USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 759 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 ASN : amide:sc= -1.57 X(o=-2.2,f=-2.6) USER MOD Set 1.2: A 71 HIS : no HD1:sc= -0.597 K(o=-2.2,f=-4.5) USER MOD Set 2.1: A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 65 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 22 SER OG : rot 153:sc= 0.806 USER MOD Set 3.2: A 40 SER OG : rot -170:sc= 0.747 USER MOD Set 4.1: A -1 HIS :FLIP no HD1:sc= -0.429 F(o=-0.54,f=0.72) USER MOD Set 4.2: A 92 LYS NZ :NH3+ -129:sc= 1.15 (180deg=-1.63) USER MOD Single : A 4 GLN : amide:sc= -0.287 K(o=-0.29,f=-1.3) USER MOD Single : A 5 HIS : no HD1:sc= -1.36 K(o=-1.4,f=-2.1) USER MOD Single : A 6 THR OG1 : rot -150:sc= -0.0243 USER MOD Single : A 8 THR OG1 : rot 170:sc= 0.00169 USER MOD Single : A -3 SER OG : rot 180:sc= 0.025 USER MOD Single : A -7 GLY N :NH3+ -101:sc= 0.0223 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.384 K(o=-0.38,f=-1.3) USER MOD Single : A 29 HIS : no HD1:sc= -0.0632 K(o=-0.063,f=-1.3) USER MOD Single : A 31 GLN : amide:sc= -0.126 K(o=-0.13,f=-2!) USER MOD Single : A 32 SER OG : rot 43:sc= 0.0324 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 130:sc= -0.585 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -1.3 K(o=-1.3,f=-4.8!) USER MOD Single : A 53 GLN : amide:sc= -0.0621 X(o=-0.062,f=0) USER MOD Single : A 55 ASN : amide:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 62 ASN :FLIP amide:sc= 0.209 F(o=-0.59,f=0.21) USER MOD Single : A 66 MET CE :methyl 136:sc= -4.63 (180deg=-8.71!) USER MOD Single : A 68 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.32) USER MOD Single : A 76 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.31) USER MOD Single : A 77 GLN : amide:sc= -1.22 X(o=-1.2,f=-1.6!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot -114:sc= 0.265 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -1.7 K(o=-1.7,f=-2.4!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot -170:sc= -0.0257 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -7 -9.919 12.138 -22.339 1.00 0.00 N ATOM 2 CA GLY A -7 -8.470 12.338 -22.061 1.00 0.00 C ATOM 3 C GLY A -7 -8.088 11.930 -20.650 1.00 0.00 C ATOM 4 O GLY A -7 -8.910 12.005 -19.737 1.00 0.00 O ATOM 0 H1 GLY A -7 -10.050 11.263 -22.885 1.00 0.00 H new ATOM 0 H2 GLY A -7 -10.438 12.067 -21.441 1.00 0.00 H new ATOM 0 H3 GLY A -7 -10.282 12.945 -22.886 1.00 0.00 H new ATOM 0 HA2 GLY A -7 -7.883 11.760 -22.775 1.00 0.00 H new ATOM 0 HA3 GLY A -7 -8.215 13.387 -22.214 1.00 0.00 H new ATOM 10 N PRO A -6 -6.835 11.489 -20.439 1.00 0.00 N ATOM 11 CA PRO A -6 -6.358 11.070 -19.118 1.00 0.00 C ATOM 12 C PRO A -6 -6.204 12.245 -18.157 1.00 0.00 C ATOM 13 O PRO A -6 -6.479 13.390 -18.514 1.00 0.00 O ATOM 14 CB PRO A -6 -4.996 10.440 -19.415 1.00 0.00 C ATOM 15 CG PRO A -6 -4.543 11.095 -20.672 1.00 0.00 C ATOM 16 CD PRO A -6 -5.788 11.367 -21.471 1.00 0.00 C ATOM 0 HA PRO A -6 -7.058 10.393 -18.629 1.00 0.00 H new ATOM 0 HB2 PRO A -6 -4.293 10.616 -18.601 1.00 0.00 H new ATOM 0 HB3 PRO A -6 -5.078 9.360 -19.538 1.00 0.00 H new ATOM 0 HG2 PRO A -6 -4.007 12.020 -20.459 1.00 0.00 H new ATOM 0 HG3 PRO A -6 -3.859 10.450 -21.223 1.00 0.00 H new ATOM 0 HD2 PRO A -6 -5.696 12.279 -22.060 1.00 0.00 H new ATOM 0 HD3 PRO A -6 -6.003 10.557 -22.168 1.00 0.00 H new ATOM 24 N LEU A -5 -5.763 11.951 -16.939 1.00 0.00 N ATOM 25 CA LEU A -5 -5.572 12.984 -15.926 1.00 0.00 C ATOM 26 C LEU A -5 -4.102 13.096 -15.536 1.00 0.00 C ATOM 27 O LEU A -5 -3.632 12.394 -14.641 1.00 0.00 O ATOM 28 CB LEU A -5 -6.418 12.678 -14.689 1.00 0.00 C ATOM 29 CG LEU A -5 -7.924 12.880 -14.868 1.00 0.00 C ATOM 30 CD1 LEU A -5 -8.231 14.333 -15.192 1.00 0.00 C ATOM 31 CD2 LEU A -5 -8.458 11.965 -15.960 1.00 0.00 C ATOM 0 H LEU A -5 -5.531 11.007 -16.629 1.00 0.00 H new ATOM 0 HA LEU A -5 -5.892 13.937 -16.349 1.00 0.00 H new ATOM 0 HB2 LEU A -5 -6.238 11.645 -14.391 1.00 0.00 H new ATOM 0 HB3 LEU A -5 -6.077 13.310 -13.869 1.00 0.00 H new ATOM 0 HG LEU A -5 -8.420 12.624 -13.932 1.00 0.00 H new ATOM 0 HD11 LEU A -5 -9.307 14.459 -15.316 1.00 0.00 H new ATOM 0 HD12 LEU A -5 -7.883 14.969 -14.378 1.00 0.00 H new ATOM 0 HD13 LEU A -5 -7.724 14.615 -16.115 1.00 0.00 H new ATOM 0 HD21 LEU A -5 -9.531 12.122 -16.074 1.00 0.00 H new ATOM 0 HD22 LEU A -5 -7.956 12.190 -16.901 1.00 0.00 H new ATOM 0 HD23 LEU A -5 -8.270 10.926 -15.688 1.00 0.00 H new ATOM 43 N GLY A -4 -3.380 13.983 -16.212 1.00 0.00 N ATOM 44 CA GLY A -4 -1.971 14.171 -15.921 1.00 0.00 C ATOM 45 C GLY A -4 -1.598 15.633 -15.773 1.00 0.00 C ATOM 46 O GLY A -4 -0.866 16.180 -16.597 1.00 0.00 O ATOM 0 H GLY A -4 -3.746 14.576 -16.957 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -1.719 13.641 -15.003 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -1.376 13.727 -16.719 1.00 0.00 H new ATOM 50 N SER A -3 -2.103 16.267 -14.720 1.00 0.00 N ATOM 51 CA SER A -3 -1.817 17.675 -14.467 1.00 0.00 C ATOM 52 C SER A -3 -0.594 17.827 -13.568 1.00 0.00 C ATOM 53 O SER A -3 0.192 18.762 -13.725 1.00 0.00 O ATOM 54 CB SER A -3 -3.027 18.354 -13.821 1.00 0.00 C ATOM 55 OG SER A -3 -3.624 17.515 -12.847 1.00 0.00 O ATOM 0 H SER A -3 -2.712 15.829 -14.029 1.00 0.00 H new ATOM 0 HA SER A -3 -1.606 18.156 -15.422 1.00 0.00 H new ATOM 0 HB2 SER A -3 -2.718 19.291 -13.358 1.00 0.00 H new ATOM 0 HB3 SER A -3 -3.760 18.604 -14.588 1.00 0.00 H new ATOM 0 HG SER A -3 -4.393 17.973 -12.448 1.00 0.00 H new ATOM 61 N ASP A -2 -0.440 16.903 -12.625 1.00 0.00 N ATOM 62 CA ASP A -2 0.687 16.932 -11.701 1.00 0.00 C ATOM 63 C ASP A -2 0.769 15.633 -10.905 1.00 0.00 C ATOM 64 O ASP A -2 -0.250 15.008 -10.614 1.00 0.00 O ATOM 65 CB ASP A -2 0.561 18.122 -10.748 1.00 0.00 C ATOM 66 CG ASP A -2 1.910 18.652 -10.304 1.00 0.00 C ATOM 67 OD1 ASP A -2 2.588 17.964 -9.511 1.00 0.00 O ATOM 68 OD2 ASP A -2 2.289 19.756 -10.750 1.00 0.00 O ATOM 0 H ASP A -2 -1.083 16.124 -12.481 1.00 0.00 H new ATOM 0 HA ASP A -2 1.602 17.039 -12.284 1.00 0.00 H new ATOM 0 HB2 ASP A -2 0.004 18.920 -11.239 1.00 0.00 H new ATOM 0 HB3 ASP A -2 -0.015 17.823 -9.872 1.00 0.00 H new ATOM 73 N HIS A -1 1.988 15.234 -10.557 1.00 0.00 N ATOM 74 CA HIS A -1 2.202 14.009 -9.795 1.00 0.00 C ATOM 75 C HIS A -1 1.674 12.797 -10.558 1.00 0.00 C ATOM 76 O HIS A -1 0.713 12.152 -10.135 1.00 0.00 O ATOM 77 CB HIS A -1 1.518 14.108 -8.430 1.00 0.00 C ATOM 78 CG HIS A -1 2.113 15.154 -7.539 1.00 0.00 C ATOM 79 ND1 HIS A -1 3.404 15.496 -7.312 1.00 0.00 N flip ATOM 80 CD2 HIS A -1 1.352 15.992 -6.750 1.00 0.00 C flip ATOM 81 CE1 HIS A -1 3.397 16.523 -6.401 1.00 0.00 C flip ATOM 82 NE2 HIS A -1 2.148 16.804 -6.078 1.00 0.00 N flip ATOM 0 H HIS A -1 2.842 15.741 -10.790 1.00 0.00 H new ATOM 0 HA HIS A -1 3.274 13.883 -9.646 1.00 0.00 H new ATOM 0 HB2 HIS A -1 0.460 14.326 -8.577 1.00 0.00 H new ATOM 0 HB3 HIS A -1 1.577 13.141 -7.931 1.00 0.00 H new ATOM 0 HD2 HIS A -1 0.274 15.985 -6.691 1.00 0.00 H new ATOM 0 HE1 HIS A -1 4.272 17.021 -6.011 1.00 0.00 H new ATOM 0 HE2 HIS A -1 1.849 17.525 -5.422 1.00 0.00 H new ATOM 91 N ILE A 1 2.309 12.493 -11.686 1.00 0.00 N ATOM 92 CA ILE A 1 1.905 11.359 -12.507 1.00 0.00 C ATOM 93 C ILE A 1 2.258 10.040 -11.830 1.00 0.00 C ATOM 94 O ILE A 1 3.417 9.790 -11.499 1.00 0.00 O ATOM 95 CB ILE A 1 2.568 11.405 -13.897 1.00 0.00 C ATOM 96 CG1 ILE A 1 2.380 12.783 -14.532 1.00 0.00 C ATOM 97 CG2 ILE A 1 1.993 10.319 -14.795 1.00 0.00 C ATOM 98 CD1 ILE A 1 3.014 12.912 -15.899 1.00 0.00 C ATOM 0 H ILE A 1 3.105 13.016 -12.051 1.00 0.00 H new ATOM 0 HA ILE A 1 0.824 11.425 -12.628 1.00 0.00 H new ATOM 0 HB ILE A 1 3.636 11.224 -13.779 1.00 0.00 H new ATOM 0 HG12 ILE A 1 1.314 12.993 -14.614 1.00 0.00 H new ATOM 0 HG13 ILE A 1 2.804 13.539 -13.871 1.00 0.00 H new ATOM 0 HG21 ILE A 1 2.472 10.365 -15.773 1.00 0.00 H new ATOM 0 HG22 ILE A 1 2.175 9.342 -14.347 1.00 0.00 H new ATOM 0 HG23 ILE A 1 0.920 10.471 -14.909 1.00 0.00 H new ATOM 0 HD11 ILE A 1 2.840 13.915 -16.287 1.00 0.00 H new ATOM 0 HD12 ILE A 1 4.086 12.734 -15.821 1.00 0.00 H new ATOM 0 HD13 ILE A 1 2.573 12.180 -16.575 1.00 0.00 H new ATOM 110 N TRP A 2 1.250 9.200 -11.624 1.00 0.00 N ATOM 111 CA TRP A 2 1.453 7.907 -10.982 1.00 0.00 C ATOM 112 C TRP A 2 1.571 6.793 -12.017 1.00 0.00 C ATOM 113 O TRP A 2 0.857 6.785 -13.019 1.00 0.00 O ATOM 114 CB TRP A 2 0.299 7.604 -10.025 1.00 0.00 C ATOM 115 CG TRP A 2 0.149 8.616 -8.931 1.00 0.00 C ATOM 116 CD1 TRP A 2 0.741 8.587 -7.702 1.00 0.00 C ATOM 117 CD2 TRP A 2 -0.648 9.805 -8.966 1.00 0.00 C ATOM 118 NE1 TRP A 2 0.363 9.687 -6.970 1.00 0.00 N ATOM 119 CE2 TRP A 2 -0.491 10.449 -7.724 1.00 0.00 C ATOM 120 CE3 TRP A 2 -1.478 10.388 -9.927 1.00 0.00 C ATOM 121 CZ2 TRP A 2 -1.133 11.647 -7.420 1.00 0.00 C ATOM 122 CZ3 TRP A 2 -2.115 11.577 -9.623 1.00 0.00 C ATOM 123 CH2 TRP A 2 -1.939 12.196 -8.379 1.00 0.00 C ATOM 0 H TRP A 2 0.285 9.391 -11.892 1.00 0.00 H new ATOM 0 HA TRP A 2 2.385 7.954 -10.419 1.00 0.00 H new ATOM 0 HB2 TRP A 2 -0.630 7.554 -10.593 1.00 0.00 H new ATOM 0 HB3 TRP A 2 0.454 6.621 -9.581 1.00 0.00 H new ATOM 0 HD1 TRP A 2 1.409 7.813 -7.355 1.00 0.00 H new ATOM 0 HE1 TRP A 2 0.668 9.901 -6.021 1.00 0.00 H new ATOM 0 HE3 TRP A 2 -1.619 9.919 -10.889 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 -0.999 12.125 -6.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 -2.760 12.036 -10.358 1.00 0.00 H new ATOM 0 HH2 TRP A 2 -2.450 13.125 -8.173 1.00 0.00 H new ATOM 134 N GLU A 3 2.471 5.849 -11.762 1.00 0.00 N ATOM 135 CA GLU A 3 2.676 4.722 -12.664 1.00 0.00 C ATOM 136 C GLU A 3 2.234 3.428 -11.991 1.00 0.00 C ATOM 137 O GLU A 3 2.571 3.179 -10.840 1.00 0.00 O ATOM 138 CB GLU A 3 4.148 4.626 -13.072 1.00 0.00 C ATOM 139 CG GLU A 3 4.579 5.709 -14.049 1.00 0.00 C ATOM 140 CD GLU A 3 5.460 5.174 -15.161 1.00 0.00 C ATOM 141 OE1 GLU A 3 6.119 4.134 -14.948 1.00 0.00 O ATOM 142 OE2 GLU A 3 5.492 5.794 -16.244 1.00 0.00 O ATOM 0 H GLU A 3 3.071 5.842 -10.937 1.00 0.00 H new ATOM 0 HA GLU A 3 2.076 4.879 -13.560 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.769 4.686 -12.178 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.329 3.650 -13.521 1.00 0.00 H new ATOM 0 HG2 GLU A 3 3.694 6.174 -14.483 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.116 6.488 -13.508 1.00 0.00 H new ATOM 149 N GLN A 4 1.467 2.617 -12.710 1.00 0.00 N ATOM 150 CA GLN A 4 0.965 1.362 -12.162 1.00 0.00 C ATOM 151 C GLN A 4 1.687 0.158 -12.756 1.00 0.00 C ATOM 152 O GLN A 4 1.803 0.022 -13.974 1.00 0.00 O ATOM 153 CB GLN A 4 -0.538 1.244 -12.421 1.00 0.00 C ATOM 154 CG GLN A 4 -1.222 0.182 -11.577 1.00 0.00 C ATOM 155 CD GLN A 4 -2.584 -0.204 -12.123 1.00 0.00 C ATOM 156 OE1 GLN A 4 -2.718 -1.188 -12.850 1.00 0.00 O ATOM 157 NE2 GLN A 4 -3.603 0.574 -11.775 1.00 0.00 N ATOM 0 H GLN A 4 1.180 2.805 -13.671 1.00 0.00 H new ATOM 0 HA GLN A 4 1.154 1.369 -11.089 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -1.008 2.208 -12.227 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -0.699 1.017 -13.475 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.589 -0.704 -11.530 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -1.334 0.549 -10.557 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -3.446 1.380 -11.170 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -4.543 0.365 -12.113 1.00 0.00 H new ATOM 166 N HIS A 5 2.166 -0.715 -11.874 1.00 0.00 N ATOM 167 CA HIS A 5 2.878 -1.920 -12.285 1.00 0.00 C ATOM 168 C HIS A 5 2.346 -3.143 -11.543 1.00 0.00 C ATOM 169 O HIS A 5 2.072 -3.083 -10.341 1.00 0.00 O ATOM 170 CB HIS A 5 4.377 -1.766 -12.027 1.00 0.00 C ATOM 171 CG HIS A 5 4.942 -0.473 -12.527 1.00 0.00 C ATOM 172 ND1 HIS A 5 5.884 0.256 -11.832 1.00 0.00 N ATOM 173 CD2 HIS A 5 4.692 0.224 -13.661 1.00 0.00 C ATOM 174 CE1 HIS A 5 6.188 1.345 -12.516 1.00 0.00 C ATOM 175 NE2 HIS A 5 5.479 1.349 -13.629 1.00 0.00 N ATOM 0 H HIS A 5 2.073 -0.609 -10.864 1.00 0.00 H new ATOM 0 HA HIS A 5 2.714 -2.063 -13.353 1.00 0.00 H new ATOM 0 HB2 HIS A 5 4.563 -1.844 -10.956 1.00 0.00 H new ATOM 0 HB3 HIS A 5 4.906 -2.592 -12.503 1.00 0.00 H new ATOM 0 HD2 HIS A 5 4.002 -0.053 -14.444 1.00 0.00 H new ATOM 0 HE1 HIS A 5 6.896 2.103 -12.215 1.00 0.00 H new ATOM 0 HE2 HIS A 5 5.510 2.071 -14.349 1.00 0.00 H new ATOM 184 N THR A 6 2.200 -4.249 -12.267 1.00 0.00 N ATOM 185 CA THR A 6 1.701 -5.490 -11.682 1.00 0.00 C ATOM 186 C THR A 6 2.835 -6.489 -11.472 1.00 0.00 C ATOM 187 O THR A 6 3.585 -6.797 -12.398 1.00 0.00 O ATOM 188 CB THR A 6 0.627 -6.107 -12.581 1.00 0.00 C ATOM 189 OG1 THR A 6 0.369 -7.448 -12.205 1.00 0.00 O ATOM 190 CG2 THR A 6 0.999 -6.105 -14.049 1.00 0.00 C ATOM 0 H THR A 6 2.420 -4.311 -13.261 1.00 0.00 H new ATOM 0 HA THR A 6 1.264 -5.253 -10.712 1.00 0.00 H new ATOM 0 HB THR A 6 -0.256 -5.482 -12.447 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.090 -7.961 -12.992 1.00 0.00 H new ATOM 0 HG21 THR A 6 0.194 -6.556 -14.629 1.00 0.00 H new ATOM 0 HG22 THR A 6 1.156 -5.079 -14.383 1.00 0.00 H new ATOM 0 HG23 THR A 6 1.915 -6.678 -14.193 1.00 0.00 H new ATOM 198 N VAL A 7 2.951 -6.994 -10.248 1.00 0.00 N ATOM 199 CA VAL A 7 3.991 -7.962 -9.915 1.00 0.00 C ATOM 200 C VAL A 7 3.388 -9.232 -9.320 1.00 0.00 C ATOM 201 O VAL A 7 2.311 -9.198 -8.727 1.00 0.00 O ATOM 202 CB VAL A 7 5.009 -7.374 -8.921 1.00 0.00 C ATOM 203 CG1 VAL A 7 6.187 -8.318 -8.739 1.00 0.00 C ATOM 204 CG2 VAL A 7 5.480 -6.006 -9.388 1.00 0.00 C ATOM 0 H VAL A 7 2.338 -6.749 -9.470 1.00 0.00 H new ATOM 0 HA VAL A 7 4.505 -8.208 -10.844 1.00 0.00 H new ATOM 0 HB VAL A 7 4.518 -7.255 -7.955 1.00 0.00 H new ATOM 0 HG11 VAL A 7 6.895 -7.884 -8.033 1.00 0.00 H new ATOM 0 HG12 VAL A 7 5.831 -9.274 -8.355 1.00 0.00 H new ATOM 0 HG13 VAL A 7 6.680 -8.473 -9.698 1.00 0.00 H new ATOM 0 HG21 VAL A 7 6.199 -5.605 -8.673 1.00 0.00 H new ATOM 0 HG22 VAL A 7 5.953 -6.098 -10.366 1.00 0.00 H new ATOM 0 HG23 VAL A 7 4.626 -5.332 -9.460 1.00 0.00 H new ATOM 214 N THR A 8 4.089 -10.350 -9.483 1.00 0.00 N ATOM 215 CA THR A 8 3.619 -11.631 -8.964 1.00 0.00 C ATOM 216 C THR A 8 4.463 -12.087 -7.777 1.00 0.00 C ATOM 217 O THR A 8 5.651 -12.372 -7.922 1.00 0.00 O ATOM 218 CB THR A 8 3.652 -12.693 -10.064 1.00 0.00 C ATOM 219 OG1 THR A 8 3.373 -13.976 -9.532 1.00 0.00 O ATOM 220 CG2 THR A 8 4.983 -12.772 -10.780 1.00 0.00 C ATOM 0 H THR A 8 4.984 -10.395 -9.970 1.00 0.00 H new ATOM 0 HA THR A 8 2.592 -11.498 -8.624 1.00 0.00 H new ATOM 0 HB THR A 8 2.890 -12.389 -10.781 1.00 0.00 H new ATOM 0 HG1 THR A 8 3.240 -14.612 -10.265 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.938 -13.545 -11.547 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.204 -11.811 -11.245 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.767 -13.017 -10.064 1.00 0.00 H new ATOM 228 N LEU A 9 3.841 -12.153 -6.602 1.00 0.00 N ATOM 229 CA LEU A 9 4.537 -12.579 -5.393 1.00 0.00 C ATOM 230 C LEU A 9 4.118 -13.988 -4.989 1.00 0.00 C ATOM 231 O LEU A 9 2.979 -14.213 -4.577 1.00 0.00 O ATOM 232 CB LEU A 9 4.260 -11.603 -4.246 1.00 0.00 C ATOM 233 CG LEU A 9 4.359 -10.123 -4.618 1.00 0.00 C ATOM 234 CD1 LEU A 9 3.371 -9.302 -3.803 1.00 0.00 C ATOM 235 CD2 LEU A 9 5.777 -9.615 -4.407 1.00 0.00 C ATOM 0 H LEU A 9 2.858 -11.917 -6.463 1.00 0.00 H new ATOM 0 HA LEU A 9 5.606 -12.585 -5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.261 -11.798 -3.856 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.963 -11.807 -3.438 1.00 0.00 H new ATOM 0 HG LEU A 9 4.108 -10.015 -5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.455 -8.251 -4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.357 -9.650 -4.002 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.592 -9.416 -2.742 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.829 -8.560 -4.677 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.055 -9.736 -3.360 1.00 0.00 H new ATOM 0 HD23 LEU A 9 6.464 -10.184 -5.033 1.00 0.00 H new ATOM 247 N HIS A 10 5.044 -14.933 -5.106 1.00 0.00 N ATOM 248 CA HIS A 10 4.767 -16.320 -4.750 1.00 0.00 C ATOM 249 C HIS A 10 4.794 -16.505 -3.236 1.00 0.00 C ATOM 250 O HIS A 10 5.818 -16.278 -2.591 1.00 0.00 O ATOM 251 CB HIS A 10 5.785 -17.253 -5.411 1.00 0.00 C ATOM 252 CG HIS A 10 7.183 -17.075 -4.902 1.00 0.00 C ATOM 253 ND1 HIS A 10 7.999 -16.034 -5.293 1.00 0.00 N ATOM 254 CD2 HIS A 10 7.909 -17.812 -4.029 1.00 0.00 C ATOM 255 CE1 HIS A 10 9.165 -16.140 -4.683 1.00 0.00 C ATOM 256 NE2 HIS A 10 9.137 -17.209 -3.910 1.00 0.00 N ATOM 0 H HIS A 10 5.992 -14.765 -5.444 1.00 0.00 H new ATOM 0 HA HIS A 10 3.770 -16.572 -5.112 1.00 0.00 H new ATOM 0 HB2 HIS A 10 5.477 -18.286 -5.249 1.00 0.00 H new ATOM 0 HB3 HIS A 10 5.775 -17.083 -6.488 1.00 0.00 H new ATOM 0 HD2 HIS A 10 7.583 -18.707 -3.521 1.00 0.00 H new ATOM 0 HE1 HIS A 10 10.001 -15.466 -4.797 1.00 0.00 H new ATOM 0 HE2 HIS A 10 9.903 -17.534 -3.320 1.00 0.00 H new ATOM 265 N ARG A 11 3.661 -16.915 -2.673 1.00 0.00 N ATOM 266 CA ARG A 11 3.556 -17.126 -1.234 1.00 0.00 C ATOM 267 C ARG A 11 4.577 -18.154 -0.755 1.00 0.00 C ATOM 268 O ARG A 11 4.927 -19.081 -1.485 1.00 0.00 O ATOM 269 CB ARG A 11 2.143 -17.583 -0.866 1.00 0.00 C ATOM 270 CG ARG A 11 1.057 -16.620 -1.319 1.00 0.00 C ATOM 271 CD ARG A 11 -0.011 -16.440 -0.251 1.00 0.00 C ATOM 272 NE ARG A 11 -0.524 -17.720 0.231 1.00 0.00 N ATOM 273 CZ ARG A 11 -1.600 -17.842 1.005 1.00 0.00 C ATOM 274 NH1 ARG A 11 -2.276 -16.765 1.386 1.00 0.00 N ATOM 275 NH2 ARG A 11 -2.001 -19.043 1.399 1.00 0.00 N ATOM 0 H ARG A 11 2.804 -17.107 -3.191 1.00 0.00 H new ATOM 0 HA ARG A 11 3.765 -16.178 -0.739 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.959 -18.561 -1.310 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.080 -17.707 0.215 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.502 -15.654 -1.556 1.00 0.00 H new ATOM 0 HG3 ARG A 11 0.598 -16.993 -2.235 1.00 0.00 H new ATOM 0 HD2 ARG A 11 0.404 -15.878 0.585 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.833 -15.849 -0.656 1.00 0.00 H new ATOM 0 HE ARG A 11 -0.029 -18.569 -0.041 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.971 -15.839 1.086 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -3.100 -16.863 1.979 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -1.485 -19.874 1.109 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -2.826 -19.136 1.992 1.00 0.00 H new ATOM 289 N ALA A 12 5.050 -17.981 0.474 1.00 0.00 N ATOM 290 CA ALA A 12 6.031 -18.890 1.051 1.00 0.00 C ATOM 291 C ALA A 12 5.571 -19.404 2.414 1.00 0.00 C ATOM 292 O ALA A 12 4.723 -18.792 3.063 1.00 0.00 O ATOM 293 CB ALA A 12 7.381 -18.201 1.175 1.00 0.00 C ATOM 0 H ALA A 12 4.769 -17.218 1.090 1.00 0.00 H new ATOM 0 HA ALA A 12 6.131 -19.746 0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.104 -18.892 1.608 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.723 -17.890 0.188 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.285 -17.326 1.818 1.00 0.00 H new ATOM 299 N PRO A 13 6.127 -20.542 2.866 1.00 0.00 N ATOM 300 CA PRO A 13 5.770 -21.135 4.160 1.00 0.00 C ATOM 301 C PRO A 13 6.158 -20.241 5.333 1.00 0.00 C ATOM 302 O PRO A 13 7.162 -19.530 5.279 1.00 0.00 O ATOM 303 CB PRO A 13 6.572 -22.441 4.194 1.00 0.00 C ATOM 304 CG PRO A 13 7.692 -22.229 3.234 1.00 0.00 C ATOM 305 CD PRO A 13 7.148 -21.334 2.158 1.00 0.00 C ATOM 0 HA PRO A 13 4.694 -21.281 4.255 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.945 -22.649 5.197 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.956 -23.291 3.900 1.00 0.00 H new ATOM 0 HG2 PRO A 13 8.548 -21.770 3.728 1.00 0.00 H new ATOM 0 HG3 PRO A 13 8.034 -23.176 2.818 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.925 -20.700 1.730 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.716 -21.907 1.337 1.00 0.00 H new ATOM 313 N GLY A 14 5.356 -20.282 6.391 1.00 0.00 N ATOM 314 CA GLY A 14 5.632 -19.469 7.562 1.00 0.00 C ATOM 315 C GLY A 14 4.868 -18.159 7.552 1.00 0.00 C ATOM 316 O GLY A 14 4.256 -17.782 8.551 1.00 0.00 O ATOM 0 H GLY A 14 4.520 -20.863 6.459 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.373 -20.030 8.460 1.00 0.00 H new ATOM 0 HA3 GLY A 14 6.701 -19.262 7.613 1.00 0.00 H new ATOM 320 N PHE A 15 4.905 -17.465 6.419 1.00 0.00 N ATOM 321 CA PHE A 15 4.209 -16.189 6.281 1.00 0.00 C ATOM 322 C PHE A 15 3.167 -16.261 5.169 1.00 0.00 C ATOM 323 O PHE A 15 1.965 -16.280 5.431 1.00 0.00 O ATOM 324 CB PHE A 15 5.202 -15.051 5.995 1.00 0.00 C ATOM 325 CG PHE A 15 6.621 -15.509 5.798 1.00 0.00 C ATOM 326 CD1 PHE A 15 7.436 -15.771 6.888 1.00 0.00 C ATOM 327 CD2 PHE A 15 7.138 -15.678 4.524 1.00 0.00 C ATOM 328 CE1 PHE A 15 8.740 -16.193 6.709 1.00 0.00 C ATOM 329 CE2 PHE A 15 8.441 -16.099 4.339 1.00 0.00 C ATOM 330 CZ PHE A 15 9.243 -16.357 5.433 1.00 0.00 C ATOM 0 H PHE A 15 5.409 -17.764 5.584 1.00 0.00 H new ATOM 0 HA PHE A 15 3.704 -15.981 7.224 1.00 0.00 H new ATOM 0 HB2 PHE A 15 4.877 -14.516 5.103 1.00 0.00 H new ATOM 0 HB3 PHE A 15 5.172 -14.341 6.821 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.048 -15.644 7.888 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.515 -15.478 3.665 1.00 0.00 H new ATOM 0 HE1 PHE A 15 9.365 -16.394 7.566 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.832 -16.226 3.340 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.262 -16.686 5.291 1.00 0.00 H new ATOM 340 N GLY A 16 3.638 -16.305 3.926 1.00 0.00 N ATOM 341 CA GLY A 16 2.733 -16.379 2.794 1.00 0.00 C ATOM 342 C GLY A 16 2.709 -15.099 1.982 1.00 0.00 C ATOM 343 O GLY A 16 3.535 -14.908 1.089 1.00 0.00 O ATOM 0 H GLY A 16 4.629 -16.291 3.683 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.029 -17.208 2.151 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.727 -16.597 3.152 1.00 0.00 H new ATOM 347 N PHE A 17 1.757 -14.223 2.287 1.00 0.00 N ATOM 348 CA PHE A 17 1.627 -12.956 1.571 1.00 0.00 C ATOM 349 C PHE A 17 2.897 -12.119 1.701 1.00 0.00 C ATOM 350 O PHE A 17 3.306 -11.446 0.756 1.00 0.00 O ATOM 351 CB PHE A 17 0.419 -12.155 2.078 1.00 0.00 C ATOM 352 CG PHE A 17 0.082 -12.387 3.526 1.00 0.00 C ATOM 353 CD1 PHE A 17 0.922 -11.937 4.532 1.00 0.00 C ATOM 354 CD2 PHE A 17 -1.080 -13.057 3.880 1.00 0.00 C ATOM 355 CE1 PHE A 17 0.613 -12.151 5.862 1.00 0.00 C ATOM 356 CE2 PHE A 17 -1.394 -13.272 5.208 1.00 0.00 C ATOM 357 CZ PHE A 17 -0.548 -12.819 6.200 1.00 0.00 C ATOM 0 H PHE A 17 1.065 -14.365 3.023 1.00 0.00 H new ATOM 0 HA PHE A 17 1.471 -13.192 0.518 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.614 -11.093 1.929 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.450 -12.408 1.470 1.00 0.00 H new ATOM 0 HD1 PHE A 17 1.830 -11.412 4.273 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -1.746 -13.414 3.109 1.00 0.00 H new ATOM 0 HE1 PHE A 17 1.278 -11.797 6.636 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -2.302 -13.795 5.470 1.00 0.00 H new ATOM 0 HZ PHE A 17 -0.793 -12.986 7.238 1.00 0.00 H new ATOM 367 N GLY A 18 3.518 -12.168 2.876 1.00 0.00 N ATOM 368 CA GLY A 18 4.737 -11.411 3.103 1.00 0.00 C ATOM 369 C GLY A 18 4.484 -9.946 3.422 1.00 0.00 C ATOM 370 O GLY A 18 5.409 -9.221 3.788 1.00 0.00 O ATOM 0 H GLY A 18 3.200 -12.718 3.674 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.290 -11.865 3.925 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.369 -11.479 2.218 1.00 0.00 H new ATOM 374 N ILE A 19 3.236 -9.505 3.286 1.00 0.00 N ATOM 375 CA ILE A 19 2.884 -8.119 3.565 1.00 0.00 C ATOM 376 C ILE A 19 1.536 -8.024 4.273 1.00 0.00 C ATOM 377 O ILE A 19 0.778 -8.993 4.321 1.00 0.00 O ATOM 378 CB ILE A 19 2.835 -7.275 2.275 1.00 0.00 C ATOM 379 CG1 ILE A 19 2.157 -8.056 1.147 1.00 0.00 C ATOM 380 CG2 ILE A 19 4.239 -6.855 1.863 1.00 0.00 C ATOM 381 CD1 ILE A 19 1.245 -7.207 0.287 1.00 0.00 C ATOM 0 H ILE A 19 2.454 -10.087 2.985 1.00 0.00 H new ATOM 0 HA ILE A 19 3.663 -7.724 4.217 1.00 0.00 H new ATOM 0 HB ILE A 19 2.248 -6.378 2.472 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.923 -8.506 0.516 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.579 -8.873 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.188 -6.260 0.951 1.00 0.00 H new ATOM 0 HG22 ILE A 19 4.689 -6.262 2.659 1.00 0.00 H new ATOM 0 HG23 ILE A 19 4.846 -7.742 1.684 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.799 -7.826 -0.492 1.00 0.00 H new ATOM 0 HD12 ILE A 19 0.457 -6.778 0.906 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.822 -6.405 -0.173 1.00 0.00 H new ATOM 393 N ALA A 20 1.243 -6.849 4.825 1.00 0.00 N ATOM 394 CA ALA A 20 -0.013 -6.629 5.532 1.00 0.00 C ATOM 395 C ALA A 20 -0.891 -5.627 4.790 1.00 0.00 C ATOM 396 O ALA A 20 -0.513 -4.469 4.608 1.00 0.00 O ATOM 397 CB ALA A 20 0.258 -6.148 6.950 1.00 0.00 C ATOM 0 H ALA A 20 1.859 -6.036 4.796 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.548 -7.578 5.578 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.688 -5.988 7.467 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.840 -6.899 7.484 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.816 -5.212 6.916 1.00 0.00 H new ATOM 403 N ILE A 21 -2.066 -6.079 4.365 1.00 0.00 N ATOM 404 CA ILE A 21 -2.999 -5.224 3.643 1.00 0.00 C ATOM 405 C ILE A 21 -3.802 -4.353 4.601 1.00 0.00 C ATOM 406 O ILE A 21 -4.288 -4.826 5.628 1.00 0.00 O ATOM 407 CB ILE A 21 -3.972 -6.054 2.784 1.00 0.00 C ATOM 408 CG1 ILE A 21 -3.206 -7.084 1.953 1.00 0.00 C ATOM 409 CG2 ILE A 21 -4.792 -5.143 1.883 1.00 0.00 C ATOM 410 CD1 ILE A 21 -3.064 -8.427 2.633 1.00 0.00 C ATOM 0 H ILE A 21 -2.394 -7.034 4.509 1.00 0.00 H new ATOM 0 HA ILE A 21 -2.402 -4.586 2.991 1.00 0.00 H new ATOM 0 HB ILE A 21 -4.653 -6.587 3.448 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -3.716 -7.221 1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -2.213 -6.693 1.730 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.475 -5.744 1.282 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.365 -4.446 2.495 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.125 -4.585 1.225 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.510 -9.106 1.985 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -2.527 -8.304 3.573 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -4.053 -8.841 2.832 1.00 0.00 H new ATOM 422 N SER A 22 -3.940 -3.076 4.257 1.00 0.00 N ATOM 423 CA SER A 22 -4.685 -2.137 5.086 1.00 0.00 C ATOM 424 C SER A 22 -5.644 -1.306 4.239 1.00 0.00 C ATOM 425 O SER A 22 -5.349 -0.980 3.090 1.00 0.00 O ATOM 426 CB SER A 22 -3.723 -1.218 5.843 1.00 0.00 C ATOM 427 OG SER A 22 -4.075 -1.129 7.213 1.00 0.00 O ATOM 0 H SER A 22 -3.545 -2.669 3.409 1.00 0.00 H new ATOM 0 HA SER A 22 -5.270 -2.710 5.806 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.705 -1.596 5.750 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.736 -0.224 5.395 1.00 0.00 H new ATOM 0 HG SER A 22 -3.277 -0.925 7.743 1.00 0.00 H new ATOM 433 N GLY A 23 -6.794 -0.967 4.815 1.00 0.00 N ATOM 434 CA GLY A 23 -7.778 -0.178 4.098 1.00 0.00 C ATOM 435 C GLY A 23 -9.171 -0.768 4.185 1.00 0.00 C ATOM 436 O GLY A 23 -9.539 -1.362 5.199 1.00 0.00 O ATOM 0 H GLY A 23 -7.061 -1.225 5.765 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.790 0.835 4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.484 -0.101 3.051 1.00 0.00 H new ATOM 440 N GLY A 24 -9.949 -0.605 3.119 1.00 0.00 N ATOM 441 CA GLY A 24 -11.301 -1.132 3.097 1.00 0.00 C ATOM 442 C GLY A 24 -12.332 -0.067 2.782 1.00 0.00 C ATOM 443 O GLY A 24 -12.499 0.889 3.540 1.00 0.00 O ATOM 0 H GLY A 24 -9.666 -0.117 2.269 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.366 -1.927 2.354 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.529 -1.580 4.064 1.00 0.00 H new ATOM 447 N ARG A 25 -13.026 -0.231 1.660 1.00 0.00 N ATOM 448 CA ARG A 25 -14.046 0.724 1.244 1.00 0.00 C ATOM 449 C ARG A 25 -15.281 0.631 2.134 1.00 0.00 C ATOM 450 O ARG A 25 -15.995 1.616 2.329 1.00 0.00 O ATOM 451 CB ARG A 25 -14.436 0.482 -0.216 1.00 0.00 C ATOM 452 CG ARG A 25 -15.161 -0.835 -0.444 1.00 0.00 C ATOM 453 CD ARG A 25 -16.666 -0.637 -0.512 1.00 0.00 C ATOM 454 NE ARG A 25 -17.119 -0.350 -1.871 1.00 0.00 N ATOM 455 CZ ARG A 25 -18.381 -0.479 -2.274 1.00 0.00 C ATOM 456 NH1 ARG A 25 -19.317 -0.888 -1.428 1.00 0.00 N ATOM 457 NH2 ARG A 25 -18.707 -0.196 -3.528 1.00 0.00 N ATOM 0 H ARG A 25 -12.900 -1.017 1.022 1.00 0.00 H new ATOM 0 HA ARG A 25 -13.628 1.726 1.341 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -15.072 1.300 -0.553 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -13.537 0.503 -0.831 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -14.810 -1.289 -1.371 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -14.920 -1.529 0.362 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -17.167 -1.533 -0.145 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -16.954 0.182 0.147 1.00 0.00 H new ATOM 0 HE ARG A 25 -16.428 -0.032 -2.551 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -19.072 -1.106 -0.462 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -20.282 -0.985 -1.743 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -17.991 0.120 -4.182 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -19.674 -0.294 -3.838 1.00 0.00 H new ATOM 471 N ASP A 26 -15.531 -0.559 2.671 1.00 0.00 N ATOM 472 CA ASP A 26 -16.683 -0.781 3.537 1.00 0.00 C ATOM 473 C ASP A 26 -16.294 -0.670 5.009 1.00 0.00 C ATOM 474 O ASP A 26 -16.844 -1.368 5.860 1.00 0.00 O ATOM 475 CB ASP A 26 -17.300 -2.154 3.261 1.00 0.00 C ATOM 476 CG ASP A 26 -18.802 -2.085 3.068 1.00 0.00 C ATOM 477 OD1 ASP A 26 -19.249 -1.393 2.131 1.00 0.00 O ATOM 478 OD2 ASP A 26 -19.531 -2.723 3.858 1.00 0.00 O ATOM 0 H ASP A 26 -14.951 -1.385 2.521 1.00 0.00 H new ATOM 0 HA ASP A 26 -17.420 -0.009 3.319 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -16.841 -2.583 2.370 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -17.073 -2.824 4.090 1.00 0.00 H new ATOM 483 N ASN A 27 -15.346 0.214 5.302 1.00 0.00 N ATOM 484 CA ASN A 27 -14.888 0.416 6.670 1.00 0.00 C ATOM 485 C ASN A 27 -15.888 1.262 7.457 1.00 0.00 C ATOM 486 O ASN A 27 -16.744 1.926 6.873 1.00 0.00 O ATOM 487 CB ASN A 27 -13.513 1.089 6.675 1.00 0.00 C ATOM 488 CG ASN A 27 -12.414 0.159 7.153 1.00 0.00 C ATOM 489 OD1 ASN A 27 -11.713 0.453 8.121 1.00 0.00 O ATOM 490 ND2 ASN A 27 -12.258 -0.971 6.472 1.00 0.00 N ATOM 0 H ASN A 27 -14.881 0.801 4.610 1.00 0.00 H new ATOM 0 HA ASN A 27 -14.807 -0.559 7.150 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -13.278 1.437 5.669 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -13.545 1.969 7.317 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -11.534 -1.636 6.746 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -12.862 -1.174 5.676 1.00 0.00 H new ATOM 497 N PRO A 28 -15.791 1.250 8.797 1.00 0.00 N ATOM 498 CA PRO A 28 -16.692 2.021 9.660 1.00 0.00 C ATOM 499 C PRO A 28 -16.513 3.526 9.486 1.00 0.00 C ATOM 500 O PRO A 28 -17.442 4.302 9.712 1.00 0.00 O ATOM 501 CB PRO A 28 -16.292 1.595 11.076 1.00 0.00 C ATOM 502 CG PRO A 28 -14.892 1.100 10.945 1.00 0.00 C ATOM 503 CD PRO A 28 -14.798 0.488 9.576 1.00 0.00 C ATOM 0 HA PRO A 28 -17.739 1.828 9.426 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -16.352 2.431 11.772 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -16.953 0.816 11.456 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.177 1.915 11.058 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.663 0.366 11.718 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -13.796 0.588 9.158 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -15.031 -0.577 9.594 1.00 0.00 H new ATOM 511 N HIS A 29 -15.314 3.931 9.080 1.00 0.00 N ATOM 512 CA HIS A 29 -15.013 5.343 8.873 1.00 0.00 C ATOM 513 C HIS A 29 -14.889 5.660 7.386 1.00 0.00 C ATOM 514 O HIS A 29 -14.623 4.775 6.573 1.00 0.00 O ATOM 515 CB HIS A 29 -13.720 5.723 9.597 1.00 0.00 C ATOM 516 CG HIS A 29 -13.533 7.200 9.754 1.00 0.00 C ATOM 517 ND1 HIS A 29 -14.584 8.078 9.916 1.00 0.00 N ATOM 518 CD2 HIS A 29 -12.409 7.954 9.774 1.00 0.00 C ATOM 519 CE1 HIS A 29 -14.114 9.308 10.028 1.00 0.00 C ATOM 520 NE2 HIS A 29 -12.797 9.259 9.946 1.00 0.00 N ATOM 0 H HIS A 29 -14.535 3.301 8.888 1.00 0.00 H new ATOM 0 HA HIS A 29 -15.836 5.928 9.284 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -13.715 5.258 10.583 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -12.872 5.314 9.047 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -11.395 7.595 9.673 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -14.706 10.201 10.163 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -12.170 10.061 10.002 1.00 0.00 H new ATOM 529 N PHE A 30 -15.084 6.928 7.038 1.00 0.00 N ATOM 530 CA PHE A 30 -14.993 7.361 5.648 1.00 0.00 C ATOM 531 C PHE A 30 -14.020 8.527 5.504 1.00 0.00 C ATOM 532 O PHE A 30 -14.028 9.458 6.309 1.00 0.00 O ATOM 533 CB PHE A 30 -16.375 7.762 5.127 1.00 0.00 C ATOM 534 CG PHE A 30 -16.763 7.061 3.857 1.00 0.00 C ATOM 535 CD1 PHE A 30 -17.037 5.702 3.856 1.00 0.00 C ATOM 536 CD2 PHE A 30 -16.856 7.760 2.664 1.00 0.00 C ATOM 537 CE1 PHE A 30 -17.395 5.055 2.689 1.00 0.00 C ATOM 538 CE2 PHE A 30 -17.213 7.117 1.494 1.00 0.00 C ATOM 539 CZ PHE A 30 -17.483 5.763 1.506 1.00 0.00 C ATOM 0 H PHE A 30 -15.306 7.673 7.699 1.00 0.00 H new ATOM 0 HA PHE A 30 -14.618 6.526 5.055 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -17.120 7.547 5.893 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -16.393 8.839 4.958 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -16.970 5.143 4.778 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -16.647 8.819 2.648 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -17.606 3.996 2.702 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -17.281 7.673 0.571 1.00 0.00 H new ATOM 0 HZ PHE A 30 -17.762 5.259 0.593 1.00 0.00 H new ATOM 549 N GLN A 31 -13.184 8.470 4.473 1.00 0.00 N ATOM 550 CA GLN A 31 -12.206 9.522 4.223 1.00 0.00 C ATOM 551 C GLN A 31 -12.030 9.759 2.726 1.00 0.00 C ATOM 552 O GLN A 31 -12.122 8.829 1.925 1.00 0.00 O ATOM 553 CB GLN A 31 -10.861 9.156 4.854 1.00 0.00 C ATOM 554 CG GLN A 31 -10.737 9.577 6.309 1.00 0.00 C ATOM 555 CD GLN A 31 -10.208 10.990 6.464 1.00 0.00 C ATOM 556 OE1 GLN A 31 -9.851 11.642 5.483 1.00 0.00 O ATOM 557 NE2 GLN A 31 -10.155 11.470 7.701 1.00 0.00 N ATOM 0 H GLN A 31 -13.164 7.706 3.797 1.00 0.00 H new ATOM 0 HA GLN A 31 -12.575 10.442 4.677 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.717 8.078 4.783 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -10.061 9.623 4.280 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.713 9.504 6.789 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.073 8.886 6.828 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.462 10.894 8.485 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.808 12.415 7.867 1.00 0.00 H new ATOM 566 N SER A 32 -11.781 11.011 2.356 1.00 0.00 N ATOM 567 CA SER A 32 -11.595 11.372 0.955 1.00 0.00 C ATOM 568 C SER A 32 -10.113 11.517 0.623 1.00 0.00 C ATOM 569 O SER A 32 -9.406 12.319 1.233 1.00 0.00 O ATOM 570 CB SER A 32 -12.330 12.676 0.641 1.00 0.00 C ATOM 571 OG SER A 32 -12.123 13.637 1.662 1.00 0.00 O ATOM 0 H SER A 32 -11.703 11.793 3.007 1.00 0.00 H new ATOM 0 HA SER A 32 -12.010 10.573 0.341 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.981 13.073 -0.312 1.00 0.00 H new ATOM 0 HB3 SER A 32 -13.397 12.479 0.533 1.00 0.00 H new ATOM 0 HG SER A 32 -11.182 13.626 1.935 1.00 0.00 H new ATOM 577 N GLY A 33 -9.650 10.736 -0.347 1.00 0.00 N ATOM 578 CA GLY A 33 -8.256 10.794 -0.744 1.00 0.00 C ATOM 579 C GLY A 33 -7.451 9.613 -0.233 1.00 0.00 C ATOM 580 O GLY A 33 -6.221 9.630 -0.277 1.00 0.00 O ATOM 0 H GLY A 33 -10.216 10.064 -0.865 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.193 10.827 -1.832 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -7.814 11.718 -0.371 1.00 0.00 H new ATOM 584 N GLU A 34 -8.142 8.584 0.250 1.00 0.00 N ATOM 585 CA GLU A 34 -7.478 7.394 0.769 1.00 0.00 C ATOM 586 C GLU A 34 -8.407 6.185 0.718 1.00 0.00 C ATOM 587 O GLU A 34 -8.301 5.275 1.540 1.00 0.00 O ATOM 588 CB GLU A 34 -7.010 7.630 2.205 1.00 0.00 C ATOM 589 CG GLU A 34 -8.103 8.156 3.122 1.00 0.00 C ATOM 590 CD GLU A 34 -7.552 8.779 4.389 1.00 0.00 C ATOM 591 OE1 GLU A 34 -7.065 8.025 5.258 1.00 0.00 O ATOM 592 OE2 GLU A 34 -7.607 10.020 4.512 1.00 0.00 O ATOM 0 H GLU A 34 -9.161 8.551 0.292 1.00 0.00 H new ATOM 0 HA GLU A 34 -6.611 7.191 0.140 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.625 6.695 2.611 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.182 8.339 2.197 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.696 8.897 2.586 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -8.775 7.339 3.386 1.00 0.00 H new ATOM 599 N THR A 35 -9.316 6.182 -0.250 1.00 0.00 N ATOM 600 CA THR A 35 -10.262 5.084 -0.407 1.00 0.00 C ATOM 601 C THR A 35 -9.565 3.826 -0.922 1.00 0.00 C ATOM 602 O THR A 35 -10.091 2.720 -0.794 1.00 0.00 O ATOM 603 CB THR A 35 -11.385 5.486 -1.365 1.00 0.00 C ATOM 604 OG1 THR A 35 -10.890 5.630 -2.685 1.00 0.00 O ATOM 605 CG2 THR A 35 -12.061 6.786 -0.984 1.00 0.00 C ATOM 0 H THR A 35 -9.418 6.928 -0.938 1.00 0.00 H new ATOM 0 HA THR A 35 -10.687 4.864 0.572 1.00 0.00 H new ATOM 0 HB THR A 35 -12.119 4.682 -1.303 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.623 5.886 -3.283 1.00 0.00 H new ATOM 0 HG21 THR A 35 -12.847 7.012 -1.705 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.497 6.692 0.011 1.00 0.00 H new ATOM 0 HG23 THR A 35 -11.327 7.591 -0.983 1.00 0.00 H new ATOM 613 N SER A 36 -8.382 4.000 -1.505 1.00 0.00 N ATOM 614 CA SER A 36 -7.621 2.876 -2.038 1.00 0.00 C ATOM 615 C SER A 36 -6.950 2.091 -0.916 1.00 0.00 C ATOM 616 O SER A 36 -6.798 2.589 0.200 1.00 0.00 O ATOM 617 CB SER A 36 -6.566 3.371 -3.030 1.00 0.00 C ATOM 618 OG SER A 36 -5.411 3.838 -2.355 1.00 0.00 O ATOM 0 H SER A 36 -7.931 4.908 -1.620 1.00 0.00 H new ATOM 0 HA SER A 36 -8.315 2.214 -2.556 1.00 0.00 H new ATOM 0 HB2 SER A 36 -6.293 2.563 -3.709 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.983 4.172 -3.640 1.00 0.00 H new ATOM 0 HG SER A 36 -4.613 3.425 -2.747 1.00 0.00 H new ATOM 624 N ILE A 37 -6.551 0.860 -1.219 1.00 0.00 N ATOM 625 CA ILE A 37 -5.895 0.006 -0.237 1.00 0.00 C ATOM 626 C ILE A 37 -4.383 0.205 -0.258 1.00 0.00 C ATOM 627 O ILE A 37 -3.790 0.419 -1.316 1.00 0.00 O ATOM 628 CB ILE A 37 -6.208 -1.482 -0.487 1.00 0.00 C ATOM 629 CG1 ILE A 37 -7.712 -1.682 -0.685 1.00 0.00 C ATOM 630 CG2 ILE A 37 -5.702 -2.332 0.667 1.00 0.00 C ATOM 631 CD1 ILE A 37 -8.071 -3.038 -1.253 1.00 0.00 C ATOM 0 H ILE A 37 -6.671 0.432 -2.137 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.284 0.293 0.740 1.00 0.00 H new ATOM 0 HB ILE A 37 -5.695 -1.798 -1.395 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -8.217 -1.553 0.272 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.089 -0.906 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.931 -3.380 0.475 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.623 -2.208 0.764 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.188 -2.018 1.591 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.153 -3.110 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -7.595 -3.163 -2.225 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -7.725 -3.819 -0.576 1.00 0.00 H new ATOM 643 N VAL A 38 -3.764 0.136 0.916 1.00 0.00 N ATOM 644 CA VAL A 38 -2.322 0.310 1.030 1.00 0.00 C ATOM 645 C VAL A 38 -1.731 -0.658 2.051 1.00 0.00 C ATOM 646 O VAL A 38 -2.437 -1.163 2.924 1.00 0.00 O ATOM 647 CB VAL A 38 -1.960 1.755 1.433 1.00 0.00 C ATOM 648 CG1 VAL A 38 -2.563 2.104 2.785 1.00 0.00 C ATOM 649 CG2 VAL A 38 -0.451 1.946 1.447 1.00 0.00 C ATOM 0 H VAL A 38 -4.239 -0.039 1.801 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.898 0.100 0.048 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.381 2.433 0.690 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.295 3.127 3.050 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.648 2.015 2.733 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.178 1.421 3.542 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -0.217 2.971 1.734 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.004 1.258 2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.050 1.746 0.453 1.00 0.00 H new ATOM 659 N ILE A 39 -0.432 -0.913 1.933 1.00 0.00 N ATOM 660 CA ILE A 39 0.254 -1.822 2.844 1.00 0.00 C ATOM 661 C ILE A 39 0.556 -1.142 4.175 1.00 0.00 C ATOM 662 O ILE A 39 1.232 -0.115 4.220 1.00 0.00 O ATOM 663 CB ILE A 39 1.571 -2.339 2.237 1.00 0.00 C ATOM 664 CG1 ILE A 39 1.344 -2.821 0.804 1.00 0.00 C ATOM 665 CG2 ILE A 39 2.144 -3.458 3.094 1.00 0.00 C ATOM 666 CD1 ILE A 39 0.318 -3.928 0.693 1.00 0.00 C ATOM 0 H ILE A 39 0.166 -0.503 1.216 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.416 -2.665 3.012 1.00 0.00 H new ATOM 0 HB ILE A 39 2.290 -1.520 2.214 1.00 0.00 H new ATOM 0 HG12 ILE A 39 1.024 -1.978 0.192 1.00 0.00 H new ATOM 0 HG13 ILE A 39 2.291 -3.172 0.393 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.075 -3.814 2.653 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.339 -3.083 4.099 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.429 -4.280 3.145 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.209 -4.220 -0.352 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.646 -4.788 1.277 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.641 -3.575 1.073 1.00 0.00 H new ATOM 678 N SER A 40 0.051 -1.724 5.259 1.00 0.00 N ATOM 679 CA SER A 40 0.268 -1.174 6.592 1.00 0.00 C ATOM 680 C SER A 40 1.691 -1.452 7.069 1.00 0.00 C ATOM 681 O SER A 40 2.467 -0.530 7.313 1.00 0.00 O ATOM 682 CB SER A 40 -0.742 -1.763 7.581 1.00 0.00 C ATOM 683 OG SER A 40 -1.499 -0.742 8.207 1.00 0.00 O ATOM 0 H SER A 40 -0.511 -2.575 5.240 1.00 0.00 H new ATOM 0 HA SER A 40 0.126 -0.094 6.541 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.411 -2.447 7.058 1.00 0.00 H new ATOM 0 HB3 SER A 40 -0.217 -2.346 8.337 1.00 0.00 H new ATOM 0 HG SER A 40 -2.021 -1.126 8.942 1.00 0.00 H new ATOM 689 N ASP A 41 2.025 -2.733 7.197 1.00 0.00 N ATOM 690 CA ASP A 41 3.354 -3.135 7.642 1.00 0.00 C ATOM 691 C ASP A 41 3.789 -4.423 6.950 1.00 0.00 C ATOM 692 O ASP A 41 2.955 -5.219 6.518 1.00 0.00 O ATOM 693 CB ASP A 41 3.371 -3.324 9.160 1.00 0.00 C ATOM 694 CG ASP A 41 3.947 -2.124 9.886 1.00 0.00 C ATOM 695 OD1 ASP A 41 3.355 -1.029 9.787 1.00 0.00 O ATOM 696 OD2 ASP A 41 4.991 -2.279 10.554 1.00 0.00 O ATOM 0 H ASP A 41 1.394 -3.509 6.999 1.00 0.00 H new ATOM 0 HA ASP A 41 4.056 -2.345 7.376 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.355 -3.505 9.512 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.957 -4.210 9.406 1.00 0.00 H new ATOM 701 N VAL A 42 5.099 -4.624 6.846 1.00 0.00 N ATOM 702 CA VAL A 42 5.637 -5.816 6.204 1.00 0.00 C ATOM 703 C VAL A 42 6.686 -6.493 7.079 1.00 0.00 C ATOM 704 O VAL A 42 7.554 -5.833 7.650 1.00 0.00 O ATOM 705 CB VAL A 42 6.263 -5.485 4.836 1.00 0.00 C ATOM 706 CG1 VAL A 42 5.215 -4.912 3.895 1.00 0.00 C ATOM 707 CG2 VAL A 42 7.432 -4.520 4.998 1.00 0.00 C ATOM 0 H VAL A 42 5.805 -3.978 7.198 1.00 0.00 H new ATOM 0 HA VAL A 42 4.799 -6.497 6.058 1.00 0.00 H new ATOM 0 HB VAL A 42 6.645 -6.408 4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.675 -4.684 2.934 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.417 -5.641 3.752 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.800 -4.000 4.324 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.860 -4.299 4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.080 -3.596 5.457 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.193 -4.974 5.633 1.00 0.00 H new ATOM 717 N LEU A 43 6.600 -7.815 7.176 1.00 0.00 N ATOM 718 CA LEU A 43 7.542 -8.587 7.978 1.00 0.00 C ATOM 719 C LEU A 43 8.970 -8.402 7.473 1.00 0.00 C ATOM 720 O LEU A 43 9.929 -8.535 8.234 1.00 0.00 O ATOM 721 CB LEU A 43 7.171 -10.072 7.953 1.00 0.00 C ATOM 722 CG LEU A 43 6.713 -10.602 6.591 1.00 0.00 C ATOM 723 CD1 LEU A 43 7.604 -11.749 6.134 1.00 0.00 C ATOM 724 CD2 LEU A 43 5.259 -11.051 6.654 1.00 0.00 C ATOM 0 H LEU A 43 5.887 -8.375 6.709 1.00 0.00 H new ATOM 0 HA LEU A 43 7.488 -8.222 9.004 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.034 -10.652 8.280 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.377 -10.245 8.679 1.00 0.00 H new ATOM 0 HG LEU A 43 6.794 -9.793 5.865 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.262 -12.111 5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.633 -11.399 6.048 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.556 -12.559 6.862 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.951 -11.424 5.677 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.155 -11.844 7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.629 -10.207 6.935 1.00 0.00 H new ATOM 736 N LYS A 44 9.106 -8.099 6.185 1.00 0.00 N ATOM 737 CA LYS A 44 10.418 -7.900 5.578 1.00 0.00 C ATOM 738 C LYS A 44 11.202 -9.208 5.542 1.00 0.00 C ATOM 739 O LYS A 44 12.433 -9.207 5.588 1.00 0.00 O ATOM 740 CB LYS A 44 11.209 -6.838 6.347 1.00 0.00 C ATOM 741 CG LYS A 44 12.463 -6.372 5.624 1.00 0.00 C ATOM 742 CD LYS A 44 12.314 -4.953 5.100 1.00 0.00 C ATOM 743 CE LYS A 44 13.633 -4.199 5.148 1.00 0.00 C ATOM 744 NZ LYS A 44 13.479 -2.781 4.721 1.00 0.00 N ATOM 0 H LYS A 44 8.323 -7.986 5.541 1.00 0.00 H new ATOM 0 HA LYS A 44 10.268 -7.556 4.555 1.00 0.00 H new ATOM 0 HB2 LYS A 44 10.564 -5.978 6.530 1.00 0.00 H new ATOM 0 HB3 LYS A 44 11.489 -7.240 7.321 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.314 -6.422 6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 44 12.677 -7.046 4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 44 11.946 -4.980 4.074 1.00 0.00 H new ATOM 0 HD3 LYS A 44 11.569 -4.422 5.692 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.033 -4.231 6.162 1.00 0.00 H new ATOM 0 HE3 LYS A 44 14.358 -4.695 4.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 14.401 -2.302 4.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 13.122 -2.749 3.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 12.806 -2.300 5.352 1.00 0.00 H new ATOM 758 N GLY A 45 10.482 -10.322 5.459 1.00 0.00 N ATOM 759 CA GLY A 45 11.128 -11.621 5.418 1.00 0.00 C ATOM 760 C GLY A 45 10.420 -12.598 4.497 1.00 0.00 C ATOM 761 O GLY A 45 10.681 -13.801 4.543 1.00 0.00 O ATOM 0 H GLY A 45 9.463 -10.348 5.419 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.160 -11.499 5.088 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.163 -12.037 6.425 1.00 0.00 H new ATOM 765 N GLY A 46 9.522 -12.085 3.660 1.00 0.00 N ATOM 766 CA GLY A 46 8.793 -12.938 2.740 1.00 0.00 C ATOM 767 C GLY A 46 8.997 -12.534 1.291 1.00 0.00 C ATOM 768 O GLY A 46 9.921 -11.783 0.979 1.00 0.00 O ATOM 0 H GLY A 46 9.287 -11.094 3.603 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.114 -13.971 2.875 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.730 -12.900 2.979 1.00 0.00 H new ATOM 772 N PRO A 47 8.142 -13.021 0.375 1.00 0.00 N ATOM 773 CA PRO A 47 8.244 -12.699 -1.052 1.00 0.00 C ATOM 774 C PRO A 47 8.136 -11.201 -1.317 1.00 0.00 C ATOM 775 O PRO A 47 8.672 -10.696 -2.305 1.00 0.00 O ATOM 776 CB PRO A 47 7.056 -13.438 -1.679 1.00 0.00 C ATOM 777 CG PRO A 47 6.693 -14.495 -0.693 1.00 0.00 C ATOM 778 CD PRO A 47 7.013 -13.924 0.658 1.00 0.00 C ATOM 0 HA PRO A 47 9.209 -12.995 -1.464 1.00 0.00 H new ATOM 0 HB2 PRO A 47 6.220 -12.761 -1.857 1.00 0.00 H new ATOM 0 HB3 PRO A 47 7.325 -13.872 -2.642 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.637 -14.753 -0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 47 7.258 -15.409 -0.875 1.00 0.00 H new ATOM 0 HD2 PRO A 47 6.164 -13.388 1.082 1.00 0.00 H new ATOM 0 HD3 PRO A 47 7.287 -14.702 1.371 1.00 0.00 H new ATOM 786 N ALA A 48 7.439 -10.495 -0.433 1.00 0.00 N ATOM 787 CA ALA A 48 7.259 -9.055 -0.576 1.00 0.00 C ATOM 788 C ALA A 48 7.877 -8.302 0.598 1.00 0.00 C ATOM 789 O ALA A 48 7.341 -7.289 1.048 1.00 0.00 O ATOM 790 CB ALA A 48 5.781 -8.719 -0.704 1.00 0.00 C ATOM 0 H ALA A 48 6.990 -10.897 0.390 1.00 0.00 H new ATOM 0 HA ALA A 48 7.772 -8.739 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.661 -7.641 -0.810 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.369 -9.218 -1.581 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.253 -9.057 0.187 1.00 0.00 H new ATOM 796 N GLU A 49 9.007 -8.802 1.088 1.00 0.00 N ATOM 797 CA GLU A 49 9.698 -8.173 2.209 1.00 0.00 C ATOM 798 C GLU A 49 10.025 -6.715 1.901 1.00 0.00 C ATOM 799 O GLU A 49 9.922 -5.848 2.768 1.00 0.00 O ATOM 800 CB GLU A 49 10.985 -8.936 2.535 1.00 0.00 C ATOM 801 CG GLU A 49 11.841 -9.230 1.313 1.00 0.00 C ATOM 802 CD GLU A 49 13.219 -9.746 1.678 1.00 0.00 C ATOM 803 OE1 GLU A 49 13.370 -10.306 2.784 1.00 0.00 O ATOM 804 OE2 GLU A 49 14.148 -9.590 0.857 1.00 0.00 O ATOM 0 H GLU A 49 9.463 -9.640 0.727 1.00 0.00 H new ATOM 0 HA GLU A 49 9.034 -8.203 3.073 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.571 -8.357 3.248 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.727 -9.876 3.023 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.335 -9.966 0.688 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.943 -8.322 0.718 1.00 0.00 H new ATOM 811 N GLY A 50 10.420 -6.454 0.659 1.00 0.00 N ATOM 812 CA GLY A 50 10.755 -5.100 0.258 1.00 0.00 C ATOM 813 C GLY A 50 10.252 -4.767 -1.133 1.00 0.00 C ATOM 814 O GLY A 50 10.906 -4.040 -1.881 1.00 0.00 O ATOM 0 H GLY A 50 10.514 -7.155 -0.076 1.00 0.00 H new ATOM 0 HA2 GLY A 50 10.329 -4.396 0.973 1.00 0.00 H new ATOM 0 HA3 GLY A 50 11.837 -4.972 0.290 1.00 0.00 H new ATOM 818 N GLN A 51 9.086 -5.303 -1.482 1.00 0.00 N ATOM 819 CA GLN A 51 8.494 -5.060 -2.792 1.00 0.00 C ATOM 820 C GLN A 51 7.277 -4.148 -2.678 1.00 0.00 C ATOM 821 O GLN A 51 7.048 -3.291 -3.533 1.00 0.00 O ATOM 822 CB GLN A 51 8.096 -6.383 -3.448 1.00 0.00 C ATOM 823 CG GLN A 51 9.225 -7.042 -4.223 1.00 0.00 C ATOM 824 CD GLN A 51 9.027 -6.964 -5.724 1.00 0.00 C ATOM 825 OE1 GLN A 51 7.929 -7.195 -6.229 1.00 0.00 O ATOM 826 NE2 GLN A 51 10.093 -6.636 -6.446 1.00 0.00 N ATOM 0 H GLN A 51 8.533 -5.908 -0.875 1.00 0.00 H new ATOM 0 HA GLN A 51 9.239 -4.564 -3.414 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.746 -7.070 -2.678 1.00 0.00 H new ATOM 0 HB3 GLN A 51 7.258 -6.207 -4.122 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.169 -6.564 -3.960 1.00 0.00 H new ATOM 0 HG3 GLN A 51 9.303 -8.087 -3.925 1.00 0.00 H new ATOM 0 HE21 GLN A 51 10.984 -6.453 -5.985 1.00 0.00 H new ATOM 0 HE22 GLN A 51 10.020 -6.567 -7.461 1.00 0.00 H new ATOM 835 N LEU A 52 6.499 -4.336 -1.618 1.00 0.00 N ATOM 836 CA LEU A 52 5.305 -3.530 -1.390 1.00 0.00 C ATOM 837 C LEU A 52 5.392 -2.793 -0.058 1.00 0.00 C ATOM 838 O LEU A 52 5.716 -3.387 0.971 1.00 0.00 O ATOM 839 CB LEU A 52 4.055 -4.412 -1.420 1.00 0.00 C ATOM 840 CG LEU A 52 3.881 -5.247 -2.689 1.00 0.00 C ATOM 841 CD1 LEU A 52 2.723 -6.220 -2.533 1.00 0.00 C ATOM 842 CD2 LEU A 52 3.665 -4.346 -3.895 1.00 0.00 C ATOM 0 H LEU A 52 6.674 -5.041 -0.902 1.00 0.00 H new ATOM 0 HA LEU A 52 5.238 -2.791 -2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.083 -5.084 -0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 52 3.178 -3.777 -1.299 1.00 0.00 H new ATOM 0 HG LEU A 52 4.793 -5.823 -2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 52 2.614 -6.806 -3.446 1.00 0.00 H new ATOM 0 HD12 LEU A 52 2.920 -6.888 -1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.804 -5.665 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.543 -4.958 -4.789 1.00 0.00 H new ATOM 0 HD22 LEU A 52 2.770 -3.743 -3.743 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.527 -3.691 -4.019 1.00 0.00 H new ATOM 854 N GLN A 53 5.101 -1.496 -0.083 1.00 0.00 N ATOM 855 CA GLN A 53 5.146 -0.678 1.122 1.00 0.00 C ATOM 856 C GLN A 53 4.168 0.488 1.025 1.00 0.00 C ATOM 857 O GLN A 53 3.554 0.711 -0.019 1.00 0.00 O ATOM 858 CB GLN A 53 6.565 -0.152 1.353 1.00 0.00 C ATOM 859 CG GLN A 53 7.049 0.791 0.263 1.00 0.00 C ATOM 860 CD GLN A 53 8.341 0.327 -0.380 1.00 0.00 C ATOM 861 OE1 GLN A 53 9.428 0.545 0.155 1.00 0.00 O ATOM 862 NE2 GLN A 53 8.230 -0.318 -1.536 1.00 0.00 N ATOM 0 H GLN A 53 4.831 -0.989 -0.926 1.00 0.00 H new ATOM 0 HA GLN A 53 4.855 -1.302 1.967 1.00 0.00 H new ATOM 0 HB2 GLN A 53 6.600 0.366 2.312 1.00 0.00 H new ATOM 0 HB3 GLN A 53 7.250 -0.997 1.422 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.278 0.881 -0.503 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.195 1.785 0.686 1.00 0.00 H new ATOM 0 HE21 GLN A 53 7.309 -0.477 -1.945 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.066 -0.654 -2.015 1.00 0.00 H new ATOM 871 N GLU A 54 4.028 1.232 2.119 1.00 0.00 N ATOM 872 CA GLU A 54 3.124 2.377 2.159 1.00 0.00 C ATOM 873 C GLU A 54 3.397 3.333 1.000 1.00 0.00 C ATOM 874 O GLU A 54 2.490 4.007 0.513 1.00 0.00 O ATOM 875 CB GLU A 54 3.268 3.119 3.489 1.00 0.00 C ATOM 876 CG GLU A 54 2.361 2.585 4.586 1.00 0.00 C ATOM 877 CD GLU A 54 2.435 3.409 5.856 1.00 0.00 C ATOM 878 OE1 GLU A 54 2.712 4.622 5.761 1.00 0.00 O ATOM 879 OE2 GLU A 54 2.214 2.840 6.946 1.00 0.00 O ATOM 0 H GLU A 54 4.530 1.062 2.990 1.00 0.00 H new ATOM 0 HA GLU A 54 2.104 2.004 2.064 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.304 3.053 3.822 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.050 4.175 3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.332 2.570 4.226 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.636 1.554 4.810 1.00 0.00 H new ATOM 886 N ASN A 55 4.651 3.382 0.563 1.00 0.00 N ATOM 887 CA ASN A 55 5.042 4.252 -0.540 1.00 0.00 C ATOM 888 C ASN A 55 4.390 3.805 -1.845 1.00 0.00 C ATOM 889 O ASN A 55 4.151 4.614 -2.741 1.00 0.00 O ATOM 890 CB ASN A 55 6.565 4.264 -0.693 1.00 0.00 C ATOM 891 CG ASN A 55 7.111 5.656 -0.942 1.00 0.00 C ATOM 892 OD1 ASN A 55 7.710 6.267 -0.058 1.00 0.00 O ATOM 893 ND2 ASN A 55 6.904 6.164 -2.152 1.00 0.00 N ATOM 0 H ASN A 55 5.413 2.830 0.956 1.00 0.00 H new ATOM 0 HA ASN A 55 4.699 5.261 -0.312 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.021 3.854 0.208 1.00 0.00 H new ATOM 0 HB3 ASN A 55 6.849 3.612 -1.519 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.247 7.097 -2.379 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.402 5.621 -2.854 1.00 0.00 H new ATOM 900 N ASP A 56 4.104 2.509 -1.944 1.00 0.00 N ATOM 901 CA ASP A 56 3.479 1.954 -3.138 1.00 0.00 C ATOM 902 C ASP A 56 1.971 1.834 -2.952 1.00 0.00 C ATOM 903 O ASP A 56 1.498 1.095 -2.089 1.00 0.00 O ATOM 904 CB ASP A 56 4.078 0.583 -3.462 1.00 0.00 C ATOM 905 CG ASP A 56 5.590 0.621 -3.564 1.00 0.00 C ATOM 906 OD1 ASP A 56 6.229 1.264 -2.705 1.00 0.00 O ATOM 907 OD2 ASP A 56 6.137 0.007 -4.506 1.00 0.00 O ATOM 0 H ASP A 56 4.296 1.825 -1.212 1.00 0.00 H new ATOM 0 HA ASP A 56 3.672 2.631 -3.970 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.787 -0.129 -2.690 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.662 0.221 -4.402 1.00 0.00 H new ATOM 912 N ARG A 57 1.222 2.570 -3.765 1.00 0.00 N ATOM 913 CA ARG A 57 -0.235 2.551 -3.688 1.00 0.00 C ATOM 914 C ARG A 57 -0.814 1.383 -4.480 1.00 0.00 C ATOM 915 O ARG A 57 -0.707 1.337 -5.706 1.00 0.00 O ATOM 916 CB ARG A 57 -0.810 3.869 -4.212 1.00 0.00 C ATOM 917 CG ARG A 57 -2.076 4.308 -3.493 1.00 0.00 C ATOM 918 CD ARG A 57 -2.151 5.822 -3.374 1.00 0.00 C ATOM 919 NE ARG A 57 -2.820 6.430 -4.523 1.00 0.00 N ATOM 920 CZ ARG A 57 -4.143 6.490 -4.664 1.00 0.00 C ATOM 921 NH1 ARG A 57 -4.941 5.974 -3.738 1.00 0.00 N ATOM 922 NH2 ARG A 57 -4.667 7.067 -5.736 1.00 0.00 N ATOM 0 H ARG A 57 1.599 3.187 -4.485 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.513 2.427 -2.641 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.056 4.650 -4.113 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -1.023 3.765 -5.276 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.949 3.940 -4.033 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.105 3.862 -2.499 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.685 6.088 -2.462 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.144 6.229 -3.284 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.240 6.832 -5.260 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.542 5.528 -2.912 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.953 6.023 -3.852 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.057 7.464 -6.451 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.680 7.114 -5.846 1.00 0.00 H new ATOM 936 N VAL A 58 -1.434 0.443 -3.772 1.00 0.00 N ATOM 937 CA VAL A 58 -2.036 -0.722 -4.409 1.00 0.00 C ATOM 938 C VAL A 58 -3.351 -0.349 -5.085 1.00 0.00 C ATOM 939 O VAL A 58 -4.204 0.305 -4.484 1.00 0.00 O ATOM 940 CB VAL A 58 -2.295 -1.851 -3.392 1.00 0.00 C ATOM 941 CG1 VAL A 58 -2.782 -3.108 -4.097 1.00 0.00 C ATOM 942 CG2 VAL A 58 -1.040 -2.139 -2.581 1.00 0.00 C ATOM 0 H VAL A 58 -1.532 0.466 -2.757 1.00 0.00 H new ATOM 0 HA VAL A 58 -1.329 -1.079 -5.158 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.076 -1.522 -2.707 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.959 -3.893 -3.361 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.710 -2.892 -4.627 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.027 -3.442 -4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.243 -2.939 -1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.236 -2.445 -3.251 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -0.741 -1.240 -2.042 1.00 0.00 H new ATOM 952 N ALA A 59 -3.507 -0.758 -6.341 1.00 0.00 N ATOM 953 CA ALA A 59 -4.718 -0.452 -7.094 1.00 0.00 C ATOM 954 C ALA A 59 -5.413 -1.713 -7.604 1.00 0.00 C ATOM 955 O ALA A 59 -6.573 -1.664 -8.013 1.00 0.00 O ATOM 956 CB ALA A 59 -4.390 0.474 -8.256 1.00 0.00 C ATOM 0 H ALA A 59 -2.813 -1.300 -6.856 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.409 0.047 -6.414 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.301 0.697 -8.812 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.963 1.401 -7.873 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.671 -0.011 -8.916 1.00 0.00 H new ATOM 962 N MET A 60 -4.707 -2.842 -7.589 1.00 0.00 N ATOM 963 CA MET A 60 -5.282 -4.097 -8.060 1.00 0.00 C ATOM 964 C MET A 60 -4.535 -5.301 -7.496 1.00 0.00 C ATOM 965 O MET A 60 -3.316 -5.270 -7.334 1.00 0.00 O ATOM 966 CB MET A 60 -5.261 -4.144 -9.590 1.00 0.00 C ATOM 967 CG MET A 60 -6.396 -4.955 -10.191 1.00 0.00 C ATOM 968 SD MET A 60 -6.594 -4.668 -11.959 1.00 0.00 S ATOM 969 CE MET A 60 -8.122 -3.733 -11.981 1.00 0.00 C ATOM 0 H MET A 60 -3.745 -2.912 -7.259 1.00 0.00 H new ATOM 0 HA MET A 60 -6.313 -4.143 -7.708 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.309 -3.126 -9.977 1.00 0.00 H new ATOM 0 HB3 MET A 60 -4.311 -4.565 -9.919 1.00 0.00 H new ATOM 0 HG2 MET A 60 -6.211 -6.015 -10.017 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.326 -4.706 -9.680 1.00 0.00 H new ATOM 0 HE1 MET A 60 -8.379 -3.480 -13.010 1.00 0.00 H new ATOM 0 HE2 MET A 60 -8.921 -4.332 -11.544 1.00 0.00 H new ATOM 0 HE3 MET A 60 -7.997 -2.818 -11.402 1.00 0.00 H new ATOM 979 N VAL A 61 -5.279 -6.364 -7.206 1.00 0.00 N ATOM 980 CA VAL A 61 -4.699 -7.589 -6.668 1.00 0.00 C ATOM 981 C VAL A 61 -5.363 -8.815 -7.289 1.00 0.00 C ATOM 982 O VAL A 61 -6.574 -9.004 -7.169 1.00 0.00 O ATOM 983 CB VAL A 61 -4.837 -7.658 -5.131 1.00 0.00 C ATOM 984 CG1 VAL A 61 -4.339 -8.996 -4.600 1.00 0.00 C ATOM 985 CG2 VAL A 61 -4.083 -6.512 -4.475 1.00 0.00 C ATOM 0 H VAL A 61 -6.290 -6.401 -7.336 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.639 -7.580 -6.920 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.894 -7.565 -4.882 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.447 -9.020 -3.516 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.924 -9.803 -5.041 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.289 -9.124 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.192 -6.577 -3.392 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.027 -6.574 -4.738 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.489 -5.562 -4.824 1.00 0.00 H new ATOM 995 N ASN A 62 -4.566 -9.642 -7.956 1.00 0.00 N ATOM 996 CA ASN A 62 -5.077 -10.847 -8.598 1.00 0.00 C ATOM 997 C ASN A 62 -6.152 -10.505 -9.624 1.00 0.00 C ATOM 998 O ASN A 62 -7.085 -11.277 -9.842 1.00 0.00 O ATOM 999 CB ASN A 62 -5.646 -11.805 -7.549 1.00 0.00 C ATOM 1000 CG ASN A 62 -5.672 -13.242 -8.033 1.00 0.00 C ATOM 1001 OD1 ASN A 62 -5.279 -14.166 -7.162 1.00 0.00 O flip ATOM 1002 ND2 ASN A 62 -6.042 -13.519 -9.173 1.00 0.00 N flip ATOM 0 H ASN A 62 -3.562 -9.500 -8.066 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.249 -11.332 -9.115 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.048 -11.741 -6.640 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.657 -11.494 -7.287 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.335 -12.777 -9.808 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.056 -14.491 -9.483 1.00 0.00 H new ATOM 1009 N GLY A 63 -6.013 -9.343 -10.255 1.00 0.00 N ATOM 1010 CA GLY A 63 -6.978 -8.921 -11.254 1.00 0.00 C ATOM 1011 C GLY A 63 -8.115 -8.103 -10.668 1.00 0.00 C ATOM 1012 O GLY A 63 -8.832 -7.418 -11.398 1.00 0.00 O ATOM 0 H GLY A 63 -5.250 -8.686 -10.092 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.469 -8.332 -12.017 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -7.388 -9.801 -11.750 1.00 0.00 H new ATOM 1016 N VAL A 64 -8.286 -8.174 -9.350 1.00 0.00 N ATOM 1017 CA VAL A 64 -9.350 -7.434 -8.679 1.00 0.00 C ATOM 1018 C VAL A 64 -8.887 -6.032 -8.294 1.00 0.00 C ATOM 1019 O VAL A 64 -7.783 -5.850 -7.781 1.00 0.00 O ATOM 1020 CB VAL A 64 -9.832 -8.168 -7.413 1.00 0.00 C ATOM 1021 CG1 VAL A 64 -11.071 -7.493 -6.845 1.00 0.00 C ATOM 1022 CG2 VAL A 64 -10.104 -9.634 -7.717 1.00 0.00 C ATOM 0 H VAL A 64 -7.703 -8.734 -8.728 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.177 -7.360 -9.385 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.043 -8.118 -6.662 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.398 -8.025 -5.951 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.837 -6.460 -6.588 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.868 -7.510 -7.589 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.443 -10.137 -6.811 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.874 -9.710 -8.484 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.189 -10.107 -8.073 1.00 0.00 H new ATOM 1032 N SER A 65 -9.742 -5.044 -8.542 1.00 0.00 N ATOM 1033 CA SER A 65 -9.422 -3.657 -8.220 1.00 0.00 C ATOM 1034 C SER A 65 -9.293 -3.464 -6.713 1.00 0.00 C ATOM 1035 O SER A 65 -10.031 -4.067 -5.934 1.00 0.00 O ATOM 1036 CB SER A 65 -10.499 -2.721 -8.774 1.00 0.00 C ATOM 1037 OG SER A 65 -10.598 -2.833 -10.183 1.00 0.00 O ATOM 0 H SER A 65 -10.661 -5.178 -8.964 1.00 0.00 H new ATOM 0 HA SER A 65 -8.465 -3.415 -8.683 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.461 -2.959 -8.319 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.264 -1.691 -8.504 1.00 0.00 H new ATOM 0 HG SER A 65 -11.294 -2.226 -10.511 1.00 0.00 H new ATOM 1043 N MET A 66 -8.350 -2.618 -6.307 1.00 0.00 N ATOM 1044 CA MET A 66 -8.125 -2.344 -4.893 1.00 0.00 C ATOM 1045 C MET A 66 -8.284 -0.857 -4.590 1.00 0.00 C ATOM 1046 O MET A 66 -7.683 -0.337 -3.649 1.00 0.00 O ATOM 1047 CB MET A 66 -6.730 -2.812 -4.474 1.00 0.00 C ATOM 1048 CG MET A 66 -6.529 -4.314 -4.589 1.00 0.00 C ATOM 1049 SD MET A 66 -7.780 -5.257 -3.696 1.00 0.00 S ATOM 1050 CE MET A 66 -8.175 -6.522 -4.899 1.00 0.00 C ATOM 0 H MET A 66 -7.730 -2.111 -6.938 1.00 0.00 H new ATOM 0 HA MET A 66 -8.873 -2.895 -4.323 1.00 0.00 H new ATOM 0 HB2 MET A 66 -5.987 -2.307 -5.091 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.549 -2.508 -3.443 1.00 0.00 H new ATOM 0 HG2 MET A 66 -6.548 -4.599 -5.641 1.00 0.00 H new ATOM 0 HG3 MET A 66 -5.542 -4.574 -4.206 1.00 0.00 H new ATOM 0 HE1 MET A 66 -8.236 -7.490 -4.402 1.00 0.00 H new ATOM 0 HE2 MET A 66 -9.133 -6.293 -5.367 1.00 0.00 H new ATOM 0 HE3 MET A 66 -7.397 -6.554 -5.662 1.00 0.00 H new ATOM 1060 N ASP A 67 -9.098 -0.176 -5.391 1.00 0.00 N ATOM 1061 CA ASP A 67 -9.337 1.250 -5.204 1.00 0.00 C ATOM 1062 C ASP A 67 -10.785 1.514 -4.804 1.00 0.00 C ATOM 1063 O ASP A 67 -11.297 2.620 -4.981 1.00 0.00 O ATOM 1064 CB ASP A 67 -9.002 2.016 -6.486 1.00 0.00 C ATOM 1065 CG ASP A 67 -8.761 3.492 -6.232 1.00 0.00 C ATOM 1066 OD1 ASP A 67 -9.741 4.266 -6.264 1.00 0.00 O ATOM 1067 OD2 ASP A 67 -7.595 3.873 -6.000 1.00 0.00 O ATOM 0 H ASP A 67 -9.603 -0.589 -6.175 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.689 1.598 -4.399 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.115 1.580 -6.945 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -9.819 1.901 -7.198 1.00 0.00 H new ATOM 1072 N ASN A 68 -11.444 0.491 -4.262 1.00 0.00 N ATOM 1073 CA ASN A 68 -12.834 0.612 -3.836 1.00 0.00 C ATOM 1074 C ASN A 68 -13.363 -0.728 -3.326 1.00 0.00 C ATOM 1075 O ASN A 68 -14.510 -1.093 -3.582 1.00 0.00 O ATOM 1076 CB ASN A 68 -13.704 1.118 -4.993 1.00 0.00 C ATOM 1077 CG ASN A 68 -14.241 2.514 -4.744 1.00 0.00 C ATOM 1078 OD1 ASN A 68 -14.205 3.372 -5.626 1.00 0.00 O ATOM 1079 ND2 ASN A 68 -14.741 2.749 -3.536 1.00 0.00 N ATOM 0 H ASN A 68 -11.036 -0.431 -4.108 1.00 0.00 H new ATOM 0 HA ASN A 68 -12.879 1.333 -3.020 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -13.119 1.115 -5.912 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -14.538 0.432 -5.144 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -15.115 3.670 -3.309 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -14.751 2.008 -2.835 1.00 0.00 H new ATOM 1086 N VAL A 69 -12.518 -1.455 -2.602 1.00 0.00 N ATOM 1087 CA VAL A 69 -12.900 -2.751 -2.056 1.00 0.00 C ATOM 1088 C VAL A 69 -12.579 -2.839 -0.567 1.00 0.00 C ATOM 1089 O VAL A 69 -11.732 -2.103 -0.061 1.00 0.00 O ATOM 1090 CB VAL A 69 -12.190 -3.904 -2.791 1.00 0.00 C ATOM 1091 CG1 VAL A 69 -12.634 -3.965 -4.244 1.00 0.00 C ATOM 1092 CG2 VAL A 69 -10.679 -3.749 -2.694 1.00 0.00 C ATOM 0 H VAL A 69 -11.565 -1.168 -2.380 1.00 0.00 H new ATOM 0 HA VAL A 69 -13.976 -2.847 -2.199 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.468 -4.842 -2.311 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.122 -4.785 -4.747 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -13.711 -4.128 -4.289 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -12.388 -3.026 -4.739 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.194 -4.572 -3.219 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -10.380 -2.804 -3.147 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.379 -3.760 -1.646 1.00 0.00 H new ATOM 1102 N GLU A 70 -13.261 -3.742 0.128 1.00 0.00 N ATOM 1103 CA GLU A 70 -13.050 -3.925 1.560 1.00 0.00 C ATOM 1104 C GLU A 70 -11.727 -4.634 1.831 1.00 0.00 C ATOM 1105 O GLU A 70 -11.231 -5.389 0.992 1.00 0.00 O ATOM 1106 CB GLU A 70 -14.204 -4.723 2.169 1.00 0.00 C ATOM 1107 CG GLU A 70 -14.494 -4.363 3.617 1.00 0.00 C ATOM 1108 CD GLU A 70 -15.448 -5.338 4.279 1.00 0.00 C ATOM 1109 OE1 GLU A 70 -15.018 -6.468 4.595 1.00 0.00 O ATOM 1110 OE2 GLU A 70 -16.625 -4.972 4.482 1.00 0.00 O ATOM 0 H GLU A 70 -13.965 -4.359 -0.277 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.014 -2.939 2.024 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -15.103 -4.557 1.575 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.972 -5.786 2.107 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.559 -4.339 4.176 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.917 -3.360 3.661 1.00 0.00 H new ATOM 1117 N HIS A 71 -11.161 -4.389 3.009 1.00 0.00 N ATOM 1118 CA HIS A 71 -9.895 -5.005 3.395 1.00 0.00 C ATOM 1119 C HIS A 71 -9.971 -6.524 3.274 1.00 0.00 C ATOM 1120 O HIS A 71 -9.103 -7.152 2.666 1.00 0.00 O ATOM 1121 CB HIS A 71 -9.529 -4.613 4.827 1.00 0.00 C ATOM 1122 CG HIS A 71 -10.629 -4.849 5.814 1.00 0.00 C ATOM 1123 ND1 HIS A 71 -11.678 -3.973 5.996 1.00 0.00 N ATOM 1124 CD2 HIS A 71 -10.841 -5.871 6.677 1.00 0.00 C ATOM 1125 CE1 HIS A 71 -12.487 -4.445 6.928 1.00 0.00 C ATOM 1126 NE2 HIS A 71 -12.001 -5.595 7.357 1.00 0.00 N ATOM 0 H HIS A 71 -11.559 -3.768 3.713 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.121 -4.643 2.718 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -8.649 -5.177 5.135 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -9.255 -3.558 4.847 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -10.214 -6.741 6.806 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -13.392 -3.971 7.279 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -12.420 -6.183 8.077 1.00 0.00 H new ATOM 1135 N ALA A 72 -11.015 -7.108 3.852 1.00 0.00 N ATOM 1136 CA ALA A 72 -11.204 -8.551 3.804 1.00 0.00 C ATOM 1137 C ALA A 72 -11.341 -9.034 2.365 1.00 0.00 C ATOM 1138 O ALA A 72 -10.915 -10.139 2.027 1.00 0.00 O ATOM 1139 CB ALA A 72 -12.428 -8.950 4.617 1.00 0.00 C ATOM 0 H ALA A 72 -11.742 -6.604 4.359 1.00 0.00 H new ATOM 0 HA ALA A 72 -10.324 -9.026 4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.558 -10.031 4.573 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -12.292 -8.643 5.654 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -13.312 -8.461 4.207 1.00 0.00 H new ATOM 1145 N PHE A 73 -11.935 -8.197 1.521 1.00 0.00 N ATOM 1146 CA PHE A 73 -12.126 -8.534 0.116 1.00 0.00 C ATOM 1147 C PHE A 73 -10.789 -8.578 -0.617 1.00 0.00 C ATOM 1148 O PHE A 73 -10.563 -9.438 -1.467 1.00 0.00 O ATOM 1149 CB PHE A 73 -13.055 -7.519 -0.551 1.00 0.00 C ATOM 1150 CG PHE A 73 -14.499 -7.928 -0.541 1.00 0.00 C ATOM 1151 CD1 PHE A 73 -14.884 -9.173 -1.013 1.00 0.00 C ATOM 1152 CD2 PHE A 73 -15.473 -7.068 -0.060 1.00 0.00 C ATOM 1153 CE1 PHE A 73 -16.212 -9.553 -1.004 1.00 0.00 C ATOM 1154 CE2 PHE A 73 -16.804 -7.441 -0.049 1.00 0.00 C ATOM 1155 CZ PHE A 73 -17.173 -8.685 -0.521 1.00 0.00 C ATOM 0 H PHE A 73 -12.293 -7.279 1.786 1.00 0.00 H new ATOM 0 HA PHE A 73 -12.582 -9.522 0.062 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -12.954 -6.559 -0.044 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -12.736 -7.370 -1.582 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -14.137 -9.854 -1.392 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -15.189 -6.094 0.311 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -16.499 -10.526 -1.374 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -17.554 -6.761 0.328 1.00 0.00 H new ATOM 0 HZ PHE A 73 -18.212 -8.980 -0.513 1.00 0.00 H new ATOM 1165 N ALA A 74 -9.907 -7.643 -0.281 1.00 0.00 N ATOM 1166 CA ALA A 74 -8.592 -7.573 -0.907 1.00 0.00 C ATOM 1167 C ALA A 74 -7.682 -8.692 -0.410 1.00 0.00 C ATOM 1168 O ALA A 74 -6.885 -9.242 -1.170 1.00 0.00 O ATOM 1169 CB ALA A 74 -7.955 -6.217 -0.642 1.00 0.00 C ATOM 0 H ALA A 74 -10.079 -6.923 0.421 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.723 -7.700 -1.982 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -6.974 -6.177 -1.115 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.588 -5.431 -1.054 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -7.846 -6.070 0.433 1.00 0.00 H new ATOM 1175 N VAL A 75 -7.803 -9.023 0.873 1.00 0.00 N ATOM 1176 CA VAL A 75 -6.988 -10.073 1.473 1.00 0.00 C ATOM 1177 C VAL A 75 -7.418 -11.456 0.993 1.00 0.00 C ATOM 1178 O VAL A 75 -6.582 -12.327 0.754 1.00 0.00 O ATOM 1179 CB VAL A 75 -7.062 -10.032 3.011 1.00 0.00 C ATOM 1180 CG1 VAL A 75 -6.055 -10.996 3.621 1.00 0.00 C ATOM 1181 CG2 VAL A 75 -6.834 -8.615 3.521 1.00 0.00 C ATOM 0 H VAL A 75 -8.458 -8.579 1.516 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.961 -9.888 1.158 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.060 -10.346 3.316 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.122 -10.953 4.708 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.272 -12.010 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.049 -10.717 3.308 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.890 -8.607 4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.850 -8.269 3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.599 -7.954 3.113 1.00 0.00 H new ATOM 1191 N GLN A 76 -8.724 -11.653 0.855 1.00 0.00 N ATOM 1192 CA GLN A 76 -9.257 -12.935 0.406 1.00 0.00 C ATOM 1193 C GLN A 76 -8.855 -13.220 -1.039 1.00 0.00 C ATOM 1194 O GLN A 76 -8.739 -14.376 -1.443 1.00 0.00 O ATOM 1195 CB GLN A 76 -10.781 -12.955 0.537 1.00 0.00 C ATOM 1196 CG GLN A 76 -11.483 -11.961 -0.372 1.00 0.00 C ATOM 1197 CD GLN A 76 -12.987 -12.151 -0.394 1.00 0.00 C ATOM 1198 OE1 GLN A 76 -13.594 -12.272 -1.458 1.00 0.00 O ATOM 1199 NE2 GLN A 76 -13.598 -12.178 0.785 1.00 0.00 N ATOM 0 H GLN A 76 -9.432 -10.944 1.047 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.835 -13.714 1.041 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -11.143 -13.958 0.313 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -11.051 -12.742 1.571 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.253 -10.948 -0.042 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -11.093 -12.062 -1.385 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -13.056 -12.074 1.643 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -14.609 -12.303 0.833 1.00 0.00 H new ATOM 1208 N GLN A 77 -8.645 -12.159 -1.814 1.00 0.00 N ATOM 1209 CA GLN A 77 -8.258 -12.302 -3.212 1.00 0.00 C ATOM 1210 C GLN A 77 -6.855 -12.888 -3.333 1.00 0.00 C ATOM 1211 O GLN A 77 -6.636 -13.853 -4.066 1.00 0.00 O ATOM 1212 CB GLN A 77 -8.324 -10.947 -3.922 1.00 0.00 C ATOM 1213 CG GLN A 77 -9.456 -10.843 -4.931 1.00 0.00 C ATOM 1214 CD GLN A 77 -10.806 -11.178 -4.330 1.00 0.00 C ATOM 1215 OE1 GLN A 77 -11.398 -10.368 -3.617 1.00 0.00 O ATOM 1216 NE2 GLN A 77 -11.300 -12.377 -4.614 1.00 0.00 N ATOM 0 H GLN A 77 -8.736 -11.194 -1.497 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.958 -12.988 -3.689 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.440 -10.161 -3.176 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.377 -10.766 -4.431 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -9.484 -9.832 -5.337 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.257 -11.516 -5.765 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.775 -13.017 -5.210 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.205 -12.658 -4.236 1.00 0.00 H new ATOM 1225 N LEU A 78 -5.908 -12.300 -2.610 1.00 0.00 N ATOM 1226 CA LEU A 78 -4.526 -12.767 -2.636 1.00 0.00 C ATOM 1227 C LEU A 78 -4.382 -14.087 -1.886 1.00 0.00 C ATOM 1228 O LEU A 78 -3.542 -14.918 -2.228 1.00 0.00 O ATOM 1229 CB LEU A 78 -3.595 -11.714 -2.030 1.00 0.00 C ATOM 1230 CG LEU A 78 -3.931 -11.296 -0.598 1.00 0.00 C ATOM 1231 CD1 LEU A 78 -3.267 -12.231 0.401 1.00 0.00 C ATOM 1232 CD2 LEU A 78 -3.504 -9.856 -0.350 1.00 0.00 C ATOM 0 H LEU A 78 -6.072 -11.500 -1.999 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.245 -12.931 -3.676 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.575 -12.099 -2.050 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.613 -10.828 -2.664 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.011 -11.363 -0.463 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.517 -11.918 1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.621 -13.249 0.238 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.186 -12.197 0.268 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.750 -9.575 0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.429 -9.764 -0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.027 -9.197 -1.043 1.00 0.00 H new ATOM 1244 N ARG A 79 -5.208 -14.273 -0.861 1.00 0.00 N ATOM 1245 CA ARG A 79 -5.172 -15.493 -0.062 1.00 0.00 C ATOM 1246 C ARG A 79 -5.583 -16.704 -0.895 1.00 0.00 C ATOM 1247 O ARG A 79 -5.150 -17.825 -0.633 1.00 0.00 O ATOM 1248 CB ARG A 79 -6.093 -15.360 1.153 1.00 0.00 C ATOM 1249 CG ARG A 79 -5.875 -16.440 2.201 1.00 0.00 C ATOM 1250 CD ARG A 79 -6.892 -16.340 3.327 1.00 0.00 C ATOM 1251 NE ARG A 79 -7.325 -17.655 3.793 1.00 0.00 N ATOM 1252 CZ ARG A 79 -8.282 -18.372 3.209 1.00 0.00 C ATOM 1253 NH1 ARG A 79 -8.910 -17.907 2.135 1.00 0.00 N ATOM 1254 NH2 ARG A 79 -8.614 -19.559 3.699 1.00 0.00 N ATOM 0 H ARG A 79 -5.910 -13.595 -0.564 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.148 -15.641 0.281 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -5.938 -14.383 1.611 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -7.130 -15.394 0.818 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.945 -17.422 1.733 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -4.868 -16.353 2.610 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -6.458 -15.786 4.159 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.758 -15.774 2.984 1.00 0.00 H new ATOM 0 HE ARG A 79 -6.866 -18.047 4.615 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.660 -16.995 1.753 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -9.643 -18.462 1.692 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -8.136 -19.922 4.523 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -9.348 -20.109 3.251 1.00 0.00 H new ATOM 1268 N LYS A 80 -6.423 -16.470 -1.899 1.00 0.00 N ATOM 1269 CA LYS A 80 -6.891 -17.542 -2.769 1.00 0.00 C ATOM 1270 C LYS A 80 -5.733 -18.157 -3.551 1.00 0.00 C ATOM 1271 O LYS A 80 -5.782 -19.327 -3.932 1.00 0.00 O ATOM 1272 CB LYS A 80 -7.958 -17.015 -3.733 1.00 0.00 C ATOM 1273 CG LYS A 80 -9.292 -17.731 -3.611 1.00 0.00 C ATOM 1274 CD LYS A 80 -10.052 -17.721 -4.928 1.00 0.00 C ATOM 1275 CE LYS A 80 -11.309 -18.571 -4.852 1.00 0.00 C ATOM 1276 NZ LYS A 80 -11.097 -19.931 -5.421 1.00 0.00 N ATOM 0 H LYS A 80 -6.793 -15.548 -2.129 1.00 0.00 H new ATOM 0 HA LYS A 80 -7.331 -18.319 -2.143 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -8.108 -15.951 -3.550 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -7.593 -17.114 -4.755 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -9.126 -18.760 -3.293 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -9.894 -17.252 -2.839 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -10.319 -16.697 -5.187 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -9.407 -18.093 -5.724 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -11.626 -18.658 -3.813 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -12.116 -18.074 -5.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -11.978 -20.478 -5.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -10.820 -19.850 -6.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -10.345 -20.416 -4.891 1.00 0.00 H new ATOM 1290 N SER A 81 -4.693 -17.363 -3.786 1.00 0.00 N ATOM 1291 CA SER A 81 -3.524 -17.832 -4.523 1.00 0.00 C ATOM 1292 C SER A 81 -2.885 -19.029 -3.826 1.00 0.00 C ATOM 1293 O SER A 81 -2.993 -20.163 -4.295 1.00 0.00 O ATOM 1294 CB SER A 81 -2.500 -16.705 -4.666 1.00 0.00 C ATOM 1295 OG SER A 81 -3.026 -15.631 -5.426 1.00 0.00 O ATOM 0 H SER A 81 -4.636 -16.393 -3.477 1.00 0.00 H new ATOM 0 HA SER A 81 -3.852 -18.144 -5.514 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.208 -16.347 -3.679 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.599 -17.087 -5.146 1.00 0.00 H new ATOM 0 HG SER A 81 -2.526 -15.549 -6.265 1.00 0.00 H new ATOM 1301 N GLY A 82 -2.220 -18.771 -2.705 1.00 0.00 N ATOM 1302 CA GLY A 82 -1.573 -19.838 -1.964 1.00 0.00 C ATOM 1303 C GLY A 82 -0.098 -19.960 -2.290 1.00 0.00 C ATOM 1304 O GLY A 82 0.695 -20.395 -1.455 1.00 0.00 O ATOM 0 H GLY A 82 -2.117 -17.842 -2.296 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -1.692 -19.658 -0.896 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.070 -20.783 -2.185 1.00 0.00 H new ATOM 1308 N LYS A 83 0.270 -19.578 -3.509 1.00 0.00 N ATOM 1309 CA LYS A 83 1.661 -19.648 -3.944 1.00 0.00 C ATOM 1310 C LYS A 83 1.868 -18.856 -5.231 1.00 0.00 C ATOM 1311 O LYS A 83 2.710 -19.205 -6.059 1.00 0.00 O ATOM 1312 CB LYS A 83 2.080 -21.104 -4.154 1.00 0.00 C ATOM 1313 CG LYS A 83 3.562 -21.349 -3.921 1.00 0.00 C ATOM 1314 CD LYS A 83 3.832 -21.811 -2.498 1.00 0.00 C ATOM 1315 CE LYS A 83 5.219 -22.420 -2.364 1.00 0.00 C ATOM 1316 NZ LYS A 83 5.223 -23.596 -1.451 1.00 0.00 N ATOM 0 H LYS A 83 -0.375 -19.217 -4.212 1.00 0.00 H new ATOM 0 HA LYS A 83 2.282 -19.208 -3.164 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.505 -21.740 -3.481 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.826 -21.404 -5.171 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.923 -22.100 -4.623 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.119 -20.433 -4.120 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.737 -20.966 -1.816 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.081 -22.544 -2.204 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.579 -22.723 -3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.912 -21.667 -1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.186 -23.982 -1.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.904 -23.303 -0.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 4.582 -24.326 -1.822 1.00 0.00 H new ATOM 1330 N ASN A 84 1.092 -17.788 -5.392 1.00 0.00 N ATOM 1331 CA ASN A 84 1.184 -16.942 -6.576 1.00 0.00 C ATOM 1332 C ASN A 84 0.165 -15.810 -6.509 1.00 0.00 C ATOM 1333 O ASN A 84 -0.837 -15.818 -7.223 1.00 0.00 O ATOM 1334 CB ASN A 84 0.965 -17.771 -7.844 1.00 0.00 C ATOM 1335 CG ASN A 84 2.267 -18.118 -8.539 1.00 0.00 C ATOM 1336 OD1 ASN A 84 2.671 -19.280 -8.581 1.00 0.00 O ATOM 1337 ND2 ASN A 84 2.932 -17.108 -9.088 1.00 0.00 N ATOM 0 H ASN A 84 0.391 -17.488 -4.715 1.00 0.00 H new ATOM 0 HA ASN A 84 2.184 -16.508 -6.608 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.437 -18.689 -7.588 1.00 0.00 H new ATOM 0 HB3 ASN A 84 0.326 -17.217 -8.531 1.00 0.00 H new ATOM 0 HD21 ASN A 84 3.815 -17.280 -9.569 1.00 0.00 H new ATOM 0 HD22 ASN A 84 2.560 -16.160 -9.029 1.00 0.00 H new ATOM 1344 N ALA A 85 0.428 -14.837 -5.643 1.00 0.00 N ATOM 1345 CA ALA A 85 -0.465 -13.698 -5.480 1.00 0.00 C ATOM 1346 C ALA A 85 0.133 -12.444 -6.105 1.00 0.00 C ATOM 1347 O ALA A 85 1.122 -11.903 -5.608 1.00 0.00 O ATOM 1348 CB ALA A 85 -0.761 -13.466 -4.006 1.00 0.00 C ATOM 0 H ALA A 85 1.253 -14.815 -5.043 1.00 0.00 H new ATOM 0 HA ALA A 85 -1.400 -13.921 -5.995 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.430 -12.612 -3.899 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.236 -14.353 -3.586 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.170 -13.267 -3.475 1.00 0.00 H new ATOM 1354 N LYS A 86 -0.468 -11.986 -7.197 1.00 0.00 N ATOM 1355 CA LYS A 86 0.014 -10.796 -7.886 1.00 0.00 C ATOM 1356 C LYS A 86 -0.658 -9.540 -7.341 1.00 0.00 C ATOM 1357 O LYS A 86 -1.874 -9.508 -7.144 1.00 0.00 O ATOM 1358 CB LYS A 86 -0.224 -10.918 -9.396 1.00 0.00 C ATOM 1359 CG LYS A 86 -1.620 -10.503 -9.838 1.00 0.00 C ATOM 1360 CD LYS A 86 -1.980 -11.100 -11.191 1.00 0.00 C ATOM 1361 CE LYS A 86 -2.004 -10.041 -12.281 1.00 0.00 C ATOM 1362 NZ LYS A 86 -3.394 -9.645 -12.640 1.00 0.00 N ATOM 0 H LYS A 86 -1.287 -12.419 -7.623 1.00 0.00 H new ATOM 0 HA LYS A 86 1.086 -10.712 -7.707 1.00 0.00 H new ATOM 0 HB2 LYS A 86 0.509 -10.305 -9.920 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.050 -11.951 -9.699 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.348 -10.823 -9.093 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.677 -9.416 -9.893 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.259 -11.875 -11.451 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.956 -11.581 -11.129 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.451 -9.163 -11.946 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.494 -10.420 -13.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.367 -8.921 -13.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.914 -10.477 -12.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.873 -9.259 -11.801 1.00 0.00 H new ATOM 1376 N ILE A 87 0.140 -8.508 -7.102 1.00 0.00 N ATOM 1377 CA ILE A 87 -0.373 -7.248 -6.583 1.00 0.00 C ATOM 1378 C ILE A 87 0.142 -6.070 -7.402 1.00 0.00 C ATOM 1379 O ILE A 87 1.346 -5.930 -7.617 1.00 0.00 O ATOM 1380 CB ILE A 87 0.018 -7.047 -5.105 1.00 0.00 C ATOM 1381 CG1 ILE A 87 -0.352 -8.285 -4.286 1.00 0.00 C ATOM 1382 CG2 ILE A 87 -0.663 -5.808 -4.540 1.00 0.00 C ATOM 1383 CD1 ILE A 87 0.043 -8.185 -2.829 1.00 0.00 C ATOM 0 H ILE A 87 1.148 -8.519 -7.260 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.460 -7.292 -6.658 1.00 0.00 H new ATOM 0 HB ILE A 87 1.097 -6.903 -5.045 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.428 -8.446 -4.352 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.129 -9.159 -4.726 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.377 -5.680 -3.496 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -0.356 -4.932 -5.111 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -1.745 -5.924 -4.608 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.250 -9.097 -2.309 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.122 -8.054 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -0.459 -7.331 -2.374 1.00 0.00 H new ATOM 1395 N THR A 88 -0.776 -5.224 -7.854 1.00 0.00 N ATOM 1396 CA THR A 88 -0.415 -4.058 -8.648 1.00 0.00 C ATOM 1397 C THR A 88 -0.360 -2.808 -7.776 1.00 0.00 C ATOM 1398 O THR A 88 -1.261 -2.557 -6.976 1.00 0.00 O ATOM 1399 CB THR A 88 -1.417 -3.858 -9.787 1.00 0.00 C ATOM 1400 OG1 THR A 88 -1.878 -5.104 -10.274 1.00 0.00 O ATOM 1401 CG2 THR A 88 -0.843 -3.090 -10.958 1.00 0.00 C ATOM 0 H THR A 88 -1.777 -5.325 -7.684 1.00 0.00 H new ATOM 0 HA THR A 88 0.574 -4.229 -9.073 1.00 0.00 H new ATOM 0 HB THR A 88 -2.233 -3.278 -9.357 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.391 -4.964 -11.097 1.00 0.00 H new ATOM 0 HG21 THR A 88 -1.604 -2.983 -11.731 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.523 -2.103 -10.624 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.012 -3.631 -11.364 1.00 0.00 H new ATOM 1409 N ILE A 89 0.704 -2.029 -7.934 1.00 0.00 N ATOM 1410 CA ILE A 89 0.876 -0.807 -7.155 1.00 0.00 C ATOM 1411 C ILE A 89 1.423 0.324 -8.017 1.00 0.00 C ATOM 1412 O ILE A 89 1.892 0.095 -9.131 1.00 0.00 O ATOM 1413 CB ILE A 89 1.818 -1.024 -5.950 1.00 0.00 C ATOM 1414 CG1 ILE A 89 2.975 -1.960 -6.318 1.00 0.00 C ATOM 1415 CG2 ILE A 89 1.042 -1.579 -4.766 1.00 0.00 C ATOM 1416 CD1 ILE A 89 4.091 -1.278 -7.079 1.00 0.00 C ATOM 0 H ILE A 89 1.459 -2.221 -8.592 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.112 -0.534 -6.784 1.00 0.00 H new ATOM 0 HB ILE A 89 2.240 -0.059 -5.671 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.383 -2.395 -5.406 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.588 -2.783 -6.919 1.00 0.00 H new ATOM 0 HG21 ILE A 89 1.719 -1.727 -3.924 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.259 -0.876 -4.483 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.591 -2.533 -5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.873 -2.003 -7.304 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.699 -0.866 -8.009 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.506 -0.473 -6.473 1.00 0.00 H new ATOM 1428 N ARG A 90 1.358 1.547 -7.497 1.00 0.00 N ATOM 1429 CA ARG A 90 1.848 2.708 -8.231 1.00 0.00 C ATOM 1430 C ARG A 90 2.656 3.638 -7.329 1.00 0.00 C ATOM 1431 O ARG A 90 2.276 3.901 -6.188 1.00 0.00 O ATOM 1432 CB ARG A 90 0.682 3.475 -8.859 1.00 0.00 C ATOM 1433 CG ARG A 90 -0.354 2.580 -9.517 1.00 0.00 C ATOM 1434 CD ARG A 90 -1.618 2.473 -8.682 1.00 0.00 C ATOM 1435 NE ARG A 90 -2.128 3.783 -8.284 1.00 0.00 N ATOM 1436 CZ ARG A 90 -2.860 4.565 -9.073 1.00 0.00 C ATOM 1437 NH1 ARG A 90 -3.167 4.180 -10.305 1.00 0.00 N ATOM 1438 NH2 ARG A 90 -3.289 5.740 -8.628 1.00 0.00 N ATOM 0 H ARG A 90 0.973 1.758 -6.576 1.00 0.00 H new ATOM 0 HA ARG A 90 2.505 2.345 -9.021 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.196 4.073 -8.089 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.074 4.169 -9.602 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.602 2.974 -10.503 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.067 1.586 -9.668 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -2.383 1.944 -9.250 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.414 1.878 -7.792 1.00 0.00 H new ATOM 0 HE ARG A 90 -1.910 4.118 -7.346 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.841 3.278 -10.654 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.729 4.786 -10.903 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -3.057 6.043 -7.682 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -3.850 6.340 -9.232 1.00 0.00 H new ATOM 1452 N ARG A 91 3.771 4.136 -7.860 1.00 0.00 N ATOM 1453 CA ARG A 91 4.640 5.047 -7.117 1.00 0.00 C ATOM 1454 C ARG A 91 5.283 6.060 -8.061 1.00 0.00 C ATOM 1455 O ARG A 91 5.722 5.710 -9.156 1.00 0.00 O ATOM 1456 CB ARG A 91 5.741 4.278 -6.373 1.00 0.00 C ATOM 1457 CG ARG A 91 5.350 2.868 -5.955 1.00 0.00 C ATOM 1458 CD ARG A 91 5.731 1.849 -7.016 1.00 0.00 C ATOM 1459 NE ARG A 91 7.090 1.346 -6.828 1.00 0.00 N ATOM 1460 CZ ARG A 91 7.693 0.507 -7.667 1.00 0.00 C ATOM 1461 NH1 ARG A 91 7.063 0.076 -8.752 1.00 0.00 N ATOM 1462 NH2 ARG A 91 8.930 0.098 -7.420 1.00 0.00 N ATOM 0 H ARG A 91 4.095 3.924 -8.804 1.00 0.00 H new ATOM 0 HA ARG A 91 4.022 5.570 -6.387 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.623 4.223 -7.011 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.024 4.842 -5.484 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.840 2.617 -5.014 1.00 0.00 H new ATOM 0 HG3 ARG A 91 4.276 2.825 -5.776 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.029 1.016 -6.987 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.646 2.304 -8.003 1.00 0.00 H new ATOM 0 HE ARG A 91 7.607 1.656 -6.005 1.00 0.00 H new ATOM 0 HH11 ARG A 91 6.111 0.388 -8.947 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.530 -0.567 -9.391 1.00 0.00 H new ATOM 0 HH21 ARG A 91 9.419 0.426 -6.587 1.00 0.00 H new ATOM 0 HH22 ARG A 91 9.392 -0.545 -8.063 1.00 0.00 H new ATOM 1476 N LYS A 92 5.341 7.317 -7.629 1.00 0.00 N ATOM 1477 CA LYS A 92 5.937 8.374 -8.442 1.00 0.00 C ATOM 1478 C LYS A 92 7.054 9.086 -7.685 1.00 0.00 C ATOM 1479 O LYS A 92 8.071 9.460 -8.270 1.00 0.00 O ATOM 1480 CB LYS A 92 4.871 9.382 -8.877 1.00 0.00 C ATOM 1481 CG LYS A 92 4.014 9.901 -7.734 1.00 0.00 C ATOM 1482 CD LYS A 92 3.618 11.351 -7.950 1.00 0.00 C ATOM 1483 CE LYS A 92 4.624 12.303 -7.325 1.00 0.00 C ATOM 1484 NZ LYS A 92 5.583 12.838 -8.331 1.00 0.00 N ATOM 0 H LYS A 92 4.985 7.628 -6.725 1.00 0.00 H new ATOM 0 HA LYS A 92 6.367 7.910 -9.330 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.360 10.226 -9.364 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.225 8.915 -9.620 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.118 9.288 -7.642 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.561 9.808 -6.796 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.540 11.553 -9.018 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.632 11.528 -7.520 1.00 0.00 H new ATOM 0 HE2 LYS A 92 4.095 13.130 -6.852 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.174 11.785 -6.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 6.556 12.705 -7.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 5.461 12.331 -9.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 5.403 13.852 -8.477 1.00 0.00 H new ATOM 1498 N LYS A 93 6.861 9.274 -6.382 1.00 0.00 N ATOM 1499 CA LYS A 93 7.855 9.941 -5.550 1.00 0.00 C ATOM 1500 C LYS A 93 8.144 11.347 -6.066 1.00 0.00 C ATOM 1501 O LYS A 93 7.582 11.719 -7.116 1.00 0.00 O ATOM 1502 CB LYS A 93 9.148 9.124 -5.508 1.00 0.00 C ATOM 1503 CG LYS A 93 9.896 9.236 -4.189 1.00 0.00 C ATOM 1504 CD LYS A 93 9.964 7.899 -3.468 1.00 0.00 C ATOM 1505 CE LYS A 93 10.859 6.914 -4.203 1.00 0.00 C ATOM 1506 NZ LYS A 93 12.303 7.197 -3.974 1.00 0.00 N ATOM 1507 OXT LYS A 93 8.933 12.065 -5.414 1.00 0.00 O ATOM 0 H LYS A 93 6.025 8.973 -5.881 1.00 0.00 H new ATOM 0 HA LYS A 93 7.451 10.021 -4.541 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.912 8.076 -5.695 1.00 0.00 H new ATOM 0 HB3 LYS A 93 9.802 9.452 -6.316 1.00 0.00 H new ATOM 0 HG2 LYS A 93 10.906 9.602 -4.373 1.00 0.00 H new ATOM 0 HG3 LYS A 93 9.402 9.969 -3.551 1.00 0.00 H new ATOM 0 HD2 LYS A 93 10.340 8.049 -2.456 1.00 0.00 H new ATOM 0 HD3 LYS A 93 8.961 7.482 -3.377 1.00 0.00 H new ATOM 0 HE2 LYS A 93 10.631 5.900 -3.873 1.00 0.00 H new ATOM 0 HE3 LYS A 93 10.646 6.957 -5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 12.879 6.503 -4.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 12.527 8.155 -4.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 12.513 7.131 -2.958 1.00 0.00 H new TER 1521 LYS A 93