USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 956 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= -0.098 (180deg=-0.404) USER MOD Single : A 5 MET CE :methyl -138:sc= -0.289 (180deg=-3.26!) USER MOD Single : A 8 GLN : amide:sc=-0.00922 X(o=-0.0092,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 136:sc= 0.61 (180deg=0.0103) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 165:sc=3.42e-06 (180deg=0) USER MOD Single : A 27 TYR OH : rot 170:sc= -2.37 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN :FLIP amide:sc= -0.765 F(o=-1.4!,f=-0.76) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 16:sc= 0.422 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -132:sc= -0.0171 (180deg=-1.79) USER MOD Single : A 52 LYS NZ :NH3+ 152:sc= -0.161 (180deg=-1.04) USER MOD Single : A 57 TYR OH : rot 34:sc= 0.919 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc=-0.00185 USER MOD Single : A 63 MET CE :methyl 136:sc= -3.69! (180deg=-8.66!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.172 K(o=-0.17,f=-2.7!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 5:sc= 1.11 USER MOD Single : A 84 GLN : amide:sc= -0.506 X(o=-0.51,f=-0.83) USER MOD Single : A 86 TYR OH : rot -80:sc= -3.25! USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -161:sc= 1.04 (180deg=0.711) USER MOD Single : A 96 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0481) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.871 2.420 10.091 1.00 0.00 N ATOM 2 CA MET A 1 -16.435 2.550 10.271 1.00 0.00 C ATOM 3 C MET A 1 -15.678 1.603 9.337 1.00 0.00 C ATOM 4 O MET A 1 -14.563 1.183 9.643 1.00 0.00 O ATOM 5 CB MET A 1 -16.071 2.233 11.723 1.00 0.00 C ATOM 6 CG MET A 1 -14.774 2.936 12.129 1.00 0.00 C ATOM 7 SD MET A 1 -15.142 4.524 12.856 1.00 0.00 S ATOM 8 CE MET A 1 -13.488 5.093 13.212 1.00 0.00 C ATOM 0 H1 MET A 1 -18.363 2.853 10.898 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.156 2.900 9.214 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.124 1.413 10.032 1.00 0.00 H new ATOM 0 HA MET A 1 -16.149 3.574 10.031 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.881 2.547 12.382 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.959 1.156 11.847 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.224 2.320 12.840 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.133 3.066 11.257 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.534 6.079 13.673 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.002 4.396 13.894 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.916 5.152 12.286 1.00 0.00 H new ATOM 17 N GLU A 2 -16.315 1.294 8.217 1.00 0.00 N ATOM 18 CA GLU A 2 -15.716 0.405 7.236 1.00 0.00 C ATOM 19 C GLU A 2 -15.252 1.199 6.013 1.00 0.00 C ATOM 20 O GLU A 2 -15.890 2.177 5.625 1.00 0.00 O ATOM 21 CB GLU A 2 -16.690 -0.704 6.834 1.00 0.00 C ATOM 22 CG GLU A 2 -15.945 -1.898 6.236 1.00 0.00 C ATOM 23 CD GLU A 2 -16.648 -2.410 4.977 1.00 0.00 C ATOM 24 OE1 GLU A 2 -17.113 -1.550 4.198 1.00 0.00 O ATOM 25 OE2 GLU A 2 -16.705 -3.649 4.822 1.00 0.00 O ATOM 0 H GLU A 2 -17.240 1.644 7.967 1.00 0.00 H new ATOM 0 HA GLU A 2 -14.845 -0.069 7.688 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.260 -1.026 7.706 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.407 -0.318 6.109 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -14.923 -1.608 5.993 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -15.883 -2.699 6.973 1.00 0.00 H new ATOM 32 N TRP A 3 -14.146 0.748 5.439 1.00 0.00 N ATOM 33 CA TRP A 3 -13.590 1.404 4.268 1.00 0.00 C ATOM 34 C TRP A 3 -13.613 0.403 3.110 1.00 0.00 C ATOM 35 O TRP A 3 -13.460 -0.799 3.321 1.00 0.00 O ATOM 36 CB TRP A 3 -12.191 1.951 4.558 1.00 0.00 C ATOM 37 CG TRP A 3 -12.075 2.685 5.895 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.593 2.218 7.055 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.471 4.047 6.165 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.648 3.174 8.048 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.199 4.322 7.490 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.039 5.014 5.318 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.463 5.561 8.085 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.297 6.248 5.928 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.029 6.540 7.260 1.00 0.00 C ATOM 0 H TRP A 3 -13.620 -0.064 5.763 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.189 2.271 3.991 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.479 1.125 4.546 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.904 2.631 3.756 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.209 1.218 7.195 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.341 3.060 9.014 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.259 4.821 4.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.242 5.752 9.125 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -13.735 7.027 5.321 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.256 7.518 7.657 1.00 0.00 H new ATOM 56 N GLU A 4 -13.804 0.937 1.913 1.00 0.00 N ATOM 57 CA GLU A 4 -13.849 0.106 0.722 1.00 0.00 C ATOM 58 C GLU A 4 -13.125 0.797 -0.435 1.00 0.00 C ATOM 59 O GLU A 4 -13.174 2.020 -0.561 1.00 0.00 O ATOM 60 CB GLU A 4 -15.292 -0.231 0.342 1.00 0.00 C ATOM 61 CG GLU A 4 -16.135 1.039 0.210 1.00 0.00 C ATOM 62 CD GLU A 4 -16.554 1.564 1.585 1.00 0.00 C ATOM 63 OE1 GLU A 4 -17.534 1.010 2.129 1.00 0.00 O ATOM 64 OE2 GLU A 4 -15.886 2.507 2.060 1.00 0.00 O ATOM 0 H GLU A 4 -13.929 1.935 1.742 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.337 -0.832 0.938 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.305 -0.780 -0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.728 -0.884 1.098 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.566 1.804 -0.318 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -17.021 0.831 -0.389 1.00 0.00 H new ATOM 71 N MET A 5 -12.469 -0.015 -1.250 1.00 0.00 N ATOM 72 CA MET A 5 -11.735 0.503 -2.393 1.00 0.00 C ATOM 73 C MET A 5 -11.745 -0.498 -3.550 1.00 0.00 C ATOM 74 O MET A 5 -11.558 -1.695 -3.342 1.00 0.00 O ATOM 75 CB MET A 5 -10.290 0.794 -1.982 1.00 0.00 C ATOM 76 CG MET A 5 -10.241 1.755 -0.793 1.00 0.00 C ATOM 77 SD MET A 5 -8.669 2.599 -0.754 1.00 0.00 S ATOM 78 CE MET A 5 -8.405 2.683 1.009 1.00 0.00 C ATOM 0 H MET A 5 -12.430 -1.029 -1.142 1.00 0.00 H new ATOM 0 HA MET A 5 -12.219 1.421 -2.727 1.00 0.00 H new ATOM 0 HB2 MET A 5 -9.787 -0.138 -1.722 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.748 1.224 -2.824 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.051 2.481 -0.868 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.391 1.205 0.136 1.00 0.00 H new ATOM 0 HE1 MET A 5 -8.014 3.666 1.272 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.350 2.518 1.527 1.00 0.00 H new ATOM 0 HE3 MET A 5 -7.690 1.916 1.307 1.00 0.00 H new ATOM 88 N GLY A 6 -11.966 0.031 -4.745 1.00 0.00 N ATOM 89 CA GLY A 6 -12.004 -0.801 -5.936 1.00 0.00 C ATOM 90 C GLY A 6 -10.630 -0.858 -6.608 1.00 0.00 C ATOM 91 O GLY A 6 -9.924 0.147 -6.671 1.00 0.00 O ATOM 0 H GLY A 6 -12.120 1.025 -4.914 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.325 -1.808 -5.670 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.740 -0.406 -6.637 1.00 0.00 H new ATOM 95 N LEU A 7 -10.293 -2.045 -7.092 1.00 0.00 N ATOM 96 CA LEU A 7 -9.016 -2.247 -7.756 1.00 0.00 C ATOM 97 C LEU A 7 -9.051 -3.568 -8.526 1.00 0.00 C ATOM 98 O LEU A 7 -10.012 -4.328 -8.420 1.00 0.00 O ATOM 99 CB LEU A 7 -7.868 -2.151 -6.750 1.00 0.00 C ATOM 100 CG LEU A 7 -7.951 -3.090 -5.545 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.555 -3.464 -5.044 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.815 -2.485 -4.437 1.00 0.00 C ATOM 0 H LEU A 7 -10.882 -2.876 -7.038 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.836 -1.457 -8.485 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.934 -2.348 -7.275 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.817 -1.126 -6.384 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.436 -4.013 -5.864 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.643 -4.132 -4.187 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.005 -3.966 -5.840 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.021 -2.561 -4.747 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.857 -3.173 -3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.381 -1.539 -4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.823 -2.312 -4.815 1.00 0.00 H new ATOM 114 N GLN A 8 -7.990 -3.802 -9.285 1.00 0.00 N ATOM 115 CA GLN A 8 -7.886 -5.018 -10.072 1.00 0.00 C ATOM 116 C GLN A 8 -7.559 -6.210 -9.169 1.00 0.00 C ATOM 117 O GLN A 8 -7.115 -6.030 -8.036 1.00 0.00 O ATOM 118 CB GLN A 8 -6.842 -4.867 -11.180 1.00 0.00 C ATOM 119 CG GLN A 8 -7.508 -4.575 -12.526 1.00 0.00 C ATOM 120 CD GLN A 8 -6.535 -3.880 -13.480 1.00 0.00 C ATOM 121 OE1 GLN A 8 -5.608 -4.474 -14.004 1.00 0.00 O ATOM 122 NE2 GLN A 8 -6.798 -2.590 -13.675 1.00 0.00 N ATOM 0 H GLN A 8 -7.195 -3.169 -9.371 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.849 -5.202 -10.548 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.154 -4.060 -10.928 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.250 -5.779 -11.254 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.858 -5.506 -12.972 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.385 -3.946 -12.373 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.591 -2.154 -13.204 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -6.206 -2.037 -14.295 1.00 0.00 H new ATOM 131 N GLU A 9 -7.792 -7.399 -9.705 1.00 0.00 N ATOM 132 CA GLU A 9 -7.527 -8.619 -8.962 1.00 0.00 C ATOM 133 C GLU A 9 -6.023 -8.789 -8.738 1.00 0.00 C ATOM 134 O GLU A 9 -5.589 -9.117 -7.635 1.00 0.00 O ATOM 135 CB GLU A 9 -8.117 -9.836 -9.678 1.00 0.00 C ATOM 136 CG GLU A 9 -7.866 -11.117 -8.879 1.00 0.00 C ATOM 137 CD GLU A 9 -8.768 -12.252 -9.367 1.00 0.00 C ATOM 138 OE1 GLU A 9 -10.000 -12.106 -9.211 1.00 0.00 O ATOM 139 OE2 GLU A 9 -8.205 -13.241 -9.885 1.00 0.00 O ATOM 0 H GLU A 9 -8.161 -7.543 -10.645 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.012 -8.541 -7.989 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.189 -9.695 -9.819 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.674 -9.929 -10.670 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -6.821 -11.411 -8.975 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.049 -10.932 -7.821 1.00 0.00 H new ATOM 146 N GLU A 10 -5.270 -8.559 -9.804 1.00 0.00 N ATOM 147 CA GLU A 10 -3.823 -8.683 -9.738 1.00 0.00 C ATOM 148 C GLU A 10 -3.271 -7.844 -8.584 1.00 0.00 C ATOM 149 O GLU A 10 -2.291 -8.227 -7.947 1.00 0.00 O ATOM 150 CB GLU A 10 -3.178 -8.282 -11.066 1.00 0.00 C ATOM 151 CG GLU A 10 -3.517 -6.835 -11.426 1.00 0.00 C ATOM 152 CD GLU A 10 -2.373 -5.893 -11.048 1.00 0.00 C ATOM 153 OE1 GLU A 10 -1.872 -6.035 -9.911 1.00 0.00 O ATOM 154 OE2 GLU A 10 -2.024 -5.052 -11.904 1.00 0.00 O ATOM 0 H GLU A 10 -5.634 -8.288 -10.717 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.575 -9.728 -9.552 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -2.096 -8.400 -10.999 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.523 -8.948 -11.857 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -3.716 -6.760 -12.495 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.428 -6.532 -10.910 1.00 0.00 H new ATOM 161 N PHE A 11 -3.923 -6.715 -8.350 1.00 0.00 N ATOM 162 CA PHE A 11 -3.509 -5.818 -7.284 1.00 0.00 C ATOM 163 C PHE A 11 -3.914 -6.370 -5.916 1.00 0.00 C ATOM 164 O PHE A 11 -3.260 -6.090 -4.912 1.00 0.00 O ATOM 165 CB PHE A 11 -4.226 -4.487 -7.516 1.00 0.00 C ATOM 166 CG PHE A 11 -3.288 -3.282 -7.607 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.750 -2.752 -6.476 1.00 0.00 C ATOM 168 CD2 PHE A 11 -2.991 -2.741 -8.819 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.879 -1.634 -6.560 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.120 -1.623 -8.904 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.582 -1.093 -7.772 1.00 0.00 C ATOM 0 H PHE A 11 -4.735 -6.400 -8.880 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.425 -5.703 -7.294 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.805 -4.554 -8.437 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.935 -4.322 -6.705 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.985 -3.182 -5.514 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.418 -3.162 -9.717 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.452 -1.213 -5.662 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.885 -1.193 -9.867 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.919 -0.243 -7.836 1.00 0.00 H new ATOM 181 N LEU A 12 -4.989 -7.144 -5.919 1.00 0.00 N ATOM 182 CA LEU A 12 -5.488 -7.738 -4.691 1.00 0.00 C ATOM 183 C LEU A 12 -4.476 -8.763 -4.177 1.00 0.00 C ATOM 184 O LEU A 12 -4.111 -8.746 -3.002 1.00 0.00 O ATOM 185 CB LEU A 12 -6.890 -8.311 -4.904 1.00 0.00 C ATOM 186 CG LEU A 12 -8.024 -7.289 -5.012 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.333 -7.965 -5.423 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.172 -6.495 -3.713 1.00 0.00 C ATOM 0 H LEU A 12 -5.529 -7.374 -6.753 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.594 -6.979 -3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.881 -8.911 -5.814 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.114 -8.987 -4.078 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.769 -6.577 -5.797 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.123 -7.217 -5.493 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.205 -8.448 -6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.606 -8.712 -4.678 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.985 -5.776 -3.817 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.394 -7.178 -2.893 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.243 -5.965 -3.503 1.00 0.00 H new ATOM 200 N GLU A 13 -4.050 -9.632 -5.082 1.00 0.00 N ATOM 201 CA GLU A 13 -3.087 -10.663 -4.735 1.00 0.00 C ATOM 202 C GLU A 13 -1.839 -10.036 -4.110 1.00 0.00 C ATOM 203 O GLU A 13 -1.191 -10.647 -3.262 1.00 0.00 O ATOM 204 CB GLU A 13 -2.722 -11.507 -5.958 1.00 0.00 C ATOM 205 CG GLU A 13 -2.188 -12.878 -5.539 1.00 0.00 C ATOM 206 CD GLU A 13 -3.324 -13.898 -5.429 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.316 -13.570 -4.744 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.173 -14.983 -6.031 1.00 0.00 O ATOM 0 H GLU A 13 -4.354 -9.643 -6.055 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.544 -11.326 -4.000 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.599 -11.633 -6.592 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.971 -10.987 -6.552 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.453 -13.224 -6.266 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.675 -12.795 -4.581 1.00 0.00 H new ATOM 215 N LEU A 14 -1.540 -8.824 -4.554 1.00 0.00 N ATOM 216 CA LEU A 14 -0.382 -8.106 -4.049 1.00 0.00 C ATOM 217 C LEU A 14 -0.538 -7.891 -2.542 1.00 0.00 C ATOM 218 O LEU A 14 0.405 -8.101 -1.781 1.00 0.00 O ATOM 219 CB LEU A 14 -0.167 -6.812 -4.837 1.00 0.00 C ATOM 220 CG LEU A 14 0.180 -6.978 -6.317 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.905 -5.741 -6.852 1.00 0.00 C ATOM 222 CD2 LEU A 14 0.983 -8.259 -6.552 1.00 0.00 C ATOM 0 H LEU A 14 -2.080 -8.321 -5.258 1.00 0.00 H new ATOM 0 HA LEU A 14 0.524 -8.694 -4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.072 -6.210 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.633 -6.247 -4.358 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.750 -7.074 -6.877 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.140 -5.885 -7.906 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.264 -4.867 -6.739 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.828 -5.589 -6.292 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.217 -8.353 -7.613 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.909 -8.218 -5.979 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.396 -9.120 -6.232 1.00 0.00 H new ATOM 234 N ILE A 15 -1.735 -7.474 -2.158 1.00 0.00 N ATOM 235 CA ILE A 15 -2.027 -7.227 -0.756 1.00 0.00 C ATOM 236 C ILE A 15 -1.783 -8.508 0.044 1.00 0.00 C ATOM 237 O ILE A 15 -1.302 -8.457 1.175 1.00 0.00 O ATOM 238 CB ILE A 15 -3.438 -6.660 -0.594 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.403 -5.139 -0.432 1.00 0.00 C ATOM 240 CG2 ILE A 15 -4.174 -7.342 0.561 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.485 -4.441 -1.792 1.00 0.00 C ATOM 0 H ILE A 15 -2.514 -7.301 -2.793 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.356 -6.467 -0.355 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.998 -6.874 -1.504 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.233 -4.817 0.197 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.485 -4.845 0.077 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.175 -6.920 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.248 -8.412 0.364 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.624 -7.181 1.488 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.458 -3.361 -1.649 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.640 -4.746 -2.409 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.415 -4.718 -2.288 1.00 0.00 H new ATOM 253 N LYS A 16 -2.127 -9.629 -0.574 1.00 0.00 N ATOM 254 CA LYS A 16 -1.952 -10.921 0.066 1.00 0.00 C ATOM 255 C LYS A 16 -0.460 -11.182 0.280 1.00 0.00 C ATOM 256 O LYS A 16 -0.075 -11.864 1.228 1.00 0.00 O ATOM 257 CB LYS A 16 -2.659 -12.016 -0.735 1.00 0.00 C ATOM 258 CG LYS A 16 -3.720 -12.719 0.115 1.00 0.00 C ATOM 259 CD LYS A 16 -4.356 -13.880 -0.652 1.00 0.00 C ATOM 260 CE LYS A 16 -5.414 -13.374 -1.634 1.00 0.00 C ATOM 261 NZ LYS A 16 -5.918 -14.485 -2.472 1.00 0.00 N ATOM 0 H LYS A 16 -2.526 -9.668 -1.512 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.421 -10.925 1.050 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.126 -11.581 -1.619 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.928 -12.744 -1.086 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.267 -13.090 1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.490 -12.005 0.405 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.585 -14.429 -1.193 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.811 -14.579 0.050 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.240 -12.921 -1.086 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.988 -12.597 -2.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.954 -14.424 -2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.501 -14.419 -3.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.654 -15.393 -2.040 1.00 0.00 H new ATOM 275 N LEU A 17 0.340 -10.624 -0.617 1.00 0.00 N ATOM 276 CA LEU A 17 1.782 -10.787 -0.539 1.00 0.00 C ATOM 277 C LEU A 17 2.360 -9.732 0.406 1.00 0.00 C ATOM 278 O LEU A 17 3.449 -9.909 0.949 1.00 0.00 O ATOM 279 CB LEU A 17 2.400 -10.765 -1.938 1.00 0.00 C ATOM 280 CG LEU A 17 2.234 -12.042 -2.765 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.577 -11.740 -4.113 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.571 -12.768 -2.928 1.00 0.00 C ATOM 0 H LEU A 17 0.017 -10.058 -1.402 1.00 0.00 H new ATOM 0 HA LEU A 17 2.033 -11.762 -0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.962 -9.936 -2.494 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.465 -10.555 -1.840 1.00 0.00 H new ATOM 0 HG LEU A 17 1.567 -12.714 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.471 -12.664 -4.681 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.593 -11.300 -3.948 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.198 -11.040 -4.672 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.425 -13.672 -3.519 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.281 -12.114 -3.434 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.961 -13.036 -1.946 1.00 0.00 H new ATOM 294 N ARG A 18 1.604 -8.656 0.573 1.00 0.00 N ATOM 295 CA ARG A 18 2.028 -7.572 1.443 1.00 0.00 C ATOM 296 C ARG A 18 1.797 -7.946 2.908 1.00 0.00 C ATOM 297 O ARG A 18 2.077 -7.153 3.806 1.00 0.00 O ATOM 298 CB ARG A 18 1.266 -6.283 1.127 1.00 0.00 C ATOM 299 CG ARG A 18 1.663 -5.734 -0.245 1.00 0.00 C ATOM 300 CD ARG A 18 0.490 -5.006 -0.904 1.00 0.00 C ATOM 301 NE ARG A 18 0.967 -3.768 -1.560 1.00 0.00 N ATOM 302 CZ ARG A 18 0.325 -3.154 -2.564 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.824 -3.660 -3.033 1.00 0.00 N ATOM 304 NH2 ARG A 18 0.832 -2.035 -3.099 1.00 0.00 N ATOM 0 H ARG A 18 0.701 -8.512 0.121 1.00 0.00 H new ATOM 0 HA ARG A 18 3.091 -7.405 1.270 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.193 -6.476 1.149 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.472 -5.537 1.895 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.506 -5.051 -0.137 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.995 -6.551 -0.886 1.00 0.00 H new ATOM 0 HD2 ARG A 18 0.014 -5.656 -1.638 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.265 -4.763 -0.156 1.00 0.00 H new ATOM 0 HE ARG A 18 1.839 -3.356 -1.227 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.210 -4.512 -2.626 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.313 -3.193 -3.797 1.00 0.00 H new ATOM 0 HH21 ARG A 18 1.707 -1.650 -2.742 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.343 -1.568 -3.863 1.00 0.00 H new ATOM 318 N LYS A 19 1.290 -9.154 3.105 1.00 0.00 N ATOM 319 CA LYS A 19 1.019 -9.643 4.446 1.00 0.00 C ATOM 320 C LYS A 19 2.341 -9.981 5.138 1.00 0.00 C ATOM 321 O LYS A 19 2.367 -10.250 6.338 1.00 0.00 O ATOM 322 CB LYS A 19 0.032 -10.811 4.402 1.00 0.00 C ATOM 323 CG LYS A 19 -0.533 -11.105 5.793 1.00 0.00 C ATOM 324 CD LYS A 19 -1.512 -12.280 5.750 1.00 0.00 C ATOM 325 CE LYS A 19 -0.771 -13.604 5.557 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.452 -14.214 6.867 1.00 0.00 N ATOM 0 H LYS A 19 1.060 -9.809 2.358 1.00 0.00 H new ATOM 0 HA LYS A 19 0.535 -8.870 5.042 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.783 -10.577 3.717 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.531 -11.699 4.013 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.282 -11.331 6.480 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.039 -10.220 6.179 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.087 -12.313 6.675 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.224 -12.136 4.937 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -1.383 -14.288 4.970 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.147 -13.435 4.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.051 -15.112 6.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.150 -13.566 7.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.333 -14.393 7.390 1.00 0.00 H new ATOM 340 N LYS A 20 3.407 -9.955 4.352 1.00 0.00 N ATOM 341 CA LYS A 20 4.730 -10.255 4.874 1.00 0.00 C ATOM 342 C LYS A 20 5.712 -9.177 4.411 1.00 0.00 C ATOM 343 O LYS A 20 6.918 -9.298 4.624 1.00 0.00 O ATOM 344 CB LYS A 20 5.148 -11.675 4.488 1.00 0.00 C ATOM 345 CG LYS A 20 6.187 -12.225 5.467 1.00 0.00 C ATOM 346 CD LYS A 20 7.251 -13.045 4.734 1.00 0.00 C ATOM 347 CE LYS A 20 8.197 -13.727 5.725 1.00 0.00 C ATOM 348 NZ LYS A 20 9.500 -14.013 5.084 1.00 0.00 N ATOM 0 H LYS A 20 3.382 -9.731 3.357 1.00 0.00 H new ATOM 0 HA LYS A 20 4.724 -10.234 5.964 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.273 -12.325 4.477 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.558 -11.675 3.478 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.661 -11.401 6.000 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.694 -12.847 6.214 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.769 -13.797 4.109 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.821 -12.396 4.069 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.345 -13.087 6.595 1.00 0.00 H new ATOM 0 HE3 LYS A 20 7.750 -14.654 6.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.130 -14.476 5.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 9.355 -14.642 4.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.932 -13.123 4.763 1.00 0.00 H new ATOM 362 N LYS A 21 5.161 -8.147 3.786 1.00 0.00 N ATOM 363 CA LYS A 21 5.974 -7.049 3.292 1.00 0.00 C ATOM 364 C LYS A 21 5.456 -5.733 3.877 1.00 0.00 C ATOM 365 O LYS A 21 5.578 -5.493 5.077 1.00 0.00 O ATOM 366 CB LYS A 21 6.023 -7.065 1.763 1.00 0.00 C ATOM 367 CG LYS A 21 6.626 -8.373 1.248 1.00 0.00 C ATOM 368 CD LYS A 21 6.124 -8.690 -0.162 1.00 0.00 C ATOM 369 CE LYS A 21 6.799 -9.947 -0.715 1.00 0.00 C ATOM 370 NZ LYS A 21 6.952 -9.850 -2.184 1.00 0.00 N ATOM 0 H LYS A 21 4.161 -8.050 3.610 1.00 0.00 H new ATOM 0 HA LYS A 21 7.007 -7.161 3.622 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.017 -6.941 1.362 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.614 -6.222 1.406 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.713 -8.299 1.243 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.365 -9.188 1.923 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.043 -8.831 -0.144 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.324 -7.845 -0.821 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.776 -10.077 -0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.206 -10.826 -0.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.625 -10.573 -2.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.030 -10.003 -2.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.309 -8.906 -2.434 1.00 0.00 H new ATOM 384 N ILE A 22 4.889 -4.916 3.001 1.00 0.00 N ATOM 385 CA ILE A 22 4.352 -3.631 3.416 1.00 0.00 C ATOM 386 C ILE A 22 3.482 -3.061 2.294 1.00 0.00 C ATOM 387 O ILE A 22 3.467 -3.592 1.185 1.00 0.00 O ATOM 388 CB ILE A 22 5.480 -2.696 3.855 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.468 -2.496 5.372 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.415 -1.366 3.101 1.00 0.00 C ATOM 391 CD1 ILE A 22 4.463 -1.415 5.774 1.00 0.00 C ATOM 0 H ILE A 22 4.790 -5.119 2.006 1.00 0.00 H new ATOM 0 HA ILE A 22 3.710 -3.750 4.289 1.00 0.00 H new ATOM 0 HB ILE A 22 6.430 -3.165 3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.214 -3.435 5.864 1.00 0.00 H new ATOM 0 HG13 ILE A 22 6.465 -2.216 5.714 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.228 -0.720 3.432 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.510 -1.549 2.031 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.460 -0.880 3.302 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.474 -1.292 6.857 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.734 -0.472 5.299 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.464 -1.709 5.452 1.00 0.00 H new ATOM 403 N GLU A 23 2.778 -1.988 2.622 1.00 0.00 N ATOM 404 CA GLU A 23 1.907 -1.340 1.656 1.00 0.00 C ATOM 405 C GLU A 23 1.887 0.172 1.890 1.00 0.00 C ATOM 406 O GLU A 23 1.170 0.660 2.762 1.00 0.00 O ATOM 407 CB GLU A 23 0.494 -1.922 1.715 1.00 0.00 C ATOM 408 CG GLU A 23 -0.400 -1.302 0.639 1.00 0.00 C ATOM 409 CD GLU A 23 -1.878 -1.429 1.014 1.00 0.00 C ATOM 410 OE1 GLU A 23 -2.363 -0.523 1.726 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.490 -2.429 0.580 1.00 0.00 O ATOM 0 H GLU A 23 2.793 -1.551 3.543 1.00 0.00 H new ATOM 0 HA GLU A 23 2.301 -1.529 0.657 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.536 -3.003 1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.063 -1.741 2.700 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.143 -0.251 0.509 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.220 -1.794 -0.317 1.00 0.00 H new ATOM 418 N GLY A 24 2.684 0.872 1.095 1.00 0.00 N ATOM 419 CA GLY A 24 2.767 2.319 1.204 1.00 0.00 C ATOM 420 C GLY A 24 1.858 2.999 0.178 1.00 0.00 C ATOM 421 O GLY A 24 1.165 2.327 -0.584 1.00 0.00 O ATOM 0 H GLY A 24 3.278 0.464 0.373 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.482 2.629 2.209 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.797 2.640 1.052 1.00 0.00 H new ATOM 425 N ARG A 25 1.891 4.323 0.193 1.00 0.00 N ATOM 426 CA ARG A 25 1.079 5.102 -0.727 1.00 0.00 C ATOM 427 C ARG A 25 0.929 6.537 -0.218 1.00 0.00 C ATOM 428 O ARG A 25 0.567 6.756 0.937 1.00 0.00 O ATOM 429 CB ARG A 25 -0.309 4.481 -0.897 1.00 0.00 C ATOM 430 CG ARG A 25 -1.300 5.501 -1.463 1.00 0.00 C ATOM 431 CD ARG A 25 -2.329 4.820 -2.369 1.00 0.00 C ATOM 432 NE ARG A 25 -3.580 4.575 -1.617 1.00 0.00 N ATOM 433 CZ ARG A 25 -3.783 3.516 -0.822 1.00 0.00 C ATOM 434 NH1 ARG A 25 -2.819 2.598 -0.669 1.00 0.00 N ATOM 435 NH2 ARG A 25 -4.950 3.374 -0.179 1.00 0.00 N ATOM 0 H ARG A 25 2.467 4.876 0.827 1.00 0.00 H new ATOM 0 HA ARG A 25 1.584 5.106 -1.693 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.247 3.620 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.668 4.115 0.065 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -1.810 6.010 -0.645 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.761 6.263 -2.027 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.533 5.447 -3.237 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -1.929 3.878 -2.743 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.335 5.255 -1.710 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -1.930 2.705 -1.158 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.974 1.792 -0.064 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -5.684 4.072 -0.295 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.104 2.567 0.426 1.00 0.00 H new ATOM 449 N LEU A 26 1.215 7.479 -1.106 1.00 0.00 N ATOM 450 CA LEU A 26 1.117 8.887 -0.761 1.00 0.00 C ATOM 451 C LEU A 26 -0.089 9.100 0.155 1.00 0.00 C ATOM 452 O LEU A 26 -1.210 8.731 -0.192 1.00 0.00 O ATOM 453 CB LEU A 26 1.088 9.747 -2.026 1.00 0.00 C ATOM 454 CG LEU A 26 0.321 11.067 -1.922 1.00 0.00 C ATOM 455 CD1 LEU A 26 1.095 12.087 -1.084 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.026 11.610 -3.310 1.00 0.00 C ATOM 0 H LEU A 26 1.514 7.294 -2.063 1.00 0.00 H new ATOM 0 HA LEU A 26 1.999 9.206 -0.206 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.116 9.968 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.650 9.158 -2.832 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.620 10.876 -1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.528 13.016 -1.026 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.248 11.692 -0.080 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.062 12.281 -1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.571 12.549 -3.208 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.891 11.782 -3.873 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.646 10.886 -3.839 1.00 0.00 H new ATOM 468 N TYR A 27 0.181 9.695 1.308 1.00 0.00 N ATOM 469 CA TYR A 27 -0.868 9.962 2.277 1.00 0.00 C ATOM 470 C TYR A 27 -1.918 10.913 1.700 1.00 0.00 C ATOM 471 O TYR A 27 -1.740 11.451 0.608 1.00 0.00 O ATOM 472 CB TYR A 27 -0.183 10.638 3.466 1.00 0.00 C ATOM 473 CG TYR A 27 -0.855 10.361 4.812 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.333 9.098 5.098 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.984 11.374 5.740 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.966 8.838 6.365 1.00 0.00 C ATOM 477 CE2 TYR A 27 -1.617 11.114 7.007 1.00 0.00 C ATOM 478 CZ TYR A 27 -2.077 9.858 7.257 1.00 0.00 C ATOM 479 OH TYR A 27 -2.675 9.612 8.453 1.00 0.00 O ATOM 0 H TYR A 27 1.112 10.000 1.593 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.375 9.039 2.557 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.853 10.303 3.513 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -0.163 11.715 3.296 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.232 8.305 4.372 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -0.610 12.362 5.516 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.344 7.854 6.601 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.724 11.898 7.742 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.543 10.379 9.049 1.00 0.00 H new ATOM 489 N ASP A 28 -2.989 11.092 2.459 1.00 0.00 N ATOM 490 CA ASP A 28 -4.068 11.970 2.037 1.00 0.00 C ATOM 491 C ASP A 28 -5.144 12.008 3.123 1.00 0.00 C ATOM 492 O ASP A 28 -4.978 11.412 4.187 1.00 0.00 O ATOM 493 CB ASP A 28 -4.716 11.465 0.746 1.00 0.00 C ATOM 494 CG ASP A 28 -4.042 11.936 -0.544 1.00 0.00 C ATOM 495 OD1 ASP A 28 -4.010 13.169 -0.749 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.575 11.054 -1.296 1.00 0.00 O ATOM 0 H ASP A 28 -3.133 10.644 3.364 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.648 12.961 1.866 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -4.717 10.375 0.760 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.758 11.785 0.731 1.00 0.00 H new ATOM 501 N GLU A 29 -6.223 12.713 2.818 1.00 0.00 N ATOM 502 CA GLU A 29 -7.326 12.836 3.756 1.00 0.00 C ATOM 503 C GLU A 29 -8.000 11.478 3.964 1.00 0.00 C ATOM 504 O GLU A 29 -8.207 11.051 5.098 1.00 0.00 O ATOM 505 CB GLU A 29 -8.336 13.883 3.280 1.00 0.00 C ATOM 506 CG GLU A 29 -7.641 15.205 2.949 1.00 0.00 C ATOM 507 CD GLU A 29 -8.653 16.348 2.857 1.00 0.00 C ATOM 508 OE1 GLU A 29 -9.697 16.239 3.536 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.360 17.306 2.109 1.00 0.00 O ATOM 0 H GLU A 29 -6.357 13.205 1.935 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.928 13.172 4.713 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.860 13.513 2.399 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.087 14.047 4.053 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.899 15.432 3.715 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.105 15.112 2.004 1.00 0.00 H new ATOM 516 N LYS A 30 -8.324 10.838 2.850 1.00 0.00 N ATOM 517 CA LYS A 30 -8.970 9.537 2.895 1.00 0.00 C ATOM 518 C LYS A 30 -7.996 8.508 3.473 1.00 0.00 C ATOM 519 O LYS A 30 -8.395 7.633 4.240 1.00 0.00 O ATOM 520 CB LYS A 30 -9.515 9.161 1.516 1.00 0.00 C ATOM 521 CG LYS A 30 -11.030 9.367 1.451 1.00 0.00 C ATOM 522 CD LYS A 30 -11.679 8.364 0.494 1.00 0.00 C ATOM 523 CE LYS A 30 -12.569 9.077 -0.526 1.00 0.00 C ATOM 524 NZ LYS A 30 -13.465 8.109 -1.197 1.00 0.00 N ATOM 0 H LYS A 30 -8.151 11.196 1.911 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.835 9.564 3.557 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -9.029 9.767 0.751 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.276 8.120 1.298 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.459 9.255 2.447 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -11.249 10.383 1.122 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.905 7.798 -0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.272 7.646 1.061 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -13.161 9.845 -0.027 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.950 9.583 -1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.062 8.609 -1.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.895 7.392 -1.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.068 7.645 -0.488 1.00 0.00 H new ATOM 538 N ARG A 31 -6.738 8.648 3.083 1.00 0.00 N ATOM 539 CA ARG A 31 -5.704 7.742 3.552 1.00 0.00 C ATOM 540 C ARG A 31 -5.514 7.891 5.063 1.00 0.00 C ATOM 541 O ARG A 31 -5.568 6.906 5.799 1.00 0.00 O ATOM 542 CB ARG A 31 -4.373 8.013 2.849 1.00 0.00 C ATOM 543 CG ARG A 31 -4.158 7.040 1.687 1.00 0.00 C ATOM 544 CD ARG A 31 -3.150 5.953 2.061 1.00 0.00 C ATOM 545 NE ARG A 31 -3.862 4.727 2.487 1.00 0.00 N ATOM 546 CZ ARG A 31 -4.233 4.474 3.750 1.00 0.00 C ATOM 547 NH1 ARG A 31 -3.961 5.359 4.718 1.00 0.00 N ATOM 548 NH2 ARG A 31 -4.875 3.335 4.044 1.00 0.00 N ATOM 0 H ARG A 31 -6.411 9.376 2.447 1.00 0.00 H new ATOM 0 HA ARG A 31 -6.024 6.726 3.320 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.356 9.038 2.478 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.555 7.919 3.563 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.108 6.581 1.412 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.802 7.585 0.813 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.507 5.733 1.209 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.504 6.306 2.865 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.084 4.031 1.775 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.472 6.225 4.494 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -4.243 5.166 5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.081 2.661 3.307 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.157 3.142 5.005 1.00 0.00 H new ATOM 562 N ARG A 32 -5.294 9.129 5.481 1.00 0.00 N ATOM 563 CA ARG A 32 -5.095 9.419 6.891 1.00 0.00 C ATOM 564 C ARG A 32 -6.362 9.089 7.684 1.00 0.00 C ATOM 565 O ARG A 32 -6.322 8.988 8.909 1.00 0.00 O ATOM 566 CB ARG A 32 -4.736 10.891 7.105 1.00 0.00 C ATOM 567 CG ARG A 32 -5.964 11.786 6.928 1.00 0.00 C ATOM 568 CD ARG A 32 -5.641 13.237 7.288 1.00 0.00 C ATOM 569 NE ARG A 32 -4.666 13.793 6.323 1.00 0.00 N ATOM 570 CZ ARG A 32 -4.213 15.054 6.354 1.00 0.00 C ATOM 571 NH1 ARG A 32 -4.644 15.897 7.302 1.00 0.00 N ATOM 572 NH2 ARG A 32 -3.330 15.471 5.437 1.00 0.00 N ATOM 0 H ARG A 32 -5.249 9.943 4.868 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.270 8.801 7.244 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -4.324 11.027 8.105 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.961 11.187 6.398 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -6.312 11.732 5.896 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -6.776 11.424 7.558 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.553 13.834 7.281 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.235 13.288 8.298 1.00 0.00 H new ATOM 0 HE ARG A 32 -4.317 13.178 5.588 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.317 15.579 8.000 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -4.299 16.857 7.326 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.003 14.829 4.715 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -2.985 16.431 5.460 1.00 0.00 H new ATOM 586 N GLN A 33 -7.455 8.932 6.953 1.00 0.00 N ATOM 587 CA GLN A 33 -8.731 8.616 7.573 1.00 0.00 C ATOM 588 C GLN A 33 -8.687 7.220 8.197 1.00 0.00 C ATOM 589 O GLN A 33 -9.171 7.017 9.309 1.00 0.00 O ATOM 590 CB GLN A 33 -9.874 8.729 6.563 1.00 0.00 C ATOM 591 CG GLN A 33 -11.162 9.197 7.243 1.00 0.00 C ATOM 592 CD GLN A 33 -10.949 10.529 7.964 1.00 0.00 C ATOM 593 OE1 GLN A 33 -10.702 10.406 9.265 1.00 0.00 O flip ATOM 594 NE2 GLN A 33 -11.004 11.598 7.379 1.00 0.00 N flip ATOM 0 H GLN A 33 -7.484 9.018 5.937 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.917 9.341 8.365 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.599 9.430 5.775 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.040 7.763 6.087 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.952 9.304 6.499 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -11.496 8.443 7.956 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -11.198 11.622 6.378 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.856 12.468 7.891 1.00 0.00 H new ATOM 603 N ILE A 34 -8.101 6.292 7.453 1.00 0.00 N ATOM 604 CA ILE A 34 -7.987 4.921 7.920 1.00 0.00 C ATOM 605 C ILE A 34 -6.893 4.839 8.986 1.00 0.00 C ATOM 606 O ILE A 34 -5.752 5.227 8.741 1.00 0.00 O ATOM 607 CB ILE A 34 -7.770 3.970 6.741 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.794 4.227 5.633 1.00 0.00 C ATOM 609 CG2 ILE A 34 -7.778 2.512 7.204 1.00 0.00 C ATOM 610 CD1 ILE A 34 -8.232 3.833 4.266 1.00 0.00 C ATOM 0 H ILE A 34 -7.701 6.463 6.531 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.916 4.600 8.391 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.784 4.168 6.319 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.703 3.660 5.834 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -9.071 5.281 5.626 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.622 1.857 6.347 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.980 2.356 7.930 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.738 2.282 7.666 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.979 4.025 3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.337 4.419 4.058 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.979 2.773 4.269 1.00 0.00 H new ATOM 622 N LYS A 35 -7.280 4.330 10.147 1.00 0.00 N ATOM 623 CA LYS A 35 -6.346 4.192 11.252 1.00 0.00 C ATOM 624 C LYS A 35 -6.150 2.708 11.566 1.00 0.00 C ATOM 625 O LYS A 35 -6.832 1.854 10.999 1.00 0.00 O ATOM 626 CB LYS A 35 -6.810 5.019 12.452 1.00 0.00 C ATOM 627 CG LYS A 35 -7.607 4.158 13.435 1.00 0.00 C ATOM 628 CD LYS A 35 -7.758 4.864 14.784 1.00 0.00 C ATOM 629 CE LYS A 35 -8.781 5.999 14.697 1.00 0.00 C ATOM 630 NZ LYS A 35 -8.399 7.111 15.596 1.00 0.00 N ATOM 0 H LYS A 35 -8.227 4.008 10.346 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.370 4.591 10.978 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.946 5.450 12.958 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.426 5.851 12.109 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.592 3.944 13.020 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.105 3.201 13.576 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -8.070 4.145 15.542 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.794 5.262 15.100 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.847 6.360 13.670 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -9.769 5.627 14.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -9.104 7.873 15.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -8.359 6.767 16.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.465 7.476 15.319 1.00 0.00 H new ATOM 644 N PRO A 36 -5.191 2.437 12.492 1.00 0.00 N ATOM 645 CA PRO A 36 -4.898 1.071 12.888 1.00 0.00 C ATOM 646 C PRO A 36 -5.989 0.520 13.807 1.00 0.00 C ATOM 647 O PRO A 36 -5.811 0.460 15.023 1.00 0.00 O ATOM 648 CB PRO A 36 -3.535 1.140 13.559 1.00 0.00 C ATOM 649 CG PRO A 36 -3.326 2.600 13.928 1.00 0.00 C ATOM 650 CD PRO A 36 -4.365 3.422 13.183 1.00 0.00 C ATOM 0 HA PRO A 36 -4.877 0.383 12.042 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.503 0.505 14.444 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.751 0.791 12.887 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.428 2.740 15.004 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.320 2.922 13.659 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.959 4.025 13.869 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.896 4.109 12.479 1.00 0.00 H new ATOM 658 N GLY A 37 -7.096 0.130 13.191 1.00 0.00 N ATOM 659 CA GLY A 37 -8.217 -0.414 13.939 1.00 0.00 C ATOM 660 C GLY A 37 -9.488 -0.430 13.087 1.00 0.00 C ATOM 661 O GLY A 37 -10.535 0.049 13.519 1.00 0.00 O ATOM 0 H GLY A 37 -7.240 0.180 12.183 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.982 -1.426 14.268 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.384 0.182 14.836 1.00 0.00 H new ATOM 665 N ASP A 38 -9.354 -0.987 11.893 1.00 0.00 N ATOM 666 CA ASP A 38 -10.479 -1.073 10.977 1.00 0.00 C ATOM 667 C ASP A 38 -10.157 -2.082 9.873 1.00 0.00 C ATOM 668 O ASP A 38 -9.169 -2.810 9.962 1.00 0.00 O ATOM 669 CB ASP A 38 -10.754 0.279 10.315 1.00 0.00 C ATOM 670 CG ASP A 38 -12.130 0.877 10.614 1.00 0.00 C ATOM 671 OD1 ASP A 38 -12.949 0.146 11.213 1.00 0.00 O ATOM 672 OD2 ASP A 38 -12.333 2.051 10.237 1.00 0.00 O ATOM 0 H ASP A 38 -8.484 -1.383 11.538 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.355 -1.381 11.547 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.989 0.986 10.636 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.650 0.166 9.236 1.00 0.00 H new ATOM 677 N VAL A 39 -11.009 -2.093 8.858 1.00 0.00 N ATOM 678 CA VAL A 39 -10.827 -3.002 7.739 1.00 0.00 C ATOM 679 C VAL A 39 -11.148 -2.268 6.435 1.00 0.00 C ATOM 680 O VAL A 39 -11.973 -1.356 6.419 1.00 0.00 O ATOM 681 CB VAL A 39 -11.675 -4.259 7.942 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.420 -5.278 6.830 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.421 -4.875 9.319 1.00 0.00 C ATOM 0 H VAL A 39 -11.827 -1.487 8.787 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.790 -3.333 7.680 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.724 -3.967 7.894 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.035 -6.162 6.998 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.675 -4.837 5.867 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.368 -5.563 6.832 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.036 -5.767 9.438 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.369 -5.145 9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.677 -4.152 10.094 1.00 0.00 H new ATOM 693 N ILE A 40 -10.479 -2.693 5.374 1.00 0.00 N ATOM 694 CA ILE A 40 -10.683 -2.088 4.069 1.00 0.00 C ATOM 695 C ILE A 40 -11.025 -3.180 3.053 1.00 0.00 C ATOM 696 O ILE A 40 -10.132 -3.832 2.513 1.00 0.00 O ATOM 697 CB ILE A 40 -9.471 -1.240 3.676 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.859 -0.559 4.902 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.838 -0.233 2.584 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.523 -1.204 5.276 1.00 0.00 C ATOM 0 H ILE A 40 -9.795 -3.449 5.391 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.529 -1.401 4.096 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.710 -1.901 3.261 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.711 0.501 4.698 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.549 -0.628 5.743 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.959 0.357 2.323 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.192 -0.766 1.702 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.624 0.429 2.948 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.109 -0.702 6.150 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.679 -2.259 5.503 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.828 -1.112 4.441 1.00 0.00 H new ATOM 712 N SER A 41 -12.319 -3.346 2.823 1.00 0.00 N ATOM 713 CA SER A 41 -12.789 -4.348 1.881 1.00 0.00 C ATOM 714 C SER A 41 -12.578 -3.858 0.447 1.00 0.00 C ATOM 715 O SER A 41 -13.043 -2.780 0.081 1.00 0.00 O ATOM 716 CB SER A 41 -14.265 -4.676 2.118 1.00 0.00 C ATOM 717 OG SER A 41 -15.122 -3.627 1.678 1.00 0.00 O ATOM 0 H SER A 41 -13.057 -2.804 3.272 1.00 0.00 H new ATOM 0 HA SER A 41 -12.212 -5.260 2.035 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.520 -5.597 1.594 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.430 -4.858 3.180 1.00 0.00 H new ATOM 0 HG SER A 41 -14.623 -3.022 1.090 1.00 0.00 H new ATOM 723 N PHE A 42 -11.875 -4.674 -0.325 1.00 0.00 N ATOM 724 CA PHE A 42 -11.596 -4.338 -1.711 1.00 0.00 C ATOM 725 C PHE A 42 -12.537 -5.087 -2.657 1.00 0.00 C ATOM 726 O PHE A 42 -12.991 -6.186 -2.344 1.00 0.00 O ATOM 727 CB PHE A 42 -10.156 -4.769 -1.995 1.00 0.00 C ATOM 728 CG PHE A 42 -9.101 -3.927 -1.274 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.266 -2.582 -1.159 1.00 0.00 C ATOM 730 CD2 PHE A 42 -7.998 -4.525 -0.749 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.287 -1.801 -0.491 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.018 -3.744 -0.080 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.183 -2.399 0.035 1.00 0.00 C ATOM 0 H PHE A 42 -11.490 -5.567 -0.017 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.739 -3.269 -1.871 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.035 -5.812 -1.703 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.977 -4.716 -3.069 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.142 -2.108 -1.576 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.867 -5.593 -0.841 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.418 -0.733 -0.400 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.142 -4.218 0.337 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.438 -1.805 0.544 1.00 0.00 H new ATOM 743 N GLU A 43 -12.801 -4.462 -3.795 1.00 0.00 N ATOM 744 CA GLU A 43 -13.679 -5.056 -4.788 1.00 0.00 C ATOM 745 C GLU A 43 -14.932 -5.623 -4.118 1.00 0.00 C ATOM 746 O GLU A 43 -15.325 -6.757 -4.388 1.00 0.00 O ATOM 747 CB GLU A 43 -12.949 -6.136 -5.590 1.00 0.00 C ATOM 748 CG GLU A 43 -11.858 -5.522 -6.470 1.00 0.00 C ATOM 749 CD GLU A 43 -12.467 -4.807 -7.678 1.00 0.00 C ATOM 750 OE1 GLU A 43 -12.683 -5.498 -8.697 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.703 -3.586 -7.555 1.00 0.00 O ATOM 0 H GLU A 43 -12.422 -3.550 -4.051 1.00 0.00 H new ATOM 0 HA GLU A 43 -13.985 -4.277 -5.486 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.506 -6.863 -4.909 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.662 -6.676 -6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.268 -4.817 -5.885 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.177 -6.303 -6.810 1.00 0.00 H new ATOM 758 N GLY A 44 -15.524 -4.809 -3.257 1.00 0.00 N ATOM 759 CA GLY A 44 -16.724 -5.215 -2.547 1.00 0.00 C ATOM 760 C GLY A 44 -16.376 -6.068 -1.325 1.00 0.00 C ATOM 761 O GLY A 44 -16.672 -5.688 -0.193 1.00 0.00 O ATOM 0 H GLY A 44 -15.195 -3.870 -3.035 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.281 -4.332 -2.232 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.373 -5.780 -3.216 1.00 0.00 H new ATOM 765 N GLY A 45 -15.752 -7.205 -1.596 1.00 0.00 N ATOM 766 CA GLY A 45 -15.360 -8.115 -0.533 1.00 0.00 C ATOM 767 C GLY A 45 -14.471 -9.238 -1.073 1.00 0.00 C ATOM 768 O GLY A 45 -14.442 -10.334 -0.515 1.00 0.00 O ATOM 0 H GLY A 45 -15.508 -7.517 -2.536 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.827 -7.566 0.243 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.249 -8.542 -0.068 1.00 0.00 H new ATOM 772 N LYS A 46 -13.768 -8.926 -2.151 1.00 0.00 N ATOM 773 CA LYS A 46 -12.881 -9.895 -2.773 1.00 0.00 C ATOM 774 C LYS A 46 -11.598 -10.008 -1.946 1.00 0.00 C ATOM 775 O LYS A 46 -11.071 -11.104 -1.759 1.00 0.00 O ATOM 776 CB LYS A 46 -12.638 -9.536 -4.240 1.00 0.00 C ATOM 777 CG LYS A 46 -12.380 -10.790 -5.076 1.00 0.00 C ATOM 778 CD LYS A 46 -10.932 -11.261 -4.926 1.00 0.00 C ATOM 779 CE LYS A 46 -10.392 -11.807 -6.249 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.428 -13.286 -6.253 1.00 0.00 N ATOM 0 H LYS A 46 -13.794 -8.016 -2.610 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.343 -10.882 -2.784 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.502 -9.003 -4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.785 -8.862 -4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -13.059 -11.584 -4.765 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.592 -10.582 -6.125 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.309 -10.432 -4.590 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.875 -12.034 -4.159 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -10.985 -11.421 -7.078 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.369 -11.462 -6.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.058 -13.640 -7.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -9.843 -13.650 -5.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.409 -13.610 -6.130 1.00 0.00 H new ATOM 794 N LEU A 47 -11.133 -8.861 -1.475 1.00 0.00 N ATOM 795 CA LEU A 47 -9.921 -8.817 -0.674 1.00 0.00 C ATOM 796 C LEU A 47 -10.144 -7.899 0.530 1.00 0.00 C ATOM 797 O LEU A 47 -10.410 -6.709 0.367 1.00 0.00 O ATOM 798 CB LEU A 47 -8.722 -8.420 -1.536 1.00 0.00 C ATOM 799 CG LEU A 47 -7.406 -9.137 -1.227 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.973 -8.888 0.219 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.508 -10.630 -1.546 1.00 0.00 C ATOM 0 H LEU A 47 -11.573 -7.955 -1.632 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.688 -9.807 -0.282 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.975 -8.602 -2.581 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.562 -7.347 -1.429 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.631 -8.722 -1.871 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.035 -9.409 0.413 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.834 -7.819 0.378 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.741 -9.259 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.560 -11.116 -1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.299 -11.077 -0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.738 -10.761 -2.603 1.00 0.00 H new ATOM 813 N LYS A 48 -10.027 -8.487 1.712 1.00 0.00 N ATOM 814 CA LYS A 48 -10.213 -7.737 2.942 1.00 0.00 C ATOM 815 C LYS A 48 -8.854 -7.519 3.611 1.00 0.00 C ATOM 816 O LYS A 48 -8.003 -8.407 3.600 1.00 0.00 O ATOM 817 CB LYS A 48 -11.237 -8.430 3.843 1.00 0.00 C ATOM 818 CG LYS A 48 -12.471 -8.854 3.044 1.00 0.00 C ATOM 819 CD LYS A 48 -13.463 -7.697 2.911 1.00 0.00 C ATOM 820 CE LYS A 48 -14.851 -8.103 3.411 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.371 -9.244 2.625 1.00 0.00 N ATOM 0 H LYS A 48 -9.806 -9.474 1.843 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.626 -6.751 2.728 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.783 -9.304 4.310 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.534 -7.757 4.647 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.168 -9.194 2.054 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.955 -9.698 3.536 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.105 -6.839 3.480 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.525 -7.385 1.868 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.799 -8.374 4.466 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.534 -7.258 3.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.348 -9.045 2.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.776 -9.386 1.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.356 -10.104 3.210 1.00 0.00 H new ATOM 835 N VAL A 49 -8.693 -6.332 4.178 1.00 0.00 N ATOM 836 CA VAL A 49 -7.452 -5.986 4.851 1.00 0.00 C ATOM 837 C VAL A 49 -7.767 -5.161 6.100 1.00 0.00 C ATOM 838 O VAL A 49 -8.813 -4.518 6.176 1.00 0.00 O ATOM 839 CB VAL A 49 -6.514 -5.267 3.880 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.102 -6.189 2.731 1.00 0.00 C ATOM 841 CG2 VAL A 49 -7.154 -3.982 3.349 1.00 0.00 C ATOM 0 H VAL A 49 -9.401 -5.598 4.185 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.931 -6.886 5.179 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.613 -4.991 4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.435 -5.653 2.055 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.587 -7.062 3.132 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.990 -6.510 2.186 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.466 -3.490 2.661 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.079 -4.225 2.826 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.374 -3.314 4.182 1.00 0.00 H new ATOM 851 N ARG A 50 -6.843 -5.206 7.048 1.00 0.00 N ATOM 852 CA ARG A 50 -7.009 -4.471 8.291 1.00 0.00 C ATOM 853 C ARG A 50 -5.722 -3.721 8.639 1.00 0.00 C ATOM 854 O ARG A 50 -4.666 -4.332 8.794 1.00 0.00 O ATOM 855 CB ARG A 50 -7.372 -5.410 9.442 1.00 0.00 C ATOM 856 CG ARG A 50 -7.148 -4.731 10.795 1.00 0.00 C ATOM 857 CD ARG A 50 -8.320 -4.995 11.742 1.00 0.00 C ATOM 858 NE ARG A 50 -7.833 -5.640 12.983 1.00 0.00 N ATOM 859 CZ ARG A 50 -7.768 -6.966 13.165 1.00 0.00 C ATOM 860 NH1 ARG A 50 -8.158 -7.796 12.188 1.00 0.00 N ATOM 861 NH2 ARG A 50 -7.312 -7.461 14.323 1.00 0.00 N ATOM 0 H ARG A 50 -5.977 -5.740 6.981 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.822 -3.759 8.149 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.415 -5.715 9.352 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.769 -6.316 9.381 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.225 -5.099 11.242 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.027 -3.657 10.651 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.822 -4.058 11.982 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -9.055 -5.635 11.254 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.528 -5.037 13.747 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.504 -7.418 11.306 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.109 -8.805 12.326 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.014 -6.829 15.066 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.262 -8.470 14.462 1.00 0.00 H new ATOM 875 N VAL A 51 -5.853 -2.407 8.753 1.00 0.00 N ATOM 876 CA VAL A 51 -4.713 -1.568 9.081 1.00 0.00 C ATOM 877 C VAL A 51 -4.066 -2.074 10.372 1.00 0.00 C ATOM 878 O VAL A 51 -4.762 -2.494 11.295 1.00 0.00 O ATOM 879 CB VAL A 51 -5.149 -0.103 9.165 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.983 0.792 9.589 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.748 0.368 7.838 1.00 0.00 C ATOM 0 H VAL A 51 -6.731 -1.903 8.624 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.959 -1.625 8.296 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.924 -0.027 9.928 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.319 1.827 9.641 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.621 0.478 10.568 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.177 0.709 8.860 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.049 1.412 7.925 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.004 0.270 7.048 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.618 -0.242 7.595 1.00 0.00 H new ATOM 891 N LYS A 52 -2.743 -2.018 10.394 1.00 0.00 N ATOM 892 CA LYS A 52 -1.995 -2.466 11.557 1.00 0.00 C ATOM 893 C LYS A 52 -1.347 -1.258 12.237 1.00 0.00 C ATOM 894 O LYS A 52 -1.340 -1.162 13.463 1.00 0.00 O ATOM 895 CB LYS A 52 -0.998 -3.558 11.164 1.00 0.00 C ATOM 896 CG LYS A 52 -1.183 -4.806 12.028 1.00 0.00 C ATOM 897 CD LYS A 52 0.121 -5.184 12.734 1.00 0.00 C ATOM 898 CE LYS A 52 0.040 -4.882 14.232 1.00 0.00 C ATOM 899 NZ LYS A 52 -1.083 -5.621 14.850 1.00 0.00 N ATOM 0 H LYS A 52 -2.169 -1.670 9.626 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.663 -2.923 12.287 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.131 -3.816 10.113 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.020 -3.183 11.274 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.963 -4.627 12.768 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.518 -5.636 11.406 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.326 -6.244 12.583 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.951 -4.633 12.292 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.976 -5.160 14.716 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.093 -3.811 14.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.869 -5.804 15.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.952 -5.054 14.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.219 -6.525 14.354 1.00 0.00 H new ATOM 913 N ALA A 53 -0.819 -0.366 11.412 1.00 0.00 N ATOM 914 CA ALA A 53 -0.171 0.831 11.919 1.00 0.00 C ATOM 915 C ALA A 53 0.077 1.801 10.762 1.00 0.00 C ATOM 916 O ALA A 53 0.093 1.396 9.600 1.00 0.00 O ATOM 917 CB ALA A 53 1.121 0.445 12.642 1.00 0.00 C ATOM 0 H ALA A 53 -0.827 -0.449 10.395 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.811 1.336 12.642 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.607 1.343 13.022 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.888 -0.221 13.473 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.789 -0.063 11.947 1.00 0.00 H new ATOM 923 N ILE A 54 0.263 3.063 11.119 1.00 0.00 N ATOM 924 CA ILE A 54 0.508 4.094 10.124 1.00 0.00 C ATOM 925 C ILE A 54 1.922 4.649 10.310 1.00 0.00 C ATOM 926 O ILE A 54 2.427 4.710 11.430 1.00 0.00 O ATOM 927 CB ILE A 54 -0.584 5.163 10.180 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.892 5.706 8.783 1.00 0.00 C ATOM 929 CG2 ILE A 54 -0.211 6.278 11.159 1.00 0.00 C ATOM 930 CD1 ILE A 54 -2.072 4.963 8.153 1.00 0.00 C ATOM 0 H ILE A 54 0.249 3.395 12.083 1.00 0.00 H new ATOM 0 HA ILE A 54 0.459 3.674 9.119 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.497 4.699 10.554 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -1.119 6.770 8.845 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.012 5.604 8.147 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.005 7.025 11.179 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.082 5.858 12.157 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.720 6.746 10.839 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.270 5.369 7.161 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.832 3.903 8.070 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.956 5.087 8.778 1.00 0.00 H new ATOM 942 N ARG A 55 2.521 5.040 9.195 1.00 0.00 N ATOM 943 CA ARG A 55 3.866 5.588 9.221 1.00 0.00 C ATOM 944 C ARG A 55 4.053 6.592 8.082 1.00 0.00 C ATOM 945 O ARG A 55 3.402 6.485 7.043 1.00 0.00 O ATOM 946 CB ARG A 55 4.915 4.481 9.092 1.00 0.00 C ATOM 947 CG ARG A 55 5.453 4.073 10.465 1.00 0.00 C ATOM 948 CD ARG A 55 6.787 4.763 10.758 1.00 0.00 C ATOM 949 NE ARG A 55 7.652 3.872 11.563 1.00 0.00 N ATOM 950 CZ ARG A 55 7.392 3.513 12.827 1.00 0.00 C ATOM 951 NH1 ARG A 55 6.290 3.968 13.440 1.00 0.00 N ATOM 952 NH2 ARG A 55 8.233 2.700 13.480 1.00 0.00 N ATOM 0 H ARG A 55 2.099 4.988 8.268 1.00 0.00 H new ATOM 0 HA ARG A 55 4.000 6.091 10.179 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.476 3.615 8.597 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.736 4.825 8.463 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.728 4.333 11.236 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.583 2.991 10.502 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.286 5.020 9.824 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.613 5.696 11.294 1.00 0.00 H new ATOM 0 HE ARG A 55 8.500 3.508 11.128 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.649 4.588 12.944 1.00 0.00 H new ATOM 0 HH12 ARG A 55 6.092 3.695 14.403 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.072 2.354 13.015 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.034 2.427 14.443 1.00 0.00 H new ATOM 966 N VAL A 56 4.943 7.545 8.315 1.00 0.00 N ATOM 967 CA VAL A 56 5.223 8.567 7.321 1.00 0.00 C ATOM 968 C VAL A 56 6.735 8.664 7.106 1.00 0.00 C ATOM 969 O VAL A 56 7.508 8.568 8.059 1.00 0.00 O ATOM 970 CB VAL A 56 4.593 9.896 7.745 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.486 10.855 6.558 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.226 9.672 8.394 1.00 0.00 C ATOM 0 H VAL A 56 5.480 7.631 9.178 1.00 0.00 H new ATOM 0 HA VAL A 56 4.775 8.301 6.364 1.00 0.00 H new ATOM 0 HB VAL A 56 5.245 10.354 8.488 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.035 11.791 6.886 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.481 11.052 6.158 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.866 10.406 5.782 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.800 10.632 8.686 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.561 9.182 7.683 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.341 9.043 9.276 1.00 0.00 H new ATOM 982 N TYR A 57 7.111 8.852 5.850 1.00 0.00 N ATOM 983 CA TYR A 57 8.517 8.963 5.499 1.00 0.00 C ATOM 984 C TYR A 57 8.784 10.242 4.702 1.00 0.00 C ATOM 985 O TYR A 57 7.870 11.028 4.459 1.00 0.00 O ATOM 986 CB TYR A 57 8.828 7.752 4.617 1.00 0.00 C ATOM 987 CG TYR A 57 9.073 6.460 5.398 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.004 5.725 5.869 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.363 6.029 5.631 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.235 4.509 6.605 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.594 4.812 6.366 1.00 0.00 C ATOM 992 CZ TYR A 57 9.519 4.112 6.817 1.00 0.00 C ATOM 993 OH TYR A 57 9.737 2.963 7.511 1.00 0.00 O ATOM 0 H TYR A 57 6.467 8.930 5.063 1.00 0.00 H new ATOM 0 HA TYR A 57 9.135 8.997 6.396 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.999 7.596 3.927 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.708 7.972 4.013 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.994 6.062 5.686 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.199 6.604 5.262 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.408 3.925 6.980 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.599 4.463 6.555 1.00 0.00 H new ATOM 0 HH TYR A 57 9.022 2.322 7.315 1.00 0.00 H new ATOM 1003 N ASN A 58 10.040 10.409 4.317 1.00 0.00 N ATOM 1004 CA ASN A 58 10.439 11.579 3.553 1.00 0.00 C ATOM 1005 C ASN A 58 9.974 11.419 2.104 1.00 0.00 C ATOM 1006 O ASN A 58 9.420 12.349 1.520 1.00 0.00 O ATOM 1007 CB ASN A 58 11.961 11.740 3.546 1.00 0.00 C ATOM 1008 CG ASN A 58 12.363 13.164 3.935 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.682 13.996 3.102 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.331 13.397 5.244 1.00 0.00 N ATOM 0 H ASN A 58 10.795 9.754 4.520 1.00 0.00 H new ATOM 0 HA ASN A 58 9.986 12.455 4.017 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.409 11.029 4.241 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.351 11.506 2.555 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.583 14.317 5.605 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.054 12.655 5.887 1.00 0.00 H new ATOM 1017 N SER A 59 10.217 10.233 1.566 1.00 0.00 N ATOM 1018 CA SER A 59 9.830 9.939 0.197 1.00 0.00 C ATOM 1019 C SER A 59 9.711 8.426 -0.001 1.00 0.00 C ATOM 1020 O SER A 59 10.169 7.650 0.836 1.00 0.00 O ATOM 1021 CB SER A 59 10.834 10.526 -0.798 1.00 0.00 C ATOM 1022 OG SER A 59 10.334 10.511 -2.132 1.00 0.00 O ATOM 0 H SER A 59 10.677 9.464 2.054 1.00 0.00 H new ATOM 0 HA SER A 59 8.861 10.401 0.010 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.072 11.550 -0.511 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.763 9.958 -0.753 1.00 0.00 H new ATOM 0 HG SER A 59 11.003 10.895 -2.736 1.00 0.00 H new ATOM 1028 N PHE A 60 9.092 8.053 -1.111 1.00 0.00 N ATOM 1029 CA PHE A 60 8.907 6.648 -1.429 1.00 0.00 C ATOM 1030 C PHE A 60 10.249 5.916 -1.481 1.00 0.00 C ATOM 1031 O PHE A 60 10.344 4.756 -1.082 1.00 0.00 O ATOM 1032 CB PHE A 60 8.250 6.583 -2.809 1.00 0.00 C ATOM 1033 CG PHE A 60 6.829 6.017 -2.797 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.613 4.732 -2.407 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.783 6.799 -3.176 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.293 4.207 -2.396 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.463 6.273 -3.164 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.247 4.988 -2.774 1.00 0.00 C ATOM 0 H PHE A 60 8.712 8.700 -1.802 1.00 0.00 H new ATOM 0 HA PHE A 60 8.293 6.172 -0.664 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.227 7.585 -3.236 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.868 5.971 -3.466 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.444 4.111 -2.106 1.00 0.00 H new ATOM 0 HD2 PHE A 60 5.955 7.819 -3.486 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.121 3.187 -2.087 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.632 6.893 -3.464 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.244 4.588 -2.765 1.00 0.00 H new ATOM 1048 N ARG A 61 11.254 6.623 -1.976 1.00 0.00 N ATOM 1049 CA ARG A 61 12.587 6.056 -2.085 1.00 0.00 C ATOM 1050 C ARG A 61 13.074 5.577 -0.716 1.00 0.00 C ATOM 1051 O ARG A 61 13.614 4.479 -0.594 1.00 0.00 O ATOM 1052 CB ARG A 61 13.578 7.080 -2.642 1.00 0.00 C ATOM 1053 CG ARG A 61 14.744 6.386 -3.350 1.00 0.00 C ATOM 1054 CD ARG A 61 16.070 7.076 -3.027 1.00 0.00 C ATOM 1055 NE ARG A 61 16.144 8.381 -3.721 1.00 0.00 N ATOM 1056 CZ ARG A 61 17.282 9.056 -3.932 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.448 8.555 -3.503 1.00 0.00 N ATOM 1058 NH2 ARG A 61 17.254 10.234 -4.571 1.00 0.00 N ATOM 0 H ARG A 61 11.172 7.584 -2.306 1.00 0.00 H new ATOM 0 HA ARG A 61 12.532 5.211 -2.771 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.067 7.743 -3.340 1.00 0.00 H new ATOM 0 HB3 ARG A 61 13.958 7.702 -1.831 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.790 5.341 -3.044 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.578 6.396 -4.427 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.161 7.222 -1.951 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.903 6.444 -3.334 1.00 0.00 H new ATOM 0 HE ARG A 61 15.274 8.792 -4.060 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.470 7.659 -3.016 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.314 9.069 -3.664 1.00 0.00 H new ATOM 0 HH21 ARG A 61 16.366 10.617 -4.897 1.00 0.00 H new ATOM 0 HH22 ARG A 61 18.120 10.748 -4.732 1.00 0.00 H new ATOM 1072 N GLU A 62 12.867 6.426 0.280 1.00 0.00 N ATOM 1073 CA GLU A 62 13.278 6.104 1.636 1.00 0.00 C ATOM 1074 C GLU A 62 12.505 4.888 2.150 1.00 0.00 C ATOM 1075 O GLU A 62 13.034 4.096 2.929 1.00 0.00 O ATOM 1076 CB GLU A 62 13.093 7.305 2.565 1.00 0.00 C ATOM 1077 CG GLU A 62 14.398 8.091 2.712 1.00 0.00 C ATOM 1078 CD GLU A 62 14.216 9.284 3.653 1.00 0.00 C ATOM 1079 OE1 GLU A 62 13.753 9.045 4.789 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.544 10.408 3.214 1.00 0.00 O ATOM 0 H GLU A 62 12.420 7.337 0.175 1.00 0.00 H new ATOM 0 HA GLU A 62 14.339 5.857 1.624 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.314 7.957 2.171 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.758 6.964 3.544 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.180 7.436 3.096 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.728 8.442 1.734 1.00 0.00 H new ATOM 1087 N MET A 63 11.266 4.779 1.695 1.00 0.00 N ATOM 1088 CA MET A 63 10.414 3.673 2.099 1.00 0.00 C ATOM 1089 C MET A 63 10.824 2.379 1.393 1.00 0.00 C ATOM 1090 O MET A 63 10.982 1.341 2.034 1.00 0.00 O ATOM 1091 CB MET A 63 8.958 4.000 1.763 1.00 0.00 C ATOM 1092 CG MET A 63 8.154 4.289 3.032 1.00 0.00 C ATOM 1093 SD MET A 63 6.408 4.303 2.659 1.00 0.00 S ATOM 1094 CE MET A 63 6.249 2.713 1.864 1.00 0.00 C ATOM 0 H MET A 63 10.831 5.439 1.050 1.00 0.00 H new ATOM 0 HA MET A 63 10.523 3.528 3.174 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.919 4.864 1.099 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.509 3.165 1.226 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.367 3.533 3.787 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.453 5.250 3.451 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.357 2.208 2.235 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.166 2.852 0.786 1.00 0.00 H new ATOM 0 HE3 MET A 63 7.127 2.106 2.085 1.00 0.00 H new ATOM 1104 N LEU A 64 10.984 2.483 0.082 1.00 0.00 N ATOM 1105 CA LEU A 64 11.371 1.334 -0.719 1.00 0.00 C ATOM 1106 C LEU A 64 12.808 0.938 -0.371 1.00 0.00 C ATOM 1107 O LEU A 64 13.176 -0.231 -0.479 1.00 0.00 O ATOM 1108 CB LEU A 64 11.155 1.620 -2.206 1.00 0.00 C ATOM 1109 CG LEU A 64 9.778 2.167 -2.591 1.00 0.00 C ATOM 1110 CD1 LEU A 64 9.905 3.309 -3.600 1.00 0.00 C ATOM 1111 CD2 LEU A 64 8.867 1.049 -3.101 1.00 0.00 C ATOM 0 H LEU A 64 10.853 3.346 -0.446 1.00 0.00 H new ATOM 0 HA LEU A 64 10.738 0.477 -0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.912 2.334 -2.532 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.326 0.698 -2.762 1.00 0.00 H new ATOM 0 HG LEU A 64 9.311 2.579 -1.696 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.913 3.680 -3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.492 4.117 -3.163 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.401 2.946 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.895 1.465 -3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.317 0.585 -3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.739 0.299 -2.320 1.00 0.00 H new ATOM 1123 N GLU A 65 13.580 1.933 0.039 1.00 0.00 N ATOM 1124 CA GLU A 65 14.968 1.703 0.402 1.00 0.00 C ATOM 1125 C GLU A 65 15.052 1.023 1.770 1.00 0.00 C ATOM 1126 O GLU A 65 15.747 0.020 1.927 1.00 0.00 O ATOM 1127 CB GLU A 65 15.762 3.010 0.390 1.00 0.00 C ATOM 1128 CG GLU A 65 15.980 3.506 -1.041 1.00 0.00 C ATOM 1129 CD GLU A 65 17.382 3.145 -1.538 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.298 3.960 -1.294 1.00 0.00 O ATOM 1131 OE2 GLU A 65 17.505 2.063 -2.151 1.00 0.00 O ATOM 0 H GLU A 65 13.271 2.901 0.128 1.00 0.00 H new ATOM 0 HA GLU A 65 15.413 1.040 -0.340 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.230 3.768 0.964 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.725 2.859 0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.232 3.066 -1.700 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.843 4.587 -1.080 1.00 0.00 H new ATOM 1138 N LYS A 66 14.334 1.596 2.726 1.00 0.00 N ATOM 1139 CA LYS A 66 14.319 1.057 4.075 1.00 0.00 C ATOM 1140 C LYS A 66 13.298 -0.079 4.155 1.00 0.00 C ATOM 1141 O LYS A 66 13.664 -1.233 4.377 1.00 0.00 O ATOM 1142 CB LYS A 66 14.079 2.173 5.094 1.00 0.00 C ATOM 1143 CG LYS A 66 15.131 2.138 6.204 1.00 0.00 C ATOM 1144 CD LYS A 66 15.419 3.546 6.731 1.00 0.00 C ATOM 1145 CE LYS A 66 14.496 3.893 7.901 1.00 0.00 C ATOM 1146 NZ LYS A 66 15.287 4.337 9.070 1.00 0.00 N ATOM 0 H LYS A 66 13.759 2.428 2.592 1.00 0.00 H new ATOM 0 HA LYS A 66 15.290 0.630 4.326 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.107 3.140 4.592 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.084 2.067 5.527 1.00 0.00 H new ATOM 0 HG2 LYS A 66 14.783 1.505 7.020 1.00 0.00 H new ATOM 0 HG3 LYS A 66 16.051 1.693 5.825 1.00 0.00 H new ATOM 0 HD2 LYS A 66 16.459 3.613 7.051 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.285 4.273 5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 66 13.802 4.679 7.604 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.896 3.023 8.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 14.646 4.569 9.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 15.932 3.575 9.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.840 5.180 8.815 1.00 0.00 H new ATOM 1160 N GLU A 67 12.038 0.286 3.970 1.00 0.00 N ATOM 1161 CA GLU A 67 10.962 -0.689 4.018 1.00 0.00 C ATOM 1162 C GLU A 67 11.233 -1.828 3.033 1.00 0.00 C ATOM 1163 O GLU A 67 11.202 -2.999 3.409 1.00 0.00 O ATOM 1164 CB GLU A 67 9.611 -0.029 3.734 1.00 0.00 C ATOM 1165 CG GLU A 67 8.549 -0.505 4.727 1.00 0.00 C ATOM 1166 CD GLU A 67 9.014 -0.296 6.169 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.986 0.873 6.611 1.00 0.00 O ATOM 1168 OE2 GLU A 67 9.386 -1.310 6.798 1.00 0.00 O ATOM 0 H GLU A 67 11.738 1.244 3.787 1.00 0.00 H new ATOM 0 HA GLU A 67 10.921 -1.107 5.024 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.712 1.055 3.795 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.294 -0.263 2.718 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.619 0.038 4.559 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.336 -1.561 4.559 1.00 0.00 H new ATOM 1175 N GLY A 68 11.493 -1.446 1.792 1.00 0.00 N ATOM 1176 CA GLY A 68 11.770 -2.420 0.750 1.00 0.00 C ATOM 1177 C GLY A 68 10.906 -2.162 -0.486 1.00 0.00 C ATOM 1178 O GLY A 68 9.692 -2.003 -0.377 1.00 0.00 O ATOM 0 H GLY A 68 11.518 -0.474 1.484 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.824 -2.376 0.477 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.581 -3.425 1.127 1.00 0.00 H new ATOM 1182 N LEU A 69 11.568 -2.128 -1.633 1.00 0.00 N ATOM 1183 CA LEU A 69 10.876 -1.891 -2.889 1.00 0.00 C ATOM 1184 C LEU A 69 9.905 -3.043 -3.156 1.00 0.00 C ATOM 1185 O LEU A 69 8.700 -2.827 -3.282 1.00 0.00 O ATOM 1186 CB LEU A 69 11.881 -1.660 -4.019 1.00 0.00 C ATOM 1187 CG LEU A 69 11.345 -1.841 -5.441 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.313 -0.764 -5.779 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.488 -1.879 -6.457 1.00 0.00 C ATOM 0 H LEU A 69 12.576 -2.260 -1.719 1.00 0.00 H new ATOM 0 HA LEU A 69 10.282 -0.979 -2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.275 -0.648 -3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.719 -2.343 -3.878 1.00 0.00 H new ATOM 0 HG LEU A 69 10.835 -2.803 -5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.948 -0.916 -6.795 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.479 -0.828 -5.081 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.776 0.220 -5.703 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.080 -2.008 -7.459 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.047 -0.944 -6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.153 -2.711 -6.226 1.00 0.00 H new ATOM 1201 N GLU A 70 10.464 -4.241 -3.234 1.00 0.00 N ATOM 1202 CA GLU A 70 9.663 -5.427 -3.484 1.00 0.00 C ATOM 1203 C GLU A 70 8.747 -5.709 -2.291 1.00 0.00 C ATOM 1204 O GLU A 70 7.882 -6.581 -2.360 1.00 0.00 O ATOM 1205 CB GLU A 70 10.551 -6.634 -3.792 1.00 0.00 C ATOM 1206 CG GLU A 70 10.610 -6.901 -5.297 1.00 0.00 C ATOM 1207 CD GLU A 70 11.476 -8.126 -5.602 1.00 0.00 C ATOM 1208 OE1 GLU A 70 10.903 -9.236 -5.618 1.00 0.00 O ATOM 1209 OE2 GLU A 70 12.691 -7.923 -5.814 1.00 0.00 O ATOM 0 H GLU A 70 11.463 -4.416 -3.128 1.00 0.00 H new ATOM 0 HA GLU A 70 9.041 -5.244 -4.360 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.557 -6.457 -3.411 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.166 -7.514 -3.278 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.602 -7.058 -5.682 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.015 -6.028 -5.809 1.00 0.00 H new ATOM 1216 N ASN A 71 8.969 -4.955 -1.224 1.00 0.00 N ATOM 1217 CA ASN A 71 8.175 -5.114 -0.018 1.00 0.00 C ATOM 1218 C ASN A 71 6.975 -4.166 -0.074 1.00 0.00 C ATOM 1219 O ASN A 71 6.057 -4.272 0.738 1.00 0.00 O ATOM 1220 CB ASN A 71 8.991 -4.768 1.229 1.00 0.00 C ATOM 1221 CG ASN A 71 10.132 -5.768 1.432 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.506 -6.511 0.540 1.00 0.00 O ATOM 1223 ND2 ASN A 71 10.661 -5.744 2.652 1.00 0.00 N ATOM 0 H ASN A 71 9.687 -4.233 -1.170 1.00 0.00 H new ATOM 0 HA ASN A 71 7.853 -6.154 0.038 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.398 -3.761 1.134 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.342 -4.769 2.105 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.428 -6.373 2.888 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.300 -5.096 3.352 1.00 0.00 H new ATOM 1230 N VAL A 72 7.020 -3.262 -1.042 1.00 0.00 N ATOM 1231 CA VAL A 72 5.948 -2.297 -1.215 1.00 0.00 C ATOM 1232 C VAL A 72 5.365 -2.436 -2.623 1.00 0.00 C ATOM 1233 O VAL A 72 4.151 -2.356 -2.807 1.00 0.00 O ATOM 1234 CB VAL A 72 6.461 -0.887 -0.917 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.309 0.121 -0.889 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.249 -0.855 0.393 1.00 0.00 C ATOM 0 H VAL A 72 7.782 -3.178 -1.714 1.00 0.00 H new ATOM 0 HA VAL A 72 5.141 -2.491 -0.508 1.00 0.00 H new ATOM 0 HB VAL A 72 7.138 -0.600 -1.722 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.701 1.115 -0.675 1.00 0.00 H new ATOM 0 HG12 VAL A 72 4.809 0.129 -1.857 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.596 -0.162 -0.115 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.602 0.159 0.581 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.605 -1.172 1.213 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.103 -1.529 0.321 1.00 0.00 H new ATOM 1246 N LEU A 73 6.256 -2.643 -3.581 1.00 0.00 N ATOM 1247 CA LEU A 73 5.845 -2.794 -4.966 1.00 0.00 C ATOM 1248 C LEU A 73 6.419 -4.098 -5.524 1.00 0.00 C ATOM 1249 O LEU A 73 7.515 -4.109 -6.083 1.00 0.00 O ATOM 1250 CB LEU A 73 6.231 -1.556 -5.777 1.00 0.00 C ATOM 1251 CG LEU A 73 5.257 -1.151 -6.886 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.157 -0.238 -6.344 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.001 -0.516 -8.063 1.00 0.00 C ATOM 0 H LEU A 73 7.262 -2.710 -3.425 1.00 0.00 H new ATOM 0 HA LEU A 73 4.760 -2.867 -5.036 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.340 -0.716 -5.091 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.209 -1.730 -6.225 1.00 0.00 H new ATOM 0 HG LEU A 73 4.771 -2.052 -7.260 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.479 0.035 -7.153 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.601 -0.760 -5.565 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.605 0.664 -5.927 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.286 -0.237 -8.837 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.531 0.373 -7.721 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.716 -1.231 -8.470 1.00 0.00 H new ATOM 1265 N PRO A 74 5.633 -5.194 -5.350 1.00 0.00 N ATOM 1266 CA PRO A 74 6.051 -6.500 -5.830 1.00 0.00 C ATOM 1267 C PRO A 74 5.909 -6.597 -7.350 1.00 0.00 C ATOM 1268 O PRO A 74 4.798 -6.548 -7.877 1.00 0.00 O ATOM 1269 CB PRO A 74 5.172 -7.492 -5.086 1.00 0.00 C ATOM 1270 CG PRO A 74 3.986 -6.694 -4.570 1.00 0.00 C ATOM 1271 CD PRO A 74 4.329 -5.218 -4.693 1.00 0.00 C ATOM 0 HA PRO A 74 7.105 -6.701 -5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.845 -8.295 -5.746 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.717 -7.957 -4.264 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.090 -6.927 -5.145 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.775 -6.952 -3.532 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.580 -4.685 -5.279 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.369 -4.738 -3.715 1.00 0.00 H new ATOM 1279 N GLY A 75 7.048 -6.732 -8.012 1.00 0.00 N ATOM 1280 CA GLY A 75 7.065 -6.836 -9.461 1.00 0.00 C ATOM 1281 C GLY A 75 7.838 -5.673 -10.086 1.00 0.00 C ATOM 1282 O GLY A 75 8.369 -5.797 -11.189 1.00 0.00 O ATOM 0 H GLY A 75 7.967 -6.772 -7.571 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.522 -7.781 -9.756 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.043 -6.844 -9.840 1.00 0.00 H new ATOM 1286 N VAL A 76 7.879 -4.570 -9.354 1.00 0.00 N ATOM 1287 CA VAL A 76 8.579 -3.386 -9.822 1.00 0.00 C ATOM 1288 C VAL A 76 9.879 -3.806 -10.509 1.00 0.00 C ATOM 1289 O VAL A 76 10.450 -4.846 -10.183 1.00 0.00 O ATOM 1290 CB VAL A 76 8.803 -2.416 -8.660 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.546 -3.101 -7.511 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.549 -1.164 -9.126 1.00 0.00 C ATOM 0 H VAL A 76 7.438 -4.471 -8.439 1.00 0.00 H new ATOM 0 HA VAL A 76 7.978 -2.854 -10.560 1.00 0.00 H new ATOM 0 HB VAL A 76 7.826 -2.105 -8.290 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.693 -2.390 -6.698 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.960 -3.947 -7.152 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.515 -3.454 -7.864 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.695 -0.492 -8.281 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.519 -1.449 -9.535 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.966 -0.658 -9.895 1.00 0.00 H new ATOM 1302 N LYS A 77 10.310 -2.976 -11.448 1.00 0.00 N ATOM 1303 CA LYS A 77 11.533 -3.249 -12.184 1.00 0.00 C ATOM 1304 C LYS A 77 12.733 -2.758 -11.371 1.00 0.00 C ATOM 1305 O LYS A 77 13.797 -3.375 -11.395 1.00 0.00 O ATOM 1306 CB LYS A 77 11.457 -2.651 -13.590 1.00 0.00 C ATOM 1307 CG LYS A 77 10.371 -3.339 -14.421 1.00 0.00 C ATOM 1308 CD LYS A 77 10.728 -3.327 -15.908 1.00 0.00 C ATOM 1309 CE LYS A 77 11.020 -4.741 -16.414 1.00 0.00 C ATOM 1310 NZ LYS A 77 11.411 -4.711 -17.841 1.00 0.00 N ATOM 0 H LYS A 77 9.834 -2.114 -11.716 1.00 0.00 H new ATOM 0 HA LYS A 77 11.661 -4.322 -12.325 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.248 -1.583 -13.524 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.422 -2.757 -14.087 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.245 -4.367 -14.082 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.417 -2.834 -14.268 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.906 -2.895 -16.479 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.598 -2.692 -16.071 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.818 -5.188 -15.822 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.138 -5.369 -16.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 11.606 -5.679 -18.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.637 -4.304 -18.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.265 -4.129 -17.955 1.00 0.00 H new ATOM 1324 N SER A 78 12.521 -1.653 -10.672 1.00 0.00 N ATOM 1325 CA SER A 78 13.572 -1.072 -9.854 1.00 0.00 C ATOM 1326 C SER A 78 13.008 0.079 -9.018 1.00 0.00 C ATOM 1327 O SER A 78 11.906 0.559 -9.279 1.00 0.00 O ATOM 1328 CB SER A 78 14.734 -0.580 -10.718 1.00 0.00 C ATOM 1329 OG SER A 78 15.577 -1.650 -11.137 1.00 0.00 O ATOM 0 H SER A 78 11.637 -1.144 -10.655 1.00 0.00 H new ATOM 0 HA SER A 78 13.953 -1.845 -9.187 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.341 -0.063 -11.594 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.322 0.146 -10.156 1.00 0.00 H new ATOM 0 HG SER A 78 15.193 -2.503 -10.845 1.00 0.00 H new ATOM 1335 N ILE A 79 13.790 0.488 -8.029 1.00 0.00 N ATOM 1336 CA ILE A 79 13.382 1.573 -7.153 1.00 0.00 C ATOM 1337 C ILE A 79 13.013 2.793 -7.998 1.00 0.00 C ATOM 1338 O ILE A 79 12.027 3.473 -7.716 1.00 0.00 O ATOM 1339 CB ILE A 79 14.464 1.853 -6.108 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.729 0.616 -5.247 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.105 3.075 -5.261 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.649 0.953 -4.072 1.00 0.00 C ATOM 0 H ILE A 79 14.703 0.088 -7.815 1.00 0.00 H new ATOM 0 HA ILE A 79 12.492 1.294 -6.590 1.00 0.00 H new ATOM 0 HB ILE A 79 15.392 2.085 -6.631 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.785 0.220 -4.873 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.183 -0.165 -5.857 1.00 0.00 H new ATOM 0 HG21 ILE A 79 14.890 3.252 -4.526 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.008 3.949 -5.906 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.161 2.897 -4.747 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.821 0.057 -3.476 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.601 1.326 -4.450 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.181 1.717 -3.451 1.00 0.00 H new ATOM 1354 N GLU A 80 13.823 3.035 -9.018 1.00 0.00 N ATOM 1355 CA GLU A 80 13.594 4.162 -9.906 1.00 0.00 C ATOM 1356 C GLU A 80 12.232 4.030 -10.590 1.00 0.00 C ATOM 1357 O GLU A 80 11.467 4.991 -10.649 1.00 0.00 O ATOM 1358 CB GLU A 80 14.716 4.284 -10.938 1.00 0.00 C ATOM 1359 CG GLU A 80 15.616 5.483 -10.631 1.00 0.00 C ATOM 1360 CD GLU A 80 15.626 6.473 -11.798 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.605 7.176 -11.954 1.00 0.00 O ATOM 1362 OE2 GLU A 80 16.655 6.505 -12.506 1.00 0.00 O ATOM 0 H GLU A 80 14.640 2.469 -9.249 1.00 0.00 H new ATOM 0 HA GLU A 80 13.593 5.075 -9.310 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.311 3.370 -10.944 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.288 4.392 -11.935 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.266 5.983 -9.728 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.631 5.139 -10.432 1.00 0.00 H new ATOM 1369 N GLU A 81 11.970 2.831 -11.090 1.00 0.00 N ATOM 1370 CA GLU A 81 10.714 2.560 -11.768 1.00 0.00 C ATOM 1371 C GLU A 81 9.543 2.713 -10.795 1.00 0.00 C ATOM 1372 O GLU A 81 8.489 3.231 -11.162 1.00 0.00 O ATOM 1373 CB GLU A 81 10.722 1.168 -12.403 1.00 0.00 C ATOM 1374 CG GLU A 81 11.099 1.243 -13.884 1.00 0.00 C ATOM 1375 CD GLU A 81 10.123 2.135 -14.654 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.095 1.590 -15.110 1.00 0.00 O ATOM 1377 OE2 GLU A 81 10.428 3.342 -14.769 1.00 0.00 O ATOM 0 H GLU A 81 12.607 2.036 -11.039 1.00 0.00 H new ATOM 0 HA GLU A 81 10.592 3.287 -12.570 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.430 0.528 -11.876 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.738 0.710 -12.297 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.112 1.633 -13.986 1.00 0.00 H new ATOM 0 HG3 GLU A 81 11.099 0.241 -14.314 1.00 0.00 H new ATOM 1384 N GLY A 82 9.766 2.251 -9.573 1.00 0.00 N ATOM 1385 CA GLY A 82 8.742 2.330 -8.545 1.00 0.00 C ATOM 1386 C GLY A 82 8.222 3.761 -8.398 1.00 0.00 C ATOM 1387 O GLY A 82 7.014 3.981 -8.317 1.00 0.00 O ATOM 0 H GLY A 82 10.640 1.821 -9.272 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.917 1.664 -8.797 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.150 1.988 -7.594 1.00 0.00 H new ATOM 1391 N ILE A 83 9.159 4.697 -8.367 1.00 0.00 N ATOM 1392 CA ILE A 83 8.810 6.101 -8.231 1.00 0.00 C ATOM 1393 C ILE A 83 7.975 6.534 -9.437 1.00 0.00 C ATOM 1394 O ILE A 83 6.961 7.213 -9.284 1.00 0.00 O ATOM 1395 CB ILE A 83 10.066 6.947 -8.017 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.539 6.869 -6.563 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.839 8.391 -8.469 1.00 0.00 C ATOM 1398 CD1 ILE A 83 11.954 6.295 -6.477 1.00 0.00 C ATOM 0 H ILE A 83 10.160 4.511 -8.434 1.00 0.00 H new ATOM 0 HA ILE A 83 8.195 6.256 -7.345 1.00 0.00 H new ATOM 0 HB ILE A 83 10.863 6.537 -8.638 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.518 7.863 -6.116 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.854 6.246 -5.987 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.748 8.970 -8.306 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.585 8.405 -9.529 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.022 8.828 -7.895 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.266 6.250 -5.433 1.00 0.00 H new ATOM 0 HD12 ILE A 83 11.966 5.292 -6.903 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.640 6.933 -7.034 1.00 0.00 H new ATOM 1410 N GLN A 84 8.433 6.124 -10.611 1.00 0.00 N ATOM 1411 CA GLN A 84 7.741 6.461 -11.844 1.00 0.00 C ATOM 1412 C GLN A 84 6.281 6.006 -11.775 1.00 0.00 C ATOM 1413 O GLN A 84 5.390 6.692 -12.271 1.00 0.00 O ATOM 1414 CB GLN A 84 8.449 5.850 -13.055 1.00 0.00 C ATOM 1415 CG GLN A 84 9.521 6.796 -13.598 1.00 0.00 C ATOM 1416 CD GLN A 84 8.915 8.148 -13.983 1.00 0.00 C ATOM 1417 OE1 GLN A 84 7.803 8.241 -14.474 1.00 0.00 O ATOM 1418 NE2 GLN A 84 9.708 9.186 -13.733 1.00 0.00 N ATOM 0 H GLN A 84 9.275 5.561 -10.735 1.00 0.00 H new ATOM 0 HA GLN A 84 7.758 7.544 -11.963 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.905 4.901 -12.773 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.720 5.634 -13.836 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.297 6.942 -12.846 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.000 6.347 -14.468 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.629 9.037 -13.320 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.396 10.131 -13.954 1.00 0.00 H new ATOM 1427 N VAL A 85 6.083 4.852 -11.155 1.00 0.00 N ATOM 1428 CA VAL A 85 4.748 4.297 -11.014 1.00 0.00 C ATOM 1429 C VAL A 85 3.908 5.219 -10.128 1.00 0.00 C ATOM 1430 O VAL A 85 2.788 5.579 -10.486 1.00 0.00 O ATOM 1431 CB VAL A 85 4.829 2.866 -10.481 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.527 2.466 -9.783 1.00 0.00 C ATOM 1433 CG2 VAL A 85 5.176 1.882 -11.600 1.00 0.00 C ATOM 0 H VAL A 85 6.826 4.286 -10.744 1.00 0.00 H new ATOM 0 HA VAL A 85 4.254 4.240 -11.984 1.00 0.00 H new ATOM 0 HB VAL A 85 5.630 2.829 -9.743 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.611 1.444 -9.413 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.340 3.140 -8.947 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.701 2.529 -10.491 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.227 0.872 -11.193 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.408 1.924 -12.372 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.140 2.148 -12.033 1.00 0.00 H new ATOM 1443 N TYR A 86 4.482 5.575 -8.988 1.00 0.00 N ATOM 1444 CA TYR A 86 3.800 6.448 -8.047 1.00 0.00 C ATOM 1445 C TYR A 86 3.625 7.852 -8.631 1.00 0.00 C ATOM 1446 O TYR A 86 2.706 8.576 -8.250 1.00 0.00 O ATOM 1447 CB TYR A 86 4.705 6.530 -6.816 1.00 0.00 C ATOM 1448 CG TYR A 86 5.081 5.168 -6.229 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.153 4.147 -6.204 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.349 4.961 -5.724 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.507 2.866 -5.651 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.703 3.679 -5.171 1.00 0.00 C ATOM 1453 CZ TYR A 86 5.765 2.695 -5.162 1.00 0.00 C ATOM 1454 OH TYR A 86 6.099 1.484 -4.640 1.00 0.00 O ATOM 0 H TYR A 86 5.412 5.275 -8.695 1.00 0.00 H new ATOM 0 HA TYR A 86 2.809 6.060 -7.812 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.617 7.063 -7.083 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.204 7.120 -6.048 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.161 4.309 -6.599 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.075 5.760 -5.744 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.790 2.059 -5.625 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.691 3.503 -4.772 1.00 0.00 H new ATOM 0 HH TYR A 86 5.751 1.414 -3.726 1.00 0.00 H new ATOM 1464 N ARG A 87 4.520 8.194 -9.545 1.00 0.00 N ATOM 1465 CA ARG A 87 4.476 9.498 -10.185 1.00 0.00 C ATOM 1466 C ARG A 87 3.359 9.539 -11.230 1.00 0.00 C ATOM 1467 O ARG A 87 2.795 10.598 -11.500 1.00 0.00 O ATOM 1468 CB ARG A 87 5.809 9.826 -10.860 1.00 0.00 C ATOM 1469 CG ARG A 87 5.976 11.337 -11.037 1.00 0.00 C ATOM 1470 CD ARG A 87 6.045 11.710 -12.520 1.00 0.00 C ATOM 1471 NE ARG A 87 7.443 12.015 -12.900 1.00 0.00 N ATOM 1472 CZ ARG A 87 7.788 12.736 -13.975 1.00 0.00 C ATOM 1473 NH1 ARG A 87 6.841 13.231 -14.783 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.082 12.963 -14.243 1.00 0.00 N ATOM 0 H ARG A 87 5.281 7.591 -9.858 1.00 0.00 H new ATOM 0 HA ARG A 87 4.282 10.241 -9.411 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.631 9.433 -10.261 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.860 9.334 -11.832 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.142 11.857 -10.566 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.884 11.668 -10.532 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.665 10.889 -13.128 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.409 12.573 -12.716 1.00 0.00 H new ATOM 0 HE ARG A 87 8.190 11.654 -12.306 1.00 0.00 H new ATOM 0 HH11 ARG A 87 5.856 13.059 -14.580 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.105 13.780 -15.601 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.804 12.587 -13.628 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.345 13.512 -15.062 1.00 0.00 H new ATOM 1488 N ARG A 88 3.073 8.373 -11.789 1.00 0.00 N ATOM 1489 CA ARG A 88 2.034 8.262 -12.799 1.00 0.00 C ATOM 1490 C ARG A 88 0.652 8.376 -12.153 1.00 0.00 C ATOM 1491 O ARG A 88 -0.250 8.997 -12.714 1.00 0.00 O ATOM 1492 CB ARG A 88 2.131 6.930 -13.546 1.00 0.00 C ATOM 1493 CG ARG A 88 3.454 6.824 -14.307 1.00 0.00 C ATOM 1494 CD ARG A 88 3.210 6.565 -15.795 1.00 0.00 C ATOM 1495 NE ARG A 88 4.344 5.806 -16.369 1.00 0.00 N ATOM 1496 CZ ARG A 88 4.373 5.331 -17.622 1.00 0.00 C ATOM 1497 NH1 ARG A 88 3.331 5.534 -18.440 1.00 0.00 N ATOM 1498 NH2 ARG A 88 5.444 4.653 -18.057 1.00 0.00 N ATOM 0 H ARG A 88 3.543 7.496 -11.562 1.00 0.00 H new ATOM 0 HA ARG A 88 2.175 9.076 -13.510 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.047 6.105 -12.838 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.298 6.838 -14.243 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.024 7.745 -14.183 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.056 6.018 -13.887 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.283 6.007 -15.928 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.091 7.511 -16.323 1.00 0.00 H new ATOM 0 HE ARG A 88 5.154 5.634 -15.774 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.516 6.050 -18.109 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.353 5.172 -19.394 1.00 0.00 H new ATOM 0 HH21 ARG A 88 6.237 4.498 -17.435 1.00 0.00 H new ATOM 0 HH22 ARG A 88 5.466 4.292 -19.011 1.00 0.00 H new ATOM 1512 N PHE A 89 0.529 7.768 -10.982 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.728 7.795 -10.253 1.00 0.00 C ATOM 1514 C PHE A 89 -0.763 8.960 -9.262 1.00 0.00 C ATOM 1515 O PHE A 89 -1.708 9.747 -9.257 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.824 6.478 -9.479 1.00 0.00 C ATOM 1517 CG PHE A 89 -1.018 5.247 -10.366 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -2.048 5.204 -11.253 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -0.161 4.196 -10.267 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.229 4.061 -12.076 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.341 3.053 -11.091 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.372 3.010 -11.978 1.00 0.00 C ATOM 0 H PHE A 89 1.279 7.254 -10.520 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.559 7.920 -10.948 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.083 6.348 -8.889 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.655 6.541 -8.776 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.728 6.039 -11.331 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.656 4.230 -9.562 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.047 4.027 -12.780 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.340 2.218 -11.014 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.510 2.141 -12.604 1.00 0.00 H new ATOM 1532 N TYR A 90 0.278 9.033 -8.447 1.00 0.00 N ATOM 1533 CA TYR A 90 0.379 10.088 -7.453 1.00 0.00 C ATOM 1534 C TYR A 90 1.246 11.241 -7.963 1.00 0.00 C ATOM 1535 O TYR A 90 2.405 11.038 -8.322 1.00 0.00 O ATOM 1536 CB TYR A 90 1.055 9.457 -6.234 1.00 0.00 C ATOM 1537 CG TYR A 90 0.691 7.988 -6.012 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.527 7.505 -6.446 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.581 7.145 -5.377 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.869 6.122 -6.237 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.238 5.762 -5.168 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.030 5.319 -5.608 1.00 0.00 C ATOM 1543 OH TYR A 90 -0.293 4.013 -5.411 1.00 0.00 O ATOM 0 H TYR A 90 1.060 8.378 -8.454 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.606 10.492 -7.221 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.136 9.540 -6.347 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.783 10.026 -5.345 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.224 8.164 -6.942 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.534 7.523 -5.037 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.818 5.731 -6.572 1.00 0.00 H new ATOM 0 HE2 TYR A 90 1.925 5.092 -4.673 1.00 0.00 H new ATOM 0 HH TYR A 90 0.444 3.560 -4.951 1.00 0.00 H new ATOM 1553 N ASP A 91 0.652 12.425 -7.979 1.00 0.00 N ATOM 1554 CA ASP A 91 1.356 13.610 -8.439 1.00 0.00 C ATOM 1555 C ASP A 91 2.649 13.772 -7.637 1.00 0.00 C ATOM 1556 O ASP A 91 2.703 13.418 -6.460 1.00 0.00 O ATOM 1557 CB ASP A 91 0.511 14.868 -8.233 1.00 0.00 C ATOM 1558 CG ASP A 91 -0.991 14.681 -8.456 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.354 14.315 -9.595 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.742 14.909 -7.483 1.00 0.00 O ATOM 0 H ASP A 91 -0.309 12.589 -7.681 1.00 0.00 H new ATOM 0 HA ASP A 91 1.565 13.487 -9.502 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.670 15.232 -7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.870 15.644 -8.910 1.00 0.00 H new ATOM 1565 N GLU A 92 3.659 14.308 -8.306 1.00 0.00 N ATOM 1566 CA GLU A 92 4.948 14.523 -7.671 1.00 0.00 C ATOM 1567 C GLU A 92 4.863 15.679 -6.673 1.00 0.00 C ATOM 1568 O GLU A 92 5.581 15.697 -5.675 1.00 0.00 O ATOM 1569 CB GLU A 92 6.038 14.778 -8.714 1.00 0.00 C ATOM 1570 CG GLU A 92 7.424 14.459 -8.149 1.00 0.00 C ATOM 1571 CD GLU A 92 8.509 15.260 -8.872 1.00 0.00 C ATOM 1572 OE1 GLU A 92 8.228 16.435 -9.193 1.00 0.00 O ATOM 1573 OE2 GLU A 92 9.594 14.679 -9.088 1.00 0.00 O ATOM 0 H GLU A 92 3.611 14.600 -9.282 1.00 0.00 H new ATOM 0 HA GLU A 92 5.217 13.618 -7.126 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.852 14.166 -9.597 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.003 15.819 -9.035 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.448 14.687 -7.083 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.626 13.393 -8.251 1.00 0.00 H new ATOM 1580 N GLU A 93 3.977 16.617 -6.977 1.00 0.00 N ATOM 1581 CA GLU A 93 3.788 17.774 -6.119 1.00 0.00 C ATOM 1582 C GLU A 93 3.092 17.364 -4.820 1.00 0.00 C ATOM 1583 O GLU A 93 3.569 17.677 -3.730 1.00 0.00 O ATOM 1584 CB GLU A 93 3.000 18.869 -6.841 1.00 0.00 C ATOM 1585 CG GLU A 93 3.768 20.192 -6.834 1.00 0.00 C ATOM 1586 CD GLU A 93 3.012 21.269 -7.615 1.00 0.00 C ATOM 1587 OE1 GLU A 93 1.943 21.686 -7.118 1.00 0.00 O ATOM 1588 OE2 GLU A 93 3.519 21.652 -8.691 1.00 0.00 O ATOM 0 H GLU A 93 3.382 16.599 -7.806 1.00 0.00 H new ATOM 0 HA GLU A 93 4.768 18.181 -5.870 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.804 18.564 -7.869 1.00 0.00 H new ATOM 0 HB3 GLU A 93 2.032 19.004 -6.358 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.921 20.523 -5.807 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.755 20.046 -7.272 1.00 0.00 H new ATOM 1595 N LYS A 94 1.975 16.669 -4.978 1.00 0.00 N ATOM 1596 CA LYS A 94 1.209 16.213 -3.831 1.00 0.00 C ATOM 1597 C LYS A 94 2.083 15.298 -2.971 1.00 0.00 C ATOM 1598 O LYS A 94 2.047 15.375 -1.743 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.100 15.564 -4.285 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.308 16.382 -3.823 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.277 15.519 -3.012 1.00 0.00 C ATOM 1602 CE LYS A 94 -1.986 15.629 -1.514 1.00 0.00 C ATOM 1603 NZ LYS A 94 -3.235 15.881 -0.761 1.00 0.00 N ATOM 0 H LYS A 94 1.582 16.411 -5.883 1.00 0.00 H new ATOM 0 HA LYS A 94 0.919 17.058 -3.206 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.109 15.477 -5.372 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.167 14.553 -3.884 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.972 17.224 -3.218 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.823 16.798 -4.689 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.302 15.832 -3.211 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.194 14.479 -3.327 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.520 14.710 -1.160 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.276 16.436 -1.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.003 16.267 0.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.822 16.564 -1.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.759 14.989 -0.649 1.00 0.00 H new ATOM 1617 N GLU A 95 2.846 14.454 -3.648 1.00 0.00 N ATOM 1618 CA GLU A 95 3.728 13.525 -2.961 1.00 0.00 C ATOM 1619 C GLU A 95 4.819 14.288 -2.207 1.00 0.00 C ATOM 1620 O GLU A 95 5.007 14.086 -1.008 1.00 0.00 O ATOM 1621 CB GLU A 95 4.338 12.521 -3.941 1.00 0.00 C ATOM 1622 CG GLU A 95 4.690 11.210 -3.235 1.00 0.00 C ATOM 1623 CD GLU A 95 6.121 11.246 -2.694 1.00 0.00 C ATOM 1624 OE1 GLU A 95 7.033 10.914 -3.481 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.269 11.604 -1.505 1.00 0.00 O ATOM 0 H GLU A 95 2.872 14.393 -4.666 1.00 0.00 H new ATOM 0 HA GLU A 95 3.138 12.963 -2.237 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.635 12.325 -4.751 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.234 12.947 -4.393 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.992 11.035 -2.416 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.581 10.378 -3.930 1.00 0.00 H new ATOM 1632 N LYS A 96 5.508 15.150 -2.941 1.00 0.00 N ATOM 1633 CA LYS A 96 6.576 15.944 -2.356 1.00 0.00 C ATOM 1634 C LYS A 96 5.983 16.908 -1.327 1.00 0.00 C ATOM 1635 O LYS A 96 6.699 17.423 -0.469 1.00 0.00 O ATOM 1636 CB LYS A 96 7.388 16.638 -3.451 1.00 0.00 C ATOM 1637 CG LYS A 96 8.408 15.678 -4.069 1.00 0.00 C ATOM 1638 CD LYS A 96 9.671 16.424 -4.503 1.00 0.00 C ATOM 1639 CE LYS A 96 10.681 16.506 -3.357 1.00 0.00 C ATOM 1640 NZ LYS A 96 10.740 17.882 -2.815 1.00 0.00 N ATOM 0 H LYS A 96 5.348 15.316 -3.935 1.00 0.00 H new ATOM 0 HA LYS A 96 7.281 15.304 -1.825 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.717 17.010 -4.226 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.904 17.503 -3.034 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.669 14.904 -3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.965 15.175 -4.929 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.123 15.916 -5.355 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.408 17.429 -4.834 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.401 15.809 -2.567 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.667 16.206 -3.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.543 17.963 -2.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 10.862 18.558 -3.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 9.857 18.094 -2.308 1.00 0.00 H new ATOM 1654 N LYS A 97 4.681 17.123 -1.445 1.00 0.00 N ATOM 1655 CA LYS A 97 3.984 18.016 -0.536 1.00 0.00 C ATOM 1656 C LYS A 97 3.974 17.403 0.866 1.00 0.00 C ATOM 1657 O LYS A 97 4.481 18.002 1.813 1.00 0.00 O ATOM 1658 CB LYS A 97 2.589 18.346 -1.072 1.00 0.00 C ATOM 1659 CG LYS A 97 2.576 19.712 -1.761 1.00 0.00 C ATOM 1660 CD LYS A 97 1.617 20.673 -1.056 1.00 0.00 C ATOM 1661 CE LYS A 97 2.242 21.229 0.225 1.00 0.00 C ATOM 1662 NZ LYS A 97 1.221 21.352 1.289 1.00 0.00 N ATOM 0 H LYS A 97 4.090 16.694 -2.157 1.00 0.00 H new ATOM 0 HA LYS A 97 4.507 18.970 -0.465 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.275 17.576 -1.777 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.870 18.341 -0.253 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.582 20.132 -1.762 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.278 19.595 -2.803 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.361 21.494 -1.726 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.688 20.155 -0.817 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.046 20.573 0.559 1.00 0.00 H new ATOM 0 HE3 LYS A 97 2.687 22.204 0.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 1.662 21.731 2.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.467 21.996 0.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.815 20.416 1.490 1.00 0.00 H new ATOM 1676 N TYR A 98 3.391 16.216 0.954 1.00 0.00 N ATOM 1677 CA TYR A 98 3.309 15.515 2.224 1.00 0.00 C ATOM 1678 C TYR A 98 4.384 14.431 2.323 1.00 0.00 C ATOM 1679 O TYR A 98 5.171 14.417 3.269 1.00 0.00 O ATOM 1680 CB TYR A 98 1.930 14.853 2.252 1.00 0.00 C ATOM 1681 CG TYR A 98 0.799 15.789 2.685 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.676 16.155 4.009 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.097 16.266 1.750 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.389 17.036 4.416 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.162 17.146 2.157 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.255 17.488 3.470 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.260 18.319 3.855 1.00 0.00 O ATOM 0 H TYR A 98 2.971 15.722 0.166 1.00 0.00 H new ATOM 0 HA TYR A 98 3.458 16.206 3.054 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.705 14.463 1.259 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.961 14.000 2.930 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.378 15.781 4.740 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.000 15.979 0.713 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.497 17.331 5.449 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.871 17.526 1.436 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.800 18.563 3.074 1.00 0.00 H new ATOM 1697 N GLY A 99 4.383 13.550 1.334 1.00 0.00 N ATOM 1698 CA GLY A 99 5.349 12.465 1.298 1.00 0.00 C ATOM 1699 C GLY A 99 4.647 11.110 1.190 1.00 0.00 C ATOM 1700 O GLY A 99 3.487 11.037 0.786 1.00 0.00 O ATOM 0 H GLY A 99 3.729 13.565 0.552 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.021 12.599 0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.963 12.490 2.198 1.00 0.00 H new ATOM 1704 N VAL A 100 5.379 10.069 1.559 1.00 0.00 N ATOM 1705 CA VAL A 100 4.841 8.720 1.509 1.00 0.00 C ATOM 1706 C VAL A 100 4.561 8.234 2.932 1.00 0.00 C ATOM 1707 O VAL A 100 5.137 8.746 3.891 1.00 0.00 O ATOM 1708 CB VAL A 100 5.796 7.804 0.742 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.060 6.580 0.192 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.506 8.566 -0.379 1.00 0.00 C ATOM 0 H VAL A 100 6.340 10.133 1.894 1.00 0.00 H new ATOM 0 HA VAL A 100 3.894 8.706 0.969 1.00 0.00 H new ATOM 0 HB VAL A 100 6.555 7.452 1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.762 5.946 -0.349 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.623 6.017 1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.269 6.904 -0.484 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.179 7.891 -0.908 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.766 8.961 -1.076 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.079 9.389 0.047 1.00 0.00 H new ATOM 1720 N VAL A 101 3.676 7.252 3.025 1.00 0.00 N ATOM 1721 CA VAL A 101 3.313 6.691 4.315 1.00 0.00 C ATOM 1722 C VAL A 101 3.232 5.168 4.200 1.00 0.00 C ATOM 1723 O VAL A 101 2.299 4.636 3.599 1.00 0.00 O ATOM 1724 CB VAL A 101 2.011 7.324 4.812 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.219 8.797 5.170 1.00 0.00 C ATOM 1726 CG2 VAL A 101 0.894 7.162 3.780 1.00 0.00 C ATOM 0 H VAL A 101 3.200 6.831 2.228 1.00 0.00 H new ATOM 0 HA VAL A 101 4.075 6.920 5.060 1.00 0.00 H new ATOM 0 HB VAL A 101 1.708 6.799 5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.279 9.223 5.520 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.969 8.878 5.957 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.558 9.341 4.288 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.020 7.620 4.158 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.186 7.648 2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.719 6.102 3.597 1.00 0.00 H new ATOM 1736 N ALA A 102 4.221 4.509 4.785 1.00 0.00 N ATOM 1737 CA ALA A 102 4.273 3.057 4.756 1.00 0.00 C ATOM 1738 C ALA A 102 3.297 2.495 5.791 1.00 0.00 C ATOM 1739 O ALA A 102 3.620 2.417 6.976 1.00 0.00 O ATOM 1740 CB ALA A 102 5.711 2.593 4.997 1.00 0.00 C ATOM 0 H ALA A 102 4.993 4.954 5.282 1.00 0.00 H new ATOM 0 HA ALA A 102 3.969 2.681 3.779 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.750 1.504 4.975 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.358 2.995 4.218 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.050 2.949 5.970 1.00 0.00 H new ATOM 1746 N ILE A 103 2.123 2.117 5.307 1.00 0.00 N ATOM 1747 CA ILE A 103 1.098 1.564 6.176 1.00 0.00 C ATOM 1748 C ILE A 103 1.112 0.038 6.067 1.00 0.00 C ATOM 1749 O ILE A 103 0.958 -0.511 4.977 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.263 2.191 5.865 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.686 1.895 4.425 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.257 3.691 6.164 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -2.077 2.463 4.135 1.00 0.00 C ATOM 0 H ILE A 103 1.859 2.183 4.324 1.00 0.00 H new ATOM 0 HA ILE A 103 1.307 1.811 7.217 1.00 0.00 H new ATOM 0 HB ILE A 103 -1.007 1.736 6.519 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.038 2.326 3.734 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -0.686 0.818 4.256 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.236 4.112 5.934 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.032 3.851 7.218 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.501 4.181 5.553 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.354 2.239 3.105 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -2.803 2.012 4.812 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.067 3.543 4.281 1.00 0.00 H new ATOM 1765 N GLU A 104 1.298 -0.603 7.211 1.00 0.00 N ATOM 1766 CA GLU A 104 1.333 -2.055 7.258 1.00 0.00 C ATOM 1767 C GLU A 104 -0.083 -2.624 7.158 1.00 0.00 C ATOM 1768 O GLU A 104 -0.902 -2.422 8.053 1.00 0.00 O ATOM 1769 CB GLU A 104 2.033 -2.546 8.527 1.00 0.00 C ATOM 1770 CG GLU A 104 2.790 -3.850 8.266 1.00 0.00 C ATOM 1771 CD GLU A 104 4.177 -3.817 8.911 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.308 -3.119 9.940 1.00 0.00 O ATOM 1773 OE2 GLU A 104 5.075 -4.490 8.360 1.00 0.00 O ATOM 0 H GLU A 104 1.426 -0.144 8.113 1.00 0.00 H new ATOM 0 HA GLU A 104 1.908 -2.413 6.404 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.726 -1.784 8.882 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.297 -2.700 9.316 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.221 -4.691 8.662 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.888 -4.009 7.192 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.329 -3.325 6.060 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.632 -3.925 5.832 1.00 0.00 C ATOM 1782 C ILE A 105 -1.523 -5.444 5.982 1.00 0.00 C ATOM 1783 O ILE A 105 -0.500 -6.033 5.639 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.198 -3.480 4.482 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -1.250 -3.852 3.340 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.526 -1.985 4.491 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -1.220 -5.366 3.124 1.00 0.00 C ATOM 0 H ILE A 105 0.352 -3.490 5.319 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.346 -3.581 6.580 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.133 -4.014 4.311 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.568 -3.356 2.423 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.246 -3.493 3.565 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.927 -1.695 3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.266 -1.779 5.265 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.620 -1.415 4.695 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.539 -5.604 2.307 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.879 -5.857 4.035 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.221 -5.718 2.876 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.593 -6.034 6.495 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.630 -7.473 6.694 1.00 0.00 C ATOM 1801 C GLU A 106 -4.009 -8.024 6.325 1.00 0.00 C ATOM 1802 O GLU A 106 -4.973 -7.841 7.065 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.262 -7.836 8.134 1.00 0.00 C ATOM 1804 CG GLU A 106 -3.000 -6.941 9.132 1.00 0.00 C ATOM 1805 CD GLU A 106 -3.472 -7.744 10.345 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -4.034 -8.837 10.118 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -3.260 -7.247 11.472 1.00 0.00 O ATOM 0 H GLU A 106 -3.440 -5.542 6.779 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.890 -7.931 6.038 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.510 -8.880 8.324 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.186 -7.733 8.275 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -2.342 -6.135 9.458 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -3.856 -6.476 8.644 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.059 -8.706 5.149 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.303 -9.286 4.672 1.00 0.00 C ATOM 1816 C PRO A 107 -5.657 -10.549 5.460 1.00 0.00 C ATOM 1817 O PRO A 107 -4.935 -11.543 5.403 1.00 0.00 O ATOM 1818 CB PRO A 107 -5.071 -9.553 3.194 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.563 -9.548 3.001 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.936 -8.943 4.246 1.00 0.00 C ATOM 0 HA PRO A 107 -6.157 -8.624 4.814 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.499 -10.511 2.898 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.546 -8.788 2.580 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.195 -10.562 2.842 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.293 -8.969 2.118 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.206 -9.620 4.691 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.411 -8.016 4.015 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.767 -10.468 6.178 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.226 -11.592 6.976 1.00 0.00 C ATOM 1830 C LEU A 108 -7.789 -12.673 6.051 1.00 0.00 C ATOM 1831 O LEU A 108 -8.952 -13.056 6.173 1.00 0.00 O ATOM 1832 CB LEU A 108 -8.214 -11.123 8.046 1.00 0.00 C ATOM 1833 CG LEU A 108 -7.903 -9.775 8.701 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.086 -8.815 8.568 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.475 -9.960 10.158 1.00 0.00 C ATOM 0 H LEU A 108 -7.362 -9.641 6.224 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.393 -12.038 7.519 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -9.206 -11.066 7.597 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -8.261 -11.882 8.827 1.00 0.00 H new ATOM 0 HG LEU A 108 -7.063 -9.324 8.173 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.839 -7.865 9.042 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -9.303 -8.649 7.513 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.961 -9.246 9.055 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.260 -8.987 10.600 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.279 -10.442 10.715 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.581 -10.583 10.198 1.00 0.00 H new ATOM 1847 N GLU A 109 -6.938 -13.135 5.147 1.00 0.00 N ATOM 1848 CA GLU A 109 -7.336 -14.164 4.201 1.00 0.00 C ATOM 1849 C GLU A 109 -6.490 -15.423 4.400 1.00 0.00 C ATOM 1850 O GLU A 109 -6.779 -16.468 3.818 1.00 0.00 O ATOM 1851 CB GLU A 109 -7.234 -13.656 2.762 1.00 0.00 C ATOM 1852 CG GLU A 109 -8.004 -14.566 1.803 1.00 0.00 C ATOM 1853 CD GLU A 109 -9.375 -13.977 1.469 1.00 0.00 C ATOM 1854 OE1 GLU A 109 -10.252 -14.041 2.357 1.00 0.00 O ATOM 1855 OE2 GLU A 109 -9.516 -13.475 0.333 1.00 0.00 O ATOM 0 H GLU A 109 -5.974 -12.816 5.049 1.00 0.00 H new ATOM 0 HA GLU A 109 -8.380 -14.418 4.388 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -7.628 -12.642 2.702 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.187 -13.609 2.463 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -7.430 -14.703 0.886 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -8.127 -15.552 2.252 1.00 0.00 H new ATOM 1862 N TYR A 110 -5.461 -15.283 5.223 1.00 0.00 N ATOM 1863 CA TYR A 110 -4.571 -16.396 5.505 1.00 0.00 C ATOM 1864 C TYR A 110 -3.915 -16.911 4.223 1.00 0.00 C ATOM 1865 O TYR A 110 -4.507 -16.842 3.147 1.00 0.00 O ATOM 1866 CB TYR A 110 -5.451 -17.501 6.094 1.00 0.00 C ATOM 1867 CG TYR A 110 -4.675 -18.567 6.870 1.00 0.00 C ATOM 1868 CD1 TYR A 110 -3.987 -18.222 8.016 1.00 0.00 C ATOM 1869 CD2 TYR A 110 -4.662 -19.873 6.424 1.00 0.00 C ATOM 1870 CE1 TYR A 110 -3.257 -19.226 8.746 1.00 0.00 C ATOM 1871 CE2 TYR A 110 -3.932 -20.876 7.154 1.00 0.00 C ATOM 1872 CZ TYR A 110 -3.266 -20.503 8.279 1.00 0.00 C ATOM 1873 OH TYR A 110 -2.576 -21.451 8.969 1.00 0.00 O ATOM 0 H TYR A 110 -5.224 -14.415 5.704 1.00 0.00 H new ATOM 0 HA TYR A 110 -3.775 -16.089 6.184 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -6.189 -17.049 6.757 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -6.001 -17.983 5.286 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -3.996 -17.200 8.365 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -5.200 -20.143 5.527 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -2.715 -18.970 9.644 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -3.914 -21.902 6.816 1.00 0.00 H new ATOM 0 HH TYR A 110 -2.672 -22.317 8.520 1.00 0.00 H new TER 1883 TYR A 110