USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=16 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+ 144:sc= 0.613 (180deg=-0.595!) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 16 LYS NZ :NH3+ -126:sc= -1.49 (180deg=-4.48!) USER MOD Single : A 19 LYS NZ :NH3+ 148:sc= 1.06 (180deg=-0.764) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.159) USER MOD Single : A 27 TYR OH : rot -30:sc= -0.953 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.0197 X(o=-0.02,f=0) USER MOD Single : A 35 LYS NZ :NH3+ -156:sc= 0.398 (180deg=0.205) USER MOD Single : A 41 SER OG : rot 137:sc= -1.03 USER MOD Single : A 46 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.24) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 26:sc= 1.06 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 USER MOD Single : A 63 MET CE :methyl 168:sc= -2.92 (180deg=-4.06!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= 0.265 K(o=0.27,f=-2.2) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 9:sc= 1.23 USER MOD Single : A 84 GLN : amide:sc= -0.175 X(o=-0.18,f=-0.5) USER MOD Single : A 86 TYR OH : rot -105:sc= -3.61! USER MOD Single : A 90 TYR OH : rot 180:sc= -0.331 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -14.399 3.049 10.153 1.00 0.00 N ATOM 2 CA MET A 1 -15.234 1.863 10.053 1.00 0.00 C ATOM 3 C MET A 1 -14.827 1.006 8.852 1.00 0.00 C ATOM 4 O MET A 1 -13.748 1.191 8.290 1.00 0.00 O ATOM 5 CB MET A 1 -16.699 2.281 9.909 1.00 0.00 C ATOM 6 CG MET A 1 -16.946 2.958 8.559 1.00 0.00 C ATOM 7 SD MET A 1 -18.699 3.092 8.255 1.00 0.00 S ATOM 8 CE MET A 1 -18.736 4.609 7.316 1.00 0.00 C ATOM 0 H1 MET A 1 -14.971 3.849 10.490 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.623 2.872 10.823 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.004 3.276 9.218 1.00 0.00 H new ATOM 0 HA MET A 1 -15.103 1.271 10.959 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.342 1.406 10.004 1.00 0.00 H new ATOM 0 HB3 MET A 1 -16.967 2.963 10.716 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.490 3.948 8.551 1.00 0.00 H new ATOM 0 HG3 MET A 1 -16.473 2.383 7.763 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.765 4.842 7.042 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.328 5.420 7.919 1.00 0.00 H new ATOM 0 HE3 MET A 1 -18.138 4.492 6.412 1.00 0.00 H new ATOM 17 N GLU A 2 -15.711 0.087 8.495 1.00 0.00 N ATOM 18 CA GLU A 2 -15.458 -0.799 7.372 1.00 0.00 C ATOM 19 C GLU A 2 -15.370 0.003 6.072 1.00 0.00 C ATOM 20 O GLU A 2 -16.380 0.501 5.576 1.00 0.00 O ATOM 21 CB GLU A 2 -16.533 -1.884 7.276 1.00 0.00 C ATOM 22 CG GLU A 2 -16.244 -2.841 6.117 1.00 0.00 C ATOM 23 CD GLU A 2 -17.543 -3.347 5.488 1.00 0.00 C ATOM 24 OE1 GLU A 2 -18.225 -4.149 6.162 1.00 0.00 O ATOM 25 OE2 GLU A 2 -17.825 -2.922 4.347 1.00 0.00 O ATOM 0 H GLU A 2 -16.604 -0.063 8.964 1.00 0.00 H new ATOM 0 HA GLU A 2 -14.501 -1.296 7.535 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -16.576 -2.442 8.211 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.510 -1.422 7.136 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.644 -2.333 5.362 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -15.656 -3.686 6.476 1.00 0.00 H new ATOM 32 N TRP A 3 -14.154 0.104 5.557 1.00 0.00 N ATOM 33 CA TRP A 3 -13.921 0.837 4.324 1.00 0.00 C ATOM 34 C TRP A 3 -14.019 -0.151 3.161 1.00 0.00 C ATOM 35 O TRP A 3 -13.697 -1.329 3.313 1.00 0.00 O ATOM 36 CB TRP A 3 -12.582 1.576 4.370 1.00 0.00 C ATOM 37 CG TRP A 3 -12.300 2.271 5.704 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.602 1.801 6.747 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.741 3.588 6.097 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.561 2.716 7.780 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.275 3.836 7.372 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.507 4.537 5.399 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.523 5.030 8.060 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.746 5.725 6.100 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.285 5.991 7.384 1.00 0.00 C ATOM 0 H TRP A 3 -13.319 -0.310 5.971 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.676 1.611 4.187 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.780 0.867 4.165 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -12.561 2.320 3.573 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.131 0.829 6.776 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.093 2.593 8.678 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.882 4.364 4.401 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.147 5.201 9.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.330 6.489 5.608 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.513 6.934 7.858 1.00 0.00 H new ATOM 56 N GLU A 4 -14.465 0.364 2.024 1.00 0.00 N ATOM 57 CA GLU A 4 -14.610 -0.459 0.835 1.00 0.00 C ATOM 58 C GLU A 4 -13.955 0.226 -0.366 1.00 0.00 C ATOM 59 O GLU A 4 -14.275 1.370 -0.683 1.00 0.00 O ATOM 60 CB GLU A 4 -16.082 -0.766 0.557 1.00 0.00 C ATOM 61 CG GLU A 4 -16.879 0.522 0.339 1.00 0.00 C ATOM 62 CD GLU A 4 -18.374 0.287 0.566 1.00 0.00 C ATOM 63 OE1 GLU A 4 -18.932 -0.563 -0.162 1.00 0.00 O ATOM 64 OE2 GLU A 4 -18.925 0.961 1.463 1.00 0.00 O ATOM 0 H GLU A 4 -14.731 1.341 1.901 1.00 0.00 H new ATOM 0 HA GLU A 4 -14.103 -1.408 1.008 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -16.164 -1.402 -0.324 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.505 -1.323 1.393 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.521 1.295 1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.715 0.889 -0.674 1.00 0.00 H new ATOM 71 N MET A 5 -13.051 -0.504 -1.002 1.00 0.00 N ATOM 72 CA MET A 5 -12.348 0.019 -2.162 1.00 0.00 C ATOM 73 C MET A 5 -12.448 -0.947 -3.345 1.00 0.00 C ATOM 74 O MET A 5 -13.206 -1.915 -3.298 1.00 0.00 O ATOM 75 CB MET A 5 -10.877 0.244 -1.809 1.00 0.00 C ATOM 76 CG MET A 5 -10.739 1.168 -0.598 1.00 0.00 C ATOM 77 SD MET A 5 -9.682 2.549 -1.001 1.00 0.00 S ATOM 78 CE MET A 5 -8.897 2.810 0.581 1.00 0.00 C ATOM 0 H MET A 5 -12.789 -1.453 -0.736 1.00 0.00 H new ATOM 0 HA MET A 5 -12.810 0.964 -2.448 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.400 -0.713 -1.597 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.357 0.678 -2.663 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.721 1.528 -0.291 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.324 0.616 0.246 1.00 0.00 H new ATOM 0 HE1 MET A 5 -8.199 3.644 0.508 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.655 3.037 1.330 1.00 0.00 H new ATOM 0 HE3 MET A 5 -8.357 1.909 0.872 1.00 0.00 H new ATOM 88 N GLY A 6 -11.671 -0.651 -4.376 1.00 0.00 N ATOM 89 CA GLY A 6 -11.663 -1.481 -5.569 1.00 0.00 C ATOM 90 C GLY A 6 -10.305 -1.416 -6.272 1.00 0.00 C ATOM 91 O GLY A 6 -9.609 -0.405 -6.194 1.00 0.00 O ATOM 0 H GLY A 6 -11.043 0.152 -4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -11.889 -2.513 -5.300 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.446 -1.151 -6.251 1.00 0.00 H new ATOM 95 N LEU A 7 -9.970 -2.508 -6.944 1.00 0.00 N ATOM 96 CA LEU A 7 -8.708 -2.587 -7.660 1.00 0.00 C ATOM 97 C LEU A 7 -8.653 -3.901 -8.443 1.00 0.00 C ATOM 98 O LEU A 7 -9.397 -4.835 -8.147 1.00 0.00 O ATOM 99 CB LEU A 7 -7.533 -2.394 -6.700 1.00 0.00 C ATOM 100 CG LEU A 7 -7.672 -3.057 -5.328 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.349 -3.687 -4.888 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.209 -2.068 -4.292 1.00 0.00 C ATOM 0 H LEU A 7 -10.550 -3.345 -7.008 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.631 -1.778 -8.386 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.632 -2.779 -7.178 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.383 -1.325 -6.551 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.401 -3.863 -5.410 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.475 -4.151 -3.910 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.047 -4.443 -5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.581 -2.916 -4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.298 -2.565 -3.326 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.524 -1.225 -4.204 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.189 -1.708 -4.606 1.00 0.00 H new ATOM 114 N GLN A 8 -7.765 -3.931 -9.426 1.00 0.00 N ATOM 115 CA GLN A 8 -7.603 -5.114 -10.253 1.00 0.00 C ATOM 116 C GLN A 8 -7.430 -6.355 -9.375 1.00 0.00 C ATOM 117 O GLN A 8 -6.730 -6.313 -8.364 1.00 0.00 O ATOM 118 CB GLN A 8 -6.424 -4.954 -11.214 1.00 0.00 C ATOM 119 CG GLN A 8 -6.891 -5.017 -12.670 1.00 0.00 C ATOM 120 CD GLN A 8 -5.715 -4.832 -13.631 1.00 0.00 C ATOM 121 OE1 GLN A 8 -4.948 -3.887 -13.541 1.00 0.00 O ATOM 122 NE2 GLN A 8 -5.616 -5.785 -14.554 1.00 0.00 N ATOM 0 H GLN A 8 -7.150 -3.154 -9.668 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.504 -5.240 -10.854 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.926 -4.002 -11.029 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.691 -5.739 -11.029 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.373 -5.976 -12.860 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -7.638 -4.244 -12.850 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -6.292 -6.549 -14.573 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.864 -5.752 -15.242 1.00 0.00 H new ATOM 131 N GLU A 9 -8.080 -7.432 -9.793 1.00 0.00 N ATOM 132 CA GLU A 9 -8.007 -8.683 -9.057 1.00 0.00 C ATOM 133 C GLU A 9 -6.547 -9.076 -8.823 1.00 0.00 C ATOM 134 O GLU A 9 -6.207 -9.618 -7.772 1.00 0.00 O ATOM 135 CB GLU A 9 -8.764 -9.794 -9.788 1.00 0.00 C ATOM 136 CG GLU A 9 -8.845 -11.058 -8.930 1.00 0.00 C ATOM 137 CD GLU A 9 -8.487 -12.300 -9.749 1.00 0.00 C ATOM 138 OE1 GLU A 9 -8.831 -12.307 -10.950 1.00 0.00 O ATOM 139 OE2 GLU A 9 -7.878 -13.215 -9.154 1.00 0.00 O ATOM 0 H GLU A 9 -8.659 -7.464 -10.632 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.484 -8.541 -8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.769 -9.453 -10.035 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.264 -10.021 -10.730 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.167 -10.970 -8.081 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.851 -11.163 -8.525 1.00 0.00 H new ATOM 146 N GLU A 10 -5.722 -8.788 -9.819 1.00 0.00 N ATOM 147 CA GLU A 10 -4.307 -9.105 -9.735 1.00 0.00 C ATOM 148 C GLU A 10 -3.662 -8.349 -8.571 1.00 0.00 C ATOM 149 O GLU A 10 -2.752 -8.862 -7.922 1.00 0.00 O ATOM 150 CB GLU A 10 -3.595 -8.792 -11.053 1.00 0.00 C ATOM 151 CG GLU A 10 -3.275 -10.076 -11.821 1.00 0.00 C ATOM 152 CD GLU A 10 -2.129 -9.852 -12.809 1.00 0.00 C ATOM 153 OE1 GLU A 10 -2.341 -9.062 -13.754 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.066 -10.475 -12.598 1.00 0.00 O ATOM 0 H GLU A 10 -6.007 -8.338 -10.689 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.205 -10.174 -9.550 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.223 -8.145 -11.665 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.674 -8.245 -10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -3.006 -10.866 -11.120 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.162 -10.414 -12.357 1.00 0.00 H new ATOM 161 N PHE A 11 -4.160 -7.143 -8.342 1.00 0.00 N ATOM 162 CA PHE A 11 -3.644 -6.312 -7.268 1.00 0.00 C ATOM 163 C PHE A 11 -4.103 -6.831 -5.904 1.00 0.00 C ATOM 164 O PHE A 11 -3.340 -6.814 -4.940 1.00 0.00 O ATOM 165 CB PHE A 11 -4.208 -4.905 -7.481 1.00 0.00 C ATOM 166 CG PHE A 11 -3.138 -3.832 -7.689 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.275 -3.526 -6.683 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.049 -3.182 -8.881 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.283 -2.530 -6.876 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.056 -2.186 -9.074 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.194 -1.880 -8.068 1.00 0.00 C ATOM 0 H PHE A 11 -4.916 -6.721 -8.882 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.554 -6.320 -7.282 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.869 -4.917 -8.347 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.817 -4.634 -6.619 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.345 -4.042 -5.737 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.734 -3.424 -9.680 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.598 -2.288 -6.077 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.985 -1.671 -10.021 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.439 -1.122 -8.215 1.00 0.00 H new ATOM 181 N LEU A 12 -5.349 -7.282 -5.867 1.00 0.00 N ATOM 182 CA LEU A 12 -5.919 -7.805 -4.637 1.00 0.00 C ATOM 183 C LEU A 12 -5.006 -8.902 -4.083 1.00 0.00 C ATOM 184 O LEU A 12 -4.757 -8.958 -2.880 1.00 0.00 O ATOM 185 CB LEU A 12 -7.360 -8.263 -4.867 1.00 0.00 C ATOM 186 CG LEU A 12 -8.441 -7.195 -4.682 1.00 0.00 C ATOM 187 CD1 LEU A 12 -8.594 -6.346 -5.945 1.00 0.00 C ATOM 188 CD2 LEU A 12 -9.766 -7.826 -4.250 1.00 0.00 C ATOM 0 H LEU A 12 -5.979 -7.296 -6.669 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.974 -7.023 -3.880 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.437 -8.658 -5.880 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.571 -9.087 -4.186 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.127 -6.526 -3.881 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.368 -5.595 -5.787 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.649 -5.851 -6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.875 -6.986 -6.782 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.517 -7.046 -4.125 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.098 -8.531 -5.012 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.628 -8.351 -3.305 1.00 0.00 H new ATOM 200 N GLU A 13 -4.533 -9.746 -4.988 1.00 0.00 N ATOM 201 CA GLU A 13 -3.654 -10.838 -4.605 1.00 0.00 C ATOM 202 C GLU A 13 -2.304 -10.292 -4.136 1.00 0.00 C ATOM 203 O GLU A 13 -1.681 -10.856 -3.237 1.00 0.00 O ATOM 204 CB GLU A 13 -3.474 -11.827 -5.758 1.00 0.00 C ATOM 205 CG GLU A 13 -2.799 -13.113 -5.277 1.00 0.00 C ATOM 206 CD GLU A 13 -3.834 -14.205 -4.997 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.895 -13.851 -4.439 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.541 -15.368 -5.347 1.00 0.00 O ATOM 0 H GLU A 13 -4.742 -9.696 -5.985 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.115 -11.376 -3.777 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.445 -12.063 -6.194 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.874 -11.369 -6.544 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.093 -13.461 -6.031 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.225 -12.910 -4.373 1.00 0.00 H new ATOM 215 N LEU A 14 -1.892 -9.201 -4.764 1.00 0.00 N ATOM 216 CA LEU A 14 -0.627 -8.573 -4.422 1.00 0.00 C ATOM 217 C LEU A 14 -0.661 -8.132 -2.958 1.00 0.00 C ATOM 218 O LEU A 14 0.370 -8.114 -2.287 1.00 0.00 O ATOM 219 CB LEU A 14 -0.311 -7.438 -5.399 1.00 0.00 C ATOM 220 CG LEU A 14 0.235 -7.861 -6.764 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.852 -6.671 -7.501 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.222 -9.022 -6.625 1.00 0.00 C ATOM 0 H LEU A 14 -2.412 -8.736 -5.508 1.00 0.00 H new ATOM 0 HA LEU A 14 0.192 -9.286 -4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.220 -6.858 -5.557 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.414 -6.773 -4.930 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.599 -8.218 -7.369 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.232 -7.000 -8.468 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.093 -5.903 -7.651 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.671 -6.261 -6.909 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.595 -9.303 -7.610 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.057 -8.716 -5.995 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.718 -9.875 -6.171 1.00 0.00 H new ATOM 234 N ILE A 15 -1.857 -7.787 -2.504 1.00 0.00 N ATOM 235 CA ILE A 15 -2.039 -7.347 -1.132 1.00 0.00 C ATOM 236 C ILE A 15 -1.679 -8.492 -0.182 1.00 0.00 C ATOM 237 O ILE A 15 -0.941 -8.294 0.782 1.00 0.00 O ATOM 238 CB ILE A 15 -3.454 -6.801 -0.927 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.499 -5.291 -1.173 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.991 -7.173 0.457 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.303 -4.971 -2.656 1.00 0.00 C ATOM 0 H ILE A 15 -2.710 -7.803 -3.063 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.367 -6.520 -0.905 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.110 -7.267 -1.662 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.455 -4.892 -0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.723 -4.800 -0.586 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.998 -6.773 0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.018 -8.258 0.557 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.341 -6.754 1.224 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.339 -3.892 -2.803 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.335 -5.350 -2.985 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.095 -5.443 -3.238 1.00 0.00 H new ATOM 253 N LYS A 16 -2.217 -9.664 -0.488 1.00 0.00 N ATOM 254 CA LYS A 16 -1.961 -10.840 0.326 1.00 0.00 C ATOM 255 C LYS A 16 -0.486 -11.227 0.206 1.00 0.00 C ATOM 256 O LYS A 16 0.056 -11.902 1.080 1.00 0.00 O ATOM 257 CB LYS A 16 -2.926 -11.968 -0.045 1.00 0.00 C ATOM 258 CG LYS A 16 -3.604 -12.541 1.201 1.00 0.00 C ATOM 259 CD LYS A 16 -4.619 -13.622 0.825 1.00 0.00 C ATOM 260 CE LYS A 16 -5.942 -13.000 0.375 1.00 0.00 C ATOM 261 NZ LYS A 16 -7.011 -13.288 1.357 1.00 0.00 N ATOM 0 H LYS A 16 -2.829 -9.824 -1.288 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.149 -10.624 1.378 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.682 -11.593 -0.735 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.385 -12.758 -0.565 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.851 -12.960 1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.104 -11.741 1.747 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.215 -14.243 0.026 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.793 -14.276 1.680 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.824 -11.922 0.263 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.222 -13.394 -0.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.818 -13.729 0.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.648 -13.936 2.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.319 -12.401 1.805 1.00 0.00 H new ATOM 275 N LEU A 17 0.122 -10.783 -0.884 1.00 0.00 N ATOM 276 CA LEU A 17 1.524 -11.075 -1.131 1.00 0.00 C ATOM 277 C LEU A 17 2.390 -10.034 -0.419 1.00 0.00 C ATOM 278 O LEU A 17 3.352 -10.383 0.264 1.00 0.00 O ATOM 279 CB LEU A 17 1.795 -11.177 -2.633 1.00 0.00 C ATOM 280 CG LEU A 17 1.563 -12.551 -3.265 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.067 -12.416 -4.705 1.00 0.00 C ATOM 282 CD2 LEU A 17 2.822 -13.417 -3.171 1.00 0.00 C ATOM 0 H LEU A 17 -0.331 -10.223 -1.606 1.00 0.00 H new ATOM 0 HA LEU A 17 1.789 -12.048 -0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.163 -10.452 -3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 17 2.829 -10.885 -2.816 1.00 0.00 H new ATOM 0 HG LEU A 17 0.780 -13.058 -2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.910 -13.407 -5.130 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.127 -11.864 -4.716 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.809 -11.881 -5.297 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.630 -14.388 -3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.642 -12.925 -3.695 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.091 -13.555 -2.124 1.00 0.00 H new ATOM 294 N ARG A 18 2.018 -8.776 -0.604 1.00 0.00 N ATOM 295 CA ARG A 18 2.749 -7.681 0.012 1.00 0.00 C ATOM 296 C ARG A 18 2.387 -7.569 1.494 1.00 0.00 C ATOM 297 O ARG A 18 2.855 -6.664 2.184 1.00 0.00 O ATOM 298 CB ARG A 18 2.441 -6.353 -0.683 1.00 0.00 C ATOM 299 CG ARG A 18 0.939 -6.061 -0.667 1.00 0.00 C ATOM 300 CD ARG A 18 0.644 -4.741 0.048 1.00 0.00 C ATOM 301 NE ARG A 18 -0.125 -3.844 -0.842 1.00 0.00 N ATOM 302 CZ ARG A 18 0.316 -3.405 -2.029 1.00 0.00 C ATOM 303 NH1 ARG A 18 1.524 -3.777 -2.475 1.00 0.00 N ATOM 304 NH2 ARG A 18 -0.450 -2.592 -2.770 1.00 0.00 N ATOM 0 H ARG A 18 1.220 -8.490 -1.172 1.00 0.00 H new ATOM 0 HA ARG A 18 3.813 -7.893 -0.091 1.00 0.00 H new ATOM 0 HB2 ARG A 18 2.977 -5.545 -0.185 1.00 0.00 H new ATOM 0 HB3 ARG A 18 2.798 -6.386 -1.712 1.00 0.00 H new ATOM 0 HG2 ARG A 18 0.563 -6.017 -1.689 1.00 0.00 H new ATOM 0 HG3 ARG A 18 0.412 -6.874 -0.168 1.00 0.00 H new ATOM 0 HD2 ARG A 18 0.080 -4.931 0.962 1.00 0.00 H new ATOM 0 HD3 ARG A 18 1.577 -4.261 0.343 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.049 -3.541 -0.533 1.00 0.00 H new ATOM 0 HH11 ARG A 18 2.108 -4.394 -1.911 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.859 -3.443 -3.378 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.369 -2.307 -2.430 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -0.114 -2.258 -3.673 1.00 0.00 H new ATOM 318 N LYS A 19 1.558 -8.501 1.940 1.00 0.00 N ATOM 319 CA LYS A 19 1.128 -8.518 3.328 1.00 0.00 C ATOM 320 C LYS A 19 2.308 -8.913 4.218 1.00 0.00 C ATOM 321 O LYS A 19 2.391 -8.489 5.370 1.00 0.00 O ATOM 322 CB LYS A 19 -0.099 -9.416 3.498 1.00 0.00 C ATOM 323 CG LYS A 19 0.316 -10.865 3.762 1.00 0.00 C ATOM 324 CD LYS A 19 -0.909 -11.776 3.861 1.00 0.00 C ATOM 325 CE LYS A 19 -0.493 -13.237 4.046 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.121 -13.838 2.745 1.00 0.00 N ATOM 0 H LYS A 19 1.172 -9.250 1.365 1.00 0.00 H new ATOM 0 HA LYS A 19 0.811 -7.523 3.641 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.709 -9.052 4.325 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.716 -9.368 2.601 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.968 -11.212 2.961 1.00 0.00 H new ATOM 0 HG3 LYS A 19 0.890 -10.920 4.687 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.533 -11.463 4.698 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.513 -11.678 2.959 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.349 -13.297 4.735 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -1.312 -13.801 4.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.622 -14.551 2.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.956 -14.290 2.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 0.232 -13.096 2.108 1.00 0.00 H new ATOM 340 N LYS A 20 3.192 -9.720 3.651 1.00 0.00 N ATOM 341 CA LYS A 20 4.363 -10.177 4.378 1.00 0.00 C ATOM 342 C LYS A 20 5.462 -9.117 4.284 1.00 0.00 C ATOM 343 O LYS A 20 6.597 -9.356 4.694 1.00 0.00 O ATOM 344 CB LYS A 20 4.797 -11.558 3.882 1.00 0.00 C ATOM 345 CG LYS A 20 5.369 -12.397 5.027 1.00 0.00 C ATOM 346 CD LYS A 20 6.826 -12.775 4.755 1.00 0.00 C ATOM 347 CE LYS A 20 7.659 -12.707 6.037 1.00 0.00 C ATOM 348 NZ LYS A 20 9.015 -13.251 5.804 1.00 0.00 N ATOM 0 H LYS A 20 3.120 -10.069 2.695 1.00 0.00 H new ATOM 0 HA LYS A 20 4.130 -10.302 5.435 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.945 -12.074 3.439 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.546 -11.448 3.098 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.303 -11.838 5.960 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.773 -13.301 5.154 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.873 -13.782 4.340 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.247 -12.102 4.008 1.00 0.00 H new ATOM 0 HE2 LYS A 20 7.729 -11.674 6.378 1.00 0.00 H new ATOM 0 HE3 LYS A 20 7.166 -13.271 6.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.567 -13.197 6.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 8.944 -14.243 5.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.489 -12.696 5.064 1.00 0.00 H new ATOM 362 N LYS A 21 5.087 -7.968 3.742 1.00 0.00 N ATOM 363 CA LYS A 21 6.027 -6.870 3.589 1.00 0.00 C ATOM 364 C LYS A 21 5.382 -5.578 4.096 1.00 0.00 C ATOM 365 O LYS A 21 5.275 -5.367 5.303 1.00 0.00 O ATOM 366 CB LYS A 21 6.520 -6.785 2.143 1.00 0.00 C ATOM 367 CG LYS A 21 7.254 -8.064 1.737 1.00 0.00 C ATOM 368 CD LYS A 21 6.707 -8.616 0.419 1.00 0.00 C ATOM 369 CE LYS A 21 7.450 -9.888 0.007 1.00 0.00 C ATOM 370 NZ LYS A 21 6.867 -11.070 0.679 1.00 0.00 N ATOM 0 H LYS A 21 4.145 -7.773 3.403 1.00 0.00 H new ATOM 0 HA LYS A 21 6.916 -7.042 4.195 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.674 -6.620 1.476 1.00 0.00 H new ATOM 0 HB3 LYS A 21 7.185 -5.929 2.032 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.320 -7.859 1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.147 -8.813 2.521 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.643 -8.830 0.524 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.805 -7.863 -0.363 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.396 -10.014 -1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.505 -9.799 0.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.214 -11.936 0.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.147 -11.073 1.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.830 -11.033 0.609 1.00 0.00 H new ATOM 384 N ILE A 22 4.970 -4.749 3.149 1.00 0.00 N ATOM 385 CA ILE A 22 4.340 -3.483 3.485 1.00 0.00 C ATOM 386 C ILE A 22 3.601 -2.945 2.258 1.00 0.00 C ATOM 387 O ILE A 22 3.615 -3.568 1.198 1.00 0.00 O ATOM 388 CB ILE A 22 5.368 -2.508 4.061 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.002 -2.106 5.491 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.540 -1.291 3.150 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.640 -1.411 5.534 1.00 0.00 C ATOM 0 H ILE A 22 5.060 -4.929 2.149 1.00 0.00 H new ATOM 0 HA ILE A 22 3.596 -3.624 4.269 1.00 0.00 H new ATOM 0 HB ILE A 22 6.332 -3.015 4.106 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.983 -2.991 6.128 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.766 -1.441 5.892 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.276 -0.614 3.583 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.881 -1.617 2.167 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.586 -0.774 3.050 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.404 -1.136 6.562 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.670 -0.514 4.916 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.874 -2.088 5.155 1.00 0.00 H new ATOM 403 N GLU A 23 2.975 -1.792 2.443 1.00 0.00 N ATOM 404 CA GLU A 23 2.232 -1.163 1.364 1.00 0.00 C ATOM 405 C GLU A 23 2.381 0.358 1.434 1.00 0.00 C ATOM 406 O GLU A 23 1.880 0.993 2.361 1.00 0.00 O ATOM 407 CB GLU A 23 0.758 -1.571 1.402 1.00 0.00 C ATOM 408 CG GLU A 23 -0.079 -0.690 0.473 1.00 0.00 C ATOM 409 CD GLU A 23 -1.526 -1.183 0.406 1.00 0.00 C ATOM 410 OE1 GLU A 23 -1.717 -2.406 0.580 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.408 -0.325 0.183 1.00 0.00 O ATOM 0 H GLU A 23 2.967 -1.277 3.323 1.00 0.00 H new ATOM 0 HA GLU A 23 2.646 -1.507 0.416 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.658 -2.615 1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.381 -1.491 2.422 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.058 0.341 0.827 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.356 -0.692 -0.526 1.00 0.00 H new ATOM 418 N GLY A 24 3.073 0.899 0.442 1.00 0.00 N ATOM 419 CA GLY A 24 3.294 2.334 0.380 1.00 0.00 C ATOM 420 C GLY A 24 2.171 3.029 -0.392 1.00 0.00 C ATOM 421 O GLY A 24 1.548 2.427 -1.265 1.00 0.00 O ATOM 0 H GLY A 24 3.488 0.370 -0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.352 2.741 1.390 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.251 2.538 -0.101 1.00 0.00 H new ATOM 425 N ARG A 25 1.946 4.287 -0.042 1.00 0.00 N ATOM 426 CA ARG A 25 0.908 5.071 -0.690 1.00 0.00 C ATOM 427 C ARG A 25 0.851 6.476 -0.089 1.00 0.00 C ATOM 428 O ARG A 25 0.418 6.651 1.049 1.00 0.00 O ATOM 429 CB ARG A 25 -0.460 4.403 -0.541 1.00 0.00 C ATOM 430 CG ARG A 25 -1.505 5.093 -1.420 1.00 0.00 C ATOM 431 CD ARG A 25 -2.182 4.090 -2.357 1.00 0.00 C ATOM 432 NE ARG A 25 -3.605 4.450 -2.542 1.00 0.00 N ATOM 433 CZ ARG A 25 -4.403 3.907 -3.471 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.922 2.975 -4.306 1.00 0.00 N ATOM 435 NH2 ARG A 25 -5.682 4.295 -3.567 1.00 0.00 N ATOM 0 H ARG A 25 2.465 4.783 0.682 1.00 0.00 H new ATOM 0 HA ARG A 25 1.154 5.136 -1.750 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.387 3.351 -0.815 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.775 4.440 0.502 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.255 5.572 -0.791 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.030 5.880 -2.006 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -1.673 4.080 -3.321 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.104 3.084 -1.944 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.004 5.156 -1.923 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.948 2.679 -4.234 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.530 2.562 -5.013 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.049 5.004 -2.932 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -6.289 3.881 -4.275 1.00 0.00 H new ATOM 449 N LEU A 26 1.293 7.442 -0.881 1.00 0.00 N ATOM 450 CA LEU A 26 1.297 8.827 -0.441 1.00 0.00 C ATOM 451 C LEU A 26 0.051 9.092 0.407 1.00 0.00 C ATOM 452 O LEU A 26 -1.057 8.725 0.019 1.00 0.00 O ATOM 453 CB LEU A 26 1.439 9.769 -1.638 1.00 0.00 C ATOM 454 CG LEU A 26 0.539 11.007 -1.627 1.00 0.00 C ATOM 455 CD1 LEU A 26 1.157 12.126 -0.787 1.00 0.00 C ATOM 456 CD2 LEU A 26 0.224 11.468 -3.052 1.00 0.00 C ATOM 0 H LEU A 26 1.651 7.293 -1.825 1.00 0.00 H new ATOM 0 HA LEU A 26 2.162 9.023 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.476 10.099 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.234 9.203 -2.547 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.408 10.737 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.498 12.994 -0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.289 11.781 0.238 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.125 12.402 -1.204 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.417 12.349 -3.016 1.00 0.00 H new ATOM 0 HD22 LEU A 26 1.152 11.715 -3.568 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.288 10.669 -3.588 1.00 0.00 H new ATOM 468 N TYR A 27 0.275 9.728 1.547 1.00 0.00 N ATOM 469 CA TYR A 27 -0.816 10.047 2.453 1.00 0.00 C ATOM 470 C TYR A 27 -1.774 11.060 1.822 1.00 0.00 C ATOM 471 O TYR A 27 -1.431 11.714 0.839 1.00 0.00 O ATOM 472 CB TYR A 27 -0.169 10.676 3.688 1.00 0.00 C ATOM 473 CG TYR A 27 -0.892 10.359 4.999 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.345 9.079 5.245 1.00 0.00 C ATOM 475 CD2 TYR A 27 -1.090 11.353 5.935 1.00 0.00 C ATOM 476 CE1 TYR A 27 -2.025 8.781 6.479 1.00 0.00 C ATOM 477 CE2 TYR A 27 -1.771 11.055 7.169 1.00 0.00 C ATOM 478 CZ TYR A 27 -2.205 9.784 7.380 1.00 0.00 C ATOM 479 OH TYR A 27 -2.848 9.502 8.545 1.00 0.00 O ATOM 0 H TYR A 27 1.196 10.031 1.865 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.390 9.152 2.692 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.862 10.331 3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -0.134 11.757 3.556 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.190 8.301 4.512 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -0.734 12.354 5.743 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.384 7.783 6.684 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.933 11.824 7.910 1.00 0.00 H new ATOM 0 HH TYR A 27 -3.492 8.779 8.396 1.00 0.00 H new ATOM 489 N ASP A 28 -2.955 11.157 2.414 1.00 0.00 N ATOM 490 CA ASP A 28 -3.965 12.079 1.923 1.00 0.00 C ATOM 491 C ASP A 28 -5.093 12.188 2.951 1.00 0.00 C ATOM 492 O ASP A 28 -5.023 11.586 4.021 1.00 0.00 O ATOM 493 CB ASP A 28 -4.570 11.583 0.608 1.00 0.00 C ATOM 494 CG ASP A 28 -3.662 11.724 -0.615 1.00 0.00 C ATOM 495 OD1 ASP A 28 -3.144 12.845 -0.811 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.507 10.708 -1.327 1.00 0.00 O ATOM 0 H ASP A 28 -3.235 10.612 3.229 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.488 13.046 1.759 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -4.839 10.533 0.723 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.494 12.131 0.421 1.00 0.00 H new ATOM 501 N GLU A 29 -6.106 12.962 2.590 1.00 0.00 N ATOM 502 CA GLU A 29 -7.247 13.158 3.468 1.00 0.00 C ATOM 503 C GLU A 29 -7.896 11.814 3.804 1.00 0.00 C ATOM 504 O GLU A 29 -8.132 11.509 4.972 1.00 0.00 O ATOM 505 CB GLU A 29 -8.263 14.115 2.841 1.00 0.00 C ATOM 506 CG GLU A 29 -7.587 15.410 2.386 1.00 0.00 C ATOM 507 CD GLU A 29 -8.357 16.635 2.885 1.00 0.00 C ATOM 508 OE1 GLU A 29 -9.401 16.939 2.269 1.00 0.00 O ATOM 509 OE2 GLU A 29 -7.883 17.239 3.871 1.00 0.00 O ATOM 0 H GLU A 29 -6.160 13.461 1.702 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.894 13.610 4.395 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.745 13.633 1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.047 14.344 3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.564 15.442 2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.529 15.431 1.298 1.00 0.00 H new ATOM 516 N LYS A 30 -8.165 11.045 2.759 1.00 0.00 N ATOM 517 CA LYS A 30 -8.782 9.740 2.928 1.00 0.00 C ATOM 518 C LYS A 30 -7.903 8.880 3.839 1.00 0.00 C ATOM 519 O LYS A 30 -8.400 8.249 4.771 1.00 0.00 O ATOM 520 CB LYS A 30 -9.067 9.102 1.568 1.00 0.00 C ATOM 521 CG LYS A 30 -10.429 9.544 1.029 1.00 0.00 C ATOM 522 CD LYS A 30 -10.290 10.187 -0.352 1.00 0.00 C ATOM 523 CE LYS A 30 -11.211 11.402 -0.486 1.00 0.00 C ATOM 524 NZ LYS A 30 -10.680 12.346 -1.495 1.00 0.00 N ATOM 0 H LYS A 30 -7.967 11.301 1.792 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.751 9.837 3.418 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.285 9.379 0.861 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.043 8.016 1.660 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.096 8.684 0.968 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.885 10.253 1.720 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.256 10.491 -0.513 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -10.532 9.456 -1.124 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.211 11.078 -0.774 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.303 11.904 0.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -11.317 13.165 -1.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.735 12.669 -1.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -10.615 11.869 -2.417 1.00 0.00 H new ATOM 538 N ARG A 31 -6.613 8.884 3.538 1.00 0.00 N ATOM 539 CA ARG A 31 -5.661 8.112 4.318 1.00 0.00 C ATOM 540 C ARG A 31 -5.651 8.592 5.771 1.00 0.00 C ATOM 541 O ARG A 31 -5.615 7.783 6.696 1.00 0.00 O ATOM 542 CB ARG A 31 -4.250 8.231 3.739 1.00 0.00 C ATOM 543 CG ARG A 31 -3.537 6.877 3.748 1.00 0.00 C ATOM 544 CD ARG A 31 -4.058 5.976 2.627 1.00 0.00 C ATOM 545 NE ARG A 31 -3.748 6.576 1.310 1.00 0.00 N ATOM 546 CZ ARG A 31 -4.569 7.406 0.651 1.00 0.00 C ATOM 547 NH1 ARG A 31 -5.753 7.738 1.182 1.00 0.00 N ATOM 548 NH2 ARG A 31 -4.205 7.903 -0.539 1.00 0.00 N ATOM 0 H ARG A 31 -6.205 9.409 2.765 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.971 7.068 4.279 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.303 8.611 2.719 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.675 8.953 4.319 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.464 7.026 3.630 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.687 6.389 4.711 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.603 4.988 2.702 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.135 5.840 2.729 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.854 6.344 0.877 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.030 7.359 2.088 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.378 8.370 0.681 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -3.303 7.650 -0.943 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -4.830 8.535 -1.041 1.00 0.00 H new ATOM 562 N ARG A 32 -5.684 9.908 5.925 1.00 0.00 N ATOM 563 CA ARG A 32 -5.679 10.506 7.250 1.00 0.00 C ATOM 564 C ARG A 32 -6.766 9.874 8.121 1.00 0.00 C ATOM 565 O ARG A 32 -6.542 9.603 9.300 1.00 0.00 O ATOM 566 CB ARG A 32 -5.911 12.016 7.173 1.00 0.00 C ATOM 567 CG ARG A 32 -4.898 12.771 8.035 1.00 0.00 C ATOM 568 CD ARG A 32 -4.127 13.798 7.203 1.00 0.00 C ATOM 569 NE ARG A 32 -3.987 15.062 7.961 1.00 0.00 N ATOM 570 CZ ARG A 32 -4.932 16.010 8.021 1.00 0.00 C ATOM 571 NH1 ARG A 32 -6.090 15.844 7.369 1.00 0.00 N ATOM 572 NH2 ARG A 32 -4.718 17.124 8.734 1.00 0.00 N ATOM 0 H ARG A 32 -5.714 10.576 5.155 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.700 10.322 7.694 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -5.831 12.347 6.138 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.922 12.250 7.506 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -5.414 13.274 8.853 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -4.200 12.065 8.485 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -3.142 13.406 6.948 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -4.649 13.983 6.264 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.117 15.221 8.469 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -6.253 14.996 6.827 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -6.809 16.566 7.415 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.836 17.250 9.231 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.437 17.846 8.780 1.00 0.00 H new ATOM 586 N GLN A 33 -7.920 9.657 7.508 1.00 0.00 N ATOM 587 CA GLN A 33 -9.042 9.061 8.213 1.00 0.00 C ATOM 588 C GLN A 33 -8.755 7.591 8.523 1.00 0.00 C ATOM 589 O GLN A 33 -9.301 7.035 9.475 1.00 0.00 O ATOM 590 CB GLN A 33 -10.336 9.210 7.410 1.00 0.00 C ATOM 591 CG GLN A 33 -11.343 10.092 8.151 1.00 0.00 C ATOM 592 CD GLN A 33 -12.624 10.267 7.333 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.708 11.084 6.431 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.614 9.456 7.697 1.00 0.00 N ATOM 0 H GLN A 33 -8.102 9.883 6.530 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.175 9.591 9.156 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.115 9.644 6.435 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.772 8.227 7.230 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.582 9.646 9.116 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.899 11.067 8.352 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -13.477 8.795 8.461 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.510 9.496 7.212 1.00 0.00 H new ATOM 603 N ILE A 34 -7.897 7.003 7.701 1.00 0.00 N ATOM 604 CA ILE A 34 -7.531 5.608 7.876 1.00 0.00 C ATOM 605 C ILE A 34 -6.579 5.480 9.067 1.00 0.00 C ATOM 606 O ILE A 34 -5.547 6.147 9.116 1.00 0.00 O ATOM 607 CB ILE A 34 -6.967 5.035 6.574 1.00 0.00 C ATOM 608 CG1 ILE A 34 -7.985 5.150 5.438 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.487 3.596 6.770 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.321 4.914 4.080 1.00 0.00 C ATOM 0 H ILE A 34 -7.445 7.467 6.913 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.412 5.009 8.106 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.098 5.628 6.289 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.785 4.424 5.587 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.444 6.138 5.455 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.091 3.213 5.829 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.705 3.574 7.529 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.323 2.974 7.092 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.067 5.002 3.290 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.538 5.656 3.924 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.884 3.916 4.057 1.00 0.00 H new ATOM 622 N LYS A 35 -6.960 4.618 9.998 1.00 0.00 N ATOM 623 CA LYS A 35 -6.153 4.394 11.186 1.00 0.00 C ATOM 624 C LYS A 35 -6.108 2.895 11.491 1.00 0.00 C ATOM 625 O LYS A 35 -6.884 2.121 10.934 1.00 0.00 O ATOM 626 CB LYS A 35 -6.667 5.243 12.350 1.00 0.00 C ATOM 627 CG LYS A 35 -7.749 4.500 13.136 1.00 0.00 C ATOM 628 CD LYS A 35 -9.069 4.474 12.362 1.00 0.00 C ATOM 629 CE LYS A 35 -10.252 4.761 13.288 1.00 0.00 C ATOM 630 NZ LYS A 35 -11.286 3.712 13.148 1.00 0.00 N ATOM 0 H LYS A 35 -7.817 4.066 9.954 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.126 4.716 11.016 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.840 5.496 13.013 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.069 6.182 11.970 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -7.421 3.480 13.338 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.899 4.983 14.101 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -9.041 5.214 11.562 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -9.199 3.500 11.891 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.909 4.807 14.322 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -10.679 5.735 13.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -12.209 4.094 13.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -11.334 3.402 12.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -11.043 2.902 13.753 1.00 0.00 H new ATOM 644 N PRO A 36 -5.167 2.522 12.399 1.00 0.00 N ATOM 645 CA PRO A 36 -5.010 1.130 12.785 1.00 0.00 C ATOM 646 C PRO A 36 -6.137 0.690 13.721 1.00 0.00 C ATOM 647 O PRO A 36 -6.040 0.858 14.936 1.00 0.00 O ATOM 648 CB PRO A 36 -3.636 1.054 13.432 1.00 0.00 C ATOM 649 CG PRO A 36 -3.270 2.481 13.803 1.00 0.00 C ATOM 650 CD PRO A 36 -4.230 3.412 13.079 1.00 0.00 C ATOM 0 HA PRO A 36 -5.075 0.448 11.937 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.655 0.414 14.314 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.904 0.629 12.745 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.339 2.625 14.881 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.240 2.697 13.518 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.746 4.071 13.778 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.703 4.050 12.369 1.00 0.00 H new ATOM 658 N GLY A 37 -7.180 0.136 13.121 1.00 0.00 N ATOM 659 CA GLY A 37 -8.324 -0.328 13.886 1.00 0.00 C ATOM 660 C GLY A 37 -9.590 -0.339 13.027 1.00 0.00 C ATOM 661 O GLY A 37 -10.625 0.188 13.433 1.00 0.00 O ATOM 0 H GLY A 37 -7.257 -0.002 12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -8.129 -1.331 14.266 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.473 0.317 14.752 1.00 0.00 H new ATOM 665 N ASP A 38 -9.467 -0.945 11.855 1.00 0.00 N ATOM 666 CA ASP A 38 -10.589 -1.031 10.935 1.00 0.00 C ATOM 667 C ASP A 38 -10.293 -2.094 9.875 1.00 0.00 C ATOM 668 O ASP A 38 -9.317 -2.834 9.989 1.00 0.00 O ATOM 669 CB ASP A 38 -10.816 0.301 10.218 1.00 0.00 C ATOM 670 CG ASP A 38 -12.100 1.035 10.610 1.00 0.00 C ATOM 671 OD1 ASP A 38 -13.088 0.330 10.910 1.00 0.00 O ATOM 672 OD2 ASP A 38 -12.065 2.285 10.601 1.00 0.00 O ATOM 0 H ASP A 38 -8.608 -1.381 11.521 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.479 -1.287 11.511 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.966 0.954 10.418 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.832 0.120 9.143 1.00 0.00 H new ATOM 677 N VAL A 39 -11.153 -2.135 8.868 1.00 0.00 N ATOM 678 CA VAL A 39 -10.996 -3.095 7.789 1.00 0.00 C ATOM 679 C VAL A 39 -11.308 -2.412 6.456 1.00 0.00 C ATOM 680 O VAL A 39 -12.177 -1.544 6.388 1.00 0.00 O ATOM 681 CB VAL A 39 -11.869 -4.324 8.050 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.625 -5.404 6.995 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.637 -4.871 9.460 1.00 0.00 C ATOM 0 H VAL A 39 -11.961 -1.519 8.777 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.966 -3.450 7.740 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.912 -4.016 7.978 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.258 -6.266 7.204 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.864 -5.009 6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.578 -5.707 7.020 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.269 -5.744 9.620 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.591 -5.155 9.572 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.885 -4.104 10.193 1.00 0.00 H new ATOM 693 N ILE A 40 -10.583 -2.831 5.429 1.00 0.00 N ATOM 694 CA ILE A 40 -10.772 -2.271 4.102 1.00 0.00 C ATOM 695 C ILE A 40 -11.084 -3.399 3.116 1.00 0.00 C ATOM 696 O ILE A 40 -10.245 -4.264 2.872 1.00 0.00 O ATOM 697 CB ILE A 40 -9.564 -1.421 3.702 1.00 0.00 C ATOM 698 CG1 ILE A 40 -9.218 -0.410 4.796 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.793 -0.745 2.348 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.703 -0.287 4.971 1.00 0.00 C ATOM 0 H ILE A 40 -9.864 -3.552 5.489 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.626 -1.594 4.093 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.704 -2.081 3.591 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.638 0.563 4.543 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.672 -0.718 5.738 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.920 -0.147 2.087 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -9.953 -1.506 1.584 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.670 -0.100 2.407 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.485 0.438 5.755 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.289 -1.256 5.248 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.254 0.045 4.035 1.00 0.00 H new ATOM 712 N SER A 41 -12.293 -3.352 2.577 1.00 0.00 N ATOM 713 CA SER A 41 -12.727 -4.359 1.623 1.00 0.00 C ATOM 714 C SER A 41 -12.317 -3.950 0.207 1.00 0.00 C ATOM 715 O SER A 41 -12.484 -2.795 -0.182 1.00 0.00 O ATOM 716 CB SER A 41 -14.240 -4.573 1.698 1.00 0.00 C ATOM 717 OG SER A 41 -14.962 -3.482 1.132 1.00 0.00 O ATOM 0 H SER A 41 -12.986 -2.632 2.783 1.00 0.00 H new ATOM 0 HA SER A 41 -12.242 -5.302 1.876 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.503 -5.492 1.174 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.537 -4.703 2.739 1.00 0.00 H new ATOM 0 HG SER A 41 -15.700 -3.826 0.586 1.00 0.00 H new ATOM 723 N PHE A 42 -11.790 -4.920 -0.526 1.00 0.00 N ATOM 724 CA PHE A 42 -11.355 -4.675 -1.890 1.00 0.00 C ATOM 725 C PHE A 42 -12.243 -5.418 -2.890 1.00 0.00 C ATOM 726 O PHE A 42 -12.336 -6.644 -2.851 1.00 0.00 O ATOM 727 CB PHE A 42 -9.924 -5.203 -2.006 1.00 0.00 C ATOM 728 CG PHE A 42 -8.868 -4.273 -1.405 1.00 0.00 C ATOM 729 CD1 PHE A 42 -8.955 -2.930 -1.598 1.00 0.00 C ATOM 730 CD2 PHE A 42 -7.841 -4.791 -0.678 1.00 0.00 C ATOM 731 CE1 PHE A 42 -7.974 -2.068 -1.040 1.00 0.00 C ATOM 732 CE2 PHE A 42 -6.860 -3.928 -0.121 1.00 0.00 C ATOM 733 CZ PHE A 42 -6.948 -2.585 -0.314 1.00 0.00 C ATOM 0 H PHE A 42 -11.655 -5.877 -0.201 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.414 -3.610 -2.113 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -9.864 -6.172 -1.511 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.692 -5.367 -3.058 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.770 -2.519 -2.175 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.772 -5.858 -0.525 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.043 -1.001 -1.193 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.044 -4.338 0.456 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.202 -1.929 0.110 1.00 0.00 H new ATOM 743 N GLU A 43 -12.873 -4.645 -3.763 1.00 0.00 N ATOM 744 CA GLU A 43 -13.750 -5.215 -4.771 1.00 0.00 C ATOM 745 C GLU A 43 -15.003 -5.800 -4.115 1.00 0.00 C ATOM 746 O GLU A 43 -15.432 -6.900 -4.460 1.00 0.00 O ATOM 747 CB GLU A 43 -13.019 -6.275 -5.598 1.00 0.00 C ATOM 748 CG GLU A 43 -11.790 -5.679 -6.287 1.00 0.00 C ATOM 749 CD GLU A 43 -12.187 -4.909 -7.548 1.00 0.00 C ATOM 750 OE1 GLU A 43 -12.540 -5.584 -8.539 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.129 -3.661 -7.492 1.00 0.00 O ATOM 0 H GLU A 43 -12.793 -3.629 -3.793 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.056 -4.419 -5.450 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.715 -7.099 -4.953 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.695 -6.688 -6.346 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.270 -5.013 -5.598 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.093 -6.475 -6.547 1.00 0.00 H new ATOM 758 N GLY A 44 -15.555 -5.038 -3.183 1.00 0.00 N ATOM 759 CA GLY A 44 -16.750 -5.467 -2.476 1.00 0.00 C ATOM 760 C GLY A 44 -16.388 -6.253 -1.214 1.00 0.00 C ATOM 761 O GLY A 44 -16.687 -5.821 -0.102 1.00 0.00 O ATOM 0 H GLY A 44 -15.197 -4.126 -2.901 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.350 -4.597 -2.208 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.362 -6.086 -3.132 1.00 0.00 H new ATOM 765 N GLY A 45 -15.750 -7.394 -1.429 1.00 0.00 N ATOM 766 CA GLY A 45 -15.345 -8.245 -0.323 1.00 0.00 C ATOM 767 C GLY A 45 -14.456 -9.391 -0.810 1.00 0.00 C ATOM 768 O GLY A 45 -14.437 -10.465 -0.211 1.00 0.00 O ATOM 0 H GLY A 45 -15.503 -7.749 -2.353 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.808 -7.653 0.418 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.228 -8.650 0.171 1.00 0.00 H new ATOM 772 N LYS A 46 -13.740 -9.123 -1.893 1.00 0.00 N ATOM 773 CA LYS A 46 -12.851 -10.118 -2.467 1.00 0.00 C ATOM 774 C LYS A 46 -11.581 -10.212 -1.619 1.00 0.00 C ATOM 775 O LYS A 46 -11.061 -11.303 -1.390 1.00 0.00 O ATOM 776 CB LYS A 46 -12.584 -9.811 -3.942 1.00 0.00 C ATOM 777 CG LYS A 46 -12.246 -11.087 -4.715 1.00 0.00 C ATOM 778 CD LYS A 46 -10.814 -11.041 -5.251 1.00 0.00 C ATOM 779 CE LYS A 46 -10.574 -12.156 -6.271 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.975 -13.466 -5.711 1.00 0.00 N ATOM 0 H LYS A 46 -13.758 -8.231 -2.387 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.320 -11.102 -2.450 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.460 -9.336 -4.383 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.761 -9.102 -4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.367 -11.953 -4.064 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.944 -11.210 -5.543 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.626 -10.073 -5.715 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.109 -11.141 -4.425 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.141 -11.954 -7.180 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.521 -12.180 -6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.552 -14.229 -6.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.644 -13.539 -4.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.011 -13.551 -5.735 1.00 0.00 H new ATOM 794 N LEU A 47 -11.117 -9.052 -1.175 1.00 0.00 N ATOM 795 CA LEU A 47 -9.918 -8.989 -0.357 1.00 0.00 C ATOM 796 C LEU A 47 -10.142 -8.006 0.794 1.00 0.00 C ATOM 797 O LEU A 47 -10.269 -6.803 0.572 1.00 0.00 O ATOM 798 CB LEU A 47 -8.698 -8.659 -1.219 1.00 0.00 C ATOM 799 CG LEU A 47 -7.418 -9.430 -0.893 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.803 -8.942 0.420 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.674 -10.939 -0.879 1.00 0.00 C ATOM 0 H LEU A 47 -11.550 -8.149 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.710 -9.961 0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.954 -8.844 -2.262 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.490 -7.593 -1.126 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.692 -9.234 -1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.894 -9.507 0.628 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.561 -7.883 0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.515 -9.089 1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.747 -11.463 -0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.425 -11.174 -0.124 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.033 -11.256 -1.858 1.00 0.00 H new ATOM 813 N LYS A 48 -10.184 -8.555 1.999 1.00 0.00 N ATOM 814 CA LYS A 48 -10.391 -7.742 3.185 1.00 0.00 C ATOM 815 C LYS A 48 -9.066 -7.597 3.936 1.00 0.00 C ATOM 816 O LYS A 48 -8.377 -8.586 4.183 1.00 0.00 O ATOM 817 CB LYS A 48 -11.522 -8.317 4.040 1.00 0.00 C ATOM 818 CG LYS A 48 -12.761 -8.603 3.188 1.00 0.00 C ATOM 819 CD LYS A 48 -13.741 -7.429 3.235 1.00 0.00 C ATOM 820 CE LYS A 48 -15.187 -7.918 3.125 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.749 -8.179 4.469 1.00 0.00 N ATOM 0 H LYS A 48 -10.078 -9.553 2.179 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.713 -6.738 2.906 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.188 -9.236 4.522 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.776 -7.615 4.834 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.462 -8.791 2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.253 -9.507 3.547 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.609 -6.878 4.166 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.524 -6.737 2.421 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.792 -7.171 2.610 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.225 -8.827 2.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.731 -8.510 4.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.181 -8.908 4.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.730 -7.303 5.029 1.00 0.00 H new ATOM 835 N VAL A 49 -8.749 -6.357 4.279 1.00 0.00 N ATOM 836 CA VAL A 49 -7.518 -6.070 4.997 1.00 0.00 C ATOM 837 C VAL A 49 -7.837 -5.216 6.225 1.00 0.00 C ATOM 838 O VAL A 49 -8.865 -4.542 6.267 1.00 0.00 O ATOM 839 CB VAL A 49 -6.506 -5.412 4.057 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.434 -6.155 2.721 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.835 -3.933 3.846 1.00 0.00 C ATOM 0 H VAL A 49 -9.323 -5.539 4.073 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.059 -6.992 5.353 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.524 -5.473 4.526 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.707 -5.667 2.072 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -6.129 -7.187 2.895 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.414 -6.141 2.244 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.100 -3.489 3.174 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.829 -3.840 3.409 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.810 -3.414 4.804 1.00 0.00 H new ATOM 851 N ARG A 50 -6.937 -5.272 7.195 1.00 0.00 N ATOM 852 CA ARG A 50 -7.109 -4.512 8.422 1.00 0.00 C ATOM 853 C ARG A 50 -5.832 -3.735 8.748 1.00 0.00 C ATOM 854 O ARG A 50 -4.787 -4.330 9.003 1.00 0.00 O ATOM 855 CB ARG A 50 -7.453 -5.431 9.596 1.00 0.00 C ATOM 856 CG ARG A 50 -7.097 -4.772 10.930 1.00 0.00 C ATOM 857 CD ARG A 50 -7.813 -5.465 12.091 1.00 0.00 C ATOM 858 NE ARG A 50 -6.903 -6.436 12.739 1.00 0.00 N ATOM 859 CZ ARG A 50 -7.316 -7.464 13.493 1.00 0.00 C ATOM 860 NH1 ARG A 50 -8.625 -7.661 13.698 1.00 0.00 N ATOM 861 NH2 ARG A 50 -6.419 -8.295 14.042 1.00 0.00 N ATOM 0 H ARG A 50 -6.086 -5.832 7.157 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.933 -3.815 8.268 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.516 -5.670 9.576 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.913 -6.373 9.496 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.019 -4.815 11.085 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.373 -3.718 10.904 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.146 -4.724 12.818 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.704 -5.976 11.727 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.899 -6.315 12.603 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.308 -7.029 13.280 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.939 -8.443 14.272 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.422 -8.145 13.886 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.733 -9.077 14.616 1.00 0.00 H new ATOM 875 N VAL A 51 -5.959 -2.416 8.730 1.00 0.00 N ATOM 876 CA VAL A 51 -4.829 -1.551 9.021 1.00 0.00 C ATOM 877 C VAL A 51 -4.144 -2.028 10.303 1.00 0.00 C ATOM 878 O VAL A 51 -4.811 -2.329 11.292 1.00 0.00 O ATOM 879 CB VAL A 51 -5.290 -0.094 9.096 1.00 0.00 C ATOM 880 CG1 VAL A 51 -4.140 0.824 9.515 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.896 0.358 7.766 1.00 0.00 C ATOM 0 H VAL A 51 -6.828 -1.926 8.518 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.092 -1.603 8.220 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.067 -0.027 9.858 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.495 1.854 9.561 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.773 0.523 10.496 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.332 0.750 8.787 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.216 1.397 7.846 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.150 0.268 6.977 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.755 -0.268 7.526 1.00 0.00 H new ATOM 891 N LYS A 52 -2.821 -2.082 10.245 1.00 0.00 N ATOM 892 CA LYS A 52 -2.039 -2.517 11.389 1.00 0.00 C ATOM 893 C LYS A 52 -1.440 -1.294 12.087 1.00 0.00 C ATOM 894 O LYS A 52 -1.468 -1.198 13.313 1.00 0.00 O ATOM 895 CB LYS A 52 -0.997 -3.553 10.963 1.00 0.00 C ATOM 896 CG LYS A 52 -1.471 -4.972 11.289 1.00 0.00 C ATOM 897 CD LYS A 52 -0.589 -5.611 12.363 1.00 0.00 C ATOM 898 CE LYS A 52 -1.043 -5.194 13.764 1.00 0.00 C ATOM 899 NZ LYS A 52 -1.694 -6.329 14.456 1.00 0.00 N ATOM 0 H LYS A 52 -2.271 -1.832 9.423 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.676 -3.020 12.117 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.808 -3.465 9.893 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.053 -3.355 11.471 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.505 -4.944 11.632 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.451 -5.582 10.386 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.628 -6.697 12.272 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.449 -5.315 12.210 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.186 -4.850 14.343 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.737 -4.356 13.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -1.996 -6.030 15.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.523 -6.639 13.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.021 -7.117 14.540 1.00 0.00 H new ATOM 913 N ALA A 53 -0.911 -0.389 11.275 1.00 0.00 N ATOM 914 CA ALA A 53 -0.306 0.823 11.799 1.00 0.00 C ATOM 915 C ALA A 53 -0.061 1.803 10.650 1.00 0.00 C ATOM 916 O ALA A 53 -0.236 1.454 9.484 1.00 0.00 O ATOM 917 CB ALA A 53 0.980 0.470 12.549 1.00 0.00 C ATOM 0 H ALA A 53 -0.889 -0.472 10.259 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.974 1.309 12.510 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.433 1.380 12.942 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.747 -0.204 13.373 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.677 -0.017 11.867 1.00 0.00 H new ATOM 923 N ILE A 54 0.341 3.010 11.020 1.00 0.00 N ATOM 924 CA ILE A 54 0.612 4.043 10.034 1.00 0.00 C ATOM 925 C ILE A 54 2.024 4.592 10.252 1.00 0.00 C ATOM 926 O ILE A 54 2.521 4.607 11.377 1.00 0.00 O ATOM 927 CB ILE A 54 -0.477 5.117 10.069 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.613 5.805 8.710 1.00 0.00 C ATOM 929 CG2 ILE A 54 -0.222 6.120 11.197 1.00 0.00 C ATOM 930 CD1 ILE A 54 -2.050 5.717 8.192 1.00 0.00 C ATOM 0 H ILE A 54 0.486 3.296 11.988 1.00 0.00 H new ATOM 0 HA ILE A 54 0.583 3.625 9.028 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.429 4.631 10.280 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.317 6.851 8.797 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.065 5.340 7.994 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.010 6.873 11.200 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.216 5.598 12.154 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.742 6.605 11.042 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.119 6.214 7.224 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.334 4.670 8.083 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.722 6.204 8.899 1.00 0.00 H new ATOM 942 N ARG A 55 2.630 5.028 9.158 1.00 0.00 N ATOM 943 CA ARG A 55 3.975 5.576 9.215 1.00 0.00 C ATOM 944 C ARG A 55 4.172 6.615 8.110 1.00 0.00 C ATOM 945 O ARG A 55 3.505 6.563 7.077 1.00 0.00 O ATOM 946 CB ARG A 55 5.025 4.474 9.063 1.00 0.00 C ATOM 947 CG ARG A 55 5.693 4.164 10.404 1.00 0.00 C ATOM 948 CD ARG A 55 5.818 2.654 10.618 1.00 0.00 C ATOM 949 NE ARG A 55 6.966 2.362 11.506 1.00 0.00 N ATOM 950 CZ ARG A 55 7.307 1.132 11.912 1.00 0.00 C ATOM 951 NH1 ARG A 55 6.592 0.071 11.512 1.00 0.00 N ATOM 952 NH2 ARG A 55 8.365 0.961 12.717 1.00 0.00 N ATOM 0 H ARG A 55 2.215 5.013 8.227 1.00 0.00 H new ATOM 0 HA ARG A 55 4.100 6.049 10.189 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.556 3.572 8.669 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.780 4.783 8.340 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.681 4.623 10.437 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.111 4.603 11.214 1.00 0.00 H new ATOM 0 HD2 ARG A 55 4.900 2.263 11.057 1.00 0.00 H new ATOM 0 HD3 ARG A 55 5.952 2.152 9.660 1.00 0.00 H new ATOM 0 HE ARG A 55 7.533 3.146 11.829 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.788 0.200 10.898 1.00 0.00 H new ATOM 0 HH12 ARG A 55 6.852 -0.865 11.822 1.00 0.00 H new ATOM 0 HH21 ARG A 55 8.911 1.768 13.021 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.625 0.024 13.026 1.00 0.00 H new ATOM 966 N VAL A 56 5.090 7.536 8.364 1.00 0.00 N ATOM 967 CA VAL A 56 5.383 8.586 7.404 1.00 0.00 C ATOM 968 C VAL A 56 6.897 8.673 7.196 1.00 0.00 C ATOM 969 O VAL A 56 7.668 8.453 8.129 1.00 0.00 O ATOM 970 CB VAL A 56 4.766 9.907 7.868 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.982 11.008 6.828 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.279 9.735 8.184 1.00 0.00 C ATOM 0 H VAL A 56 5.641 7.577 9.222 1.00 0.00 H new ATOM 0 HA VAL A 56 4.935 8.356 6.437 1.00 0.00 H new ATOM 0 HB VAL A 56 5.271 10.210 8.785 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.534 11.936 7.182 1.00 0.00 H new ATOM 0 HG12 VAL A 56 6.051 11.157 6.673 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.516 10.716 5.887 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.864 10.688 8.512 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.754 9.398 7.290 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.158 8.996 8.976 1.00 0.00 H new ATOM 982 N TYR A 57 7.276 8.996 5.969 1.00 0.00 N ATOM 983 CA TYR A 57 8.683 9.115 5.627 1.00 0.00 C ATOM 984 C TYR A 57 8.950 10.400 4.840 1.00 0.00 C ATOM 985 O TYR A 57 8.035 11.189 4.604 1.00 0.00 O ATOM 986 CB TYR A 57 9.006 7.912 4.740 1.00 0.00 C ATOM 987 CG TYR A 57 9.239 6.613 5.514 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.177 5.965 6.111 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.512 6.089 5.615 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.397 4.742 6.839 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.732 4.866 6.343 1.00 0.00 C ATOM 992 CZ TYR A 57 9.663 4.253 6.919 1.00 0.00 C ATOM 993 OH TYR A 57 9.870 3.099 7.607 1.00 0.00 O ATOM 0 H TYR A 57 6.633 9.179 5.199 1.00 0.00 H new ATOM 0 HA TYR A 57 9.295 9.145 6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.187 7.762 4.037 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.895 8.136 4.151 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.181 6.375 6.032 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.343 6.596 5.148 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.575 4.225 7.311 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.723 4.445 6.430 1.00 0.00 H new ATOM 0 HH TYR A 57 9.047 2.567 7.608 1.00 0.00 H new ATOM 1003 N ASN A 58 10.206 10.571 4.455 1.00 0.00 N ATOM 1004 CA ASN A 58 10.604 11.746 3.699 1.00 0.00 C ATOM 1005 C ASN A 58 10.143 11.595 2.248 1.00 0.00 C ATOM 1006 O ASN A 58 9.580 12.524 1.672 1.00 0.00 O ATOM 1007 CB ASN A 58 12.125 11.911 3.697 1.00 0.00 C ATOM 1008 CG ASN A 58 12.539 13.186 4.434 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.810 14.217 3.840 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.573 13.060 5.758 1.00 0.00 N ATOM 0 H ASN A 58 10.962 9.915 4.653 1.00 0.00 H new ATOM 0 HA ASN A 58 10.147 12.618 4.167 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.589 11.046 4.171 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.489 11.946 2.670 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.838 13.855 6.339 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.334 12.168 6.192 1.00 0.00 H new ATOM 1017 N SER A 59 10.399 10.416 1.700 1.00 0.00 N ATOM 1018 CA SER A 59 10.017 10.131 0.327 1.00 0.00 C ATOM 1019 C SER A 59 9.867 8.621 0.129 1.00 0.00 C ATOM 1020 O SER A 59 10.273 7.836 0.984 1.00 0.00 O ATOM 1021 CB SER A 59 11.042 10.696 -0.658 1.00 0.00 C ATOM 1022 OG SER A 59 10.468 11.670 -1.525 1.00 0.00 O ATOM 0 H SER A 59 10.866 9.648 2.181 1.00 0.00 H new ATOM 0 HA SER A 59 9.060 10.614 0.130 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.867 11.144 -0.105 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.460 9.883 -1.252 1.00 0.00 H new ATOM 0 HG SER A 59 11.154 12.008 -2.137 1.00 0.00 H new ATOM 1028 N PHE A 60 9.282 8.261 -1.004 1.00 0.00 N ATOM 1029 CA PHE A 60 9.073 6.859 -1.325 1.00 0.00 C ATOM 1030 C PHE A 60 10.406 6.115 -1.427 1.00 0.00 C ATOM 1031 O PHE A 60 10.506 4.956 -1.030 1.00 0.00 O ATOM 1032 CB PHE A 60 8.371 6.812 -2.684 1.00 0.00 C ATOM 1033 CG PHE A 60 6.951 6.245 -2.631 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.736 4.991 -2.149 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.902 6.994 -3.066 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.418 4.465 -2.099 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.585 6.468 -3.017 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.370 5.215 -2.535 1.00 0.00 C ATOM 0 H PHE A 60 8.946 8.915 -1.711 1.00 0.00 H new ATOM 0 HA PHE A 60 8.481 6.382 -0.544 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.334 7.820 -3.097 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.967 6.209 -3.369 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.568 4.395 -1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.072 7.990 -3.449 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.248 3.470 -1.715 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.753 7.063 -3.363 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.367 4.815 -2.498 1.00 0.00 H new ATOM 1048 N ARG A 61 11.397 6.813 -1.962 1.00 0.00 N ATOM 1049 CA ARG A 61 12.720 6.233 -2.122 1.00 0.00 C ATOM 1050 C ARG A 61 13.266 5.778 -0.767 1.00 0.00 C ATOM 1051 O ARG A 61 13.939 4.752 -0.678 1.00 0.00 O ATOM 1052 CB ARG A 61 13.691 7.239 -2.744 1.00 0.00 C ATOM 1053 CG ARG A 61 14.692 6.537 -3.663 1.00 0.00 C ATOM 1054 CD ARG A 61 16.059 6.407 -2.988 1.00 0.00 C ATOM 1055 NE ARG A 61 16.789 7.691 -3.072 1.00 0.00 N ATOM 1056 CZ ARG A 61 17.532 8.065 -4.123 1.00 0.00 C ATOM 1057 NH1 ARG A 61 17.646 7.256 -5.185 1.00 0.00 N ATOM 1058 NH2 ARG A 61 18.159 9.249 -4.113 1.00 0.00 N ATOM 0 H ARG A 61 11.310 7.775 -2.290 1.00 0.00 H new ATOM 0 HA ARG A 61 12.628 5.375 -2.788 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.134 7.986 -3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.225 7.770 -1.956 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.317 5.548 -3.927 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.793 7.098 -4.592 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.933 6.119 -1.944 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.638 5.618 -3.469 1.00 0.00 H new ATOM 0 HE ARG A 61 16.723 8.331 -2.281 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.167 6.355 -5.194 1.00 0.00 H new ATOM 0 HH12 ARG A 61 18.211 7.541 -5.985 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.071 9.866 -3.305 1.00 0.00 H new ATOM 0 HH22 ARG A 61 18.724 9.533 -4.913 1.00 0.00 H new ATOM 1072 N GLU A 62 12.956 6.563 0.254 1.00 0.00 N ATOM 1073 CA GLU A 62 13.408 6.253 1.600 1.00 0.00 C ATOM 1074 C GLU A 62 12.651 5.042 2.148 1.00 0.00 C ATOM 1075 O GLU A 62 13.201 4.260 2.923 1.00 0.00 O ATOM 1076 CB GLU A 62 13.249 7.463 2.524 1.00 0.00 C ATOM 1077 CG GLU A 62 14.549 8.266 2.603 1.00 0.00 C ATOM 1078 CD GLU A 62 14.515 9.249 3.775 1.00 0.00 C ATOM 1079 OE1 GLU A 62 14.148 8.799 4.883 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.856 10.428 3.538 1.00 0.00 O ATOM 0 H GLU A 62 12.397 7.413 0.177 1.00 0.00 H new ATOM 0 HA GLU A 62 14.469 6.006 1.558 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.445 8.101 2.158 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.962 7.129 3.521 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.394 7.587 2.718 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.702 8.810 1.671 1.00 0.00 H new ATOM 1087 N MET A 63 11.402 4.923 1.725 1.00 0.00 N ATOM 1088 CA MET A 63 10.564 3.820 2.163 1.00 0.00 C ATOM 1089 C MET A 63 10.961 2.518 1.464 1.00 0.00 C ATOM 1090 O MET A 63 11.163 1.495 2.117 1.00 0.00 O ATOM 1091 CB MET A 63 9.099 4.138 1.857 1.00 0.00 C ATOM 1092 CG MET A 63 8.305 4.356 3.147 1.00 0.00 C ATOM 1093 SD MET A 63 6.735 5.120 2.775 1.00 0.00 S ATOM 1094 CE MET A 63 6.074 3.926 1.625 1.00 0.00 C ATOM 0 H MET A 63 10.949 5.573 1.083 1.00 0.00 H new ATOM 0 HA MET A 63 10.700 3.690 3.237 1.00 0.00 H new ATOM 0 HB2 MET A 63 9.039 5.030 1.234 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.657 3.321 1.287 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.145 3.403 3.651 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.873 4.987 3.831 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.017 4.132 1.454 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.614 3.993 0.681 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.186 2.923 2.037 1.00 0.00 H new ATOM 1104 N LEU A 64 11.061 2.599 0.145 1.00 0.00 N ATOM 1105 CA LEU A 64 11.430 1.440 -0.650 1.00 0.00 C ATOM 1106 C LEU A 64 12.817 0.955 -0.223 1.00 0.00 C ATOM 1107 O LEU A 64 13.106 -0.239 -0.282 1.00 0.00 O ATOM 1108 CB LEU A 64 11.323 1.758 -2.142 1.00 0.00 C ATOM 1109 CG LEU A 64 10.033 2.449 -2.590 1.00 0.00 C ATOM 1110 CD1 LEU A 64 10.323 3.532 -3.630 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.011 1.428 -3.095 1.00 0.00 C ATOM 0 H LEU A 64 10.893 3.449 -0.393 1.00 0.00 H new ATOM 0 HA LEU A 64 10.735 0.619 -0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.166 2.391 -2.420 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.426 0.827 -2.700 1.00 0.00 H new ATOM 0 HG LEU A 64 9.593 2.944 -1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.389 4.007 -3.931 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.989 4.280 -3.200 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.798 3.082 -4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.104 1.945 -3.407 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.428 0.884 -3.942 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.772 0.727 -2.296 1.00 0.00 H new ATOM 1123 N GLU A 65 13.638 1.906 0.198 1.00 0.00 N ATOM 1124 CA GLU A 65 14.987 1.590 0.635 1.00 0.00 C ATOM 1125 C GLU A 65 14.963 0.991 2.042 1.00 0.00 C ATOM 1126 O GLU A 65 15.600 -0.030 2.297 1.00 0.00 O ATOM 1127 CB GLU A 65 15.885 2.829 0.581 1.00 0.00 C ATOM 1128 CG GLU A 65 16.409 3.065 -0.836 1.00 0.00 C ATOM 1129 CD GLU A 65 17.899 3.412 -0.819 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.680 2.538 -0.385 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.223 4.544 -1.240 1.00 0.00 O ATOM 0 H GLU A 65 13.395 2.895 0.246 1.00 0.00 H new ATOM 0 HA GLU A 65 15.405 0.849 -0.046 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.326 3.703 0.916 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.723 2.705 1.267 1.00 0.00 H new ATOM 0 HG2 GLU A 65 16.247 2.173 -1.441 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.849 3.874 -1.305 1.00 0.00 H new ATOM 1138 N LYS A 66 14.222 1.652 2.920 1.00 0.00 N ATOM 1139 CA LYS A 66 14.107 1.197 4.295 1.00 0.00 C ATOM 1140 C LYS A 66 13.131 0.020 4.358 1.00 0.00 C ATOM 1141 O LYS A 66 13.530 -1.107 4.644 1.00 0.00 O ATOM 1142 CB LYS A 66 13.728 2.360 5.214 1.00 0.00 C ATOM 1143 CG LYS A 66 14.460 2.261 6.554 1.00 0.00 C ATOM 1144 CD LYS A 66 13.705 3.017 7.649 1.00 0.00 C ATOM 1145 CE LYS A 66 14.155 4.478 7.717 1.00 0.00 C ATOM 1146 NZ LYS A 66 15.401 4.599 8.506 1.00 0.00 N ATOM 0 H LYS A 66 13.696 2.499 2.706 1.00 0.00 H new ATOM 0 HA LYS A 66 15.069 0.834 4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.974 3.305 4.730 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.651 2.359 5.383 1.00 0.00 H new ATOM 0 HG2 LYS A 66 14.567 1.214 6.838 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.466 2.668 6.454 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.633 2.972 7.455 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.875 2.535 8.612 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.316 4.862 6.710 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.371 5.086 8.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 15.693 5.596 8.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 15.235 4.251 9.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.151 4.035 8.059 1.00 0.00 H new ATOM 1160 N GLU A 67 11.870 0.324 4.086 1.00 0.00 N ATOM 1161 CA GLU A 67 10.834 -0.695 4.109 1.00 0.00 C ATOM 1162 C GLU A 67 11.170 -1.816 3.123 1.00 0.00 C ATOM 1163 O GLU A 67 11.006 -2.994 3.437 1.00 0.00 O ATOM 1164 CB GLU A 67 9.463 -0.089 3.804 1.00 0.00 C ATOM 1165 CG GLU A 67 9.096 0.983 4.832 1.00 0.00 C ATOM 1166 CD GLU A 67 8.781 0.355 6.191 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.751 -0.893 6.245 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.579 1.137 7.144 1.00 0.00 O ATOM 0 H GLU A 67 11.543 1.260 3.849 1.00 0.00 H new ATOM 0 HA GLU A 67 10.792 -1.120 5.112 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.468 0.347 2.805 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.706 -0.873 3.805 1.00 0.00 H new ATOM 0 HG2 GLU A 67 9.920 1.689 4.936 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.233 1.549 4.480 1.00 0.00 H new ATOM 1175 N GLY A 68 11.634 -1.409 1.950 1.00 0.00 N ATOM 1176 CA GLY A 68 11.994 -2.364 0.916 1.00 0.00 C ATOM 1177 C GLY A 68 11.110 -2.193 -0.321 1.00 0.00 C ATOM 1178 O GLY A 68 9.887 -2.279 -0.231 1.00 0.00 O ATOM 0 H GLY A 68 11.769 -0.431 1.693 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.040 -2.230 0.641 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.893 -3.378 1.302 1.00 0.00 H new ATOM 1182 N LEU A 69 11.765 -1.952 -1.448 1.00 0.00 N ATOM 1183 CA LEU A 69 11.054 -1.767 -2.701 1.00 0.00 C ATOM 1184 C LEU A 69 10.110 -2.950 -2.927 1.00 0.00 C ATOM 1185 O LEU A 69 8.897 -2.771 -3.025 1.00 0.00 O ATOM 1186 CB LEU A 69 12.041 -1.540 -3.849 1.00 0.00 C ATOM 1187 CG LEU A 69 11.495 -1.771 -5.259 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.605 -0.607 -5.700 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.630 -2.033 -6.251 1.00 0.00 C ATOM 0 H LEU A 69 12.780 -1.881 -1.519 1.00 0.00 H new ATOM 0 HA LEU A 69 10.437 -0.870 -2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.410 -0.516 -3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.898 -2.197 -3.700 1.00 0.00 H new ATOM 0 HG LEU A 69 10.871 -2.665 -5.241 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.230 -0.796 -6.706 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.765 -0.510 -5.012 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.185 0.316 -5.697 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.214 -2.194 -7.246 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.300 -1.174 -6.273 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.186 -2.919 -5.942 1.00 0.00 H new ATOM 1201 N GLU A 70 10.703 -4.133 -3.002 1.00 0.00 N ATOM 1202 CA GLU A 70 9.930 -5.345 -3.214 1.00 0.00 C ATOM 1203 C GLU A 70 9.052 -5.634 -1.995 1.00 0.00 C ATOM 1204 O GLU A 70 8.167 -6.487 -2.052 1.00 0.00 O ATOM 1205 CB GLU A 70 10.845 -6.531 -3.525 1.00 0.00 C ATOM 1206 CG GLU A 70 10.949 -6.763 -5.034 1.00 0.00 C ATOM 1207 CD GLU A 70 11.801 -7.996 -5.342 1.00 0.00 C ATOM 1208 OE1 GLU A 70 12.964 -8.011 -4.883 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.271 -8.895 -6.029 1.00 0.00 O ATOM 0 H GLU A 70 11.709 -4.278 -2.920 1.00 0.00 H new ATOM 0 HA GLU A 70 9.281 -5.193 -4.077 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.837 -6.347 -3.113 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.460 -7.429 -3.041 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.952 -6.891 -5.455 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.386 -5.886 -5.511 1.00 0.00 H new ATOM 1216 N ASN A 71 9.328 -4.909 -0.921 1.00 0.00 N ATOM 1217 CA ASN A 71 8.574 -5.077 0.309 1.00 0.00 C ATOM 1218 C ASN A 71 7.456 -4.034 0.364 1.00 0.00 C ATOM 1219 O ASN A 71 6.759 -3.919 1.371 1.00 0.00 O ATOM 1220 CB ASN A 71 9.468 -4.878 1.535 1.00 0.00 C ATOM 1221 CG ASN A 71 10.613 -5.892 1.549 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.742 -6.734 0.675 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.435 -5.765 2.587 1.00 0.00 N ATOM 0 H ASN A 71 10.064 -4.204 -0.877 1.00 0.00 H new ATOM 0 HA ASN A 71 8.168 -6.088 0.320 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.874 -3.866 1.533 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.874 -4.982 2.443 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.231 -6.395 2.687 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.269 -5.038 3.283 1.00 0.00 H new ATOM 1230 N VAL A 72 7.321 -3.300 -0.730 1.00 0.00 N ATOM 1231 CA VAL A 72 6.300 -2.270 -0.819 1.00 0.00 C ATOM 1232 C VAL A 72 5.617 -2.351 -2.186 1.00 0.00 C ATOM 1233 O VAL A 72 4.392 -2.425 -2.268 1.00 0.00 O ATOM 1234 CB VAL A 72 6.915 -0.898 -0.539 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.854 0.203 -0.605 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.636 -0.885 0.810 1.00 0.00 C ATOM 0 H VAL A 72 7.902 -3.398 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 72 5.532 -2.428 -0.062 1.00 0.00 H new ATOM 0 HB VAL A 72 7.654 -0.698 -1.315 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.318 1.168 -0.402 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.406 0.217 -1.599 1.00 0.00 H new ATOM 0 HG13 VAL A 72 5.081 0.009 0.139 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.064 0.102 0.984 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.927 -1.118 1.604 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.432 -1.630 0.804 1.00 0.00 H new ATOM 1246 N LEU A 73 6.439 -2.335 -3.225 1.00 0.00 N ATOM 1247 CA LEU A 73 5.930 -2.406 -4.584 1.00 0.00 C ATOM 1248 C LEU A 73 6.475 -3.664 -5.263 1.00 0.00 C ATOM 1249 O LEU A 73 7.530 -3.626 -5.893 1.00 0.00 O ATOM 1250 CB LEU A 73 6.242 -1.114 -5.341 1.00 0.00 C ATOM 1251 CG LEU A 73 5.388 -0.840 -6.580 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.249 0.129 -6.257 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.250 -0.343 -7.742 1.00 0.00 C ATOM 0 H LEU A 73 7.455 -2.274 -3.153 1.00 0.00 H new ATOM 0 HA LEU A 73 4.843 -2.491 -4.580 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.128 -0.276 -4.653 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.289 -1.137 -5.644 1.00 0.00 H new ATOM 0 HG LEU A 73 4.933 -1.779 -6.895 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.657 0.307 -7.155 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.614 -0.301 -5.483 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.664 1.073 -5.903 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.618 -0.156 -8.610 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.752 0.580 -7.453 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.995 -1.099 -7.992 1.00 0.00 H new ATOM 1265 N PRO A 74 5.711 -4.778 -5.107 1.00 0.00 N ATOM 1266 CA PRO A 74 6.106 -6.046 -5.698 1.00 0.00 C ATOM 1267 C PRO A 74 5.861 -6.047 -7.208 1.00 0.00 C ATOM 1268 O PRO A 74 4.749 -5.779 -7.660 1.00 0.00 O ATOM 1269 CB PRO A 74 5.288 -7.095 -4.962 1.00 0.00 C ATOM 1270 CG PRO A 74 4.133 -6.346 -4.317 1.00 0.00 C ATOM 1271 CD PRO A 74 4.455 -4.861 -4.367 1.00 0.00 C ATOM 0 HA PRO A 74 7.172 -6.246 -5.592 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.923 -7.859 -5.649 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.891 -7.604 -4.211 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.202 -6.553 -4.845 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.995 -6.672 -3.286 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.664 -4.301 -4.866 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.558 -4.444 -3.365 1.00 0.00 H new ATOM 1279 N GLY A 75 6.918 -6.350 -7.946 1.00 0.00 N ATOM 1280 CA GLY A 75 6.832 -6.390 -9.396 1.00 0.00 C ATOM 1281 C GLY A 75 7.732 -5.326 -10.028 1.00 0.00 C ATOM 1282 O GLY A 75 8.317 -5.553 -11.086 1.00 0.00 O ATOM 0 H GLY A 75 7.839 -6.570 -7.567 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.123 -7.377 -9.754 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.800 -6.230 -9.707 1.00 0.00 H new ATOM 1286 N VAL A 76 7.814 -4.189 -9.353 1.00 0.00 N ATOM 1287 CA VAL A 76 8.633 -3.090 -9.836 1.00 0.00 C ATOM 1288 C VAL A 76 9.923 -3.648 -10.441 1.00 0.00 C ATOM 1289 O VAL A 76 10.379 -4.724 -10.055 1.00 0.00 O ATOM 1290 CB VAL A 76 8.887 -2.091 -8.705 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.932 -2.627 -7.724 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.304 -0.728 -9.261 1.00 0.00 C ATOM 0 H VAL A 76 7.327 -4.005 -8.476 1.00 0.00 H new ATOM 0 HA VAL A 76 8.114 -2.544 -10.624 1.00 0.00 H new ATOM 0 HB VAL A 76 7.953 -1.958 -8.159 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.094 -1.898 -6.930 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.578 -3.562 -7.291 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.870 -2.803 -8.251 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.478 -0.037 -8.437 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.219 -0.837 -9.843 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.512 -0.338 -9.900 1.00 0.00 H new ATOM 1302 N LYS A 77 10.474 -2.892 -11.379 1.00 0.00 N ATOM 1303 CA LYS A 77 11.702 -3.298 -12.041 1.00 0.00 C ATOM 1304 C LYS A 77 12.901 -2.850 -11.202 1.00 0.00 C ATOM 1305 O LYS A 77 13.914 -3.545 -11.140 1.00 0.00 O ATOM 1306 CB LYS A 77 11.731 -2.779 -13.480 1.00 0.00 C ATOM 1307 CG LYS A 77 10.793 -3.592 -14.375 1.00 0.00 C ATOM 1308 CD LYS A 77 11.291 -3.608 -15.821 1.00 0.00 C ATOM 1309 CE LYS A 77 11.036 -4.968 -16.474 1.00 0.00 C ATOM 1310 NZ LYS A 77 11.785 -5.082 -17.745 1.00 0.00 N ATOM 0 H LYS A 77 10.093 -2.001 -11.696 1.00 0.00 H new ATOM 0 HA LYS A 77 11.753 -4.384 -12.116 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.437 -1.729 -13.498 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.748 -2.832 -13.869 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.721 -4.613 -14.000 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.790 -3.167 -14.337 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.788 -2.827 -16.391 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.357 -3.384 -15.845 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.337 -5.766 -15.795 1.00 0.00 H new ATOM 0 HE3 LYS A 77 9.970 -5.094 -16.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 11.600 -6.011 -18.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.479 -4.332 -18.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.803 -4.983 -17.558 1.00 0.00 H new ATOM 1324 N SER A 78 12.746 -1.692 -10.577 1.00 0.00 N ATOM 1325 CA SER A 78 13.802 -1.143 -9.745 1.00 0.00 C ATOM 1326 C SER A 78 13.256 0.006 -8.895 1.00 0.00 C ATOM 1327 O SER A 78 12.175 0.526 -9.169 1.00 0.00 O ATOM 1328 CB SER A 78 14.980 -0.661 -10.595 1.00 0.00 C ATOM 1329 OG SER A 78 15.815 -1.739 -11.009 1.00 0.00 O ATOM 0 H SER A 78 11.904 -1.119 -10.631 1.00 0.00 H new ATOM 0 HA SER A 78 14.163 -1.933 -9.087 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.603 -0.136 -11.473 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.570 0.056 -10.024 1.00 0.00 H new ATOM 0 HG SER A 78 15.384 -2.591 -10.787 1.00 0.00 H new ATOM 1335 N ILE A 79 14.029 0.370 -7.882 1.00 0.00 N ATOM 1336 CA ILE A 79 13.635 1.448 -6.991 1.00 0.00 C ATOM 1337 C ILE A 79 13.295 2.690 -7.818 1.00 0.00 C ATOM 1338 O ILE A 79 12.370 3.428 -7.484 1.00 0.00 O ATOM 1339 CB ILE A 79 14.715 1.691 -5.934 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.996 0.417 -5.135 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.341 2.866 -5.028 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.957 0.697 -3.977 1.00 0.00 C ATOM 0 H ILE A 79 14.926 -0.062 -7.659 1.00 0.00 H new ATOM 0 HA ILE A 79 12.735 1.176 -6.439 1.00 0.00 H new ATOM 0 HB ILE A 79 15.639 1.961 -6.445 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.061 0.013 -4.747 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.423 -0.342 -5.791 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.125 3.017 -4.286 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.231 3.769 -5.629 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.400 2.650 -4.522 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.140 -0.225 -3.425 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.900 1.078 -4.370 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.517 1.438 -3.310 1.00 0.00 H new ATOM 1354 N GLU A 80 14.061 2.880 -8.883 1.00 0.00 N ATOM 1355 CA GLU A 80 13.852 4.019 -9.761 1.00 0.00 C ATOM 1356 C GLU A 80 12.494 3.909 -10.458 1.00 0.00 C ATOM 1357 O GLU A 80 11.731 4.874 -10.495 1.00 0.00 O ATOM 1358 CB GLU A 80 14.985 4.140 -10.782 1.00 0.00 C ATOM 1359 CG GLU A 80 15.895 5.324 -10.453 1.00 0.00 C ATOM 1360 CD GLU A 80 15.860 6.369 -11.570 1.00 0.00 C ATOM 1361 OE1 GLU A 80 16.548 6.135 -12.587 1.00 0.00 O ATOM 1362 OE2 GLU A 80 15.147 7.378 -11.382 1.00 0.00 O ATOM 0 H GLU A 80 14.827 2.265 -9.157 1.00 0.00 H new ATOM 0 HA GLU A 80 13.856 4.925 -9.156 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.569 3.220 -10.793 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.567 4.264 -11.781 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.580 5.779 -9.514 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.917 4.973 -10.310 1.00 0.00 H new ATOM 1369 N GLU A 81 12.234 2.726 -10.995 1.00 0.00 N ATOM 1370 CA GLU A 81 10.983 2.478 -11.690 1.00 0.00 C ATOM 1371 C GLU A 81 9.805 2.601 -10.721 1.00 0.00 C ATOM 1372 O GLU A 81 8.739 3.091 -11.092 1.00 0.00 O ATOM 1373 CB GLU A 81 10.994 1.107 -12.368 1.00 0.00 C ATOM 1374 CG GLU A 81 11.558 1.202 -13.787 1.00 0.00 C ATOM 1375 CD GLU A 81 10.434 1.344 -14.815 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.434 0.609 -14.668 1.00 0.00 O ATOM 1377 OE2 GLU A 81 10.600 2.184 -15.725 1.00 0.00 O ATOM 0 H GLU A 81 12.869 1.928 -10.963 1.00 0.00 H new ATOM 0 HA GLU A 81 10.868 3.231 -12.470 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.593 0.411 -11.780 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.981 0.706 -12.401 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.231 2.056 -13.858 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.148 0.312 -14.008 1.00 0.00 H new ATOM 1384 N GLY A 82 10.036 2.147 -9.498 1.00 0.00 N ATOM 1385 CA GLY A 82 9.008 2.200 -8.473 1.00 0.00 C ATOM 1386 C GLY A 82 8.460 3.620 -8.318 1.00 0.00 C ATOM 1387 O GLY A 82 7.247 3.825 -8.320 1.00 0.00 O ATOM 0 H GLY A 82 10.921 1.741 -9.194 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.197 1.520 -8.731 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.419 1.859 -7.523 1.00 0.00 H new ATOM 1391 N ILE A 83 9.381 4.564 -8.187 1.00 0.00 N ATOM 1392 CA ILE A 83 9.006 5.959 -8.031 1.00 0.00 C ATOM 1393 C ILE A 83 8.116 6.377 -9.203 1.00 0.00 C ATOM 1394 O ILE A 83 7.142 7.106 -9.019 1.00 0.00 O ATOM 1395 CB ILE A 83 10.250 6.833 -7.862 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.758 6.790 -6.419 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.984 8.263 -8.333 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.165 6.193 -6.351 1.00 0.00 C ATOM 0 H ILE A 83 10.386 4.390 -8.186 1.00 0.00 H new ATOM 0 HA ILE A 83 8.422 6.097 -7.121 1.00 0.00 H new ATOM 0 HB ILE A 83 11.040 6.428 -8.494 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.766 7.797 -6.002 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.078 6.197 -5.808 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.885 8.863 -8.202 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.705 8.253 -9.387 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.172 8.694 -7.747 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.502 6.174 -5.315 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.149 5.177 -6.746 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.848 6.802 -6.944 1.00 0.00 H new ATOM 1410 N GLN A 84 8.481 5.897 -10.383 1.00 0.00 N ATOM 1411 CA GLN A 84 7.728 6.212 -11.585 1.00 0.00 C ATOM 1412 C GLN A 84 6.267 5.790 -11.421 1.00 0.00 C ATOM 1413 O GLN A 84 5.359 6.507 -11.840 1.00 0.00 O ATOM 1414 CB GLN A 84 8.355 5.551 -12.814 1.00 0.00 C ATOM 1415 CG GLN A 84 9.145 6.568 -13.641 1.00 0.00 C ATOM 1416 CD GLN A 84 10.280 7.181 -12.818 1.00 0.00 C ATOM 1417 OE1 GLN A 84 11.316 6.576 -12.595 1.00 0.00 O ATOM 1418 NE2 GLN A 84 10.028 8.411 -12.380 1.00 0.00 N ATOM 0 H GLN A 84 9.289 5.292 -10.532 1.00 0.00 H new ATOM 0 HA GLN A 84 7.760 7.291 -11.738 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.014 4.742 -12.500 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.574 5.105 -13.429 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.555 6.082 -14.527 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.477 7.356 -13.990 1.00 0.00 H new ATOM 0 HE21 GLN A 84 9.140 8.860 -12.603 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.723 8.906 -11.821 1.00 0.00 H new ATOM 1427 N VAL A 85 6.084 4.628 -10.812 1.00 0.00 N ATOM 1428 CA VAL A 85 4.749 4.102 -10.587 1.00 0.00 C ATOM 1429 C VAL A 85 3.962 5.076 -9.708 1.00 0.00 C ATOM 1430 O VAL A 85 2.778 5.313 -9.943 1.00 0.00 O ATOM 1431 CB VAL A 85 4.833 2.695 -9.993 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.680 2.440 -9.020 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.865 1.634 -11.095 1.00 0.00 C ATOM 0 H VAL A 85 6.839 4.035 -10.467 1.00 0.00 H new ATOM 0 HA VAL A 85 4.212 4.010 -11.531 1.00 0.00 H new ATOM 0 HB VAL A 85 5.766 2.624 -9.433 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.764 1.433 -8.612 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.723 3.165 -8.207 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.731 2.540 -9.546 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.925 0.643 -10.645 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.958 1.706 -11.695 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.735 1.796 -11.731 1.00 0.00 H new ATOM 1443 N TYR A 86 4.652 5.615 -8.713 1.00 0.00 N ATOM 1444 CA TYR A 86 4.033 6.558 -7.798 1.00 0.00 C ATOM 1445 C TYR A 86 3.851 7.925 -8.460 1.00 0.00 C ATOM 1446 O TYR A 86 3.031 8.729 -8.017 1.00 0.00 O ATOM 1447 CB TYR A 86 5.000 6.699 -6.621 1.00 0.00 C ATOM 1448 CG TYR A 86 5.314 5.380 -5.912 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.370 4.375 -5.874 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.543 5.196 -5.310 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.666 3.134 -5.206 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.839 3.955 -4.642 1.00 0.00 C ATOM 1453 CZ TYR A 86 5.885 2.985 -4.623 1.00 0.00 C ATOM 1454 OH TYR A 86 6.165 1.813 -3.993 1.00 0.00 O ATOM 0 H TYR A 86 5.634 5.416 -8.521 1.00 0.00 H new ATOM 0 HA TYR A 86 3.049 6.205 -7.491 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.931 7.137 -6.980 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.577 7.396 -5.898 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.409 4.519 -6.345 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.282 5.983 -5.340 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.936 2.339 -5.169 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.796 3.798 -4.167 1.00 0.00 H new ATOM 0 HH TYR A 86 6.131 1.947 -3.023 1.00 0.00 H new ATOM 1464 N ARG A 87 4.628 8.147 -9.509 1.00 0.00 N ATOM 1465 CA ARG A 87 4.563 9.404 -10.237 1.00 0.00 C ATOM 1466 C ARG A 87 3.295 9.456 -11.093 1.00 0.00 C ATOM 1467 O ARG A 87 2.585 10.460 -11.096 1.00 0.00 O ATOM 1468 CB ARG A 87 5.786 9.583 -11.137 1.00 0.00 C ATOM 1469 CG ARG A 87 6.337 11.007 -11.036 1.00 0.00 C ATOM 1470 CD ARG A 87 6.828 11.305 -9.618 1.00 0.00 C ATOM 1471 NE ARG A 87 7.905 12.320 -9.658 1.00 0.00 N ATOM 1472 CZ ARG A 87 8.276 13.063 -8.607 1.00 0.00 C ATOM 1473 NH1 ARG A 87 7.660 12.910 -7.427 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.263 13.960 -8.736 1.00 0.00 N ATOM 0 H ARG A 87 5.306 7.478 -9.873 1.00 0.00 H new ATOM 0 HA ARG A 87 4.545 10.211 -9.505 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.559 8.869 -10.853 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.516 9.366 -12.171 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.157 11.135 -11.743 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.562 11.721 -11.314 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.001 11.664 -9.006 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.196 10.391 -9.152 1.00 0.00 H new ATOM 0 HE ARG A 87 8.395 12.462 -10.541 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.908 12.228 -7.329 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.943 13.476 -6.627 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.732 14.077 -9.634 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.546 14.526 -7.936 1.00 0.00 H new ATOM 1488 N ARG A 88 3.051 8.361 -11.798 1.00 0.00 N ATOM 1489 CA ARG A 88 1.882 8.270 -12.656 1.00 0.00 C ATOM 1490 C ARG A 88 0.608 8.191 -11.812 1.00 0.00 C ATOM 1491 O ARG A 88 -0.436 8.706 -12.208 1.00 0.00 O ATOM 1492 CB ARG A 88 1.960 7.041 -13.564 1.00 0.00 C ATOM 1493 CG ARG A 88 2.105 5.759 -12.742 1.00 0.00 C ATOM 1494 CD ARG A 88 1.943 4.520 -13.624 1.00 0.00 C ATOM 1495 NE ARG A 88 3.259 4.102 -14.156 1.00 0.00 N ATOM 1496 CZ ARG A 88 3.420 3.328 -15.238 1.00 0.00 C ATOM 1497 NH1 ARG A 88 2.349 2.884 -15.910 1.00 0.00 N ATOM 1498 NH2 ARG A 88 4.652 2.999 -15.649 1.00 0.00 N ATOM 0 H ARG A 88 3.642 7.530 -11.793 1.00 0.00 H new ATOM 0 HA ARG A 88 1.856 9.166 -13.276 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.063 6.982 -14.180 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.807 7.139 -14.243 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.082 5.741 -12.260 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.358 5.745 -11.949 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.500 3.708 -13.047 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.261 4.736 -14.446 1.00 0.00 H new ATOM 0 HE ARG A 88 4.096 4.423 -13.669 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.411 3.135 -15.598 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.472 2.295 -16.734 1.00 0.00 H new ATOM 0 HH21 ARG A 88 5.467 3.338 -15.138 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.775 2.410 -16.473 1.00 0.00 H new ATOM 1512 N PHE A 89 0.737 7.543 -10.663 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.390 7.390 -9.760 1.00 0.00 C ATOM 1514 C PHE A 89 -0.573 8.638 -8.894 1.00 0.00 C ATOM 1515 O PHE A 89 -1.651 9.229 -8.870 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.079 6.197 -8.854 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.791 4.905 -9.259 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -0.241 4.092 -10.201 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -1.974 4.569 -8.678 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -0.902 2.893 -10.578 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -2.635 3.370 -9.054 1.00 0.00 C ATOM 1522 CZ PHE A 89 -2.085 2.557 -9.996 1.00 0.00 C ATOM 0 H PHE A 89 1.605 7.118 -10.337 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.306 7.239 -10.331 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.997 6.023 -8.857 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.359 6.448 -7.831 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.699 4.359 -10.662 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.411 5.214 -7.930 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -0.466 2.248 -11.326 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.574 3.103 -8.592 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.588 1.645 -10.282 1.00 0.00 H new ATOM 1532 N TYR A 90 0.498 9.003 -8.205 1.00 0.00 N ATOM 1533 CA TYR A 90 0.470 10.170 -7.340 1.00 0.00 C ATOM 1534 C TYR A 90 1.232 11.338 -7.971 1.00 0.00 C ATOM 1535 O TYR A 90 2.256 11.136 -8.622 1.00 0.00 O ATOM 1536 CB TYR A 90 1.176 9.755 -6.048 1.00 0.00 C ATOM 1537 CG TYR A 90 0.944 8.295 -5.654 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.291 7.713 -5.856 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.971 7.559 -5.098 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.509 6.339 -5.485 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.753 6.185 -4.728 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.524 5.642 -4.940 1.00 0.00 C ATOM 1543 OH TYR A 90 0.319 4.344 -4.590 1.00 0.00 O ATOM 0 H TYR A 90 1.391 8.511 -8.228 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.556 10.496 -7.169 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.247 9.925 -6.161 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.835 10.398 -5.237 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.094 8.288 -6.292 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.938 8.014 -4.941 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.471 5.872 -5.636 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.548 5.598 -4.292 1.00 0.00 H new ATOM 0 HH TYR A 90 1.144 3.972 -4.215 1.00 0.00 H new ATOM 1553 N ASP A 91 0.703 12.533 -7.755 1.00 0.00 N ATOM 1554 CA ASP A 91 1.321 13.733 -8.294 1.00 0.00 C ATOM 1555 C ASP A 91 2.705 13.915 -7.667 1.00 0.00 C ATOM 1556 O ASP A 91 2.907 13.592 -6.497 1.00 0.00 O ATOM 1557 CB ASP A 91 0.488 14.975 -7.969 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.026 14.757 -7.974 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.441 13.661 -8.411 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.736 15.691 -7.541 1.00 0.00 O ATOM 0 H ASP A 91 -0.146 12.696 -7.214 1.00 0.00 H new ATOM 0 HA ASP A 91 1.392 13.619 -9.376 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.783 15.346 -6.987 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.730 15.755 -8.690 1.00 0.00 H new ATOM 1565 N GLU A 92 3.621 14.431 -8.472 1.00 0.00 N ATOM 1566 CA GLU A 92 4.980 14.660 -8.011 1.00 0.00 C ATOM 1567 C GLU A 92 5.005 15.777 -6.966 1.00 0.00 C ATOM 1568 O GLU A 92 5.794 15.733 -6.024 1.00 0.00 O ATOM 1569 CB GLU A 92 5.909 14.984 -9.182 1.00 0.00 C ATOM 1570 CG GLU A 92 5.359 16.144 -10.015 1.00 0.00 C ATOM 1571 CD GLU A 92 6.301 17.348 -9.966 1.00 0.00 C ATOM 1572 OE1 GLU A 92 6.713 17.702 -8.840 1.00 0.00 O ATOM 1573 OE2 GLU A 92 6.589 17.888 -11.056 1.00 0.00 O ATOM 0 H GLU A 92 3.449 14.697 -9.441 1.00 0.00 H new ATOM 0 HA GLU A 92 5.343 13.744 -7.544 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.899 15.240 -8.805 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.026 14.103 -9.812 1.00 0.00 H new ATOM 0 HG2 GLU A 92 5.226 15.824 -11.048 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.376 16.431 -9.641 1.00 0.00 H new ATOM 1580 N GLU A 93 4.132 16.753 -7.169 1.00 0.00 N ATOM 1581 CA GLU A 93 4.044 17.880 -6.256 1.00 0.00 C ATOM 1582 C GLU A 93 3.342 17.462 -4.963 1.00 0.00 C ATOM 1583 O GLU A 93 3.873 17.664 -3.871 1.00 0.00 O ATOM 1584 CB GLU A 93 3.326 19.062 -6.912 1.00 0.00 C ATOM 1585 CG GLU A 93 4.218 20.305 -6.927 1.00 0.00 C ATOM 1586 CD GLU A 93 3.777 21.310 -5.861 1.00 0.00 C ATOM 1587 OE1 GLU A 93 4.115 21.071 -4.682 1.00 0.00 O ATOM 1588 OE2 GLU A 93 3.111 22.294 -6.250 1.00 0.00 O ATOM 0 H GLU A 93 3.479 16.787 -7.952 1.00 0.00 H new ATOM 0 HA GLU A 93 5.056 18.203 -6.009 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.044 18.800 -7.932 1.00 0.00 H new ATOM 0 HB3 GLU A 93 2.404 19.278 -6.372 1.00 0.00 H new ATOM 0 HG2 GLU A 93 5.254 20.015 -6.752 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.179 20.773 -7.911 1.00 0.00 H new ATOM 1595 N LYS A 94 2.160 16.887 -5.127 1.00 0.00 N ATOM 1596 CA LYS A 94 1.380 16.439 -3.986 1.00 0.00 C ATOM 1597 C LYS A 94 2.230 15.495 -3.133 1.00 0.00 C ATOM 1598 O LYS A 94 2.234 15.594 -1.907 1.00 0.00 O ATOM 1599 CB LYS A 94 0.057 15.826 -4.449 1.00 0.00 C ATOM 1600 CG LYS A 94 0.174 14.306 -4.584 1.00 0.00 C ATOM 1601 CD LYS A 94 -1.193 13.673 -4.851 1.00 0.00 C ATOM 1602 CE LYS A 94 -2.138 13.889 -3.667 1.00 0.00 C ATOM 1603 NZ LYS A 94 -3.310 14.693 -4.080 1.00 0.00 N ATOM 0 H LYS A 94 1.723 16.721 -6.034 1.00 0.00 H new ATOM 0 HA LYS A 94 1.109 17.284 -3.354 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.731 16.072 -3.737 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.233 16.258 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.857 14.061 -5.397 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.601 13.888 -3.672 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.628 14.105 -5.752 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.074 12.605 -5.036 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.469 12.926 -3.278 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.609 14.395 -2.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.941 14.830 -3.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.990 15.619 -4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.823 14.196 -4.835 1.00 0.00 H new ATOM 1617 N GLU A 95 2.929 14.600 -3.815 1.00 0.00 N ATOM 1618 CA GLU A 95 3.781 13.639 -3.135 1.00 0.00 C ATOM 1619 C GLU A 95 4.904 14.360 -2.387 1.00 0.00 C ATOM 1620 O GLU A 95 5.103 14.138 -1.194 1.00 0.00 O ATOM 1621 CB GLU A 95 4.347 12.614 -4.120 1.00 0.00 C ATOM 1622 CG GLU A 95 4.851 11.369 -3.387 1.00 0.00 C ATOM 1623 CD GLU A 95 6.312 11.536 -2.963 1.00 0.00 C ATOM 1624 OE1 GLU A 95 7.183 11.310 -3.830 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.524 11.885 -1.782 1.00 0.00 O ATOM 0 H GLU A 95 2.923 14.520 -4.832 1.00 0.00 H new ATOM 0 HA GLU A 95 3.176 13.098 -2.407 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.577 12.331 -4.838 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.163 13.062 -4.687 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.233 11.184 -2.509 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.754 10.497 -4.034 1.00 0.00 H new ATOM 1632 N LYS A 96 5.609 15.209 -3.120 1.00 0.00 N ATOM 1633 CA LYS A 96 6.707 15.965 -2.542 1.00 0.00 C ATOM 1634 C LYS A 96 6.157 16.928 -1.487 1.00 0.00 C ATOM 1635 O LYS A 96 6.899 17.403 -0.629 1.00 0.00 O ATOM 1636 CB LYS A 96 7.520 16.653 -3.639 1.00 0.00 C ATOM 1637 CG LYS A 96 8.687 15.773 -4.091 1.00 0.00 C ATOM 1638 CD LYS A 96 10.001 16.556 -4.081 1.00 0.00 C ATOM 1639 CE LYS A 96 10.517 16.779 -5.504 1.00 0.00 C ATOM 1640 NZ LYS A 96 11.992 16.658 -5.545 1.00 0.00 N ATOM 0 H LYS A 96 5.441 15.390 -4.110 1.00 0.00 H new ATOM 0 HA LYS A 96 7.403 15.298 -2.034 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.876 16.874 -4.490 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.900 17.606 -3.271 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.770 14.908 -3.433 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.493 15.393 -5.094 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.852 17.517 -3.590 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.747 16.014 -3.500 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.067 16.050 -6.179 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.217 17.766 -5.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.326 16.812 -6.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.416 17.370 -4.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.271 15.707 -5.230 1.00 0.00 H new ATOM 1654 N LYS A 97 4.862 17.188 -1.587 1.00 0.00 N ATOM 1655 CA LYS A 97 4.205 18.086 -0.653 1.00 0.00 C ATOM 1656 C LYS A 97 4.180 17.443 0.735 1.00 0.00 C ATOM 1657 O LYS A 97 4.701 18.009 1.695 1.00 0.00 O ATOM 1658 CB LYS A 97 2.821 18.481 -1.172 1.00 0.00 C ATOM 1659 CG LYS A 97 2.259 19.669 -0.388 1.00 0.00 C ATOM 1660 CD LYS A 97 0.925 20.132 -0.977 1.00 0.00 C ATOM 1661 CE LYS A 97 1.141 20.919 -2.271 1.00 0.00 C ATOM 1662 NZ LYS A 97 0.090 21.949 -2.433 1.00 0.00 N ATOM 0 H LYS A 97 4.250 16.792 -2.301 1.00 0.00 H new ATOM 0 HA LYS A 97 4.764 19.017 -0.564 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.885 18.736 -2.230 1.00 0.00 H new ATOM 0 HB3 LYS A 97 2.142 17.632 -1.089 1.00 0.00 H new ATOM 0 HG2 LYS A 97 2.122 19.388 0.656 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.974 20.492 -0.406 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.291 19.268 -1.174 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.400 20.754 -0.252 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.123 21.392 -2.256 1.00 0.00 H new ATOM 0 HE3 LYS A 97 1.127 20.240 -3.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 0.252 22.474 -3.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -0.843 21.491 -2.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.122 22.607 -1.628 1.00 0.00 H new ATOM 1676 N TYR A 98 3.570 16.268 0.797 1.00 0.00 N ATOM 1677 CA TYR A 98 3.471 15.542 2.051 1.00 0.00 C ATOM 1678 C TYR A 98 4.588 14.503 2.173 1.00 0.00 C ATOM 1679 O TYR A 98 5.345 14.511 3.143 1.00 0.00 O ATOM 1680 CB TYR A 98 2.123 14.820 2.016 1.00 0.00 C ATOM 1681 CG TYR A 98 0.917 15.759 1.937 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.652 16.630 2.975 1.00 0.00 C ATOM 1683 CD2 TYR A 98 0.094 15.735 0.829 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.483 17.513 2.901 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.040 16.618 0.756 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.273 17.464 1.795 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.345 18.298 1.726 1.00 0.00 O ATOM 0 H TYR A 98 3.140 15.801 -0.001 1.00 0.00 H new ATOM 0 HA TYR A 98 3.558 16.224 2.896 1.00 0.00 H new ATOM 0 HB2 TYR A 98 2.104 14.148 1.158 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.031 14.201 2.908 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.296 16.649 3.842 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.301 15.054 0.017 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.702 18.199 3.706 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.692 16.609 -0.105 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.818 18.154 0.880 1.00 0.00 H new ATOM 1697 N GLY A 99 4.657 13.635 1.175 1.00 0.00 N ATOM 1698 CA GLY A 99 5.669 12.592 1.158 1.00 0.00 C ATOM 1699 C GLY A 99 5.033 11.214 0.965 1.00 0.00 C ATOM 1700 O GLY A 99 4.103 11.061 0.174 1.00 0.00 O ATOM 0 H GLY A 99 4.028 13.632 0.372 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.381 12.784 0.355 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.230 12.610 2.092 1.00 0.00 H new ATOM 1704 N VAL A 100 5.560 10.246 1.700 1.00 0.00 N ATOM 1705 CA VAL A 100 5.055 8.886 1.619 1.00 0.00 C ATOM 1706 C VAL A 100 4.741 8.378 3.028 1.00 0.00 C ATOM 1707 O VAL A 100 5.322 8.848 4.005 1.00 0.00 O ATOM 1708 CB VAL A 100 6.056 8.000 0.875 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.390 6.712 0.385 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.702 8.759 -0.286 1.00 0.00 C ATOM 0 H VAL A 100 6.332 10.376 2.354 1.00 0.00 H new ATOM 0 HA VAL A 100 4.127 8.857 1.048 1.00 0.00 H new ATOM 0 HB VAL A 100 6.844 7.724 1.575 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.123 6.100 -0.140 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.999 6.157 1.238 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.572 6.960 -0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.409 8.107 -0.798 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.930 9.078 -0.986 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.227 9.633 0.098 1.00 0.00 H new ATOM 1720 N VAL A 101 3.822 7.426 3.088 1.00 0.00 N ATOM 1721 CA VAL A 101 3.423 6.849 4.361 1.00 0.00 C ATOM 1722 C VAL A 101 3.298 5.332 4.212 1.00 0.00 C ATOM 1723 O VAL A 101 2.351 4.840 3.601 1.00 0.00 O ATOM 1724 CB VAL A 101 2.134 7.510 4.853 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.360 8.991 5.164 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.003 7.329 3.839 1.00 0.00 C ATOM 0 H VAL A 101 3.342 7.039 2.275 1.00 0.00 H new ATOM 0 HA VAL A 101 4.181 7.039 5.121 1.00 0.00 H new ATOM 0 HB VAL A 101 1.837 7.016 5.778 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.428 9.436 5.512 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.120 9.088 5.939 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.694 9.505 4.263 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.098 7.808 4.213 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.289 7.784 2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.815 6.266 3.690 1.00 0.00 H new ATOM 1736 N ALA A 102 4.269 4.632 4.781 1.00 0.00 N ATOM 1737 CA ALA A 102 4.279 3.180 4.720 1.00 0.00 C ATOM 1738 C ALA A 102 3.330 2.622 5.782 1.00 0.00 C ATOM 1739 O ALA A 102 3.694 2.517 6.952 1.00 0.00 O ATOM 1740 CB ALA A 102 5.712 2.672 4.893 1.00 0.00 C ATOM 0 H ALA A 102 5.054 5.043 5.286 1.00 0.00 H new ATOM 0 HA ALA A 102 3.925 2.834 3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.720 1.583 4.847 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.339 3.073 4.097 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.099 2.997 5.858 1.00 0.00 H new ATOM 1746 N ILE A 103 2.131 2.278 5.336 1.00 0.00 N ATOM 1747 CA ILE A 103 1.126 1.733 6.233 1.00 0.00 C ATOM 1748 C ILE A 103 1.157 0.206 6.158 1.00 0.00 C ATOM 1749 O ILE A 103 1.286 -0.364 5.076 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.247 2.337 5.930 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.764 1.866 4.569 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.210 3.863 6.033 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -1.973 2.693 4.126 1.00 0.00 C ATOM 0 H ILE A 103 1.833 2.366 4.365 1.00 0.00 H new ATOM 0 HA ILE A 103 1.347 2.006 7.265 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.951 1.981 6.683 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.029 1.948 3.826 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -1.040 0.813 4.625 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.198 4.267 5.813 1.00 0.00 H new ATOM 0 HG22 ILE A 103 0.084 4.153 7.042 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.511 4.259 5.318 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.321 2.338 3.156 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -2.773 2.589 4.859 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.687 3.742 4.047 1.00 0.00 H new ATOM 1765 N GLU A 104 1.035 -0.415 7.323 1.00 0.00 N ATOM 1766 CA GLU A 104 1.047 -1.865 7.403 1.00 0.00 C ATOM 1767 C GLU A 104 -0.383 -2.409 7.409 1.00 0.00 C ATOM 1768 O GLU A 104 -1.184 -2.048 8.270 1.00 0.00 O ATOM 1769 CB GLU A 104 1.819 -2.340 8.636 1.00 0.00 C ATOM 1770 CG GLU A 104 2.558 -3.649 8.350 1.00 0.00 C ATOM 1771 CD GLU A 104 3.859 -3.731 9.151 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.855 -3.142 8.677 1.00 0.00 O ATOM 1773 OE2 GLU A 104 3.828 -4.381 10.218 1.00 0.00 O ATOM 0 H GLU A 104 0.927 0.061 8.219 1.00 0.00 H new ATOM 0 HA GLU A 104 1.559 -2.253 6.522 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.533 -1.574 8.940 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.130 -2.482 9.469 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.918 -4.495 8.602 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.777 -3.722 7.285 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.660 -3.267 6.438 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.980 -3.863 6.321 1.00 0.00 C ATOM 1782 C ILE A 105 -1.888 -5.358 6.632 1.00 0.00 C ATOM 1783 O ILE A 105 -0.800 -5.883 6.859 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.587 -3.556 4.951 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -1.911 -4.382 3.854 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.536 -2.056 4.652 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.544 -3.799 3.492 1.00 0.00 C ATOM 0 H ILE A 105 0.007 -3.564 5.725 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.662 -3.426 7.051 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.638 -3.845 4.971 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.793 -5.412 4.190 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.546 -4.406 2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.974 -1.865 3.672 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.098 -1.514 5.412 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.499 -1.719 4.658 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.085 -4.405 2.710 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.668 -2.777 3.133 1.00 0.00 H new ATOM 0 HD13 ILE A 105 0.097 -3.799 4.374 1.00 0.00 H new ATOM 1799 N GLU A 106 -3.047 -6.002 6.632 1.00 0.00 N ATOM 1800 CA GLU A 106 -3.111 -7.427 6.911 1.00 0.00 C ATOM 1801 C GLU A 106 -4.429 -8.009 6.396 1.00 0.00 C ATOM 1802 O GLU A 106 -5.473 -7.840 7.023 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.937 -7.701 8.406 1.00 0.00 C ATOM 1804 CG GLU A 106 -2.017 -8.901 8.640 1.00 0.00 C ATOM 1805 CD GLU A 106 -0.589 -8.594 8.185 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -0.097 -7.506 8.555 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -0.022 -9.454 7.477 1.00 0.00 O ATOM 0 H GLU A 106 -3.948 -5.563 6.443 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.290 -7.918 6.388 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.522 -6.820 8.895 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -3.910 -7.890 8.860 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -2.017 -9.163 9.698 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.397 -9.767 8.097 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.334 -8.702 5.230 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.506 -9.311 4.624 1.00 0.00 C ATOM 1816 C PRO A 107 -5.921 -10.574 5.380 1.00 0.00 C ATOM 1817 O PRO A 107 -5.304 -11.627 5.224 1.00 0.00 O ATOM 1818 CB PRO A 107 -5.106 -9.585 3.183 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.587 -9.551 3.159 1.00 0.00 C ATOM 1820 CD PRO A 107 -3.114 -8.923 4.460 1.00 0.00 C ATOM 0 HA PRO A 107 -6.384 -8.666 4.664 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.480 -10.553 2.851 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.524 -8.835 2.512 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.184 -10.558 3.053 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.232 -8.974 2.305 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.425 -9.581 4.990 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.585 -7.987 4.279 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.963 -10.428 6.185 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.468 -11.544 6.967 1.00 0.00 C ATOM 1830 C LEU A 108 -8.703 -12.127 6.277 1.00 0.00 C ATOM 1831 O LEU A 108 -9.763 -12.244 6.890 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.716 -11.116 8.414 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.541 -9.841 8.604 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.784 -10.114 9.454 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.684 -8.716 9.187 1.00 0.00 C ATOM 0 H LEU A 108 -7.472 -9.553 6.313 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.725 -12.340 7.018 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.220 -11.932 8.932 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.751 -10.977 8.901 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.887 -9.508 7.625 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -10.353 -9.192 9.574 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.405 -10.862 8.961 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.481 -10.483 10.434 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.294 -7.821 9.312 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.289 -9.024 10.155 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.858 -8.500 8.510 1.00 0.00 H new ATOM 1847 N GLU A 109 -8.526 -12.476 5.011 1.00 0.00 N ATOM 1848 CA GLU A 109 -9.613 -13.044 4.232 1.00 0.00 C ATOM 1849 C GLU A 109 -9.269 -14.472 3.803 1.00 0.00 C ATOM 1850 O GLU A 109 -10.132 -15.203 3.320 1.00 0.00 O ATOM 1851 CB GLU A 109 -9.932 -12.169 3.019 1.00 0.00 C ATOM 1852 CG GLU A 109 -11.427 -11.848 2.953 1.00 0.00 C ATOM 1853 CD GLU A 109 -12.081 -12.530 1.749 1.00 0.00 C ATOM 1854 OE1 GLU A 109 -12.375 -13.738 1.872 1.00 0.00 O ATOM 1855 OE2 GLU A 109 -12.273 -11.826 0.734 1.00 0.00 O ATOM 0 H GLU A 109 -7.646 -12.376 4.505 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.504 -13.079 4.859 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -9.360 -11.243 3.073 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -9.625 -12.680 2.106 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.914 -12.177 3.871 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.569 -10.769 2.886 1.00 0.00 H new ATOM 1862 N TYR A 110 -8.006 -14.825 3.994 1.00 0.00 N ATOM 1863 CA TYR A 110 -7.538 -16.153 3.633 1.00 0.00 C ATOM 1864 C TYR A 110 -6.044 -16.305 3.923 1.00 0.00 C ATOM 1865 O TYR A 110 -5.332 -16.990 3.190 1.00 0.00 O ATOM 1866 CB TYR A 110 -7.769 -16.286 2.126 1.00 0.00 C ATOM 1867 CG TYR A 110 -8.737 -17.406 1.741 1.00 0.00 C ATOM 1868 CD1 TYR A 110 -8.616 -18.652 2.322 1.00 0.00 C ATOM 1869 CD2 TYR A 110 -9.731 -17.171 0.813 1.00 0.00 C ATOM 1870 CE1 TYR A 110 -9.527 -19.707 1.960 1.00 0.00 C ATOM 1871 CE2 TYR A 110 -10.642 -18.225 0.451 1.00 0.00 C ATOM 1872 CZ TYR A 110 -10.495 -19.441 1.042 1.00 0.00 C ATOM 1873 OH TYR A 110 -11.356 -20.437 0.700 1.00 0.00 O ATOM 0 H TYR A 110 -7.293 -14.215 4.394 1.00 0.00 H new ATOM 0 HA TYR A 110 -8.066 -16.915 4.206 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -8.153 -15.340 1.743 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -6.811 -16.463 1.636 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -7.838 -18.836 3.048 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -9.825 -16.196 0.358 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -9.444 -20.687 2.407 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -11.424 -18.054 -0.273 1.00 0.00 H new ATOM 0 HH TYR A 110 -11.994 -20.104 0.035 1.00 0.00 H new TER 1883 TYR A 110