USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 826 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 108 ASN : amide:sc= 0.679 K(o=3.6,f=-9.1!) USER MOD Set 1.2: A 112 ASN : amide:sc= 2.95 K(o=3.6,f=-12!) USER MOD Set 2.1: A 51 HIS : no HE2:sc= 0.647 K(o=2.6,f=-3.2!) USER MOD Set 2.2: A 106 THR OG1 : rot -73:sc= 1.98 USER MOD Set 3.1: A 44 SER OG : rot -162:sc= 0.829 USER MOD Set 3.2: A 48 SER OG : rot 99:sc= 1.07 USER MOD Set 4.1: A 31 GLN : amide:sc= -0.157 K(o=-0.22,f=-6.4!) USER MOD Set 4.2: A 37 MET CE :methyl 153:sc= -0.0676 (180deg=-0.123) USER MOD Set 5.1: A 5 LYS NZ :NH3+ -172:sc= 0.8 (180deg=0) USER MOD Set 5.2: A 7 THR OG1 : rot 180:sc= 0.976 USER MOD Set 5.3: A 17 THR OG1 : rot 80:sc= 1.98 USER MOD Single : A 1 GLY N :NH3+ -140:sc= 0.01 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 15 GLN : amide:sc= -0.266 K(o=-0.27,f=-0.77) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 180:sc= -0.338 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 HIS :FLIP no HD1:sc= -0.98 F(o=-2.1,f=-0.98) USER MOD Single : A 34 ASN : amide:sc= -0.3 X(o=-0.3,f=-0.0051) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -78:sc= 1.33 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 165:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0.402 K(o=0.4,f=-1.1) USER MOD Single : A 72 MET CE :methyl -159:sc=-0.00373 (180deg=-0.434) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -150:sc= 0 USER MOD Single : A 82 THR OG1 : rot 137:sc= 1.09 USER MOD Single : A 83 SER OG : rot 43:sc= 1.21 USER MOD Single : A 88 GLN : amide:sc= 2 K(o=2,f=-0.0029) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 165:sc= -0.0641 (180deg=-1.03) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 105 MET CE :methyl -176:sc= 0 (180deg=-0.0314) USER MOD Single : A 110 ASN : amide:sc= 0.459 K(o=0.46,f=-3.7!) USER MOD Single : A 111 ASN : amide:sc= 0.0984 K(o=0.098,f=-1.6) USER MOD Single : A 115 SER OG : rot -53:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 43.769 14.500 22.825 1.00 0.00 N ATOM 2 CA GLY A 1 44.949 14.438 21.951 1.00 0.00 C ATOM 3 C GLY A 1 44.950 15.625 21.014 1.00 0.00 C ATOM 4 O GLY A 1 44.715 16.753 21.445 1.00 0.00 O ATOM 0 H1 GLY A 1 44.035 14.210 23.788 1.00 0.00 H new ATOM 0 H2 GLY A 1 43.403 15.473 22.845 1.00 0.00 H new ATOM 0 H3 GLY A 1 43.034 13.861 22.461 1.00 0.00 H new ATOM 0 HA2 GLY A 1 45.859 14.435 22.551 1.00 0.00 H new ATOM 0 HA3 GLY A 1 44.942 13.510 21.379 1.00 0.00 H new ATOM 10 N GLU A 2 45.164 15.368 19.723 1.00 0.00 N ATOM 11 CA GLU A 2 45.020 16.347 18.637 1.00 0.00 C ATOM 12 C GLU A 2 43.564 16.856 18.528 1.00 0.00 C ATOM 13 O GLU A 2 42.675 16.110 18.099 1.00 0.00 O ATOM 14 CB GLU A 2 45.480 15.659 17.336 1.00 0.00 C ATOM 15 CG GLU A 2 45.339 16.515 16.071 1.00 0.00 C ATOM 16 CD GLU A 2 45.595 15.744 14.762 1.00 0.00 C ATOM 17 OE1 GLU A 2 45.478 14.491 14.737 1.00 0.00 O ATOM 18 OE2 GLU A 2 45.836 16.403 13.719 1.00 0.00 O ATOM 0 H GLU A 2 45.451 14.447 19.391 1.00 0.00 H new ATOM 0 HA GLU A 2 45.633 17.227 18.834 1.00 0.00 H new ATOM 0 HB2 GLU A 2 46.524 15.367 17.446 1.00 0.00 H new ATOM 0 HB3 GLU A 2 44.905 14.742 17.203 1.00 0.00 H new ATOM 0 HG2 GLU A 2 44.335 16.938 16.041 1.00 0.00 H new ATOM 0 HG3 GLU A 2 46.036 17.351 16.131 1.00 0.00 H new ATOM 25 N GLU A 3 43.344 18.124 18.900 1.00 0.00 N ATOM 26 CA GLU A 3 42.082 18.890 18.853 1.00 0.00 C ATOM 27 C GLU A 3 40.825 18.219 19.475 1.00 0.00 C ATOM 28 O GLU A 3 40.204 17.310 18.910 1.00 0.00 O ATOM 29 CB GLU A 3 41.809 19.418 17.429 1.00 0.00 C ATOM 30 CG GLU A 3 42.726 20.577 16.984 1.00 0.00 C ATOM 31 CD GLU A 3 44.035 20.157 16.291 1.00 0.00 C ATOM 32 OE1 GLU A 3 43.978 19.481 15.234 1.00 0.00 O ATOM 33 OE2 GLU A 3 45.131 20.597 16.717 1.00 0.00 O ATOM 0 H GLU A 3 44.105 18.692 19.273 1.00 0.00 H new ATOM 0 HA GLU A 3 42.262 19.726 19.528 1.00 0.00 H new ATOM 0 HB2 GLU A 3 41.919 18.594 16.724 1.00 0.00 H new ATOM 0 HB3 GLU A 3 40.772 19.750 17.372 1.00 0.00 H new ATOM 0 HG2 GLU A 3 42.166 21.220 16.305 1.00 0.00 H new ATOM 0 HG3 GLU A 3 42.975 21.177 17.859 1.00 0.00 H new ATOM 40 N LEU A 4 40.383 18.753 20.619 1.00 0.00 N ATOM 41 CA LEU A 4 39.052 18.522 21.199 1.00 0.00 C ATOM 42 C LEU A 4 38.033 19.492 20.552 1.00 0.00 C ATOM 43 O LEU A 4 38.407 20.378 19.781 1.00 0.00 O ATOM 44 CB LEU A 4 39.122 18.716 22.732 1.00 0.00 C ATOM 45 CG LEU A 4 40.203 17.915 23.490 1.00 0.00 C ATOM 46 CD1 LEU A 4 40.262 18.366 24.952 1.00 0.00 C ATOM 47 CD2 LEU A 4 39.941 16.408 23.491 1.00 0.00 C ATOM 0 H LEU A 4 40.958 19.377 21.185 1.00 0.00 H new ATOM 0 HA LEU A 4 38.724 17.502 20.998 1.00 0.00 H new ATOM 0 HB2 LEU A 4 39.282 19.775 22.933 1.00 0.00 H new ATOM 0 HB3 LEU A 4 38.150 18.455 23.151 1.00 0.00 H new ATOM 0 HG LEU A 4 41.140 18.108 22.967 1.00 0.00 H new ATOM 0 HD11 LEU A 4 41.027 17.795 25.478 1.00 0.00 H new ATOM 0 HD12 LEU A 4 40.506 19.427 24.996 1.00 0.00 H new ATOM 0 HD13 LEU A 4 39.294 18.197 25.424 1.00 0.00 H new ATOM 0 HD21 LEU A 4 40.735 15.901 24.039 1.00 0.00 H new ATOM 0 HD22 LEU A 4 38.983 16.206 23.970 1.00 0.00 H new ATOM 0 HD23 LEU A 4 39.918 16.042 22.465 1.00 0.00 H new ATOM 59 N LYS A 5 36.741 19.375 20.881 1.00 0.00 N ATOM 60 CA LYS A 5 35.712 20.338 20.445 1.00 0.00 C ATOM 61 C LYS A 5 34.623 20.580 21.494 1.00 0.00 C ATOM 62 O LYS A 5 34.424 19.757 22.382 1.00 0.00 O ATOM 63 CB LYS A 5 35.130 19.928 19.083 1.00 0.00 C ATOM 64 CG LYS A 5 34.149 18.743 19.123 1.00 0.00 C ATOM 65 CD LYS A 5 33.253 18.795 17.885 1.00 0.00 C ATOM 66 CE LYS A 5 32.002 17.927 18.052 1.00 0.00 C ATOM 67 NZ LYS A 5 30.932 18.342 17.117 1.00 0.00 N ATOM 0 H LYS A 5 36.376 18.615 21.455 1.00 0.00 H new ATOM 0 HA LYS A 5 36.208 21.301 20.326 1.00 0.00 H new ATOM 0 HB2 LYS A 5 34.619 20.788 18.650 1.00 0.00 H new ATOM 0 HB3 LYS A 5 35.953 19.676 18.414 1.00 0.00 H new ATOM 0 HG2 LYS A 5 34.697 17.801 19.151 1.00 0.00 H new ATOM 0 HG3 LYS A 5 33.543 18.786 20.028 1.00 0.00 H new ATOM 0 HD2 LYS A 5 32.957 19.826 17.694 1.00 0.00 H new ATOM 0 HD3 LYS A 5 33.816 18.458 17.014 1.00 0.00 H new ATOM 0 HE2 LYS A 5 32.256 16.882 17.877 1.00 0.00 H new ATOM 0 HE3 LYS A 5 31.640 18.000 19.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 30.055 17.830 17.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 30.769 19.365 17.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 31.219 18.123 16.142 1.00 0.00 H new ATOM 81 N ILE A 6 33.929 21.706 21.357 1.00 0.00 N ATOM 82 CA ILE A 6 32.859 22.217 22.225 1.00 0.00 C ATOM 83 C ILE A 6 31.700 22.723 21.355 1.00 0.00 C ATOM 84 O ILE A 6 31.918 23.435 20.377 1.00 0.00 O ATOM 85 CB ILE A 6 33.415 23.317 23.172 1.00 0.00 C ATOM 86 CG1 ILE A 6 32.306 24.046 23.980 1.00 0.00 C ATOM 87 CG2 ILE A 6 34.239 24.364 22.397 1.00 0.00 C ATOM 88 CD1 ILE A 6 32.827 24.830 25.187 1.00 0.00 C ATOM 0 H ILE A 6 34.110 22.338 20.577 1.00 0.00 H new ATOM 0 HA ILE A 6 32.476 21.418 22.860 1.00 0.00 H new ATOM 0 HB ILE A 6 34.056 22.791 23.879 1.00 0.00 H new ATOM 0 HG12 ILE A 6 31.778 24.730 23.316 1.00 0.00 H new ATOM 0 HG13 ILE A 6 31.579 23.311 24.324 1.00 0.00 H new ATOM 0 HG21 ILE A 6 34.613 25.118 23.090 1.00 0.00 H new ATOM 0 HG22 ILE A 6 35.080 23.874 21.906 1.00 0.00 H new ATOM 0 HG23 ILE A 6 33.608 24.841 21.647 1.00 0.00 H new ATOM 0 HD11 ILE A 6 31.992 25.309 25.698 1.00 0.00 H new ATOM 0 HD12 ILE A 6 33.329 24.149 25.874 1.00 0.00 H new ATOM 0 HD13 ILE A 6 33.531 25.591 24.850 1.00 0.00 H new ATOM 100 N THR A 7 30.461 22.390 21.714 1.00 0.00 N ATOM 101 CA THR A 7 29.247 22.898 21.057 1.00 0.00 C ATOM 102 C THR A 7 28.475 23.794 21.998 1.00 0.00 C ATOM 103 O THR A 7 28.202 23.423 23.135 1.00 0.00 O ATOM 104 CB THR A 7 28.329 21.770 20.552 1.00 0.00 C ATOM 105 OG1 THR A 7 29.045 20.925 19.677 1.00 0.00 O ATOM 106 CG2 THR A 7 27.145 22.319 19.758 1.00 0.00 C ATOM 0 H THR A 7 30.264 21.749 22.482 1.00 0.00 H new ATOM 0 HA THR A 7 29.577 23.467 20.188 1.00 0.00 H new ATOM 0 HB THR A 7 27.973 21.235 21.432 1.00 0.00 H new ATOM 0 HG1 THR A 7 28.457 20.208 19.360 1.00 0.00 H new ATOM 0 HG21 THR A 7 26.520 21.493 19.418 1.00 0.00 H new ATOM 0 HG22 THR A 7 26.557 22.982 20.393 1.00 0.00 H new ATOM 0 HG23 THR A 7 27.512 22.875 18.895 1.00 0.00 H new ATOM 114 N PHE A 8 28.069 24.948 21.490 1.00 0.00 N ATOM 115 CA PHE A 8 27.219 25.899 22.186 1.00 0.00 C ATOM 116 C PHE A 8 25.938 26.187 21.390 1.00 0.00 C ATOM 117 O PHE A 8 25.972 26.344 20.166 1.00 0.00 O ATOM 118 CB PHE A 8 28.006 27.185 22.466 1.00 0.00 C ATOM 119 CG PHE A 8 29.510 27.079 22.710 1.00 0.00 C ATOM 120 CD1 PHE A 8 30.357 26.893 21.598 1.00 0.00 C ATOM 121 CD2 PHE A 8 30.097 27.337 23.977 1.00 0.00 C ATOM 122 CE1 PHE A 8 31.744 26.925 21.742 1.00 0.00 C ATOM 123 CE2 PHE A 8 31.489 27.435 24.103 1.00 0.00 C ATOM 124 CZ PHE A 8 32.308 27.214 22.987 1.00 0.00 C ATOM 0 H PHE A 8 28.331 25.257 20.554 1.00 0.00 H new ATOM 0 HA PHE A 8 26.911 25.465 23.137 1.00 0.00 H new ATOM 0 HB2 PHE A 8 27.853 27.858 21.622 1.00 0.00 H new ATOM 0 HB3 PHE A 8 27.561 27.663 23.339 1.00 0.00 H new ATOM 0 HD1 PHE A 8 29.926 26.724 20.622 1.00 0.00 H new ATOM 0 HD2 PHE A 8 29.468 27.458 24.847 1.00 0.00 H new ATOM 0 HE1 PHE A 8 32.381 26.727 20.893 1.00 0.00 H new ATOM 0 HE2 PHE A 8 31.930 27.680 25.058 1.00 0.00 H new ATOM 0 HZ PHE A 8 33.382 27.267 23.090 1.00 0.00 H new ATOM 134 N ILE A 9 24.816 26.299 22.105 1.00 0.00 N ATOM 135 CA ILE A 9 23.569 26.885 21.589 1.00 0.00 C ATOM 136 C ILE A 9 23.620 28.404 21.793 1.00 0.00 C ATOM 137 O ILE A 9 23.927 28.864 22.891 1.00 0.00 O ATOM 138 CB ILE A 9 22.326 26.272 22.268 1.00 0.00 C ATOM 139 CG1 ILE A 9 22.391 24.725 22.214 1.00 0.00 C ATOM 140 CG2 ILE A 9 21.041 26.858 21.641 1.00 0.00 C ATOM 141 CD1 ILE A 9 21.086 23.980 22.515 1.00 0.00 C ATOM 0 H ILE A 9 24.743 25.982 23.072 1.00 0.00 H new ATOM 0 HA ILE A 9 23.482 26.660 20.526 1.00 0.00 H new ATOM 0 HB ILE A 9 22.307 26.539 23.325 1.00 0.00 H new ATOM 0 HG12 ILE A 9 22.732 24.431 21.221 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.148 24.389 22.923 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.168 26.421 22.125 1.00 0.00 H new ATOM 0 HG22 ILE A 9 21.029 27.939 21.779 1.00 0.00 H new ATOM 0 HG23 ILE A 9 21.018 26.628 20.576 1.00 0.00 H new ATOM 0 HD11 ILE A 9 21.256 22.906 22.447 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.747 24.231 23.520 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.325 24.273 21.792 1.00 0.00 H new ATOM 153 N LEU A 10 23.321 29.179 20.752 1.00 0.00 N ATOM 154 CA LEU A 10 23.419 30.642 20.739 1.00 0.00 C ATOM 155 C LEU A 10 22.240 31.336 21.438 1.00 0.00 C ATOM 156 O LEU A 10 21.149 30.774 21.552 1.00 0.00 O ATOM 157 CB LEU A 10 23.533 31.124 19.275 1.00 0.00 C ATOM 158 CG LEU A 10 24.735 30.604 18.466 1.00 0.00 C ATOM 159 CD1 LEU A 10 24.995 31.558 17.296 1.00 0.00 C ATOM 160 CD2 LEU A 10 26.015 30.544 19.300 1.00 0.00 C ATOM 0 H LEU A 10 22.993 28.796 19.865 1.00 0.00 H new ATOM 0 HA LEU A 10 24.309 30.916 21.305 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.621 30.838 18.751 1.00 0.00 H new ATOM 0 HB3 LEU A 10 23.571 32.213 19.278 1.00 0.00 H new ATOM 0 HG LEU A 10 24.488 29.597 18.130 1.00 0.00 H new ATOM 0 HD11 LEU A 10 25.845 31.199 16.716 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.112 31.600 16.658 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.213 32.554 17.680 1.00 0.00 H new ATOM 0 HD21 LEU A 10 26.833 30.171 18.684 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.260 31.542 19.663 1.00 0.00 H new ATOM 0 HD23 LEU A 10 25.866 29.876 20.148 1.00 0.00 H new ATOM 172 N LYS A 11 22.404 32.622 21.777 1.00 0.00 N ATOM 173 CA LYS A 11 21.289 33.544 22.085 1.00 0.00 C ATOM 174 C LYS A 11 20.373 33.805 20.883 1.00 0.00 C ATOM 175 O LYS A 11 19.249 34.266 21.057 1.00 0.00 O ATOM 176 CB LYS A 11 21.842 34.867 22.654 1.00 0.00 C ATOM 177 CG LYS A 11 21.873 34.872 24.191 1.00 0.00 C ATOM 178 CD LYS A 11 20.474 35.152 24.765 1.00 0.00 C ATOM 179 CE LYS A 11 20.121 36.643 24.646 1.00 0.00 C ATOM 180 NZ LYS A 11 18.660 36.856 24.551 1.00 0.00 N ATOM 0 H LYS A 11 23.322 33.061 21.847 1.00 0.00 H new ATOM 0 HA LYS A 11 20.668 33.056 22.836 1.00 0.00 H new ATOM 0 HB2 LYS A 11 22.849 35.032 22.272 1.00 0.00 H new ATOM 0 HB3 LYS A 11 21.228 35.696 22.302 1.00 0.00 H new ATOM 0 HG2 LYS A 11 22.234 33.910 24.555 1.00 0.00 H new ATOM 0 HG3 LYS A 11 22.573 35.630 24.543 1.00 0.00 H new ATOM 0 HD2 LYS A 11 19.732 34.555 24.234 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.438 34.848 25.811 1.00 0.00 H new ATOM 0 HE2 LYS A 11 20.511 37.179 25.511 1.00 0.00 H new ATOM 0 HE3 LYS A 11 20.607 37.063 23.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 18.462 37.874 24.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 18.292 36.366 23.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 18.198 36.478 25.403 1.00 0.00 H new ATOM 194 N ASP A 12 20.823 33.461 19.676 1.00 0.00 N ATOM 195 CA ASP A 12 20.009 33.433 18.454 1.00 0.00 C ATOM 196 C ASP A 12 19.310 32.074 18.212 1.00 0.00 C ATOM 197 O ASP A 12 18.598 31.914 17.221 1.00 0.00 O ATOM 198 CB ASP A 12 20.913 33.834 17.273 1.00 0.00 C ATOM 199 CG ASP A 12 20.137 34.335 16.050 1.00 0.00 C ATOM 200 OD1 ASP A 12 19.121 35.054 16.215 1.00 0.00 O ATOM 201 OD2 ASP A 12 20.581 34.100 14.900 1.00 0.00 O ATOM 0 H ASP A 12 21.792 33.186 19.514 1.00 0.00 H new ATOM 0 HA ASP A 12 19.190 34.144 18.562 1.00 0.00 H new ATOM 0 HB2 ASP A 12 21.601 34.613 17.601 1.00 0.00 H new ATOM 0 HB3 ASP A 12 21.519 32.976 16.982 1.00 0.00 H new ATOM 206 N GLY A 13 19.535 31.071 19.074 1.00 0.00 N ATOM 207 CA GLY A 13 19.049 29.688 18.929 1.00 0.00 C ATOM 208 C GLY A 13 19.809 28.826 17.908 1.00 0.00 C ATOM 209 O GLY A 13 19.448 27.667 17.687 1.00 0.00 O ATOM 0 H GLY A 13 20.082 31.205 19.925 1.00 0.00 H new ATOM 0 HA2 GLY A 13 19.100 29.199 19.902 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.998 29.718 18.643 1.00 0.00 H new ATOM 213 N SER A 14 20.859 29.365 17.283 1.00 0.00 N ATOM 214 CA SER A 14 21.773 28.646 16.378 1.00 0.00 C ATOM 215 C SER A 14 22.689 27.687 17.147 1.00 0.00 C ATOM 216 O SER A 14 22.805 27.763 18.368 1.00 0.00 O ATOM 217 CB SER A 14 22.618 29.620 15.532 1.00 0.00 C ATOM 218 OG SER A 14 21.889 30.817 15.296 1.00 0.00 O ATOM 0 H SER A 14 21.109 30.348 17.394 1.00 0.00 H new ATOM 0 HA SER A 14 21.149 28.059 15.704 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.551 29.848 16.048 1.00 0.00 H new ATOM 0 HB3 SER A 14 22.885 29.154 14.583 1.00 0.00 H new ATOM 0 HG SER A 14 22.433 31.431 14.760 1.00 0.00 H new ATOM 224 N GLN A 15 23.354 26.785 16.432 1.00 0.00 N ATOM 225 CA GLN A 15 24.278 25.782 16.953 1.00 0.00 C ATOM 226 C GLN A 15 25.647 26.000 16.347 1.00 0.00 C ATOM 227 O GLN A 15 25.785 26.134 15.125 1.00 0.00 O ATOM 228 CB GLN A 15 23.829 24.375 16.552 1.00 0.00 C ATOM 229 CG GLN A 15 22.707 23.731 17.383 1.00 0.00 C ATOM 230 CD GLN A 15 21.513 24.599 17.782 1.00 0.00 C ATOM 231 OE1 GLN A 15 21.124 24.649 18.941 1.00 0.00 O ATOM 232 NE2 GLN A 15 20.854 25.287 16.878 1.00 0.00 N ATOM 0 H GLN A 15 23.258 26.731 15.418 1.00 0.00 H new ATOM 0 HA GLN A 15 24.301 25.876 18.039 1.00 0.00 H new ATOM 0 HB2 GLN A 15 23.503 24.408 15.512 1.00 0.00 H new ATOM 0 HB3 GLN A 15 24.698 23.719 16.592 1.00 0.00 H new ATOM 0 HG2 GLN A 15 22.325 22.878 16.822 1.00 0.00 H new ATOM 0 HG3 GLN A 15 23.153 23.338 18.297 1.00 0.00 H new ATOM 0 HE21 GLN A 15 21.153 25.266 15.903 1.00 0.00 H new ATOM 0 HE22 GLN A 15 20.043 25.842 17.151 1.00 0.00 H new ATOM 241 N LYS A 16 26.652 26.026 17.214 1.00 0.00 N ATOM 242 CA LYS A 16 28.011 26.332 16.824 1.00 0.00 C ATOM 243 C LYS A 16 28.945 25.412 17.571 1.00 0.00 C ATOM 244 O LYS A 16 29.001 25.395 18.799 1.00 0.00 O ATOM 245 CB LYS A 16 28.294 27.799 17.111 1.00 0.00 C ATOM 246 CG LYS A 16 27.417 28.772 16.295 1.00 0.00 C ATOM 247 CD LYS A 16 27.650 28.865 14.781 1.00 0.00 C ATOM 248 CE LYS A 16 28.900 29.679 14.438 1.00 0.00 C ATOM 249 NZ LYS A 16 28.896 30.103 13.020 1.00 0.00 N ATOM 0 H LYS A 16 26.540 25.834 18.210 1.00 0.00 H new ATOM 0 HA LYS A 16 28.162 26.172 15.756 1.00 0.00 H new ATOM 0 HB2 LYS A 16 28.139 27.988 18.173 1.00 0.00 H new ATOM 0 HB3 LYS A 16 29.343 28.005 16.900 1.00 0.00 H new ATOM 0 HG2 LYS A 16 26.375 28.494 16.455 1.00 0.00 H new ATOM 0 HG3 LYS A 16 27.549 29.770 16.714 1.00 0.00 H new ATOM 0 HD2 LYS A 16 27.747 27.861 14.368 1.00 0.00 H new ATOM 0 HD3 LYS A 16 26.780 29.321 14.308 1.00 0.00 H new ATOM 0 HE2 LYS A 16 28.952 30.557 15.082 1.00 0.00 H new ATOM 0 HE3 LYS A 16 29.790 29.083 14.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 29.756 30.652 12.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 28.871 29.263 12.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 28.059 30.692 12.836 1.00 0.00 H new ATOM 263 N THR A 17 29.629 24.617 16.780 1.00 0.00 N ATOM 264 CA THR A 17 30.602 23.604 17.219 1.00 0.00 C ATOM 265 C THR A 17 32.041 23.988 16.841 1.00 0.00 C ATOM 266 O THR A 17 32.376 24.151 15.667 1.00 0.00 O ATOM 267 CB THR A 17 30.184 22.188 16.784 1.00 0.00 C ATOM 268 OG1 THR A 17 30.779 21.229 17.623 1.00 0.00 O ATOM 269 CG2 THR A 17 30.556 21.797 15.360 1.00 0.00 C ATOM 0 H THR A 17 29.528 24.649 15.765 1.00 0.00 H new ATOM 0 HA THR A 17 30.597 23.580 18.309 1.00 0.00 H new ATOM 0 HB THR A 17 29.096 22.210 16.849 1.00 0.00 H new ATOM 0 HG1 THR A 17 30.268 21.161 18.456 1.00 0.00 H new ATOM 0 HG21 THR A 17 30.214 20.781 15.160 1.00 0.00 H new ATOM 0 HG22 THR A 17 30.082 22.484 14.659 1.00 0.00 H new ATOM 0 HG23 THR A 17 31.638 21.846 15.240 1.00 0.00 H new ATOM 277 N TYR A 18 32.897 24.178 17.844 1.00 0.00 N ATOM 278 CA TYR A 18 34.205 24.845 17.757 1.00 0.00 C ATOM 279 C TYR A 18 35.337 23.950 18.278 1.00 0.00 C ATOM 280 O TYR A 18 35.169 23.259 19.281 1.00 0.00 O ATOM 281 CB TYR A 18 34.176 26.152 18.570 1.00 0.00 C ATOM 282 CG TYR A 18 33.290 27.291 18.060 1.00 0.00 C ATOM 283 CD1 TYR A 18 32.756 27.279 16.754 1.00 0.00 C ATOM 284 CD2 TYR A 18 33.027 28.405 18.887 1.00 0.00 C ATOM 285 CE1 TYR A 18 31.965 28.339 16.287 1.00 0.00 C ATOM 286 CE2 TYR A 18 32.253 29.482 18.411 1.00 0.00 C ATOM 287 CZ TYR A 18 31.725 29.458 17.104 1.00 0.00 C ATOM 288 OH TYR A 18 31.008 30.506 16.620 1.00 0.00 O ATOM 0 H TYR A 18 32.691 23.856 18.790 1.00 0.00 H new ATOM 0 HA TYR A 18 34.398 25.058 16.706 1.00 0.00 H new ATOM 0 HB2 TYR A 18 33.858 25.909 19.584 1.00 0.00 H new ATOM 0 HB3 TYR A 18 35.197 26.527 18.638 1.00 0.00 H new ATOM 0 HD1 TYR A 18 32.959 26.441 16.104 1.00 0.00 H new ATOM 0 HD2 TYR A 18 33.422 28.432 19.892 1.00 0.00 H new ATOM 0 HE1 TYR A 18 31.538 28.296 15.296 1.00 0.00 H new ATOM 0 HE2 TYR A 18 32.063 30.331 19.051 1.00 0.00 H new ATOM 0 HH TYR A 18 30.932 31.197 17.311 1.00 0.00 H new ATOM 298 N GLU A 19 36.509 23.988 17.642 1.00 0.00 N ATOM 299 CA GLU A 19 37.654 23.126 17.984 1.00 0.00 C ATOM 300 C GLU A 19 38.649 23.824 18.923 1.00 0.00 C ATOM 301 O GLU A 19 39.126 24.927 18.644 1.00 0.00 O ATOM 302 CB GLU A 19 38.324 22.616 16.700 1.00 0.00 C ATOM 303 CG GLU A 19 37.473 21.507 16.061 1.00 0.00 C ATOM 304 CD GLU A 19 37.877 21.184 14.621 1.00 0.00 C ATOM 305 OE1 GLU A 19 38.997 21.527 14.171 1.00 0.00 O ATOM 306 OE2 GLU A 19 37.042 20.608 13.884 1.00 0.00 O ATOM 0 H GLU A 19 36.697 24.623 16.866 1.00 0.00 H new ATOM 0 HA GLU A 19 37.281 22.266 18.540 1.00 0.00 H new ATOM 0 HB2 GLU A 19 38.451 23.438 15.996 1.00 0.00 H new ATOM 0 HB3 GLU A 19 39.320 22.235 16.927 1.00 0.00 H new ATOM 0 HG2 GLU A 19 37.555 20.603 16.665 1.00 0.00 H new ATOM 0 HG3 GLU A 19 36.425 21.808 16.078 1.00 0.00 H new ATOM 313 N VAL A 20 38.966 23.184 20.052 1.00 0.00 N ATOM 314 CA VAL A 20 39.700 23.746 21.197 1.00 0.00 C ATOM 315 C VAL A 20 40.715 22.760 21.782 1.00 0.00 C ATOM 316 O VAL A 20 40.690 21.561 21.505 1.00 0.00 O ATOM 317 CB VAL A 20 38.715 24.197 22.296 1.00 0.00 C ATOM 318 CG1 VAL A 20 37.867 25.387 21.839 1.00 0.00 C ATOM 319 CG2 VAL A 20 37.780 23.070 22.758 1.00 0.00 C ATOM 0 H VAL A 20 38.706 22.209 20.203 1.00 0.00 H new ATOM 0 HA VAL A 20 40.256 24.607 20.826 1.00 0.00 H new ATOM 0 HB VAL A 20 39.338 24.493 23.140 1.00 0.00 H new ATOM 0 HG11 VAL A 20 37.185 25.677 22.639 1.00 0.00 H new ATOM 0 HG12 VAL A 20 38.519 26.226 21.596 1.00 0.00 H new ATOM 0 HG13 VAL A 20 37.292 25.107 20.956 1.00 0.00 H new ATOM 0 HG21 VAL A 20 37.110 23.447 23.531 1.00 0.00 H new ATOM 0 HG22 VAL A 20 37.193 22.714 21.911 1.00 0.00 H new ATOM 0 HG23 VAL A 20 38.372 22.248 23.160 1.00 0.00 H new ATOM 329 N CYS A 21 41.609 23.273 22.624 1.00 0.00 N ATOM 330 CA CYS A 21 42.589 22.470 23.348 1.00 0.00 C ATOM 331 C CYS A 21 42.136 22.140 24.778 1.00 0.00 C ATOM 332 O CYS A 21 41.244 22.768 25.351 1.00 0.00 O ATOM 333 CB CYS A 21 43.925 23.210 23.316 1.00 0.00 C ATOM 334 SG CYS A 21 45.280 22.057 23.684 1.00 0.00 S ATOM 0 H CYS A 21 41.673 24.271 22.825 1.00 0.00 H new ATOM 0 HA CYS A 21 42.698 21.502 22.859 1.00 0.00 H new ATOM 0 HB2 CYS A 21 44.077 23.662 22.336 1.00 0.00 H new ATOM 0 HB3 CYS A 21 43.919 24.021 24.044 1.00 0.00 H new ATOM 0 HG CYS A 21 46.413 22.694 23.652 1.00 0.00 H new ATOM 340 N GLU A 22 42.796 21.151 25.365 1.00 0.00 N ATOM 341 CA GLU A 22 42.700 20.763 26.760 1.00 0.00 C ATOM 342 C GLU A 22 43.063 21.918 27.727 1.00 0.00 C ATOM 343 O GLU A 22 44.001 22.683 27.474 1.00 0.00 O ATOM 344 CB GLU A 22 43.627 19.541 26.893 1.00 0.00 C ATOM 345 CG GLU A 22 43.424 18.822 28.212 1.00 0.00 C ATOM 346 CD GLU A 22 44.339 17.607 28.399 1.00 0.00 C ATOM 347 OE1 GLU A 22 44.276 16.633 27.611 1.00 0.00 O ATOM 348 OE2 GLU A 22 45.106 17.587 29.394 1.00 0.00 O ATOM 0 H GLU A 22 43.451 20.565 24.847 1.00 0.00 H new ATOM 0 HA GLU A 22 41.677 20.515 27.044 1.00 0.00 H new ATOM 0 HB2 GLU A 22 43.439 18.851 26.070 1.00 0.00 H new ATOM 0 HB3 GLU A 22 44.665 19.862 26.810 1.00 0.00 H new ATOM 0 HG2 GLU A 22 43.595 19.524 29.028 1.00 0.00 H new ATOM 0 HG3 GLU A 22 42.386 18.498 28.283 1.00 0.00 H new ATOM 355 N GLY A 23 42.316 22.044 28.833 1.00 0.00 N ATOM 356 CA GLY A 23 42.496 23.052 29.890 1.00 0.00 C ATOM 357 C GLY A 23 41.605 24.301 29.785 1.00 0.00 C ATOM 358 O GLY A 23 41.446 25.031 30.770 1.00 0.00 O ATOM 0 H GLY A 23 41.534 21.418 29.025 1.00 0.00 H new ATOM 0 HA2 GLY A 23 42.311 22.577 30.854 1.00 0.00 H new ATOM 0 HA3 GLY A 23 43.538 23.371 29.887 1.00 0.00 H new ATOM 362 N GLU A 24 40.965 24.546 28.638 1.00 0.00 N ATOM 363 CA GLU A 24 40.071 25.697 28.436 1.00 0.00 C ATOM 364 C GLU A 24 38.694 25.509 29.106 1.00 0.00 C ATOM 365 O GLU A 24 38.175 24.397 29.181 1.00 0.00 O ATOM 366 CB GLU A 24 39.919 25.971 26.932 1.00 0.00 C ATOM 367 CG GLU A 24 41.259 26.132 26.199 1.00 0.00 C ATOM 368 CD GLU A 24 42.060 27.339 26.697 1.00 0.00 C ATOM 369 OE1 GLU A 24 41.743 28.486 26.299 1.00 0.00 O ATOM 370 OE2 GLU A 24 43.028 27.164 27.483 1.00 0.00 O ATOM 0 H GLU A 24 41.051 23.949 27.816 1.00 0.00 H new ATOM 0 HA GLU A 24 40.527 26.560 28.921 1.00 0.00 H new ATOM 0 HB2 GLU A 24 39.361 25.153 26.477 1.00 0.00 H new ATOM 0 HB3 GLU A 24 39.328 26.876 26.794 1.00 0.00 H new ATOM 0 HG2 GLU A 24 41.852 25.227 26.331 1.00 0.00 H new ATOM 0 HG3 GLU A 24 41.074 26.239 25.130 1.00 0.00 H new ATOM 377 N THR A 25 38.083 26.593 29.586 1.00 0.00 N ATOM 378 CA THR A 25 36.841 26.597 30.391 1.00 0.00 C ATOM 379 C THR A 25 35.651 27.014 29.526 1.00 0.00 C ATOM 380 O THR A 25 35.799 27.837 28.630 1.00 0.00 O ATOM 381 CB THR A 25 36.977 27.537 31.601 1.00 0.00 C ATOM 382 OG1 THR A 25 38.320 27.754 31.975 1.00 0.00 O ATOM 383 CG2 THR A 25 36.317 26.940 32.837 1.00 0.00 C ATOM 0 H THR A 25 38.446 27.532 29.424 1.00 0.00 H new ATOM 0 HA THR A 25 36.670 25.586 30.761 1.00 0.00 H new ATOM 0 HB THR A 25 36.506 28.467 31.283 1.00 0.00 H new ATOM 0 HG1 THR A 25 38.351 28.358 32.746 1.00 0.00 H new ATOM 0 HG21 THR A 25 36.429 27.626 33.676 1.00 0.00 H new ATOM 0 HG22 THR A 25 35.257 26.777 32.641 1.00 0.00 H new ATOM 0 HG23 THR A 25 36.792 25.989 33.080 1.00 0.00 H new ATOM 391 N ILE A 26 34.450 26.488 29.779 1.00 0.00 N ATOM 392 CA ILE A 26 33.298 26.640 28.866 1.00 0.00 C ATOM 393 C ILE A 26 32.976 28.117 28.566 1.00 0.00 C ATOM 394 O ILE A 26 32.923 28.501 27.397 1.00 0.00 O ATOM 395 CB ILE A 26 32.080 25.869 29.425 1.00 0.00 C ATOM 396 CG1 ILE A 26 32.216 24.331 29.331 1.00 0.00 C ATOM 397 CG2 ILE A 26 30.808 26.254 28.671 1.00 0.00 C ATOM 398 CD1 ILE A 26 33.144 23.689 30.369 1.00 0.00 C ATOM 0 H ILE A 26 34.242 25.946 30.617 1.00 0.00 H new ATOM 0 HA ILE A 26 33.564 26.202 27.904 1.00 0.00 H new ATOM 0 HB ILE A 26 32.030 26.149 30.477 1.00 0.00 H new ATOM 0 HG12 ILE A 26 31.225 23.889 29.432 1.00 0.00 H new ATOM 0 HG13 ILE A 26 32.580 24.075 28.336 1.00 0.00 H new ATOM 0 HG21 ILE A 26 29.962 25.701 29.079 1.00 0.00 H new ATOM 0 HG22 ILE A 26 30.629 27.324 28.781 1.00 0.00 H new ATOM 0 HG23 ILE A 26 30.924 26.012 27.614 1.00 0.00 H new ATOM 0 HD11 ILE A 26 33.169 22.610 30.216 1.00 0.00 H new ATOM 0 HD12 ILE A 26 34.150 24.095 30.258 1.00 0.00 H new ATOM 0 HD13 ILE A 26 32.774 23.905 31.371 1.00 0.00 H new ATOM 410 N LEU A 27 32.804 28.962 29.591 1.00 0.00 N ATOM 411 CA LEU A 27 32.479 30.380 29.370 1.00 0.00 C ATOM 412 C LEU A 27 33.696 31.207 28.891 1.00 0.00 C ATOM 413 O LEU A 27 33.535 32.188 28.168 1.00 0.00 O ATOM 414 CB LEU A 27 31.755 30.973 30.589 1.00 0.00 C ATOM 415 CG LEU A 27 30.703 32.037 30.213 1.00 0.00 C ATOM 416 CD1 LEU A 27 29.455 31.430 29.558 1.00 0.00 C ATOM 417 CD2 LEU A 27 30.241 32.747 31.482 1.00 0.00 C ATOM 0 H LEU A 27 32.883 28.694 30.572 1.00 0.00 H new ATOM 0 HA LEU A 27 31.776 30.437 28.539 1.00 0.00 H new ATOM 0 HB2 LEU A 27 31.268 30.169 31.141 1.00 0.00 H new ATOM 0 HB3 LEU A 27 32.490 31.419 31.259 1.00 0.00 H new ATOM 0 HG LEU A 27 31.178 32.715 29.504 1.00 0.00 H new ATOM 0 HD11 LEU A 27 28.749 32.224 29.315 1.00 0.00 H new ATOM 0 HD12 LEU A 27 29.741 30.907 28.646 1.00 0.00 H new ATOM 0 HD13 LEU A 27 28.987 30.728 30.248 1.00 0.00 H new ATOM 0 HD21 LEU A 27 29.497 33.501 31.226 1.00 0.00 H new ATOM 0 HD22 LEU A 27 29.801 32.021 32.166 1.00 0.00 H new ATOM 0 HD23 LEU A 27 31.094 33.227 31.962 1.00 0.00 H new ATOM 429 N ASP A 28 34.916 30.744 29.176 1.00 0.00 N ATOM 430 CA ASP A 28 36.160 31.294 28.622 1.00 0.00 C ATOM 431 C ASP A 28 36.340 30.994 27.123 1.00 0.00 C ATOM 432 O ASP A 28 36.990 31.771 26.423 1.00 0.00 O ATOM 433 CB ASP A 28 37.345 30.735 29.414 1.00 0.00 C ATOM 434 CG ASP A 28 37.465 31.366 30.804 1.00 0.00 C ATOM 435 OD1 ASP A 28 36.851 30.868 31.767 1.00 0.00 O ATOM 436 OD2 ASP A 28 38.237 32.343 30.980 1.00 0.00 O ATOM 0 H ASP A 28 35.072 29.961 29.811 1.00 0.00 H new ATOM 0 HA ASP A 28 36.109 32.379 28.714 1.00 0.00 H new ATOM 0 HB2 ASP A 28 37.234 29.655 29.516 1.00 0.00 H new ATOM 0 HB3 ASP A 28 38.266 30.910 28.857 1.00 0.00 H new ATOM 441 N ILE A 29 35.731 29.922 26.599 1.00 0.00 N ATOM 442 CA ILE A 29 35.585 29.702 25.150 1.00 0.00 C ATOM 443 C ILE A 29 34.420 30.536 24.616 1.00 0.00 C ATOM 444 O ILE A 29 34.524 31.083 23.521 1.00 0.00 O ATOM 445 CB ILE A 29 35.486 28.198 24.762 1.00 0.00 C ATOM 446 CG1 ILE A 29 36.589 27.328 25.429 1.00 0.00 C ATOM 447 CG2 ILE A 29 35.718 28.122 23.236 1.00 0.00 C ATOM 448 CD1 ILE A 29 36.199 25.864 25.646 1.00 0.00 C ATOM 0 H ILE A 29 35.324 29.180 27.168 1.00 0.00 H new ATOM 0 HA ILE A 29 36.499 30.044 24.665 1.00 0.00 H new ATOM 0 HB ILE A 29 34.516 27.822 25.087 1.00 0.00 H new ATOM 0 HG12 ILE A 29 37.486 27.364 24.810 1.00 0.00 H new ATOM 0 HG13 ILE A 29 36.848 27.768 26.392 1.00 0.00 H new ATOM 0 HG21 ILE A 29 35.659 27.084 22.910 1.00 0.00 H new ATOM 0 HG22 ILE A 29 34.955 28.707 22.722 1.00 0.00 H new ATOM 0 HG23 ILE A 29 36.704 28.521 22.998 1.00 0.00 H new ATOM 0 HD11 ILE A 29 37.027 25.333 26.115 1.00 0.00 H new ATOM 0 HD12 ILE A 29 35.322 25.813 26.292 1.00 0.00 H new ATOM 0 HD13 ILE A 29 35.970 25.402 24.686 1.00 0.00 H new ATOM 460 N ALA A 30 33.356 30.746 25.394 1.00 0.00 N ATOM 461 CA ALA A 30 32.253 31.595 24.957 1.00 0.00 C ATOM 462 C ALA A 30 32.695 33.049 24.693 1.00 0.00 C ATOM 463 O ALA A 30 32.380 33.603 23.637 1.00 0.00 O ATOM 464 CB ALA A 30 31.093 31.492 25.953 1.00 0.00 C ATOM 0 H ALA A 30 33.238 30.342 26.323 1.00 0.00 H new ATOM 0 HA ALA A 30 31.899 31.231 23.992 1.00 0.00 H new ATOM 0 HB1 ALA A 30 30.272 32.128 25.622 1.00 0.00 H new ATOM 0 HB2 ALA A 30 30.752 30.458 26.009 1.00 0.00 H new ATOM 0 HB3 ALA A 30 31.429 31.817 26.938 1.00 0.00 H new ATOM 470 N GLN A 31 33.488 33.639 25.597 1.00 0.00 N ATOM 471 CA GLN A 31 34.137 34.937 25.373 1.00 0.00 C ATOM 472 C GLN A 31 35.381 34.853 24.483 1.00 0.00 C ATOM 473 O GLN A 31 35.522 35.700 23.613 1.00 0.00 O ATOM 474 CB GLN A 31 34.469 35.615 26.702 1.00 0.00 C ATOM 475 CG GLN A 31 33.243 36.330 27.289 1.00 0.00 C ATOM 476 CD GLN A 31 32.751 37.532 26.480 1.00 0.00 C ATOM 477 OE1 GLN A 31 31.636 37.569 25.977 1.00 0.00 O ATOM 478 NE2 GLN A 31 33.539 38.569 26.328 1.00 0.00 N ATOM 0 H GLN A 31 33.698 33.228 26.507 1.00 0.00 H new ATOM 0 HA GLN A 31 33.414 35.546 24.830 1.00 0.00 H new ATOM 0 HB2 GLN A 31 34.832 34.871 27.411 1.00 0.00 H new ATOM 0 HB3 GLN A 31 35.275 36.334 26.554 1.00 0.00 H new ATOM 0 HG2 GLN A 31 32.428 35.611 27.376 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.484 36.664 28.298 1.00 0.00 H new ATOM 0 HE21 GLN A 31 34.473 38.564 26.737 1.00 0.00 H new ATOM 0 HE22 GLN A 31 33.218 39.381 25.801 1.00 0.00 H new ATOM 487 N GLY A 32 36.248 33.844 24.604 1.00 0.00 N ATOM 488 CA GLY A 32 37.447 33.740 23.756 1.00 0.00 C ATOM 489 C GLY A 32 37.141 33.574 22.265 1.00 0.00 C ATOM 490 O GLY A 32 37.871 34.093 21.418 1.00 0.00 O ATOM 0 H GLY A 32 36.146 33.086 25.279 1.00 0.00 H new ATOM 0 HA2 GLY A 32 38.056 34.633 23.894 1.00 0.00 H new ATOM 0 HA3 GLY A 32 38.044 32.892 24.091 1.00 0.00 H new ATOM 494 N HIS A 33 36.020 32.930 21.926 1.00 0.00 N ATOM 495 CA HIS A 33 35.523 32.816 20.557 1.00 0.00 C ATOM 496 C HIS A 33 34.500 33.908 20.193 1.00 0.00 C ATOM 497 O HIS A 33 34.094 34.013 19.033 1.00 0.00 O ATOM 498 CB HIS A 33 34.938 31.410 20.389 1.00 0.00 C ATOM 499 CG HIS A 33 35.307 30.778 19.068 1.00 0.00 C ATOM 500 ND1 HIS A 33 34.802 31.089 17.834 1.00 0.00 N flip ATOM 501 CD2 HIS A 33 36.263 29.807 18.871 1.00 0.00 C flip ATOM 502 CE1 HIS A 33 35.431 30.278 16.879 1.00 0.00 C flip ATOM 503 NE2 HIS A 33 36.309 29.524 17.561 1.00 0.00 N flip ATOM 0 H HIS A 33 35.423 32.465 22.611 1.00 0.00 H new ATOM 0 HA HIS A 33 36.350 32.969 19.864 1.00 0.00 H new ATOM 0 HB2 HIS A 33 35.291 30.775 21.202 1.00 0.00 H new ATOM 0 HB3 HIS A 33 33.852 31.461 20.472 1.00 0.00 H new ATOM 0 HD2 HIS A 33 36.871 29.352 19.639 1.00 0.00 H new ATOM 0 HE1 HIS A 33 35.248 30.263 15.815 1.00 0.00 H new ATOM 0 HE2 HIS A 33 36.927 28.830 17.140 1.00 0.00 H new ATOM 511 N ASN A 34 34.069 34.713 21.173 1.00 0.00 N ATOM 512 CA ASN A 34 32.991 35.699 21.064 1.00 0.00 C ATOM 513 C ASN A 34 31.759 35.152 20.341 1.00 0.00 C ATOM 514 O ASN A 34 31.334 35.652 19.301 1.00 0.00 O ATOM 515 CB ASN A 34 33.508 37.026 20.510 1.00 0.00 C ATOM 516 CG ASN A 34 34.357 37.728 21.542 1.00 0.00 C ATOM 517 OD1 ASN A 34 33.844 38.370 22.452 1.00 0.00 O ATOM 518 ND2 ASN A 34 35.649 37.528 21.525 1.00 0.00 N ATOM 0 H ASN A 34 34.483 34.692 22.105 1.00 0.00 H new ATOM 0 HA ASN A 34 32.635 35.914 22.072 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.093 36.848 19.608 1.00 0.00 H new ATOM 0 HB3 ASN A 34 32.669 37.661 20.226 1.00 0.00 H new ATOM 0 HD21 ASN A 34 36.234 37.906 22.270 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.072 36.993 20.766 1.00 0.00 H new ATOM 525 N LEU A 35 31.193 34.110 20.935 1.00 0.00 N ATOM 526 CA LEU A 35 29.874 33.565 20.558 1.00 0.00 C ATOM 527 C LEU A 35 28.778 34.657 20.565 1.00 0.00 C ATOM 528 O LEU A 35 28.891 35.668 21.263 1.00 0.00 O ATOM 529 CB LEU A 35 29.513 32.481 21.599 1.00 0.00 C ATOM 530 CG LEU A 35 30.159 31.116 21.319 1.00 0.00 C ATOM 531 CD1 LEU A 35 30.009 30.194 22.524 1.00 0.00 C ATOM 532 CD2 LEU A 35 29.523 30.397 20.131 1.00 0.00 C ATOM 0 H LEU A 35 31.634 33.605 21.704 1.00 0.00 H new ATOM 0 HA LEU A 35 29.926 33.160 19.547 1.00 0.00 H new ATOM 0 HB2 LEU A 35 29.820 32.823 22.587 1.00 0.00 H new ATOM 0 HB3 LEU A 35 28.430 32.362 21.626 1.00 0.00 H new ATOM 0 HG LEU A 35 31.206 31.325 21.101 1.00 0.00 H new ATOM 0 HD11 LEU A 35 30.473 29.232 22.306 1.00 0.00 H new ATOM 0 HD12 LEU A 35 30.496 30.644 23.389 1.00 0.00 H new ATOM 0 HD13 LEU A 35 28.951 30.046 22.739 1.00 0.00 H new ATOM 0 HD21 LEU A 35 30.018 29.438 19.978 1.00 0.00 H new ATOM 0 HD22 LEU A 35 28.464 30.231 20.330 1.00 0.00 H new ATOM 0 HD23 LEU A 35 29.632 31.008 19.235 1.00 0.00 H new ATOM 544 N ASP A 36 27.702 34.467 19.793 1.00 0.00 N ATOM 545 CA ASP A 36 26.475 35.285 19.883 1.00 0.00 C ATOM 546 C ASP A 36 25.679 34.849 21.102 1.00 0.00 C ATOM 547 O ASP A 36 24.790 33.997 21.074 1.00 0.00 O ATOM 548 CB ASP A 36 25.681 35.268 18.561 1.00 0.00 C ATOM 549 CG ASP A 36 24.905 36.566 18.318 1.00 0.00 C ATOM 550 OD1 ASP A 36 25.516 37.526 17.786 1.00 0.00 O ATOM 551 OD2 ASP A 36 23.691 36.631 18.612 1.00 0.00 O ATOM 0 H ASP A 36 27.652 33.738 19.082 1.00 0.00 H new ATOM 0 HA ASP A 36 26.732 36.335 20.026 1.00 0.00 H new ATOM 0 HB2 ASP A 36 26.368 35.100 17.732 1.00 0.00 H new ATOM 0 HB3 ASP A 36 24.984 34.430 18.572 1.00 0.00 H new ATOM 556 N MET A 37 26.159 35.385 22.218 1.00 0.00 N ATOM 557 CA MET A 37 25.838 34.985 23.567 1.00 0.00 C ATOM 558 C MET A 37 26.193 36.150 24.505 1.00 0.00 C ATOM 559 O MET A 37 27.222 36.812 24.358 1.00 0.00 O ATOM 560 CB MET A 37 26.598 33.674 23.860 1.00 0.00 C ATOM 561 CG MET A 37 28.030 33.843 24.366 1.00 0.00 C ATOM 562 SD MET A 37 28.175 34.192 26.141 1.00 0.00 S ATOM 563 CE MET A 37 29.758 35.064 26.145 1.00 0.00 C ATOM 0 H MET A 37 26.824 36.158 22.194 1.00 0.00 H new ATOM 0 HA MET A 37 24.779 34.777 23.718 1.00 0.00 H new ATOM 0 HB2 MET A 37 26.035 33.105 24.600 1.00 0.00 H new ATOM 0 HB3 MET A 37 26.621 33.076 22.949 1.00 0.00 H new ATOM 0 HG2 MET A 37 28.589 32.934 24.142 1.00 0.00 H new ATOM 0 HG3 MET A 37 28.503 34.653 23.811 1.00 0.00 H new ATOM 0 HE1 MET A 37 29.794 35.749 26.992 1.00 0.00 H new ATOM 0 HE2 MET A 37 30.571 34.342 26.228 1.00 0.00 H new ATOM 0 HE3 MET A 37 29.866 35.627 25.218 1.00 0.00 H new ATOM 573 N GLU A 38 25.305 36.415 25.451 1.00 0.00 N ATOM 574 CA GLU A 38 25.486 37.396 26.534 1.00 0.00 C ATOM 575 C GLU A 38 25.870 36.729 27.870 1.00 0.00 C ATOM 576 O GLU A 38 25.011 36.210 28.590 1.00 0.00 O ATOM 577 CB GLU A 38 24.219 38.258 26.678 1.00 0.00 C ATOM 578 CG GLU A 38 24.010 39.236 25.511 1.00 0.00 C ATOM 579 CD GLU A 38 25.136 40.274 25.404 1.00 0.00 C ATOM 580 OE1 GLU A 38 25.481 40.910 26.428 1.00 0.00 O ATOM 581 OE2 GLU A 38 25.748 40.429 24.319 1.00 0.00 O ATOM 0 H GLU A 38 24.403 35.941 25.496 1.00 0.00 H new ATOM 0 HA GLU A 38 26.322 38.042 26.265 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.350 37.604 26.754 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.276 38.822 27.609 1.00 0.00 H new ATOM 0 HG2 GLU A 38 23.947 38.675 24.578 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.057 39.750 25.638 1.00 0.00 H new ATOM 588 N GLY A 39 27.163 36.777 28.215 1.00 0.00 N ATOM 589 CA GLY A 39 27.732 36.155 29.412 1.00 0.00 C ATOM 590 C GLY A 39 29.076 36.751 29.839 1.00 0.00 C ATOM 591 O GLY A 39 30.113 36.095 29.755 1.00 0.00 O ATOM 0 H GLY A 39 27.860 37.264 27.651 1.00 0.00 H new ATOM 0 HA2 GLY A 39 27.023 36.255 30.234 1.00 0.00 H new ATOM 0 HA3 GLY A 39 27.860 35.088 29.230 1.00 0.00 H new ATOM 595 N ALA A 40 29.062 37.983 30.356 1.00 0.00 N ATOM 596 CA ALA A 40 30.257 38.781 30.661 1.00 0.00 C ATOM 597 C ALA A 40 31.105 38.327 31.878 1.00 0.00 C ATOM 598 O ALA A 40 31.991 39.073 32.302 1.00 0.00 O ATOM 599 CB ALA A 40 29.827 40.251 30.770 1.00 0.00 C ATOM 0 H ALA A 40 28.194 38.469 30.581 1.00 0.00 H new ATOM 0 HA ALA A 40 30.953 38.626 29.836 1.00 0.00 H new ATOM 0 HB1 ALA A 40 30.696 40.869 30.996 1.00 0.00 H new ATOM 0 HB2 ALA A 40 29.389 40.573 29.825 1.00 0.00 H new ATOM 0 HB3 ALA A 40 29.090 40.356 31.566 1.00 0.00 H new ATOM 605 N CYS A 41 30.864 37.134 32.445 1.00 0.00 N ATOM 606 CA CYS A 41 31.571 36.622 33.632 1.00 0.00 C ATOM 607 C CYS A 41 33.100 36.584 33.466 1.00 0.00 C ATOM 608 O CYS A 41 33.614 36.603 32.340 1.00 0.00 O ATOM 609 CB CYS A 41 31.045 35.242 34.029 1.00 0.00 C ATOM 610 SG CYS A 41 31.029 34.945 35.801 1.00 0.00 S ATOM 0 H CYS A 41 30.161 36.487 32.087 1.00 0.00 H new ATOM 0 HA CYS A 41 31.363 37.332 34.433 1.00 0.00 H new ATOM 0 HB2 CYS A 41 30.032 35.126 33.643 1.00 0.00 H new ATOM 0 HB3 CYS A 41 31.658 34.479 33.549 1.00 0.00 H new ATOM 615 N GLY A 42 33.842 36.540 34.577 1.00 0.00 N ATOM 616 CA GLY A 42 35.303 36.676 34.545 1.00 0.00 C ATOM 617 C GLY A 42 35.752 38.106 34.207 1.00 0.00 C ATOM 618 O GLY A 42 36.567 38.295 33.301 1.00 0.00 O ATOM 0 H GLY A 42 33.455 36.411 35.512 1.00 0.00 H new ATOM 0 HA2 GLY A 42 35.713 36.389 35.513 1.00 0.00 H new ATOM 0 HA3 GLY A 42 35.713 35.986 33.808 1.00 0.00 H new ATOM 622 N GLY A 43 35.190 39.114 34.884 1.00 0.00 N ATOM 623 CA GLY A 43 35.381 40.548 34.607 1.00 0.00 C ATOM 624 C GLY A 43 34.106 41.408 34.512 1.00 0.00 C ATOM 625 O GLY A 43 34.208 42.614 34.280 1.00 0.00 O ATOM 0 H GLY A 43 34.564 38.950 35.672 1.00 0.00 H new ATOM 0 HA2 GLY A 43 36.015 40.965 35.389 1.00 0.00 H new ATOM 0 HA3 GLY A 43 35.927 40.644 33.669 1.00 0.00 H new ATOM 629 N SER A 44 32.912 40.848 34.744 1.00 0.00 N ATOM 630 CA SER A 44 31.694 41.609 35.077 1.00 0.00 C ATOM 631 C SER A 44 31.772 42.070 36.540 1.00 0.00 C ATOM 632 O SER A 44 31.355 41.358 37.453 1.00 0.00 O ATOM 633 CB SER A 44 30.442 40.757 34.807 1.00 0.00 C ATOM 634 OG SER A 44 30.565 39.455 35.349 1.00 0.00 O ATOM 0 H SER A 44 32.759 39.840 34.706 1.00 0.00 H new ATOM 0 HA SER A 44 31.622 42.493 34.444 1.00 0.00 H new ATOM 0 HB2 SER A 44 29.569 41.248 35.236 1.00 0.00 H new ATOM 0 HB3 SER A 44 30.274 40.689 33.732 1.00 0.00 H new ATOM 0 HG SER A 44 29.906 38.863 34.930 1.00 0.00 H new ATOM 640 N CYS A 45 32.422 43.215 36.782 1.00 0.00 N ATOM 641 CA CYS A 45 33.184 43.442 38.020 1.00 0.00 C ATOM 642 C CYS A 45 34.201 42.297 38.215 1.00 0.00 C ATOM 643 O CYS A 45 35.208 42.285 37.503 1.00 0.00 O ATOM 644 CB CYS A 45 32.270 43.775 39.214 1.00 0.00 C ATOM 645 SG CYS A 45 31.607 45.458 39.037 1.00 0.00 S ATOM 0 H CYS A 45 32.436 44.003 36.135 1.00 0.00 H new ATOM 0 HA CYS A 45 33.786 44.347 37.940 1.00 0.00 H new ATOM 0 HB2 CYS A 45 31.452 43.057 39.268 1.00 0.00 H new ATOM 0 HB3 CYS A 45 32.830 43.692 40.146 1.00 0.00 H new ATOM 0 HG CYS A 45 30.835 45.729 40.048 1.00 0.00 H new ATOM 651 N ALA A 46 33.940 41.311 39.080 1.00 0.00 N ATOM 652 CA ALA A 46 34.756 40.099 39.198 1.00 0.00 C ATOM 653 C ALA A 46 34.112 38.877 38.510 1.00 0.00 C ATOM 654 O ALA A 46 34.698 38.338 37.568 1.00 0.00 O ATOM 655 CB ALA A 46 35.092 39.856 40.674 1.00 0.00 C ATOM 0 H ALA A 46 33.149 41.333 39.724 1.00 0.00 H new ATOM 0 HA ALA A 46 35.690 40.252 38.658 1.00 0.00 H new ATOM 0 HB1 ALA A 46 35.699 38.955 40.765 1.00 0.00 H new ATOM 0 HB2 ALA A 46 35.647 40.709 41.066 1.00 0.00 H new ATOM 0 HB3 ALA A 46 34.170 39.731 41.241 1.00 0.00 H new ATOM 661 N CYS A 47 32.932 38.431 38.950 1.00 0.00 N ATOM 662 CA CYS A 47 32.246 37.232 38.440 1.00 0.00 C ATOM 663 C CYS A 47 30.723 37.277 38.723 1.00 0.00 C ATOM 664 O CYS A 47 30.262 38.044 39.569 1.00 0.00 O ATOM 665 CB CYS A 47 32.928 35.980 39.031 1.00 0.00 C ATOM 666 SG CYS A 47 33.825 34.928 37.862 1.00 0.00 S ATOM 0 H CYS A 47 32.411 38.903 39.689 1.00 0.00 H new ATOM 0 HA CYS A 47 32.335 37.194 37.354 1.00 0.00 H new ATOM 0 HB2 CYS A 47 33.625 36.303 39.805 1.00 0.00 H new ATOM 0 HB3 CYS A 47 32.166 35.374 39.521 1.00 0.00 H new ATOM 671 N SER A 48 29.904 36.516 37.988 1.00 0.00 N ATOM 672 CA SER A 48 28.426 36.620 37.985 1.00 0.00 C ATOM 673 C SER A 48 27.743 35.264 37.689 1.00 0.00 C ATOM 674 O SER A 48 28.370 34.223 37.822 1.00 0.00 O ATOM 675 CB SER A 48 28.002 37.707 36.984 1.00 0.00 C ATOM 676 OG SER A 48 28.643 38.940 37.278 1.00 0.00 O ATOM 0 H SER A 48 30.251 35.791 37.361 1.00 0.00 H new ATOM 0 HA SER A 48 28.093 36.905 38.983 1.00 0.00 H new ATOM 0 HB2 SER A 48 28.254 37.393 35.971 1.00 0.00 H new ATOM 0 HB3 SER A 48 26.920 37.837 37.018 1.00 0.00 H new ATOM 0 HG SER A 48 29.416 39.056 36.687 1.00 0.00 H new ATOM 682 N THR A 49 26.451 35.231 37.326 1.00 0.00 N ATOM 683 CA THR A 49 25.639 33.984 37.250 1.00 0.00 C ATOM 684 C THR A 49 26.019 32.941 36.180 1.00 0.00 C ATOM 685 O THR A 49 25.358 31.909 36.098 1.00 0.00 O ATOM 686 CB THR A 49 24.126 34.272 37.181 1.00 0.00 C ATOM 687 OG1 THR A 49 23.837 35.280 36.244 1.00 0.00 O ATOM 688 CG2 THR A 49 23.535 34.731 38.508 1.00 0.00 C ATOM 0 H THR A 49 25.928 36.069 37.073 1.00 0.00 H new ATOM 0 HA THR A 49 25.900 33.507 38.195 1.00 0.00 H new ATOM 0 HB THR A 49 23.681 33.319 36.895 1.00 0.00 H new ATOM 0 HG1 THR A 49 24.041 36.156 36.633 1.00 0.00 H new ATOM 0 HG21 THR A 49 22.468 34.916 38.386 1.00 0.00 H new ATOM 0 HG22 THR A 49 23.686 33.957 39.261 1.00 0.00 H new ATOM 0 HG23 THR A 49 24.028 35.649 38.828 1.00 0.00 H new ATOM 696 N CYS A 50 27.077 33.164 35.387 1.00 0.00 N ATOM 697 CA CYS A 50 27.799 32.121 34.633 1.00 0.00 C ATOM 698 C CYS A 50 26.934 31.097 33.864 1.00 0.00 C ATOM 699 O CYS A 50 27.151 29.882 33.941 1.00 0.00 O ATOM 700 CB CYS A 50 28.763 31.446 35.606 1.00 0.00 C ATOM 701 SG CYS A 50 30.182 30.569 34.924 1.00 0.00 S ATOM 0 H CYS A 50 27.466 34.096 35.247 1.00 0.00 H new ATOM 0 HA CYS A 50 28.323 32.620 33.817 1.00 0.00 H new ATOM 0 HB2 CYS A 50 29.139 32.210 36.287 1.00 0.00 H new ATOM 0 HB3 CYS A 50 28.190 30.738 36.206 1.00 0.00 H new ATOM 706 N HIS A 51 25.906 31.550 33.134 1.00 0.00 N ATOM 707 CA HIS A 51 24.766 30.658 32.925 1.00 0.00 C ATOM 708 C HIS A 51 24.958 29.813 31.654 1.00 0.00 C ATOM 709 O HIS A 51 24.677 30.213 30.529 1.00 0.00 O ATOM 710 CB HIS A 51 23.447 31.451 32.955 1.00 0.00 C ATOM 711 CG HIS A 51 22.238 30.639 33.377 1.00 0.00 C ATOM 712 ND1 HIS A 51 21.103 31.149 33.966 1.00 0.00 N ATOM 713 CD2 HIS A 51 22.064 29.278 33.312 1.00 0.00 C ATOM 714 CE1 HIS A 51 20.286 30.131 34.269 1.00 0.00 C ATOM 715 NE2 HIS A 51 20.817 28.963 33.869 1.00 0.00 N ATOM 0 H HIS A 51 25.840 32.472 32.703 1.00 0.00 H new ATOM 0 HA HIS A 51 24.707 29.945 33.747 1.00 0.00 H new ATOM 0 HB2 HIS A 51 23.559 32.294 33.637 1.00 0.00 H new ATOM 0 HB3 HIS A 51 23.263 31.865 31.964 1.00 0.00 H new ATOM 0 HD1 HIS A 51 20.915 32.136 34.142 1.00 0.00 H new ATOM 0 HD2 HIS A 51 22.769 28.570 32.901 1.00 0.00 H new ATOM 0 HE1 HIS A 51 19.333 30.235 34.766 1.00 0.00 H new ATOM 723 N VAL A 52 25.385 28.580 31.906 1.00 0.00 N ATOM 724 CA VAL A 52 25.437 27.419 31.008 1.00 0.00 C ATOM 725 C VAL A 52 24.837 26.192 31.653 1.00 0.00 C ATOM 726 O VAL A 52 24.836 26.022 32.875 1.00 0.00 O ATOM 727 CB VAL A 52 26.855 26.995 30.561 1.00 0.00 C ATOM 728 CG1 VAL A 52 27.185 27.365 29.137 1.00 0.00 C ATOM 729 CG2 VAL A 52 27.972 27.547 31.462 1.00 0.00 C ATOM 0 H VAL A 52 25.739 28.340 32.832 1.00 0.00 H new ATOM 0 HA VAL A 52 24.875 27.762 30.139 1.00 0.00 H new ATOM 0 HB VAL A 52 26.820 25.909 30.647 1.00 0.00 H new ATOM 0 HG11 VAL A 52 28.196 27.034 28.900 1.00 0.00 H new ATOM 0 HG12 VAL A 52 26.478 26.883 28.462 1.00 0.00 H new ATOM 0 HG13 VAL A 52 27.120 28.447 29.018 1.00 0.00 H new ATOM 0 HG21 VAL A 52 28.940 27.210 31.090 1.00 0.00 H new ATOM 0 HG22 VAL A 52 27.940 28.637 31.455 1.00 0.00 H new ATOM 0 HG23 VAL A 52 27.830 27.186 32.481 1.00 0.00 H new ATOM 739 N ILE A 53 24.441 25.273 30.788 1.00 0.00 N ATOM 740 CA ILE A 53 24.054 23.921 31.107 1.00 0.00 C ATOM 741 C ILE A 53 24.647 22.947 30.087 1.00 0.00 C ATOM 742 O ILE A 53 24.684 23.248 28.908 1.00 0.00 O ATOM 743 CB ILE A 53 22.525 23.908 31.211 1.00 0.00 C ATOM 744 CG1 ILE A 53 22.160 22.500 31.674 1.00 0.00 C ATOM 745 CG2 ILE A 53 21.840 24.397 29.915 1.00 0.00 C ATOM 746 CD1 ILE A 53 20.875 21.996 31.120 1.00 0.00 C ATOM 0 H ILE A 53 24.380 25.468 29.789 1.00 0.00 H new ATOM 0 HA ILE A 53 24.452 23.580 32.063 1.00 0.00 H new ATOM 0 HB ILE A 53 22.146 24.627 31.937 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.960 21.816 31.390 1.00 0.00 H new ATOM 0 HG13 ILE A 53 22.104 22.490 32.762 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.758 24.368 30.042 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.153 25.419 29.701 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.125 23.749 29.086 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.686 20.990 31.496 1.00 0.00 H new ATOM 0 HD12 ILE A 53 20.063 22.656 31.426 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.932 21.972 30.032 1.00 0.00 H new ATOM 758 N VAL A 54 25.048 21.757 30.529 1.00 0.00 N ATOM 759 CA VAL A 54 25.625 20.672 29.737 1.00 0.00 C ATOM 760 C VAL A 54 24.596 19.627 29.319 1.00 0.00 C ATOM 761 O VAL A 54 23.551 19.444 29.954 1.00 0.00 O ATOM 762 CB VAL A 54 26.792 20.096 30.556 1.00 0.00 C ATOM 763 CG1 VAL A 54 26.366 19.160 31.642 1.00 0.00 C ATOM 764 CG2 VAL A 54 27.819 19.274 29.761 1.00 0.00 C ATOM 0 H VAL A 54 24.974 21.508 31.515 1.00 0.00 H new ATOM 0 HA VAL A 54 25.995 21.050 28.784 1.00 0.00 H new ATOM 0 HB VAL A 54 27.233 21.018 30.936 1.00 0.00 H new ATOM 0 HG11 VAL A 54 27.245 18.796 32.174 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.711 19.684 32.338 1.00 0.00 H new ATOM 0 HG13 VAL A 54 25.831 18.316 31.206 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.598 18.916 30.434 1.00 0.00 H new ATOM 0 HG22 VAL A 54 27.322 18.423 29.296 1.00 0.00 H new ATOM 0 HG23 VAL A 54 28.266 19.900 28.989 1.00 0.00 H new ATOM 774 N ASP A 55 24.925 18.918 28.242 1.00 0.00 N ATOM 775 CA ASP A 55 24.284 17.659 27.883 1.00 0.00 C ATOM 776 C ASP A 55 24.356 16.674 29.088 1.00 0.00 C ATOM 777 O ASP A 55 25.453 16.503 29.643 1.00 0.00 O ATOM 778 CB ASP A 55 25.127 17.080 26.732 1.00 0.00 C ATOM 779 CG ASP A 55 24.499 15.877 26.017 1.00 0.00 C ATOM 780 OD1 ASP A 55 23.534 15.278 26.538 1.00 0.00 O ATOM 781 OD2 ASP A 55 24.929 15.547 24.892 1.00 0.00 O ATOM 0 H ASP A 55 25.653 19.206 27.588 1.00 0.00 H new ATOM 0 HA ASP A 55 23.239 17.805 27.608 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.306 17.867 26.000 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.099 16.784 27.126 1.00 0.00 H new ATOM 786 N PRO A 56 23.292 15.917 29.430 1.00 0.00 N ATOM 787 CA PRO A 56 23.358 14.823 30.404 1.00 0.00 C ATOM 788 C PRO A 56 24.359 13.720 30.050 1.00 0.00 C ATOM 789 O PRO A 56 24.767 12.959 30.926 1.00 0.00 O ATOM 790 CB PRO A 56 21.939 14.252 30.479 1.00 0.00 C ATOM 791 CG PRO A 56 21.074 15.463 30.154 1.00 0.00 C ATOM 792 CD PRO A 56 21.902 16.174 29.085 1.00 0.00 C ATOM 0 HA PRO A 56 23.716 15.214 31.357 1.00 0.00 H new ATOM 0 HB2 PRO A 56 21.789 13.444 29.763 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.716 13.849 31.467 1.00 0.00 H new ATOM 0 HG2 PRO A 56 20.091 15.173 29.782 1.00 0.00 H new ATOM 0 HG3 PRO A 56 20.911 16.093 31.028 1.00 0.00 H new ATOM 0 HD2 PRO A 56 21.668 15.793 28.091 1.00 0.00 H new ATOM 0 HD3 PRO A 56 21.692 17.244 29.074 1.00 0.00 H new ATOM 800 N ASP A 57 24.789 13.634 28.790 1.00 0.00 N ATOM 801 CA ASP A 57 25.818 12.691 28.357 1.00 0.00 C ATOM 802 C ASP A 57 27.221 13.109 28.818 1.00 0.00 C ATOM 803 O ASP A 57 27.998 12.243 29.236 1.00 0.00 O ATOM 804 CB ASP A 57 25.748 12.516 26.832 1.00 0.00 C ATOM 805 CG ASP A 57 24.923 11.286 26.456 1.00 0.00 C ATOM 806 OD1 ASP A 57 23.681 11.309 26.624 1.00 0.00 O ATOM 807 OD2 ASP A 57 25.502 10.284 25.975 1.00 0.00 O ATOM 0 H ASP A 57 24.430 14.221 28.037 1.00 0.00 H new ATOM 0 HA ASP A 57 25.621 11.729 28.831 1.00 0.00 H new ATOM 0 HB2 ASP A 57 25.307 13.405 26.381 1.00 0.00 H new ATOM 0 HB3 ASP A 57 26.756 12.419 26.427 1.00 0.00 H new ATOM 812 N TYR A 58 27.552 14.414 28.796 1.00 0.00 N ATOM 813 CA TYR A 58 28.888 14.892 29.122 1.00 0.00 C ATOM 814 C TYR A 58 29.066 15.340 30.565 1.00 0.00 C ATOM 815 O TYR A 58 30.131 15.089 31.120 1.00 0.00 O ATOM 816 CB TYR A 58 29.227 16.013 28.159 1.00 0.00 C ATOM 817 CG TYR A 58 29.559 15.473 26.795 1.00 0.00 C ATOM 818 CD1 TYR A 58 30.851 14.992 26.509 1.00 0.00 C ATOM 819 CD2 TYR A 58 28.536 15.377 25.840 1.00 0.00 C ATOM 820 CE1 TYR A 58 31.108 14.404 25.257 1.00 0.00 C ATOM 821 CE2 TYR A 58 28.794 14.817 24.581 1.00 0.00 C ATOM 822 CZ TYR A 58 30.082 14.300 24.293 1.00 0.00 C ATOM 823 OH TYR A 58 30.353 13.683 23.113 1.00 0.00 O ATOM 0 H TYR A 58 26.896 15.156 28.551 1.00 0.00 H new ATOM 0 HA TYR A 58 29.575 14.052 29.016 1.00 0.00 H new ATOM 0 HB2 TYR A 58 28.385 16.701 28.086 1.00 0.00 H new ATOM 0 HB3 TYR A 58 30.072 16.584 28.543 1.00 0.00 H new ATOM 0 HD1 TYR A 58 31.638 15.074 27.244 1.00 0.00 H new ATOM 0 HD2 TYR A 58 27.545 15.736 26.076 1.00 0.00 H new ATOM 0 HE1 TYR A 58 32.096 14.030 25.032 1.00 0.00 H new ATOM 0 HE2 TYR A 58 28.015 14.780 23.834 1.00 0.00 H new ATOM 0 HH TYR A 58 29.551 13.686 22.550 1.00 0.00 H new ATOM 833 N TYR A 59 28.034 15.911 31.207 1.00 0.00 N ATOM 834 CA TYR A 59 28.070 16.178 32.670 1.00 0.00 C ATOM 835 C TYR A 59 28.486 14.958 33.458 1.00 0.00 C ATOM 836 O TYR A 59 28.992 15.044 34.574 1.00 0.00 O ATOM 837 CB TYR A 59 26.672 16.396 33.259 1.00 0.00 C ATOM 838 CG TYR A 59 26.604 17.293 34.498 1.00 0.00 C ATOM 839 CD1 TYR A 59 27.240 18.547 34.532 1.00 0.00 C ATOM 840 CD2 TYR A 59 25.911 16.873 35.648 1.00 0.00 C ATOM 841 CE1 TYR A 59 27.145 19.382 35.644 1.00 0.00 C ATOM 842 CE2 TYR A 59 25.880 17.671 36.808 1.00 0.00 C ATOM 843 CZ TYR A 59 26.492 18.941 36.810 1.00 0.00 C ATOM 844 OH TYR A 59 26.401 19.756 37.892 1.00 0.00 O ATOM 0 H TYR A 59 27.169 16.197 30.749 1.00 0.00 H new ATOM 0 HA TYR A 59 28.740 17.034 32.749 1.00 0.00 H new ATOM 0 HB2 TYR A 59 26.036 16.827 32.486 1.00 0.00 H new ATOM 0 HB3 TYR A 59 26.250 15.424 33.514 1.00 0.00 H new ATOM 0 HD1 TYR A 59 27.815 18.870 33.677 1.00 0.00 H new ATOM 0 HD2 TYR A 59 25.395 15.924 35.641 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.575 20.372 35.611 1.00 0.00 H new ATOM 0 HE2 TYR A 59 25.386 17.309 37.698 1.00 0.00 H new ATOM 0 HH TYR A 59 25.727 19.404 38.511 1.00 0.00 H new ATOM 854 N ASP A 60 28.130 13.798 32.913 1.00 0.00 N ATOM 855 CA ASP A 60 28.105 12.589 33.688 1.00 0.00 C ATOM 856 C ASP A 60 29.528 12.124 34.062 1.00 0.00 C ATOM 857 O ASP A 60 29.727 11.256 34.910 1.00 0.00 O ATOM 858 CB ASP A 60 27.411 11.536 32.850 1.00 0.00 C ATOM 859 CG ASP A 60 27.089 10.254 33.609 1.00 0.00 C ATOM 860 OD1 ASP A 60 26.678 10.317 34.794 1.00 0.00 O ATOM 861 OD2 ASP A 60 27.212 9.183 32.972 1.00 0.00 O ATOM 0 H ASP A 60 27.857 13.683 31.937 1.00 0.00 H new ATOM 0 HA ASP A 60 27.575 12.760 34.625 1.00 0.00 H new ATOM 0 HB2 ASP A 60 26.486 11.954 32.453 1.00 0.00 H new ATOM 0 HB3 ASP A 60 28.042 11.292 31.996 1.00 0.00 H new ATOM 866 N ALA A 61 30.515 12.732 33.399 1.00 0.00 N ATOM 867 CA ALA A 61 31.947 12.530 33.581 1.00 0.00 C ATOM 868 C ALA A 61 32.608 13.707 34.333 1.00 0.00 C ATOM 869 O ALA A 61 33.827 13.707 34.533 1.00 0.00 O ATOM 870 CB ALA A 61 32.541 12.308 32.186 1.00 0.00 C ATOM 0 H ALA A 61 30.318 13.423 32.675 1.00 0.00 H new ATOM 0 HA ALA A 61 32.139 11.662 34.211 1.00 0.00 H new ATOM 0 HB1 ALA A 61 33.616 12.151 32.269 1.00 0.00 H new ATOM 0 HB2 ALA A 61 32.081 11.432 31.730 1.00 0.00 H new ATOM 0 HB3 ALA A 61 32.349 13.183 31.565 1.00 0.00 H new ATOM 876 N LEU A 62 31.805 14.708 34.724 1.00 0.00 N ATOM 877 CA LEU A 62 32.220 15.974 35.341 1.00 0.00 C ATOM 878 C LEU A 62 31.930 16.029 36.854 1.00 0.00 C ATOM 879 O LEU A 62 30.905 15.508 37.305 1.00 0.00 O ATOM 880 CB LEU A 62 31.482 17.153 34.672 1.00 0.00 C ATOM 881 CG LEU A 62 31.687 17.356 33.166 1.00 0.00 C ATOM 882 CD1 LEU A 62 31.143 18.736 32.783 1.00 0.00 C ATOM 883 CD2 LEU A 62 33.131 17.224 32.680 1.00 0.00 C ATOM 0 H LEU A 62 30.793 14.651 34.611 1.00 0.00 H new ATOM 0 HA LEU A 62 33.298 16.045 35.196 1.00 0.00 H new ATOM 0 HB2 LEU A 62 30.414 17.026 34.852 1.00 0.00 H new ATOM 0 HB3 LEU A 62 31.784 18.070 35.179 1.00 0.00 H new ATOM 0 HG LEU A 62 31.147 16.547 32.674 1.00 0.00 H new ATOM 0 HD11 LEU A 62 31.281 18.898 31.714 1.00 0.00 H new ATOM 0 HD12 LEU A 62 30.081 18.788 33.024 1.00 0.00 H new ATOM 0 HD13 LEU A 62 31.679 19.505 33.338 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.168 17.385 31.603 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.752 17.967 33.180 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.503 16.226 32.911 1.00 0.00 H new ATOM 895 N PRO A 63 32.749 16.758 37.632 1.00 0.00 N ATOM 896 CA PRO A 63 32.418 17.166 38.994 1.00 0.00 C ATOM 897 C PRO A 63 31.336 18.258 39.000 1.00 0.00 C ATOM 898 O PRO A 63 31.328 19.153 38.149 1.00 0.00 O ATOM 899 CB PRO A 63 33.733 17.681 39.587 1.00 0.00 C ATOM 900 CG PRO A 63 34.482 18.226 38.371 1.00 0.00 C ATOM 901 CD PRO A 63 34.032 17.319 37.234 1.00 0.00 C ATOM 0 HA PRO A 63 32.008 16.341 39.577 1.00 0.00 H new ATOM 0 HB2 PRO A 63 33.561 18.457 40.333 1.00 0.00 H new ATOM 0 HB3 PRO A 63 34.291 16.884 40.079 1.00 0.00 H new ATOM 0 HG2 PRO A 63 34.227 19.268 38.177 1.00 0.00 H new ATOM 0 HG3 PRO A 63 35.562 18.184 38.514 1.00 0.00 H new ATOM 0 HD2 PRO A 63 33.938 17.881 36.305 1.00 0.00 H new ATOM 0 HD3 PRO A 63 34.762 16.529 37.056 1.00 0.00 H new ATOM 909 N GLU A 64 30.469 18.241 40.008 1.00 0.00 N ATOM 910 CA GLU A 64 29.599 19.372 40.378 1.00 0.00 C ATOM 911 C GLU A 64 30.443 20.520 40.972 1.00 0.00 C ATOM 912 O GLU A 64 31.558 20.259 41.436 1.00 0.00 O ATOM 913 CB GLU A 64 28.548 18.894 41.392 1.00 0.00 C ATOM 914 CG GLU A 64 27.539 17.922 40.764 1.00 0.00 C ATOM 915 CD GLU A 64 26.897 17.045 41.839 1.00 0.00 C ATOM 916 OE1 GLU A 64 25.920 17.473 42.499 1.00 0.00 O ATOM 917 OE2 GLU A 64 27.411 15.927 42.082 1.00 0.00 O ATOM 0 H GLU A 64 30.343 17.426 40.609 1.00 0.00 H new ATOM 0 HA GLU A 64 29.092 19.747 39.489 1.00 0.00 H new ATOM 0 HB2 GLU A 64 29.048 18.406 42.229 1.00 0.00 H new ATOM 0 HB3 GLU A 64 28.017 19.756 41.796 1.00 0.00 H new ATOM 0 HG2 GLU A 64 26.768 18.482 40.235 1.00 0.00 H new ATOM 0 HG3 GLU A 64 28.040 17.295 40.027 1.00 0.00 H new ATOM 924 N PRO A 65 29.981 21.786 40.971 1.00 0.00 N ATOM 925 CA PRO A 65 30.836 22.910 41.328 1.00 0.00 C ATOM 926 C PRO A 65 30.984 23.034 42.853 1.00 0.00 C ATOM 927 O PRO A 65 30.112 22.576 43.604 1.00 0.00 O ATOM 928 CB PRO A 65 30.175 24.123 40.663 1.00 0.00 C ATOM 929 CG PRO A 65 29.096 23.560 39.740 1.00 0.00 C ATOM 930 CD PRO A 65 28.714 22.328 40.502 1.00 0.00 C ATOM 0 HA PRO A 65 31.863 22.798 40.979 1.00 0.00 H new ATOM 0 HB2 PRO A 65 29.742 24.789 41.409 1.00 0.00 H new ATOM 0 HB3 PRO A 65 30.905 24.706 40.101 1.00 0.00 H new ATOM 0 HG2 PRO A 65 28.259 24.246 39.611 1.00 0.00 H new ATOM 0 HG3 PRO A 65 29.477 23.332 38.745 1.00 0.00 H new ATOM 0 HD2 PRO A 65 28.051 22.565 41.334 1.00 0.00 H new ATOM 0 HD3 PRO A 65 28.187 21.615 39.867 1.00 0.00 H new ATOM 938 N GLU A 66 32.059 23.661 43.336 1.00 0.00 N ATOM 939 CA GLU A 66 32.213 23.912 44.779 1.00 0.00 C ATOM 940 C GLU A 66 31.222 24.959 45.315 1.00 0.00 C ATOM 941 O GLU A 66 30.578 25.666 44.541 1.00 0.00 O ATOM 942 CB GLU A 66 33.674 24.160 45.170 1.00 0.00 C ATOM 943 CG GLU A 66 34.145 25.585 44.909 1.00 0.00 C ATOM 944 CD GLU A 66 35.543 25.790 45.490 1.00 0.00 C ATOM 945 OE1 GLU A 66 35.684 26.011 46.717 1.00 0.00 O ATOM 946 OE2 GLU A 66 36.541 25.704 44.733 1.00 0.00 O ATOM 0 H GLU A 66 32.829 24.002 42.761 1.00 0.00 H new ATOM 0 HA GLU A 66 31.933 22.993 45.294 1.00 0.00 H new ATOM 0 HB2 GLU A 66 33.801 23.933 46.229 1.00 0.00 H new ATOM 0 HB3 GLU A 66 34.311 23.469 44.617 1.00 0.00 H new ATOM 0 HG2 GLU A 66 34.156 25.782 43.837 1.00 0.00 H new ATOM 0 HG3 GLU A 66 33.449 26.294 45.357 1.00 0.00 H new ATOM 953 N ASP A 67 31.103 25.095 46.637 1.00 0.00 N ATOM 954 CA ASP A 67 30.157 26.018 47.288 1.00 0.00 C ATOM 955 C ASP A 67 30.369 27.513 46.932 1.00 0.00 C ATOM 956 O ASP A 67 29.451 28.318 47.084 1.00 0.00 O ATOM 957 CB ASP A 67 30.222 25.771 48.806 1.00 0.00 C ATOM 958 CG ASP A 67 29.015 26.329 49.561 1.00 0.00 C ATOM 959 OD1 ASP A 67 27.887 25.811 49.377 1.00 0.00 O ATOM 960 OD2 ASP A 67 29.186 27.250 50.398 1.00 0.00 O ATOM 0 H ASP A 67 31.667 24.562 47.299 1.00 0.00 H new ATOM 0 HA ASP A 67 29.159 25.803 46.905 1.00 0.00 H new ATOM 0 HB2 ASP A 67 30.293 24.699 48.990 1.00 0.00 H new ATOM 0 HB3 ASP A 67 31.131 26.224 49.202 1.00 0.00 H new ATOM 965 N ASP A 68 31.552 27.883 46.429 1.00 0.00 N ATOM 966 CA ASP A 68 31.893 29.205 45.877 1.00 0.00 C ATOM 967 C ASP A 68 31.533 29.341 44.388 1.00 0.00 C ATOM 968 O ASP A 68 31.437 30.461 43.883 1.00 0.00 O ATOM 969 CB ASP A 68 33.402 29.449 46.072 1.00 0.00 C ATOM 970 CG ASP A 68 33.834 30.899 45.822 1.00 0.00 C ATOM 971 OD1 ASP A 68 33.168 31.840 46.314 1.00 0.00 O ATOM 972 OD2 ASP A 68 34.893 31.114 45.186 1.00 0.00 O ATOM 0 H ASP A 68 32.340 27.237 46.393 1.00 0.00 H new ATOM 0 HA ASP A 68 31.305 29.951 46.412 1.00 0.00 H new ATOM 0 HB2 ASP A 68 33.677 29.168 47.089 1.00 0.00 H new ATOM 0 HB3 ASP A 68 33.956 28.794 45.400 1.00 0.00 H new ATOM 977 N GLU A 69 31.374 28.219 43.677 1.00 0.00 N ATOM 978 CA GLU A 69 30.888 28.158 42.297 1.00 0.00 C ATOM 979 C GLU A 69 29.356 28.035 42.238 1.00 0.00 C ATOM 980 O GLU A 69 28.702 28.914 41.689 1.00 0.00 O ATOM 981 CB GLU A 69 31.507 26.984 41.526 1.00 0.00 C ATOM 982 CG GLU A 69 32.977 27.061 41.106 1.00 0.00 C ATOM 983 CD GLU A 69 33.408 25.714 40.497 1.00 0.00 C ATOM 984 OE1 GLU A 69 33.257 25.486 39.271 1.00 0.00 O ATOM 985 OE2 GLU A 69 33.893 24.853 41.270 1.00 0.00 O ATOM 0 H GLU A 69 31.588 27.298 44.061 1.00 0.00 H new ATOM 0 HA GLU A 69 31.192 29.094 41.829 1.00 0.00 H new ATOM 0 HB2 GLU A 69 31.386 26.090 42.137 1.00 0.00 H new ATOM 0 HB3 GLU A 69 30.915 26.835 40.623 1.00 0.00 H new ATOM 0 HG2 GLU A 69 33.117 27.862 40.380 1.00 0.00 H new ATOM 0 HG3 GLU A 69 33.601 27.299 41.968 1.00 0.00 H new ATOM 992 N ASN A 70 28.751 26.973 42.801 1.00 0.00 N ATOM 993 CA ASN A 70 27.313 26.691 42.666 1.00 0.00 C ATOM 994 C ASN A 70 26.369 27.775 43.240 1.00 0.00 C ATOM 995 O ASN A 70 25.226 27.893 42.785 1.00 0.00 O ATOM 996 CB ASN A 70 27.016 25.268 43.183 1.00 0.00 C ATOM 997 CG ASN A 70 27.233 25.027 44.672 1.00 0.00 C ATOM 998 OD1 ASN A 70 26.735 25.740 45.532 1.00 0.00 O ATOM 999 ND2 ASN A 70 27.948 23.986 45.031 1.00 0.00 N ATOM 0 H ASN A 70 29.250 26.284 43.365 1.00 0.00 H new ATOM 0 HA ASN A 70 27.080 26.731 41.602 1.00 0.00 H new ATOM 0 HB2 ASN A 70 25.979 25.028 42.946 1.00 0.00 H new ATOM 0 HB3 ASN A 70 27.640 24.567 42.629 1.00 0.00 H new ATOM 0 HD21 ASN A 70 28.084 23.778 46.020 1.00 0.00 H new ATOM 0 HD22 ASN A 70 28.367 23.386 44.321 1.00 0.00 H new ATOM 1006 N ASP A 71 26.861 28.617 44.155 1.00 0.00 N ATOM 1007 CA ASP A 71 26.162 29.810 44.664 1.00 0.00 C ATOM 1008 C ASP A 71 26.296 31.052 43.769 1.00 0.00 C ATOM 1009 O ASP A 71 25.604 32.032 44.012 1.00 0.00 O ATOM 1010 CB ASP A 71 26.616 30.152 46.086 1.00 0.00 C ATOM 1011 CG ASP A 71 25.492 30.778 46.919 1.00 0.00 C ATOM 1012 OD1 ASP A 71 24.413 30.150 47.065 1.00 0.00 O ATOM 1013 OD2 ASP A 71 25.701 31.877 47.490 1.00 0.00 O ATOM 0 H ASP A 71 27.781 28.487 44.576 1.00 0.00 H new ATOM 0 HA ASP A 71 25.107 29.537 44.663 1.00 0.00 H new ATOM 0 HB2 ASP A 71 26.971 29.247 46.580 1.00 0.00 H new ATOM 0 HB3 ASP A 71 27.459 30.842 46.040 1.00 0.00 H new ATOM 1018 N MET A 72 27.189 31.074 42.772 1.00 0.00 N ATOM 1019 CA MET A 72 27.136 32.101 41.716 1.00 0.00 C ATOM 1020 C MET A 72 25.858 31.942 40.879 1.00 0.00 C ATOM 1021 O MET A 72 25.294 32.922 40.412 1.00 0.00 O ATOM 1022 CB MET A 72 28.391 32.056 40.828 1.00 0.00 C ATOM 1023 CG MET A 72 29.680 32.314 41.617 1.00 0.00 C ATOM 1024 SD MET A 72 29.747 33.856 42.576 1.00 0.00 S ATOM 1025 CE MET A 72 29.522 35.074 41.251 1.00 0.00 C ATOM 0 H MET A 72 27.950 30.402 42.671 1.00 0.00 H new ATOM 0 HA MET A 72 27.113 33.080 42.195 1.00 0.00 H new ATOM 0 HB2 MET A 72 28.454 31.081 40.344 1.00 0.00 H new ATOM 0 HB3 MET A 72 28.299 32.800 40.037 1.00 0.00 H new ATOM 0 HG2 MET A 72 29.834 31.480 42.301 1.00 0.00 H new ATOM 0 HG3 MET A 72 30.515 32.311 40.917 1.00 0.00 H new ATOM 0 HE1 MET A 72 29.899 36.043 41.579 1.00 0.00 H new ATOM 0 HE2 MET A 72 30.069 34.753 40.365 1.00 0.00 H new ATOM 0 HE3 MET A 72 28.462 35.160 41.012 1.00 0.00 H new ATOM 1035 N LEU A 73 25.411 30.696 40.698 1.00 0.00 N ATOM 1036 CA LEU A 73 24.468 30.242 39.680 1.00 0.00 C ATOM 1037 C LEU A 73 23.001 30.347 40.107 1.00 0.00 C ATOM 1038 O LEU A 73 22.190 30.940 39.411 1.00 0.00 O ATOM 1039 CB LEU A 73 24.817 28.798 39.297 1.00 0.00 C ATOM 1040 CG LEU A 73 26.293 28.398 39.268 1.00 0.00 C ATOM 1041 CD1 LEU A 73 26.344 26.905 38.937 1.00 0.00 C ATOM 1042 CD2 LEU A 73 27.073 29.259 38.274 1.00 0.00 C ATOM 0 H LEU A 73 25.720 29.931 41.298 1.00 0.00 H new ATOM 0 HA LEU A 73 24.568 30.906 38.821 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.305 28.135 39.995 1.00 0.00 H new ATOM 0 HB3 LEU A 73 24.399 28.605 38.309 1.00 0.00 H new ATOM 0 HG LEU A 73 26.772 28.570 40.232 1.00 0.00 H new ATOM 0 HD11 LEU A 73 27.382 26.575 38.906 1.00 0.00 H new ATOM 0 HD12 LEU A 73 25.808 26.344 39.702 1.00 0.00 H new ATOM 0 HD13 LEU A 73 25.879 26.731 37.967 1.00 0.00 H new ATOM 0 HD21 LEU A 73 28.120 28.955 38.272 1.00 0.00 H new ATOM 0 HD22 LEU A 73 26.656 29.130 37.275 1.00 0.00 H new ATOM 0 HD23 LEU A 73 27.000 30.307 38.565 1.00 0.00 H new ATOM 1054 N ASP A 74 22.670 29.772 41.268 1.00 0.00 N ATOM 1055 CA ASP A 74 21.371 29.831 41.968 1.00 0.00 C ATOM 1056 C ASP A 74 20.748 31.240 42.059 1.00 0.00 C ATOM 1057 O ASP A 74 19.531 31.370 42.216 1.00 0.00 O ATOM 1058 CB ASP A 74 21.562 29.285 43.404 1.00 0.00 C ATOM 1059 CG ASP A 74 20.552 28.190 43.751 1.00 0.00 C ATOM 1060 OD1 ASP A 74 20.773 27.031 43.325 1.00 0.00 O ATOM 1061 OD2 ASP A 74 19.537 28.475 44.431 1.00 0.00 O ATOM 0 H ASP A 74 23.348 29.212 41.785 1.00 0.00 H new ATOM 0 HA ASP A 74 20.680 29.231 41.377 1.00 0.00 H new ATOM 0 HB2 ASP A 74 22.572 28.890 43.508 1.00 0.00 H new ATOM 0 HB3 ASP A 74 21.465 30.104 44.117 1.00 0.00 H new ATOM 1066 N LEU A 75 21.567 32.293 41.951 1.00 0.00 N ATOM 1067 CA LEU A 75 21.126 33.686 41.896 1.00 0.00 C ATOM 1068 C LEU A 75 20.480 34.071 40.549 1.00 0.00 C ATOM 1069 O LEU A 75 19.933 35.169 40.437 1.00 0.00 O ATOM 1070 CB LEU A 75 22.314 34.603 42.229 1.00 0.00 C ATOM 1071 CG LEU A 75 23.103 34.254 43.507 1.00 0.00 C ATOM 1072 CD1 LEU A 75 24.049 35.414 43.797 1.00 0.00 C ATOM 1073 CD2 LEU A 75 22.226 34.012 44.734 1.00 0.00 C ATOM 0 H LEU A 75 22.581 32.194 41.898 1.00 0.00 H new ATOM 0 HA LEU A 75 20.339 33.814 42.639 1.00 0.00 H new ATOM 0 HB2 LEU A 75 23.004 34.590 41.385 1.00 0.00 H new ATOM 0 HB3 LEU A 75 21.944 35.624 42.322 1.00 0.00 H new ATOM 0 HG LEU A 75 23.629 33.318 43.321 1.00 0.00 H new ATOM 0 HD11 LEU A 75 24.624 35.198 44.698 1.00 0.00 H new ATOM 0 HD12 LEU A 75 24.729 35.548 42.956 1.00 0.00 H new ATOM 0 HD13 LEU A 75 23.471 36.326 43.945 1.00 0.00 H new ATOM 0 HD21 LEU A 75 22.856 33.772 45.590 1.00 0.00 H new ATOM 0 HD22 LEU A 75 21.647 34.910 44.950 1.00 0.00 H new ATOM 0 HD23 LEU A 75 21.548 33.181 44.539 1.00 0.00 H new ATOM 1085 N ALA A 76 20.522 33.184 39.549 1.00 0.00 N ATOM 1086 CA ALA A 76 19.733 33.247 38.318 1.00 0.00 C ATOM 1087 C ALA A 76 18.517 32.298 38.334 1.00 0.00 C ATOM 1088 O ALA A 76 18.557 31.187 38.875 1.00 0.00 O ATOM 1089 CB ALA A 76 20.633 32.948 37.115 1.00 0.00 C ATOM 0 H ALA A 76 21.134 32.368 39.579 1.00 0.00 H new ATOM 0 HA ALA A 76 19.332 34.258 38.240 1.00 0.00 H new ATOM 0 HB1 ALA A 76 20.044 32.995 36.199 1.00 0.00 H new ATOM 0 HB2 ALA A 76 21.435 33.684 37.069 1.00 0.00 H new ATOM 0 HB3 ALA A 76 21.061 31.951 37.220 1.00 0.00 H new ATOM 1095 N TYR A 77 17.442 32.723 37.666 1.00 0.00 N ATOM 1096 CA TYR A 77 16.216 31.946 37.478 1.00 0.00 C ATOM 1097 C TYR A 77 16.437 30.644 36.698 1.00 0.00 C ATOM 1098 O TYR A 77 17.101 30.616 35.657 1.00 0.00 O ATOM 1099 CB TYR A 77 15.183 32.821 36.752 1.00 0.00 C ATOM 1100 CG TYR A 77 13.939 32.116 36.243 1.00 0.00 C ATOM 1101 CD1 TYR A 77 12.837 31.902 37.096 1.00 0.00 C ATOM 1102 CD2 TYR A 77 13.883 31.693 34.901 1.00 0.00 C ATOM 1103 CE1 TYR A 77 11.680 31.262 36.606 1.00 0.00 C ATOM 1104 CE2 TYR A 77 12.732 31.047 34.412 1.00 0.00 C ATOM 1105 CZ TYR A 77 11.630 30.830 35.263 1.00 0.00 C ATOM 1106 OH TYR A 77 10.525 30.218 34.766 1.00 0.00 O ATOM 0 H TYR A 77 17.400 33.644 37.229 1.00 0.00 H new ATOM 0 HA TYR A 77 15.858 31.655 38.465 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.872 33.616 37.430 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.675 33.299 35.905 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.879 32.228 38.125 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.724 31.865 34.246 1.00 0.00 H new ATOM 0 HE1 TYR A 77 10.833 31.103 37.257 1.00 0.00 H new ATOM 0 HE2 TYR A 77 12.693 30.718 33.384 1.00 0.00 H new ATOM 0 HH TYR A 77 10.672 29.992 33.824 1.00 0.00 H new ATOM 1116 N GLY A 78 15.766 29.582 37.143 1.00 0.00 N ATOM 1117 CA GLY A 78 15.441 28.442 36.292 1.00 0.00 C ATOM 1118 C GLY A 78 16.552 27.413 36.055 1.00 0.00 C ATOM 1119 O GLY A 78 16.492 26.655 35.085 1.00 0.00 O ATOM 0 H GLY A 78 15.434 29.489 38.103 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.587 27.925 36.730 1.00 0.00 H new ATOM 0 HA3 GLY A 78 15.120 28.823 35.323 1.00 0.00 H new ATOM 1123 N LEU A 79 17.546 27.361 36.942 1.00 0.00 N ATOM 1124 CA LEU A 79 18.756 26.541 36.829 1.00 0.00 C ATOM 1125 C LEU A 79 18.497 25.024 36.843 1.00 0.00 C ATOM 1126 O LEU A 79 17.648 24.532 37.587 1.00 0.00 O ATOM 1127 CB LEU A 79 19.716 27.039 37.916 1.00 0.00 C ATOM 1128 CG LEU A 79 21.140 26.492 37.750 1.00 0.00 C ATOM 1129 CD1 LEU A 79 22.136 27.474 38.303 1.00 0.00 C ATOM 1130 CD2 LEU A 79 21.382 25.197 38.508 1.00 0.00 C ATOM 0 H LEU A 79 17.530 27.914 37.799 1.00 0.00 H new ATOM 0 HA LEU A 79 19.210 26.667 35.846 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.746 28.128 37.896 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.332 26.748 38.894 1.00 0.00 H new ATOM 0 HG LEU A 79 21.257 26.319 36.680 1.00 0.00 H new ATOM 0 HD11 LEU A 79 23.144 27.078 38.181 1.00 0.00 H new ATOM 0 HD12 LEU A 79 22.051 28.419 37.767 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.936 27.638 39.362 1.00 0.00 H new ATOM 0 HD21 LEU A 79 22.408 24.867 38.346 1.00 0.00 H new ATOM 0 HD22 LEU A 79 21.218 25.362 39.573 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.694 24.431 38.149 1.00 0.00 H new ATOM 1142 N THR A 80 19.255 24.275 36.035 1.00 0.00 N ATOM 1143 CA THR A 80 19.068 22.832 35.775 1.00 0.00 C ATOM 1144 C THR A 80 20.095 21.959 36.512 1.00 0.00 C ATOM 1145 O THR A 80 21.183 22.400 36.888 1.00 0.00 O ATOM 1146 CB THR A 80 19.169 22.531 34.265 1.00 0.00 C ATOM 1147 OG1 THR A 80 18.739 23.629 33.488 1.00 0.00 O ATOM 1148 CG2 THR A 80 18.362 21.336 33.764 1.00 0.00 C ATOM 0 H THR A 80 20.046 24.665 35.523 1.00 0.00 H new ATOM 0 HA THR A 80 18.074 22.586 36.148 1.00 0.00 H new ATOM 0 HB THR A 80 20.229 22.307 34.147 1.00 0.00 H new ATOM 0 HG1 THR A 80 18.362 23.305 32.643 1.00 0.00 H new ATOM 0 HG21 THR A 80 18.510 21.221 32.690 1.00 0.00 H new ATOM 0 HG22 THR A 80 18.695 20.432 34.275 1.00 0.00 H new ATOM 0 HG23 THR A 80 17.304 21.500 33.969 1.00 0.00 H new ATOM 1156 N GLU A 81 19.797 20.667 36.619 1.00 0.00 N ATOM 1157 CA GLU A 81 20.604 19.646 37.317 1.00 0.00 C ATOM 1158 C GLU A 81 21.947 19.314 36.629 1.00 0.00 C ATOM 1159 O GLU A 81 22.743 18.548 37.176 1.00 0.00 O ATOM 1160 CB GLU A 81 19.754 18.376 37.507 1.00 0.00 C ATOM 1161 CG GLU A 81 18.718 18.523 38.631 1.00 0.00 C ATOM 1162 CD GLU A 81 19.297 18.142 39.997 1.00 0.00 C ATOM 1163 OE1 GLU A 81 19.231 16.939 40.354 1.00 0.00 O ATOM 1164 OE2 GLU A 81 19.837 19.012 40.724 1.00 0.00 O ATOM 0 H GLU A 81 18.950 20.276 36.206 1.00 0.00 H new ATOM 0 HA GLU A 81 20.882 20.069 38.282 1.00 0.00 H new ATOM 0 HB2 GLU A 81 19.242 18.143 36.574 1.00 0.00 H new ATOM 0 HB3 GLU A 81 20.410 17.534 37.730 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.361 19.552 38.663 1.00 0.00 H new ATOM 0 HG3 GLU A 81 17.855 17.893 38.414 1.00 0.00 H new ATOM 1171 N THR A 82 22.225 19.913 35.466 1.00 0.00 N ATOM 1172 CA THR A 82 23.514 19.853 34.758 1.00 0.00 C ATOM 1173 C THR A 82 24.094 21.243 34.428 1.00 0.00 C ATOM 1174 O THR A 82 24.800 21.412 33.433 1.00 0.00 O ATOM 1175 CB THR A 82 23.440 18.998 33.493 1.00 0.00 C ATOM 1176 OG1 THR A 82 22.521 19.508 32.556 1.00 0.00 O ATOM 1177 CG2 THR A 82 23.026 17.549 33.707 1.00 0.00 C ATOM 0 H THR A 82 21.533 20.475 34.971 1.00 0.00 H new ATOM 0 HA THR A 82 24.199 19.375 35.458 1.00 0.00 H new ATOM 0 HB THR A 82 24.470 19.034 33.137 1.00 0.00 H new ATOM 0 HG1 THR A 82 22.914 19.472 31.659 1.00 0.00 H new ATOM 0 HG21 THR A 82 23.005 17.031 32.748 1.00 0.00 H new ATOM 0 HG22 THR A 82 23.742 17.060 34.368 1.00 0.00 H new ATOM 0 HG23 THR A 82 22.035 17.517 34.159 1.00 0.00 H new ATOM 1185 N SER A 83 23.797 22.294 35.201 1.00 0.00 N ATOM 1186 CA SER A 83 24.416 23.607 34.942 1.00 0.00 C ATOM 1187 C SER A 83 25.952 23.565 35.082 1.00 0.00 C ATOM 1188 O SER A 83 26.464 23.094 36.104 1.00 0.00 O ATOM 1189 CB SER A 83 23.832 24.725 35.781 1.00 0.00 C ATOM 1190 OG SER A 83 24.543 25.931 35.593 1.00 0.00 O ATOM 0 H SER A 83 23.151 22.269 35.990 1.00 0.00 H new ATOM 0 HA SER A 83 24.175 23.834 33.904 1.00 0.00 H new ATOM 0 HB2 SER A 83 22.785 24.872 35.517 1.00 0.00 H new ATOM 0 HB3 SER A 83 23.859 24.445 36.834 1.00 0.00 H new ATOM 0 HG SER A 83 24.736 26.052 34.640 1.00 0.00 H new ATOM 1196 N ARG A 84 26.691 24.009 34.051 1.00 0.00 N ATOM 1197 CA ARG A 84 28.174 23.927 34.009 1.00 0.00 C ATOM 1198 C ARG A 84 28.917 24.684 32.890 1.00 0.00 C ATOM 1199 O ARG A 84 28.572 24.531 31.728 1.00 0.00 O ATOM 1200 CB ARG A 84 28.585 22.453 33.861 1.00 0.00 C ATOM 1201 CG ARG A 84 29.837 22.085 34.652 1.00 0.00 C ATOM 1202 CD ARG A 84 29.685 22.144 36.181 1.00 0.00 C ATOM 1203 NE ARG A 84 30.875 21.676 36.934 1.00 0.00 N ATOM 1204 CZ ARG A 84 31.791 22.350 37.624 1.00 0.00 C ATOM 1205 NH1 ARG A 84 31.912 23.649 37.624 1.00 0.00 N ATOM 1206 NH2 ARG A 84 32.606 21.671 38.368 1.00 0.00 N ATOM 0 H ARG A 84 26.283 24.436 33.219 1.00 0.00 H new ATOM 0 HA ARG A 84 28.466 24.411 34.941 1.00 0.00 H new ATOM 0 HB2 ARG A 84 27.760 21.820 34.188 1.00 0.00 H new ATOM 0 HB3 ARG A 84 28.755 22.236 32.806 1.00 0.00 H new ATOM 0 HG2 ARG A 84 30.141 21.077 34.372 1.00 0.00 H new ATOM 0 HG3 ARG A 84 30.644 22.755 34.357 1.00 0.00 H new ATOM 0 HD2 ARG A 84 29.466 23.171 36.473 1.00 0.00 H new ATOM 0 HD3 ARG A 84 28.825 21.540 36.472 1.00 0.00 H new ATOM 0 HE ARG A 84 31.014 20.666 36.920 1.00 0.00 H new ATOM 0 HH11 ARG A 84 31.277 24.220 37.067 1.00 0.00 H new ATOM 0 HH12 ARG A 84 32.642 24.093 38.181 1.00 0.00 H new ATOM 0 HH21 ARG A 84 32.532 20.655 38.410 1.00 0.00 H new ATOM 0 HH22 ARG A 84 33.322 22.153 38.912 1.00 0.00 H new ATOM 1220 N LEU A 85 30.121 25.204 33.157 1.00 0.00 N ATOM 1221 CA LEU A 85 30.416 26.384 33.994 1.00 0.00 C ATOM 1222 C LEU A 85 31.639 27.142 33.438 1.00 0.00 C ATOM 1223 O LEU A 85 32.498 26.537 32.798 1.00 0.00 O ATOM 1224 CB LEU A 85 30.614 26.001 35.477 1.00 0.00 C ATOM 1225 CG LEU A 85 29.699 26.797 36.427 1.00 0.00 C ATOM 1226 CD1 LEU A 85 28.212 26.562 36.140 1.00 0.00 C ATOM 1227 CD2 LEU A 85 29.963 26.382 37.879 1.00 0.00 C ATOM 0 H LEU A 85 30.971 24.790 32.773 1.00 0.00 H new ATOM 0 HA LEU A 85 29.553 27.049 33.955 1.00 0.00 H new ATOM 0 HB2 LEU A 85 30.420 24.936 35.601 1.00 0.00 H new ATOM 0 HB3 LEU A 85 31.654 26.170 35.755 1.00 0.00 H new ATOM 0 HG LEU A 85 29.928 27.851 36.267 1.00 0.00 H new ATOM 0 HD11 LEU A 85 27.610 27.146 36.837 1.00 0.00 H new ATOM 0 HD12 LEU A 85 27.985 26.870 35.119 1.00 0.00 H new ATOM 0 HD13 LEU A 85 27.981 25.503 36.260 1.00 0.00 H new ATOM 0 HD21 LEU A 85 29.312 26.950 38.544 1.00 0.00 H new ATOM 0 HD22 LEU A 85 29.761 25.317 37.996 1.00 0.00 H new ATOM 0 HD23 LEU A 85 31.004 26.584 38.132 1.00 0.00 H new ATOM 1239 N GLY A 86 31.755 28.443 33.700 1.00 0.00 N ATOM 1240 CA GLY A 86 32.906 29.263 33.302 1.00 0.00 C ATOM 1241 C GLY A 86 34.132 29.180 34.217 1.00 0.00 C ATOM 1242 O GLY A 86 35.160 29.771 33.893 1.00 0.00 O ATOM 0 H GLY A 86 31.041 28.969 34.204 1.00 0.00 H new ATOM 0 HA2 GLY A 86 33.206 28.970 32.296 1.00 0.00 H new ATOM 0 HA3 GLY A 86 32.586 30.304 33.249 1.00 0.00 H new ATOM 1246 N CYS A 87 34.039 28.489 35.353 1.00 0.00 N ATOM 1247 CA CYS A 87 34.958 28.666 36.471 1.00 0.00 C ATOM 1248 C CYS A 87 35.964 27.514 36.649 1.00 0.00 C ATOM 1249 O CYS A 87 37.156 27.716 36.408 1.00 0.00 O ATOM 1250 CB CYS A 87 34.098 28.952 37.707 1.00 0.00 C ATOM 1251 SG CYS A 87 32.316 29.021 37.418 1.00 0.00 S ATOM 0 H CYS A 87 33.319 27.787 35.522 1.00 0.00 H new ATOM 0 HA CYS A 87 35.622 29.509 36.279 1.00 0.00 H new ATOM 0 HB2 CYS A 87 34.298 28.182 38.453 1.00 0.00 H new ATOM 0 HB3 CYS A 87 34.416 29.902 38.137 1.00 0.00 H new ATOM 1256 N GLN A 88 35.526 26.318 37.076 1.00 0.00 N ATOM 1257 CA GLN A 88 36.442 25.228 37.477 1.00 0.00 C ATOM 1258 C GLN A 88 36.134 23.843 36.879 1.00 0.00 C ATOM 1259 O GLN A 88 36.452 22.824 37.494 1.00 0.00 O ATOM 1260 CB GLN A 88 36.641 25.181 39.003 1.00 0.00 C ATOM 1261 CG GLN A 88 36.869 26.557 39.647 1.00 0.00 C ATOM 1262 CD GLN A 88 37.292 26.444 41.102 1.00 0.00 C ATOM 1263 OE1 GLN A 88 38.373 26.879 41.490 1.00 0.00 O ATOM 1264 NE2 GLN A 88 36.470 25.866 41.949 1.00 0.00 N ATOM 0 H GLN A 88 34.538 26.077 37.154 1.00 0.00 H new ATOM 0 HA GLN A 88 37.395 25.495 37.019 1.00 0.00 H new ATOM 0 HB2 GLN A 88 35.766 24.719 39.459 1.00 0.00 H new ATOM 0 HB3 GLN A 88 37.494 24.540 39.228 1.00 0.00 H new ATOM 0 HG2 GLN A 88 37.634 27.096 39.088 1.00 0.00 H new ATOM 0 HG3 GLN A 88 35.953 27.144 39.581 1.00 0.00 H new ATOM 0 HE21 GLN A 88 35.573 25.506 41.624 1.00 0.00 H new ATOM 0 HE22 GLN A 88 36.729 25.778 42.932 1.00 0.00 H new ATOM 1273 N ILE A 89 35.554 23.777 35.673 1.00 0.00 N ATOM 1274 CA ILE A 89 35.660 22.572 34.832 1.00 0.00 C ATOM 1275 C ILE A 89 35.921 22.921 33.362 1.00 0.00 C ATOM 1276 O ILE A 89 35.398 23.903 32.835 1.00 0.00 O ATOM 1277 CB ILE A 89 34.471 21.609 35.033 1.00 0.00 C ATOM 1278 CG1 ILE A 89 34.706 20.204 34.444 1.00 0.00 C ATOM 1279 CG2 ILE A 89 33.161 22.147 34.438 1.00 0.00 C ATOM 1280 CD1 ILE A 89 35.990 19.509 34.913 1.00 0.00 C ATOM 0 H ILE A 89 35.011 24.535 35.259 1.00 0.00 H new ATOM 0 HA ILE A 89 36.538 22.021 35.169 1.00 0.00 H new ATOM 0 HB ILE A 89 34.387 21.533 36.117 1.00 0.00 H new ATOM 0 HG12 ILE A 89 33.855 19.573 34.700 1.00 0.00 H new ATOM 0 HG13 ILE A 89 34.730 20.282 33.357 1.00 0.00 H new ATOM 0 HG21 ILE A 89 32.361 21.427 34.610 1.00 0.00 H new ATOM 0 HG22 ILE A 89 32.906 23.093 34.915 1.00 0.00 H new ATOM 0 HG23 ILE A 89 33.285 22.303 33.366 1.00 0.00 H new ATOM 0 HD11 ILE A 89 36.065 18.528 34.444 1.00 0.00 H new ATOM 0 HD12 ILE A 89 36.853 20.112 34.633 1.00 0.00 H new ATOM 0 HD13 ILE A 89 35.965 19.392 35.996 1.00 0.00 H new ATOM 1292 N LYS A 90 36.769 22.116 32.721 1.00 0.00 N ATOM 1293 CA LYS A 90 37.512 22.440 31.507 1.00 0.00 C ATOM 1294 C LYS A 90 37.508 21.310 30.472 1.00 0.00 C ATOM 1295 O LYS A 90 37.018 20.217 30.742 1.00 0.00 O ATOM 1296 CB LYS A 90 38.941 22.845 31.925 1.00 0.00 C ATOM 1297 CG LYS A 90 39.633 21.996 33.012 1.00 0.00 C ATOM 1298 CD LYS A 90 39.786 20.522 32.614 1.00 0.00 C ATOM 1299 CE LYS A 90 40.797 19.748 33.478 1.00 0.00 C ATOM 1300 NZ LYS A 90 40.331 19.503 34.867 1.00 0.00 N ATOM 0 H LYS A 90 36.965 21.172 33.053 1.00 0.00 H new ATOM 0 HA LYS A 90 37.019 23.269 30.999 1.00 0.00 H new ATOM 0 HB2 LYS A 90 39.569 22.828 31.035 1.00 0.00 H new ATOM 0 HB3 LYS A 90 38.910 23.877 32.274 1.00 0.00 H new ATOM 0 HG2 LYS A 90 40.618 22.415 33.220 1.00 0.00 H new ATOM 0 HG3 LYS A 90 39.058 22.059 33.936 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.814 20.034 32.683 1.00 0.00 H new ATOM 0 HD3 LYS A 90 40.097 20.467 31.571 1.00 0.00 H new ATOM 0 HE2 LYS A 90 41.011 18.791 33.002 1.00 0.00 H new ATOM 0 HE3 LYS A 90 41.734 20.304 33.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 41.061 18.978 35.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 40.153 20.412 35.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 39.453 18.947 34.845 1.00 0.00 H new ATOM 1314 N MET A 91 38.068 21.567 29.291 1.00 0.00 N ATOM 1315 CA MET A 91 38.242 20.553 28.247 1.00 0.00 C ATOM 1316 C MET A 91 39.310 19.524 28.663 1.00 0.00 C ATOM 1317 O MET A 91 40.402 19.904 29.082 1.00 0.00 O ATOM 1318 CB MET A 91 38.617 21.190 26.897 1.00 0.00 C ATOM 1319 CG MET A 91 37.797 22.401 26.431 1.00 0.00 C ATOM 1320 SD MET A 91 36.003 22.244 26.185 1.00 0.00 S ATOM 1321 CE MET A 91 35.337 22.470 27.851 1.00 0.00 C ATOM 0 H MET A 91 38.416 22.489 29.028 1.00 0.00 H new ATOM 0 HA MET A 91 37.287 20.042 28.124 1.00 0.00 H new ATOM 0 HB2 MET A 91 39.663 21.492 26.947 1.00 0.00 H new ATOM 0 HB3 MET A 91 38.544 20.419 26.130 1.00 0.00 H new ATOM 0 HG2 MET A 91 37.956 23.199 27.157 1.00 0.00 H new ATOM 0 HG3 MET A 91 38.225 22.739 25.487 1.00 0.00 H new ATOM 0 HE1 MET A 91 34.265 22.660 27.792 1.00 0.00 H new ATOM 0 HE2 MET A 91 35.514 21.569 28.439 1.00 0.00 H new ATOM 0 HE3 MET A 91 35.830 23.317 28.328 1.00 0.00 H new ATOM 1331 N SER A 92 39.001 18.238 28.513 1.00 0.00 N ATOM 1332 CA SER A 92 39.831 17.055 28.796 1.00 0.00 C ATOM 1333 C SER A 92 39.390 15.874 27.917 1.00 0.00 C ATOM 1334 O SER A 92 38.394 15.981 27.201 1.00 0.00 O ATOM 1335 CB SER A 92 39.703 16.690 30.275 1.00 0.00 C ATOM 1336 OG SER A 92 38.380 16.285 30.563 1.00 0.00 O ATOM 0 H SER A 92 38.084 17.966 28.159 1.00 0.00 H new ATOM 0 HA SER A 92 40.873 17.282 28.569 1.00 0.00 H new ATOM 0 HB2 SER A 92 40.399 15.888 30.521 1.00 0.00 H new ATOM 0 HB3 SER A 92 39.972 17.546 30.893 1.00 0.00 H new ATOM 0 HG SER A 92 38.309 16.052 31.512 1.00 0.00 H new ATOM 1342 N LYS A 93 40.063 14.719 27.953 1.00 0.00 N ATOM 1343 CA LYS A 93 39.686 13.546 27.146 1.00 0.00 C ATOM 1344 C LYS A 93 38.262 13.025 27.420 1.00 0.00 C ATOM 1345 O LYS A 93 37.697 12.313 26.593 1.00 0.00 O ATOM 1346 CB LYS A 93 40.752 12.446 27.309 1.00 0.00 C ATOM 1347 CG LYS A 93 40.914 11.701 25.980 1.00 0.00 C ATOM 1348 CD LYS A 93 41.686 10.385 26.117 1.00 0.00 C ATOM 1349 CE LYS A 93 41.897 9.786 24.722 1.00 0.00 C ATOM 1350 NZ LYS A 93 42.032 8.315 24.775 1.00 0.00 N ATOM 0 H LYS A 93 40.883 14.568 28.540 1.00 0.00 H new ATOM 0 HA LYS A 93 39.656 13.866 26.105 1.00 0.00 H new ATOM 0 HB2 LYS A 93 41.702 12.886 27.611 1.00 0.00 H new ATOM 0 HB3 LYS A 93 40.458 11.751 28.096 1.00 0.00 H new ATOM 0 HG2 LYS A 93 39.928 11.495 25.564 1.00 0.00 H new ATOM 0 HG3 LYS A 93 41.431 12.346 25.270 1.00 0.00 H new ATOM 0 HD2 LYS A 93 42.647 10.560 26.601 1.00 0.00 H new ATOM 0 HD3 LYS A 93 41.134 9.688 26.747 1.00 0.00 H new ATOM 0 HE2 LYS A 93 41.057 10.052 24.081 1.00 0.00 H new ATOM 0 HE3 LYS A 93 42.791 10.218 24.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 42.173 7.944 23.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 42.849 8.062 25.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 41.169 7.902 25.182 1.00 0.00 H new ATOM 1364 N ASP A 94 37.648 13.407 28.543 1.00 0.00 N ATOM 1365 CA ASP A 94 36.253 13.083 28.882 1.00 0.00 C ATOM 1366 C ASP A 94 35.220 13.792 27.976 1.00 0.00 C ATOM 1367 O ASP A 94 34.064 13.371 27.884 1.00 0.00 O ATOM 1368 CB ASP A 94 35.991 13.500 30.341 1.00 0.00 C ATOM 1369 CG ASP A 94 36.751 12.663 31.384 1.00 0.00 C ATOM 1370 OD1 ASP A 94 36.719 11.409 31.320 1.00 0.00 O ATOM 1371 OD2 ASP A 94 37.364 13.246 32.313 1.00 0.00 O ATOM 0 H ASP A 94 38.114 13.963 29.260 1.00 0.00 H new ATOM 0 HA ASP A 94 36.129 12.010 28.734 1.00 0.00 H new ATOM 0 HB2 ASP A 94 36.266 14.548 30.462 1.00 0.00 H new ATOM 0 HB3 ASP A 94 34.922 13.426 30.542 1.00 0.00 H new ATOM 1376 N ILE A 95 35.621 14.886 27.319 1.00 0.00 N ATOM 1377 CA ILE A 95 34.727 15.882 26.718 1.00 0.00 C ATOM 1378 C ILE A 95 34.562 15.752 25.212 1.00 0.00 C ATOM 1379 O ILE A 95 33.909 16.612 24.651 1.00 0.00 O ATOM 1380 CB ILE A 95 35.176 17.326 27.058 1.00 0.00 C ATOM 1381 CG1 ILE A 95 36.361 17.806 26.175 1.00 0.00 C ATOM 1382 CG2 ILE A 95 35.467 17.499 28.560 1.00 0.00 C ATOM 1383 CD1 ILE A 95 36.028 18.900 25.165 1.00 0.00 C ATOM 0 H ILE A 95 36.607 15.110 27.187 1.00 0.00 H new ATOM 0 HA ILE A 95 33.754 15.676 27.163 1.00 0.00 H new ATOM 0 HB ILE A 95 34.334 17.975 26.819 1.00 0.00 H new ATOM 0 HG12 ILE A 95 37.154 18.169 26.829 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.760 16.947 25.635 1.00 0.00 H new ATOM 0 HG21 ILE A 95 35.778 18.525 28.754 1.00 0.00 H new ATOM 0 HG22 ILE A 95 34.566 17.278 29.133 1.00 0.00 H new ATOM 0 HG23 ILE A 95 36.263 16.816 28.858 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.924 19.161 24.602 1.00 0.00 H new ATOM 0 HD12 ILE A 95 35.261 18.541 24.479 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.661 19.781 25.691 1.00 0.00 H new ATOM 1395 N ASP A 96 35.192 14.794 24.529 1.00 0.00 N ATOM 1396 CA ASP A 96 35.376 14.846 23.068 1.00 0.00 C ATOM 1397 C ASP A 96 34.046 14.788 22.282 1.00 0.00 C ATOM 1398 O ASP A 96 33.574 13.728 21.861 1.00 0.00 O ATOM 1399 CB ASP A 96 36.385 13.773 22.656 1.00 0.00 C ATOM 1400 CG ASP A 96 36.625 13.758 21.144 1.00 0.00 C ATOM 1401 OD1 ASP A 96 37.222 14.732 20.633 1.00 0.00 O ATOM 1402 OD2 ASP A 96 36.286 12.755 20.469 1.00 0.00 O ATOM 0 H ASP A 96 35.589 13.962 24.966 1.00 0.00 H new ATOM 0 HA ASP A 96 35.785 15.820 22.799 1.00 0.00 H new ATOM 0 HB2 ASP A 96 37.330 13.948 23.171 1.00 0.00 H new ATOM 0 HB3 ASP A 96 36.024 12.795 22.975 1.00 0.00 H new ATOM 1407 N GLY A 97 33.449 15.970 22.117 1.00 0.00 N ATOM 1408 CA GLY A 97 32.103 16.204 21.562 1.00 0.00 C ATOM 1409 C GLY A 97 31.085 16.907 22.484 1.00 0.00 C ATOM 1410 O GLY A 97 29.893 16.935 22.172 1.00 0.00 O ATOM 0 H GLY A 97 33.912 16.840 22.379 1.00 0.00 H new ATOM 0 HA2 GLY A 97 32.208 16.799 20.655 1.00 0.00 H new ATOM 0 HA3 GLY A 97 31.685 15.242 21.265 1.00 0.00 H new ATOM 1414 N ILE A 98 31.522 17.467 23.617 1.00 0.00 N ATOM 1415 CA ILE A 98 30.700 18.127 24.643 1.00 0.00 C ATOM 1416 C ILE A 98 29.809 19.235 24.082 1.00 0.00 C ATOM 1417 O ILE A 98 30.235 20.043 23.256 1.00 0.00 O ATOM 1418 CB ILE A 98 31.604 18.624 25.800 1.00 0.00 C ATOM 1419 CG1 ILE A 98 30.850 19.086 27.068 1.00 0.00 C ATOM 1420 CG2 ILE A 98 32.623 19.681 25.344 1.00 0.00 C ATOM 1421 CD1 ILE A 98 30.589 20.594 27.212 1.00 0.00 C ATOM 0 H ILE A 98 32.513 17.473 23.858 1.00 0.00 H new ATOM 0 HA ILE A 98 30.006 17.386 25.038 1.00 0.00 H new ATOM 0 HB ILE A 98 32.152 17.730 26.099 1.00 0.00 H new ATOM 0 HG12 ILE A 98 29.890 18.571 27.098 1.00 0.00 H new ATOM 0 HG13 ILE A 98 31.416 18.755 27.939 1.00 0.00 H new ATOM 0 HG21 ILE A 98 33.229 19.993 26.195 1.00 0.00 H new ATOM 0 HG22 ILE A 98 33.268 19.256 24.575 1.00 0.00 H new ATOM 0 HG23 ILE A 98 32.095 20.544 24.939 1.00 0.00 H new ATOM 0 HD11 ILE A 98 30.054 20.783 28.142 1.00 0.00 H new ATOM 0 HD12 ILE A 98 31.539 21.128 27.225 1.00 0.00 H new ATOM 0 HD13 ILE A 98 29.989 20.941 26.371 1.00 0.00 H new ATOM 1433 N ARG A 99 28.574 19.303 24.585 1.00 0.00 N ATOM 1434 CA ARG A 99 27.641 20.411 24.355 1.00 0.00 C ATOM 1435 C ARG A 99 27.372 21.162 25.635 1.00 0.00 C ATOM 1436 O ARG A 99 27.285 20.552 26.703 1.00 0.00 O ATOM 1437 CB ARG A 99 26.264 19.874 23.920 1.00 0.00 C ATOM 1438 CG ARG A 99 25.433 20.814 23.028 1.00 0.00 C ATOM 1439 CD ARG A 99 23.936 20.488 23.142 1.00 0.00 C ATOM 1440 NE ARG A 99 23.622 19.158 22.588 1.00 0.00 N ATOM 1441 CZ ARG A 99 22.905 18.209 23.159 1.00 0.00 C ATOM 1442 NH1 ARG A 99 22.371 18.335 24.340 1.00 0.00 N ATOM 1443 NH2 ARG A 99 22.693 17.080 22.554 1.00 0.00 N ATOM 0 H ARG A 99 28.184 18.571 25.179 1.00 0.00 H new ATOM 0 HA ARG A 99 28.098 21.047 23.597 1.00 0.00 H new ATOM 0 HB2 ARG A 99 26.412 18.935 23.387 1.00 0.00 H new ATOM 0 HB3 ARG A 99 25.685 19.645 24.814 1.00 0.00 H new ATOM 0 HG2 ARG A 99 25.608 21.849 23.320 1.00 0.00 H new ATOM 0 HG3 ARG A 99 25.754 20.717 21.991 1.00 0.00 H new ATOM 0 HD2 ARG A 99 23.634 20.526 24.189 1.00 0.00 H new ATOM 0 HD3 ARG A 99 23.357 21.247 22.615 1.00 0.00 H new ATOM 0 HE ARG A 99 24.000 18.949 21.664 1.00 0.00 H new ATOM 0 HH11 ARG A 99 22.499 19.198 24.868 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.825 17.570 24.737 1.00 0.00 H new ATOM 0 HH21 ARG A 99 23.083 16.918 21.625 1.00 0.00 H new ATOM 0 HH22 ARG A 99 22.137 16.355 23.007 1.00 0.00 H new ATOM 1457 N VAL A 100 27.031 22.427 25.472 1.00 0.00 N ATOM 1458 CA VAL A 100 26.225 23.170 26.423 1.00 0.00 C ATOM 1459 C VAL A 100 25.152 24.009 25.732 1.00 0.00 C ATOM 1460 O VAL A 100 25.296 24.383 24.566 1.00 0.00 O ATOM 1461 CB VAL A 100 27.121 24.090 27.292 1.00 0.00 C ATOM 1462 CG1 VAL A 100 28.009 23.318 28.272 1.00 0.00 C ATOM 1463 CG2 VAL A 100 28.034 24.984 26.432 1.00 0.00 C ATOM 0 H VAL A 100 27.312 22.977 24.660 1.00 0.00 H new ATOM 0 HA VAL A 100 25.725 22.438 27.058 1.00 0.00 H new ATOM 0 HB VAL A 100 26.418 24.701 27.858 1.00 0.00 H new ATOM 0 HG11 VAL A 100 28.610 24.021 28.849 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.384 22.735 28.948 1.00 0.00 H new ATOM 0 HG13 VAL A 100 28.666 22.648 27.717 1.00 0.00 H new ATOM 0 HG21 VAL A 100 28.644 25.612 27.081 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.682 24.358 25.818 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.422 25.615 25.787 1.00 0.00 H new ATOM 1473 N ALA A 101 24.095 24.355 26.466 1.00 0.00 N ATOM 1474 CA ALA A 101 23.149 25.384 26.044 1.00 0.00 C ATOM 1475 C ALA A 101 23.424 26.682 26.817 1.00 0.00 C ATOM 1476 O ALA A 101 23.749 26.640 28.008 1.00 0.00 O ATOM 1477 CB ALA A 101 21.718 24.874 26.207 1.00 0.00 C ATOM 0 H ALA A 101 23.872 23.931 27.366 1.00 0.00 H new ATOM 0 HA ALA A 101 23.278 25.611 24.986 1.00 0.00 H new ATOM 0 HB1 ALA A 101 21.018 25.647 25.890 1.00 0.00 H new ATOM 0 HB2 ALA A 101 21.577 23.984 25.594 1.00 0.00 H new ATOM 0 HB3 ALA A 101 21.537 24.627 27.253 1.00 0.00 H new ATOM 1483 N LEU A 102 23.323 27.820 26.128 1.00 0.00 N ATOM 1484 CA LEU A 102 23.756 29.122 26.626 1.00 0.00 C ATOM 1485 C LEU A 102 22.568 30.115 26.667 1.00 0.00 C ATOM 1486 O LEU A 102 22.288 30.797 25.673 1.00 0.00 O ATOM 1487 CB LEU A 102 24.941 29.553 25.739 1.00 0.00 C ATOM 1488 CG LEU A 102 26.107 30.182 26.506 1.00 0.00 C ATOM 1489 CD1 LEU A 102 27.259 30.358 25.518 1.00 0.00 C ATOM 1490 CD2 LEU A 102 25.738 31.505 27.169 1.00 0.00 C ATOM 0 H LEU A 102 22.929 27.860 25.188 1.00 0.00 H new ATOM 0 HA LEU A 102 24.099 29.089 27.660 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.307 28.683 25.194 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.583 30.266 24.996 1.00 0.00 H new ATOM 0 HG LEU A 102 26.394 29.524 27.326 1.00 0.00 H new ATOM 0 HD11 LEU A 102 28.112 30.805 26.029 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.546 29.386 25.116 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.943 31.008 24.703 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.605 31.902 27.697 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.420 32.217 26.408 1.00 0.00 H new ATOM 0 HD23 LEU A 102 24.925 31.343 27.877 1.00 0.00 H new ATOM 1502 N PRO A 103 21.807 30.162 27.778 1.00 0.00 N ATOM 1503 CA PRO A 103 20.837 31.226 28.040 1.00 0.00 C ATOM 1504 C PRO A 103 21.540 32.563 28.341 1.00 0.00 C ATOM 1505 O PRO A 103 22.765 32.654 28.405 1.00 0.00 O ATOM 1506 CB PRO A 103 20.012 30.721 29.233 1.00 0.00 C ATOM 1507 CG PRO A 103 21.025 29.888 30.013 1.00 0.00 C ATOM 1508 CD PRO A 103 21.848 29.236 28.905 1.00 0.00 C ATOM 0 HA PRO A 103 20.204 31.430 27.177 1.00 0.00 H new ATOM 0 HB2 PRO A 103 19.619 31.543 29.830 1.00 0.00 H new ATOM 0 HB3 PRO A 103 19.159 30.124 28.911 1.00 0.00 H new ATOM 0 HG2 PRO A 103 21.642 30.507 30.665 1.00 0.00 H new ATOM 0 HG3 PRO A 103 20.538 29.146 30.645 1.00 0.00 H new ATOM 0 HD2 PRO A 103 22.874 29.063 29.231 1.00 0.00 H new ATOM 0 HD3 PRO A 103 21.433 28.267 28.629 1.00 0.00 H new ATOM 1516 N GLN A 104 20.767 33.627 28.548 1.00 0.00 N ATOM 1517 CA GLN A 104 21.298 34.923 28.978 1.00 0.00 C ATOM 1518 C GLN A 104 21.832 34.851 30.420 1.00 0.00 C ATOM 1519 O GLN A 104 21.134 34.363 31.309 1.00 0.00 O ATOM 1520 CB GLN A 104 20.157 35.938 28.840 1.00 0.00 C ATOM 1521 CG GLN A 104 20.512 37.393 29.174 1.00 0.00 C ATOM 1522 CD GLN A 104 19.353 38.335 28.849 1.00 0.00 C ATOM 1523 OE1 GLN A 104 18.354 37.967 28.246 1.00 0.00 O ATOM 1524 NE2 GLN A 104 19.413 39.583 29.244 1.00 0.00 N ATOM 0 H GLN A 104 19.755 33.617 28.423 1.00 0.00 H new ATOM 0 HA GLN A 104 22.145 35.223 28.361 1.00 0.00 H new ATOM 0 HB2 GLN A 104 19.785 35.901 27.816 1.00 0.00 H new ATOM 0 HB3 GLN A 104 19.338 35.626 29.488 1.00 0.00 H new ATOM 0 HG2 GLN A 104 20.765 37.475 30.231 1.00 0.00 H new ATOM 0 HG3 GLN A 104 21.396 37.693 28.611 1.00 0.00 H new ATOM 0 HE21 GLN A 104 20.233 39.919 29.749 1.00 0.00 H new ATOM 0 HE22 GLN A 104 18.640 40.218 29.047 1.00 0.00 H new ATOM 1533 N MET A 105 23.027 35.396 30.688 1.00 0.00 N ATOM 1534 CA MET A 105 23.535 35.578 32.060 1.00 0.00 C ATOM 1535 C MET A 105 22.578 36.493 32.837 1.00 0.00 C ATOM 1536 O MET A 105 22.395 37.659 32.476 1.00 0.00 O ATOM 1537 CB MET A 105 24.976 36.105 31.995 1.00 0.00 C ATOM 1538 CG MET A 105 25.723 36.177 33.335 1.00 0.00 C ATOM 1539 SD MET A 105 25.229 37.450 34.534 1.00 0.00 S ATOM 1540 CE MET A 105 25.616 38.993 33.673 1.00 0.00 C ATOM 0 H MET A 105 23.668 35.723 29.965 1.00 0.00 H new ATOM 0 HA MET A 105 23.569 34.632 32.601 1.00 0.00 H new ATOM 0 HB2 MET A 105 25.545 35.469 31.317 1.00 0.00 H new ATOM 0 HB3 MET A 105 24.958 37.103 31.556 1.00 0.00 H new ATOM 0 HG2 MET A 105 25.625 35.207 33.822 1.00 0.00 H new ATOM 0 HG3 MET A 105 26.782 36.319 33.117 1.00 0.00 H new ATOM 0 HE1 MET A 105 25.423 39.837 34.335 1.00 0.00 H new ATOM 0 HE2 MET A 105 26.666 38.993 33.381 1.00 0.00 H new ATOM 0 HE3 MET A 105 24.992 39.080 32.783 1.00 0.00 H new ATOM 1550 N THR A 106 21.907 35.926 33.844 1.00 0.00 N ATOM 1551 CA THR A 106 20.529 36.295 34.240 1.00 0.00 C ATOM 1552 C THR A 106 20.418 37.000 35.596 1.00 0.00 C ATOM 1553 O THR A 106 19.311 37.318 36.035 1.00 0.00 O ATOM 1554 CB THR A 106 19.586 35.067 34.215 1.00 0.00 C ATOM 1555 OG1 THR A 106 20.239 33.894 33.768 1.00 0.00 O ATOM 1556 CG2 THR A 106 18.387 35.285 33.296 1.00 0.00 C ATOM 0 H THR A 106 22.305 35.185 34.421 1.00 0.00 H new ATOM 0 HA THR A 106 20.218 37.022 33.490 1.00 0.00 H new ATOM 0 HB THR A 106 19.260 34.945 35.248 1.00 0.00 H new ATOM 0 HG1 THR A 106 20.396 33.955 32.803 1.00 0.00 H new ATOM 0 HG21 THR A 106 17.753 34.399 33.309 1.00 0.00 H new ATOM 0 HG22 THR A 106 17.815 36.146 33.642 1.00 0.00 H new ATOM 0 HG23 THR A 106 18.736 35.466 32.279 1.00 0.00 H new ATOM 1564 N ARG A 107 21.551 37.240 36.267 1.00 0.00 N ATOM 1565 CA ARG A 107 21.693 38.205 37.369 1.00 0.00 C ATOM 1566 C ARG A 107 23.161 38.576 37.602 1.00 0.00 C ATOM 1567 O ARG A 107 24.042 37.716 37.521 1.00 0.00 O ATOM 1568 CB ARG A 107 21.084 37.650 38.679 1.00 0.00 C ATOM 1569 CG ARG A 107 20.408 38.744 39.524 1.00 0.00 C ATOM 1570 CD ARG A 107 18.991 39.047 39.013 1.00 0.00 C ATOM 1571 NE ARG A 107 18.468 40.322 39.533 1.00 0.00 N ATOM 1572 CZ ARG A 107 17.987 40.605 40.729 1.00 0.00 C ATOM 1573 NH1 ARG A 107 17.909 39.763 41.717 1.00 0.00 N ATOM 1574 NH2 ARG A 107 17.550 41.802 40.963 1.00 0.00 N ATOM 0 H ARG A 107 22.422 36.754 36.053 1.00 0.00 H new ATOM 0 HA ARG A 107 21.148 39.103 37.078 1.00 0.00 H new ATOM 0 HB2 ARG A 107 20.353 36.878 38.438 1.00 0.00 H new ATOM 0 HB3 ARG A 107 21.868 37.174 39.267 1.00 0.00 H new ATOM 0 HG2 ARG A 107 20.361 38.425 40.565 1.00 0.00 H new ATOM 0 HG3 ARG A 107 21.009 39.653 39.495 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.999 39.078 37.923 1.00 0.00 H new ATOM 0 HD3 ARG A 107 18.322 38.237 39.304 1.00 0.00 H new ATOM 0 HE ARG A 107 18.479 41.099 38.873 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.234 38.804 41.596 1.00 0.00 H new ATOM 0 HH12 ARG A 107 17.523 40.062 42.613 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.581 42.509 40.228 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.175 42.037 41.882 1.00 0.00 H new ATOM 1588 N ASN A 108 23.399 39.828 37.979 1.00 0.00 N ATOM 1589 CA ASN A 108 24.624 40.303 38.624 1.00 0.00 C ATOM 1590 C ASN A 108 24.238 41.205 39.815 1.00 0.00 C ATOM 1591 O ASN A 108 24.290 42.432 39.734 1.00 0.00 O ATOM 1592 CB ASN A 108 25.527 40.983 37.578 1.00 0.00 C ATOM 1593 CG ASN A 108 26.791 41.591 38.170 1.00 0.00 C ATOM 1594 OD1 ASN A 108 27.162 41.366 39.319 1.00 0.00 O ATOM 1595 ND2 ASN A 108 27.477 42.398 37.398 1.00 0.00 N ATOM 0 H ASN A 108 22.716 40.573 37.839 1.00 0.00 H new ATOM 0 HA ASN A 108 25.211 39.480 39.032 1.00 0.00 H new ATOM 0 HB2 ASN A 108 25.806 40.251 36.820 1.00 0.00 H new ATOM 0 HB3 ASN A 108 24.960 41.765 37.073 1.00 0.00 H new ATOM 0 HD21 ASN A 108 28.324 42.843 37.751 1.00 0.00 H new ATOM 0 HD22 ASN A 108 27.164 42.581 36.445 1.00 0.00 H new ATOM 1602 N VAL A 109 23.806 40.567 40.906 1.00 0.00 N ATOM 1603 CA VAL A 109 23.426 41.183 42.191 1.00 0.00 C ATOM 1604 C VAL A 109 23.928 40.277 43.322 1.00 0.00 C ATOM 1605 O VAL A 109 23.656 39.073 43.306 1.00 0.00 O ATOM 1606 CB VAL A 109 21.897 41.390 42.290 1.00 0.00 C ATOM 1607 CG1 VAL A 109 21.483 41.943 43.659 1.00 0.00 C ATOM 1608 CG2 VAL A 109 21.385 42.373 41.228 1.00 0.00 C ATOM 0 H VAL A 109 23.705 39.552 40.923 1.00 0.00 H new ATOM 0 HA VAL A 109 23.882 42.170 42.270 1.00 0.00 H new ATOM 0 HB VAL A 109 21.459 40.404 42.134 1.00 0.00 H new ATOM 0 HG11 VAL A 109 20.401 42.074 43.687 1.00 0.00 H new ATOM 0 HG12 VAL A 109 21.784 41.245 44.440 1.00 0.00 H new ATOM 0 HG13 VAL A 109 21.969 42.904 43.825 1.00 0.00 H new ATOM 0 HG21 VAL A 109 20.306 42.491 41.331 1.00 0.00 H new ATOM 0 HG22 VAL A 109 21.870 43.340 41.363 1.00 0.00 H new ATOM 0 HG23 VAL A 109 21.614 41.987 40.235 1.00 0.00 H new ATOM 1618 N ASN A 110 24.658 40.842 44.291 1.00 0.00 N ATOM 1619 CA ASN A 110 25.403 40.117 45.336 1.00 0.00 C ATOM 1620 C ASN A 110 26.481 39.138 44.777 1.00 0.00 C ATOM 1621 O ASN A 110 26.702 39.064 43.563 1.00 0.00 O ATOM 1622 CB ASN A 110 24.367 39.485 46.300 1.00 0.00 C ATOM 1623 CG ASN A 110 24.830 39.322 47.737 1.00 0.00 C ATOM 1624 OD1 ASN A 110 25.993 39.485 48.077 1.00 0.00 O ATOM 1625 ND2 ASN A 110 23.918 39.016 48.628 1.00 0.00 N ATOM 0 H ASN A 110 24.752 41.854 44.375 1.00 0.00 H new ATOM 0 HA ASN A 110 26.020 40.812 45.905 1.00 0.00 H new ATOM 0 HB2 ASN A 110 23.467 40.100 46.293 1.00 0.00 H new ATOM 0 HB3 ASN A 110 24.086 38.505 45.913 1.00 0.00 H new ATOM 0 HD21 ASN A 110 24.178 38.913 49.609 1.00 0.00 H new ATOM 0 HD22 ASN A 110 22.949 38.881 48.340 1.00 0.00 H new ATOM 1632 N ASN A 111 27.183 38.418 45.662 1.00 0.00 N ATOM 1633 CA ASN A 111 28.240 37.414 45.402 1.00 0.00 C ATOM 1634 C ASN A 111 29.461 37.873 44.549 1.00 0.00 C ATOM 1635 O ASN A 111 30.307 37.047 44.189 1.00 0.00 O ATOM 1636 CB ASN A 111 27.611 36.078 44.932 1.00 0.00 C ATOM 1637 CG ASN A 111 26.867 35.309 46.018 1.00 0.00 C ATOM 1638 OD1 ASN A 111 26.387 35.847 47.007 1.00 0.00 O ATOM 1639 ND2 ASN A 111 26.731 34.010 45.868 1.00 0.00 N ATOM 0 H ASN A 111 27.018 38.527 46.663 1.00 0.00 H new ATOM 0 HA ASN A 111 28.721 37.256 46.367 1.00 0.00 H new ATOM 0 HB2 ASN A 111 26.921 36.285 44.114 1.00 0.00 H new ATOM 0 HB3 ASN A 111 28.400 35.442 44.530 1.00 0.00 H new ATOM 0 HD21 ASN A 111 26.231 33.465 46.570 1.00 0.00 H new ATOM 0 HD22 ASN A 111 27.125 33.547 45.049 1.00 0.00 H new ATOM 1646 N ASN A 112 29.590 39.170 44.251 1.00 0.00 N ATOM 1647 CA ASN A 112 30.596 39.771 43.360 1.00 0.00 C ATOM 1648 C ASN A 112 31.600 40.669 44.131 1.00 0.00 C ATOM 1649 O ASN A 112 31.323 41.096 45.259 1.00 0.00 O ATOM 1650 CB ASN A 112 29.827 40.498 42.235 1.00 0.00 C ATOM 1651 CG ASN A 112 30.612 40.729 40.955 1.00 0.00 C ATOM 1652 OD1 ASN A 112 31.822 40.572 40.882 1.00 0.00 O ATOM 1653 ND2 ASN A 112 29.950 41.108 39.890 1.00 0.00 N ATOM 0 H ASN A 112 28.962 39.870 44.645 1.00 0.00 H new ATOM 0 HA ASN A 112 31.233 39.007 42.915 1.00 0.00 H new ATOM 0 HB2 ASN A 112 28.935 39.920 41.995 1.00 0.00 H new ATOM 0 HB3 ASN A 112 29.489 41.463 42.613 1.00 0.00 H new ATOM 0 HD21 ASN A 112 30.445 41.269 39.012 1.00 0.00 H new ATOM 0 HD22 ASN A 112 28.940 41.242 39.938 1.00 0.00 H new ATOM 1660 N ASP A 113 32.763 40.958 43.542 1.00 0.00 N ATOM 1661 CA ASP A 113 33.948 41.520 44.217 1.00 0.00 C ATOM 1662 C ASP A 113 34.583 42.727 43.482 1.00 0.00 C ATOM 1663 O ASP A 113 34.303 42.996 42.311 1.00 0.00 O ATOM 1664 CB ASP A 113 34.961 40.377 44.447 1.00 0.00 C ATOM 1665 CG ASP A 113 36.218 40.824 45.198 1.00 0.00 C ATOM 1666 OD1 ASP A 113 36.094 41.572 46.196 1.00 0.00 O ATOM 1667 OD2 ASP A 113 37.347 40.516 44.755 1.00 0.00 O ATOM 0 H ASP A 113 32.917 40.803 42.546 1.00 0.00 H new ATOM 0 HA ASP A 113 33.628 41.937 45.172 1.00 0.00 H new ATOM 0 HB2 ASP A 113 34.476 39.578 45.008 1.00 0.00 H new ATOM 0 HB3 ASP A 113 35.251 39.959 43.483 1.00 0.00 H new ATOM 1672 N PHE A 114 35.449 43.454 44.197 1.00 0.00 N ATOM 1673 CA PHE A 114 36.246 44.603 43.743 1.00 0.00 C ATOM 1674 C PHE A 114 37.753 44.487 44.077 1.00 0.00 C ATOM 1675 O PHE A 114 38.563 45.255 43.547 1.00 0.00 O ATOM 1676 CB PHE A 114 35.662 45.875 44.388 1.00 0.00 C ATOM 1677 CG PHE A 114 36.014 46.026 45.861 1.00 0.00 C ATOM 1678 CD1 PHE A 114 35.329 45.284 46.842 1.00 0.00 C ATOM 1679 CD2 PHE A 114 37.097 46.842 46.242 1.00 0.00 C ATOM 1680 CE1 PHE A 114 35.745 45.333 48.185 1.00 0.00 C ATOM 1681 CE2 PHE A 114 37.505 46.898 47.588 1.00 0.00 C ATOM 1682 CZ PHE A 114 36.835 46.135 48.559 1.00 0.00 C ATOM 0 H PHE A 114 35.625 43.241 45.179 1.00 0.00 H new ATOM 0 HA PHE A 114 36.185 44.639 42.655 1.00 0.00 H new ATOM 0 HB2 PHE A 114 36.025 46.748 43.845 1.00 0.00 H new ATOM 0 HB3 PHE A 114 34.577 45.862 44.281 1.00 0.00 H new ATOM 0 HD1 PHE A 114 34.482 44.675 46.563 1.00 0.00 H new ATOM 0 HD2 PHE A 114 37.617 47.427 45.498 1.00 0.00 H new ATOM 0 HE1 PHE A 114 35.224 44.751 48.931 1.00 0.00 H new ATOM 0 HE2 PHE A 114 38.334 47.528 47.875 1.00 0.00 H new ATOM 0 HZ PHE A 114 37.157 46.165 49.589 1.00 0.00 H new ATOM 1692 N SER A 115 38.140 43.573 44.983 1.00 0.00 N ATOM 1693 CA SER A 115 39.454 43.564 45.661 1.00 0.00 C ATOM 1694 C SER A 115 40.656 43.344 44.755 1.00 0.00 C ATOM 1695 O SER A 115 41.675 44.041 44.979 1.00 0.00 O ATOM 1696 CB SER A 115 39.443 42.593 46.839 1.00 0.00 C ATOM 1697 OG SER A 115 39.394 41.243 46.400 1.00 0.00 O ATOM 1698 OXT SER A 115 40.576 42.541 43.798 1.00 0.00 O ATOM 0 H SER A 115 37.538 42.802 45.273 1.00 0.00 H new ATOM 0 HA SER A 115 39.593 44.580 46.031 1.00 0.00 H new ATOM 0 HB2 SER A 115 40.334 42.747 47.447 1.00 0.00 H new ATOM 0 HB3 SER A 115 38.583 42.801 47.476 1.00 0.00 H new ATOM 0 HG SER A 115 38.642 41.127 45.782 1.00 0.00 H new TER 1704 SER A 115 HETATM 1705 FE1 FES A 201 32.444 33.444 36.797 1.00 0.00 FE HETATM 1706 FE2 FES A 201 31.837 31.035 36.423 1.00 0.00 FE HETATM 1707 S1 FES A 201 33.521 32.076 35.469 1.00 0.00 S HETATM 1708 S2 FES A 201 31.112 32.263 38.072 1.00 0.00 S