USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=25 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 49 THR OG1 : rot 142:sc= 2.01 USER MOD Set 1.2: A 51 HIS : no HE2:sc= 0.994 K(o=3,f=-1.6) USER MOD Set 2.1: A 31 GLN : amide:sc= 0.711 K(o=0.71,f=-1.2) USER MOD Set 2.2: A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 7 THR OG1 : rot 180:sc= 1 USER MOD Set 3.2: A 17 THR OG1 : rot 94:sc= 1.18 USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0959 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 0.286 (180deg=0.27) USER MOD Single : A 14 SER OG : rot 92:sc= 0.939 USER MOD Single : A 15 GLN : amide:sc= -0.666 X(o=-0.67,f=-0.99) 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= 0.152 USER MOD Single : A 25 THR OG1 : rot 130:sc= 1.16 USER MOD Single : A 33 HIS :FLIP no HD1:sc= -0.321 F(o=-1.2,f=-0.32) USER MOD Single : A 34 ASN : amide:sc= -0.249 X(o=-0.25,f=-4e-05) USER MOD Single : A 44 SER OG : rot -130:sc= 0 USER MOD Single : A 45 CYS SG : rot -29:sc= 0.00243 USER MOD Single : A 48 SER OG : rot 180:sc= 0.185 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 23:sc= 0.146 USER MOD Single : A 70 ASN : amide:sc= -0.457 K(o=-0.46,f=-3.7!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -170:sc= -0.472 USER MOD Single : A 82 THR OG1 : rot 146:sc= 1.24 USER MOD Single : A 83 SER OG : rot 45:sc= 0.0128 USER MOD Single : A 88 GLN : amide:sc= -2.34! C(o=-2.3!,f=-4.6!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 149:sc= -0.162 (180deg=-1.22) 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 X(o=0,f=0) USER MOD Single : A 105 MET CE :methyl 178:sc= 0 (180deg=-0.00825) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 111 ASN : amide:sc= -0.0914 K(o=-0.091,f=-1.1) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 41.901 11.496 19.728 1.00 0.00 N ATOM 2 CA GLY A 1 42.583 12.306 18.704 1.00 0.00 C ATOM 3 C GLY A 1 43.663 13.168 19.325 1.00 0.00 C ATOM 4 O GLY A 1 44.117 12.890 20.434 1.00 0.00 O ATOM 0 H1 GLY A 1 41.825 10.512 19.399 1.00 0.00 H new ATOM 0 H2 GLY A 1 42.447 11.524 20.613 1.00 0.00 H new ATOM 0 H3 GLY A 1 40.949 11.879 19.896 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.023 11.652 17.951 1.00 0.00 H new ATOM 0 HA3 GLY A 1 41.857 12.938 18.192 1.00 0.00 H new ATOM 10 N GLU A 2 44.089 14.214 18.615 1.00 0.00 N ATOM 11 CA GLU A 2 45.105 15.188 19.054 1.00 0.00 C ATOM 12 C GLU A 2 44.475 16.489 19.598 1.00 0.00 C ATOM 13 O GLU A 2 45.076 17.169 20.430 1.00 0.00 O ATOM 14 CB GLU A 2 46.024 15.489 17.853 1.00 0.00 C ATOM 15 CG GLU A 2 47.333 16.219 18.197 1.00 0.00 C ATOM 16 CD GLU A 2 48.391 15.298 18.815 1.00 0.00 C ATOM 17 OE1 GLU A 2 48.782 14.302 18.159 1.00 0.00 O ATOM 18 OE2 GLU A 2 48.897 15.582 19.929 1.00 0.00 O ATOM 0 H GLU A 2 43.726 14.419 17.684 1.00 0.00 H new ATOM 0 HA GLU A 2 45.675 14.759 19.878 1.00 0.00 H new ATOM 0 HB2 GLU A 2 46.270 14.549 17.360 1.00 0.00 H new ATOM 0 HB3 GLU A 2 45.469 16.091 17.133 1.00 0.00 H new ATOM 0 HG2 GLU A 2 47.738 16.672 17.292 1.00 0.00 H new ATOM 0 HG3 GLU A 2 47.117 17.032 18.891 1.00 0.00 H new ATOM 25 N GLU A 3 43.262 16.834 19.155 1.00 0.00 N ATOM 26 CA GLU A 3 42.514 18.047 19.533 1.00 0.00 C ATOM 27 C GLU A 3 41.068 17.738 19.969 1.00 0.00 C ATOM 28 O GLU A 3 40.588 16.604 19.847 1.00 0.00 O ATOM 29 CB GLU A 3 42.496 19.040 18.357 1.00 0.00 C ATOM 30 CG GLU A 3 43.877 19.552 17.930 1.00 0.00 C ATOM 31 CD GLU A 3 43.699 20.690 16.922 1.00 0.00 C ATOM 32 OE1 GLU A 3 43.265 20.412 15.779 1.00 0.00 O ATOM 33 OE2 GLU A 3 43.898 21.874 17.295 1.00 0.00 O ATOM 0 H GLU A 3 42.748 16.252 18.493 1.00 0.00 H new ATOM 0 HA GLU A 3 43.027 18.486 20.389 1.00 0.00 H new ATOM 0 HB2 GLU A 3 42.021 18.560 17.501 1.00 0.00 H new ATOM 0 HB3 GLU A 3 41.875 19.894 18.629 1.00 0.00 H new ATOM 0 HG2 GLU A 3 44.433 19.903 18.799 1.00 0.00 H new ATOM 0 HG3 GLU A 3 44.457 18.743 17.486 1.00 0.00 H new ATOM 40 N LEU A 4 40.352 18.761 20.452 1.00 0.00 N ATOM 41 CA LEU A 4 38.978 18.678 20.964 1.00 0.00 C ATOM 42 C LEU A 4 38.003 19.558 20.149 1.00 0.00 C ATOM 43 O LEU A 4 38.423 20.405 19.351 1.00 0.00 O ATOM 44 CB LEU A 4 38.957 19.137 22.436 1.00 0.00 C ATOM 45 CG LEU A 4 40.108 18.696 23.364 1.00 0.00 C ATOM 46 CD1 LEU A 4 39.834 19.305 24.725 1.00 0.00 C ATOM 47 CD2 LEU A 4 40.226 17.199 23.610 1.00 0.00 C ATOM 0 H LEU A 4 40.729 19.708 20.499 1.00 0.00 H new ATOM 0 HA LEU A 4 38.651 17.642 20.876 1.00 0.00 H new ATOM 0 HB2 LEU A 4 38.926 20.227 22.442 1.00 0.00 H new ATOM 0 HB3 LEU A 4 38.024 18.789 22.878 1.00 0.00 H new ATOM 0 HG LEU A 4 41.025 19.016 22.869 1.00 0.00 H new ATOM 0 HD11 LEU A 4 40.626 19.019 25.418 1.00 0.00 H new ATOM 0 HD12 LEU A 4 39.803 20.391 24.638 1.00 0.00 H new ATOM 0 HD13 LEU A 4 38.876 18.943 25.099 1.00 0.00 H new ATOM 0 HD21 LEU A 4 41.067 17.005 24.275 1.00 0.00 H new ATOM 0 HD22 LEU A 4 39.308 16.832 24.069 1.00 0.00 H new ATOM 0 HD23 LEU A 4 40.387 16.686 22.662 1.00 0.00 H new ATOM 59 N LYS A 5 36.699 19.432 20.426 1.00 0.00 N ATOM 60 CA LYS A 5 35.663 20.418 20.066 1.00 0.00 C ATOM 61 C LYS A 5 34.695 20.693 21.228 1.00 0.00 C ATOM 62 O LYS A 5 34.582 19.877 22.142 1.00 0.00 O ATOM 63 CB LYS A 5 34.939 20.025 18.770 1.00 0.00 C ATOM 64 CG LYS A 5 34.085 18.751 18.868 1.00 0.00 C ATOM 65 CD LYS A 5 33.105 18.716 17.689 1.00 0.00 C ATOM 66 CE LYS A 5 32.056 17.600 17.800 1.00 0.00 C ATOM 67 NZ LYS A 5 32.630 16.256 17.554 1.00 0.00 N ATOM 0 H LYS A 5 36.322 18.622 20.919 1.00 0.00 H new ATOM 0 HA LYS A 5 36.168 21.363 19.868 1.00 0.00 H new ATOM 0 HB2 LYS A 5 34.298 20.852 18.464 1.00 0.00 H new ATOM 0 HB3 LYS A 5 35.681 19.888 17.983 1.00 0.00 H new ATOM 0 HG2 LYS A 5 34.723 17.868 18.853 1.00 0.00 H new ATOM 0 HG3 LYS A 5 33.540 18.735 19.812 1.00 0.00 H new ATOM 0 HD2 LYS A 5 32.596 19.677 17.621 1.00 0.00 H new ATOM 0 HD3 LYS A 5 33.666 18.586 16.764 1.00 0.00 H new ATOM 0 HE2 LYS A 5 31.608 17.624 18.793 1.00 0.00 H new ATOM 0 HE3 LYS A 5 31.255 17.786 17.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 31.882 15.538 17.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 33.034 16.221 16.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 33.377 16.064 18.252 1.00 0.00 H new ATOM 81 N ILE A 6 34.032 21.847 21.179 1.00 0.00 N ATOM 82 CA ILE A 6 33.005 22.342 22.114 1.00 0.00 C ATOM 83 C ILE A 6 31.837 22.904 21.300 1.00 0.00 C ATOM 84 O ILE A 6 32.043 23.694 20.378 1.00 0.00 O ATOM 85 CB ILE A 6 33.588 23.403 23.095 1.00 0.00 C ATOM 86 CG1 ILE A 6 32.526 24.177 23.930 1.00 0.00 C ATOM 87 CG2 ILE A 6 34.462 24.433 22.356 1.00 0.00 C ATOM 88 CD1 ILE A 6 33.078 24.928 25.144 1.00 0.00 C ATOM 0 H ILE A 6 34.207 22.517 20.430 1.00 0.00 H new ATOM 0 HA ILE A 6 32.650 21.519 22.734 1.00 0.00 H new ATOM 0 HB ILE A 6 34.182 22.813 23.792 1.00 0.00 H new ATOM 0 HG12 ILE A 6 32.023 24.891 23.278 1.00 0.00 H new ATOM 0 HG13 ILE A 6 31.770 23.471 24.272 1.00 0.00 H new ATOM 0 HG21 ILE A 6 34.852 25.158 23.070 1.00 0.00 H new ATOM 0 HG22 ILE A 6 35.292 23.922 21.867 1.00 0.00 H new ATOM 0 HG23 ILE A 6 33.862 24.949 21.607 1.00 0.00 H new ATOM 0 HD11 ILE A 6 32.263 25.435 25.660 1.00 0.00 H new ATOM 0 HD12 ILE A 6 33.554 24.221 25.824 1.00 0.00 H new ATOM 0 HD13 ILE A 6 33.811 25.664 24.814 1.00 0.00 H new ATOM 100 N THR A 7 30.608 22.533 21.655 1.00 0.00 N ATOM 101 CA THR A 7 29.394 23.120 21.073 1.00 0.00 C ATOM 102 C THR A 7 28.671 23.989 22.083 1.00 0.00 C ATOM 103 O THR A 7 28.460 23.586 23.224 1.00 0.00 O ATOM 104 CB THR A 7 28.451 22.048 20.506 1.00 0.00 C ATOM 105 OG1 THR A 7 29.091 21.312 19.487 1.00 0.00 O ATOM 106 CG2 THR A 7 27.188 22.651 19.878 1.00 0.00 C ATOM 0 H THR A 7 30.422 21.816 22.356 1.00 0.00 H new ATOM 0 HA THR A 7 29.711 23.749 20.241 1.00 0.00 H new ATOM 0 HB THR A 7 28.180 21.417 21.352 1.00 0.00 H new ATOM 0 HG1 THR A 7 28.476 20.633 19.139 1.00 0.00 H new ATOM 0 HG21 THR A 7 26.556 21.851 19.493 1.00 0.00 H new ATOM 0 HG22 THR A 7 26.640 23.215 20.633 1.00 0.00 H new ATOM 0 HG23 THR A 7 27.470 23.316 19.062 1.00 0.00 H new ATOM 114 N PHE A 8 28.230 25.159 21.633 1.00 0.00 N ATOM 115 CA PHE A 8 27.366 26.065 22.375 1.00 0.00 C ATOM 116 C PHE A 8 26.081 26.350 21.589 1.00 0.00 C ATOM 117 O PHE A 8 26.113 26.665 20.396 1.00 0.00 O ATOM 118 CB PHE A 8 28.110 27.353 22.773 1.00 0.00 C ATOM 119 CG PHE A 8 29.627 27.294 22.940 1.00 0.00 C ATOM 120 CD1 PHE A 8 30.435 27.112 21.798 1.00 0.00 C ATOM 121 CD2 PHE A 8 30.254 27.555 24.183 1.00 0.00 C ATOM 122 CE1 PHE A 8 31.824 27.111 21.901 1.00 0.00 C ATOM 123 CE2 PHE A 8 31.651 27.629 24.268 1.00 0.00 C ATOM 124 CZ PHE A 8 32.429 27.386 23.128 1.00 0.00 C ATOM 0 H PHE A 8 28.474 25.513 20.708 1.00 0.00 H new ATOM 0 HA PHE A 8 27.075 25.578 23.306 1.00 0.00 H new ATOM 0 HB2 PHE A 8 27.888 28.110 22.021 1.00 0.00 H new ATOM 0 HB3 PHE A 8 27.686 27.704 23.714 1.00 0.00 H new ATOM 0 HD1 PHE A 8 29.971 26.972 20.833 1.00 0.00 H new ATOM 0 HD2 PHE A 8 29.653 27.698 25.069 1.00 0.00 H new ATOM 0 HE1 PHE A 8 32.431 26.898 21.034 1.00 0.00 H new ATOM 0 HE2 PHE A 8 32.126 27.872 25.207 1.00 0.00 H new ATOM 0 HZ PHE A 8 33.506 27.412 23.200 1.00 0.00 H new ATOM 134 N ILE A 9 24.950 26.260 22.289 1.00 0.00 N ATOM 135 CA ILE A 9 23.647 26.772 21.832 1.00 0.00 C ATOM 136 C ILE A 9 23.525 28.229 22.267 1.00 0.00 C ATOM 137 O ILE A 9 23.793 28.549 23.425 1.00 0.00 O ATOM 138 CB ILE A 9 22.451 25.963 22.375 1.00 0.00 C ATOM 139 CG1 ILE A 9 22.692 24.440 22.271 1.00 0.00 C ATOM 140 CG2 ILE A 9 21.143 26.444 21.707 1.00 0.00 C ATOM 141 CD1 ILE A 9 21.450 23.546 22.396 1.00 0.00 C ATOM 0 H ILE A 9 24.907 25.821 23.209 1.00 0.00 H new ATOM 0 HA ILE A 9 23.613 26.677 20.747 1.00 0.00 H new ATOM 0 HB ILE A 9 22.344 26.151 23.443 1.00 0.00 H new ATOM 0 HG12 ILE A 9 23.168 24.233 21.312 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.401 24.152 23.047 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.303 25.868 22.095 1.00 0.00 H new ATOM 0 HG22 ILE A 9 20.990 27.501 21.925 1.00 0.00 H new ATOM 0 HG23 ILE A 9 21.212 26.303 20.628 1.00 0.00 H new ATOM 0 HD11 ILE A 9 21.744 22.500 22.307 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.980 23.710 23.366 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.743 23.793 21.604 1.00 0.00 H new ATOM 153 N LEU A 10 23.127 29.106 21.351 1.00 0.00 N ATOM 154 CA LEU A 10 23.167 30.555 21.542 1.00 0.00 C ATOM 155 C LEU A 10 21.868 31.126 22.141 1.00 0.00 C ATOM 156 O LEU A 10 20.802 30.507 22.079 1.00 0.00 O ATOM 157 CB LEU A 10 23.492 31.214 20.191 1.00 0.00 C ATOM 158 CG LEU A 10 24.761 30.751 19.448 1.00 0.00 C ATOM 159 CD1 LEU A 10 25.211 31.899 18.538 1.00 0.00 C ATOM 160 CD2 LEU A 10 25.947 30.399 20.345 1.00 0.00 C ATOM 0 H LEU A 10 22.762 28.827 20.440 1.00 0.00 H new ATOM 0 HA LEU A 10 23.944 30.781 22.273 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.641 31.056 19.529 1.00 0.00 H new ATOM 0 HB3 LEU A 10 23.574 32.289 20.354 1.00 0.00 H new ATOM 0 HG LEU A 10 24.486 29.839 18.919 1.00 0.00 H new ATOM 0 HD11 LEU A 10 26.109 31.603 17.996 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.418 32.132 17.827 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.426 32.780 19.143 1.00 0.00 H new ATOM 0 HD21 LEU A 10 26.789 30.085 19.728 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.232 31.273 20.931 1.00 0.00 H new ATOM 0 HD23 LEU A 10 25.667 29.587 21.016 1.00 0.00 H new ATOM 172 N LYS A 11 21.933 32.374 22.630 1.00 0.00 N ATOM 173 CA LYS A 11 20.750 33.149 23.059 1.00 0.00 C ATOM 174 C LYS A 11 19.756 33.483 21.934 1.00 0.00 C ATOM 175 O LYS A 11 18.602 33.784 22.216 1.00 0.00 O ATOM 176 CB LYS A 11 21.193 34.398 23.844 1.00 0.00 C ATOM 177 CG LYS A 11 22.201 35.344 23.173 1.00 0.00 C ATOM 178 CD LYS A 11 21.736 35.994 21.860 1.00 0.00 C ATOM 179 CE LYS A 11 22.507 37.290 21.615 1.00 0.00 C ATOM 180 NZ LYS A 11 22.267 37.844 20.265 1.00 0.00 N ATOM 0 H LYS A 11 22.812 32.880 22.741 1.00 0.00 H new ATOM 0 HA LYS A 11 20.179 32.498 23.721 1.00 0.00 H new ATOM 0 HB2 LYS A 11 20.301 34.976 24.086 1.00 0.00 H new ATOM 0 HB3 LYS A 11 21.623 34.065 24.789 1.00 0.00 H new ATOM 0 HG2 LYS A 11 22.453 36.135 23.879 1.00 0.00 H new ATOM 0 HG3 LYS A 11 23.118 34.788 22.976 1.00 0.00 H new ATOM 0 HD2 LYS A 11 21.892 35.306 21.029 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.667 36.201 21.906 1.00 0.00 H new ATOM 0 HE2 LYS A 11 22.219 38.028 22.364 1.00 0.00 H new ATOM 0 HE3 LYS A 11 23.573 37.105 21.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 22.785 38.740 20.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 22.597 37.167 19.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 21.249 38.016 20.136 1.00 0.00 H new ATOM 194 N ASP A 12 20.185 33.398 20.673 1.00 0.00 N ATOM 195 CA ASP A 12 19.336 33.492 19.471 1.00 0.00 C ATOM 196 C ASP A 12 18.930 32.108 18.917 1.00 0.00 C ATOM 197 O ASP A 12 18.297 32.007 17.863 1.00 0.00 O ATOM 198 CB ASP A 12 20.013 34.385 18.410 1.00 0.00 C ATOM 199 CG ASP A 12 21.126 33.711 17.597 1.00 0.00 C ATOM 200 OD1 ASP A 12 21.593 32.612 17.973 1.00 0.00 O ATOM 201 OD2 ASP A 12 21.535 34.275 16.555 1.00 0.00 O ATOM 0 H ASP A 12 21.169 33.256 20.446 1.00 0.00 H new ATOM 0 HA ASP A 12 18.398 33.967 19.759 1.00 0.00 H new ATOM 0 HB2 ASP A 12 19.249 34.744 17.720 1.00 0.00 H new ATOM 0 HB3 ASP A 12 20.429 35.260 18.908 1.00 0.00 H new ATOM 206 N GLY A 13 19.313 31.038 19.621 1.00 0.00 N ATOM 207 CA GLY A 13 19.082 29.643 19.265 1.00 0.00 C ATOM 208 C GLY A 13 19.989 29.072 18.171 1.00 0.00 C ATOM 209 O GLY A 13 19.711 27.953 17.737 1.00 0.00 O ATOM 0 H GLY A 13 19.820 31.132 20.501 1.00 0.00 H new ATOM 0 HA2 GLY A 13 19.200 29.035 20.162 1.00 0.00 H new ATOM 0 HA3 GLY A 13 18.046 29.537 18.943 1.00 0.00 H new ATOM 213 N SER A 14 21.049 29.763 17.719 1.00 0.00 N ATOM 214 CA SER A 14 22.061 29.164 16.820 1.00 0.00 C ATOM 215 C SER A 14 22.872 28.057 17.498 1.00 0.00 C ATOM 216 O SER A 14 22.911 27.943 18.725 1.00 0.00 O ATOM 217 CB SER A 14 23.070 30.164 16.225 1.00 0.00 C ATOM 218 OG SER A 14 22.490 31.388 15.833 1.00 0.00 O ATOM 0 H SER A 14 21.231 30.737 17.959 1.00 0.00 H new ATOM 0 HA SER A 14 21.451 28.761 16.012 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.850 30.361 16.960 1.00 0.00 H new ATOM 0 HB3 SER A 14 23.554 29.708 15.361 1.00 0.00 H new ATOM 0 HG SER A 14 22.546 32.028 16.573 1.00 0.00 H new ATOM 224 N GLN A 15 23.575 27.277 16.682 1.00 0.00 N ATOM 225 CA GLN A 15 24.540 26.255 17.071 1.00 0.00 C ATOM 226 C GLN A 15 25.898 26.624 16.527 1.00 0.00 C ATOM 227 O GLN A 15 26.097 26.785 15.319 1.00 0.00 O ATOM 228 CB GLN A 15 24.171 24.879 16.496 1.00 0.00 C ATOM 229 CG GLN A 15 22.909 24.220 17.074 1.00 0.00 C ATOM 230 CD GLN A 15 21.656 25.086 16.998 1.00 0.00 C ATOM 231 OE1 GLN A 15 21.190 25.479 15.935 1.00 0.00 O ATOM 232 NE2 GLN A 15 21.112 25.482 18.122 1.00 0.00 N ATOM 0 H GLN A 15 23.480 27.347 15.669 1.00 0.00 H new ATOM 0 HA GLN A 15 24.542 26.201 18.160 1.00 0.00 H new ATOM 0 HB2 GLN A 15 24.042 24.981 15.419 1.00 0.00 H new ATOM 0 HB3 GLN A 15 25.013 24.205 16.653 1.00 0.00 H new ATOM 0 HG2 GLN A 15 22.724 23.287 16.541 1.00 0.00 H new ATOM 0 HG3 GLN A 15 23.094 23.960 18.116 1.00 0.00 H new ATOM 0 HE21 GLN A 15 21.491 25.161 19.013 1.00 0.00 H new ATOM 0 HE22 GLN A 15 20.309 26.111 18.106 1.00 0.00 H new ATOM 241 N LYS A 16 26.853 26.699 17.444 1.00 0.00 N ATOM 242 CA LYS A 16 28.224 27.007 17.125 1.00 0.00 C ATOM 243 C LYS A 16 29.071 25.931 17.751 1.00 0.00 C ATOM 244 O LYS A 16 29.045 25.716 18.959 1.00 0.00 O ATOM 245 CB LYS A 16 28.559 28.388 17.645 1.00 0.00 C ATOM 246 CG LYS A 16 27.760 29.517 16.971 1.00 0.00 C ATOM 247 CD LYS A 16 28.192 29.835 15.532 1.00 0.00 C ATOM 248 CE LYS A 16 27.887 31.305 15.206 1.00 0.00 C ATOM 249 NZ LYS A 16 28.492 31.719 13.920 1.00 0.00 N ATOM 0 H LYS A 16 26.687 26.545 18.438 1.00 0.00 H new ATOM 0 HA LYS A 16 28.408 27.024 16.051 1.00 0.00 H new ATOM 0 HB2 LYS A 16 28.374 28.416 18.719 1.00 0.00 H new ATOM 0 HB3 LYS A 16 29.623 28.572 17.500 1.00 0.00 H new ATOM 0 HG2 LYS A 16 26.704 29.245 16.968 1.00 0.00 H new ATOM 0 HG3 LYS A 16 27.855 30.421 17.573 1.00 0.00 H new ATOM 0 HD2 LYS A 16 29.258 29.641 15.412 1.00 0.00 H new ATOM 0 HD3 LYS A 16 27.668 29.182 14.833 1.00 0.00 H new ATOM 0 HE2 LYS A 16 26.808 31.452 15.164 1.00 0.00 H new ATOM 0 HE3 LYS A 16 28.264 31.941 16.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 28.264 32.717 13.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 29.524 31.603 13.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 28.113 31.129 13.152 1.00 0.00 H new ATOM 263 N THR A 17 29.762 25.230 16.881 1.00 0.00 N ATOM 264 CA THR A 17 30.672 24.133 17.238 1.00 0.00 C ATOM 265 C THR A 17 32.108 24.461 16.835 1.00 0.00 C ATOM 266 O THR A 17 32.377 24.792 15.680 1.00 0.00 O ATOM 267 CB THR A 17 30.182 22.770 16.729 1.00 0.00 C ATOM 268 OG1 THR A 17 30.867 21.761 17.430 1.00 0.00 O ATOM 269 CG2 THR A 17 30.388 22.518 15.238 1.00 0.00 C ATOM 0 H THR A 17 29.715 25.401 15.877 1.00 0.00 H new ATOM 0 HA THR A 17 30.670 24.038 18.324 1.00 0.00 H new ATOM 0 HB THR A 17 29.105 22.764 16.897 1.00 0.00 H new ATOM 0 HG1 THR A 17 30.335 21.481 18.204 1.00 0.00 H new ATOM 0 HG21 THR A 17 30.009 21.529 14.980 1.00 0.00 H new ATOM 0 HG22 THR A 17 29.851 23.273 14.664 1.00 0.00 H new ATOM 0 HG23 THR A 17 31.451 22.571 15.003 1.00 0.00 H new ATOM 277 N TYR A 18 33.017 24.454 17.805 1.00 0.00 N ATOM 278 CA TYR A 18 34.309 25.145 17.750 1.00 0.00 C ATOM 279 C TYR A 18 35.463 24.230 18.189 1.00 0.00 C ATOM 280 O TYR A 18 35.368 23.562 19.220 1.00 0.00 O ATOM 281 CB TYR A 18 34.242 26.392 18.654 1.00 0.00 C ATOM 282 CG TYR A 18 33.421 27.595 18.185 1.00 0.00 C ATOM 283 CD1 TYR A 18 32.980 27.729 16.851 1.00 0.00 C ATOM 284 CD2 TYR A 18 33.130 28.630 19.099 1.00 0.00 C ATOM 285 CE1 TYR A 18 32.249 28.854 16.437 1.00 0.00 C ATOM 286 CE2 TYR A 18 32.407 29.762 18.683 1.00 0.00 C ATOM 287 CZ TYR A 18 31.979 29.890 17.349 1.00 0.00 C ATOM 288 OH TYR A 18 31.337 31.018 16.945 1.00 0.00 O ATOM 0 H TYR A 18 32.874 23.952 18.681 1.00 0.00 H new ATOM 0 HA TYR A 18 34.506 25.437 16.719 1.00 0.00 H new ATOM 0 HB2 TYR A 18 33.847 26.079 19.621 1.00 0.00 H new ATOM 0 HB3 TYR A 18 35.263 26.734 18.822 1.00 0.00 H new ATOM 0 HD1 TYR A 18 33.209 26.953 16.136 1.00 0.00 H new ATOM 0 HD2 TYR A 18 33.464 28.552 20.123 1.00 0.00 H new ATOM 0 HE1 TYR A 18 31.894 28.924 15.419 1.00 0.00 H new ATOM 0 HE2 TYR A 18 32.178 30.541 19.395 1.00 0.00 H new ATOM 0 HH TYR A 18 31.234 31.626 17.707 1.00 0.00 H new ATOM 298 N GLU A 19 36.575 24.221 17.448 1.00 0.00 N ATOM 299 CA GLU A 19 37.788 23.479 17.827 1.00 0.00 C ATOM 300 C GLU A 19 38.640 24.212 18.884 1.00 0.00 C ATOM 301 O GLU A 19 38.950 25.394 18.732 1.00 0.00 O ATOM 302 CB GLU A 19 38.610 23.079 16.591 1.00 0.00 C ATOM 303 CG GLU A 19 39.237 24.226 15.780 1.00 0.00 C ATOM 304 CD GLU A 19 39.963 23.699 14.534 1.00 0.00 C ATOM 305 OE1 GLU A 19 40.974 22.968 14.680 1.00 0.00 O ATOM 306 OE2 GLU A 19 39.553 24.025 13.394 1.00 0.00 O ATOM 0 H GLU A 19 36.663 24.728 16.567 1.00 0.00 H new ATOM 0 HA GLU A 19 37.452 22.560 18.308 1.00 0.00 H new ATOM 0 HB2 GLU A 19 39.410 22.414 16.915 1.00 0.00 H new ATOM 0 HB3 GLU A 19 37.967 22.503 15.926 1.00 0.00 H new ATOM 0 HG2 GLU A 19 38.460 24.929 15.480 1.00 0.00 H new ATOM 0 HG3 GLU A 19 39.939 24.776 16.407 1.00 0.00 H new ATOM 313 N VAL A 20 39.041 23.515 19.955 1.00 0.00 N ATOM 314 CA VAL A 20 39.791 24.068 21.104 1.00 0.00 C ATOM 315 C VAL A 20 40.846 23.093 21.645 1.00 0.00 C ATOM 316 O VAL A 20 41.044 22.003 21.095 1.00 0.00 O ATOM 317 CB VAL A 20 38.817 24.486 22.227 1.00 0.00 C ATOM 318 CG1 VAL A 20 37.850 25.576 21.766 1.00 0.00 C ATOM 319 CG2 VAL A 20 38.009 23.306 22.780 1.00 0.00 C ATOM 0 H VAL A 20 38.849 22.518 20.055 1.00 0.00 H new ATOM 0 HA VAL A 20 40.327 24.946 20.744 1.00 0.00 H new ATOM 0 HB VAL A 20 39.449 24.877 23.025 1.00 0.00 H new ATOM 0 HG11 VAL A 20 37.183 25.841 22.586 1.00 0.00 H new ATOM 0 HG12 VAL A 20 38.414 26.457 21.458 1.00 0.00 H new ATOM 0 HG13 VAL A 20 37.263 25.209 20.924 1.00 0.00 H new ATOM 0 HG21 VAL A 20 37.341 23.659 23.566 1.00 0.00 H new ATOM 0 HG22 VAL A 20 37.421 22.860 21.978 1.00 0.00 H new ATOM 0 HG23 VAL A 20 38.689 22.559 23.190 1.00 0.00 H new ATOM 329 N CYS A 21 41.538 23.485 22.720 1.00 0.00 N ATOM 330 CA CYS A 21 42.485 22.641 23.451 1.00 0.00 C ATOM 331 C CYS A 21 41.982 22.274 24.858 1.00 0.00 C ATOM 332 O CYS A 21 40.957 22.764 25.333 1.00 0.00 O ATOM 333 CB CYS A 21 43.845 23.347 23.503 1.00 0.00 C ATOM 334 SG CYS A 21 45.163 22.098 23.474 1.00 0.00 S ATOM 0 H CYS A 21 41.452 24.422 23.114 1.00 0.00 H new ATOM 0 HA CYS A 21 42.588 21.695 22.919 1.00 0.00 H new ATOM 0 HB2 CYS A 21 43.950 24.024 22.655 1.00 0.00 H new ATOM 0 HB3 CYS A 21 43.920 23.953 24.406 1.00 0.00 H new ATOM 0 HG CYS A 21 46.321 22.688 23.515 1.00 0.00 H new ATOM 340 N GLU A 22 42.723 21.397 25.528 1.00 0.00 N ATOM 341 CA GLU A 22 42.448 20.911 26.884 1.00 0.00 C ATOM 342 C GLU A 22 42.797 21.980 27.943 1.00 0.00 C ATOM 343 O GLU A 22 43.695 22.800 27.735 1.00 0.00 O ATOM 344 CB GLU A 22 43.272 19.637 27.137 1.00 0.00 C ATOM 345 CG GLU A 22 43.273 18.544 26.060 1.00 0.00 C ATOM 346 CD GLU A 22 44.638 17.839 26.000 1.00 0.00 C ATOM 347 OE1 GLU A 22 44.983 17.087 26.944 1.00 0.00 O ATOM 348 OE2 GLU A 22 45.374 18.029 24.999 1.00 0.00 O ATOM 0 H GLU A 22 43.567 20.986 25.128 1.00 0.00 H new ATOM 0 HA GLU A 22 41.383 20.692 26.968 1.00 0.00 H new ATOM 0 HB2 GLU A 22 44.306 19.938 27.306 1.00 0.00 H new ATOM 0 HB3 GLU A 22 42.915 19.189 28.064 1.00 0.00 H new ATOM 0 HG2 GLU A 22 42.491 17.815 26.274 1.00 0.00 H new ATOM 0 HG3 GLU A 22 43.042 18.983 25.089 1.00 0.00 H new ATOM 355 N GLY A 23 42.112 21.995 29.092 1.00 0.00 N ATOM 356 CA GLY A 23 42.329 22.961 30.174 1.00 0.00 C ATOM 357 C GLY A 23 41.759 24.360 29.894 1.00 0.00 C ATOM 358 O GLY A 23 41.766 25.200 30.795 1.00 0.00 O ATOM 0 H GLY A 23 41.375 21.321 29.300 1.00 0.00 H new ATOM 0 HA2 GLY A 23 41.878 22.574 31.088 1.00 0.00 H new ATOM 0 HA3 GLY A 23 43.400 23.048 30.359 1.00 0.00 H new ATOM 362 N GLU A 24 41.242 24.627 28.688 1.00 0.00 N ATOM 363 CA GLU A 24 40.450 25.829 28.382 1.00 0.00 C ATOM 364 C GLU A 24 39.050 25.731 29.019 1.00 0.00 C ATOM 365 O GLU A 24 38.487 24.645 29.163 1.00 0.00 O ATOM 366 CB GLU A 24 40.390 26.110 26.862 1.00 0.00 C ATOM 367 CG GLU A 24 41.790 26.211 26.235 1.00 0.00 C ATOM 368 CD GLU A 24 41.814 26.949 24.887 1.00 0.00 C ATOM 369 OE1 GLU A 24 41.436 26.383 23.832 1.00 0.00 O ATOM 370 OE2 GLU A 24 42.287 28.114 24.863 1.00 0.00 O ATOM 0 H GLU A 24 41.362 24.008 27.886 1.00 0.00 H new ATOM 0 HA GLU A 24 40.953 26.688 28.826 1.00 0.00 H new ATOM 0 HB2 GLU A 24 39.829 25.316 26.369 1.00 0.00 H new ATOM 0 HB3 GLU A 24 39.847 27.039 26.687 1.00 0.00 H new ATOM 0 HG2 GLU A 24 42.454 26.724 26.931 1.00 0.00 H new ATOM 0 HG3 GLU A 24 42.189 25.206 26.096 1.00 0.00 H new ATOM 377 N THR A 25 38.499 26.863 29.451 1.00 0.00 N ATOM 378 CA THR A 25 37.311 26.958 30.320 1.00 0.00 C ATOM 379 C THR A 25 36.067 27.326 29.506 1.00 0.00 C ATOM 380 O THR A 25 36.154 28.091 28.555 1.00 0.00 O ATOM 381 CB THR A 25 37.566 27.970 31.458 1.00 0.00 C ATOM 382 OG1 THR A 25 38.893 28.456 31.483 1.00 0.00 O ATOM 383 CG2 THR A 25 37.389 27.323 32.829 1.00 0.00 C ATOM 0 H THR A 25 38.876 27.777 29.201 1.00 0.00 H new ATOM 0 HA THR A 25 37.125 25.983 30.770 1.00 0.00 H new ATOM 0 HB THR A 25 36.851 28.769 31.263 1.00 0.00 H new ATOM 0 HG1 THR A 25 38.882 29.435 31.521 1.00 0.00 H new ATOM 0 HG21 THR A 25 37.576 28.063 33.607 1.00 0.00 H new ATOM 0 HG22 THR A 25 36.371 26.945 32.924 1.00 0.00 H new ATOM 0 HG23 THR A 25 38.094 26.498 32.936 1.00 0.00 H new ATOM 391 N ILE A 26 34.884 26.825 29.862 1.00 0.00 N ATOM 392 CA ILE A 26 33.662 26.991 29.041 1.00 0.00 C ATOM 393 C ILE A 26 33.250 28.470 28.874 1.00 0.00 C ATOM 394 O ILE A 26 32.928 28.876 27.756 1.00 0.00 O ATOM 395 CB ILE A 26 32.550 26.055 29.573 1.00 0.00 C ATOM 396 CG1 ILE A 26 32.724 24.583 29.121 1.00 0.00 C ATOM 397 CG2 ILE A 26 31.145 26.505 29.149 1.00 0.00 C ATOM 398 CD1 ILE A 26 34.047 23.894 29.476 1.00 0.00 C ATOM 0 H ILE A 26 34.735 26.294 30.720 1.00 0.00 H new ATOM 0 HA ILE A 26 33.870 26.679 28.018 1.00 0.00 H new ATOM 0 HB ILE A 26 32.651 26.117 30.657 1.00 0.00 H new ATOM 0 HG12 ILE A 26 31.912 23.998 29.553 1.00 0.00 H new ATOM 0 HG13 ILE A 26 32.603 24.545 28.038 1.00 0.00 H new ATOM 0 HG21 ILE A 26 30.405 25.812 29.550 1.00 0.00 H new ATOM 0 HG22 ILE A 26 30.952 27.506 29.535 1.00 0.00 H new ATOM 0 HG23 ILE A 26 31.079 26.516 28.061 1.00 0.00 H new ATOM 0 HD11 ILE A 26 34.036 22.870 29.102 1.00 0.00 H new ATOM 0 HD12 ILE A 26 34.874 24.438 29.021 1.00 0.00 H new ATOM 0 HD13 ILE A 26 34.172 23.883 30.559 1.00 0.00 H new ATOM 410 N LEU A 27 33.343 29.305 29.920 1.00 0.00 N ATOM 411 CA LEU A 27 33.107 30.754 29.780 1.00 0.00 C ATOM 412 C LEU A 27 34.268 31.453 29.051 1.00 0.00 C ATOM 413 O LEU A 27 34.048 32.370 28.263 1.00 0.00 O ATOM 414 CB LEU A 27 32.824 31.411 31.154 1.00 0.00 C ATOM 415 CG LEU A 27 31.453 32.107 31.289 1.00 0.00 C ATOM 416 CD1 LEU A 27 31.246 33.203 30.241 1.00 0.00 C ATOM 417 CD2 LEU A 27 30.277 31.131 31.197 1.00 0.00 C ATOM 0 H LEU A 27 33.578 29.007 30.867 1.00 0.00 H new ATOM 0 HA LEU A 27 32.218 30.881 29.162 1.00 0.00 H new ATOM 0 HB2 LEU A 27 32.900 30.645 31.926 1.00 0.00 H new ATOM 0 HB3 LEU A 27 33.605 32.144 31.354 1.00 0.00 H new ATOM 0 HG LEU A 27 31.471 32.552 32.284 1.00 0.00 H new ATOM 0 HD11 LEU A 27 30.266 33.660 30.381 1.00 0.00 H new ATOM 0 HD12 LEU A 27 32.020 33.963 30.351 1.00 0.00 H new ATOM 0 HD13 LEU A 27 31.304 32.768 29.243 1.00 0.00 H new ATOM 0 HD21 LEU A 27 29.340 31.679 31.299 1.00 0.00 H new ATOM 0 HD22 LEU A 27 30.298 30.625 30.232 1.00 0.00 H new ATOM 0 HD23 LEU A 27 30.354 30.393 31.995 1.00 0.00 H new ATOM 429 N ASP A 28 35.497 30.970 29.250 1.00 0.00 N ATOM 430 CA ASP A 28 36.699 31.448 28.558 1.00 0.00 C ATOM 431 C ASP A 28 36.717 31.118 27.057 1.00 0.00 C ATOM 432 O ASP A 28 37.371 31.834 26.301 1.00 0.00 O ATOM 433 CB ASP A 28 37.940 30.852 29.232 1.00 0.00 C ATOM 434 CG ASP A 28 38.371 31.628 30.485 1.00 0.00 C ATOM 435 OD1 ASP A 28 38.684 32.839 30.363 1.00 0.00 O ATOM 436 OD2 ASP A 28 38.461 31.030 31.585 1.00 0.00 O ATOM 0 H ASP A 28 35.690 30.218 29.912 1.00 0.00 H new ATOM 0 HA ASP A 28 36.697 32.535 28.634 1.00 0.00 H new ATOM 0 HB2 ASP A 28 37.737 29.816 29.504 1.00 0.00 H new ATOM 0 HB3 ASP A 28 38.764 30.838 28.518 1.00 0.00 H new ATOM 441 N ILE A 29 35.998 30.090 26.590 1.00 0.00 N ATOM 442 CA ILE A 29 35.785 29.852 25.153 1.00 0.00 C ATOM 443 C ILE A 29 34.613 30.702 24.660 1.00 0.00 C ATOM 444 O ILE A 29 34.723 31.325 23.607 1.00 0.00 O ATOM 445 CB ILE A 29 35.661 28.350 24.770 1.00 0.00 C ATOM 446 CG1 ILE A 29 36.806 27.484 25.369 1.00 0.00 C ATOM 447 CG2 ILE A 29 35.805 28.289 23.234 1.00 0.00 C ATOM 448 CD1 ILE A 29 36.423 26.024 25.632 1.00 0.00 C ATOM 0 H ILE A 29 35.548 29.401 27.193 1.00 0.00 H new ATOM 0 HA ILE A 29 36.686 30.171 24.629 1.00 0.00 H new ATOM 0 HB ILE A 29 34.714 27.965 25.149 1.00 0.00 H new ATOM 0 HG12 ILE A 29 37.657 27.507 24.688 1.00 0.00 H new ATOM 0 HG13 ILE A 29 37.135 27.935 26.305 1.00 0.00 H new ATOM 0 HG21 ILE A 29 35.726 27.254 22.902 1.00 0.00 H new ATOM 0 HG22 ILE A 29 35.015 28.880 22.771 1.00 0.00 H new ATOM 0 HG23 ILE A 29 36.776 28.690 22.943 1.00 0.00 H new ATOM 0 HD11 ILE A 29 37.279 25.493 26.049 1.00 0.00 H new ATOM 0 HD12 ILE A 29 35.594 25.987 26.338 1.00 0.00 H new ATOM 0 HD13 ILE A 29 36.124 25.552 24.696 1.00 0.00 H new ATOM 460 N ALA A 30 33.534 30.850 25.435 1.00 0.00 N ATOM 461 CA ALA A 30 32.434 31.728 25.037 1.00 0.00 C ATOM 462 C ALA A 30 32.864 33.206 24.871 1.00 0.00 C ATOM 463 O ALA A 30 32.382 33.910 23.977 1.00 0.00 O ATOM 464 CB ALA A 30 31.292 31.571 26.047 1.00 0.00 C ATOM 0 H ALA A 30 33.401 30.379 26.330 1.00 0.00 H new ATOM 0 HA ALA A 30 32.092 31.425 24.047 1.00 0.00 H new ATOM 0 HB1 ALA A 30 30.464 32.220 25.763 1.00 0.00 H new ATOM 0 HB2 ALA A 30 30.954 30.535 26.056 1.00 0.00 H new ATOM 0 HB3 ALA A 30 31.645 31.846 27.041 1.00 0.00 H new ATOM 470 N GLN A 31 33.814 33.658 25.691 1.00 0.00 N ATOM 471 CA GLN A 31 34.478 34.957 25.568 1.00 0.00 C ATOM 472 C GLN A 31 35.656 34.948 24.602 1.00 0.00 C ATOM 473 O GLN A 31 35.739 35.838 23.766 1.00 0.00 O ATOM 474 CB GLN A 31 34.939 35.422 26.940 1.00 0.00 C ATOM 475 CG GLN A 31 33.743 35.805 27.815 1.00 0.00 C ATOM 476 CD GLN A 31 33.049 37.117 27.468 1.00 0.00 C ATOM 477 OE1 GLN A 31 33.311 37.754 26.459 1.00 0.00 O ATOM 478 NE2 GLN A 31 32.137 37.566 28.300 1.00 0.00 N ATOM 0 H GLN A 31 34.153 33.113 26.484 1.00 0.00 H new ATOM 0 HA GLN A 31 33.745 35.648 25.153 1.00 0.00 H new ATOM 0 HB2 GLN A 31 35.511 34.630 27.424 1.00 0.00 H new ATOM 0 HB3 GLN A 31 35.606 36.277 26.834 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.007 35.003 27.760 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.079 35.858 28.851 1.00 0.00 H new ATOM 0 HE21 GLN A 31 31.913 37.039 29.144 1.00 0.00 H new ATOM 0 HE22 GLN A 31 31.653 38.441 28.102 1.00 0.00 H new ATOM 487 N GLY A 32 36.559 33.967 24.654 1.00 0.00 N ATOM 488 CA GLY A 32 37.711 33.904 23.747 1.00 0.00 C ATOM 489 C GLY A 32 37.299 33.829 22.275 1.00 0.00 C ATOM 490 O GLY A 32 37.888 34.503 21.430 1.00 0.00 O ATOM 0 H GLY A 32 36.515 33.197 25.321 1.00 0.00 H new ATOM 0 HA2 GLY A 32 38.338 34.782 23.901 1.00 0.00 H new ATOM 0 HA3 GLY A 32 38.317 33.033 23.996 1.00 0.00 H new ATOM 494 N HIS A 33 36.207 33.120 21.970 1.00 0.00 N ATOM 495 CA HIS A 33 35.678 33.003 20.613 1.00 0.00 C ATOM 496 C HIS A 33 34.656 34.096 20.261 1.00 0.00 C ATOM 497 O HIS A 33 34.191 34.162 19.120 1.00 0.00 O ATOM 498 CB HIS A 33 35.114 31.586 20.445 1.00 0.00 C ATOM 499 CG HIS A 33 35.598 30.928 19.171 1.00 0.00 C ATOM 500 ND1 HIS A 33 35.144 31.120 17.891 1.00 0.00 N flip ATOM 501 CD2 HIS A 33 36.704 30.117 19.081 1.00 0.00 C flip ATOM 502 CE1 HIS A 33 35.975 30.404 17.013 1.00 0.00 C flip ATOM 503 NE2 HIS A 33 36.908 29.818 17.787 1.00 0.00 N flip ATOM 0 H HIS A 33 35.664 32.609 22.665 1.00 0.00 H new ATOM 0 HA HIS A 33 36.487 33.163 19.900 1.00 0.00 H new ATOM 0 HB2 HIS A 33 35.405 30.977 21.301 1.00 0.00 H new ATOM 0 HB3 HIS A 33 34.025 31.628 20.440 1.00 0.00 H new ATOM 0 HD2 HIS A 33 37.307 29.777 19.910 1.00 0.00 H new ATOM 0 HE1 HIS A 33 35.884 30.337 15.939 1.00 0.00 H new ATOM 0 HE2 HIS A 33 37.665 29.229 17.439 1.00 0.00 H new ATOM 511 N ASN A 34 34.311 34.960 21.227 1.00 0.00 N ATOM 512 CA ASN A 34 33.286 36.005 21.123 1.00 0.00 C ATOM 513 C ASN A 34 31.972 35.484 20.537 1.00 0.00 C ATOM 514 O ASN A 34 31.426 36.010 19.563 1.00 0.00 O ATOM 515 CB ASN A 34 33.855 37.239 20.423 1.00 0.00 C ATOM 516 CG ASN A 34 34.670 38.075 21.381 1.00 0.00 C ATOM 517 OD1 ASN A 34 34.196 39.058 21.930 1.00 0.00 O ATOM 518 ND2 ASN A 34 35.881 37.686 21.674 1.00 0.00 N ATOM 0 H ASN A 34 34.760 34.947 22.143 1.00 0.00 H new ATOM 0 HA ASN A 34 33.009 36.325 22.128 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.478 36.931 19.583 1.00 0.00 H new ATOM 0 HB3 ASN A 34 33.041 37.837 20.014 1.00 0.00 H new ATOM 0 HD21 ASN A 34 36.430 38.203 22.361 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.278 36.865 21.216 1.00 0.00 H new ATOM 525 N LEU A 35 31.453 34.450 21.195 1.00 0.00 N ATOM 526 CA LEU A 35 30.094 33.953 20.926 1.00 0.00 C ATOM 527 C LEU A 35 29.063 35.078 21.092 1.00 0.00 C ATOM 528 O LEU A 35 29.170 35.884 22.018 1.00 0.00 O ATOM 529 CB LEU A 35 29.741 32.818 21.913 1.00 0.00 C ATOM 530 CG LEU A 35 30.364 31.470 21.510 1.00 0.00 C ATOM 531 CD1 LEU A 35 30.208 30.406 22.597 1.00 0.00 C ATOM 532 CD2 LEU A 35 29.715 30.919 20.241 1.00 0.00 C ATOM 0 H LEU A 35 31.950 33.935 21.922 1.00 0.00 H new ATOM 0 HA LEU A 35 30.068 33.583 19.901 1.00 0.00 H new ATOM 0 HB2 LEU A 35 30.085 33.089 22.911 1.00 0.00 H new ATOM 0 HB3 LEU A 35 28.658 32.712 21.967 1.00 0.00 H new ATOM 0 HG LEU A 35 31.422 31.675 21.348 1.00 0.00 H new ATOM 0 HD11 LEU A 35 30.664 29.474 22.262 1.00 0.00 H new ATOM 0 HD12 LEU A 35 30.699 30.743 23.510 1.00 0.00 H new ATOM 0 HD13 LEU A 35 29.149 30.241 22.795 1.00 0.00 H new ATOM 0 HD21 LEU A 35 30.176 29.966 19.981 1.00 0.00 H new ATOM 0 HD22 LEU A 35 28.649 30.772 20.412 1.00 0.00 H new ATOM 0 HD23 LEU A 35 29.857 31.626 19.423 1.00 0.00 H new ATOM 544 N ASP A 36 28.057 35.109 20.215 1.00 0.00 N ATOM 545 CA ASP A 36 26.924 36.041 20.276 1.00 0.00 C ATOM 546 C ASP A 36 25.981 35.699 21.421 1.00 0.00 C ATOM 547 O ASP A 36 24.952 35.035 21.283 1.00 0.00 O ATOM 548 CB ASP A 36 26.214 36.098 18.920 1.00 0.00 C ATOM 549 CG ASP A 36 25.098 37.147 18.905 1.00 0.00 C ATOM 550 OD1 ASP A 36 25.206 38.166 19.625 1.00 0.00 O ATOM 551 OD2 ASP A 36 24.111 37.001 18.144 1.00 0.00 O ATOM 0 H ASP A 36 28.005 34.471 19.421 1.00 0.00 H new ATOM 0 HA ASP A 36 27.303 37.041 20.488 1.00 0.00 H new ATOM 0 HB2 ASP A 36 26.939 36.328 18.140 1.00 0.00 H new ATOM 0 HB3 ASP A 36 25.795 35.119 18.688 1.00 0.00 H new ATOM 556 N MET A 37 26.430 36.128 22.591 1.00 0.00 N ATOM 557 CA MET A 37 25.988 35.652 23.879 1.00 0.00 C ATOM 558 C MET A 37 26.020 36.837 24.856 1.00 0.00 C ATOM 559 O MET A 37 27.029 37.542 24.984 1.00 0.00 O ATOM 560 CB MET A 37 26.852 34.417 24.219 1.00 0.00 C ATOM 561 CG MET A 37 28.195 34.691 24.903 1.00 0.00 C ATOM 562 SD MET A 37 28.155 34.837 26.710 1.00 0.00 S ATOM 563 CE MET A 37 29.880 35.296 27.027 1.00 0.00 C ATOM 0 H MET A 37 27.146 36.851 22.664 1.00 0.00 H new ATOM 0 HA MET A 37 24.957 35.301 23.922 1.00 0.00 H new ATOM 0 HB2 MET A 37 26.269 33.759 24.863 1.00 0.00 H new ATOM 0 HB3 MET A 37 27.044 33.870 23.296 1.00 0.00 H new ATOM 0 HG2 MET A 37 28.884 33.889 24.639 1.00 0.00 H new ATOM 0 HG3 MET A 37 28.607 35.613 24.493 1.00 0.00 H new ATOM 0 HE1 MET A 37 30.031 35.426 28.099 1.00 0.00 H new ATOM 0 HE2 MET A 37 30.539 34.509 26.661 1.00 0.00 H new ATOM 0 HE3 MET A 37 30.109 36.229 26.512 1.00 0.00 H new ATOM 573 N GLU A 38 24.862 37.115 25.455 1.00 0.00 N ATOM 574 CA GLU A 38 24.695 38.162 26.477 1.00 0.00 C ATOM 575 C GLU A 38 25.644 37.945 27.668 1.00 0.00 C ATOM 576 O GLU A 38 25.815 36.810 28.122 1.00 0.00 O ATOM 577 CB GLU A 38 23.245 38.212 26.986 1.00 0.00 C ATOM 578 CG GLU A 38 22.273 38.830 25.976 1.00 0.00 C ATOM 579 CD GLU A 38 20.944 39.195 26.647 1.00 0.00 C ATOM 580 OE1 GLU A 38 20.928 40.121 27.496 1.00 0.00 O ATOM 581 OE2 GLU A 38 19.896 38.593 26.304 1.00 0.00 O ATOM 0 H GLU A 38 23.998 36.615 25.245 1.00 0.00 H new ATOM 0 HA GLU A 38 24.941 39.111 26.001 1.00 0.00 H new ATOM 0 HB2 GLU A 38 22.916 37.201 27.226 1.00 0.00 H new ATOM 0 HB3 GLU A 38 23.211 38.786 27.912 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.719 39.721 25.535 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.093 38.128 25.162 1.00 0.00 H new ATOM 588 N GLY A 39 26.241 39.030 28.179 1.00 0.00 N ATOM 589 CA GLY A 39 27.375 39.024 29.110 1.00 0.00 C ATOM 590 C GLY A 39 27.103 38.319 30.440 1.00 0.00 C ATOM 591 O GLY A 39 26.691 38.944 31.418 1.00 0.00 O ATOM 0 H GLY A 39 25.934 39.974 27.945 1.00 0.00 H new ATOM 0 HA2 GLY A 39 28.224 38.542 28.625 1.00 0.00 H new ATOM 0 HA3 GLY A 39 27.667 40.054 29.313 1.00 0.00 H new ATOM 595 N ALA A 40 27.336 37.007 30.476 1.00 0.00 N ATOM 596 CA ALA A 40 27.004 36.165 31.619 1.00 0.00 C ATOM 597 C ALA A 40 28.082 36.173 32.717 1.00 0.00 C ATOM 598 O ALA A 40 27.742 36.273 33.890 1.00 0.00 O ATOM 599 CB ALA A 40 26.720 34.753 31.105 1.00 0.00 C ATOM 0 H ALA A 40 27.765 36.497 29.704 1.00 0.00 H new ATOM 0 HA ALA A 40 26.117 36.572 32.105 1.00 0.00 H new ATOM 0 HB1 ALA A 40 26.469 34.104 31.944 1.00 0.00 H new ATOM 0 HB2 ALA A 40 25.884 34.782 30.406 1.00 0.00 H new ATOM 0 HB3 ALA A 40 27.604 34.366 30.599 1.00 0.00 H new ATOM 605 N CYS A 41 29.352 36.040 32.325 1.00 0.00 N ATOM 606 CA CYS A 41 30.573 36.238 33.119 1.00 0.00 C ATOM 607 C CYS A 41 31.784 36.211 32.153 1.00 0.00 C ATOM 608 O CYS A 41 31.625 36.458 30.951 1.00 0.00 O ATOM 609 CB CYS A 41 30.685 35.169 34.225 1.00 0.00 C ATOM 610 SG CYS A 41 31.926 35.482 35.498 1.00 0.00 S ATOM 0 H CYS A 41 29.573 35.769 31.367 1.00 0.00 H new ATOM 0 HA CYS A 41 30.546 37.201 33.628 1.00 0.00 H new ATOM 0 HB2 CYS A 41 29.713 35.070 34.708 1.00 0.00 H new ATOM 0 HB3 CYS A 41 30.907 34.210 33.756 1.00 0.00 H new ATOM 615 N GLY A 42 32.982 35.866 32.636 1.00 0.00 N ATOM 616 CA GLY A 42 34.168 35.662 31.790 1.00 0.00 C ATOM 617 C GLY A 42 35.059 36.899 31.631 1.00 0.00 C ATOM 618 O GLY A 42 35.364 37.317 30.510 1.00 0.00 O ATOM 0 H GLY A 42 33.160 35.719 33.630 1.00 0.00 H new ATOM 0 HA2 GLY A 42 34.764 34.853 32.212 1.00 0.00 H new ATOM 0 HA3 GLY A 42 33.842 35.336 30.802 1.00 0.00 H new ATOM 622 N GLY A 43 35.419 37.523 32.754 1.00 0.00 N ATOM 623 CA GLY A 43 36.212 38.757 32.825 1.00 0.00 C ATOM 624 C GLY A 43 35.573 39.876 33.648 1.00 0.00 C ATOM 625 O GLY A 43 36.027 41.023 33.600 1.00 0.00 O ATOM 0 H GLY A 43 35.158 37.171 33.675 1.00 0.00 H new ATOM 0 HA2 GLY A 43 37.188 38.523 33.250 1.00 0.00 H new ATOM 0 HA3 GLY A 43 36.385 39.121 31.812 1.00 0.00 H new ATOM 629 N SER A 44 34.527 39.552 34.406 1.00 0.00 N ATOM 630 CA SER A 44 33.897 40.424 35.397 1.00 0.00 C ATOM 631 C SER A 44 34.796 40.529 36.635 1.00 0.00 C ATOM 632 O SER A 44 35.253 39.514 37.169 1.00 0.00 O ATOM 633 CB SER A 44 32.524 39.845 35.750 1.00 0.00 C ATOM 634 OG SER A 44 31.688 39.856 34.608 1.00 0.00 O ATOM 0 H SER A 44 34.077 38.639 34.345 1.00 0.00 H new ATOM 0 HA SER A 44 33.763 41.429 34.997 1.00 0.00 H new ATOM 0 HB2 SER A 44 32.634 38.826 36.121 1.00 0.00 H new ATOM 0 HB3 SER A 44 32.069 40.428 36.550 1.00 0.00 H new ATOM 0 HG SER A 44 30.827 40.263 34.837 1.00 0.00 H new ATOM 640 N CYS A 45 35.068 41.747 37.108 1.00 0.00 N ATOM 641 CA CYS A 45 36.063 42.021 38.151 1.00 0.00 C ATOM 642 C CYS A 45 35.798 41.312 39.501 1.00 0.00 C ATOM 643 O CYS A 45 36.757 41.003 40.219 1.00 0.00 O ATOM 644 CB CYS A 45 36.157 43.544 38.308 1.00 0.00 C ATOM 645 SG CYS A 45 37.663 43.989 39.218 1.00 0.00 S ATOM 0 H CYS A 45 34.596 42.586 36.772 1.00 0.00 H new ATOM 0 HA CYS A 45 37.016 41.600 37.832 1.00 0.00 H new ATOM 0 HB2 CYS A 45 36.163 44.018 37.327 1.00 0.00 H new ATOM 0 HB3 CYS A 45 35.280 43.917 38.837 1.00 0.00 H new ATOM 0 HG CYS A 45 37.974 43.029 40.038 1.00 0.00 H new ATOM 651 N ALA A 46 34.533 41.010 39.824 1.00 0.00 N ATOM 652 CA ALA A 46 34.101 40.202 40.975 1.00 0.00 C ATOM 653 C ALA A 46 33.448 38.844 40.595 1.00 0.00 C ATOM 654 O ALA A 46 32.815 38.200 41.443 1.00 0.00 O ATOM 655 CB ALA A 46 33.194 41.082 41.846 1.00 0.00 C ATOM 0 H ALA A 46 33.746 41.337 39.264 1.00 0.00 H new ATOM 0 HA ALA A 46 34.982 39.897 41.539 1.00 0.00 H new ATOM 0 HB1 ALA A 46 32.855 40.511 42.711 1.00 0.00 H new ATOM 0 HB2 ALA A 46 33.751 41.956 42.183 1.00 0.00 H new ATOM 0 HB3 ALA A 46 32.331 41.404 41.263 1.00 0.00 H new ATOM 661 N CYS A 47 33.595 38.415 39.333 1.00 0.00 N ATOM 662 CA CYS A 47 32.794 37.375 38.666 1.00 0.00 C ATOM 663 C CYS A 47 31.277 37.695 38.590 1.00 0.00 C ATOM 664 O CYS A 47 30.786 38.614 39.252 1.00 0.00 O ATOM 665 CB CYS A 47 33.143 35.981 39.216 1.00 0.00 C ATOM 666 SG CYS A 47 34.092 34.899 38.120 1.00 0.00 S ATOM 0 H CYS A 47 34.311 38.802 38.718 1.00 0.00 H new ATOM 0 HA CYS A 47 33.079 37.366 37.614 1.00 0.00 H new ATOM 0 HB2 CYS A 47 33.706 36.109 40.141 1.00 0.00 H new ATOM 0 HB3 CYS A 47 32.214 35.474 39.476 1.00 0.00 H new ATOM 671 N SER A 48 30.537 36.994 37.724 1.00 0.00 N ATOM 672 CA SER A 48 29.108 37.240 37.451 1.00 0.00 C ATOM 673 C SER A 48 28.301 35.928 37.342 1.00 0.00 C ATOM 674 O SER A 48 28.739 34.881 37.808 1.00 0.00 O ATOM 675 CB SER A 48 28.985 38.157 36.226 1.00 0.00 C ATOM 676 OG SER A 48 27.671 38.675 36.104 1.00 0.00 O ATOM 0 H SER A 48 30.919 36.221 37.179 1.00 0.00 H new ATOM 0 HA SER A 48 28.656 37.758 38.296 1.00 0.00 H new ATOM 0 HB2 SER A 48 29.696 38.979 36.310 1.00 0.00 H new ATOM 0 HB3 SER A 48 29.245 37.602 35.325 1.00 0.00 H new ATOM 0 HG SER A 48 27.620 39.257 35.317 1.00 0.00 H new ATOM 682 N THR A 49 27.081 35.970 36.802 1.00 0.00 N ATOM 683 CA THR A 49 26.065 34.901 36.908 1.00 0.00 C ATOM 684 C THR A 49 26.265 33.672 36.006 1.00 0.00 C ATOM 685 O THR A 49 25.494 32.725 36.126 1.00 0.00 O ATOM 686 CB THR A 49 24.651 35.468 36.711 1.00 0.00 C ATOM 687 OG1 THR A 49 24.538 36.133 35.469 1.00 0.00 O ATOM 688 CG2 THR A 49 24.276 36.482 37.790 1.00 0.00 C ATOM 0 H THR A 49 26.755 36.771 36.260 1.00 0.00 H new ATOM 0 HA THR A 49 26.198 34.524 37.922 1.00 0.00 H new ATOM 0 HB THR A 49 23.983 34.608 36.761 1.00 0.00 H new ATOM 0 HG1 THR A 49 23.658 35.949 35.078 1.00 0.00 H new ATOM 0 HG21 THR A 49 23.268 36.853 37.606 1.00 0.00 H new ATOM 0 HG22 THR A 49 24.313 36.003 38.768 1.00 0.00 H new ATOM 0 HG23 THR A 49 24.979 37.315 37.767 1.00 0.00 H new ATOM 696 N CYS A 50 27.271 33.660 35.124 1.00 0.00 N ATOM 697 CA CYS A 50 27.839 32.465 34.472 1.00 0.00 C ATOM 698 C CYS A 50 26.806 31.441 33.946 1.00 0.00 C ATOM 699 O CYS A 50 26.628 30.357 34.505 1.00 0.00 O ATOM 700 CB CYS A 50 28.841 31.843 35.449 1.00 0.00 C ATOM 701 SG CYS A 50 30.187 30.844 34.777 1.00 0.00 S ATOM 0 H CYS A 50 27.735 34.519 34.829 1.00 0.00 H new ATOM 0 HA CYS A 50 28.333 32.785 33.555 1.00 0.00 H new ATOM 0 HB2 CYS A 50 29.285 32.652 36.029 1.00 0.00 H new ATOM 0 HB3 CYS A 50 28.282 31.220 36.147 1.00 0.00 H new ATOM 706 N HIS A 51 26.111 31.771 32.851 1.00 0.00 N ATOM 707 CA HIS A 51 24.914 31.048 32.414 1.00 0.00 C ATOM 708 C HIS A 51 25.294 29.927 31.425 1.00 0.00 C ATOM 709 O HIS A 51 25.507 30.170 30.236 1.00 0.00 O ATOM 710 CB HIS A 51 23.928 32.026 31.732 1.00 0.00 C ATOM 711 CG HIS A 51 23.486 33.261 32.489 1.00 0.00 C ATOM 712 ND1 HIS A 51 23.242 34.489 31.912 1.00 0.00 N ATOM 713 CD2 HIS A 51 23.115 33.363 33.805 1.00 0.00 C ATOM 714 CE1 HIS A 51 22.731 35.307 32.843 1.00 0.00 C ATOM 715 NE2 HIS A 51 22.643 34.670 34.027 1.00 0.00 N ATOM 0 H HIS A 51 26.365 32.549 32.242 1.00 0.00 H new ATOM 0 HA HIS A 51 24.439 30.603 33.288 1.00 0.00 H new ATOM 0 HB2 HIS A 51 24.383 32.356 30.798 1.00 0.00 H new ATOM 0 HB3 HIS A 51 23.033 31.462 31.468 1.00 0.00 H new ATOM 0 HD1 HIS A 51 23.421 34.734 30.938 1.00 0.00 H new ATOM 0 HD2 HIS A 51 23.175 32.577 34.543 1.00 0.00 H new ATOM 0 HE1 HIS A 51 22.433 36.330 32.669 1.00 0.00 H new ATOM 723 N VAL A 52 25.342 28.682 31.905 1.00 0.00 N ATOM 724 CA VAL A 52 25.408 27.459 31.091 1.00 0.00 C ATOM 725 C VAL A 52 24.584 26.314 31.656 1.00 0.00 C ATOM 726 O VAL A 52 24.318 26.197 32.850 1.00 0.00 O ATOM 727 CB VAL A 52 26.836 26.934 30.789 1.00 0.00 C ATOM 728 CG1 VAL A 52 27.288 27.311 29.389 1.00 0.00 C ATOM 729 CG2 VAL A 52 27.929 27.419 31.745 1.00 0.00 C ATOM 0 H VAL A 52 25.336 28.488 32.906 1.00 0.00 H new ATOM 0 HA VAL A 52 24.977 27.795 30.148 1.00 0.00 H new ATOM 0 HB VAL A 52 26.728 25.856 30.911 1.00 0.00 H new ATOM 0 HG11 VAL A 52 28.293 26.926 29.215 1.00 0.00 H new ATOM 0 HG12 VAL A 52 26.603 26.882 28.658 1.00 0.00 H new ATOM 0 HG13 VAL A 52 27.293 28.396 29.288 1.00 0.00 H new ATOM 0 HG21 VAL A 52 28.888 26.995 31.447 1.00 0.00 H new ATOM 0 HG22 VAL A 52 27.987 28.507 31.710 1.00 0.00 H new ATOM 0 HG23 VAL A 52 27.692 27.101 32.760 1.00 0.00 H new ATOM 739 N ILE A 53 24.237 25.407 30.761 1.00 0.00 N ATOM 740 CA ILE A 53 23.750 24.073 31.031 1.00 0.00 C ATOM 741 C ILE A 53 24.437 23.111 30.058 1.00 0.00 C ATOM 742 O ILE A 53 24.683 23.453 28.913 1.00 0.00 O ATOM 743 CB ILE A 53 22.217 24.098 30.962 1.00 0.00 C ATOM 744 CG1 ILE A 53 21.727 22.682 31.292 1.00 0.00 C ATOM 745 CG2 ILE A 53 21.700 24.680 29.633 1.00 0.00 C ATOM 746 CD1 ILE A 53 20.560 22.204 30.487 1.00 0.00 C ATOM 0 H ILE A 53 24.293 25.599 29.761 1.00 0.00 H new ATOM 0 HA ILE A 53 23.996 23.715 32.031 1.00 0.00 H new ATOM 0 HB ILE A 53 21.797 24.783 31.698 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.554 21.987 31.150 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.458 22.645 32.348 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.610 24.676 29.634 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.059 25.703 29.520 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.065 24.074 28.804 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.293 21.194 30.798 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.711 22.869 30.646 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.824 22.200 29.430 1.00 0.00 H new ATOM 758 N VAL A 54 24.747 21.904 30.507 1.00 0.00 N ATOM 759 CA VAL A 54 25.402 20.843 29.752 1.00 0.00 C ATOM 760 C VAL A 54 24.425 19.815 29.181 1.00 0.00 C ATOM 761 O VAL A 54 23.248 19.737 29.544 1.00 0.00 O ATOM 762 CB VAL A 54 26.520 20.260 30.630 1.00 0.00 C ATOM 763 CG1 VAL A 54 26.029 19.257 31.599 1.00 0.00 C ATOM 764 CG2 VAL A 54 27.676 19.579 29.887 1.00 0.00 C ATOM 0 H VAL A 54 24.536 21.621 31.464 1.00 0.00 H new ATOM 0 HA VAL A 54 25.857 21.251 28.850 1.00 0.00 H new ATOM 0 HB VAL A 54 26.891 21.162 31.116 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.865 18.882 32.190 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.295 19.718 32.260 1.00 0.00 H new ATOM 0 HG13 VAL A 54 25.564 18.430 31.062 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.403 19.207 30.609 1.00 0.00 H new ATOM 0 HG22 VAL A 54 27.290 18.747 29.299 1.00 0.00 H new ATOM 0 HG23 VAL A 54 28.157 20.299 29.225 1.00 0.00 H new ATOM 774 N ASP A 55 24.936 19.056 28.228 1.00 0.00 N ATOM 775 CA ASP A 55 24.371 17.841 27.664 1.00 0.00 C ATOM 776 C ASP A 55 23.938 16.777 28.719 1.00 0.00 C ATOM 777 O ASP A 55 24.285 16.871 29.896 1.00 0.00 O ATOM 778 CB ASP A 55 25.498 17.306 26.773 1.00 0.00 C ATOM 779 CG ASP A 55 26.324 16.250 27.447 1.00 0.00 C ATOM 780 OD1 ASP A 55 26.942 16.537 28.485 1.00 0.00 O ATOM 781 OD2 ASP A 55 26.325 15.121 26.912 1.00 0.00 O ATOM 0 H ASP A 55 25.828 19.292 27.793 1.00 0.00 H new ATOM 0 HA ASP A 55 23.443 18.055 27.134 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.068 16.896 25.859 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.144 18.133 26.478 1.00 0.00 H new ATOM 786 N PRO A 56 23.193 15.726 28.336 1.00 0.00 N ATOM 787 CA PRO A 56 22.834 14.650 29.262 1.00 0.00 C ATOM 788 C PRO A 56 23.990 13.680 29.596 1.00 0.00 C ATOM 789 O PRO A 56 23.923 13.003 30.621 1.00 0.00 O ATOM 790 CB PRO A 56 21.677 13.930 28.563 1.00 0.00 C ATOM 791 CG PRO A 56 21.979 14.112 27.077 1.00 0.00 C ATOM 792 CD PRO A 56 22.608 15.503 27.022 1.00 0.00 C ATOM 0 HA PRO A 56 22.568 15.056 30.238 1.00 0.00 H new ATOM 0 HB2 PRO A 56 21.638 12.876 28.837 1.00 0.00 H new ATOM 0 HB3 PRO A 56 20.714 14.365 28.832 1.00 0.00 H new ATOM 0 HG2 PRO A 56 22.660 13.346 26.707 1.00 0.00 H new ATOM 0 HG3 PRO A 56 21.075 14.054 26.471 1.00 0.00 H new ATOM 0 HD2 PRO A 56 23.367 15.558 26.242 1.00 0.00 H new ATOM 0 HD3 PRO A 56 21.860 16.262 26.793 1.00 0.00 H new ATOM 800 N ASP A 57 25.002 13.546 28.735 1.00 0.00 N ATOM 801 CA ASP A 57 26.069 12.534 28.791 1.00 0.00 C ATOM 802 C ASP A 57 27.360 12.943 29.514 1.00 0.00 C ATOM 803 O ASP A 57 27.895 12.149 30.301 1.00 0.00 O ATOM 804 CB ASP A 57 26.425 12.093 27.363 1.00 0.00 C ATOM 805 CG ASP A 57 26.410 10.578 27.202 1.00 0.00 C ATOM 806 OD1 ASP A 57 27.297 9.884 27.754 1.00 0.00 O ATOM 807 OD2 ASP A 57 25.525 10.059 26.481 1.00 0.00 O ATOM 0 H ASP A 57 25.108 14.172 27.937 1.00 0.00 H new ATOM 0 HA ASP A 57 25.649 11.727 29.392 1.00 0.00 H new ATOM 0 HB2 ASP A 57 25.718 12.537 26.662 1.00 0.00 H new ATOM 0 HB3 ASP A 57 27.413 12.473 27.104 1.00 0.00 H new ATOM 812 N TYR A 58 27.912 14.135 29.246 1.00 0.00 N ATOM 813 CA TYR A 58 29.212 14.534 29.757 1.00 0.00 C ATOM 814 C TYR A 58 29.110 15.150 31.158 1.00 0.00 C ATOM 815 O TYR A 58 30.015 14.901 31.956 1.00 0.00 O ATOM 816 CB TYR A 58 29.888 15.461 28.746 1.00 0.00 C ATOM 817 CG TYR A 58 30.128 14.894 27.358 1.00 0.00 C ATOM 818 CD1 TYR A 58 31.161 13.969 27.102 1.00 0.00 C ATOM 819 CD2 TYR A 58 29.342 15.356 26.296 1.00 0.00 C ATOM 820 CE1 TYR A 58 31.395 13.524 25.782 1.00 0.00 C ATOM 821 CE2 TYR A 58 29.564 14.924 24.984 1.00 0.00 C ATOM 822 CZ TYR A 58 30.601 14.007 24.717 1.00 0.00 C ATOM 823 OH TYR A 58 30.814 13.598 23.438 1.00 0.00 O ATOM 0 H TYR A 58 27.461 14.844 28.667 1.00 0.00 H new ATOM 0 HA TYR A 58 29.838 13.650 29.877 1.00 0.00 H new ATOM 0 HB2 TYR A 58 29.278 16.359 28.646 1.00 0.00 H new ATOM 0 HB3 TYR A 58 30.848 15.772 29.158 1.00 0.00 H new ATOM 0 HD1 TYR A 58 31.772 13.602 27.913 1.00 0.00 H new ATOM 0 HD2 TYR A 58 28.548 16.061 26.493 1.00 0.00 H new ATOM 0 HE1 TYR A 58 32.183 12.812 25.586 1.00 0.00 H new ATOM 0 HE2 TYR A 58 28.944 15.291 24.180 1.00 0.00 H new ATOM 0 HH TYR A 58 30.170 14.036 22.843 1.00 0.00 H new ATOM 833 N TYR A 59 27.988 15.819 31.506 1.00 0.00 N ATOM 834 CA TYR A 59 27.625 16.170 32.907 1.00 0.00 C ATOM 835 C TYR A 59 27.743 14.983 33.844 1.00 0.00 C ATOM 836 O TYR A 59 27.975 15.115 35.042 1.00 0.00 O ATOM 837 CB TYR A 59 26.126 16.435 33.081 1.00 0.00 C ATOM 838 CG TYR A 59 25.744 17.232 34.338 1.00 0.00 C ATOM 839 CD1 TYR A 59 26.253 18.523 34.561 1.00 0.00 C ATOM 840 CD2 TYR A 59 24.872 16.699 35.306 1.00 0.00 C ATOM 841 CE1 TYR A 59 25.840 19.313 35.632 1.00 0.00 C ATOM 842 CE2 TYR A 59 24.509 17.452 36.443 1.00 0.00 C ATOM 843 CZ TYR A 59 24.965 18.780 36.599 1.00 0.00 C ATOM 844 OH TYR A 59 24.493 19.567 37.601 1.00 0.00 O ATOM 0 H TYR A 59 27.301 16.135 30.821 1.00 0.00 H new ATOM 0 HA TYR A 59 28.281 17.015 33.116 1.00 0.00 H new ATOM 0 HB2 TYR A 59 25.764 16.974 32.205 1.00 0.00 H new ATOM 0 HB3 TYR A 59 25.605 15.478 33.105 1.00 0.00 H new ATOM 0 HD1 TYR A 59 26.991 18.917 33.878 1.00 0.00 H new ATOM 0 HD2 TYR A 59 24.476 15.702 35.177 1.00 0.00 H new ATOM 0 HE1 TYR A 59 26.190 20.331 35.721 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.878 17.010 37.200 1.00 0.00 H new ATOM 0 HH TYR A 59 24.535 20.507 37.326 1.00 0.00 H new ATOM 854 N ASP A 60 27.407 13.814 33.309 1.00 0.00 N ATOM 855 CA ASP A 60 26.840 12.732 34.100 1.00 0.00 C ATOM 856 C ASP A 60 27.917 12.027 34.943 1.00 0.00 C ATOM 857 O ASP A 60 27.644 11.140 35.752 1.00 0.00 O ATOM 858 CB ASP A 60 26.177 11.786 33.108 1.00 0.00 C ATOM 859 CG ASP A 60 25.153 10.838 33.724 1.00 0.00 C ATOM 860 OD1 ASP A 60 24.086 11.313 34.188 1.00 0.00 O ATOM 861 OD2 ASP A 60 25.385 9.605 33.682 1.00 0.00 O ATOM 0 H ASP A 60 27.520 13.592 32.320 1.00 0.00 H new ATOM 0 HA ASP A 60 26.112 13.106 34.820 1.00 0.00 H new ATOM 0 HB2 ASP A 60 25.687 12.377 32.334 1.00 0.00 H new ATOM 0 HB3 ASP A 60 26.950 11.195 32.616 1.00 0.00 H new ATOM 866 N ALA A 61 29.157 12.455 34.697 1.00 0.00 N ATOM 867 CA ALA A 61 30.400 12.016 35.312 1.00 0.00 C ATOM 868 C ALA A 61 31.128 13.168 36.036 1.00 0.00 C ATOM 869 O ALA A 61 32.101 12.914 36.752 1.00 0.00 O ATOM 870 CB ALA A 61 31.255 11.413 34.189 1.00 0.00 C ATOM 0 H ALA A 61 29.326 13.181 34.001 1.00 0.00 H new ATOM 0 HA ALA A 61 30.203 11.275 36.087 1.00 0.00 H new ATOM 0 HB1 ALA A 61 32.203 11.067 34.600 1.00 0.00 H new ATOM 0 HB2 ALA A 61 30.726 10.573 33.740 1.00 0.00 H new ATOM 0 HB3 ALA A 61 31.444 12.171 33.429 1.00 0.00 H new ATOM 876 N LEU A 62 30.655 14.411 35.865 1.00 0.00 N ATOM 877 CA LEU A 62 31.332 15.654 36.274 1.00 0.00 C ATOM 878 C LEU A 62 31.577 15.795 37.795 1.00 0.00 C ATOM 879 O LEU A 62 30.745 15.357 38.602 1.00 0.00 O ATOM 880 CB LEU A 62 30.515 16.868 35.766 1.00 0.00 C ATOM 881 CG LEU A 62 30.670 17.242 34.292 1.00 0.00 C ATOM 882 CD1 LEU A 62 29.980 18.589 34.068 1.00 0.00 C ATOM 883 CD2 LEU A 62 32.110 17.397 33.830 1.00 0.00 C ATOM 0 H LEU A 62 29.754 14.587 35.420 1.00 0.00 H new ATOM 0 HA LEU A 62 32.323 15.617 35.822 1.00 0.00 H new ATOM 0 HB2 LEU A 62 29.460 16.670 35.956 1.00 0.00 H new ATOM 0 HB3 LEU A 62 30.789 17.736 36.366 1.00 0.00 H new ATOM 0 HG LEU A 62 30.232 16.423 33.721 1.00 0.00 H new ATOM 0 HD11 LEU A 62 30.077 18.878 33.021 1.00 0.00 H new ATOM 0 HD12 LEU A 62 28.924 18.504 34.324 1.00 0.00 H new ATOM 0 HD13 LEU A 62 30.447 19.346 34.698 1.00 0.00 H new ATOM 0 HD21 LEU A 62 32.126 17.663 32.773 1.00 0.00 H new ATOM 0 HD22 LEU A 62 32.595 18.183 34.409 1.00 0.00 H new ATOM 0 HD23 LEU A 62 32.642 16.457 33.976 1.00 0.00 H new ATOM 895 N PRO A 63 32.669 16.479 38.192 1.00 0.00 N ATOM 896 CA PRO A 63 32.877 16.981 39.549 1.00 0.00 C ATOM 897 C PRO A 63 31.964 18.182 39.857 1.00 0.00 C ATOM 898 O PRO A 63 31.478 18.863 38.948 1.00 0.00 O ATOM 899 CB PRO A 63 34.360 17.355 39.615 1.00 0.00 C ATOM 900 CG PRO A 63 34.658 17.808 38.189 1.00 0.00 C ATOM 901 CD PRO A 63 33.783 16.889 37.345 1.00 0.00 C ATOM 0 HA PRO A 63 32.621 16.234 40.301 1.00 0.00 H new ATOM 0 HB2 PRO A 63 34.545 18.149 40.339 1.00 0.00 H new ATOM 0 HB3 PRO A 63 34.979 16.506 39.907 1.00 0.00 H new ATOM 0 HG2 PRO A 63 34.404 18.857 38.038 1.00 0.00 H new ATOM 0 HG3 PRO A 63 35.714 17.697 37.943 1.00 0.00 H new ATOM 0 HD2 PRO A 63 33.423 17.406 36.456 1.00 0.00 H new ATOM 0 HD3 PRO A 63 34.349 16.022 37.003 1.00 0.00 H new ATOM 909 N GLU A 64 31.712 18.441 41.140 1.00 0.00 N ATOM 910 CA GLU A 64 30.891 19.551 41.658 1.00 0.00 C ATOM 911 C GLU A 64 31.732 20.826 41.904 1.00 0.00 C ATOM 912 O GLU A 64 32.930 20.707 42.201 1.00 0.00 O ATOM 913 CB GLU A 64 30.194 19.111 42.961 1.00 0.00 C ATOM 914 CG GLU A 64 29.148 17.993 42.783 1.00 0.00 C ATOM 915 CD GLU A 64 27.710 18.516 42.891 1.00 0.00 C ATOM 916 OE1 GLU A 64 27.188 19.063 41.892 1.00 0.00 O ATOM 917 OE2 GLU A 64 27.088 18.404 43.977 1.00 0.00 O ATOM 0 H GLU A 64 32.090 17.859 41.887 1.00 0.00 H new ATOM 0 HA GLU A 64 30.143 19.798 40.905 1.00 0.00 H new ATOM 0 HB2 GLU A 64 30.952 18.772 43.667 1.00 0.00 H new ATOM 0 HB3 GLU A 64 29.707 19.978 43.408 1.00 0.00 H new ATOM 0 HG2 GLU A 64 29.288 17.520 41.811 1.00 0.00 H new ATOM 0 HG3 GLU A 64 29.310 17.224 43.538 1.00 0.00 H new ATOM 924 N PRO A 65 31.155 22.047 41.823 1.00 0.00 N ATOM 925 CA PRO A 65 31.876 23.294 42.097 1.00 0.00 C ATOM 926 C PRO A 65 31.962 23.623 43.598 1.00 0.00 C ATOM 927 O PRO A 65 31.284 22.996 44.419 1.00 0.00 O ATOM 928 CB PRO A 65 31.126 24.381 41.317 1.00 0.00 C ATOM 929 CG PRO A 65 30.189 23.623 40.381 1.00 0.00 C ATOM 930 CD PRO A 65 29.870 22.416 41.241 1.00 0.00 C ATOM 0 HA PRO A 65 32.916 23.213 41.782 1.00 0.00 H new ATOM 0 HB2 PRO A 65 30.569 25.035 41.988 1.00 0.00 H new ATOM 0 HB3 PRO A 65 31.816 25.012 40.758 1.00 0.00 H new ATOM 0 HG2 PRO A 65 29.299 24.199 40.127 1.00 0.00 H new ATOM 0 HG3 PRO A 65 30.671 23.349 39.442 1.00 0.00 H new ATOM 0 HD2 PRO A 65 29.138 22.657 42.011 1.00 0.00 H new ATOM 0 HD3 PRO A 65 29.452 21.603 40.648 1.00 0.00 H new ATOM 938 N GLU A 66 32.756 24.631 43.963 1.00 0.00 N ATOM 939 CA GLU A 66 32.824 25.190 45.327 1.00 0.00 C ATOM 940 C GLU A 66 31.511 25.860 45.781 1.00 0.00 C ATOM 941 O GLU A 66 30.648 26.193 44.972 1.00 0.00 O ATOM 942 CB GLU A 66 33.957 26.226 45.406 1.00 0.00 C ATOM 943 CG GLU A 66 35.344 25.614 45.193 1.00 0.00 C ATOM 944 CD GLU A 66 36.458 26.657 45.323 1.00 0.00 C ATOM 945 OE1 GLU A 66 36.295 27.820 44.885 1.00 0.00 O ATOM 946 OE2 GLU A 66 37.542 26.318 45.854 1.00 0.00 O ATOM 0 H GLU A 66 33.386 25.096 43.309 1.00 0.00 H new ATOM 0 HA GLU A 66 33.009 24.348 45.995 1.00 0.00 H new ATOM 0 HB2 GLU A 66 33.788 26.999 44.656 1.00 0.00 H new ATOM 0 HB3 GLU A 66 33.927 26.715 46.380 1.00 0.00 H new ATOM 0 HG2 GLU A 66 35.505 24.819 45.921 1.00 0.00 H new ATOM 0 HG3 GLU A 66 35.390 25.156 44.205 1.00 0.00 H new ATOM 953 N ASP A 67 31.394 26.151 47.080 1.00 0.00 N ATOM 954 CA ASP A 67 30.289 26.903 47.702 1.00 0.00 C ATOM 955 C ASP A 67 30.170 28.377 47.236 1.00 0.00 C ATOM 956 O ASP A 67 29.142 29.017 47.451 1.00 0.00 O ATOM 957 CB ASP A 67 30.452 26.793 49.226 1.00 0.00 C ATOM 958 CG ASP A 67 29.339 27.490 50.004 1.00 0.00 C ATOM 959 OD1 ASP A 67 28.198 26.971 50.013 1.00 0.00 O ATOM 960 OD2 ASP A 67 29.610 28.527 50.655 1.00 0.00 O ATOM 0 H ASP A 67 32.095 25.858 47.760 1.00 0.00 H new ATOM 0 HA ASP A 67 29.349 26.458 47.377 1.00 0.00 H new ATOM 0 HB2 ASP A 67 30.478 25.740 49.507 1.00 0.00 H new ATOM 0 HB3 ASP A 67 31.411 27.223 49.514 1.00 0.00 H new ATOM 965 N ASP A 68 31.211 28.939 46.616 1.00 0.00 N ATOM 966 CA ASP A 68 31.164 30.217 45.883 1.00 0.00 C ATOM 967 C ASP A 68 30.633 30.039 44.462 1.00 0.00 C ATOM 968 O ASP A 68 29.929 30.904 43.953 1.00 0.00 O ATOM 969 CB ASP A 68 32.582 30.805 45.885 1.00 0.00 C ATOM 970 CG ASP A 68 32.705 32.198 45.262 1.00 0.00 C ATOM 971 OD1 ASP A 68 31.865 33.078 45.567 1.00 0.00 O ATOM 972 OD2 ASP A 68 33.719 32.444 44.564 1.00 0.00 O ATOM 0 H ASP A 68 32.136 28.510 46.607 1.00 0.00 H new ATOM 0 HA ASP A 68 30.472 30.901 46.375 1.00 0.00 H new ATOM 0 HB2 ASP A 68 32.939 30.851 46.914 1.00 0.00 H new ATOM 0 HB3 ASP A 68 33.242 30.124 45.349 1.00 0.00 H new ATOM 977 N GLU A 69 30.932 28.902 43.843 1.00 0.00 N ATOM 978 CA GLU A 69 30.695 28.622 42.429 1.00 0.00 C ATOM 979 C GLU A 69 29.272 28.069 42.214 1.00 0.00 C ATOM 980 O GLU A 69 28.496 28.635 41.450 1.00 0.00 O ATOM 981 CB GLU A 69 31.802 27.656 41.975 1.00 0.00 C ATOM 982 CG GLU A 69 33.200 28.290 42.047 1.00 0.00 C ATOM 983 CD GLU A 69 34.309 27.345 41.569 1.00 0.00 C ATOM 984 OE1 GLU A 69 34.316 26.149 41.940 1.00 0.00 O ATOM 985 OE2 GLU A 69 35.176 27.814 40.783 1.00 0.00 O ATOM 0 H GLU A 69 31.364 28.118 44.332 1.00 0.00 H new ATOM 0 HA GLU A 69 30.741 29.526 41.822 1.00 0.00 H new ATOM 0 HB2 GLU A 69 31.779 26.763 42.599 1.00 0.00 H new ATOM 0 HB3 GLU A 69 31.604 27.336 40.952 1.00 0.00 H new ATOM 0 HG2 GLU A 69 33.215 29.195 41.440 1.00 0.00 H new ATOM 0 HG3 GLU A 69 33.404 28.591 43.074 1.00 0.00 H new ATOM 992 N ASN A 70 28.848 27.056 42.981 1.00 0.00 N ATOM 993 CA ASN A 70 27.458 26.574 43.046 1.00 0.00 C ATOM 994 C ASN A 70 26.412 27.624 43.463 1.00 0.00 C ATOM 995 O ASN A 70 25.211 27.404 43.303 1.00 0.00 O ATOM 996 CB ASN A 70 27.401 25.273 43.867 1.00 0.00 C ATOM 997 CG ASN A 70 27.400 25.393 45.388 1.00 0.00 C ATOM 998 OD1 ASN A 70 26.931 26.349 45.996 1.00 0.00 O ATOM 999 ND2 ASN A 70 27.831 24.360 46.069 1.00 0.00 N ATOM 0 H ASN A 70 29.477 26.534 43.590 1.00 0.00 H new ATOM 0 HA ASN A 70 27.152 26.353 42.023 1.00 0.00 H new ATOM 0 HB2 ASN A 70 26.503 24.730 43.573 1.00 0.00 H new ATOM 0 HB3 ASN A 70 28.254 24.658 43.580 1.00 0.00 H new ATOM 0 HD21 ASN A 70 27.773 24.360 47.087 1.00 0.00 H new ATOM 0 HD22 ASN A 70 28.224 23.555 45.581 1.00 0.00 H new ATOM 1006 N ASP A 71 26.869 28.749 44.003 1.00 0.00 N ATOM 1007 CA ASP A 71 26.037 29.915 44.319 1.00 0.00 C ATOM 1008 C ASP A 71 25.851 30.843 43.106 1.00 0.00 C ATOM 1009 O ASP A 71 24.749 31.348 42.939 1.00 0.00 O ATOM 1010 CB ASP A 71 26.582 30.662 45.550 1.00 0.00 C ATOM 1011 CG ASP A 71 25.481 31.405 46.322 1.00 0.00 C ATOM 1012 OD1 ASP A 71 24.588 30.729 46.891 1.00 0.00 O ATOM 1013 OD2 ASP A 71 25.530 32.649 46.469 1.00 0.00 O ATOM 0 H ASP A 71 27.852 28.883 44.241 1.00 0.00 H new ATOM 0 HA ASP A 71 25.042 29.550 44.573 1.00 0.00 H new ATOM 0 HB2 ASP A 71 27.071 29.951 46.215 1.00 0.00 H new ATOM 0 HB3 ASP A 71 27.342 31.375 45.231 1.00 0.00 H new ATOM 1018 N MET A 72 26.850 30.986 42.212 1.00 0.00 N ATOM 1019 CA MET A 72 26.742 31.743 40.939 1.00 0.00 C ATOM 1020 C MET A 72 25.646 31.165 40.023 1.00 0.00 C ATOM 1021 O MET A 72 24.995 31.893 39.273 1.00 0.00 O ATOM 1022 CB MET A 72 28.068 31.735 40.161 1.00 0.00 C ATOM 1023 CG MET A 72 29.305 32.205 40.932 1.00 0.00 C ATOM 1024 SD MET A 72 29.389 33.971 41.324 1.00 0.00 S ATOM 1025 CE MET A 72 31.143 34.031 41.783 1.00 0.00 C ATOM 0 H MET A 72 27.772 30.573 42.353 1.00 0.00 H new ATOM 0 HA MET A 72 26.485 32.765 41.218 1.00 0.00 H new ATOM 0 HB2 MET A 72 28.251 30.721 39.805 1.00 0.00 H new ATOM 0 HB3 MET A 72 27.953 32.366 39.280 1.00 0.00 H new ATOM 0 HG2 MET A 72 29.358 31.645 41.866 1.00 0.00 H new ATOM 0 HG3 MET A 72 30.189 31.942 40.352 1.00 0.00 H new ATOM 0 HE1 MET A 72 31.411 35.049 42.065 1.00 0.00 H new ATOM 0 HE2 MET A 72 31.322 33.362 42.625 1.00 0.00 H new ATOM 0 HE3 MET A 72 31.752 33.717 40.935 1.00 0.00 H new ATOM 1035 N LEU A 73 25.417 29.849 40.122 1.00 0.00 N ATOM 1036 CA LEU A 73 24.359 29.100 39.463 1.00 0.00 C ATOM 1037 C LEU A 73 22.994 29.616 39.936 1.00 0.00 C ATOM 1038 O LEU A 73 22.262 30.255 39.190 1.00 0.00 O ATOM 1039 CB LEU A 73 24.528 27.613 39.878 1.00 0.00 C ATOM 1040 CG LEU A 73 25.828 26.915 39.490 1.00 0.00 C ATOM 1041 CD1 LEU A 73 25.747 25.452 39.925 1.00 0.00 C ATOM 1042 CD2 LEU A 73 25.998 26.916 37.977 1.00 0.00 C ATOM 0 H LEU A 73 26.005 29.250 40.701 1.00 0.00 H new ATOM 0 HA LEU A 73 24.415 29.212 38.380 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.425 27.553 40.961 1.00 0.00 H new ATOM 0 HB3 LEU A 73 23.702 27.048 39.447 1.00 0.00 H new ATOM 0 HG LEU A 73 26.658 27.437 39.966 1.00 0.00 H new ATOM 0 HD11 LEU A 73 26.670 24.940 39.654 1.00 0.00 H new ATOM 0 HD12 LEU A 73 25.607 25.401 41.005 1.00 0.00 H new ATOM 0 HD13 LEU A 73 24.905 24.970 39.427 1.00 0.00 H new ATOM 0 HD21 LEU A 73 26.930 26.415 37.715 1.00 0.00 H new ATOM 0 HD22 LEU A 73 25.161 26.390 37.517 1.00 0.00 H new ATOM 0 HD23 LEU A 73 26.025 27.944 37.615 1.00 0.00 H new ATOM 1054 N ASP A 74 22.737 29.405 41.225 1.00 0.00 N ATOM 1055 CA ASP A 74 21.567 29.759 42.039 1.00 0.00 C ATOM 1056 C ASP A 74 21.011 31.178 41.822 1.00 0.00 C ATOM 1057 O ASP A 74 19.825 31.413 42.071 1.00 0.00 O ATOM 1058 CB ASP A 74 22.001 29.646 43.516 1.00 0.00 C ATOM 1059 CG ASP A 74 20.926 29.161 44.490 1.00 0.00 C ATOM 1060 OD1 ASP A 74 19.809 28.769 44.077 1.00 0.00 O ATOM 1061 OD2 ASP A 74 21.219 29.145 45.710 1.00 0.00 O ATOM 0 H ASP A 74 23.429 28.922 41.798 1.00 0.00 H new ATOM 0 HA ASP A 74 20.766 29.080 41.747 1.00 0.00 H new ATOM 0 HB2 ASP A 74 22.851 28.966 43.574 1.00 0.00 H new ATOM 0 HB3 ASP A 74 22.351 30.623 43.848 1.00 0.00 H new ATOM 1066 N LEU A 75 21.846 32.111 41.354 1.00 0.00 N ATOM 1067 CA LEU A 75 21.469 33.479 40.994 1.00 0.00 C ATOM 1068 C LEU A 75 20.560 33.539 39.753 1.00 0.00 C ATOM 1069 O LEU A 75 19.770 34.478 39.619 1.00 0.00 O ATOM 1070 CB LEU A 75 22.749 34.297 40.737 1.00 0.00 C ATOM 1071 CG LEU A 75 23.835 34.240 41.826 1.00 0.00 C ATOM 1072 CD1 LEU A 75 24.877 35.333 41.610 1.00 0.00 C ATOM 1073 CD2 LEU A 75 23.307 34.323 43.260 1.00 0.00 C ATOM 0 H LEU A 75 22.839 31.926 41.211 1.00 0.00 H new ATOM 0 HA LEU A 75 20.900 33.896 41.825 1.00 0.00 H new ATOM 0 HB2 LEU A 75 23.189 33.956 39.800 1.00 0.00 H new ATOM 0 HB3 LEU A 75 22.464 35.339 40.595 1.00 0.00 H new ATOM 0 HG LEU A 75 24.284 33.253 41.719 1.00 0.00 H new ATOM 0 HD11 LEU A 75 25.634 35.273 42.392 1.00 0.00 H new ATOM 0 HD12 LEU A 75 25.349 35.199 40.637 1.00 0.00 H new ATOM 0 HD13 LEU A 75 24.393 36.309 41.647 1.00 0.00 H new ATOM 0 HD21 LEU A 75 24.142 34.275 43.959 1.00 0.00 H new ATOM 0 HD22 LEU A 75 22.773 35.263 43.397 1.00 0.00 H new ATOM 0 HD23 LEU A 75 22.629 33.490 43.447 1.00 0.00 H new ATOM 1085 N ALA A 76 20.645 32.559 38.849 1.00 0.00 N ATOM 1086 CA ALA A 76 19.713 32.400 37.727 1.00 0.00 C ATOM 1087 C ALA A 76 18.402 31.708 38.150 1.00 0.00 C ATOM 1088 O ALA A 76 18.311 31.099 39.222 1.00 0.00 O ATOM 1089 CB ALA A 76 20.417 31.647 36.594 1.00 0.00 C ATOM 0 H ALA A 76 21.372 31.844 38.875 1.00 0.00 H new ATOM 0 HA ALA A 76 19.423 33.389 37.371 1.00 0.00 H new ATOM 0 HB1 ALA A 76 19.730 31.525 35.756 1.00 0.00 H new ATOM 0 HB2 ALA A 76 21.290 32.213 36.268 1.00 0.00 H new ATOM 0 HB3 ALA A 76 20.733 30.666 36.950 1.00 0.00 H new ATOM 1095 N TYR A 77 17.370 31.811 37.312 1.00 0.00 N ATOM 1096 CA TYR A 77 16.069 31.173 37.523 1.00 0.00 C ATOM 1097 C TYR A 77 16.042 29.713 37.067 1.00 0.00 C ATOM 1098 O TYR A 77 16.671 29.350 36.068 1.00 0.00 O ATOM 1099 CB TYR A 77 14.998 31.973 36.773 1.00 0.00 C ATOM 1100 CG TYR A 77 13.589 31.428 36.864 1.00 0.00 C ATOM 1101 CD1 TYR A 77 12.865 31.548 38.063 1.00 0.00 C ATOM 1102 CD2 TYR A 77 13.004 30.797 35.750 1.00 0.00 C ATOM 1103 CE1 TYR A 77 11.555 31.042 38.149 1.00 0.00 C ATOM 1104 CE2 TYR A 77 11.688 30.306 35.828 1.00 0.00 C ATOM 1105 CZ TYR A 77 10.956 30.420 37.029 1.00 0.00 C ATOM 1106 OH TYR A 77 9.683 29.940 37.090 1.00 0.00 O ATOM 0 H TYR A 77 17.416 32.352 36.449 1.00 0.00 H new ATOM 0 HA TYR A 77 15.871 31.169 38.595 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.999 32.994 37.155 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.280 32.026 35.722 1.00 0.00 H new ATOM 0 HD1 TYR A 77 13.315 32.029 38.919 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.566 30.690 34.834 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.005 31.129 39.074 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.236 29.840 34.965 1.00 0.00 H new ATOM 0 HH TYR A 77 9.440 29.547 36.226 1.00 0.00 H new ATOM 1116 N GLY A 78 15.232 28.898 37.749 1.00 0.00 N ATOM 1117 CA GLY A 78 14.741 27.648 37.173 1.00 0.00 C ATOM 1118 C GLY A 78 15.845 26.612 36.909 1.00 0.00 C ATOM 1119 O GLY A 78 15.861 25.982 35.850 1.00 0.00 O ATOM 0 H GLY A 78 14.905 29.083 38.697 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.002 27.214 37.846 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.229 27.867 36.236 1.00 0.00 H new ATOM 1123 N LEU A 79 16.825 26.513 37.815 1.00 0.00 N ATOM 1124 CA LEU A 79 18.133 25.913 37.531 1.00 0.00 C ATOM 1125 C LEU A 79 18.092 24.383 37.328 1.00 0.00 C ATOM 1126 O LEU A 79 17.539 23.620 38.128 1.00 0.00 O ATOM 1127 CB LEU A 79 19.179 26.482 38.509 1.00 0.00 C ATOM 1128 CG LEU A 79 20.609 26.205 38.020 1.00 0.00 C ATOM 1129 CD1 LEU A 79 21.467 27.433 38.233 1.00 0.00 C ATOM 1130 CD2 LEU A 79 21.203 25.012 38.746 1.00 0.00 C ATOM 0 H LEU A 79 16.731 26.850 38.773 1.00 0.00 H new ATOM 0 HA LEU A 79 18.473 26.215 36.541 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.031 27.556 38.618 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.037 26.039 39.495 1.00 0.00 H new ATOM 0 HG LEU A 79 20.578 25.971 36.956 1.00 0.00 H new ATOM 0 HD11 LEU A 79 22.481 27.233 37.885 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.050 28.270 37.673 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.490 27.681 39.294 1.00 0.00 H new ATOM 0 HD21 LEU A 79 22.216 24.833 38.385 1.00 0.00 H new ATOM 0 HD22 LEU A 79 21.230 25.214 39.817 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.590 24.130 38.559 1.00 0.00 H new ATOM 1142 N THR A 80 18.659 23.941 36.202 1.00 0.00 N ATOM 1143 CA THR A 80 18.402 22.637 35.570 1.00 0.00 C ATOM 1144 C THR A 80 19.198 21.474 36.152 1.00 0.00 C ATOM 1145 O THR A 80 20.273 21.628 36.739 1.00 0.00 O ATOM 1146 CB THR A 80 18.669 22.680 34.047 1.00 0.00 C ATOM 1147 OG1 THR A 80 19.581 23.692 33.704 1.00 0.00 O ATOM 1148 CG2 THR A 80 17.399 22.859 33.235 1.00 0.00 C ATOM 0 H THR A 80 19.336 24.500 35.683 1.00 0.00 H new ATOM 0 HA THR A 80 17.348 22.454 35.780 1.00 0.00 H new ATOM 0 HB THR A 80 19.100 21.710 33.801 1.00 0.00 H new ATOM 0 HG1 THR A 80 19.605 23.794 32.730 1.00 0.00 H new ATOM 0 HG21 THR A 80 17.646 22.882 32.174 1.00 0.00 H new ATOM 0 HG22 THR A 80 16.721 22.028 33.432 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.917 23.795 33.516 1.00 0.00 H new ATOM 1156 N GLU A 81 18.693 20.275 35.872 1.00 0.00 N ATOM 1157 CA GLU A 81 19.291 18.968 36.162 1.00 0.00 C ATOM 1158 C GLU A 81 20.716 18.755 35.621 1.00 0.00 C ATOM 1159 O GLU A 81 21.417 17.864 36.113 1.00 0.00 O ATOM 1160 CB GLU A 81 18.361 17.912 35.551 1.00 0.00 C ATOM 1161 CG GLU A 81 17.196 17.607 36.494 1.00 0.00 C ATOM 1162 CD GLU A 81 16.369 16.430 35.982 1.00 0.00 C ATOM 1163 OE1 GLU A 81 16.945 15.324 35.828 1.00 0.00 O ATOM 1164 OE2 GLU A 81 15.142 16.594 35.782 1.00 0.00 O ATOM 0 H GLU A 81 17.792 20.181 35.404 1.00 0.00 H new ATOM 0 HA GLU A 81 19.392 18.894 37.245 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.978 18.267 34.595 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.922 16.999 35.350 1.00 0.00 H new ATOM 0 HG2 GLU A 81 17.579 17.381 37.489 1.00 0.00 H new ATOM 0 HG3 GLU A 81 16.561 18.488 36.589 1.00 0.00 H new ATOM 1171 N THR A 82 21.158 19.562 34.651 1.00 0.00 N ATOM 1172 CA THR A 82 22.538 19.615 34.147 1.00 0.00 C ATOM 1173 C THR A 82 23.089 21.042 34.059 1.00 0.00 C ATOM 1174 O THR A 82 24.015 21.323 33.295 1.00 0.00 O ATOM 1175 CB THR A 82 22.726 18.874 32.824 1.00 0.00 C ATOM 1176 OG1 THR A 82 21.900 19.408 31.815 1.00 0.00 O ATOM 1177 CG2 THR A 82 22.373 17.392 32.871 1.00 0.00 C ATOM 0 H THR A 82 20.542 20.222 34.176 1.00 0.00 H new ATOM 0 HA THR A 82 23.127 19.085 34.896 1.00 0.00 H new ATOM 0 HB THR A 82 23.790 18.997 32.620 1.00 0.00 H new ATOM 0 HG1 THR A 82 22.363 19.358 30.953 1.00 0.00 H new ATOM 0 HG21 THR A 82 22.537 16.948 31.889 1.00 0.00 H new ATOM 0 HG22 THR A 82 23.003 16.891 33.606 1.00 0.00 H new ATOM 0 HG23 THR A 82 21.326 17.276 33.152 1.00 0.00 H new ATOM 1185 N SER A 83 22.537 21.992 34.816 1.00 0.00 N ATOM 1186 CA SER A 83 23.134 23.323 34.894 1.00 0.00 C ATOM 1187 C SER A 83 24.502 23.262 35.564 1.00 0.00 C ATOM 1188 O SER A 83 24.695 22.551 36.553 1.00 0.00 O ATOM 1189 CB SER A 83 22.237 24.300 35.616 1.00 0.00 C ATOM 1190 OG SER A 83 22.895 25.535 35.773 1.00 0.00 O ATOM 0 H SER A 83 21.692 21.867 35.374 1.00 0.00 H new ATOM 0 HA SER A 83 23.258 23.682 33.873 1.00 0.00 H new ATOM 0 HB2 SER A 83 21.313 24.440 35.055 1.00 0.00 H new ATOM 0 HB3 SER A 83 21.961 23.900 36.591 1.00 0.00 H new ATOM 0 HG SER A 83 23.337 25.779 34.933 1.00 0.00 H new ATOM 1196 N ARG A 84 25.458 24.002 35.006 1.00 0.00 N ATOM 1197 CA ARG A 84 26.846 24.079 35.477 1.00 0.00 C ATOM 1198 C ARG A 84 27.365 25.498 35.221 1.00 0.00 C ATOM 1199 O ARG A 84 26.606 26.342 34.756 1.00 0.00 O ATOM 1200 CB ARG A 84 27.668 22.956 34.789 1.00 0.00 C ATOM 1201 CG ARG A 84 28.602 22.128 35.699 1.00 0.00 C ATOM 1202 CD ARG A 84 28.009 21.724 37.064 1.00 0.00 C ATOM 1203 NE ARG A 84 28.650 20.529 37.655 1.00 0.00 N ATOM 1204 CZ ARG A 84 28.157 19.784 38.636 1.00 0.00 C ATOM 1205 NH1 ARG A 84 27.100 20.090 39.317 1.00 0.00 N ATOM 1206 NH2 ARG A 84 28.748 18.688 38.995 1.00 0.00 N ATOM 0 H ARG A 84 25.286 24.585 34.187 1.00 0.00 H new ATOM 0 HA ARG A 84 26.935 23.906 36.549 1.00 0.00 H new ATOM 0 HB2 ARG A 84 26.972 22.273 34.303 1.00 0.00 H new ATOM 0 HB3 ARG A 84 28.272 23.408 34.002 1.00 0.00 H new ATOM 0 HG2 ARG A 84 28.892 21.223 35.166 1.00 0.00 H new ATOM 0 HG3 ARG A 84 29.513 22.701 35.873 1.00 0.00 H new ATOM 0 HD2 ARG A 84 28.109 22.560 37.756 1.00 0.00 H new ATOM 0 HD3 ARG A 84 26.942 21.533 36.946 1.00 0.00 H new ATOM 0 HE ARG A 84 29.554 20.252 37.273 1.00 0.00 H new ATOM 0 HH11 ARG A 84 26.592 20.950 39.111 1.00 0.00 H new ATOM 0 HH12 ARG A 84 26.775 19.471 40.060 1.00 0.00 H new ATOM 0 HH21 ARG A 84 29.601 18.390 38.522 1.00 0.00 H new ATOM 0 HH22 ARG A 84 28.360 18.123 39.751 1.00 0.00 H new ATOM 1220 N LEU A 85 28.617 25.793 35.553 1.00 0.00 N ATOM 1221 CA LEU A 85 29.233 27.103 35.306 1.00 0.00 C ATOM 1222 C LEU A 85 30.594 26.962 34.613 1.00 0.00 C ATOM 1223 O LEU A 85 31.111 25.854 34.477 1.00 0.00 O ATOM 1224 CB LEU A 85 29.211 27.986 36.561 1.00 0.00 C ATOM 1225 CG LEU A 85 30.193 27.661 37.685 1.00 0.00 C ATOM 1226 CD1 LEU A 85 30.192 28.834 38.657 1.00 0.00 C ATOM 1227 CD2 LEU A 85 29.847 26.393 38.475 1.00 0.00 C ATOM 0 H LEU A 85 29.243 25.127 36.006 1.00 0.00 H new ATOM 0 HA LEU A 85 28.624 27.652 34.588 1.00 0.00 H new ATOM 0 HB2 LEU A 85 29.390 29.015 36.248 1.00 0.00 H new ATOM 0 HB3 LEU A 85 28.204 27.950 36.977 1.00 0.00 H new ATOM 0 HG LEU A 85 31.163 27.487 37.219 1.00 0.00 H new ATOM 0 HD11 LEU A 85 30.886 28.631 39.473 1.00 0.00 H new ATOM 0 HD12 LEU A 85 30.501 29.739 38.135 1.00 0.00 H new ATOM 0 HD13 LEU A 85 29.189 28.972 39.060 1.00 0.00 H new ATOM 0 HD21 LEU A 85 30.593 26.234 39.253 1.00 0.00 H new ATOM 0 HD22 LEU A 85 28.864 26.506 38.932 1.00 0.00 H new ATOM 0 HD23 LEU A 85 29.837 25.536 37.802 1.00 0.00 H new ATOM 1239 N GLY A 86 31.106 28.054 34.048 1.00 0.00 N ATOM 1240 CA GLY A 86 32.119 27.997 32.992 1.00 0.00 C ATOM 1241 C GLY A 86 33.584 28.126 33.420 1.00 0.00 C ATOM 1242 O GLY A 86 34.411 28.391 32.546 1.00 0.00 O ATOM 0 H GLY A 86 30.832 29.002 34.307 1.00 0.00 H new ATOM 0 HA2 GLY A 86 32.003 27.051 32.464 1.00 0.00 H new ATOM 0 HA3 GLY A 86 31.905 28.790 32.276 1.00 0.00 H new ATOM 1246 N CYS A 87 33.895 27.989 34.713 1.00 0.00 N ATOM 1247 CA CYS A 87 35.127 28.483 35.343 1.00 0.00 C ATOM 1248 C CYS A 87 35.986 27.441 36.092 1.00 0.00 C ATOM 1249 O CYS A 87 37.124 27.733 36.460 1.00 0.00 O ATOM 1250 CB CYS A 87 34.679 29.579 36.308 1.00 0.00 C ATOM 1251 SG CYS A 87 32.959 29.482 36.852 1.00 0.00 S ATOM 0 H CYS A 87 33.277 27.516 35.373 1.00 0.00 H new ATOM 0 HA CYS A 87 35.792 28.822 34.548 1.00 0.00 H new ATOM 0 HB2 CYS A 87 35.322 29.549 37.188 1.00 0.00 H new ATOM 0 HB3 CYS A 87 34.837 30.546 35.830 1.00 0.00 H new ATOM 1256 N GLN A 88 35.463 26.245 36.372 1.00 0.00 N ATOM 1257 CA GLN A 88 36.140 25.161 37.121 1.00 0.00 C ATOM 1258 C GLN A 88 36.010 23.793 36.456 1.00 0.00 C ATOM 1259 O GLN A 88 36.899 22.958 36.640 1.00 0.00 O ATOM 1260 CB GLN A 88 35.675 25.073 38.591 1.00 0.00 C ATOM 1261 CG GLN A 88 34.188 24.758 38.808 1.00 0.00 C ATOM 1262 CD GLN A 88 33.310 25.806 38.154 1.00 0.00 C ATOM 1263 OE1 GLN A 88 32.694 25.545 37.135 1.00 0.00 O ATOM 1264 NE2 GLN A 88 33.373 27.044 38.595 1.00 0.00 N ATOM 0 H GLN A 88 34.522 25.986 36.076 1.00 0.00 H new ATOM 0 HA GLN A 88 37.194 25.438 37.108 1.00 0.00 H new ATOM 0 HB2 GLN A 88 36.266 24.307 39.093 1.00 0.00 H new ATOM 0 HB3 GLN A 88 35.901 26.021 39.080 1.00 0.00 H new ATOM 0 HG2 GLN A 88 33.957 23.776 38.396 1.00 0.00 H new ATOM 0 HG3 GLN A 88 33.974 24.714 39.876 1.00 0.00 H new ATOM 0 HE21 GLN A 88 33.890 27.256 39.448 1.00 0.00 H new ATOM 0 HE22 GLN A 88 32.905 27.792 38.084 1.00 0.00 H new ATOM 1273 N ILE A 89 34.945 23.574 35.674 1.00 0.00 N ATOM 1274 CA ILE A 89 34.934 22.570 34.610 1.00 0.00 C ATOM 1275 C ILE A 89 35.505 23.194 33.327 1.00 0.00 C ATOM 1276 O ILE A 89 35.186 24.324 32.950 1.00 0.00 O ATOM 1277 CB ILE A 89 33.551 21.885 34.449 1.00 0.00 C ATOM 1278 CG1 ILE A 89 33.554 20.806 33.343 1.00 0.00 C ATOM 1279 CG2 ILE A 89 32.402 22.875 34.182 1.00 0.00 C ATOM 1280 CD1 ILE A 89 34.584 19.687 33.562 1.00 0.00 C ATOM 0 H ILE A 89 34.069 24.089 35.763 1.00 0.00 H new ATOM 0 HA ILE A 89 35.587 21.740 34.880 1.00 0.00 H new ATOM 0 HB ILE A 89 33.370 21.411 35.414 1.00 0.00 H new ATOM 0 HG12 ILE A 89 32.560 20.363 33.280 1.00 0.00 H new ATOM 0 HG13 ILE A 89 33.752 21.285 32.384 1.00 0.00 H new ATOM 0 HG21 ILE A 89 31.466 22.327 34.080 1.00 0.00 H new ATOM 0 HG22 ILE A 89 32.324 23.575 35.014 1.00 0.00 H new ATOM 0 HG23 ILE A 89 32.602 23.425 33.263 1.00 0.00 H new ATOM 0 HD11 ILE A 89 34.522 18.970 32.743 1.00 0.00 H new ATOM 0 HD12 ILE A 89 35.586 20.116 33.595 1.00 0.00 H new ATOM 0 HD13 ILE A 89 34.376 19.180 34.504 1.00 0.00 H new ATOM 1292 N LYS A 90 36.402 22.447 32.690 1.00 0.00 N ATOM 1293 CA LYS A 90 37.237 22.801 31.547 1.00 0.00 C ATOM 1294 C LYS A 90 37.343 21.607 30.606 1.00 0.00 C ATOM 1295 O LYS A 90 36.874 20.512 30.905 1.00 0.00 O ATOM 1296 CB LYS A 90 38.638 23.238 32.024 1.00 0.00 C ATOM 1297 CG LYS A 90 39.160 22.597 33.316 1.00 0.00 C ATOM 1298 CD LYS A 90 39.540 21.121 33.118 1.00 0.00 C ATOM 1299 CE LYS A 90 40.354 20.709 34.343 1.00 0.00 C ATOM 1300 NZ LYS A 90 40.919 19.352 34.207 1.00 0.00 N ATOM 0 H LYS A 90 36.579 21.488 32.990 1.00 0.00 H new ATOM 0 HA LYS A 90 36.782 23.635 31.013 1.00 0.00 H new ATOM 0 HB2 LYS A 90 39.350 23.024 31.227 1.00 0.00 H new ATOM 0 HB3 LYS A 90 38.628 24.319 32.161 1.00 0.00 H new ATOM 0 HG2 LYS A 90 40.030 23.151 33.669 1.00 0.00 H new ATOM 0 HG3 LYS A 90 38.398 22.674 34.092 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.648 20.502 33.020 1.00 0.00 H new ATOM 0 HD3 LYS A 90 40.121 20.990 32.205 1.00 0.00 H new ATOM 0 HE2 LYS A 90 41.163 21.424 34.497 1.00 0.00 H new ATOM 0 HE3 LYS A 90 39.720 20.750 35.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 41.463 19.115 35.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 40.147 18.665 34.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 41.545 19.318 33.377 1.00 0.00 H new ATOM 1314 N MET A 91 37.988 21.828 29.474 1.00 0.00 N ATOM 1315 CA MET A 91 38.174 20.804 28.465 1.00 0.00 C ATOM 1316 C MET A 91 39.174 19.700 28.874 1.00 0.00 C ATOM 1317 O MET A 91 40.214 19.990 29.453 1.00 0.00 O ATOM 1318 CB MET A 91 38.611 21.472 27.162 1.00 0.00 C ATOM 1319 CG MET A 91 37.677 22.537 26.588 1.00 0.00 C ATOM 1320 SD MET A 91 35.966 22.025 26.263 1.00 0.00 S ATOM 1321 CE MET A 91 36.196 20.949 24.817 1.00 0.00 C ATOM 0 H MET A 91 38.399 22.729 29.229 1.00 0.00 H new ATOM 0 HA MET A 91 37.219 20.295 28.337 1.00 0.00 H new ATOM 0 HB2 MET A 91 39.587 21.928 27.325 1.00 0.00 H new ATOM 0 HB3 MET A 91 38.744 20.695 26.409 1.00 0.00 H new ATOM 0 HG2 MET A 91 37.655 23.380 27.279 1.00 0.00 H new ATOM 0 HG3 MET A 91 38.107 22.901 25.655 1.00 0.00 H new ATOM 0 HE1 MET A 91 35.439 20.165 24.823 1.00 0.00 H new ATOM 0 HE2 MET A 91 36.101 21.539 23.906 1.00 0.00 H new ATOM 0 HE3 MET A 91 37.187 20.497 24.854 1.00 0.00 H new ATOM 1331 N SER A 92 38.905 18.451 28.490 1.00 0.00 N ATOM 1332 CA SER A 92 39.823 17.292 28.540 1.00 0.00 C ATOM 1333 C SER A 92 39.622 16.371 27.320 1.00 0.00 C ATOM 1334 O SER A 92 38.728 16.611 26.511 1.00 0.00 O ATOM 1335 CB SER A 92 39.616 16.511 29.848 1.00 0.00 C ATOM 1336 OG SER A 92 38.412 15.761 29.828 1.00 0.00 O ATOM 0 H SER A 92 37.992 18.198 28.113 1.00 0.00 H new ATOM 0 HA SER A 92 40.847 17.664 28.510 1.00 0.00 H new ATOM 0 HB2 SER A 92 40.460 15.840 30.008 1.00 0.00 H new ATOM 0 HB3 SER A 92 39.598 17.206 30.687 1.00 0.00 H new ATOM 0 HG SER A 92 38.314 15.276 30.674 1.00 0.00 H new ATOM 1342 N LYS A 93 40.413 15.303 27.147 1.00 0.00 N ATOM 1343 CA LYS A 93 40.232 14.356 26.021 1.00 0.00 C ATOM 1344 C LYS A 93 39.035 13.405 26.146 1.00 0.00 C ATOM 1345 O LYS A 93 38.607 12.841 25.140 1.00 0.00 O ATOM 1346 CB LYS A 93 41.539 13.589 25.740 1.00 0.00 C ATOM 1347 CG LYS A 93 42.533 14.510 25.025 1.00 0.00 C ATOM 1348 CD LYS A 93 43.862 13.827 24.692 1.00 0.00 C ATOM 1349 CE LYS A 93 44.701 14.891 23.985 1.00 0.00 C ATOM 1350 NZ LYS A 93 46.022 14.390 23.549 1.00 0.00 N ATOM 0 H LYS A 93 41.186 15.067 27.769 1.00 0.00 H new ATOM 0 HA LYS A 93 39.985 14.980 25.162 1.00 0.00 H new ATOM 0 HB2 LYS A 93 41.969 13.229 26.675 1.00 0.00 H new ATOM 0 HB3 LYS A 93 41.333 12.713 25.125 1.00 0.00 H new ATOM 0 HG2 LYS A 93 42.080 14.876 24.104 1.00 0.00 H new ATOM 0 HG3 LYS A 93 42.727 15.380 25.652 1.00 0.00 H new ATOM 0 HD2 LYS A 93 44.358 13.472 25.595 1.00 0.00 H new ATOM 0 HD3 LYS A 93 43.708 12.959 24.051 1.00 0.00 H new ATOM 0 HE2 LYS A 93 44.154 15.260 23.117 1.00 0.00 H new ATOM 0 HE3 LYS A 93 44.843 15.738 24.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 46.545 15.155 23.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 46.560 14.063 24.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 45.892 13.599 22.886 1.00 0.00 H new ATOM 1364 N ASP A 94 38.471 13.204 27.339 1.00 0.00 N ATOM 1365 CA ASP A 94 37.333 12.281 27.537 1.00 0.00 C ATOM 1366 C ASP A 94 36.026 12.814 26.911 1.00 0.00 C ATOM 1367 O ASP A 94 35.231 12.062 26.337 1.00 0.00 O ATOM 1368 CB ASP A 94 37.141 12.044 29.042 1.00 0.00 C ATOM 1369 CG ASP A 94 36.411 10.729 29.300 1.00 0.00 C ATOM 1370 OD1 ASP A 94 37.073 9.663 29.272 1.00 0.00 O ATOM 1371 OD2 ASP A 94 35.168 10.725 29.476 1.00 0.00 O ATOM 0 H ASP A 94 38.781 13.668 28.193 1.00 0.00 H new ATOM 0 HA ASP A 94 37.565 11.344 27.030 1.00 0.00 H new ATOM 0 HB2 ASP A 94 38.111 12.029 29.538 1.00 0.00 H new ATOM 0 HB3 ASP A 94 36.575 12.869 29.474 1.00 0.00 H new ATOM 1376 N ILE A 95 35.859 14.135 26.996 1.00 0.00 N ATOM 1377 CA ILE A 95 34.721 14.978 26.594 1.00 0.00 C ATOM 1378 C ILE A 95 34.762 15.407 25.129 1.00 0.00 C ATOM 1379 O ILE A 95 34.194 16.434 24.776 1.00 0.00 O ATOM 1380 CB ILE A 95 34.668 16.209 27.517 1.00 0.00 C ATOM 1381 CG1 ILE A 95 35.891 17.119 27.265 1.00 0.00 C ATOM 1382 CG2 ILE A 95 34.563 15.827 29.000 1.00 0.00 C ATOM 1383 CD1 ILE A 95 35.530 18.591 27.338 1.00 0.00 C ATOM 0 H ILE A 95 36.602 14.710 27.394 1.00 0.00 H new ATOM 0 HA ILE A 95 33.817 14.378 26.696 1.00 0.00 H new ATOM 0 HB ILE A 95 33.760 16.760 27.273 1.00 0.00 H new ATOM 0 HG12 ILE A 95 36.664 16.899 28.001 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.312 16.897 26.284 1.00 0.00 H new ATOM 0 HG21 ILE A 95 34.529 16.732 29.607 1.00 0.00 H new ATOM 0 HG22 ILE A 95 33.655 15.246 29.163 1.00 0.00 H new ATOM 0 HG23 ILE A 95 35.430 15.231 29.285 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.420 19.193 27.155 1.00 0.00 H new ATOM 0 HD12 ILE A 95 34.776 18.819 26.584 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.134 18.820 28.328 1.00 0.00 H new ATOM 1395 N ASP A 96 35.502 14.704 24.280 1.00 0.00 N ATOM 1396 CA ASP A 96 35.785 15.144 22.918 1.00 0.00 C ATOM 1397 C ASP A 96 34.516 15.097 22.039 1.00 0.00 C ATOM 1398 O ASP A 96 34.234 14.133 21.320 1.00 0.00 O ATOM 1399 CB ASP A 96 36.977 14.329 22.418 1.00 0.00 C ATOM 1400 CG ASP A 96 37.308 14.472 20.934 1.00 0.00 C ATOM 1401 OD1 ASP A 96 37.006 15.508 20.295 1.00 0.00 O ATOM 1402 OD2 ASP A 96 37.911 13.512 20.403 1.00 0.00 O ATOM 0 H ASP A 96 35.925 13.807 24.518 1.00 0.00 H new ATOM 0 HA ASP A 96 36.071 16.195 22.873 1.00 0.00 H new ATOM 0 HB2 ASP A 96 37.856 14.615 22.996 1.00 0.00 H new ATOM 0 HB3 ASP A 96 36.786 13.277 22.628 1.00 0.00 H new ATOM 1407 N GLY A 97 33.775 16.206 22.097 1.00 0.00 N ATOM 1408 CA GLY A 97 32.395 16.368 21.598 1.00 0.00 C ATOM 1409 C GLY A 97 31.346 16.924 22.586 1.00 0.00 C ATOM 1410 O GLY A 97 30.161 16.956 22.249 1.00 0.00 O ATOM 0 H GLY A 97 34.135 17.064 22.514 1.00 0.00 H new ATOM 0 HA2 GLY A 97 32.425 17.028 20.731 1.00 0.00 H new ATOM 0 HA3 GLY A 97 32.047 15.396 21.247 1.00 0.00 H new ATOM 1414 N ILE A 98 31.755 17.429 23.757 1.00 0.00 N ATOM 1415 CA ILE A 98 30.936 18.166 24.740 1.00 0.00 C ATOM 1416 C ILE A 98 30.029 19.250 24.107 1.00 0.00 C ATOM 1417 O ILE A 98 30.425 19.960 23.175 1.00 0.00 O ATOM 1418 CB ILE A 98 31.918 18.763 25.786 1.00 0.00 C ATOM 1419 CG1 ILE A 98 31.375 18.904 27.223 1.00 0.00 C ATOM 1420 CG2 ILE A 98 32.598 20.057 25.303 1.00 0.00 C ATOM 1421 CD1 ILE A 98 30.666 20.212 27.586 1.00 0.00 C ATOM 0 H ILE A 98 32.722 17.331 24.066 1.00 0.00 H new ATOM 0 HA ILE A 98 30.231 17.480 25.211 1.00 0.00 H new ATOM 0 HB ILE A 98 32.683 17.990 25.864 1.00 0.00 H new ATOM 0 HG12 ILE A 98 30.680 18.084 27.402 1.00 0.00 H new ATOM 0 HG13 ILE A 98 32.209 18.771 27.912 1.00 0.00 H new ATOM 0 HG21 ILE A 98 33.271 20.425 26.077 1.00 0.00 H new ATOM 0 HG22 ILE A 98 33.166 19.853 24.395 1.00 0.00 H new ATOM 0 HG23 ILE A 98 31.839 20.811 25.094 1.00 0.00 H new ATOM 0 HD11 ILE A 98 30.337 20.172 28.625 1.00 0.00 H new ATOM 0 HD12 ILE A 98 31.354 21.047 27.455 1.00 0.00 H new ATOM 0 HD13 ILE A 98 29.801 20.349 26.937 1.00 0.00 H new ATOM 1433 N ARG A 99 28.822 19.417 24.666 1.00 0.00 N ATOM 1434 CA ARG A 99 27.898 20.531 24.380 1.00 0.00 C ATOM 1435 C ARG A 99 27.528 21.255 25.651 1.00 0.00 C ATOM 1436 O ARG A 99 27.344 20.629 26.696 1.00 0.00 O ATOM 1437 CB ARG A 99 26.549 20.023 23.825 1.00 0.00 C ATOM 1438 CG ARG A 99 25.797 20.984 22.885 1.00 0.00 C ATOM 1439 CD ARG A 99 24.300 20.654 22.797 1.00 0.00 C ATOM 1440 NE ARG A 99 24.080 19.328 22.193 1.00 0.00 N ATOM 1441 CZ ARG A 99 23.388 18.314 22.679 1.00 0.00 C ATOM 1442 NH1 ARG A 99 22.638 18.399 23.740 1.00 0.00 N ATOM 1443 NH2 ARG A 99 23.451 17.159 22.094 1.00 0.00 N ATOM 0 H ARG A 99 28.447 18.761 25.352 1.00 0.00 H new ATOM 0 HA ARG A 99 28.418 21.169 23.665 1.00 0.00 H new ATOM 0 HB2 ARG A 99 26.728 19.090 23.290 1.00 0.00 H new ATOM 0 HB3 ARG A 99 25.898 19.788 24.667 1.00 0.00 H new ATOM 0 HG2 ARG A 99 25.922 22.007 23.239 1.00 0.00 H new ATOM 0 HG3 ARG A 99 26.238 20.935 21.889 1.00 0.00 H new ATOM 0 HD2 ARG A 99 23.860 20.680 23.794 1.00 0.00 H new ATOM 0 HD3 ARG A 99 23.792 21.415 22.205 1.00 0.00 H new ATOM 0 HE ARG A 99 24.518 19.174 21.285 1.00 0.00 H new ATOM 0 HH11 ARG A 99 22.563 19.284 24.242 1.00 0.00 H new ATOM 0 HH12 ARG A 99 22.126 17.581 24.069 1.00 0.00 H new ATOM 0 HH21 ARG A 99 24.032 17.039 21.264 1.00 0.00 H new ATOM 0 HH22 ARG A 99 22.919 16.371 22.463 1.00 0.00 H new ATOM 1457 N VAL A 100 27.224 22.530 25.498 1.00 0.00 N ATOM 1458 CA VAL A 100 26.391 23.261 26.435 1.00 0.00 C ATOM 1459 C VAL A 100 25.347 24.117 25.722 1.00 0.00 C ATOM 1460 O VAL A 100 25.502 24.437 24.545 1.00 0.00 O ATOM 1461 CB VAL A 100 27.268 24.138 27.367 1.00 0.00 C ATOM 1462 CG1 VAL A 100 28.146 23.322 28.327 1.00 0.00 C ATOM 1463 CG2 VAL A 100 28.189 25.085 26.576 1.00 0.00 C ATOM 0 H VAL A 100 27.551 23.093 24.713 1.00 0.00 H new ATOM 0 HA VAL A 100 25.855 22.528 27.038 1.00 0.00 H new ATOM 0 HB VAL A 100 26.548 24.712 27.950 1.00 0.00 H new ATOM 0 HG11 VAL A 100 28.732 23.999 28.948 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.512 22.703 28.962 1.00 0.00 H new ATOM 0 HG13 VAL A 100 28.817 22.684 27.753 1.00 0.00 H new ATOM 0 HG21 VAL A 100 28.783 25.679 27.271 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.852 24.500 25.939 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.584 25.748 25.958 1.00 0.00 H new ATOM 1473 N ALA A 101 24.298 24.528 26.430 1.00 0.00 N ATOM 1474 CA ALA A 101 23.433 25.617 25.990 1.00 0.00 C ATOM 1475 C ALA A 101 23.679 26.860 26.866 1.00 0.00 C ATOM 1476 O ALA A 101 24.007 26.728 28.048 1.00 0.00 O ATOM 1477 CB ALA A 101 21.978 25.145 25.993 1.00 0.00 C ATOM 0 H ALA A 101 24.025 24.116 27.322 1.00 0.00 H new ATOM 0 HA ALA A 101 23.666 25.908 24.966 1.00 0.00 H new ATOM 0 HB1 ALA A 101 21.331 25.958 25.664 1.00 0.00 H new ATOM 0 HB2 ALA A 101 21.869 24.298 25.316 1.00 0.00 H new ATOM 0 HB3 ALA A 101 21.696 24.842 27.001 1.00 0.00 H new ATOM 1483 N LEU A 102 23.544 28.056 26.289 1.00 0.00 N ATOM 1484 CA LEU A 102 23.911 29.340 26.894 1.00 0.00 C ATOM 1485 C LEU A 102 22.640 30.220 27.037 1.00 0.00 C ATOM 1486 O LEU A 102 22.398 31.102 26.206 1.00 0.00 O ATOM 1487 CB LEU A 102 25.040 29.910 26.007 1.00 0.00 C ATOM 1488 CG LEU A 102 26.138 30.680 26.751 1.00 0.00 C ATOM 1489 CD1 LEU A 102 27.272 30.939 25.754 1.00 0.00 C ATOM 1490 CD2 LEU A 102 25.638 32.000 27.331 1.00 0.00 C ATOM 0 H LEU A 102 23.161 28.162 25.350 1.00 0.00 H new ATOM 0 HA LEU A 102 24.296 29.272 27.912 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.503 29.086 25.464 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.596 30.572 25.264 1.00 0.00 H new ATOM 0 HG LEU A 102 26.478 30.084 27.598 1.00 0.00 H new ATOM 0 HD11 LEU A 102 28.074 31.487 26.249 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.656 29.988 25.385 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.894 31.527 24.918 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.456 32.504 27.847 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.271 32.636 26.525 1.00 0.00 H new ATOM 0 HD23 LEU A 102 24.830 31.805 28.036 1.00 0.00 H new ATOM 1502 N PRO A 103 21.767 29.924 28.025 1.00 0.00 N ATOM 1503 CA PRO A 103 20.325 30.208 27.984 1.00 0.00 C ATOM 1504 C PRO A 103 19.941 31.694 28.023 1.00 0.00 C ATOM 1505 O PRO A 103 20.688 32.538 28.523 1.00 0.00 O ATOM 1506 CB PRO A 103 19.731 29.458 29.187 1.00 0.00 C ATOM 1507 CG PRO A 103 20.898 29.359 30.164 1.00 0.00 C ATOM 1508 CD PRO A 103 22.072 29.143 29.217 1.00 0.00 C ATOM 0 HA PRO A 103 19.929 29.878 27.023 1.00 0.00 H new ATOM 0 HB2 PRO A 103 18.890 29.999 29.621 1.00 0.00 H new ATOM 0 HB3 PRO A 103 19.363 28.472 28.902 1.00 0.00 H new ATOM 0 HG2 PRO A 103 21.013 30.265 30.759 1.00 0.00 H new ATOM 0 HG3 PRO A 103 20.778 28.532 30.863 1.00 0.00 H new ATOM 0 HD2 PRO A 103 23.007 29.471 29.671 1.00 0.00 H new ATOM 0 HD3 PRO A 103 22.189 28.087 28.974 1.00 0.00 H new ATOM 1516 N GLN A 104 18.729 32.012 27.551 1.00 0.00 N ATOM 1517 CA GLN A 104 18.127 33.342 27.722 1.00 0.00 C ATOM 1518 C GLN A 104 17.676 33.510 29.181 1.00 0.00 C ATOM 1519 O GLN A 104 16.900 32.690 29.686 1.00 0.00 O ATOM 1520 CB GLN A 104 16.944 33.535 26.758 1.00 0.00 C ATOM 1521 CG GLN A 104 17.380 33.592 25.288 1.00 0.00 C ATOM 1522 CD GLN A 104 16.205 33.890 24.359 1.00 0.00 C ATOM 1523 OE1 GLN A 104 15.396 33.016 24.053 1.00 0.00 O ATOM 1524 NE2 GLN A 104 16.058 35.113 23.902 1.00 0.00 N ATOM 0 H GLN A 104 18.138 31.356 27.040 1.00 0.00 H new ATOM 0 HA GLN A 104 18.870 34.104 27.487 1.00 0.00 H new ATOM 0 HB2 GLN A 104 16.235 32.717 26.891 1.00 0.00 H new ATOM 0 HB3 GLN A 104 16.420 34.456 27.013 1.00 0.00 H new ATOM 0 HG2 GLN A 104 18.144 34.359 25.165 1.00 0.00 H new ATOM 0 HG3 GLN A 104 17.834 32.642 25.006 1.00 0.00 H new ATOM 0 HE21 GLN A 104 16.730 35.837 24.157 1.00 0.00 H new ATOM 0 HE22 GLN A 104 15.272 35.339 23.292 1.00 0.00 H new ATOM 1533 N MET A 105 18.172 34.542 29.870 1.00 0.00 N ATOM 1534 CA MET A 105 18.074 34.657 31.330 1.00 0.00 C ATOM 1535 C MET A 105 18.020 36.118 31.807 1.00 0.00 C ATOM 1536 O MET A 105 18.758 36.979 31.323 1.00 0.00 O ATOM 1537 CB MET A 105 19.279 33.916 31.942 1.00 0.00 C ATOM 1538 CG MET A 105 19.211 33.765 33.466 1.00 0.00 C ATOM 1539 SD MET A 105 17.700 33.003 34.129 1.00 0.00 S ATOM 1540 CE MET A 105 17.731 31.369 33.340 1.00 0.00 C ATOM 0 H MET A 105 18.655 35.325 29.430 1.00 0.00 H new ATOM 0 HA MET A 105 17.138 34.207 31.661 1.00 0.00 H new ATOM 0 HB2 MET A 105 19.350 32.926 31.492 1.00 0.00 H new ATOM 0 HB3 MET A 105 20.192 34.451 31.681 1.00 0.00 H new ATOM 0 HG2 MET A 105 20.065 33.171 33.790 1.00 0.00 H new ATOM 0 HG3 MET A 105 19.322 34.753 33.914 1.00 0.00 H new ATOM 0 HE1 MET A 105 16.880 30.782 33.686 1.00 0.00 H new ATOM 0 HE2 MET A 105 17.675 31.486 32.258 1.00 0.00 H new ATOM 0 HE3 MET A 105 18.656 30.856 33.602 1.00 0.00 H new ATOM 1550 N THR A 106 17.180 36.408 32.802 1.00 0.00 N ATOM 1551 CA THR A 106 17.082 37.757 33.387 1.00 0.00 C ATOM 1552 C THR A 106 18.112 37.954 34.501 1.00 0.00 C ATOM 1553 O THR A 106 18.342 37.052 35.314 1.00 0.00 O ATOM 1554 CB THR A 106 15.663 38.079 33.886 1.00 0.00 C ATOM 1555 OG1 THR A 106 14.717 37.643 32.935 1.00 0.00 O ATOM 1556 CG2 THR A 106 15.440 39.580 34.068 1.00 0.00 C ATOM 0 H THR A 106 16.552 35.725 33.226 1.00 0.00 H new ATOM 0 HA THR A 106 17.305 38.462 32.586 1.00 0.00 H new ATOM 0 HB THR A 106 15.548 37.574 34.845 1.00 0.00 H new ATOM 0 HG1 THR A 106 13.813 37.847 33.255 1.00 0.00 H new ATOM 0 HG21 THR A 106 14.424 39.757 34.421 1.00 0.00 H new ATOM 0 HG22 THR A 106 16.151 39.968 34.798 1.00 0.00 H new ATOM 0 HG23 THR A 106 15.586 40.088 33.115 1.00 0.00 H new ATOM 1564 N ARG A 107 18.712 39.150 34.566 1.00 0.00 N ATOM 1565 CA ARG A 107 19.509 39.628 35.709 1.00 0.00 C ATOM 1566 C ARG A 107 19.129 41.067 36.076 1.00 0.00 C ATOM 1567 O ARG A 107 19.100 41.930 35.195 1.00 0.00 O ATOM 1568 CB ARG A 107 21.017 39.516 35.408 1.00 0.00 C ATOM 1569 CG ARG A 107 21.839 39.529 36.710 1.00 0.00 C ATOM 1570 CD ARG A 107 23.315 39.892 36.520 1.00 0.00 C ATOM 1571 NE ARG A 107 24.014 39.012 35.566 1.00 0.00 N ATOM 1572 CZ ARG A 107 24.610 39.361 34.444 1.00 0.00 C ATOM 1573 NH1 ARG A 107 24.571 40.571 33.964 1.00 0.00 N ATOM 1574 NH2 ARG A 107 25.286 38.469 33.791 1.00 0.00 N ATOM 0 H ARG A 107 18.657 39.830 33.808 1.00 0.00 H new ATOM 0 HA ARG A 107 19.287 38.993 36.567 1.00 0.00 H new ATOM 0 HB2 ARG A 107 21.215 38.596 34.857 1.00 0.00 H new ATOM 0 HB3 ARG A 107 21.327 40.343 34.769 1.00 0.00 H new ATOM 0 HG2 ARG A 107 21.389 40.239 37.403 1.00 0.00 H new ATOM 0 HG3 ARG A 107 21.776 38.545 37.176 1.00 0.00 H new ATOM 0 HD2 ARG A 107 23.387 40.923 36.172 1.00 0.00 H new ATOM 0 HD3 ARG A 107 23.821 39.845 37.485 1.00 0.00 H new ATOM 0 HE ARG A 107 24.039 38.020 35.801 1.00 0.00 H new ATOM 0 HH11 ARG A 107 24.061 41.301 34.462 1.00 0.00 H new ATOM 0 HH12 ARG A 107 25.050 40.789 33.090 1.00 0.00 H new ATOM 0 HH21 ARG A 107 25.350 37.515 34.148 1.00 0.00 H new ATOM 0 HH22 ARG A 107 25.754 38.720 32.920 1.00 0.00 H new ATOM 1588 N ASN A 108 18.889 41.312 37.361 1.00 0.00 N ATOM 1589 CA ASN A 108 18.625 42.619 37.974 1.00 0.00 C ATOM 1590 C ASN A 108 19.821 43.056 38.854 1.00 0.00 C ATOM 1591 O ASN A 108 20.669 42.234 39.208 1.00 0.00 O ATOM 1592 CB ASN A 108 17.305 42.508 38.764 1.00 0.00 C ATOM 1593 CG ASN A 108 16.091 42.310 37.870 1.00 0.00 C ATOM 1594 OD1 ASN A 108 15.651 41.194 37.612 1.00 0.00 O ATOM 1595 ND2 ASN A 108 15.544 43.385 37.357 1.00 0.00 N ATOM 0 H ASN A 108 18.872 40.559 38.049 1.00 0.00 H new ATOM 0 HA ASN A 108 18.515 43.396 37.217 1.00 0.00 H new ATOM 0 HB2 ASN A 108 17.375 41.674 39.462 1.00 0.00 H new ATOM 0 HB3 ASN A 108 17.167 43.411 39.359 1.00 0.00 H new ATOM 0 HD21 ASN A 108 14.741 43.301 36.734 1.00 0.00 H new ATOM 0 HD22 ASN A 108 15.921 44.306 37.581 1.00 0.00 H new ATOM 1602 N VAL A 109 19.922 44.346 39.203 1.00 0.00 N ATOM 1603 CA VAL A 109 21.078 44.891 39.954 1.00 0.00 C ATOM 1604 C VAL A 109 21.111 44.463 41.430 1.00 0.00 C ATOM 1605 O VAL A 109 20.158 44.685 42.186 1.00 0.00 O ATOM 1606 CB VAL A 109 21.216 46.423 39.826 1.00 0.00 C ATOM 1607 CG1 VAL A 109 21.829 46.790 38.470 1.00 0.00 C ATOM 1608 CG2 VAL A 109 19.895 47.189 39.993 1.00 0.00 C ATOM 0 H VAL A 109 19.213 45.043 38.978 1.00 0.00 H new ATOM 0 HA VAL A 109 21.946 44.441 39.473 1.00 0.00 H new ATOM 0 HB VAL A 109 21.867 46.724 40.647 1.00 0.00 H new ATOM 0 HG11 VAL A 109 21.920 47.873 38.393 1.00 0.00 H new ATOM 0 HG12 VAL A 109 22.816 46.335 38.382 1.00 0.00 H new ATOM 0 HG13 VAL A 109 21.187 46.423 37.669 1.00 0.00 H new ATOM 0 HG21 VAL A 109 20.079 48.258 39.889 1.00 0.00 H new ATOM 0 HG22 VAL A 109 19.188 46.866 39.229 1.00 0.00 H new ATOM 0 HG23 VAL A 109 19.479 46.987 40.980 1.00 0.00 H new ATOM 1618 N ASN A 110 22.242 43.880 41.842 1.00 0.00 N ATOM 1619 CA ASN A 110 22.472 43.296 43.170 1.00 0.00 C ATOM 1620 C ASN A 110 23.809 43.726 43.819 1.00 0.00 C ATOM 1621 O ASN A 110 23.931 43.683 45.048 1.00 0.00 O ATOM 1622 CB ASN A 110 22.393 41.765 43.018 1.00 0.00 C ATOM 1623 CG ASN A 110 22.358 41.022 44.343 1.00 0.00 C ATOM 1624 OD1 ASN A 110 21.884 41.519 45.355 1.00 0.00 O ATOM 1625 ND2 ASN A 110 22.856 39.811 44.395 1.00 0.00 N ATOM 0 H ASN A 110 23.057 43.798 41.234 1.00 0.00 H new ATOM 0 HA ASN A 110 21.706 43.667 43.851 1.00 0.00 H new ATOM 0 HB2 ASN A 110 21.501 41.511 42.445 1.00 0.00 H new ATOM 0 HB3 ASN A 110 23.251 41.421 42.441 1.00 0.00 H new ATOM 0 HD21 ASN A 110 22.846 39.293 45.273 1.00 0.00 H new ATOM 0 HD22 ASN A 110 23.254 39.387 43.557 1.00 0.00 H new ATOM 1632 N ASN A 111 24.801 44.165 43.032 1.00 0.00 N ATOM 1633 CA ASN A 111 26.067 44.727 43.520 1.00 0.00 C ATOM 1634 C ASN A 111 26.549 45.938 42.686 1.00 0.00 C ATOM 1635 O ASN A 111 27.673 45.961 42.173 1.00 0.00 O ATOM 1636 CB ASN A 111 27.124 43.611 43.648 1.00 0.00 C ATOM 1637 CG ASN A 111 28.362 44.099 44.385 1.00 0.00 C ATOM 1638 OD1 ASN A 111 28.305 44.978 45.235 1.00 0.00 O ATOM 1639 ND2 ASN A 111 29.517 43.565 44.081 1.00 0.00 N ATOM 0 H ASN A 111 24.743 44.138 42.014 1.00 0.00 H new ATOM 0 HA ASN A 111 25.897 45.136 44.516 1.00 0.00 H new ATOM 0 HB2 ASN A 111 26.695 42.761 44.178 1.00 0.00 H new ATOM 0 HB3 ASN A 111 27.405 43.259 42.656 1.00 0.00 H new ATOM 0 HD21 ASN A 111 30.365 43.881 44.552 1.00 0.00 H new ATOM 0 HD22 ASN A 111 29.570 42.832 43.373 1.00 0.00 H new ATOM 1646 N ASN A 112 25.689 46.949 42.552 1.00 0.00 N ATOM 1647 CA ASN A 112 25.941 48.225 41.862 1.00 0.00 C ATOM 1648 C ASN A 112 25.429 49.439 42.676 1.00 0.00 C ATOM 1649 O ASN A 112 24.946 50.427 42.120 1.00 0.00 O ATOM 1650 CB ASN A 112 25.377 48.152 40.425 1.00 0.00 C ATOM 1651 CG ASN A 112 26.210 47.270 39.511 1.00 0.00 C ATOM 1652 OD1 ASN A 112 25.800 46.197 39.084 1.00 0.00 O ATOM 1653 ND2 ASN A 112 27.407 47.699 39.188 1.00 0.00 N ATOM 0 H ASN A 112 24.747 46.902 42.941 1.00 0.00 H new ATOM 0 HA ASN A 112 27.016 48.386 41.782 1.00 0.00 H new ATOM 0 HB2 ASN A 112 24.356 47.771 40.459 1.00 0.00 H new ATOM 0 HB3 ASN A 112 25.328 49.157 40.007 1.00 0.00 H new ATOM 0 HD21 ASN A 112 28.002 47.139 38.578 1.00 0.00 H new ATOM 0 HD22 ASN A 112 27.742 48.593 39.547 1.00 0.00 H new ATOM 1660 N ASP A 113 25.495 49.361 44.008 1.00 0.00 N ATOM 1661 CA ASP A 113 24.921 50.358 44.919 1.00 0.00 C ATOM 1662 C ASP A 113 25.762 51.637 45.072 1.00 0.00 C ATOM 1663 O ASP A 113 26.997 51.611 45.004 1.00 0.00 O ATOM 1664 CB ASP A 113 24.660 49.737 46.301 1.00 0.00 C ATOM 1665 CG ASP A 113 25.939 49.595 47.126 1.00 0.00 C ATOM 1666 OD1 ASP A 113 26.829 48.817 46.722 1.00 0.00 O ATOM 1667 OD2 ASP A 113 26.078 50.263 48.181 1.00 0.00 O ATOM 0 H ASP A 113 25.956 48.591 44.493 1.00 0.00 H new ATOM 0 HA ASP A 113 23.983 50.666 44.458 1.00 0.00 H new ATOM 0 HB2 ASP A 113 23.946 50.355 46.845 1.00 0.00 H new ATOM 0 HB3 ASP A 113 24.201 48.756 46.175 1.00 0.00 H new ATOM 1672 N PHE A 114 25.081 52.740 45.377 1.00 0.00 N ATOM 1673 CA PHE A 114 25.666 54.000 45.846 1.00 0.00 C ATOM 1674 C PHE A 114 24.821 54.576 46.996 1.00 0.00 C ATOM 1675 O PHE A 114 23.613 54.329 47.063 1.00 0.00 O ATOM 1676 CB PHE A 114 25.801 54.991 44.676 1.00 0.00 C ATOM 1677 CG PHE A 114 26.906 54.678 43.679 1.00 0.00 C ATOM 1678 CD1 PHE A 114 28.252 54.647 44.098 1.00 0.00 C ATOM 1679 CD2 PHE A 114 26.602 54.471 42.318 1.00 0.00 C ATOM 1680 CE1 PHE A 114 29.281 54.405 43.169 1.00 0.00 C ATOM 1681 CE2 PHE A 114 27.633 54.249 41.386 1.00 0.00 C ATOM 1682 CZ PHE A 114 28.974 54.219 41.809 1.00 0.00 C ATOM 0 H PHE A 114 24.065 52.785 45.302 1.00 0.00 H new ATOM 0 HA PHE A 114 26.668 53.815 46.233 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.852 55.027 44.141 1.00 0.00 H new ATOM 0 HB3 PHE A 114 25.975 55.987 45.084 1.00 0.00 H new ATOM 0 HD1 PHE A 114 28.495 54.810 45.138 1.00 0.00 H new ATOM 0 HD2 PHE A 114 25.573 54.483 41.989 1.00 0.00 H new ATOM 0 HE1 PHE A 114 30.308 54.362 43.501 1.00 0.00 H new ATOM 0 HE2 PHE A 114 27.394 54.101 40.343 1.00 0.00 H new ATOM 0 HZ PHE A 114 29.765 54.054 41.092 1.00 0.00 H new ATOM 1692 N SER A 115 25.454 55.337 47.898 1.00 0.00 N ATOM 1693 CA SER A 115 24.891 55.810 49.182 1.00 0.00 C ATOM 1694 C SER A 115 24.378 54.674 50.092 1.00 0.00 C ATOM 1695 O SER A 115 24.990 53.578 50.118 1.00 0.00 O ATOM 1696 CB SER A 115 23.845 56.911 48.928 1.00 0.00 C ATOM 1697 OG SER A 115 24.395 57.969 48.152 1.00 0.00 O ATOM 1698 OXT SER A 115 23.398 54.901 50.839 1.00 0.00 O ATOM 0 H SER A 115 26.412 55.656 47.753 1.00 0.00 H new ATOM 0 HA SER A 115 25.707 56.250 49.755 1.00 0.00 H new ATOM 0 HB2 SER A 115 22.984 56.487 48.412 1.00 0.00 H new ATOM 0 HB3 SER A 115 23.486 57.302 49.880 1.00 0.00 H new ATOM 0 HG SER A 115 23.711 58.655 48.003 1.00 0.00 H new TER 1704 SER A 115 HETATM 1705 FE1 FES A 201 32.787 33.706 36.663 1.00 0.00 FE HETATM 1706 FE2 FES A 201 31.961 31.403 36.104 1.00 0.00 FE HETATM 1707 S1 FES A 201 31.275 32.609 37.792 1.00 0.00 S HETATM 1708 S2 FES A 201 33.473 32.509 34.968 1.00 0.00 S