USER MOD reduce.3.24.130724 H: found=0, std=0, add=527, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 527 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 46 ASN : amide:sc= -0.217 K(o=-0.22,f=-2!) USER MOD Set 1.2: A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 22:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0298 X(o=-0.03,f=-0.03) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.0407 K(o=-0.041,f=-0.83) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0296) USER MOD Single : A 25 SER OG : rot 159:sc= 1.73 USER MOD Single : A 27 TYR OH : rot 30:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -1.31 K(o=-1.3,f=-2.9) USER MOD Single : A 31 MET CE :methyl 169:sc= -0.0582 (180deg=-0.287) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 34 ASN : amide:sc= -0.0224 X(o=-0.022,f=-0.1) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.104 K(o=-0.1,f=-0.99) USER MOD Single : A 43 GLN : amide:sc= -1.15 X(o=-1.1,f=-0.78) USER MOD Single : A 48 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.25) USER MOD Single : A 56 CYS SG : rot 84:sc= 0.64 USER MOD Single : A 58 SER OG : rot -40:sc= 0.149 USER MOD Single : A 59 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.5) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 18.267 40.991 33.141 1.00 0.00 N ATOM 2 CA PRO A 1 19.409 41.793 32.651 1.00 0.00 C ATOM 3 C PRO A 1 19.981 41.238 31.332 1.00 0.00 C ATOM 4 O PRO A 1 19.354 40.386 30.695 1.00 0.00 O ATOM 5 CB PRO A 1 20.423 41.852 33.813 1.00 0.00 C ATOM 6 CG PRO A 1 19.680 41.266 35.018 1.00 0.00 C ATOM 7 CD PRO A 1 18.224 41.283 34.578 1.00 0.00 C ATOM 0 H2 PRO A 1 18.406 39.996 32.965 1.00 0.00 H new ATOM 0 H3 PRO A 1 17.397 41.257 32.679 1.00 0.00 H new ATOM 0 HA PRO A 1 19.109 42.806 32.383 1.00 0.00 H new ATOM 0 HB2 PRO A 1 21.320 41.276 33.584 1.00 0.00 H new ATOM 0 HB3 PRO A 1 20.743 42.876 34.006 1.00 0.00 H new ATOM 0 HG2 PRO A 1 20.019 40.255 35.246 1.00 0.00 H new ATOM 0 HG3 PRO A 1 19.835 41.865 35.916 1.00 0.00 H new ATOM 0 HD2 PRO A 1 17.639 40.538 35.116 1.00 0.00 H new ATOM 0 HD3 PRO A 1 17.763 42.251 34.772 1.00 0.00 H new ATOM 17 N LYS A 2 21.158 41.720 30.898 1.00 0.00 N ATOM 18 CA LYS A 2 21.832 41.272 29.661 1.00 0.00 C ATOM 19 C LYS A 2 23.341 41.083 29.831 1.00 0.00 C ATOM 20 O LYS A 2 23.997 41.877 30.504 1.00 0.00 O ATOM 21 CB LYS A 2 21.504 42.234 28.504 1.00 0.00 C ATOM 22 CG LYS A 2 22.044 43.669 28.694 1.00 0.00 C ATOM 23 CD LYS A 2 20.994 44.768 28.485 1.00 0.00 C ATOM 24 CE LYS A 2 19.904 44.621 29.548 1.00 0.00 C ATOM 25 NZ LYS A 2 18.995 45.783 29.613 1.00 0.00 N ATOM 0 H LYS A 2 21.677 42.440 31.400 1.00 0.00 H new ATOM 0 HA LYS A 2 21.442 40.283 29.419 1.00 0.00 H new ATOM 0 HB2 LYS A 2 21.913 41.824 27.580 1.00 0.00 H new ATOM 0 HB3 LYS A 2 20.422 42.279 28.381 1.00 0.00 H new ATOM 0 HG2 LYS A 2 22.455 43.761 29.700 1.00 0.00 H new ATOM 0 HG3 LYS A 2 22.867 43.831 27.998 1.00 0.00 H new ATOM 0 HD2 LYS A 2 21.459 45.751 28.555 1.00 0.00 H new ATOM 0 HD3 LYS A 2 20.561 44.691 27.488 1.00 0.00 H new ATOM 0 HE2 LYS A 2 19.322 43.723 29.340 1.00 0.00 H new ATOM 0 HE3 LYS A 2 20.372 44.479 30.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 18.280 45.623 30.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 19.541 46.639 29.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 18.523 45.906 28.694 1.00 0.00 H new ATOM 39 N SER A 3 23.892 40.040 29.225 1.00 0.00 N ATOM 40 CA SER A 3 25.322 39.729 29.197 1.00 0.00 C ATOM 41 C SER A 3 25.646 38.823 28.009 1.00 0.00 C ATOM 42 O SER A 3 24.881 37.914 27.680 1.00 0.00 O ATOM 43 CB SER A 3 25.708 39.020 30.493 1.00 0.00 C ATOM 44 OG SER A 3 27.100 38.790 30.553 1.00 0.00 O ATOM 0 H SER A 3 23.333 39.355 28.716 1.00 0.00 H new ATOM 0 HA SER A 3 25.885 40.657 29.097 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.399 39.623 31.347 1.00 0.00 H new ATOM 0 HB3 SER A 3 25.176 38.071 30.564 1.00 0.00 H new ATOM 0 HG SER A 3 27.561 39.414 29.954 1.00 0.00 H new ATOM 50 N ARG A 4 26.795 39.047 27.370 1.00 0.00 N ATOM 51 CA ARG A 4 27.276 38.241 26.243 1.00 0.00 C ATOM 52 C ARG A 4 28.578 37.528 26.576 1.00 0.00 C ATOM 53 O ARG A 4 29.423 38.065 27.290 1.00 0.00 O ATOM 54 CB ARG A 4 27.332 39.078 24.956 1.00 0.00 C ATOM 55 CG ARG A 4 28.424 40.156 24.958 1.00 0.00 C ATOM 56 CD ARG A 4 28.416 40.992 23.677 1.00 0.00 C ATOM 57 NE ARG A 4 27.172 41.768 23.533 1.00 0.00 N ATOM 58 CZ ARG A 4 26.602 42.144 22.407 1.00 0.00 C ATOM 59 NH1 ARG A 4 27.168 41.967 21.251 1.00 0.00 N ATOM 60 NH2 ARG A 4 25.405 42.648 22.439 1.00 0.00 N ATOM 0 H ARG A 4 27.429 39.805 27.624 1.00 0.00 H new ATOM 0 HA ARG A 4 26.557 37.444 26.053 1.00 0.00 H new ATOM 0 HB2 ARG A 4 27.495 38.412 24.109 1.00 0.00 H new ATOM 0 HB3 ARG A 4 26.364 39.556 24.804 1.00 0.00 H new ATOM 0 HG2 ARG A 4 28.283 40.811 25.818 1.00 0.00 H new ATOM 0 HG3 ARG A 4 29.399 39.682 25.074 1.00 0.00 H new ATOM 0 HD2 ARG A 4 29.269 41.671 23.682 1.00 0.00 H new ATOM 0 HD3 ARG A 4 28.536 40.336 22.815 1.00 0.00 H new ATOM 0 HE ARG A 4 26.703 42.043 24.396 1.00 0.00 H new ATOM 0 HH11 ARG A 4 28.085 41.523 21.195 1.00 0.00 H new ATOM 0 HH12 ARG A 4 26.696 42.272 20.400 1.00 0.00 H new ATOM 0 HH21 ARG A 4 24.918 42.749 23.329 1.00 0.00 H new ATOM 0 HH22 ARG A 4 24.953 42.943 21.574 1.00 0.00 H new ATOM 74 N LEU A 5 28.734 36.330 26.028 1.00 0.00 N ATOM 75 CA LEU A 5 29.895 35.462 26.202 1.00 0.00 C ATOM 76 C LEU A 5 30.510 35.184 24.831 1.00 0.00 C ATOM 77 O LEU A 5 29.822 34.702 23.932 1.00 0.00 O ATOM 78 CB LEU A 5 29.428 34.186 26.921 1.00 0.00 C ATOM 79 CG LEU A 5 30.479 33.171 27.398 1.00 0.00 C ATOM 80 CD1 LEU A 5 31.158 32.382 26.284 1.00 0.00 C ATOM 81 CD2 LEU A 5 31.545 33.807 28.283 1.00 0.00 C ATOM 0 H LEU A 5 28.024 35.917 25.423 1.00 0.00 H new ATOM 0 HA LEU A 5 30.670 35.926 26.812 1.00 0.00 H new ATOM 0 HB2 LEU A 5 28.848 34.493 27.792 1.00 0.00 H new ATOM 0 HB3 LEU A 5 28.745 33.663 26.252 1.00 0.00 H new ATOM 0 HG LEU A 5 29.894 32.460 27.982 1.00 0.00 H new ATOM 0 HD11 LEU A 5 31.883 31.692 26.716 1.00 0.00 H new ATOM 0 HD12 LEU A 5 30.408 31.819 25.728 1.00 0.00 H new ATOM 0 HD13 LEU A 5 31.669 33.070 25.610 1.00 0.00 H new ATOM 0 HD21 LEU A 5 32.262 33.047 28.592 1.00 0.00 H new ATOM 0 HD22 LEU A 5 32.062 34.588 27.726 1.00 0.00 H new ATOM 0 HD23 LEU A 5 31.074 34.242 29.165 1.00 0.00 H new ATOM 93 N PHE A 6 31.796 35.483 24.682 1.00 0.00 N ATOM 94 CA PHE A 6 32.570 35.295 23.458 1.00 0.00 C ATOM 95 C PHE A 6 33.580 34.144 23.604 1.00 0.00 C ATOM 96 O PHE A 6 34.278 34.030 24.616 1.00 0.00 O ATOM 97 CB PHE A 6 33.232 36.634 23.105 1.00 0.00 C ATOM 98 CG PHE A 6 34.362 36.537 22.102 1.00 0.00 C ATOM 99 CD1 PHE A 6 34.194 35.850 20.882 1.00 0.00 C ATOM 100 CD2 PHE A 6 35.613 37.097 22.421 1.00 0.00 C ATOM 101 CE1 PHE A 6 35.294 35.664 20.026 1.00 0.00 C ATOM 102 CE2 PHE A 6 36.686 36.961 21.532 1.00 0.00 C ATOM 103 CZ PHE A 6 36.538 36.223 20.347 1.00 0.00 C ATOM 0 H PHE A 6 32.351 35.879 25.441 1.00 0.00 H new ATOM 0 HA PHE A 6 31.918 34.999 22.636 1.00 0.00 H new ATOM 0 HB2 PHE A 6 32.471 37.307 22.710 1.00 0.00 H new ATOM 0 HB3 PHE A 6 33.614 37.087 24.020 1.00 0.00 H new ATOM 0 HD1 PHE A 6 33.223 35.468 20.606 1.00 0.00 H new ATOM 0 HD2 PHE A 6 35.745 37.631 23.350 1.00 0.00 H new ATOM 0 HE1 PHE A 6 35.180 35.089 19.119 1.00 0.00 H new ATOM 0 HE2 PHE A 6 37.634 37.427 21.759 1.00 0.00 H new ATOM 0 HZ PHE A 6 37.380 36.087 19.685 1.00 0.00 H new ATOM 113 N ILE A 7 33.667 33.292 22.576 1.00 0.00 N ATOM 114 CA ILE A 7 34.560 32.127 22.518 1.00 0.00 C ATOM 115 C ILE A 7 35.917 32.508 21.888 1.00 0.00 C ATOM 116 O ILE A 7 36.204 32.211 20.725 1.00 0.00 O ATOM 117 CB ILE A 7 33.835 30.945 21.829 1.00 0.00 C ATOM 118 CG1 ILE A 7 32.467 30.611 22.462 1.00 0.00 C ATOM 119 CG2 ILE A 7 34.702 29.674 21.832 1.00 0.00 C ATOM 120 CD1 ILE A 7 32.517 30.211 23.942 1.00 0.00 C ATOM 0 H ILE A 7 33.100 33.397 21.734 1.00 0.00 H new ATOM 0 HA ILE A 7 34.804 31.785 23.524 1.00 0.00 H new ATOM 0 HB ILE A 7 33.661 31.278 20.806 1.00 0.00 H new ATOM 0 HG12 ILE A 7 31.814 31.478 22.357 1.00 0.00 H new ATOM 0 HG13 ILE A 7 32.011 29.798 21.897 1.00 0.00 H new ATOM 0 HG21 ILE A 7 34.162 28.864 21.341 1.00 0.00 H new ATOM 0 HG22 ILE A 7 35.632 29.867 21.298 1.00 0.00 H new ATOM 0 HG23 ILE A 7 34.926 29.389 22.860 1.00 0.00 H new ATOM 0 HD11 ILE A 7 31.508 29.996 24.295 1.00 0.00 H new ATOM 0 HD12 ILE A 7 33.139 29.324 24.058 1.00 0.00 H new ATOM 0 HD13 ILE A 7 32.939 31.029 24.526 1.00 0.00 H new ATOM 132 N GLY A 8 36.792 33.117 22.698 1.00 0.00 N ATOM 133 CA GLY A 8 38.184 33.453 22.346 1.00 0.00 C ATOM 134 C GLY A 8 39.100 32.246 22.074 1.00 0.00 C ATOM 135 O GLY A 8 40.248 32.401 21.664 1.00 0.00 O ATOM 0 H GLY A 8 36.546 33.400 23.647 1.00 0.00 H new ATOM 0 HA2 GLY A 8 38.175 34.089 21.461 1.00 0.00 H new ATOM 0 HA3 GLY A 8 38.615 34.041 23.156 1.00 0.00 H new ATOM 139 N ASN A 9 38.592 31.027 22.263 1.00 0.00 N ATOM 140 CA ASN A 9 39.205 29.753 21.873 1.00 0.00 C ATOM 141 C ASN A 9 39.352 29.559 20.339 1.00 0.00 C ATOM 142 O ASN A 9 40.038 28.632 19.912 1.00 0.00 O ATOM 143 CB ASN A 9 38.330 28.674 22.538 1.00 0.00 C ATOM 144 CG ASN A 9 38.712 27.239 22.242 1.00 0.00 C ATOM 145 OD1 ASN A 9 37.934 26.480 21.678 1.00 0.00 O ATOM 146 ND2 ASN A 9 39.867 26.812 22.682 1.00 0.00 N ATOM 0 H ASN A 9 37.689 30.893 22.719 1.00 0.00 H new ATOM 0 HA ASN A 9 40.240 29.703 22.210 1.00 0.00 H new ATOM 0 HB2 ASN A 9 38.361 28.823 23.617 1.00 0.00 H new ATOM 0 HB3 ASN A 9 37.297 28.827 22.225 1.00 0.00 H new ATOM 0 HD21 ASN A 9 40.131 25.835 22.557 1.00 0.00 H new ATOM 0 HD22 ASN A 9 40.504 27.456 23.150 1.00 0.00 H new ATOM 153 N LEU A 10 38.732 30.422 19.516 1.00 0.00 N ATOM 154 CA LEU A 10 38.796 30.415 18.040 1.00 0.00 C ATOM 155 C LEU A 10 38.541 29.019 17.408 1.00 0.00 C ATOM 156 O LEU A 10 39.429 28.453 16.763 1.00 0.00 O ATOM 157 CB LEU A 10 40.104 31.086 17.561 1.00 0.00 C ATOM 158 CG LEU A 10 40.285 32.561 17.978 1.00 0.00 C ATOM 159 CD1 LEU A 10 41.635 33.076 17.479 1.00 0.00 C ATOM 160 CD2 LEU A 10 39.190 33.475 17.422 1.00 0.00 C ATOM 0 H LEU A 10 38.147 31.177 19.874 1.00 0.00 H new ATOM 0 HA LEU A 10 37.964 31.015 17.672 1.00 0.00 H new ATOM 0 HB2 LEU A 10 40.948 30.512 17.944 1.00 0.00 H new ATOM 0 HB3 LEU A 10 40.145 31.026 16.473 1.00 0.00 H new ATOM 0 HG LEU A 10 40.228 32.586 19.066 1.00 0.00 H new ATOM 0 HD11 LEU A 10 41.759 34.118 17.775 1.00 0.00 H new ATOM 0 HD12 LEU A 10 42.436 32.477 17.913 1.00 0.00 H new ATOM 0 HD13 LEU A 10 41.674 33.001 16.392 1.00 0.00 H new ATOM 0 HD21 LEU A 10 39.370 34.499 17.749 1.00 0.00 H new ATOM 0 HD22 LEU A 10 39.200 33.434 16.333 1.00 0.00 H new ATOM 0 HD23 LEU A 10 38.218 33.143 17.788 1.00 0.00 H new ATOM 172 N PRO A 11 37.331 28.447 17.578 1.00 0.00 N ATOM 173 CA PRO A 11 36.964 27.083 17.174 1.00 0.00 C ATOM 174 C PRO A 11 36.683 26.938 15.660 1.00 0.00 C ATOM 175 O PRO A 11 35.703 26.315 15.256 1.00 0.00 O ATOM 176 CB PRO A 11 35.750 26.753 18.056 1.00 0.00 C ATOM 177 CG PRO A 11 35.035 28.097 18.132 1.00 0.00 C ATOM 178 CD PRO A 11 36.208 29.058 18.276 1.00 0.00 C ATOM 0 HA PRO A 11 37.783 26.379 17.321 1.00 0.00 H new ATOM 0 HB2 PRO A 11 35.121 25.981 17.612 1.00 0.00 H new ATOM 0 HB3 PRO A 11 36.048 26.393 19.041 1.00 0.00 H new ATOM 0 HG2 PRO A 11 34.446 28.300 17.237 1.00 0.00 H new ATOM 0 HG3 PRO A 11 34.354 28.152 18.981 1.00 0.00 H new ATOM 0 HD2 PRO A 11 35.967 30.031 17.847 1.00 0.00 H new ATOM 0 HD3 PRO A 11 36.448 29.223 19.326 1.00 0.00 H new ATOM 186 N LEU A 12 37.542 27.512 14.811 1.00 0.00 N ATOM 187 CA LEU A 12 37.347 27.736 13.367 1.00 0.00 C ATOM 188 C LEU A 12 36.892 26.509 12.547 1.00 0.00 C ATOM 189 O LEU A 12 36.289 26.691 11.482 1.00 0.00 O ATOM 190 CB LEU A 12 38.668 28.299 12.797 1.00 0.00 C ATOM 191 CG LEU A 12 39.068 29.692 13.329 1.00 0.00 C ATOM 192 CD1 LEU A 12 40.464 30.068 12.842 1.00 0.00 C ATOM 193 CD2 LEU A 12 38.111 30.788 12.866 1.00 0.00 C ATOM 0 H LEU A 12 38.448 27.855 15.129 1.00 0.00 H new ATOM 0 HA LEU A 12 36.516 28.435 13.271 1.00 0.00 H new ATOM 0 HB2 LEU A 12 39.471 27.597 13.021 1.00 0.00 H new ATOM 0 HB3 LEU A 12 38.584 28.352 11.711 1.00 0.00 H new ATOM 0 HG LEU A 12 39.035 29.622 14.416 1.00 0.00 H new ATOM 0 HD11 LEU A 12 40.730 31.053 13.226 1.00 0.00 H new ATOM 0 HD12 LEU A 12 41.184 29.332 13.199 1.00 0.00 H new ATOM 0 HD13 LEU A 12 40.476 30.088 11.752 1.00 0.00 H new ATOM 0 HD21 LEU A 12 38.436 31.748 13.267 1.00 0.00 H new ATOM 0 HD22 LEU A 12 38.108 30.832 11.777 1.00 0.00 H new ATOM 0 HD23 LEU A 12 37.105 30.567 13.223 1.00 0.00 H new ATOM 205 N LYS A 13 37.158 25.286 13.022 1.00 0.00 N ATOM 206 CA LYS A 13 36.790 23.990 12.423 1.00 0.00 C ATOM 207 C LYS A 13 36.063 23.036 13.388 1.00 0.00 C ATOM 208 O LYS A 13 35.760 21.915 12.988 1.00 0.00 O ATOM 209 CB LYS A 13 38.061 23.329 11.842 1.00 0.00 C ATOM 210 CG LYS A 13 38.739 24.117 10.708 1.00 0.00 C ATOM 211 CD LYS A 13 37.871 24.163 9.445 1.00 0.00 C ATOM 212 CE LYS A 13 38.512 25.058 8.387 1.00 0.00 C ATOM 213 NZ LYS A 13 37.635 25.168 7.205 1.00 0.00 N ATOM 0 H LYS A 13 37.671 25.164 13.895 1.00 0.00 H new ATOM 0 HA LYS A 13 36.068 24.193 11.632 1.00 0.00 H new ATOM 0 HB2 LYS A 13 38.781 23.188 12.648 1.00 0.00 H new ATOM 0 HB3 LYS A 13 37.800 22.338 11.471 1.00 0.00 H new ATOM 0 HG2 LYS A 13 38.944 25.133 11.045 1.00 0.00 H new ATOM 0 HG3 LYS A 13 39.700 23.659 10.472 1.00 0.00 H new ATOM 0 HD2 LYS A 13 37.742 23.156 9.048 1.00 0.00 H new ATOM 0 HD3 LYS A 13 36.878 24.537 9.693 1.00 0.00 H new ATOM 0 HE2 LYS A 13 38.698 26.048 8.803 1.00 0.00 H new ATOM 0 HE3 LYS A 13 39.479 24.649 8.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 38.085 25.780 6.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 37.479 24.223 6.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 36.722 25.579 7.487 1.00 0.00 H new ATOM 227 N ASN A 14 35.770 23.436 14.628 1.00 0.00 N ATOM 228 CA ASN A 14 35.044 22.630 15.624 1.00 0.00 C ATOM 229 C ASN A 14 33.982 23.479 16.345 1.00 0.00 C ATOM 230 O ASN A 14 34.054 23.700 17.556 1.00 0.00 O ATOM 231 CB ASN A 14 36.039 21.954 16.590 1.00 0.00 C ATOM 232 CG ASN A 14 35.368 21.006 17.579 1.00 0.00 C ATOM 233 OD1 ASN A 14 34.207 20.630 17.463 1.00 0.00 O ATOM 234 ND2 ASN A 14 36.084 20.543 18.573 1.00 0.00 N ATOM 0 H ASN A 14 36.037 24.355 14.981 1.00 0.00 H new ATOM 0 HA ASN A 14 34.502 21.831 15.118 1.00 0.00 H new ATOM 0 HB2 ASN A 14 36.778 21.401 16.011 1.00 0.00 H new ATOM 0 HB3 ASN A 14 36.578 22.723 17.143 1.00 0.00 H new ATOM 0 HD21 ASN A 14 35.674 19.882 19.233 1.00 0.00 H new ATOM 0 HD22 ASN A 14 37.052 20.843 18.687 1.00 0.00 H new ATOM 241 N VAL A 15 33.018 23.990 15.578 1.00 0.00 N ATOM 242 CA VAL A 15 31.998 24.940 16.037 1.00 0.00 C ATOM 243 C VAL A 15 30.586 24.410 15.752 1.00 0.00 C ATOM 244 O VAL A 15 30.206 24.163 14.605 1.00 0.00 O ATOM 245 CB VAL A 15 32.298 26.347 15.475 1.00 0.00 C ATOM 246 CG1 VAL A 15 32.244 26.469 13.945 1.00 0.00 C ATOM 247 CG2 VAL A 15 31.411 27.417 16.102 1.00 0.00 C ATOM 0 H VAL A 15 32.921 23.749 14.592 1.00 0.00 H new ATOM 0 HA VAL A 15 32.037 25.043 17.121 1.00 0.00 H new ATOM 0 HB VAL A 15 33.337 26.513 15.758 1.00 0.00 H new ATOM 0 HG11 VAL A 15 32.469 27.495 13.654 1.00 0.00 H new ATOM 0 HG12 VAL A 15 32.977 25.796 13.500 1.00 0.00 H new ATOM 0 HG13 VAL A 15 31.247 26.203 13.594 1.00 0.00 H new ATOM 0 HG21 VAL A 15 31.658 28.390 15.676 1.00 0.00 H new ATOM 0 HG22 VAL A 15 30.365 27.187 15.899 1.00 0.00 H new ATOM 0 HG23 VAL A 15 31.575 27.440 17.179 1.00 0.00 H new ATOM 257 N SER A 16 29.821 24.201 16.826 1.00 0.00 N ATOM 258 CA SER A 16 28.433 23.709 16.840 1.00 0.00 C ATOM 259 C SER A 16 27.731 24.173 18.121 1.00 0.00 C ATOM 260 O SER A 16 28.395 24.365 19.145 1.00 0.00 O ATOM 261 CB SER A 16 28.415 22.178 16.780 1.00 0.00 C ATOM 262 OG SER A 16 27.106 21.692 17.017 1.00 0.00 O ATOM 0 H SER A 16 30.171 24.380 17.767 1.00 0.00 H new ATOM 0 HA SER A 16 27.911 24.109 15.971 1.00 0.00 H new ATOM 0 HB2 SER A 16 28.764 21.841 15.804 1.00 0.00 H new ATOM 0 HB3 SER A 16 29.102 21.770 17.522 1.00 0.00 H new ATOM 0 HG SER A 16 27.108 20.713 16.974 1.00 0.00 H new ATOM 268 N LYS A 17 26.401 24.345 18.093 1.00 0.00 N ATOM 269 CA LYS A 17 25.587 24.788 19.248 1.00 0.00 C ATOM 270 C LYS A 17 25.857 23.972 20.520 1.00 0.00 C ATOM 271 O LYS A 17 25.888 24.539 21.612 1.00 0.00 O ATOM 272 CB LYS A 17 24.090 24.731 18.885 1.00 0.00 C ATOM 273 CG LYS A 17 23.687 25.853 17.910 1.00 0.00 C ATOM 274 CD LYS A 17 22.202 25.835 17.513 1.00 0.00 C ATOM 275 CE LYS A 17 21.788 24.558 16.772 1.00 0.00 C ATOM 276 NZ LYS A 17 22.478 24.421 15.471 1.00 0.00 N ATOM 0 H LYS A 17 25.845 24.178 17.254 1.00 0.00 H new ATOM 0 HA LYS A 17 25.878 25.815 19.469 1.00 0.00 H new ATOM 0 HB2 LYS A 17 23.863 23.763 18.437 1.00 0.00 H new ATOM 0 HB3 LYS A 17 23.494 24.810 19.794 1.00 0.00 H new ATOM 0 HG2 LYS A 17 23.919 26.816 18.365 1.00 0.00 H new ATOM 0 HG3 LYS A 17 24.294 25.772 17.008 1.00 0.00 H new ATOM 0 HD2 LYS A 17 21.592 25.940 18.410 1.00 0.00 H new ATOM 0 HD3 LYS A 17 21.991 26.698 16.881 1.00 0.00 H new ATOM 0 HE2 LYS A 17 22.011 23.691 17.393 1.00 0.00 H new ATOM 0 HE3 LYS A 17 20.710 24.566 16.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 22.119 23.581 14.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 22.300 25.267 14.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 23.501 24.319 15.630 1.00 0.00 H new ATOM 290 N GLU A 18 26.148 22.676 20.391 1.00 0.00 N ATOM 291 CA GLU A 18 26.471 21.819 21.539 1.00 0.00 C ATOM 292 C GLU A 18 27.822 22.160 22.202 1.00 0.00 C ATOM 293 O GLU A 18 28.014 21.854 23.376 1.00 0.00 O ATOM 294 CB GLU A 18 26.424 20.339 21.124 1.00 0.00 C ATOM 295 CG GLU A 18 26.150 19.427 22.334 1.00 0.00 C ATOM 296 CD GLU A 18 26.439 17.964 22.007 1.00 0.00 C ATOM 297 OE1 GLU A 18 27.640 17.605 21.991 1.00 0.00 O ATOM 298 OE2 GLU A 18 25.482 17.181 21.775 1.00 0.00 O ATOM 0 H GLU A 18 26.167 22.191 19.494 1.00 0.00 H new ATOM 0 HA GLU A 18 25.710 22.011 22.296 1.00 0.00 H new ATOM 0 HB2 GLU A 18 25.647 20.194 20.373 1.00 0.00 H new ATOM 0 HB3 GLU A 18 27.370 20.059 20.661 1.00 0.00 H new ATOM 0 HG2 GLU A 18 26.767 19.742 23.176 1.00 0.00 H new ATOM 0 HG3 GLU A 18 25.110 19.533 22.644 1.00 0.00 H new ATOM 305 N ASP A 19 28.765 22.809 21.510 1.00 0.00 N ATOM 306 CA ASP A 19 30.020 23.274 22.120 1.00 0.00 C ATOM 307 C ASP A 19 29.784 24.505 23.010 1.00 0.00 C ATOM 308 O ASP A 19 30.369 24.630 24.081 1.00 0.00 O ATOM 309 CB ASP A 19 31.069 23.562 21.031 1.00 0.00 C ATOM 310 CG ASP A 19 32.500 23.609 21.589 1.00 0.00 C ATOM 311 OD1 ASP A 19 32.898 22.651 22.297 1.00 0.00 O ATOM 312 OD2 ASP A 19 33.264 24.552 21.266 1.00 0.00 O ATOM 0 H ASP A 19 28.683 23.027 20.517 1.00 0.00 H new ATOM 0 HA ASP A 19 30.404 22.481 22.761 1.00 0.00 H new ATOM 0 HB2 ASP A 19 31.008 22.793 20.260 1.00 0.00 H new ATOM 0 HB3 ASP A 19 30.838 24.513 20.551 1.00 0.00 H new ATOM 317 N LEU A 20 28.854 25.383 22.622 1.00 0.00 N ATOM 318 CA LEU A 20 28.428 26.528 23.440 1.00 0.00 C ATOM 319 C LEU A 20 27.596 26.048 24.641 1.00 0.00 C ATOM 320 O LEU A 20 27.814 26.507 25.761 1.00 0.00 O ATOM 321 CB LEU A 20 27.670 27.536 22.546 1.00 0.00 C ATOM 322 CG LEU A 20 28.548 28.549 21.782 1.00 0.00 C ATOM 323 CD1 LEU A 20 28.901 29.757 22.648 1.00 0.00 C ATOM 324 CD2 LEU A 20 29.861 27.968 21.249 1.00 0.00 C ATOM 0 H LEU A 20 28.371 25.321 21.726 1.00 0.00 H new ATOM 0 HA LEU A 20 29.296 27.042 23.854 1.00 0.00 H new ATOM 0 HB2 LEU A 20 27.079 26.977 21.821 1.00 0.00 H new ATOM 0 HB3 LEU A 20 26.968 28.090 23.170 1.00 0.00 H new ATOM 0 HG LEU A 20 27.930 28.841 20.933 1.00 0.00 H new ATOM 0 HD11 LEU A 20 29.520 30.447 22.075 1.00 0.00 H new ATOM 0 HD12 LEU A 20 27.986 30.262 22.958 1.00 0.00 H new ATOM 0 HD13 LEU A 20 29.449 29.425 23.530 1.00 0.00 H new ATOM 0 HD21 LEU A 20 30.417 28.746 20.726 1.00 0.00 H new ATOM 0 HD22 LEU A 20 30.457 27.593 22.081 1.00 0.00 H new ATOM 0 HD23 LEU A 20 29.644 27.151 20.561 1.00 0.00 H new ATOM 336 N PHE A 21 26.712 25.069 24.427 1.00 0.00 N ATOM 337 CA PHE A 21 25.876 24.481 25.477 1.00 0.00 C ATOM 338 C PHE A 21 26.677 23.643 26.492 1.00 0.00 C ATOM 339 O PHE A 21 26.390 23.697 27.691 1.00 0.00 O ATOM 340 CB PHE A 21 24.776 23.649 24.804 1.00 0.00 C ATOM 341 CG PHE A 21 23.645 23.232 25.726 1.00 0.00 C ATOM 342 CD1 PHE A 21 23.796 22.128 26.585 1.00 0.00 C ATOM 343 CD2 PHE A 21 22.427 23.937 25.711 1.00 0.00 C ATOM 344 CE1 PHE A 21 22.741 21.737 27.428 1.00 0.00 C ATOM 345 CE2 PHE A 21 21.364 23.527 26.533 1.00 0.00 C ATOM 346 CZ PHE A 21 21.518 22.424 27.390 1.00 0.00 C ATOM 0 H PHE A 21 26.555 24.657 23.507 1.00 0.00 H new ATOM 0 HA PHE A 21 25.436 25.288 26.062 1.00 0.00 H new ATOM 0 HB2 PHE A 21 24.359 24.223 23.976 1.00 0.00 H new ATOM 0 HB3 PHE A 21 25.227 22.754 24.376 1.00 0.00 H new ATOM 0 HD1 PHE A 21 24.726 21.579 26.597 1.00 0.00 H new ATOM 0 HD2 PHE A 21 22.309 24.795 25.066 1.00 0.00 H new ATOM 0 HE1 PHE A 21 22.872 20.907 28.106 1.00 0.00 H new ATOM 0 HE2 PHE A 21 20.426 24.061 26.506 1.00 0.00 H new ATOM 0 HZ PHE A 21 20.698 22.106 28.017 1.00 0.00 H new ATOM 356 N ARG A 22 27.695 22.878 26.056 1.00 0.00 N ATOM 357 CA ARG A 22 28.573 22.122 26.976 1.00 0.00 C ATOM 358 C ARG A 22 29.474 23.040 27.799 1.00 0.00 C ATOM 359 O ARG A 22 29.824 22.683 28.925 1.00 0.00 O ATOM 360 CB ARG A 22 29.363 21.014 26.247 1.00 0.00 C ATOM 361 CG ARG A 22 30.647 21.465 25.521 1.00 0.00 C ATOM 362 CD ARG A 22 31.927 21.296 26.356 1.00 0.00 C ATOM 363 NE ARG A 22 32.343 19.885 26.422 1.00 0.00 N ATOM 364 CZ ARG A 22 33.209 19.322 27.243 1.00 0.00 C ATOM 365 NH1 ARG A 22 33.682 19.924 28.297 1.00 0.00 N ATOM 366 NH2 ARG A 22 33.603 18.108 27.010 1.00 0.00 N ATOM 0 H ARG A 22 27.932 22.765 25.070 1.00 0.00 H new ATOM 0 HA ARG A 22 27.921 21.616 27.688 1.00 0.00 H new ATOM 0 HB2 ARG A 22 29.631 20.248 26.974 1.00 0.00 H new ATOM 0 HB3 ARG A 22 28.703 20.544 25.518 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.750 20.895 24.597 1.00 0.00 H new ATOM 0 HG3 ARG A 22 30.544 22.513 25.239 1.00 0.00 H new ATOM 0 HD2 ARG A 22 32.728 21.893 25.921 1.00 0.00 H new ATOM 0 HD3 ARG A 22 31.758 21.675 27.364 1.00 0.00 H new ATOM 0 HE ARG A 22 31.904 19.261 25.744 1.00 0.00 H new ATOM 0 HH11 ARG A 22 33.384 20.874 28.518 1.00 0.00 H new ATOM 0 HH12 ARG A 22 34.350 19.445 28.901 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.244 17.602 26.201 1.00 0.00 H new ATOM 0 HH22 ARG A 22 34.272 17.660 27.636 1.00 0.00 H new ATOM 380 N ILE A 23 29.813 24.217 27.265 1.00 0.00 N ATOM 381 CA ILE A 23 30.467 25.306 27.996 1.00 0.00 C ATOM 382 C ILE A 23 29.471 25.876 29.016 1.00 0.00 C ATOM 383 O ILE A 23 29.556 25.515 30.193 1.00 0.00 O ATOM 384 CB ILE A 23 31.090 26.325 27.005 1.00 0.00 C ATOM 385 CG1 ILE A 23 32.340 25.695 26.346 1.00 0.00 C ATOM 386 CG2 ILE A 23 31.468 27.664 27.663 1.00 0.00 C ATOM 387 CD1 ILE A 23 32.851 26.471 25.124 1.00 0.00 C ATOM 0 H ILE A 23 29.635 24.445 26.287 1.00 0.00 H new ATOM 0 HA ILE A 23 31.320 24.956 28.578 1.00 0.00 H new ATOM 0 HB ILE A 23 30.329 26.551 26.258 1.00 0.00 H new ATOM 0 HG12 ILE A 23 33.138 25.634 27.086 1.00 0.00 H new ATOM 0 HG13 ILE A 23 32.105 24.674 26.045 1.00 0.00 H new ATOM 0 HG21 ILE A 23 31.898 28.329 26.914 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.577 28.125 28.089 1.00 0.00 H new ATOM 0 HG23 ILE A 23 32.198 27.488 28.453 1.00 0.00 H new ATOM 0 HD11 ILE A 23 33.729 25.970 24.716 1.00 0.00 H new ATOM 0 HD12 ILE A 23 32.070 26.510 24.365 1.00 0.00 H new ATOM 0 HD13 ILE A 23 33.118 27.485 25.422 1.00 0.00 H new ATOM 399 N PHE A 24 28.501 26.706 28.605 1.00 0.00 N ATOM 400 CA PHE A 24 27.568 27.389 29.515 1.00 0.00 C ATOM 401 C PHE A 24 26.119 26.961 29.262 1.00 0.00 C ATOM 402 O PHE A 24 25.508 27.302 28.252 1.00 0.00 O ATOM 403 CB PHE A 24 27.702 28.920 29.424 1.00 0.00 C ATOM 404 CG PHE A 24 28.926 29.596 30.030 1.00 0.00 C ATOM 405 CD1 PHE A 24 30.013 28.875 30.566 1.00 0.00 C ATOM 406 CD2 PHE A 24 28.973 31.002 30.046 1.00 0.00 C ATOM 407 CE1 PHE A 24 31.168 29.537 31.000 1.00 0.00 C ATOM 408 CE2 PHE A 24 30.109 31.669 30.538 1.00 0.00 C ATOM 409 CZ PHE A 24 31.220 30.934 30.972 1.00 0.00 C ATOM 0 H PHE A 24 28.340 26.925 27.622 1.00 0.00 H new ATOM 0 HA PHE A 24 27.838 27.088 30.527 1.00 0.00 H new ATOM 0 HB2 PHE A 24 27.667 29.190 28.369 1.00 0.00 H new ATOM 0 HB3 PHE A 24 26.820 29.355 29.894 1.00 0.00 H new ATOM 0 HD1 PHE A 24 29.954 27.799 30.643 1.00 0.00 H new ATOM 0 HD2 PHE A 24 28.132 31.572 29.679 1.00 0.00 H new ATOM 0 HE1 PHE A 24 32.016 28.970 31.355 1.00 0.00 H new ATOM 0 HE2 PHE A 24 30.125 32.748 30.581 1.00 0.00 H new ATOM 0 HZ PHE A 24 32.117 31.447 31.285 1.00 0.00 H new ATOM 419 N SER A 25 25.556 26.255 30.242 1.00 0.00 N ATOM 420 CA SER A 25 24.128 25.949 30.363 1.00 0.00 C ATOM 421 C SER A 25 23.731 25.563 31.807 1.00 0.00 C ATOM 422 O SER A 25 22.752 26.115 32.311 1.00 0.00 O ATOM 423 CB SER A 25 23.750 24.854 29.355 1.00 0.00 C ATOM 424 OG SER A 25 22.392 24.490 29.466 1.00 0.00 O ATOM 0 H SER A 25 26.105 25.863 31.007 1.00 0.00 H new ATOM 0 HA SER A 25 23.563 26.852 30.130 1.00 0.00 H new ATOM 0 HB2 SER A 25 23.951 25.206 28.343 1.00 0.00 H new ATOM 0 HB3 SER A 25 24.376 23.977 29.518 1.00 0.00 H new ATOM 0 HG SER A 25 22.098 24.064 28.634 1.00 0.00 H new ATOM 430 N PRO A 26 24.486 24.719 32.553 1.00 0.00 N ATOM 431 CA PRO A 26 24.040 24.206 33.858 1.00 0.00 C ATOM 432 C PRO A 26 24.391 25.089 35.068 1.00 0.00 C ATOM 433 O PRO A 26 24.359 24.631 36.209 1.00 0.00 O ATOM 434 CB PRO A 26 24.618 22.795 33.947 1.00 0.00 C ATOM 435 CG PRO A 26 25.952 22.945 33.235 1.00 0.00 C ATOM 436 CD PRO A 26 25.652 23.948 32.125 1.00 0.00 C ATOM 0 HA PRO A 26 22.951 24.207 33.908 1.00 0.00 H new ATOM 0 HB2 PRO A 26 24.743 22.471 34.980 1.00 0.00 H new ATOM 0 HB3 PRO A 26 23.977 22.061 33.458 1.00 0.00 H new ATOM 0 HG2 PRO A 26 26.727 23.311 33.908 1.00 0.00 H new ATOM 0 HG3 PRO A 26 26.302 21.994 32.833 1.00 0.00 H new ATOM 0 HD2 PRO A 26 26.507 24.603 31.955 1.00 0.00 H new ATOM 0 HD3 PRO A 26 25.452 23.435 31.185 1.00 0.00 H new ATOM 444 N TYR A 27 24.732 26.359 34.837 1.00 0.00 N ATOM 445 CA TYR A 27 25.141 27.313 35.875 1.00 0.00 C ATOM 446 C TYR A 27 23.974 28.118 36.484 1.00 0.00 C ATOM 447 O TYR A 27 24.206 28.954 37.355 1.00 0.00 O ATOM 448 CB TYR A 27 26.236 28.224 35.297 1.00 0.00 C ATOM 449 CG TYR A 27 27.624 27.612 35.251 1.00 0.00 C ATOM 450 CD1 TYR A 27 28.045 26.860 34.136 1.00 0.00 C ATOM 451 CD2 TYR A 27 28.508 27.819 36.328 1.00 0.00 C ATOM 452 CE1 TYR A 27 29.343 26.313 34.101 1.00 0.00 C ATOM 453 CE2 TYR A 27 29.807 27.279 36.294 1.00 0.00 C ATOM 454 CZ TYR A 27 30.228 26.521 35.181 1.00 0.00 C ATOM 455 OH TYR A 27 31.466 25.964 35.184 1.00 0.00 O ATOM 0 H TYR A 27 24.732 26.764 33.901 1.00 0.00 H new ATOM 0 HA TYR A 27 25.536 26.745 36.717 1.00 0.00 H new ATOM 0 HB2 TYR A 27 25.950 28.514 34.286 1.00 0.00 H new ATOM 0 HB3 TYR A 27 26.278 29.137 35.890 1.00 0.00 H new ATOM 0 HD1 TYR A 27 27.371 26.703 33.307 1.00 0.00 H new ATOM 0 HD2 TYR A 27 28.187 28.395 37.184 1.00 0.00 H new ATOM 0 HE1 TYR A 27 29.661 25.734 33.247 1.00 0.00 H new ATOM 0 HE2 TYR A 27 30.482 27.445 37.120 1.00 0.00 H new ATOM 0 HH TYR A 27 31.785 25.870 34.262 1.00 0.00 H new ATOM 465 N GLY A 28 22.725 27.885 36.066 1.00 0.00 N ATOM 466 CA GLY A 28 21.565 28.646 36.552 1.00 0.00 C ATOM 467 C GLY A 28 21.428 30.036 35.925 1.00 0.00 C ATOM 468 O GLY A 28 20.762 30.913 36.482 1.00 0.00 O ATOM 0 H GLY A 28 22.488 27.166 35.383 1.00 0.00 H new ATOM 0 HA2 GLY A 28 20.658 28.076 36.350 1.00 0.00 H new ATOM 0 HA3 GLY A 28 21.640 28.752 37.634 1.00 0.00 H new ATOM 472 N HIS A 29 22.066 30.270 34.779 1.00 0.00 N ATOM 473 CA HIS A 29 21.897 31.472 33.966 1.00 0.00 C ATOM 474 C HIS A 29 21.824 31.098 32.486 1.00 0.00 C ATOM 475 O HIS A 29 22.553 30.225 32.019 1.00 0.00 O ATOM 476 CB HIS A 29 23.008 32.477 34.273 1.00 0.00 C ATOM 477 CG HIS A 29 24.354 32.097 33.721 1.00 0.00 C ATOM 478 ND1 HIS A 29 25.228 31.152 34.255 1.00 0.00 N ATOM 479 CD2 HIS A 29 24.899 32.609 32.586 1.00 0.00 C ATOM 480 CE1 HIS A 29 26.280 31.117 33.426 1.00 0.00 C ATOM 481 NE2 HIS A 29 26.103 31.969 32.405 1.00 0.00 N ATOM 0 H HIS A 29 22.733 29.610 34.380 1.00 0.00 H new ATOM 0 HA HIS A 29 20.954 31.959 34.217 1.00 0.00 H new ATOM 0 HB2 HIS A 29 22.724 33.449 33.870 1.00 0.00 H new ATOM 0 HB3 HIS A 29 23.090 32.591 35.354 1.00 0.00 H new ATOM 0 HD2 HIS A 29 24.470 33.370 31.950 1.00 0.00 H new ATOM 0 HE1 HIS A 29 27.149 30.490 33.561 1.00 0.00 H new ATOM 0 HE2 HIS A 29 26.749 32.117 31.629 1.00 0.00 H new ATOM 489 N ILE A 30 20.899 31.732 31.768 1.00 0.00 N ATOM 490 CA ILE A 30 20.533 31.385 30.393 1.00 0.00 C ATOM 491 C ILE A 30 19.876 32.596 29.716 1.00 0.00 C ATOM 492 O ILE A 30 19.441 33.514 30.409 1.00 0.00 O ATOM 493 CB ILE A 30 19.601 30.138 30.422 1.00 0.00 C ATOM 494 CG1 ILE A 30 19.911 29.181 29.259 1.00 0.00 C ATOM 495 CG2 ILE A 30 18.100 30.481 30.449 1.00 0.00 C ATOM 496 CD1 ILE A 30 21.179 28.356 29.513 1.00 0.00 C ATOM 0 H ILE A 30 20.368 32.522 32.135 1.00 0.00 H new ATOM 0 HA ILE A 30 21.415 31.129 29.806 1.00 0.00 H new ATOM 0 HB ILE A 30 19.819 29.638 31.366 1.00 0.00 H new ATOM 0 HG12 ILE A 30 19.066 28.509 29.108 1.00 0.00 H new ATOM 0 HG13 ILE A 30 20.030 29.755 28.340 1.00 0.00 H new ATOM 0 HG21 ILE A 30 17.517 29.560 30.468 1.00 0.00 H new ATOM 0 HG22 ILE A 30 17.877 31.070 31.339 1.00 0.00 H new ATOM 0 HG23 ILE A 30 17.842 31.055 29.559 1.00 0.00 H new ATOM 0 HD11 ILE A 30 21.359 27.694 28.665 1.00 0.00 H new ATOM 0 HD12 ILE A 30 22.030 29.026 29.637 1.00 0.00 H new ATOM 0 HD13 ILE A 30 21.051 27.761 30.417 1.00 0.00 H new ATOM 508 N MET A 31 19.779 32.605 28.383 1.00 0.00 N ATOM 509 CA MET A 31 18.699 33.286 27.647 1.00 0.00 C ATOM 510 C MET A 31 18.651 32.800 26.192 1.00 0.00 C ATOM 511 O MET A 31 17.714 32.099 25.813 1.00 0.00 O ATOM 512 CB MET A 31 18.789 34.829 27.715 1.00 0.00 C ATOM 513 CG MET A 31 17.564 35.520 27.117 1.00 0.00 C ATOM 514 SD MET A 31 15.981 35.034 27.845 1.00 0.00 S ATOM 515 CE MET A 31 16.289 35.395 29.596 1.00 0.00 C ATOM 0 H MET A 31 20.452 32.137 27.775 1.00 0.00 H new ATOM 0 HA MET A 31 17.767 33.018 28.144 1.00 0.00 H new ATOM 0 HB2 MET A 31 18.903 35.136 28.755 1.00 0.00 H new ATOM 0 HB3 MET A 31 19.682 35.160 27.185 1.00 0.00 H new ATOM 0 HG2 MET A 31 17.683 36.598 27.229 1.00 0.00 H new ATOM 0 HG3 MET A 31 17.534 35.312 26.047 1.00 0.00 H new ATOM 0 HE1 MET A 31 15.352 35.336 30.150 1.00 0.00 H new ATOM 0 HE2 MET A 31 16.995 34.669 29.998 1.00 0.00 H new ATOM 0 HE3 MET A 31 16.705 36.398 29.693 1.00 0.00 H new ATOM 525 N GLN A 32 19.675 33.113 25.392 1.00 0.00 N ATOM 526 CA GLN A 32 19.741 32.874 23.947 1.00 0.00 C ATOM 527 C GLN A 32 21.139 32.395 23.505 1.00 0.00 C ATOM 528 O GLN A 32 22.163 32.860 24.014 1.00 0.00 O ATOM 529 CB GLN A 32 19.344 34.195 23.261 1.00 0.00 C ATOM 530 CG GLN A 32 19.375 34.159 21.729 1.00 0.00 C ATOM 531 CD GLN A 32 18.818 35.428 21.091 1.00 0.00 C ATOM 532 OE1 GLN A 32 18.687 36.480 21.712 1.00 0.00 O ATOM 533 NE2 GLN A 32 18.483 35.372 19.825 1.00 0.00 N ATOM 0 H GLN A 32 20.519 33.560 25.750 1.00 0.00 H new ATOM 0 HA GLN A 32 19.060 32.073 23.661 1.00 0.00 H new ATOM 0 HB2 GLN A 32 18.339 34.468 23.584 1.00 0.00 H new ATOM 0 HB3 GLN A 32 20.014 34.983 23.605 1.00 0.00 H new ATOM 0 HG2 GLN A 32 20.402 34.012 21.395 1.00 0.00 H new ATOM 0 HG3 GLN A 32 18.801 33.301 21.380 1.00 0.00 H new ATOM 0 HE21 GLN A 32 18.591 34.500 19.307 1.00 0.00 H new ATOM 0 HE22 GLN A 32 18.115 36.201 19.358 1.00 0.00 H new ATOM 542 N ILE A 33 21.194 31.496 22.517 1.00 0.00 N ATOM 543 CA ILE A 33 22.444 31.055 21.868 1.00 0.00 C ATOM 544 C ILE A 33 22.553 31.627 20.445 1.00 0.00 C ATOM 545 O ILE A 33 21.543 31.759 19.749 1.00 0.00 O ATOM 546 CB ILE A 33 22.630 29.520 21.937 1.00 0.00 C ATOM 547 CG1 ILE A 33 21.557 28.736 21.152 1.00 0.00 C ATOM 548 CG2 ILE A 33 22.676 29.066 23.410 1.00 0.00 C ATOM 549 CD1 ILE A 33 21.772 27.218 21.163 1.00 0.00 C ATOM 0 H ILE A 33 20.362 31.045 22.136 1.00 0.00 H new ATOM 0 HA ILE A 33 23.282 31.465 22.432 1.00 0.00 H new ATOM 0 HB ILE A 33 23.579 29.291 21.451 1.00 0.00 H new ATOM 0 HG12 ILE A 33 20.577 28.958 21.573 1.00 0.00 H new ATOM 0 HG13 ILE A 33 21.547 29.085 20.120 1.00 0.00 H new ATOM 0 HG21 ILE A 33 22.807 27.985 23.454 1.00 0.00 H new ATOM 0 HG22 ILE A 33 23.510 29.553 23.915 1.00 0.00 H new ATOM 0 HG23 ILE A 33 21.743 29.339 23.904 1.00 0.00 H new ATOM 0 HD11 ILE A 33 20.980 26.734 20.592 1.00 0.00 H new ATOM 0 HD12 ILE A 33 22.738 26.984 20.715 1.00 0.00 H new ATOM 0 HD13 ILE A 33 21.752 26.855 22.191 1.00 0.00 H new ATOM 561 N ASN A 34 23.767 32.014 20.036 1.00 0.00 N ATOM 562 CA ASN A 34 24.039 32.717 18.778 1.00 0.00 C ATOM 563 C ASN A 34 25.401 32.277 18.197 1.00 0.00 C ATOM 564 O ASN A 34 26.403 32.991 18.258 1.00 0.00 O ATOM 565 CB ASN A 34 23.929 34.231 19.054 1.00 0.00 C ATOM 566 CG ASN A 34 24.283 35.085 17.852 1.00 0.00 C ATOM 567 OD1 ASN A 34 25.228 35.851 17.872 1.00 0.00 O ATOM 568 ND2 ASN A 34 23.528 35.016 16.782 1.00 0.00 N ATOM 0 H ASN A 34 24.609 31.842 20.586 1.00 0.00 H new ATOM 0 HA ASN A 34 23.310 32.464 18.008 1.00 0.00 H new ATOM 0 HB2 ASN A 34 22.912 34.463 19.370 1.00 0.00 H new ATOM 0 HB3 ASN A 34 24.587 34.491 19.883 1.00 0.00 H new ATOM 0 HD21 ASN A 34 23.735 35.602 15.973 1.00 0.00 H new ATOM 0 HD22 ASN A 34 22.734 34.376 16.758 1.00 0.00 H new ATOM 575 N ILE A 35 25.465 31.050 17.674 1.00 0.00 N ATOM 576 CA ILE A 35 26.708 30.472 17.154 1.00 0.00 C ATOM 577 C ILE A 35 26.922 30.748 15.656 1.00 0.00 C ATOM 578 O ILE A 35 26.004 30.650 14.836 1.00 0.00 O ATOM 579 CB ILE A 35 26.844 28.992 17.559 1.00 0.00 C ATOM 580 CG1 ILE A 35 28.338 28.688 17.757 1.00 0.00 C ATOM 581 CG2 ILE A 35 26.184 28.021 16.571 1.00 0.00 C ATOM 582 CD1 ILE A 35 28.613 27.238 18.124 1.00 0.00 C ATOM 0 H ILE A 35 24.659 30.430 17.599 1.00 0.00 H new ATOM 0 HA ILE A 35 27.539 30.991 17.631 1.00 0.00 H new ATOM 0 HB ILE A 35 26.301 28.836 18.491 1.00 0.00 H new ATOM 0 HG12 ILE A 35 28.876 28.932 16.841 1.00 0.00 H new ATOM 0 HG13 ILE A 35 28.733 29.335 18.540 1.00 0.00 H new ATOM 0 HG21 ILE A 35 26.320 26.998 16.921 1.00 0.00 H new ATOM 0 HG22 ILE A 35 25.119 28.242 16.500 1.00 0.00 H new ATOM 0 HG23 ILE A 35 26.644 28.133 15.589 1.00 0.00 H new ATOM 0 HD11 ILE A 35 29.686 27.092 18.249 1.00 0.00 H new ATOM 0 HD12 ILE A 35 28.103 26.995 19.056 1.00 0.00 H new ATOM 0 HD13 ILE A 35 28.248 26.586 17.330 1.00 0.00 H new ATOM 594 N LYS A 36 28.168 31.077 15.306 1.00 0.00 N ATOM 595 CA LYS A 36 28.616 31.491 13.970 1.00 0.00 C ATOM 596 C LYS A 36 29.693 30.540 13.452 1.00 0.00 C ATOM 597 O LYS A 36 30.399 29.921 14.241 1.00 0.00 O ATOM 598 CB LYS A 36 29.152 32.934 14.024 1.00 0.00 C ATOM 599 CG LYS A 36 28.260 33.952 14.760 1.00 0.00 C ATOM 600 CD LYS A 36 26.879 34.141 14.119 1.00 0.00 C ATOM 601 CE LYS A 36 27.014 34.910 12.805 1.00 0.00 C ATOM 602 NZ LYS A 36 25.720 34.991 12.103 1.00 0.00 N ATOM 0 H LYS A 36 28.933 31.062 15.981 1.00 0.00 H new ATOM 0 HA LYS A 36 27.769 31.454 13.285 1.00 0.00 H new ATOM 0 HB2 LYS A 36 30.130 32.921 14.506 1.00 0.00 H new ATOM 0 HB3 LYS A 36 29.304 33.284 13.003 1.00 0.00 H new ATOM 0 HG2 LYS A 36 28.130 33.628 15.792 1.00 0.00 H new ATOM 0 HG3 LYS A 36 28.771 34.914 14.790 1.00 0.00 H new ATOM 0 HD2 LYS A 36 26.418 33.170 13.936 1.00 0.00 H new ATOM 0 HD3 LYS A 36 26.223 34.682 14.801 1.00 0.00 H new ATOM 0 HE2 LYS A 36 27.387 35.915 13.004 1.00 0.00 H new ATOM 0 HE3 LYS A 36 27.748 34.419 12.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 25.840 35.518 11.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 25.378 34.031 11.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 25.028 35.481 12.706 1.00 0.00 H new ATOM 616 N ASN A 37 29.867 30.473 12.136 1.00 0.00 N ATOM 617 CA ASN A 37 30.667 29.462 11.429 1.00 0.00 C ATOM 618 C ASN A 37 32.206 29.534 11.633 1.00 0.00 C ATOM 619 O ASN A 37 32.955 28.835 10.948 1.00 0.00 O ATOM 620 CB ASN A 37 30.260 29.552 9.944 1.00 0.00 C ATOM 621 CG ASN A 37 30.648 28.337 9.127 1.00 0.00 C ATOM 622 OD1 ASN A 37 30.846 27.245 9.636 1.00 0.00 O ATOM 623 ND2 ASN A 37 30.729 28.486 7.832 1.00 0.00 N ATOM 0 H ASN A 37 29.439 31.147 11.501 1.00 0.00 H new ATOM 0 HA ASN A 37 30.443 28.487 11.861 1.00 0.00 H new ATOM 0 HB2 ASN A 37 29.181 29.691 9.881 1.00 0.00 H new ATOM 0 HB3 ASN A 37 30.721 30.436 9.504 1.00 0.00 H new ATOM 0 HD21 ASN A 37 30.959 27.688 7.240 1.00 0.00 H new ATOM 0 HD22 ASN A 37 30.563 29.401 7.412 1.00 0.00 H new ATOM 630 N ALA A 38 32.693 30.373 12.551 1.00 0.00 N ATOM 631 CA ALA A 38 34.117 30.576 12.846 1.00 0.00 C ATOM 632 C ALA A 38 34.386 30.644 14.362 1.00 0.00 C ATOM 633 O ALA A 38 35.225 29.915 14.887 1.00 0.00 O ATOM 634 CB ALA A 38 34.565 31.851 12.118 1.00 0.00 C ATOM 0 H ALA A 38 32.086 30.952 13.131 1.00 0.00 H new ATOM 0 HA ALA A 38 34.698 29.726 12.490 1.00 0.00 H new ATOM 0 HB1 ALA A 38 35.621 32.031 12.317 1.00 0.00 H new ATOM 0 HB2 ALA A 38 34.413 31.730 11.045 1.00 0.00 H new ATOM 0 HB3 ALA A 38 33.979 32.698 12.474 1.00 0.00 H new ATOM 640 N PHE A 39 33.648 31.488 15.085 1.00 0.00 N ATOM 641 CA PHE A 39 33.673 31.565 16.550 1.00 0.00 C ATOM 642 C PHE A 39 32.297 31.958 17.096 1.00 0.00 C ATOM 643 O PHE A 39 31.612 32.809 16.524 1.00 0.00 O ATOM 644 CB PHE A 39 34.779 32.523 17.023 1.00 0.00 C ATOM 645 CG PHE A 39 34.780 33.883 16.354 1.00 0.00 C ATOM 646 CD1 PHE A 39 33.977 34.926 16.852 1.00 0.00 C ATOM 647 CD2 PHE A 39 35.582 34.103 15.217 1.00 0.00 C ATOM 648 CE1 PHE A 39 34.002 36.188 16.236 1.00 0.00 C ATOM 649 CE2 PHE A 39 35.580 35.356 14.583 1.00 0.00 C ATOM 650 CZ PHE A 39 34.799 36.403 15.100 1.00 0.00 C ATOM 0 H PHE A 39 33.001 32.153 14.661 1.00 0.00 H new ATOM 0 HA PHE A 39 33.907 30.578 16.949 1.00 0.00 H new ATOM 0 HB2 PHE A 39 34.680 32.665 18.099 1.00 0.00 H new ATOM 0 HB3 PHE A 39 35.746 32.050 16.851 1.00 0.00 H new ATOM 0 HD1 PHE A 39 33.341 34.756 17.708 1.00 0.00 H new ATOM 0 HD2 PHE A 39 36.200 33.306 14.832 1.00 0.00 H new ATOM 0 HE1 PHE A 39 33.407 36.995 16.637 1.00 0.00 H new ATOM 0 HE2 PHE A 39 36.179 35.515 13.698 1.00 0.00 H new ATOM 0 HZ PHE A 39 34.812 37.372 14.624 1.00 0.00 H new ATOM 660 N GLY A 40 31.880 31.308 18.183 1.00 0.00 N ATOM 661 CA GLY A 40 30.531 31.429 18.733 1.00 0.00 C ATOM 662 C GLY A 40 30.325 32.564 19.733 1.00 0.00 C ATOM 663 O GLY A 40 31.273 33.020 20.378 1.00 0.00 O ATOM 0 H GLY A 40 32.478 30.674 18.713 1.00 0.00 H new ATOM 0 HA2 GLY A 40 29.832 31.565 17.907 1.00 0.00 H new ATOM 0 HA3 GLY A 40 30.271 30.489 19.219 1.00 0.00 H new ATOM 667 N PHE A 41 29.054 32.935 19.911 1.00 0.00 N ATOM 668 CA PHE A 41 28.581 33.806 20.981 1.00 0.00 C ATOM 669 C PHE A 41 27.418 33.168 21.759 1.00 0.00 C ATOM 670 O PHE A 41 26.631 32.372 21.240 1.00 0.00 O ATOM 671 CB PHE A 41 28.181 35.182 20.421 1.00 0.00 C ATOM 672 CG PHE A 41 29.345 35.995 19.888 1.00 0.00 C ATOM 673 CD1 PHE A 41 29.793 35.802 18.569 1.00 0.00 C ATOM 674 CD2 PHE A 41 29.980 36.948 20.708 1.00 0.00 C ATOM 675 CE1 PHE A 41 30.877 36.547 18.078 1.00 0.00 C ATOM 676 CE2 PHE A 41 31.053 37.707 20.208 1.00 0.00 C ATOM 677 CZ PHE A 41 31.507 37.505 18.893 1.00 0.00 C ATOM 0 H PHE A 41 28.305 32.625 19.292 1.00 0.00 H new ATOM 0 HA PHE A 41 29.403 33.946 21.684 1.00 0.00 H new ATOM 0 HB2 PHE A 41 27.454 35.040 19.621 1.00 0.00 H new ATOM 0 HB3 PHE A 41 27.683 35.751 21.206 1.00 0.00 H new ATOM 0 HD1 PHE A 41 29.303 35.080 17.933 1.00 0.00 H new ATOM 0 HD2 PHE A 41 29.642 37.096 21.723 1.00 0.00 H new ATOM 0 HE1 PHE A 41 31.229 36.384 17.070 1.00 0.00 H new ATOM 0 HE2 PHE A 41 31.529 38.446 20.835 1.00 0.00 H new ATOM 0 HZ PHE A 41 32.335 38.083 18.510 1.00 0.00 H new ATOM 687 N ILE A 42 27.299 33.565 23.022 1.00 0.00 N ATOM 688 CA ILE A 42 26.131 33.347 23.878 1.00 0.00 C ATOM 689 C ILE A 42 25.599 34.714 24.321 1.00 0.00 C ATOM 690 O ILE A 42 26.375 35.648 24.523 1.00 0.00 O ATOM 691 CB ILE A 42 26.490 32.366 25.026 1.00 0.00 C ATOM 692 CG1 ILE A 42 25.810 31.008 24.756 1.00 0.00 C ATOM 693 CG2 ILE A 42 26.112 32.880 26.427 1.00 0.00 C ATOM 694 CD1 ILE A 42 26.366 29.847 25.593 1.00 0.00 C ATOM 0 H ILE A 42 28.045 34.070 23.501 1.00 0.00 H new ATOM 0 HA ILE A 42 25.315 32.857 23.346 1.00 0.00 H new ATOM 0 HB ILE A 42 27.575 32.265 25.031 1.00 0.00 H new ATOM 0 HG12 ILE A 42 24.742 31.104 24.953 1.00 0.00 H new ATOM 0 HG13 ILE A 42 25.919 30.764 23.699 1.00 0.00 H new ATOM 0 HG21 ILE A 42 26.394 32.139 27.175 1.00 0.00 H new ATOM 0 HG22 ILE A 42 26.637 33.814 26.626 1.00 0.00 H new ATOM 0 HG23 ILE A 42 25.037 33.051 26.474 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.833 28.930 25.342 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.427 29.720 25.380 1.00 0.00 H new ATOM 0 HD13 ILE A 42 26.232 30.066 26.652 1.00 0.00 H new ATOM 706 N GLN A 43 24.280 34.835 24.464 1.00 0.00 N ATOM 707 CA GLN A 43 23.572 36.059 24.842 1.00 0.00 C ATOM 708 C GLN A 43 22.618 35.693 25.983 1.00 0.00 C ATOM 709 O GLN A 43 21.499 35.259 25.735 1.00 0.00 O ATOM 710 CB GLN A 43 22.832 36.597 23.600 1.00 0.00 C ATOM 711 CG GLN A 43 23.767 37.201 22.536 1.00 0.00 C ATOM 712 CD GLN A 43 24.362 38.549 22.939 1.00 0.00 C ATOM 713 OE1 GLN A 43 23.938 39.204 23.885 1.00 0.00 O ATOM 714 NE2 GLN A 43 25.349 39.053 22.238 1.00 0.00 N ATOM 0 H GLN A 43 23.648 34.049 24.313 1.00 0.00 H new ATOM 0 HA GLN A 43 24.242 36.846 25.187 1.00 0.00 H new ATOM 0 HB2 GLN A 43 22.259 35.786 23.150 1.00 0.00 H new ATOM 0 HB3 GLN A 43 22.116 37.356 23.915 1.00 0.00 H new ATOM 0 HG2 GLN A 43 24.578 36.500 22.337 1.00 0.00 H new ATOM 0 HG3 GLN A 43 23.214 37.321 21.604 1.00 0.00 H new ATOM 0 HE21 GLN A 43 25.727 38.536 21.444 1.00 0.00 H new ATOM 0 HE22 GLN A 43 25.739 39.962 22.487 1.00 0.00 H new ATOM 723 N PHE A 44 23.091 35.751 27.230 1.00 0.00 N ATOM 724 CA PHE A 44 22.427 35.207 28.424 1.00 0.00 C ATOM 725 C PHE A 44 22.016 36.303 29.422 1.00 0.00 C ATOM 726 O PHE A 44 22.371 37.474 29.280 1.00 0.00 O ATOM 727 CB PHE A 44 23.321 34.128 29.077 1.00 0.00 C ATOM 728 CG PHE A 44 23.324 32.723 28.478 1.00 0.00 C ATOM 729 CD1 PHE A 44 22.624 32.383 27.300 1.00 0.00 C ATOM 730 CD2 PHE A 44 24.042 31.711 29.143 1.00 0.00 C ATOM 731 CE1 PHE A 44 22.624 31.064 26.812 1.00 0.00 C ATOM 732 CE2 PHE A 44 24.061 30.396 28.648 1.00 0.00 C ATOM 733 CZ PHE A 44 23.353 30.070 27.482 1.00 0.00 C ATOM 0 H PHE A 44 23.983 36.196 27.448 1.00 0.00 H new ATOM 0 HA PHE A 44 21.496 34.737 28.107 1.00 0.00 H new ATOM 0 HB2 PHE A 44 24.347 34.496 29.064 1.00 0.00 H new ATOM 0 HB3 PHE A 44 23.026 34.042 30.123 1.00 0.00 H new ATOM 0 HD1 PHE A 44 22.080 33.148 26.765 1.00 0.00 H new ATOM 0 HD2 PHE A 44 24.585 31.948 30.046 1.00 0.00 H new ATOM 0 HE1 PHE A 44 22.064 30.817 25.923 1.00 0.00 H new ATOM 0 HE2 PHE A 44 24.623 29.634 29.167 1.00 0.00 H new ATOM 0 HZ PHE A 44 23.369 29.059 27.102 1.00 0.00 H new ATOM 743 N ASP A 45 21.225 35.922 30.423 1.00 0.00 N ATOM 744 CA ASP A 45 20.906 36.731 31.601 1.00 0.00 C ATOM 745 C ASP A 45 21.906 36.462 32.759 1.00 0.00 C ATOM 746 O ASP A 45 22.803 35.628 32.629 1.00 0.00 O ATOM 747 CB ASP A 45 19.442 36.431 31.969 1.00 0.00 C ATOM 748 CG ASP A 45 18.764 37.522 32.789 1.00 0.00 C ATOM 749 OD1 ASP A 45 19.417 38.506 33.188 1.00 0.00 O ATOM 750 OD2 ASP A 45 17.547 37.400 33.053 1.00 0.00 O ATOM 0 H ASP A 45 20.771 35.009 30.438 1.00 0.00 H new ATOM 0 HA ASP A 45 21.010 37.796 31.393 1.00 0.00 H new ATOM 0 HB2 ASP A 45 18.874 36.276 31.052 1.00 0.00 H new ATOM 0 HB3 ASP A 45 19.405 35.496 32.529 1.00 0.00 H new ATOM 755 N ASN A 46 21.760 37.176 33.883 1.00 0.00 N ATOM 756 CA ASN A 46 22.617 37.157 35.081 1.00 0.00 C ATOM 757 C ASN A 46 24.133 37.296 34.787 1.00 0.00 C ATOM 758 O ASN A 46 24.877 36.307 34.807 1.00 0.00 O ATOM 759 CB ASN A 46 22.266 35.962 35.983 1.00 0.00 C ATOM 760 CG ASN A 46 22.865 36.109 37.373 1.00 0.00 C ATOM 761 OD1 ASN A 46 23.678 36.980 37.665 1.00 0.00 O ATOM 762 ND2 ASN A 46 22.475 35.270 38.298 1.00 0.00 N ATOM 0 H ASN A 46 20.984 37.830 33.989 1.00 0.00 H new ATOM 0 HA ASN A 46 22.391 38.064 35.641 1.00 0.00 H new ATOM 0 HB2 ASN A 46 21.183 35.872 36.062 1.00 0.00 H new ATOM 0 HB3 ASN A 46 22.630 35.042 35.526 1.00 0.00 H new ATOM 0 HD21 ASN A 46 22.846 35.346 39.245 1.00 0.00 H new ATOM 0 HD22 ASN A 46 21.800 34.540 38.072 1.00 0.00 H new ATOM 769 N PRO A 47 24.630 38.532 34.568 1.00 0.00 N ATOM 770 CA PRO A 47 26.012 38.786 34.153 1.00 0.00 C ATOM 771 C PRO A 47 27.069 38.285 35.144 1.00 0.00 C ATOM 772 O PRO A 47 28.173 37.902 34.745 1.00 0.00 O ATOM 773 CB PRO A 47 26.118 40.307 33.984 1.00 0.00 C ATOM 774 CG PRO A 47 24.679 40.808 33.889 1.00 0.00 C ATOM 775 CD PRO A 47 23.888 39.780 34.680 1.00 0.00 C ATOM 0 HA PRO A 47 26.219 38.236 33.235 1.00 0.00 H new ATOM 0 HB2 PRO A 47 26.636 40.761 34.829 1.00 0.00 H new ATOM 0 HB3 PRO A 47 26.683 40.564 33.088 1.00 0.00 H new ATOM 0 HG2 PRO A 47 24.574 41.807 34.312 1.00 0.00 H new ATOM 0 HG3 PRO A 47 24.342 40.863 32.854 1.00 0.00 H new ATOM 0 HD2 PRO A 47 23.788 40.082 35.722 1.00 0.00 H new ATOM 0 HD3 PRO A 47 22.879 39.672 34.281 1.00 0.00 H new ATOM 783 N GLN A 48 26.745 38.250 36.440 1.00 0.00 N ATOM 784 CA GLN A 48 27.665 37.734 37.452 1.00 0.00 C ATOM 785 C GLN A 48 27.767 36.203 37.395 1.00 0.00 C ATOM 786 O GLN A 48 28.861 35.673 37.566 1.00 0.00 O ATOM 787 CB GLN A 48 27.261 38.267 38.833 1.00 0.00 C ATOM 788 CG GLN A 48 28.277 37.883 39.920 1.00 0.00 C ATOM 789 CD GLN A 48 29.701 38.390 39.688 1.00 0.00 C ATOM 790 OE1 GLN A 48 29.954 39.436 39.096 1.00 0.00 O ATOM 791 NE2 GLN A 48 30.680 37.678 40.188 1.00 0.00 N ATOM 0 H GLN A 48 25.852 38.574 36.811 1.00 0.00 H new ATOM 0 HA GLN A 48 28.672 38.096 37.244 1.00 0.00 H new ATOM 0 HB2 GLN A 48 27.170 39.352 38.790 1.00 0.00 H new ATOM 0 HB3 GLN A 48 26.280 37.875 39.100 1.00 0.00 H new ATOM 0 HG2 GLN A 48 27.923 38.266 40.877 1.00 0.00 H new ATOM 0 HG3 GLN A 48 28.304 36.796 40.002 1.00 0.00 H new ATOM 0 HE21 GLN A 48 30.478 36.808 40.681 1.00 0.00 H new ATOM 0 HE22 GLN A 48 31.644 37.993 40.084 1.00 0.00 H new ATOM 800 N SER A 49 26.688 35.487 37.059 1.00 0.00 N ATOM 801 CA SER A 49 26.754 34.036 36.818 1.00 0.00 C ATOM 802 C SER A 49 27.492 33.687 35.522 1.00 0.00 C ATOM 803 O SER A 49 28.202 32.678 35.495 1.00 0.00 O ATOM 804 CB SER A 49 25.363 33.407 36.826 1.00 0.00 C ATOM 805 OG SER A 49 24.824 33.474 38.131 1.00 0.00 O ATOM 0 H SER A 49 25.756 35.887 36.947 1.00 0.00 H new ATOM 0 HA SER A 49 27.331 33.616 37.642 1.00 0.00 H new ATOM 0 HB2 SER A 49 24.712 33.929 36.125 1.00 0.00 H new ATOM 0 HB3 SER A 49 25.419 32.369 36.497 1.00 0.00 H new ATOM 0 HG SER A 49 23.930 33.072 38.137 1.00 0.00 H new ATOM 811 N VAL A 50 27.429 34.548 34.493 1.00 0.00 N ATOM 812 CA VAL A 50 28.296 34.455 33.299 1.00 0.00 C ATOM 813 C VAL A 50 29.771 34.582 33.695 1.00 0.00 C ATOM 814 O VAL A 50 30.576 33.738 33.303 1.00 0.00 O ATOM 815 CB VAL A 50 27.933 35.501 32.217 1.00 0.00 C ATOM 816 CG1 VAL A 50 28.796 35.354 30.955 1.00 0.00 C ATOM 817 CG2 VAL A 50 26.484 35.382 31.731 1.00 0.00 C ATOM 0 H VAL A 50 26.776 35.331 34.462 1.00 0.00 H new ATOM 0 HA VAL A 50 28.127 33.472 32.860 1.00 0.00 H new ATOM 0 HB VAL A 50 28.101 36.457 32.712 1.00 0.00 H new ATOM 0 HG11 VAL A 50 28.505 36.109 30.225 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.846 35.487 31.215 1.00 0.00 H new ATOM 0 HG13 VAL A 50 28.650 34.362 30.528 1.00 0.00 H new ATOM 0 HG21 VAL A 50 26.291 36.142 30.974 1.00 0.00 H new ATOM 0 HG22 VAL A 50 26.324 34.393 31.302 1.00 0.00 H new ATOM 0 HG23 VAL A 50 25.805 35.527 32.572 1.00 0.00 H new ATOM 827 N ARG A 51 30.135 35.581 34.513 1.00 0.00 N ATOM 828 CA ARG A 51 31.516 35.764 34.993 1.00 0.00 C ATOM 829 C ARG A 51 31.986 34.609 35.887 1.00 0.00 C ATOM 830 O ARG A 51 33.081 34.093 35.673 1.00 0.00 O ATOM 831 CB ARG A 51 31.644 37.137 35.683 1.00 0.00 C ATOM 832 CG ARG A 51 33.017 37.391 36.329 1.00 0.00 C ATOM 833 CD ARG A 51 34.208 37.290 35.361 1.00 0.00 C ATOM 834 NE ARG A 51 35.473 37.239 36.110 1.00 0.00 N ATOM 835 CZ ARG A 51 36.607 36.668 35.750 1.00 0.00 C ATOM 836 NH1 ARG A 51 36.831 36.164 34.571 1.00 0.00 N ATOM 837 NH2 ARG A 51 37.581 36.592 36.597 1.00 0.00 N ATOM 0 H ARG A 51 29.483 36.284 34.861 1.00 0.00 H new ATOM 0 HA ARG A 51 32.185 35.748 34.133 1.00 0.00 H new ATOM 0 HB2 ARG A 51 31.449 37.920 34.950 1.00 0.00 H new ATOM 0 HB3 ARG A 51 30.873 37.220 36.449 1.00 0.00 H new ATOM 0 HG2 ARG A 51 33.014 38.384 36.779 1.00 0.00 H new ATOM 0 HG3 ARG A 51 33.161 36.675 37.138 1.00 0.00 H new ATOM 0 HD2 ARG A 51 34.108 36.398 34.742 1.00 0.00 H new ATOM 0 HD3 ARG A 51 34.211 38.147 34.687 1.00 0.00 H new ATOM 0 HE ARG A 51 35.474 37.702 37.019 1.00 0.00 H new ATOM 0 HH11 ARG A 51 36.104 36.196 33.856 1.00 0.00 H new ATOM 0 HH12 ARG A 51 37.733 35.737 34.362 1.00 0.00 H new ATOM 0 HH21 ARG A 51 37.470 36.972 37.537 1.00 0.00 H new ATOM 0 HH22 ARG A 51 38.460 36.152 36.325 1.00 0.00 H new ATOM 851 N ASP A 52 31.151 34.159 36.823 1.00 0.00 N ATOM 852 CA ASP A 52 31.411 32.996 37.682 1.00 0.00 C ATOM 853 C ASP A 52 31.680 31.719 36.870 1.00 0.00 C ATOM 854 O ASP A 52 32.562 30.930 37.209 1.00 0.00 O ATOM 855 CB ASP A 52 30.198 32.786 38.595 1.00 0.00 C ATOM 856 CG ASP A 52 30.345 31.555 39.492 1.00 0.00 C ATOM 857 OD1 ASP A 52 31.130 31.601 40.473 1.00 0.00 O ATOM 858 OD2 ASP A 52 29.619 30.561 39.265 1.00 0.00 O ATOM 0 H ASP A 52 30.252 34.602 37.012 1.00 0.00 H new ATOM 0 HA ASP A 52 32.309 33.195 38.267 1.00 0.00 H new ATOM 0 HB2 ASP A 52 30.058 33.670 39.217 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.301 32.681 37.984 1.00 0.00 H new ATOM 863 N ALA A 53 30.963 31.530 35.764 1.00 0.00 N ATOM 864 CA ALA A 53 31.179 30.392 34.885 1.00 0.00 C ATOM 865 C ALA A 53 32.491 30.497 34.078 1.00 0.00 C ATOM 866 O ALA A 53 33.078 29.462 33.765 1.00 0.00 O ATOM 867 CB ALA A 53 29.926 30.220 34.028 1.00 0.00 C ATOM 0 H ALA A 53 30.221 32.159 35.457 1.00 0.00 H new ATOM 0 HA ALA A 53 31.325 29.486 35.473 1.00 0.00 H new ATOM 0 HB1 ALA A 53 30.058 29.372 33.356 1.00 0.00 H new ATOM 0 HB2 ALA A 53 29.066 30.042 34.673 1.00 0.00 H new ATOM 0 HB3 ALA A 53 29.759 31.124 33.442 1.00 0.00 H new ATOM 873 N ILE A 54 33.018 31.703 33.804 1.00 0.00 N ATOM 874 CA ILE A 54 34.349 31.880 33.184 1.00 0.00 C ATOM 875 C ILE A 54 35.449 31.427 34.145 1.00 0.00 C ATOM 876 O ILE A 54 36.278 30.601 33.768 1.00 0.00 O ATOM 877 CB ILE A 54 34.595 33.331 32.699 1.00 0.00 C ATOM 878 CG1 ILE A 54 33.640 33.661 31.536 1.00 0.00 C ATOM 879 CG2 ILE A 54 36.055 33.542 32.247 1.00 0.00 C ATOM 880 CD1 ILE A 54 33.770 35.081 30.993 1.00 0.00 C ATOM 0 H ILE A 54 32.538 32.581 34.004 1.00 0.00 H new ATOM 0 HA ILE A 54 34.376 31.250 32.295 1.00 0.00 H new ATOM 0 HB ILE A 54 34.404 34.000 33.538 1.00 0.00 H new ATOM 0 HG12 ILE A 54 33.821 32.957 30.724 1.00 0.00 H new ATOM 0 HG13 ILE A 54 32.614 33.506 31.870 1.00 0.00 H new ATOM 0 HG21 ILE A 54 36.188 34.571 31.914 1.00 0.00 H new ATOM 0 HG22 ILE A 54 36.727 33.341 33.081 1.00 0.00 H new ATOM 0 HG23 ILE A 54 36.283 32.863 31.426 1.00 0.00 H new ATOM 0 HD11 ILE A 54 33.061 35.225 30.178 1.00 0.00 H new ATOM 0 HD12 ILE A 54 33.558 35.796 31.788 1.00 0.00 H new ATOM 0 HD13 ILE A 54 34.784 35.238 30.624 1.00 0.00 H new ATOM 892 N GLU A 55 35.454 31.913 35.387 1.00 0.00 N ATOM 893 CA GLU A 55 36.471 31.514 36.375 1.00 0.00 C ATOM 894 C GLU A 55 36.377 30.026 36.772 1.00 0.00 C ATOM 895 O GLU A 55 37.356 29.458 37.259 1.00 0.00 O ATOM 896 CB GLU A 55 36.438 32.442 37.600 1.00 0.00 C ATOM 897 CG GLU A 55 35.088 32.420 38.319 1.00 0.00 C ATOM 898 CD GLU A 55 35.105 33.248 39.599 1.00 0.00 C ATOM 899 OE1 GLU A 55 35.881 32.924 40.526 1.00 0.00 O ATOM 900 OE2 GLU A 55 34.300 34.197 39.749 1.00 0.00 O ATOM 0 H GLU A 55 34.769 32.583 35.737 1.00 0.00 H new ATOM 0 HA GLU A 55 37.442 31.627 35.893 1.00 0.00 H new ATOM 0 HB2 GLU A 55 37.222 32.145 38.297 1.00 0.00 H new ATOM 0 HB3 GLU A 55 36.661 33.461 37.285 1.00 0.00 H new ATOM 0 HG2 GLU A 55 34.316 32.802 37.651 1.00 0.00 H new ATOM 0 HG3 GLU A 55 34.822 31.390 38.558 1.00 0.00 H new ATOM 907 N CYS A 56 35.242 29.370 36.511 1.00 0.00 N ATOM 908 CA CYS A 56 35.118 27.917 36.594 1.00 0.00 C ATOM 909 C CYS A 56 35.665 27.217 35.330 1.00 0.00 C ATOM 910 O CYS A 56 36.599 26.424 35.435 1.00 0.00 O ATOM 911 CB CYS A 56 33.664 27.531 36.892 1.00 0.00 C ATOM 912 SG CYS A 56 33.155 28.159 38.520 1.00 0.00 S ATOM 0 H CYS A 56 34.379 29.838 36.235 1.00 0.00 H new ATOM 0 HA CYS A 56 35.736 27.565 37.420 1.00 0.00 H new ATOM 0 HB2 CYS A 56 33.009 27.935 36.120 1.00 0.00 H new ATOM 0 HB3 CYS A 56 33.557 26.447 36.865 1.00 0.00 H new ATOM 0 HG CYS A 56 32.777 29.398 38.408 1.00 0.00 H new ATOM 918 N GLU A 57 35.115 27.494 34.143 1.00 0.00 N ATOM 919 CA GLU A 57 35.327 26.720 32.901 1.00 0.00 C ATOM 920 C GLU A 57 36.571 27.131 32.090 1.00 0.00 C ATOM 921 O GLU A 57 37.228 26.273 31.495 1.00 0.00 O ATOM 922 CB GLU A 57 34.061 26.881 32.038 1.00 0.00 C ATOM 923 CG GLU A 57 34.038 26.072 30.732 1.00 0.00 C ATOM 924 CD GLU A 57 33.997 24.570 30.990 1.00 0.00 C ATOM 925 OE1 GLU A 57 32.885 24.021 31.159 1.00 0.00 O ATOM 926 OE2 GLU A 57 35.063 23.920 31.068 1.00 0.00 O ATOM 0 H GLU A 57 34.489 28.288 34.009 1.00 0.00 H new ATOM 0 HA GLU A 57 35.510 25.684 33.187 1.00 0.00 H new ATOM 0 HB2 GLU A 57 33.196 26.594 32.637 1.00 0.00 H new ATOM 0 HB3 GLU A 57 33.943 27.936 31.792 1.00 0.00 H new ATOM 0 HG2 GLU A 57 33.169 26.362 30.141 1.00 0.00 H new ATOM 0 HG3 GLU A 57 34.921 26.314 30.140 1.00 0.00 H new ATOM 933 N SER A 58 36.894 28.428 32.068 1.00 0.00 N ATOM 934 CA SER A 58 38.048 29.014 31.360 1.00 0.00 C ATOM 935 C SER A 58 39.336 28.969 32.194 1.00 0.00 C ATOM 936 O SER A 58 40.416 29.318 31.709 1.00 0.00 O ATOM 937 CB SER A 58 37.719 30.453 30.942 1.00 0.00 C ATOM 938 OG SER A 58 38.545 30.892 29.884 1.00 0.00 O ATOM 0 H SER A 58 36.341 29.129 32.560 1.00 0.00 H new ATOM 0 HA SER A 58 38.234 28.409 30.472 1.00 0.00 H new ATOM 0 HB2 SER A 58 36.674 30.513 30.637 1.00 0.00 H new ATOM 0 HB3 SER A 58 37.840 31.117 31.798 1.00 0.00 H new ATOM 0 HG SER A 58 39.461 30.577 30.032 1.00 0.00 H new ATOM 944 N GLN A 59 39.239 28.500 33.443 1.00 0.00 N ATOM 945 CA GLN A 59 40.374 28.063 34.254 1.00 0.00 C ATOM 946 C GLN A 59 40.847 26.683 33.769 1.00 0.00 C ATOM 947 O GLN A 59 40.598 25.647 34.390 1.00 0.00 O ATOM 948 CB GLN A 59 39.994 28.128 35.743 1.00 0.00 C ATOM 949 CG GLN A 59 41.162 27.869 36.713 1.00 0.00 C ATOM 950 CD GLN A 59 42.243 28.948 36.701 1.00 0.00 C ATOM 951 OE1 GLN A 59 42.180 29.956 36.002 1.00 0.00 O ATOM 952 NE2 GLN A 59 43.278 28.783 37.484 1.00 0.00 N ATOM 0 H GLN A 59 38.345 28.413 33.927 1.00 0.00 H new ATOM 0 HA GLN A 59 41.230 28.728 34.137 1.00 0.00 H new ATOM 0 HB2 GLN A 59 39.574 29.111 35.955 1.00 0.00 H new ATOM 0 HB3 GLN A 59 39.209 27.397 35.937 1.00 0.00 H new ATOM 0 HG2 GLN A 59 40.766 27.780 37.724 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.619 26.911 36.465 1.00 0.00 H new ATOM 0 HE21 GLN A 59 43.346 27.952 38.071 1.00 0.00 H new ATOM 0 HE22 GLN A 59 44.017 29.486 37.507 1.00 0.00 H new ATOM 1097 N ILE A 68 39.731 29.903 26.105 1.00 0.00 N ATOM 1098 CA ILE A 68 39.457 31.308 26.434 1.00 0.00 C ATOM 1099 C ILE A 68 37.967 31.607 26.244 1.00 0.00 C ATOM 1100 O ILE A 68 37.424 31.442 25.148 1.00 0.00 O ATOM 1101 CB ILE A 68 40.348 32.255 25.603 1.00 0.00 C ATOM 1102 CG1 ILE A 68 41.833 32.024 25.960 1.00 0.00 C ATOM 1103 CG2 ILE A 68 39.971 33.732 25.818 1.00 0.00 C ATOM 1104 CD1 ILE A 68 42.822 32.826 25.107 1.00 0.00 C ATOM 0 HA ILE A 68 39.704 31.482 27.481 1.00 0.00 H new ATOM 0 HB ILE A 68 40.187 32.028 24.549 1.00 0.00 H new ATOM 0 HG12 ILE A 68 41.986 32.280 27.008 1.00 0.00 H new ATOM 0 HG13 ILE A 68 42.058 30.963 25.855 1.00 0.00 H new ATOM 0 HG21 ILE A 68 40.622 34.365 25.215 1.00 0.00 H new ATOM 0 HG22 ILE A 68 38.934 33.890 25.521 1.00 0.00 H new ATOM 0 HG23 ILE A 68 40.089 33.988 26.871 1.00 0.00 H new ATOM 0 HD11 ILE A 68 43.841 32.603 25.425 1.00 0.00 H new ATOM 0 HD12 ILE A 68 42.702 32.554 24.058 1.00 0.00 H new ATOM 0 HD13 ILE A 68 42.628 33.892 25.230 1.00 0.00 H new ATOM 1116 N LEU A 69 37.339 32.098 27.312 1.00 0.00 N ATOM 1117 CA LEU A 69 35.976 32.621 27.339 1.00 0.00 C ATOM 1118 C LEU A 69 36.019 34.069 27.849 1.00 0.00 C ATOM 1119 O LEU A 69 36.765 34.353 28.787 1.00 0.00 O ATOM 1120 CB LEU A 69 35.106 31.752 28.271 1.00 0.00 C ATOM 1121 CG LEU A 69 35.175 30.225 28.079 1.00 0.00 C ATOM 1122 CD1 LEU A 69 34.290 29.536 29.118 1.00 0.00 C ATOM 1123 CD2 LEU A 69 34.696 29.781 26.701 1.00 0.00 C ATOM 0 H LEU A 69 37.790 32.143 28.226 1.00 0.00 H new ATOM 0 HA LEU A 69 35.543 32.598 26.339 1.00 0.00 H new ATOM 0 HB2 LEU A 69 35.386 31.976 29.300 1.00 0.00 H new ATOM 0 HB3 LEU A 69 34.068 32.061 28.149 1.00 0.00 H new ATOM 0 HG LEU A 69 36.223 29.946 28.190 1.00 0.00 H new ATOM 0 HD11 LEU A 69 34.340 28.456 28.980 1.00 0.00 H new ATOM 0 HD12 LEU A 69 34.638 29.791 30.119 1.00 0.00 H new ATOM 0 HD13 LEU A 69 33.259 29.869 28.997 1.00 0.00 H new ATOM 0 HD21 LEU A 69 34.767 28.696 26.623 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.660 30.088 26.560 1.00 0.00 H new ATOM 0 HD23 LEU A 69 35.318 30.241 25.934 1.00 0.00 H new ATOM 1135 N GLU A 70 35.241 34.984 27.275 1.00 0.00 N ATOM 1136 CA GLU A 70 35.212 36.392 27.704 1.00 0.00 C ATOM 1137 C GLU A 70 33.784 36.914 27.874 1.00 0.00 C ATOM 1138 O GLU A 70 32.942 36.705 27.003 1.00 0.00 O ATOM 1139 CB GLU A 70 36.000 37.249 26.702 1.00 0.00 C ATOM 1140 CG GLU A 70 36.064 38.741 27.063 1.00 0.00 C ATOM 1141 CD GLU A 70 36.900 39.010 28.317 1.00 0.00 C ATOM 1142 OE1 GLU A 70 36.466 38.682 29.449 1.00 0.00 O ATOM 1143 OE2 GLU A 70 38.020 39.557 28.192 1.00 0.00 O ATOM 0 H GLU A 70 34.611 34.777 26.500 1.00 0.00 H new ATOM 0 HA GLU A 70 35.684 36.459 28.684 1.00 0.00 H new ATOM 0 HB2 GLU A 70 37.016 36.861 26.629 1.00 0.00 H new ATOM 0 HB3 GLU A 70 35.547 37.144 25.716 1.00 0.00 H new ATOM 0 HG2 GLU A 70 36.485 39.296 26.225 1.00 0.00 H new ATOM 0 HG3 GLU A 70 35.053 39.117 27.218 1.00 0.00 H new ATOM 1150 N VAL A 71 33.526 37.625 28.978 1.00 0.00 N ATOM 1151 CA VAL A 71 32.228 38.254 29.266 1.00 0.00 C ATOM 1152 C VAL A 71 32.228 39.731 28.882 1.00 0.00 C ATOM 1153 O VAL A 71 33.182 40.459 29.170 1.00 0.00 O ATOM 1154 CB VAL A 71 31.766 38.031 30.721 1.00 0.00 C ATOM 1155 CG1 VAL A 71 32.700 38.629 31.782 1.00 0.00 C ATOM 1156 CG2 VAL A 71 30.351 38.564 30.951 1.00 0.00 C ATOM 0 H VAL A 71 34.221 37.783 29.707 1.00 0.00 H new ATOM 0 HA VAL A 71 31.490 37.753 28.639 1.00 0.00 H new ATOM 0 HB VAL A 71 31.787 36.948 30.845 1.00 0.00 H new ATOM 0 HG11 VAL A 71 32.300 38.426 32.775 1.00 0.00 H new ATOM 0 HG12 VAL A 71 33.689 38.180 31.691 1.00 0.00 H new ATOM 0 HG13 VAL A 71 32.776 39.706 31.635 1.00 0.00 H new ATOM 0 HG21 VAL A 71 30.060 38.389 31.987 1.00 0.00 H new ATOM 0 HG22 VAL A 71 30.327 39.634 30.743 1.00 0.00 H new ATOM 0 HG23 VAL A 71 29.656 38.050 30.287 1.00 0.00 H new ATOM 1166 N SER A 72 31.130 40.171 28.275 1.00 0.00 N ATOM 1167 CA SER A 72 30.845 41.558 27.909 1.00 0.00 C ATOM 1168 C SER A 72 29.375 41.901 28.180 1.00 0.00 C ATOM 1169 O SER A 72 28.554 41.021 28.441 1.00 0.00 O ATOM 1170 CB SER A 72 31.236 41.788 26.444 1.00 0.00 C ATOM 1171 OG SER A 72 32.643 41.879 26.345 1.00 0.00 O ATOM 0 H SER A 72 30.375 39.538 28.011 1.00 0.00 H new ATOM 0 HA SER A 72 31.440 42.230 28.527 1.00 0.00 H new ATOM 0 HB2 SER A 72 30.869 40.970 25.825 1.00 0.00 H new ATOM 0 HB3 SER A 72 30.774 42.702 26.071 1.00 0.00 H new ATOM 0 HG SER A 72 32.896 42.024 25.410 1.00 0.00 H new ATOM 1177 N SER A 73 29.024 43.186 28.145 1.00 0.00 N ATOM 1178 CA SER A 73 27.682 43.668 28.494 1.00 0.00 C ATOM 1179 C SER A 73 27.359 44.982 27.794 1.00 0.00 C ATOM 1180 O SER A 73 28.251 45.784 27.517 1.00 0.00 O ATOM 1181 CB SER A 73 27.607 43.844 30.015 1.00 0.00 C ATOM 1182 OG SER A 73 26.381 44.402 30.450 1.00 0.00 O ATOM 0 H SER A 73 29.666 43.930 27.872 1.00 0.00 H new ATOM 0 HA SER A 73 26.946 42.936 28.161 1.00 0.00 H new ATOM 0 HB2 SER A 73 27.749 42.875 30.494 1.00 0.00 H new ATOM 0 HB3 SER A 73 28.427 44.484 30.341 1.00 0.00 H new ATOM 0 HG SER A 73 26.389 44.489 31.426 1.00 0.00 H new