USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 780 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: C 13 ASN : amide:sc= -0.223 K(o=-0.22,f=-1.4) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.421 USER MOD Set 2.2: C 21 THR OG1 : rot -70:sc= 0.453 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.0748 K(o=-0.075,f=-1.6!) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -153:sc= 0 (180deg=-0.209) USER MOD Single : A 1 MET N :NH3+ 140:sc= 0.0042 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.456 X(o=-0.46,f=-0.36) USER MOD Single : A 29 GLN : amide:sc= -0.625 K(o=-0.62,f=-3.1) USER MOD Single : A 35 ASN : amide:sc= -0.127 K(o=-0.13,f=-2.4!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -1.04 K(o=-1,f=-2.1) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl -155:sc= 0 (180deg=-0.0653) USER MOD Single : C 1 MET N :NH3+ 139:sc= 0.0146 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0233) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.16) USER MOD Single : C 29 GLN : amide:sc= -2.77! C(o=-2.8!,f=-4.4!) USER MOD Single : C 35 ASN : amide:sc= -0.0786 K(o=-0.079,f=-1.9!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.23 K(o=-1.2,f=-2.3) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.022 10.137 -1.962 1.00 0.00 N ATOM 2 CA MET A 1 6.553 10.155 -2.121 1.00 0.00 C ATOM 3 C MET A 1 6.177 9.833 -3.559 1.00 0.00 C ATOM 4 O MET A 1 6.737 10.422 -4.478 1.00 0.00 O ATOM 5 CB MET A 1 5.992 11.529 -1.755 1.00 0.00 C ATOM 6 CG MET A 1 4.471 11.576 -1.897 1.00 0.00 C ATOM 7 SD MET A 1 3.554 10.506 -0.765 1.00 0.00 S ATOM 8 CE MET A 1 1.888 11.069 -1.195 1.00 0.00 C ATOM 0 H1 MET A 1 8.314 10.919 -1.341 1.00 0.00 H new ATOM 0 H2 MET A 1 8.314 9.232 -1.540 1.00 0.00 H new ATOM 0 H3 MET A 1 8.473 10.247 -2.892 1.00 0.00 H new ATOM 0 HA MET A 1 6.130 9.403 -1.455 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.269 11.774 -0.730 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.441 12.288 -2.396 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.140 12.604 -1.747 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.210 11.304 -2.920 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.224 10.925 -0.343 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.918 12.127 -1.457 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.518 10.495 -2.044 1.00 0.00 H new ATOM 20 N LEU A 2 5.236 8.913 -3.762 1.00 0.00 N ATOM 21 CA LEU A 2 4.709 8.627 -5.085 1.00 0.00 C ATOM 22 C LEU A 2 3.188 8.591 -5.012 1.00 0.00 C ATOM 23 O LEU A 2 2.625 8.355 -3.945 1.00 0.00 O ATOM 24 CB LEU A 2 5.239 7.279 -5.592 1.00 0.00 C ATOM 25 CG LEU A 2 6.032 7.351 -6.901 1.00 0.00 C ATOM 26 CD1 LEU A 2 6.203 5.950 -7.481 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.433 8.261 -7.972 1.00 0.00 C ATOM 0 H LEU A 2 4.823 8.351 -3.017 1.00 0.00 H new ATOM 0 HA LEU A 2 5.029 9.405 -5.778 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.875 6.842 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.396 6.602 -5.731 1.00 0.00 H new ATOM 0 HG LEU A 2 6.990 7.795 -6.629 1.00 0.00 H new ATOM 0 HD11 LEU A 2 6.768 6.008 -8.412 1.00 0.00 H new ATOM 0 HD12 LEU A 2 6.741 5.324 -6.769 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.223 5.516 -7.678 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.066 8.245 -8.859 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.435 7.909 -8.232 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.370 9.280 -7.590 1.00 0.00 H new ATOM 39 N ILE A 3 2.520 8.824 -6.142 1.00 0.00 N ATOM 40 CA ILE A 3 1.070 8.755 -6.235 1.00 0.00 C ATOM 41 C ILE A 3 0.717 7.919 -7.458 1.00 0.00 C ATOM 42 O ILE A 3 1.450 7.920 -8.446 1.00 0.00 O ATOM 43 CB ILE A 3 0.459 10.164 -6.312 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.641 10.941 -5.005 1.00 0.00 C ATOM 45 CG2 ILE A 3 -1.049 10.062 -6.548 1.00 0.00 C ATOM 46 CD1 ILE A 3 1.959 11.700 -4.921 1.00 0.00 C ATOM 0 H ILE A 3 2.977 9.067 -7.021 1.00 0.00 H new ATOM 0 HA ILE A 3 0.654 8.286 -5.343 1.00 0.00 H new ATOM 0 HB ILE A 3 0.969 10.680 -7.125 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.182 11.647 -4.895 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.579 10.246 -4.168 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.477 11.063 -6.602 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.236 9.536 -7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.510 9.514 -5.726 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.016 12.226 -3.968 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.789 10.998 -4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.016 12.421 -5.737 1.00 0.00 H new ATOM 58 N LEU A 4 -0.409 7.205 -7.386 1.00 0.00 N ATOM 59 CA LEU A 4 -0.860 6.303 -8.433 1.00 0.00 C ATOM 60 C LEU A 4 -2.379 6.371 -8.560 1.00 0.00 C ATOM 61 O LEU A 4 -3.045 6.895 -7.668 1.00 0.00 O ATOM 62 CB LEU A 4 -0.473 4.867 -8.069 1.00 0.00 C ATOM 63 CG LEU A 4 1.033 4.634 -7.930 1.00 0.00 C ATOM 64 CD1 LEU A 4 1.225 3.202 -7.437 1.00 0.00 C ATOM 65 CD2 LEU A 4 1.753 4.793 -9.265 1.00 0.00 C ATOM 0 H LEU A 4 -1.038 7.242 -6.584 1.00 0.00 H new ATOM 0 HA LEU A 4 -0.395 6.596 -9.374 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -0.958 4.600 -7.130 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.864 4.194 -8.832 1.00 0.00 H new ATOM 0 HG LEU A 4 1.448 5.367 -7.238 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.289 2.996 -7.325 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.728 3.079 -6.475 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.795 2.508 -8.159 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.820 4.620 -9.126 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.359 4.070 -9.979 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.596 5.802 -9.645 1.00 0.00 H new ATOM 77 N THR A 5 -2.922 5.843 -9.662 1.00 0.00 N ATOM 78 CA THR A 5 -4.369 5.727 -9.804 1.00 0.00 C ATOM 79 C THR A 5 -4.709 4.399 -10.472 1.00 0.00 C ATOM 80 O THR A 5 -4.688 4.279 -11.695 1.00 0.00 O ATOM 81 CB THR A 5 -4.963 6.916 -10.573 1.00 0.00 C ATOM 82 OG1 THR A 5 -4.186 8.083 -10.398 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.372 7.202 -10.066 1.00 0.00 C ATOM 0 H THR A 5 -2.386 5.495 -10.457 1.00 0.00 H new ATOM 0 HA THR A 5 -4.820 5.747 -8.812 1.00 0.00 H new ATOM 0 HB THR A 5 -4.977 6.652 -11.630 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.588 8.822 -10.900 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.791 8.046 -10.613 1.00 0.00 H new ATOM 0 HG22 THR A 5 -6.999 6.323 -10.218 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.335 7.441 -9.003 1.00 0.00 H new ATOM 91 N ARG A 6 -5.022 3.400 -9.643 1.00 0.00 N ATOM 92 CA ARG A 6 -5.381 2.053 -10.076 1.00 0.00 C ATOM 93 C ARG A 6 -6.887 1.869 -9.931 1.00 0.00 C ATOM 94 O ARG A 6 -7.559 2.784 -9.468 1.00 0.00 O ATOM 95 CB ARG A 6 -4.643 1.040 -9.189 1.00 0.00 C ATOM 96 CG ARG A 6 -3.128 1.081 -9.415 1.00 0.00 C ATOM 97 CD ARG A 6 -2.697 0.112 -10.514 1.00 0.00 C ATOM 98 NE ARG A 6 -3.455 0.311 -11.755 1.00 0.00 N ATOM 99 CZ ARG A 6 -2.972 0.798 -12.903 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.693 1.138 -13.028 1.00 0.00 N ATOM 101 NH2 ARG A 6 -3.794 0.944 -13.938 1.00 0.00 N ATOM 0 H ARG A 6 -5.032 3.511 -8.629 1.00 0.00 H new ATOM 0 HA ARG A 6 -5.100 1.900 -11.118 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -4.860 1.249 -8.141 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -5.014 0.037 -9.397 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -2.827 2.094 -9.683 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -2.614 0.831 -8.487 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -1.634 0.242 -10.715 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -2.833 -0.912 -10.167 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.442 0.054 -11.740 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.057 1.029 -12.238 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -1.348 1.507 -13.914 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -4.777 0.686 -13.849 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -3.442 1.314 -14.821 1.00 0.00 H new ATOM 115 N LYS A 7 -7.425 0.710 -10.310 1.00 0.00 N ATOM 116 CA LYS A 7 -8.821 0.371 -10.042 1.00 0.00 C ATOM 117 C LYS A 7 -8.925 -1.040 -9.478 1.00 0.00 C ATOM 118 O LYS A 7 -7.937 -1.768 -9.426 1.00 0.00 O ATOM 119 CB LYS A 7 -9.730 0.542 -11.268 1.00 0.00 C ATOM 120 CG LYS A 7 -9.331 -0.365 -12.433 1.00 0.00 C ATOM 121 CD LYS A 7 -10.510 -0.504 -13.399 1.00 0.00 C ATOM 122 CE LYS A 7 -10.852 0.841 -14.033 1.00 0.00 C ATOM 123 NZ LYS A 7 -11.927 0.705 -15.033 1.00 0.00 N ATOM 0 H LYS A 7 -6.909 -0.015 -10.808 1.00 0.00 H new ATOM 0 HA LYS A 7 -9.180 1.081 -9.297 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -10.760 0.328 -10.983 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.699 1.581 -11.595 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.468 0.051 -12.953 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.035 -1.346 -12.060 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.265 -1.226 -14.178 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.379 -0.892 -12.867 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.160 1.543 -13.258 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.963 1.259 -14.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.137 1.636 -15.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -11.622 0.054 -15.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -12.782 0.329 -14.575 1.00 0.00 H new ATOM 137 N VAL A 8 -10.128 -1.423 -9.054 1.00 0.00 N ATOM 138 CA VAL A 8 -10.311 -2.672 -8.329 1.00 0.00 C ATOM 139 C VAL A 8 -9.847 -3.882 -9.135 1.00 0.00 C ATOM 140 O VAL A 8 -10.178 -4.023 -10.313 1.00 0.00 O ATOM 141 CB VAL A 8 -11.754 -2.810 -7.826 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.144 -1.547 -7.054 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.792 -3.024 -8.923 1.00 0.00 C ATOM 0 H VAL A 8 -10.984 -0.888 -9.200 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.668 -2.641 -7.450 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.760 -3.703 -7.201 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.169 -1.642 -6.695 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.473 -1.418 -6.205 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.068 -0.681 -7.711 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.782 -3.111 -8.475 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.777 -2.177 -9.609 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.560 -3.938 -9.470 1.00 0.00 H new ATOM 153 N GLY A 9 -9.077 -4.751 -8.474 1.00 0.00 N ATOM 154 CA GLY A 9 -8.574 -5.982 -9.067 1.00 0.00 C ATOM 155 C GLY A 9 -7.118 -5.863 -9.521 1.00 0.00 C ATOM 156 O GLY A 9 -6.512 -6.871 -9.882 1.00 0.00 O ATOM 0 H GLY A 9 -8.786 -4.614 -7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.660 -6.792 -8.342 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.196 -6.251 -9.921 1.00 0.00 H new ATOM 160 N GLU A 10 -6.547 -4.653 -9.505 1.00 0.00 N ATOM 161 CA GLU A 10 -5.166 -4.429 -9.915 1.00 0.00 C ATOM 162 C GLU A 10 -4.214 -4.499 -8.718 1.00 0.00 C ATOM 163 O GLU A 10 -4.648 -4.705 -7.583 1.00 0.00 O ATOM 164 CB GLU A 10 -5.062 -3.080 -10.639 1.00 0.00 C ATOM 165 CG GLU A 10 -5.952 -3.091 -11.886 1.00 0.00 C ATOM 166 CD GLU A 10 -5.755 -1.831 -12.723 1.00 0.00 C ATOM 167 OE1 GLU A 10 -5.927 -0.727 -12.164 1.00 0.00 O ATOM 168 OE2 GLU A 10 -5.427 -1.982 -13.923 1.00 0.00 O ATOM 0 H GLU A 10 -7.032 -3.807 -9.207 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.866 -5.220 -10.603 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.366 -2.274 -9.971 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.027 -2.887 -10.921 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.724 -3.970 -12.490 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.997 -3.172 -11.588 1.00 0.00 H new ATOM 175 N SER A 11 -2.910 -4.329 -8.967 1.00 0.00 N ATOM 176 CA SER A 11 -1.894 -4.493 -7.937 1.00 0.00 C ATOM 177 C SER A 11 -0.762 -3.481 -8.084 1.00 0.00 C ATOM 178 O SER A 11 -0.649 -2.795 -9.101 1.00 0.00 O ATOM 179 CB SER A 11 -1.317 -5.911 -8.004 1.00 0.00 C ATOM 180 OG SER A 11 -2.329 -6.872 -7.778 1.00 0.00 O ATOM 0 H SER A 11 -2.538 -4.076 -9.882 1.00 0.00 H new ATOM 0 HA SER A 11 -2.373 -4.323 -6.973 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.861 -6.078 -8.980 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.528 -6.024 -7.260 1.00 0.00 H new ATOM 0 HG SER A 11 -1.943 -7.771 -7.826 1.00 0.00 H new ATOM 186 N ILE A 12 0.075 -3.399 -7.047 1.00 0.00 N ATOM 187 CA ILE A 12 1.203 -2.476 -6.932 1.00 0.00 C ATOM 188 C ILE A 12 2.313 -3.208 -6.170 1.00 0.00 C ATOM 189 O ILE A 12 2.062 -4.262 -5.587 1.00 0.00 O ATOM 190 CB ILE A 12 0.747 -1.199 -6.192 1.00 0.00 C ATOM 191 CG1 ILE A 12 -0.548 -0.649 -6.809 1.00 0.00 C ATOM 192 CG2 ILE A 12 1.830 -0.109 -6.224 1.00 0.00 C ATOM 193 CD1 ILE A 12 -1.111 0.529 -6.018 1.00 0.00 C ATOM 0 H ILE A 12 -0.021 -4.001 -6.229 1.00 0.00 H new ATOM 0 HA ILE A 12 1.576 -2.169 -7.909 1.00 0.00 H new ATOM 0 HB ILE A 12 0.566 -1.476 -5.153 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.355 -0.336 -7.835 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.293 -1.443 -6.853 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.473 0.774 -5.694 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.735 -0.481 -5.743 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.051 0.154 -7.258 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.026 0.883 -6.493 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.331 0.211 -4.999 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -0.378 1.336 -5.996 1.00 0.00 H new ATOM 205 N ASN A 13 3.540 -2.678 -6.155 1.00 0.00 N ATOM 206 CA ASN A 13 4.658 -3.345 -5.502 1.00 0.00 C ATOM 207 C ASN A 13 5.577 -2.372 -4.771 1.00 0.00 C ATOM 208 O ASN A 13 5.650 -1.192 -5.113 1.00 0.00 O ATOM 209 CB ASN A 13 5.468 -4.116 -6.545 1.00 0.00 C ATOM 210 CG ASN A 13 4.763 -5.404 -6.948 1.00 0.00 C ATOM 211 OD1 ASN A 13 4.075 -5.458 -7.960 1.00 0.00 O ATOM 212 ND2 ASN A 13 4.933 -6.449 -6.148 1.00 0.00 N ATOM 0 H ASN A 13 3.779 -1.787 -6.590 1.00 0.00 H new ATOM 0 HA ASN A 13 4.241 -4.022 -4.757 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.621 -3.491 -7.425 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.455 -4.348 -6.144 1.00 0.00 H new ATOM 0 HD21 ASN A 13 4.483 -7.338 -6.367 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.514 -6.364 -5.314 1.00 0.00 H new ATOM 219 N ILE A 14 6.274 -2.893 -3.758 1.00 0.00 N ATOM 220 CA ILE A 14 7.240 -2.150 -2.959 1.00 0.00 C ATOM 221 C ILE A 14 8.437 -3.055 -2.660 1.00 0.00 C ATOM 222 O ILE A 14 8.294 -4.277 -2.572 1.00 0.00 O ATOM 223 CB ILE A 14 6.583 -1.654 -1.657 1.00 0.00 C ATOM 224 CG1 ILE A 14 5.313 -0.847 -1.970 1.00 0.00 C ATOM 225 CG2 ILE A 14 7.572 -0.795 -0.859 1.00 0.00 C ATOM 226 CD1 ILE A 14 4.616 -0.335 -0.710 1.00 0.00 C ATOM 0 H ILE A 14 6.177 -3.866 -3.467 1.00 0.00 H new ATOM 0 HA ILE A 14 7.585 -1.276 -3.511 1.00 0.00 H new ATOM 0 HB ILE A 14 6.305 -2.520 -1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.572 -0.001 -2.606 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.621 -1.471 -2.536 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.096 -0.450 0.059 1.00 0.00 H new ATOM 0 HG22 ILE A 14 8.452 -1.389 -0.611 1.00 0.00 H new ATOM 0 HG23 ILE A 14 7.872 0.065 -1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 14 3.726 0.228 -0.990 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.329 -1.180 -0.084 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.295 0.313 -0.156 1.00 0.00 H new ATOM 238 N GLY A 15 9.622 -2.455 -2.503 1.00 0.00 N ATOM 239 CA GLY A 15 10.845 -3.191 -2.228 1.00 0.00 C ATOM 240 C GLY A 15 11.070 -4.271 -3.276 1.00 0.00 C ATOM 241 O GLY A 15 10.824 -4.058 -4.463 1.00 0.00 O ATOM 0 H GLY A 15 9.752 -1.445 -2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.693 -2.506 -2.217 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.788 -3.644 -1.238 1.00 0.00 H new ATOM 245 N ASP A 16 11.542 -5.434 -2.828 1.00 0.00 N ATOM 246 CA ASP A 16 11.763 -6.592 -3.683 1.00 0.00 C ATOM 247 C ASP A 16 11.090 -7.821 -3.066 1.00 0.00 C ATOM 248 O ASP A 16 11.310 -8.946 -3.515 1.00 0.00 O ATOM 249 CB ASP A 16 13.264 -6.815 -3.876 1.00 0.00 C ATOM 250 CG ASP A 16 13.929 -5.629 -4.569 1.00 0.00 C ATOM 251 OD1 ASP A 16 13.873 -5.588 -5.817 1.00 0.00 O ATOM 252 OD2 ASP A 16 14.489 -4.774 -3.845 1.00 0.00 O ATOM 0 H ASP A 16 11.783 -5.597 -1.850 1.00 0.00 H new ATOM 0 HA ASP A 16 11.320 -6.418 -4.664 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.734 -6.980 -2.907 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.424 -7.717 -4.466 1.00 0.00 H new ATOM 257 N ASP A 17 10.270 -7.603 -2.033 1.00 0.00 N ATOM 258 CA ASP A 17 9.604 -8.667 -1.296 1.00 0.00 C ATOM 259 C ASP A 17 8.196 -8.262 -0.852 1.00 0.00 C ATOM 260 O ASP A 17 7.600 -8.964 -0.037 1.00 0.00 O ATOM 261 CB ASP A 17 10.439 -9.043 -0.069 1.00 0.00 C ATOM 262 CG ASP A 17 11.822 -9.562 -0.455 1.00 0.00 C ATOM 263 OD1 ASP A 17 11.911 -10.766 -0.790 1.00 0.00 O ATOM 264 OD2 ASP A 17 12.778 -8.753 -0.413 1.00 0.00 O ATOM 0 H ASP A 17 10.051 -6.669 -1.686 1.00 0.00 H new ATOM 0 HA ASP A 17 9.509 -9.523 -1.964 1.00 0.00 H new ATOM 0 HB2 ASP A 17 10.546 -8.172 0.577 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.914 -9.805 0.507 1.00 0.00 H new ATOM 269 N ILE A 18 7.644 -7.151 -1.361 1.00 0.00 N ATOM 270 CA ILE A 18 6.321 -6.704 -0.949 1.00 0.00 C ATOM 271 C ILE A 18 5.434 -6.459 -2.166 1.00 0.00 C ATOM 272 O ILE A 18 5.899 -6.032 -3.221 1.00 0.00 O ATOM 273 CB ILE A 18 6.409 -5.446 -0.075 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.312 -5.638 1.153 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.015 -5.045 0.414 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.750 -5.219 0.847 1.00 0.00 C ATOM 0 H ILE A 18 8.096 -6.554 -2.054 1.00 0.00 H new ATOM 0 HA ILE A 18 5.870 -7.494 -0.349 1.00 0.00 H new ATOM 0 HB ILE A 18 6.843 -4.667 -0.702 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.928 -5.050 1.987 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.292 -6.683 1.464 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.090 -4.151 1.033 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.374 -4.840 -0.443 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.587 -5.858 1.001 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.368 -5.365 1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.139 -5.825 0.029 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.769 -4.168 0.560 1.00 0.00 H new ATOM 288 N THR A 19 4.136 -6.735 -1.995 1.00 0.00 N ATOM 289 CA THR A 19 3.120 -6.529 -3.015 1.00 0.00 C ATOM 290 C THR A 19 1.879 -5.941 -2.353 1.00 0.00 C ATOM 291 O THR A 19 1.656 -6.136 -1.159 1.00 0.00 O ATOM 292 CB THR A 19 2.797 -7.868 -3.694 1.00 0.00 C ATOM 293 OG1 THR A 19 3.983 -8.453 -4.186 1.00 0.00 O ATOM 294 CG2 THR A 19 1.831 -7.693 -4.865 1.00 0.00 C ATOM 0 H THR A 19 3.763 -7.115 -1.125 1.00 0.00 H new ATOM 0 HA THR A 19 3.478 -5.838 -3.778 1.00 0.00 H new ATOM 0 HB THR A 19 2.330 -8.506 -2.944 1.00 0.00 H new ATOM 0 HG1 THR A 19 3.772 -9.307 -4.617 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.628 -8.664 -5.318 1.00 0.00 H new ATOM 0 HG22 THR A 19 0.898 -7.259 -4.505 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.276 -7.032 -5.608 1.00 0.00 H new ATOM 302 N ILE A 20 1.073 -5.221 -3.133 1.00 0.00 N ATOM 303 CA ILE A 20 -0.143 -4.574 -2.663 1.00 0.00 C ATOM 304 C ILE A 20 -1.241 -4.845 -3.683 1.00 0.00 C ATOM 305 O ILE A 20 -0.960 -4.951 -4.874 1.00 0.00 O ATOM 306 CB ILE A 20 0.100 -3.064 -2.534 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.248 -2.730 -1.575 1.00 0.00 C ATOM 308 CG2 ILE A 20 -1.173 -2.336 -2.093 1.00 0.00 C ATOM 309 CD1 ILE A 20 0.922 -3.053 -0.117 1.00 0.00 C ATOM 0 H ILE A 20 1.253 -5.071 -4.126 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.436 -4.962 -1.687 1.00 0.00 H new ATOM 0 HB ILE A 20 0.388 -2.717 -3.526 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.137 -3.285 -1.874 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.490 -1.671 -1.661 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.971 -1.268 -2.010 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.960 -2.500 -2.829 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -1.495 -2.721 -1.125 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.774 -2.794 0.512 1.00 0.00 H new ATOM 0 HD12 ILE A 20 0.051 -2.478 0.197 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.709 -4.117 -0.019 1.00 0.00 H new ATOM 321 N THR A 21 -2.487 -4.954 -3.222 1.00 0.00 N ATOM 322 CA THR A 21 -3.613 -5.212 -4.109 1.00 0.00 C ATOM 323 C THR A 21 -4.822 -4.408 -3.659 1.00 0.00 C ATOM 324 O THR A 21 -5.009 -4.177 -2.466 1.00 0.00 O ATOM 325 CB THR A 21 -3.933 -6.713 -4.102 1.00 0.00 C ATOM 326 OG1 THR A 21 -2.771 -7.450 -4.409 1.00 0.00 O ATOM 327 CG2 THR A 21 -5.001 -7.064 -5.133 1.00 0.00 C ATOM 0 H THR A 21 -2.739 -4.867 -2.237 1.00 0.00 H new ATOM 0 HA THR A 21 -3.356 -4.909 -5.124 1.00 0.00 H new ATOM 0 HB THR A 21 -4.301 -6.962 -3.107 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.980 -8.408 -4.402 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.201 -8.135 -5.099 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.916 -6.516 -4.909 1.00 0.00 H new ATOM 0 HG23 THR A 21 -4.649 -6.792 -6.128 1.00 0.00 H new ATOM 335 N ILE A 22 -5.644 -3.984 -4.619 1.00 0.00 N ATOM 336 CA ILE A 22 -6.872 -3.252 -4.359 1.00 0.00 C ATOM 337 C ILE A 22 -8.043 -4.210 -4.579 1.00 0.00 C ATOM 338 O ILE A 22 -8.522 -4.388 -5.697 1.00 0.00 O ATOM 339 CB ILE A 22 -6.916 -1.973 -5.217 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.299 -1.319 -5.239 1.00 0.00 C ATOM 341 CG2 ILE A 22 -6.489 -2.224 -6.665 1.00 0.00 C ATOM 342 CD1 ILE A 22 -8.834 -1.080 -3.832 1.00 0.00 C ATOM 0 H ILE A 22 -5.468 -4.144 -5.611 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.931 -2.900 -3.329 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.207 -1.299 -4.737 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.244 -0.370 -5.773 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.993 -1.955 -5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.538 -1.291 -7.226 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.468 -2.605 -6.682 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.157 -2.956 -7.120 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.818 -0.614 -3.891 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -8.914 -2.032 -3.307 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.153 -0.423 -3.291 1.00 0.00 H new ATOM 354 N LEU A 23 -8.506 -4.836 -3.488 1.00 0.00 N ATOM 355 CA LEU A 23 -9.503 -5.896 -3.559 1.00 0.00 C ATOM 356 C LEU A 23 -10.856 -5.374 -4.043 1.00 0.00 C ATOM 357 O LEU A 23 -11.625 -6.130 -4.633 1.00 0.00 O ATOM 358 CB LEU A 23 -9.664 -6.556 -2.181 1.00 0.00 C ATOM 359 CG LEU A 23 -8.338 -6.972 -1.534 1.00 0.00 C ATOM 360 CD1 LEU A 23 -8.622 -7.768 -0.263 1.00 0.00 C ATOM 361 CD2 LEU A 23 -7.495 -7.858 -2.446 1.00 0.00 C ATOM 0 H LEU A 23 -8.198 -4.619 -2.540 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.152 -6.632 -4.283 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.181 -5.864 -1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.300 -7.436 -2.282 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.787 -6.054 -1.327 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.680 -8.065 0.199 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.189 -7.151 0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.200 -8.658 -0.512 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.567 -8.124 -1.939 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.050 -8.765 -2.686 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.265 -7.319 -3.365 1.00 0.00 H new ATOM 373 N GLY A 24 -11.149 -4.090 -3.803 1.00 0.00 N ATOM 374 CA GLY A 24 -12.384 -3.472 -4.268 1.00 0.00 C ATOM 375 C GLY A 24 -12.737 -2.226 -3.466 1.00 0.00 C ATOM 376 O GLY A 24 -11.941 -1.762 -2.651 1.00 0.00 O ATOM 0 H GLY A 24 -10.538 -3.459 -3.284 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.283 -3.209 -5.321 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.199 -4.192 -4.196 1.00 0.00 H new ATOM 380 N VAL A 25 -13.933 -1.681 -3.696 1.00 0.00 N ATOM 381 CA VAL A 25 -14.414 -0.513 -2.971 1.00 0.00 C ATOM 382 C VAL A 25 -15.789 -0.775 -2.367 1.00 0.00 C ATOM 383 O VAL A 25 -16.486 -1.705 -2.763 1.00 0.00 O ATOM 384 CB VAL A 25 -14.463 0.729 -3.877 1.00 0.00 C ATOM 385 CG1 VAL A 25 -13.101 1.004 -4.509 1.00 0.00 C ATOM 386 CG2 VAL A 25 -15.514 0.574 -4.978 1.00 0.00 C ATOM 0 H VAL A 25 -14.591 -2.039 -4.389 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.708 -0.318 -2.163 1.00 0.00 H new ATOM 0 HB VAL A 25 -14.738 1.574 -3.246 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.166 1.888 -5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.364 1.175 -3.725 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.799 0.147 -5.110 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.523 1.469 -5.601 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -15.272 -0.293 -5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.496 0.436 -4.526 1.00 0.00 H new ATOM 396 N SER A 26 -16.167 0.061 -1.400 1.00 0.00 N ATOM 397 CA SER A 26 -17.461 0.016 -0.739 1.00 0.00 C ATOM 398 C SER A 26 -17.796 1.438 -0.308 1.00 0.00 C ATOM 399 O SER A 26 -17.696 1.787 0.870 1.00 0.00 O ATOM 400 CB SER A 26 -17.400 -0.942 0.453 1.00 0.00 C ATOM 401 OG SER A 26 -18.651 -0.983 1.108 1.00 0.00 O ATOM 0 H SER A 26 -15.563 0.805 -1.050 1.00 0.00 H new ATOM 0 HA SER A 26 -18.240 -0.355 -1.405 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.126 -1.941 0.113 1.00 0.00 H new ATOM 0 HB3 SER A 26 -16.626 -0.619 1.150 1.00 0.00 H new ATOM 0 HG SER A 26 -18.602 -1.600 1.868 1.00 0.00 H new ATOM 407 N GLY A 27 -18.201 2.269 -1.271 1.00 0.00 N ATOM 408 CA GLY A 27 -18.420 3.678 -1.003 1.00 0.00 C ATOM 409 C GLY A 27 -17.084 4.347 -0.713 1.00 0.00 C ATOM 410 O GLY A 27 -16.092 4.059 -1.378 1.00 0.00 O ATOM 0 H GLY A 27 -18.381 1.986 -2.234 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -18.900 4.153 -1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -19.092 3.798 -0.154 1.00 0.00 H new ATOM 414 N GLN A 28 -17.047 5.240 0.278 1.00 0.00 N ATOM 415 CA GLN A 28 -15.812 5.896 0.683 1.00 0.00 C ATOM 416 C GLN A 28 -14.842 4.920 1.341 1.00 0.00 C ATOM 417 O GLN A 28 -13.678 5.270 1.531 1.00 0.00 O ATOM 418 CB GLN A 28 -16.137 7.061 1.618 1.00 0.00 C ATOM 419 CG GLN A 28 -16.331 8.359 0.827 1.00 0.00 C ATOM 420 CD GLN A 28 -17.126 8.139 -0.456 1.00 0.00 C ATOM 421 OE1 GLN A 28 -18.338 7.943 -0.421 1.00 0.00 O ATOM 422 NE2 GLN A 28 -16.444 8.167 -1.600 1.00 0.00 N ATOM 0 H GLN A 28 -17.866 5.524 0.815 1.00 0.00 H new ATOM 0 HA GLN A 28 -15.316 6.279 -0.209 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -17.041 6.837 2.184 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -15.331 7.188 2.341 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -16.846 9.089 1.451 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -15.357 8.781 0.581 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -15.438 8.333 -1.590 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -16.928 8.023 -2.486 1.00 0.00 H new ATOM 431 N GLN A 29 -15.282 3.707 1.695 1.00 0.00 N ATOM 432 CA GLN A 29 -14.363 2.697 2.199 1.00 0.00 C ATOM 433 C GLN A 29 -13.721 1.997 1.007 1.00 0.00 C ATOM 434 O GLN A 29 -14.321 1.924 -0.067 1.00 0.00 O ATOM 435 CB GLN A 29 -15.106 1.670 3.055 1.00 0.00 C ATOM 436 CG GLN A 29 -14.202 1.101 4.151 1.00 0.00 C ATOM 437 CD GLN A 29 -14.164 1.963 5.403 1.00 0.00 C ATOM 438 OE1 GLN A 29 -13.105 2.437 5.799 1.00 0.00 O ATOM 439 NE2 GLN A 29 -15.312 2.171 6.039 1.00 0.00 N ATOM 0 H GLN A 29 -16.256 3.410 1.641 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.604 3.173 2.819 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -15.981 2.136 3.508 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -15.468 0.860 2.422 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -14.548 0.102 4.416 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.190 0.995 3.760 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -16.175 1.761 5.681 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -15.330 2.741 6.885 1.00 0.00 H new ATOM 448 N VAL A 30 -12.509 1.476 1.186 1.00 0.00 N ATOM 449 CA VAL A 30 -11.802 0.771 0.133 1.00 0.00 C ATOM 450 C VAL A 30 -11.160 -0.465 0.740 1.00 0.00 C ATOM 451 O VAL A 30 -10.475 -0.371 1.755 1.00 0.00 O ATOM 452 CB VAL A 30 -10.748 1.697 -0.483 1.00 0.00 C ATOM 453 CG1 VAL A 30 -10.010 0.975 -1.605 1.00 0.00 C ATOM 454 CG2 VAL A 30 -11.397 2.948 -1.073 1.00 0.00 C ATOM 0 H VAL A 30 -11.995 1.533 2.065 1.00 0.00 H new ATOM 0 HA VAL A 30 -12.485 0.468 -0.660 1.00 0.00 H new ATOM 0 HB VAL A 30 -10.056 1.982 0.309 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -9.263 1.641 -2.037 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.518 0.088 -1.205 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -10.721 0.679 -2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -10.627 3.588 -1.504 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -12.105 2.659 -1.850 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -11.922 3.491 -0.287 1.00 0.00 H new ATOM 464 N ARG A 31 -11.378 -1.629 0.121 1.00 0.00 N ATOM 465 CA ARG A 31 -10.835 -2.876 0.638 1.00 0.00 C ATOM 466 C ARG A 31 -9.500 -3.125 -0.042 1.00 0.00 C ATOM 467 O ARG A 31 -9.414 -3.123 -1.269 1.00 0.00 O ATOM 468 CB ARG A 31 -11.815 -4.018 0.388 1.00 0.00 C ATOM 469 CG ARG A 31 -11.516 -5.164 1.358 1.00 0.00 C ATOM 470 CD ARG A 31 -12.476 -6.321 1.113 1.00 0.00 C ATOM 471 NE ARG A 31 -12.503 -7.223 2.267 1.00 0.00 N ATOM 472 CZ ARG A 31 -12.453 -8.556 2.211 1.00 0.00 C ATOM 473 NH1 ARG A 31 -12.353 -9.202 1.053 1.00 0.00 N ATOM 474 NH2 ARG A 31 -12.505 -9.254 3.341 1.00 0.00 N ATOM 0 H ARG A 31 -11.925 -1.728 -0.734 1.00 0.00 H new ATOM 0 HA ARG A 31 -10.683 -2.814 1.716 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -12.839 -3.670 0.523 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -11.730 -4.366 -0.641 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -10.487 -5.501 1.229 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -11.610 -4.815 2.386 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -13.478 -5.935 0.923 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -12.172 -6.871 0.222 1.00 0.00 H new ATOM 0 HE ARG A 31 -12.565 -6.797 3.191 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.313 -8.678 0.179 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -12.317 -10.221 1.039 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -12.582 -8.771 4.236 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.468 -10.273 3.313 1.00 0.00 H new ATOM 488 N ILE A 32 -8.460 -3.341 0.757 1.00 0.00 N ATOM 489 CA ILE A 32 -7.089 -3.376 0.265 1.00 0.00 C ATOM 490 C ILE A 32 -6.365 -4.576 0.857 1.00 0.00 C ATOM 491 O ILE A 32 -6.742 -5.063 1.918 1.00 0.00 O ATOM 492 CB ILE A 32 -6.372 -2.064 0.635 1.00 0.00 C ATOM 493 CG1 ILE A 32 -7.306 -0.859 0.446 1.00 0.00 C ATOM 494 CG2 ILE A 32 -5.104 -1.904 -0.211 1.00 0.00 C ATOM 495 CD1 ILE A 32 -6.595 0.479 0.658 1.00 0.00 C ATOM 0 H ILE A 32 -8.544 -3.496 1.762 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.089 -3.474 -0.821 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.089 -2.106 1.687 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -7.728 -0.886 -0.559 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.139 -0.937 1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.603 -0.974 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.434 -2.744 -0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.372 -1.881 -1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -7.303 1.295 0.512 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.196 0.522 1.671 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.779 0.575 -0.058 1.00 0.00 H new ATOM 507 N GLY A 33 -5.329 -5.058 0.170 1.00 0.00 N ATOM 508 CA GLY A 33 -4.550 -6.192 0.631 1.00 0.00 C ATOM 509 C GLY A 33 -3.058 -5.889 0.568 1.00 0.00 C ATOM 510 O GLY A 33 -2.618 -5.022 -0.190 1.00 0.00 O ATOM 0 H GLY A 33 -5.012 -4.670 -0.719 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.832 -6.440 1.654 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.774 -7.065 0.018 1.00 0.00 H new ATOM 514 N ILE A 34 -2.284 -6.612 1.379 1.00 0.00 N ATOM 515 CA ILE A 34 -0.851 -6.423 1.508 1.00 0.00 C ATOM 516 C ILE A 34 -0.198 -7.787 1.621 1.00 0.00 C ATOM 517 O ILE A 34 -0.743 -8.692 2.250 1.00 0.00 O ATOM 518 CB ILE A 34 -0.554 -5.601 2.767 1.00 0.00 C ATOM 519 CG1 ILE A 34 -1.314 -4.266 2.753 1.00 0.00 C ATOM 520 CG2 ILE A 34 0.957 -5.365 2.890 1.00 0.00 C ATOM 521 CD1 ILE A 34 -1.188 -3.545 4.091 1.00 0.00 C ATOM 0 H ILE A 34 -2.649 -7.357 1.972 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.460 -5.892 0.640 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.897 -6.164 3.635 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.925 -3.631 1.957 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.366 -4.446 2.532 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.162 -4.780 3.787 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.471 -6.324 2.957 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.313 -4.823 2.014 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.736 -2.604 4.050 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.601 -4.171 4.882 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.137 -3.344 4.298 1.00 0.00 H new ATOM 533 N ASN A 35 0.975 -7.939 1.012 1.00 0.00 N ATOM 534 CA ASN A 35 1.655 -9.214 0.982 1.00 0.00 C ATOM 535 C ASN A 35 3.152 -9.003 1.170 1.00 0.00 C ATOM 536 O ASN A 35 3.840 -8.539 0.265 1.00 0.00 O ATOM 537 CB ASN A 35 1.313 -9.890 -0.345 1.00 0.00 C ATOM 538 CG ASN A 35 1.704 -11.362 -0.375 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.705 -11.768 0.203 1.00 0.00 O ATOM 540 ND2 ASN A 35 0.896 -12.173 -1.053 1.00 0.00 N ATOM 0 H ASN A 35 1.470 -7.186 0.533 1.00 0.00 H new ATOM 0 HA ASN A 35 1.331 -9.863 1.795 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.242 -9.799 -0.529 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.821 -9.367 -1.155 1.00 0.00 H new ATOM 0 HD21 ASN A 35 1.101 -13.171 -1.104 1.00 0.00 H new ATOM 0 HD22 ASN A 35 0.072 -11.797 -1.521 1.00 0.00 H new ATOM 547 N ALA A 36 3.640 -9.355 2.361 1.00 0.00 N ATOM 548 CA ALA A 36 5.045 -9.242 2.721 1.00 0.00 C ATOM 549 C ALA A 36 5.409 -10.348 3.705 1.00 0.00 C ATOM 550 O ALA A 36 4.530 -10.886 4.382 1.00 0.00 O ATOM 551 CB ALA A 36 5.287 -7.884 3.380 1.00 0.00 C ATOM 0 H ALA A 36 3.058 -9.731 3.109 1.00 0.00 H new ATOM 0 HA ALA A 36 5.659 -9.334 1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.339 -7.794 3.652 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.023 -7.089 2.683 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.672 -7.800 4.276 1.00 0.00 H new ATOM 557 N PRO A 37 6.697 -10.687 3.793 1.00 0.00 N ATOM 558 CA PRO A 37 7.192 -11.658 4.744 1.00 0.00 C ATOM 559 C PRO A 37 6.990 -11.163 6.172 1.00 0.00 C ATOM 560 O PRO A 37 6.846 -9.966 6.408 1.00 0.00 O ATOM 561 CB PRO A 37 8.678 -11.806 4.424 1.00 0.00 C ATOM 562 CG PRO A 37 9.049 -10.499 3.727 1.00 0.00 C ATOM 563 CD PRO A 37 7.773 -10.157 2.976 1.00 0.00 C ATOM 0 HA PRO A 37 6.665 -12.609 4.670 1.00 0.00 H new ATOM 0 HB2 PRO A 37 9.266 -11.954 5.329 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.862 -12.666 3.780 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.322 -9.721 4.440 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.896 -10.624 3.053 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.672 -9.080 2.842 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.769 -10.604 1.982 1.00 0.00 H new ATOM 571 N LYS A 38 6.982 -12.090 7.134 1.00 0.00 N ATOM 572 CA LYS A 38 6.941 -11.739 8.549 1.00 0.00 C ATOM 573 C LYS A 38 8.264 -11.099 8.963 1.00 0.00 C ATOM 574 O LYS A 38 8.441 -10.709 10.114 1.00 0.00 O ATOM 575 CB LYS A 38 6.610 -12.980 9.379 1.00 0.00 C ATOM 576 CG LYS A 38 5.204 -13.473 9.033 1.00 0.00 C ATOM 577 CD LYS A 38 4.132 -12.532 9.585 1.00 0.00 C ATOM 578 CE LYS A 38 3.790 -12.922 11.022 1.00 0.00 C ATOM 579 NZ LYS A 38 2.715 -12.069 11.560 1.00 0.00 N ATOM 0 H LYS A 38 7.004 -13.094 6.953 1.00 0.00 H new ATOM 0 HA LYS A 38 6.155 -11.006 8.730 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.340 -13.766 9.183 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.672 -12.746 10.442 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.100 -13.551 7.951 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.057 -14.473 9.440 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.488 -11.502 9.553 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.238 -12.580 8.963 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.481 -13.967 11.055 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.678 -12.832 11.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.502 -12.354 12.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.022 -11.075 11.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.862 -12.175 10.974 1.00 0.00 H new ATOM 593 N ASP A 39 9.181 -11.000 8.000 1.00 0.00 N ATOM 594 CA ASP A 39 10.464 -10.325 8.133 1.00 0.00 C ATOM 595 C ASP A 39 10.284 -8.813 8.265 1.00 0.00 C ATOM 596 O ASP A 39 11.236 -8.097 8.575 1.00 0.00 O ATOM 597 CB ASP A 39 11.277 -10.629 6.876 1.00 0.00 C ATOM 598 CG ASP A 39 12.761 -10.349 7.080 1.00 0.00 C ATOM 599 OD1 ASP A 39 13.345 -10.976 7.993 1.00 0.00 O ATOM 600 OD2 ASP A 39 13.305 -9.512 6.324 1.00 0.00 O ATOM 0 H ASP A 39 9.042 -11.404 7.074 1.00 0.00 H new ATOM 0 HA ASP A 39 10.970 -10.679 9.031 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.139 -11.674 6.598 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.904 -10.027 6.048 1.00 0.00 H new ATOM 605 N VAL A 40 9.060 -8.319 8.030 1.00 0.00 N ATOM 606 CA VAL A 40 8.746 -6.895 8.086 1.00 0.00 C ATOM 607 C VAL A 40 7.417 -6.691 8.805 1.00 0.00 C ATOM 608 O VAL A 40 6.677 -7.644 9.041 1.00 0.00 O ATOM 609 CB VAL A 40 8.689 -6.294 6.669 1.00 0.00 C ATOM 610 CG1 VAL A 40 9.968 -6.605 5.887 1.00 0.00 C ATOM 611 CG2 VAL A 40 7.492 -6.814 5.873 1.00 0.00 C ATOM 0 H VAL A 40 8.259 -8.905 7.795 1.00 0.00 H new ATOM 0 HA VAL A 40 9.533 -6.382 8.639 1.00 0.00 H new ATOM 0 HB VAL A 40 8.586 -5.217 6.798 1.00 0.00 H new ATOM 0 HG11 VAL A 40 9.900 -6.169 4.890 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.826 -6.183 6.410 1.00 0.00 H new ATOM 0 HG13 VAL A 40 10.089 -7.685 5.803 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.492 -6.364 4.880 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.560 -7.898 5.780 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.569 -6.552 6.391 1.00 0.00 H new ATOM 621 N ALA A 41 7.108 -5.439 9.155 1.00 0.00 N ATOM 622 CA ALA A 41 5.896 -5.121 9.890 1.00 0.00 C ATOM 623 C ALA A 41 4.866 -4.460 8.980 1.00 0.00 C ATOM 624 O ALA A 41 5.220 -3.859 7.968 1.00 0.00 O ATOM 625 CB ALA A 41 6.253 -4.198 11.055 1.00 0.00 C ATOM 0 H ALA A 41 7.689 -4.630 8.936 1.00 0.00 H new ATOM 0 HA ALA A 41 5.455 -6.041 10.273 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.350 -3.952 11.614 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.962 -4.700 11.713 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.701 -3.282 10.670 1.00 0.00 H new ATOM 631 N VAL A 42 3.588 -4.571 9.342 1.00 0.00 N ATOM 632 CA VAL A 42 2.510 -3.886 8.645 1.00 0.00 C ATOM 633 C VAL A 42 1.317 -3.743 9.583 1.00 0.00 C ATOM 634 O VAL A 42 0.848 -4.732 10.147 1.00 0.00 O ATOM 635 CB VAL A 42 2.142 -4.632 7.352 1.00 0.00 C ATOM 636 CG1 VAL A 42 2.176 -6.146 7.539 1.00 0.00 C ATOM 637 CG2 VAL A 42 0.761 -4.234 6.842 1.00 0.00 C ATOM 0 H VAL A 42 3.275 -5.140 10.128 1.00 0.00 H new ATOM 0 HA VAL A 42 2.835 -2.888 8.352 1.00 0.00 H new ATOM 0 HB VAL A 42 2.894 -4.345 6.617 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.910 -6.634 6.602 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.179 -6.453 7.836 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.464 -6.433 8.313 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.539 -4.783 5.927 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.012 -4.470 7.598 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.744 -3.164 6.636 1.00 0.00 H new ATOM 647 N HIS A 43 0.822 -2.510 9.751 1.00 0.00 N ATOM 648 CA HIS A 43 -0.314 -2.228 10.625 1.00 0.00 C ATOM 649 C HIS A 43 -1.053 -0.982 10.142 1.00 0.00 C ATOM 650 O HIS A 43 -0.588 -0.286 9.237 1.00 0.00 O ATOM 651 CB HIS A 43 0.145 -1.983 12.067 1.00 0.00 C ATOM 652 CG HIS A 43 1.234 -2.901 12.560 1.00 0.00 C ATOM 653 ND1 HIS A 43 1.036 -4.089 13.264 1.00 0.00 N ATOM 654 CD2 HIS A 43 2.574 -2.696 12.390 1.00 0.00 C ATOM 655 CE1 HIS A 43 2.267 -4.571 13.501 1.00 0.00 C ATOM 656 NE2 HIS A 43 3.208 -3.757 12.994 1.00 0.00 N ATOM 0 H HIS A 43 1.199 -1.685 9.285 1.00 0.00 H new ATOM 0 HA HIS A 43 -0.972 -3.096 10.596 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.495 -0.954 12.150 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -0.717 -2.081 12.727 1.00 0.00 H new ATOM 0 HD1 HIS A 43 0.146 -4.503 13.540 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.042 -1.866 11.882 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.473 -5.490 14.029 1.00 0.00 H new ATOM 664 N ARG A 44 -2.211 -0.699 10.745 1.00 0.00 N ATOM 665 CA ARG A 44 -2.967 0.509 10.457 1.00 0.00 C ATOM 666 C ARG A 44 -2.221 1.687 11.066 1.00 0.00 C ATOM 667 O ARG A 44 -1.390 1.501 11.954 1.00 0.00 O ATOM 668 CB ARG A 44 -4.366 0.372 11.065 1.00 0.00 C ATOM 669 CG ARG A 44 -5.150 -0.713 10.321 1.00 0.00 C ATOM 670 CD ARG A 44 -6.414 -1.126 11.077 1.00 0.00 C ATOM 671 NE ARG A 44 -7.292 0.021 11.343 1.00 0.00 N ATOM 672 CZ ARG A 44 -7.600 0.473 12.564 1.00 0.00 C ATOM 673 NH1 ARG A 44 -7.131 -0.120 13.657 1.00 0.00 N ATOM 674 NH2 ARG A 44 -8.391 1.533 12.704 1.00 0.00 N ATOM 0 H ARG A 44 -2.644 -1.303 11.444 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.071 0.667 9.384 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.290 0.118 12.122 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.895 1.323 11.003 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.423 -0.349 9.331 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.513 -1.585 10.176 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.957 -1.872 10.496 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.136 -1.597 12.020 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.695 0.507 10.541 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.524 -0.936 13.574 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.378 0.241 14.579 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -8.764 2.003 11.879 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.624 1.876 13.636 1.00 0.00 H new ATOM 688 N GLU A 45 -2.508 2.902 10.605 1.00 0.00 N ATOM 689 CA GLU A 45 -1.837 4.081 11.131 1.00 0.00 C ATOM 690 C GLU A 45 -2.132 4.231 12.625 1.00 0.00 C ATOM 691 O GLU A 45 -1.395 4.898 13.347 1.00 0.00 O ATOM 692 CB GLU A 45 -2.269 5.296 10.303 1.00 0.00 C ATOM 693 CG GLU A 45 -1.345 6.510 10.439 1.00 0.00 C ATOM 694 CD GLU A 45 -1.496 7.251 11.759 1.00 0.00 C ATOM 695 OE1 GLU A 45 -2.657 7.471 12.175 1.00 0.00 O ATOM 696 OE2 GLU A 45 -0.443 7.594 12.344 1.00 0.00 O ATOM 0 H GLU A 45 -3.195 3.092 9.875 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.754 3.988 11.045 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.318 5.007 9.253 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.277 5.585 10.602 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -0.311 6.182 10.333 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.545 7.201 9.620 1.00 0.00 H new ATOM 703 N GLU A 46 -3.216 3.603 13.095 1.00 0.00 N ATOM 704 CA GLU A 46 -3.593 3.621 14.497 1.00 0.00 C ATOM 705 C GLU A 46 -2.671 2.724 15.324 1.00 0.00 C ATOM 706 O GLU A 46 -2.164 3.151 16.361 1.00 0.00 O ATOM 707 CB GLU A 46 -5.042 3.124 14.592 1.00 0.00 C ATOM 708 CG GLU A 46 -5.546 3.157 16.035 1.00 0.00 C ATOM 709 CD GLU A 46 -7.023 2.767 16.102 1.00 0.00 C ATOM 710 OE1 GLU A 46 -7.327 1.601 15.769 1.00 0.00 O ATOM 711 OE2 GLU A 46 -7.837 3.639 16.485 1.00 0.00 O ATOM 0 H GLU A 46 -3.853 3.068 12.504 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.504 4.632 14.895 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.683 3.744 13.966 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.106 2.107 14.205 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.957 2.474 16.647 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.409 4.156 16.450 1.00 0.00 H new ATOM 718 N ILE A 47 -2.448 1.490 14.867 1.00 0.00 N ATOM 719 CA ILE A 47 -1.645 0.516 15.594 1.00 0.00 C ATOM 720 C ILE A 47 -0.173 0.899 15.500 1.00 0.00 C ATOM 721 O ILE A 47 0.619 0.544 16.371 1.00 0.00 O ATOM 722 CB ILE A 47 -1.897 -0.885 15.015 1.00 0.00 C ATOM 723 CG1 ILE A 47 -3.194 -1.504 15.547 1.00 0.00 C ATOM 724 CG2 ILE A 47 -0.775 -1.859 15.399 1.00 0.00 C ATOM 725 CD1 ILE A 47 -4.442 -0.671 15.272 1.00 0.00 C ATOM 0 H ILE A 47 -2.820 1.142 13.983 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.927 0.507 16.647 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.951 -0.744 13.935 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.323 -2.490 15.100 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.099 -1.651 16.623 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.984 -2.841 14.974 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.175 -1.491 15.012 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.718 -1.939 16.485 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.316 -1.179 15.680 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.338 0.307 15.742 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.566 -0.545 14.196 1.00 0.00 H new ATOM 737 N TYR A 48 0.209 1.627 14.452 1.00 0.00 N ATOM 738 CA TYR A 48 1.589 2.021 14.259 1.00 0.00 C ATOM 739 C TYR A 48 2.074 2.904 15.408 1.00 0.00 C ATOM 740 O TYR A 48 3.220 2.793 15.833 1.00 0.00 O ATOM 741 CB TYR A 48 1.688 2.750 12.919 1.00 0.00 C ATOM 742 CG TYR A 48 3.100 3.084 12.513 1.00 0.00 C ATOM 743 CD1 TYR A 48 3.937 2.085 11.996 1.00 0.00 C ATOM 744 CD2 TYR A 48 3.568 4.399 12.658 1.00 0.00 C ATOM 745 CE1 TYR A 48 5.248 2.399 11.612 1.00 0.00 C ATOM 746 CE2 TYR A 48 4.871 4.719 12.264 1.00 0.00 C ATOM 747 CZ TYR A 48 5.717 3.721 11.739 1.00 0.00 C ATOM 748 OH TYR A 48 6.986 4.034 11.353 1.00 0.00 O ATOM 0 H TYR A 48 -0.427 1.953 13.724 1.00 0.00 H new ATOM 0 HA TYR A 48 2.231 1.140 14.249 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.234 2.132 12.145 1.00 0.00 H new ATOM 0 HB3 TYR A 48 1.108 3.671 12.973 1.00 0.00 H new ATOM 0 HD1 TYR A 48 3.572 1.074 11.894 1.00 0.00 H new ATOM 0 HD2 TYR A 48 2.924 5.161 13.072 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.897 1.630 11.220 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.230 5.733 12.362 1.00 0.00 H new ATOM 0 HH TYR A 48 7.149 4.988 11.507 1.00 0.00 H new ATOM 1211 N MET C 1 0.134 -12.395 4.346 1.00 0.00 N ATOM 1212 CA MET C 1 -0.956 -11.675 3.661 1.00 0.00 C ATOM 1213 C MET C 1 -1.838 -10.963 4.676 1.00 0.00 C ATOM 1214 O MET C 1 -2.173 -11.543 5.702 1.00 0.00 O ATOM 1215 CB MET C 1 -1.793 -12.652 2.826 1.00 0.00 C ATOM 1216 CG MET C 1 -2.950 -11.957 2.105 1.00 0.00 C ATOM 1217 SD MET C 1 -2.445 -10.784 0.824 1.00 0.00 S ATOM 1218 CE MET C 1 -4.091 -10.293 0.252 1.00 0.00 C ATOM 0 H1 MET C 1 0.273 -13.323 3.897 1.00 0.00 H new ATOM 0 H2 MET C 1 1.012 -11.842 4.278 1.00 0.00 H new ATOM 0 H3 MET C 1 -0.114 -12.529 5.347 1.00 0.00 H new ATOM 0 HA MET C 1 -0.518 -10.931 2.996 1.00 0.00 H new ATOM 0 HB2 MET C 1 -1.152 -13.141 2.092 1.00 0.00 H new ATOM 0 HB3 MET C 1 -2.189 -13.434 3.474 1.00 0.00 H new ATOM 0 HG2 MET C 1 -3.587 -12.717 1.652 1.00 0.00 H new ATOM 0 HG3 MET C 1 -3.556 -11.431 2.842 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.029 -9.943 -0.778 1.00 0.00 H new ATOM 0 HE2 MET C 1 -4.764 -11.148 0.304 1.00 0.00 H new ATOM 0 HE3 MET C 1 -4.472 -9.492 0.885 1.00 0.00 H new ATOM 1230 N LEU C 2 -2.223 -9.714 4.402 1.00 0.00 N ATOM 1231 CA LEU C 2 -3.136 -8.975 5.253 1.00 0.00 C ATOM 1232 C LEU C 2 -4.183 -8.276 4.398 1.00 0.00 C ATOM 1233 O LEU C 2 -3.930 -7.961 3.236 1.00 0.00 O ATOM 1234 CB LEU C 2 -2.349 -7.932 6.051 1.00 0.00 C ATOM 1235 CG LEU C 2 -2.098 -8.355 7.494 1.00 0.00 C ATOM 1236 CD1 LEU C 2 -1.261 -7.286 8.190 1.00 0.00 C ATOM 1237 CD2 LEU C 2 -3.412 -8.490 8.261 1.00 0.00 C ATOM 0 H LEU C 2 -1.907 -9.194 3.583 1.00 0.00 H new ATOM 0 HA LEU C 2 -3.633 -9.663 5.937 1.00 0.00 H new ATOM 0 HB2 LEU C 2 -1.393 -7.751 5.559 1.00 0.00 H new ATOM 0 HB3 LEU C 2 -2.895 -6.989 6.044 1.00 0.00 H new ATOM 0 HG LEU C 2 -1.584 -9.316 7.481 1.00 0.00 H new ATOM 0 HD11 LEU C 2 -1.078 -7.583 9.223 1.00 0.00 H new ATOM 0 HD12 LEU C 2 -0.309 -7.174 7.671 1.00 0.00 H new ATOM 0 HD13 LEU C 2 -1.797 -6.337 8.175 1.00 0.00 H new ATOM 0 HD21 LEU C 2 -3.205 -8.793 9.287 1.00 0.00 H new ATOM 0 HD22 LEU C 2 -3.932 -7.532 8.263 1.00 0.00 H new ATOM 0 HD23 LEU C 2 -4.038 -9.242 7.780 1.00 0.00 H new ATOM 1249 N ILE C 3 -5.361 -8.033 4.976 1.00 0.00 N ATOM 1250 CA ILE C 3 -6.435 -7.316 4.303 1.00 0.00 C ATOM 1251 C ILE C 3 -7.000 -6.255 5.239 1.00 0.00 C ATOM 1252 O ILE C 3 -7.171 -6.490 6.436 1.00 0.00 O ATOM 1253 CB ILE C 3 -7.529 -8.286 3.831 1.00 0.00 C ATOM 1254 CG1 ILE C 3 -7.005 -9.199 2.717 1.00 0.00 C ATOM 1255 CG2 ILE C 3 -8.722 -7.501 3.279 1.00 0.00 C ATOM 1256 CD1 ILE C 3 -6.380 -10.481 3.261 1.00 0.00 C ATOM 0 H ILE C 3 -5.593 -8.330 5.924 1.00 0.00 H new ATOM 0 HA ILE C 3 -6.037 -6.823 3.416 1.00 0.00 H new ATOM 0 HB ILE C 3 -7.831 -8.888 4.688 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -7.824 -9.454 2.045 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -6.265 -8.659 2.127 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -9.493 -8.196 2.947 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -9.127 -6.857 4.060 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -8.397 -6.890 2.437 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -6.025 -11.093 2.432 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -5.542 -10.230 3.912 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -7.126 -11.037 3.828 1.00 0.00 H new ATOM 1268 N LEU C 4 -7.286 -5.083 4.668 1.00 0.00 N ATOM 1269 CA LEU C 4 -7.722 -3.896 5.383 1.00 0.00 C ATOM 1270 C LEU C 4 -8.933 -3.293 4.678 1.00 0.00 C ATOM 1271 O LEU C 4 -9.205 -3.619 3.523 1.00 0.00 O ATOM 1272 CB LEU C 4 -6.591 -2.855 5.348 1.00 0.00 C ATOM 1273 CG LEU C 4 -5.514 -2.971 6.433 1.00 0.00 C ATOM 1274 CD1 LEU C 4 -6.137 -2.750 7.806 1.00 0.00 C ATOM 1275 CD2 LEU C 4 -4.754 -4.293 6.433 1.00 0.00 C ATOM 0 H LEU C 4 -7.216 -4.936 3.661 1.00 0.00 H new ATOM 0 HA LEU C 4 -7.976 -4.164 6.409 1.00 0.00 H new ATOM 0 HB2 LEU C 4 -6.102 -2.916 4.376 1.00 0.00 H new ATOM 0 HB3 LEU C 4 -7.039 -1.864 5.418 1.00 0.00 H new ATOM 0 HG LEU C 4 -4.781 -2.198 6.202 1.00 0.00 H new ATOM 0 HD11 LEU C 4 -5.367 -2.834 8.573 1.00 0.00 H new ATOM 0 HD12 LEU C 4 -6.584 -1.757 7.847 1.00 0.00 H new ATOM 0 HD13 LEU C 4 -6.907 -3.501 7.981 1.00 0.00 H new ATOM 0 HD21 LEU C 4 -4.013 -4.287 7.232 1.00 0.00 H new ATOM 0 HD22 LEU C 4 -5.453 -5.114 6.592 1.00 0.00 H new ATOM 0 HD23 LEU C 4 -4.252 -4.424 5.474 1.00 0.00 H new ATOM 1287 N THR C 5 -9.660 -2.414 5.371 1.00 0.00 N ATOM 1288 CA THR C 5 -10.734 -1.646 4.761 1.00 0.00 C ATOM 1289 C THR C 5 -10.633 -0.210 5.262 1.00 0.00 C ATOM 1290 O THR C 5 -11.112 0.120 6.346 1.00 0.00 O ATOM 1291 CB THR C 5 -12.115 -2.257 5.029 1.00 0.00 C ATOM 1292 OG1 THR C 5 -12.031 -3.658 5.133 1.00 0.00 O ATOM 1293 CG2 THR C 5 -13.038 -1.930 3.853 1.00 0.00 C ATOM 0 H THR C 5 -9.518 -2.219 6.362 1.00 0.00 H new ATOM 0 HA THR C 5 -10.622 -1.664 3.677 1.00 0.00 H new ATOM 0 HB THR C 5 -12.498 -1.845 5.963 1.00 0.00 H new ATOM 0 HG1 THR C 5 -12.922 -4.027 5.305 1.00 0.00 H new ATOM 0 HG21 THR C 5 -14.023 -2.360 4.033 1.00 0.00 H new ATOM 0 HG22 THR C 5 -13.127 -0.849 3.750 1.00 0.00 H new ATOM 0 HG23 THR C 5 -12.622 -2.348 2.937 1.00 0.00 H new ATOM 1301 N ARG C 6 -9.992 0.640 4.457 1.00 0.00 N ATOM 1302 CA ARG C 6 -9.613 2.006 4.806 1.00 0.00 C ATOM 1303 C ARG C 6 -10.462 3.011 4.037 1.00 0.00 C ATOM 1304 O ARG C 6 -10.724 2.816 2.851 1.00 0.00 O ATOM 1305 CB ARG C 6 -8.135 2.129 4.413 1.00 0.00 C ATOM 1306 CG ARG C 6 -7.437 3.418 4.842 1.00 0.00 C ATOM 1307 CD ARG C 6 -6.901 3.353 6.274 1.00 0.00 C ATOM 1308 NE ARG C 6 -7.933 3.632 7.280 1.00 0.00 N ATOM 1309 CZ ARG C 6 -7.684 3.737 8.588 1.00 0.00 C ATOM 1310 NH1 ARG C 6 -6.451 3.574 9.064 1.00 0.00 N ATOM 1311 NH2 ARG C 6 -8.676 4.007 9.429 1.00 0.00 N ATOM 0 H ARG C 6 -9.713 0.384 3.510 1.00 0.00 H new ATOM 0 HA ARG C 6 -9.768 2.214 5.865 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -7.594 1.285 4.841 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -8.058 2.040 3.329 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -6.613 3.624 4.159 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -8.136 4.250 4.758 1.00 0.00 H new ATOM 0 HD2 ARG C 6 -6.481 2.364 6.455 1.00 0.00 H new ATOM 0 HD3 ARG C 6 -6.088 4.070 6.386 1.00 0.00 H new ATOM 0 HE ARG C 6 -8.895 3.752 6.962 1.00 0.00 H new ATOM 0 HH11 ARG C 6 -5.682 3.366 8.427 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -6.276 3.657 10.065 1.00 0.00 H new ATOM 0 HH21 ARG C 6 -9.624 4.133 9.075 1.00 0.00 H new ATOM 0 HH22 ARG C 6 -8.489 4.088 10.429 1.00 0.00 H new ATOM 1325 N LYS C 7 -10.891 4.087 4.701 1.00 0.00 N ATOM 1326 CA LYS C 7 -11.638 5.144 4.042 1.00 0.00 C ATOM 1327 C LYS C 7 -10.691 6.132 3.385 1.00 0.00 C ATOM 1328 O LYS C 7 -9.521 6.223 3.749 1.00 0.00 O ATOM 1329 CB LYS C 7 -12.509 5.910 5.034 1.00 0.00 C ATOM 1330 CG LYS C 7 -13.941 5.381 5.103 1.00 0.00 C ATOM 1331 CD LYS C 7 -14.921 6.517 5.411 1.00 0.00 C ATOM 1332 CE LYS C 7 -14.538 7.291 6.675 1.00 0.00 C ATOM 1333 NZ LYS C 7 -14.546 6.424 7.870 1.00 0.00 N ATOM 0 H LYS C 7 -10.730 4.243 5.696 1.00 0.00 H new ATOM 0 HA LYS C 7 -12.272 4.669 3.293 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -12.058 5.853 6.025 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -12.530 6.963 4.754 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -14.207 4.911 4.156 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -14.014 4.612 5.872 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -14.956 7.203 4.565 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -15.924 6.106 5.530 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -13.547 7.727 6.548 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -15.234 8.117 6.820 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -14.332 6.993 8.713 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -15.484 5.988 7.976 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -13.828 5.679 7.763 1.00 0.00 H new ATOM 1347 N VAL C 8 -11.206 6.880 2.408 1.00 0.00 N ATOM 1348 CA VAL C 8 -10.397 7.869 1.716 1.00 0.00 C ATOM 1349 C VAL C 8 -9.903 8.923 2.701 1.00 0.00 C ATOM 1350 O VAL C 8 -10.641 9.370 3.574 1.00 0.00 O ATOM 1351 CB VAL C 8 -11.163 8.487 0.545 1.00 0.00 C ATOM 1352 CG1 VAL C 8 -11.603 7.388 -0.423 1.00 0.00 C ATOM 1353 CG2 VAL C 8 -12.402 9.271 0.970 1.00 0.00 C ATOM 0 H VAL C 8 -12.171 6.817 2.084 1.00 0.00 H new ATOM 0 HA VAL C 8 -9.523 7.375 1.291 1.00 0.00 H new ATOM 0 HB VAL C 8 -10.475 9.188 0.072 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -12.148 7.833 -1.255 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -10.725 6.865 -0.803 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -12.250 6.682 0.098 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -12.894 9.680 0.088 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -13.090 8.608 1.494 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -12.108 10.086 1.632 1.00 0.00 H new ATOM 1363 N GLY C 9 -8.637 9.317 2.547 1.00 0.00 N ATOM 1364 CA GLY C 9 -8.028 10.331 3.396 1.00 0.00 C ATOM 1365 C GLY C 9 -7.352 9.735 4.632 1.00 0.00 C ATOM 1366 O GLY C 9 -6.815 10.482 5.450 1.00 0.00 O ATOM 0 H GLY C 9 -8.012 8.942 1.833 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -7.292 10.889 2.818 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -8.792 11.042 3.711 1.00 0.00 H new ATOM 1370 N GLU C 10 -7.369 8.407 4.780 1.00 0.00 N ATOM 1371 CA GLU C 10 -6.738 7.735 5.912 1.00 0.00 C ATOM 1372 C GLU C 10 -5.457 7.028 5.460 1.00 0.00 C ATOM 1373 O GLU C 10 -5.112 7.066 4.277 1.00 0.00 O ATOM 1374 CB GLU C 10 -7.725 6.757 6.549 1.00 0.00 C ATOM 1375 CG GLU C 10 -9.006 7.460 7.000 1.00 0.00 C ATOM 1376 CD GLU C 10 -9.976 6.502 7.689 1.00 0.00 C ATOM 1377 OE1 GLU C 10 -10.056 5.333 7.250 1.00 0.00 O ATOM 1378 OE2 GLU C 10 -10.636 6.948 8.652 1.00 0.00 O ATOM 0 H GLU C 10 -7.819 7.773 4.120 1.00 0.00 H new ATOM 0 HA GLU C 10 -6.460 8.473 6.665 1.00 0.00 H new ATOM 0 HB2 GLU C 10 -7.973 5.973 5.834 1.00 0.00 H new ATOM 0 HB3 GLU C 10 -7.256 6.272 7.405 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -8.753 8.271 7.682 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -9.495 7.911 6.136 1.00 0.00 H new ATOM 1385 N SER C 11 -4.743 6.374 6.385 1.00 0.00 N ATOM 1386 CA SER C 11 -3.428 5.820 6.087 1.00 0.00 C ATOM 1387 C SER C 11 -3.182 4.455 6.728 1.00 0.00 C ATOM 1388 O SER C 11 -3.941 3.999 7.587 1.00 0.00 O ATOM 1389 CB SER C 11 -2.353 6.802 6.555 1.00 0.00 C ATOM 1390 OG SER C 11 -2.465 8.030 5.865 1.00 0.00 O ATOM 0 H SER C 11 -5.058 6.219 7.343 1.00 0.00 H new ATOM 0 HA SER C 11 -3.384 5.671 5.008 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.450 6.971 7.627 1.00 0.00 H new ATOM 0 HB3 SER C 11 -1.365 6.374 6.388 1.00 0.00 H new ATOM 0 HG SER C 11 -1.770 8.646 6.179 1.00 0.00 H new ATOM 1396 N ILE C 12 -2.101 3.811 6.279 1.00 0.00 N ATOM 1397 CA ILE C 12 -1.623 2.508 6.729 1.00 0.00 C ATOM 1398 C ILE C 12 -0.091 2.568 6.712 1.00 0.00 C ATOM 1399 O ILE C 12 0.476 3.474 6.100 1.00 0.00 O ATOM 1400 CB ILE C 12 -2.171 1.415 5.792 1.00 0.00 C ATOM 1401 CG1 ILE C 12 -3.707 1.472 5.760 1.00 0.00 C ATOM 1402 CG2 ILE C 12 -1.723 0.015 6.229 1.00 0.00 C ATOM 1403 CD1 ILE C 12 -4.314 0.447 4.806 1.00 0.00 C ATOM 0 H ILE C 12 -1.506 4.209 5.552 1.00 0.00 H new ATOM 0 HA ILE C 12 -1.966 2.267 7.735 1.00 0.00 H new ATOM 0 HB ILE C 12 -1.770 1.605 4.796 1.00 0.00 H new ATOM 0 HG12 ILE C 12 -4.094 1.301 6.765 1.00 0.00 H new ATOM 0 HG13 ILE C 12 -4.023 2.472 5.462 1.00 0.00 H new ATOM 0 HG21 ILE C 12 -2.130 -0.728 5.543 1.00 0.00 H new ATOM 0 HG22 ILE C 12 -0.634 -0.039 6.218 1.00 0.00 H new ATOM 0 HG23 ILE C 12 -2.086 -0.185 7.237 1.00 0.00 H new ATOM 0 HD11 ILE C 12 -5.401 0.532 4.824 1.00 0.00 H new ATOM 0 HD12 ILE C 12 -3.952 0.632 3.795 1.00 0.00 H new ATOM 0 HD13 ILE C 12 -4.024 -0.556 5.117 1.00 0.00 H new ATOM 1415 N ASN C 13 0.601 1.630 7.364 1.00 0.00 N ATOM 1416 CA ASN C 13 2.053 1.664 7.468 1.00 0.00 C ATOM 1417 C ASN C 13 2.683 0.293 7.244 1.00 0.00 C ATOM 1418 O ASN C 13 2.054 -0.740 7.470 1.00 0.00 O ATOM 1419 CB ASN C 13 2.446 2.197 8.845 1.00 0.00 C ATOM 1420 CG ASN C 13 2.126 3.676 8.981 1.00 0.00 C ATOM 1421 OD1 ASN C 13 1.048 4.046 9.437 1.00 0.00 O ATOM 1422 ND2 ASN C 13 3.060 4.532 8.578 1.00 0.00 N ATOM 0 H ASN C 13 0.169 0.832 7.830 1.00 0.00 H new ATOM 0 HA ASN C 13 2.428 2.322 6.684 1.00 0.00 H new ATOM 0 HB2 ASN C 13 1.919 1.637 9.617 1.00 0.00 H new ATOM 0 HB3 ASN C 13 3.512 2.038 9.007 1.00 0.00 H new ATOM 0 HD21 ASN C 13 2.893 5.536 8.642 1.00 0.00 H new ATOM 0 HD22 ASN C 13 3.943 4.185 8.205 1.00 0.00 H new ATOM 1429 N ILE C 14 3.941 0.304 6.794 1.00 0.00 N ATOM 1430 CA ILE C 14 4.722 -0.900 6.539 1.00 0.00 C ATOM 1431 C ILE C 14 6.157 -0.661 7.016 1.00 0.00 C ATOM 1432 O ILE C 14 6.647 0.469 6.992 1.00 0.00 O ATOM 1433 CB ILE C 14 4.688 -1.242 5.039 1.00 0.00 C ATOM 1434 CG1 ILE C 14 3.240 -1.383 4.550 1.00 0.00 C ATOM 1435 CG2 ILE C 14 5.465 -2.541 4.780 1.00 0.00 C ATOM 1436 CD1 ILE C 14 3.153 -1.704 3.058 1.00 0.00 C ATOM 0 H ILE C 14 4.449 1.166 6.595 1.00 0.00 H new ATOM 0 HA ILE C 14 4.300 -1.745 7.082 1.00 0.00 H new ATOM 0 HB ILE C 14 5.159 -0.430 4.486 1.00 0.00 H new ATOM 0 HG12 ILE C 14 2.744 -2.171 5.117 1.00 0.00 H new ATOM 0 HG13 ILE C 14 2.701 -0.457 4.751 1.00 0.00 H new ATOM 0 HG21 ILE C 14 5.436 -2.776 3.716 1.00 0.00 H new ATOM 0 HG22 ILE C 14 6.501 -2.415 5.096 1.00 0.00 H new ATOM 0 HG23 ILE C 14 5.010 -3.355 5.344 1.00 0.00 H new ATOM 0 HD11 ILE C 14 2.107 -1.793 2.765 1.00 0.00 H new ATOM 0 HD12 ILE C 14 3.623 -0.904 2.486 1.00 0.00 H new ATOM 0 HD13 ILE C 14 3.667 -2.644 2.858 1.00 0.00 H new ATOM 1448 N GLY C 15 6.835 -1.729 7.447 1.00 0.00 N ATOM 1449 CA GLY C 15 8.189 -1.638 7.963 1.00 0.00 C ATOM 1450 C GLY C 15 8.255 -0.606 9.084 1.00 0.00 C ATOM 1451 O GLY C 15 7.347 -0.516 9.912 1.00 0.00 O ATOM 0 H GLY C 15 6.455 -2.675 7.445 1.00 0.00 H new ATOM 0 HA2 GLY C 15 8.511 -2.611 8.335 1.00 0.00 H new ATOM 0 HA3 GLY C 15 8.874 -1.360 7.162 1.00 0.00 H new ATOM 1455 N ASP C 16 9.334 0.173 9.103 1.00 0.00 N ATOM 1456 CA ASP C 16 9.536 1.248 10.062 1.00 0.00 C ATOM 1457 C ASP C 16 9.907 2.533 9.325 1.00 0.00 C ATOM 1458 O ASP C 16 10.312 3.515 9.944 1.00 0.00 O ATOM 1459 CB ASP C 16 10.619 0.840 11.065 1.00 0.00 C ATOM 1460 CG ASP C 16 10.239 -0.438 11.803 1.00 0.00 C ATOM 1461 OD1 ASP C 16 9.398 -0.343 12.726 1.00 0.00 O ATOM 1462 OD2 ASP C 16 10.793 -1.504 11.444 1.00 0.00 O ATOM 0 H ASP C 16 10.103 0.071 8.441 1.00 0.00 H new ATOM 0 HA ASP C 16 8.615 1.434 10.615 1.00 0.00 H new ATOM 0 HB2 ASP C 16 11.564 0.693 10.543 1.00 0.00 H new ATOM 0 HB3 ASP C 16 10.774 1.645 11.784 1.00 0.00 H new ATOM 1467 N ASP C 17 9.770 2.519 7.994 1.00 0.00 N ATOM 1468 CA ASP C 17 10.164 3.624 7.133 1.00 0.00 C ATOM 1469 C ASP C 17 9.221 3.777 5.932 1.00 0.00 C ATOM 1470 O ASP C 17 9.546 4.503 4.995 1.00 0.00 O ATOM 1471 CB ASP C 17 11.595 3.394 6.635 1.00 0.00 C ATOM 1472 CG ASP C 17 12.607 3.346 7.775 1.00 0.00 C ATOM 1473 OD1 ASP C 17 12.998 4.438 8.245 1.00 0.00 O ATOM 1474 OD2 ASP C 17 12.985 2.216 8.166 1.00 0.00 O ATOM 0 H ASP C 17 9.377 1.727 7.485 1.00 0.00 H new ATOM 0 HA ASP C 17 10.109 4.542 7.718 1.00 0.00 H new ATOM 0 HB2 ASP C 17 11.636 2.459 6.076 1.00 0.00 H new ATOM 0 HB3 ASP C 17 11.869 4.191 5.943 1.00 0.00 H new ATOM 1479 N ILE C 18 8.056 3.110 5.938 1.00 0.00 N ATOM 1480 CA ILE C 18 7.123 3.204 4.821 1.00 0.00 C ATOM 1481 C ILE C 18 5.726 3.558 5.322 1.00 0.00 C ATOM 1482 O ILE C 18 5.317 3.148 6.409 1.00 0.00 O ATOM 1483 CB ILE C 18 7.094 1.893 4.014 1.00 0.00 C ATOM 1484 CG1 ILE C 18 8.482 1.457 3.528 1.00 0.00 C ATOM 1485 CG2 ILE C 18 6.186 2.056 2.792 1.00 0.00 C ATOM 1486 CD1 ILE C 18 9.160 0.538 4.546 1.00 0.00 C ATOM 0 H ILE C 18 7.746 2.507 6.700 1.00 0.00 H new ATOM 0 HA ILE C 18 7.466 3.999 4.158 1.00 0.00 H new ATOM 0 HB ILE C 18 6.717 1.124 4.688 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.390 0.941 2.572 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.103 2.336 3.357 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.169 1.126 2.225 1.00 0.00 H new ATOM 0 HG22 ILE C 18 5.175 2.300 3.120 1.00 0.00 H new ATOM 0 HG23 ILE C 18 6.566 2.859 2.161 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.142 0.245 4.174 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.273 1.065 5.493 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.549 -0.352 4.696 1.00 0.00 H new ATOM 1498 N THR C 19 4.998 4.331 4.515 1.00 0.00 N ATOM 1499 CA THR C 19 3.641 4.753 4.815 1.00 0.00 C ATOM 1500 C THR C 19 2.813 4.713 3.534 1.00 0.00 C ATOM 1501 O THR C 19 3.354 4.830 2.434 1.00 0.00 O ATOM 1502 CB THR C 19 3.662 6.173 5.399 1.00 0.00 C ATOM 1503 OG1 THR C 19 4.504 6.214 6.530 1.00 0.00 O ATOM 1504 CG2 THR C 19 2.268 6.639 5.823 1.00 0.00 C ATOM 0 H THR C 19 5.345 4.683 3.623 1.00 0.00 H new ATOM 0 HA THR C 19 3.194 4.083 5.549 1.00 0.00 H new ATOM 0 HB THR C 19 4.030 6.836 4.616 1.00 0.00 H new ATOM 0 HG1 THR C 19 4.514 7.123 6.897 1.00 0.00 H new ATOM 0 HG21 THR C 19 2.330 7.648 6.230 1.00 0.00 H new ATOM 0 HG22 THR C 19 1.605 6.637 4.958 1.00 0.00 H new ATOM 0 HG23 THR C 19 1.875 5.964 6.583 1.00 0.00 H new ATOM 1512 N ILE C 20 1.499 4.550 3.684 1.00 0.00 N ATOM 1513 CA ILE C 20 0.556 4.477 2.578 1.00 0.00 C ATOM 1514 C ILE C 20 -0.631 5.372 2.912 1.00 0.00 C ATOM 1515 O ILE C 20 -1.056 5.420 4.065 1.00 0.00 O ATOM 1516 CB ILE C 20 0.077 3.026 2.407 1.00 0.00 C ATOM 1517 CG1 ILE C 20 1.236 2.051 2.163 1.00 0.00 C ATOM 1518 CG2 ILE C 20 -0.944 2.927 1.270 1.00 0.00 C ATOM 1519 CD1 ILE C 20 1.905 2.250 0.802 1.00 0.00 C ATOM 0 H ILE C 20 1.055 4.464 4.598 1.00 0.00 H new ATOM 0 HA ILE C 20 1.028 4.804 1.652 1.00 0.00 H new ATOM 0 HB ILE C 20 -0.398 2.737 3.345 1.00 0.00 H new ATOM 0 HG12 ILE C 20 1.980 2.175 2.950 1.00 0.00 H new ATOM 0 HG13 ILE C 20 0.865 1.029 2.234 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -1.271 1.893 1.164 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.803 3.558 1.497 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -0.485 3.259 0.339 1.00 0.00 H new ATOM 0 HD11 ILE C 20 2.717 1.532 0.687 1.00 0.00 H new ATOM 0 HD12 ILE C 20 1.171 2.098 0.010 1.00 0.00 H new ATOM 0 HD13 ILE C 20 2.304 3.262 0.737 1.00 0.00 H new ATOM 1531 N THR C 21 -1.168 6.074 1.911 1.00 0.00 N ATOM 1532 CA THR C 21 -2.322 6.941 2.110 1.00 0.00 C ATOM 1533 C THR C 21 -3.266 6.823 0.924 1.00 0.00 C ATOM 1534 O THR C 21 -2.883 7.084 -0.214 1.00 0.00 O ATOM 1535 CB THR C 21 -1.860 8.391 2.279 1.00 0.00 C ATOM 1536 OG1 THR C 21 -0.921 8.489 3.328 1.00 0.00 O ATOM 1537 CG2 THR C 21 -3.043 9.299 2.606 1.00 0.00 C ATOM 0 H THR C 21 -0.818 6.056 0.953 1.00 0.00 H new ATOM 0 HA THR C 21 -2.851 6.634 3.012 1.00 0.00 H new ATOM 0 HB THR C 21 -1.404 8.705 1.340 1.00 0.00 H new ATOM 0 HG1 THR C 21 -1.373 8.348 4.186 1.00 0.00 H new ATOM 0 HG21 THR C 21 -2.693 10.325 2.722 1.00 0.00 H new ATOM 0 HG22 THR C 21 -3.771 9.253 1.796 1.00 0.00 H new ATOM 0 HG23 THR C 21 -3.510 8.968 3.533 1.00 0.00 H new ATOM 1545 N ILE C 22 -4.509 6.427 1.194 1.00 0.00 N ATOM 1546 CA ILE C 22 -5.558 6.333 0.191 1.00 0.00 C ATOM 1547 C ILE C 22 -6.057 7.747 -0.115 1.00 0.00 C ATOM 1548 O ILE C 22 -6.828 8.318 0.655 1.00 0.00 O ATOM 1549 CB ILE C 22 -6.660 5.384 0.689 1.00 0.00 C ATOM 1550 CG1 ILE C 22 -7.955 5.483 -0.117 1.00 0.00 C ATOM 1551 CG2 ILE C 22 -7.009 5.611 2.165 1.00 0.00 C ATOM 1552 CD1 ILE C 22 -7.710 5.245 -1.599 1.00 0.00 C ATOM 0 H ILE C 22 -4.816 6.160 2.129 1.00 0.00 H new ATOM 0 HA ILE C 22 -5.189 5.907 -0.742 1.00 0.00 H new ATOM 0 HB ILE C 22 -6.232 4.391 0.556 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -8.673 4.753 0.256 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -8.399 6.468 0.026 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -7.792 4.915 2.465 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -6.123 5.446 2.778 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -7.360 6.634 2.303 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -8.653 5.323 -2.141 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -7.011 5.992 -1.977 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -7.290 4.249 -1.743 1.00 0.00 H new ATOM 1564 N LEU C 23 -5.620 8.322 -1.238 1.00 0.00 N ATOM 1565 CA LEU C 23 -5.940 9.709 -1.556 1.00 0.00 C ATOM 1566 C LEU C 23 -7.419 9.884 -1.920 1.00 0.00 C ATOM 1567 O LEU C 23 -7.969 10.968 -1.724 1.00 0.00 O ATOM 1568 CB LEU C 23 -5.051 10.221 -2.699 1.00 0.00 C ATOM 1569 CG LEU C 23 -3.551 10.007 -2.460 1.00 0.00 C ATOM 1570 CD1 LEU C 23 -2.762 10.767 -3.525 1.00 0.00 C ATOM 1571 CD2 LEU C 23 -3.098 10.517 -1.095 1.00 0.00 C ATOM 0 H LEU C 23 -5.047 7.849 -1.937 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.745 10.299 -0.661 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.338 9.718 -3.623 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -5.238 11.285 -2.844 1.00 0.00 H new ATOM 0 HG LEU C 23 -3.369 8.933 -2.506 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.694 10.619 -3.361 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.033 10.395 -4.513 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.995 11.830 -3.461 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -2.029 10.341 -0.977 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -3.300 11.585 -1.020 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -3.641 9.989 -0.311 1.00 0.00 H new ATOM 1583 N GLY C 24 -8.071 8.839 -2.443 1.00 0.00 N ATOM 1584 CA GLY C 24 -9.497 8.887 -2.737 1.00 0.00 C ATOM 1585 C GLY C 24 -9.912 7.892 -3.813 1.00 0.00 C ATOM 1586 O GLY C 24 -9.122 7.043 -4.220 1.00 0.00 O ATOM 0 H GLY C 24 -7.626 7.949 -2.670 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -10.058 8.684 -1.825 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -9.763 9.894 -3.058 1.00 0.00 H new ATOM 1590 N VAL C 25 -11.162 7.997 -4.278 1.00 0.00 N ATOM 1591 CA VAL C 25 -11.693 7.124 -5.320 1.00 0.00 C ATOM 1592 C VAL C 25 -12.438 7.926 -6.380 1.00 0.00 C ATOM 1593 O VAL C 25 -12.849 9.064 -6.150 1.00 0.00 O ATOM 1594 CB VAL C 25 -12.630 6.059 -4.730 1.00 0.00 C ATOM 1595 CG1 VAL C 25 -11.979 5.341 -3.548 1.00 0.00 C ATOM 1596 CG2 VAL C 25 -13.969 6.658 -4.295 1.00 0.00 C ATOM 0 H VAL C 25 -11.830 8.690 -3.940 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.843 6.625 -5.785 1.00 0.00 H new ATOM 0 HB VAL C 25 -12.819 5.335 -5.523 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -12.667 4.594 -3.153 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -11.063 4.852 -3.879 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.742 6.065 -2.768 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -14.603 5.872 -3.883 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -13.797 7.420 -3.535 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -14.463 7.109 -5.156 1.00 0.00 H new ATOM 1606 N SER C 26 -12.610 7.307 -7.553 1.00 0.00 N ATOM 1607 CA SER C 26 -13.347 7.878 -8.673 1.00 0.00 C ATOM 1608 C SER C 26 -13.955 6.730 -9.470 1.00 0.00 C ATOM 1609 O SER C 26 -13.334 6.225 -10.403 1.00 0.00 O ATOM 1610 CB SER C 26 -12.413 8.699 -9.565 1.00 0.00 C ATOM 1611 OG SER C 26 -11.883 9.799 -8.859 1.00 0.00 O ATOM 0 H SER C 26 -12.233 6.380 -7.749 1.00 0.00 H new ATOM 0 HA SER C 26 -14.129 8.542 -8.305 1.00 0.00 H new ATOM 0 HB2 SER C 26 -11.601 8.068 -9.927 1.00 0.00 H new ATOM 0 HB3 SER C 26 -12.957 9.052 -10.441 1.00 0.00 H new ATOM 0 HG SER C 26 -11.288 10.309 -9.447 1.00 0.00 H new ATOM 1617 N GLY C 27 -15.173 6.313 -9.111 1.00 0.00 N ATOM 1618 CA GLY C 27 -15.826 5.197 -9.777 1.00 0.00 C ATOM 1619 C GLY C 27 -15.215 3.882 -9.311 1.00 0.00 C ATOM 1620 O GLY C 27 -15.521 3.425 -8.211 1.00 0.00 O ATOM 0 H GLY C 27 -15.721 6.736 -8.362 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.894 5.208 -9.560 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -15.719 5.295 -10.857 1.00 0.00 H new ATOM 1624 N GLN C 28 -14.356 3.274 -10.137 1.00 0.00 N ATOM 1625 CA GLN C 28 -13.630 2.078 -9.730 1.00 0.00 C ATOM 1626 C GLN C 28 -12.182 2.441 -9.475 1.00 0.00 C ATOM 1627 O GLN C 28 -11.461 1.676 -8.838 1.00 0.00 O ATOM 1628 CB GLN C 28 -13.660 0.982 -10.797 1.00 0.00 C ATOM 1629 CG GLN C 28 -15.075 0.557 -11.171 1.00 0.00 C ATOM 1630 CD GLN C 28 -15.939 0.283 -9.941 1.00 0.00 C ATOM 1631 OE1 GLN C 28 -16.984 0.904 -9.756 1.00 0.00 O ATOM 1632 NE2 GLN C 28 -15.513 -0.640 -9.081 1.00 0.00 N ATOM 0 H GLN C 28 -14.151 3.592 -11.084 1.00 0.00 H new ATOM 0 HA GLN C 28 -14.117 1.696 -8.833 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -13.145 1.337 -11.690 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -13.109 0.114 -10.435 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.540 1.338 -11.773 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -15.032 -0.339 -11.790 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -14.642 -1.140 -9.260 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -16.058 -0.847 -8.244 1.00 0.00 H new ATOM 1641 N GLN C 29 -11.749 3.605 -9.968 1.00 0.00 N ATOM 1642 CA GLN C 29 -10.393 4.041 -9.724 1.00 0.00 C ATOM 1643 C GLN C 29 -10.231 4.353 -8.243 1.00 0.00 C ATOM 1644 O GLN C 29 -11.187 4.714 -7.552 1.00 0.00 O ATOM 1645 CB GLN C 29 -10.016 5.260 -10.564 1.00 0.00 C ATOM 1646 CG GLN C 29 -9.716 4.902 -12.022 1.00 0.00 C ATOM 1647 CD GLN C 29 -10.943 4.526 -12.840 1.00 0.00 C ATOM 1648 OE1 GLN C 29 -10.886 3.623 -13.664 1.00 0.00 O ATOM 1649 NE2 GLN C 29 -12.067 5.204 -12.630 1.00 0.00 N ATOM 0 H GLN C 29 -12.314 4.244 -10.527 1.00 0.00 H new ATOM 0 HA GLN C 29 -9.720 3.235 -10.016 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -10.830 5.984 -10.532 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -9.143 5.743 -10.125 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -9.222 5.749 -12.498 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -9.012 4.070 -12.042 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -12.089 5.953 -11.937 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -12.907 4.976 -13.161 1.00 0.00 H new ATOM 1658 N VAL C 30 -8.999 4.207 -7.771 1.00 0.00 N ATOM 1659 CA VAL C 30 -8.600 4.435 -6.404 1.00 0.00 C ATOM 1660 C VAL C 30 -7.245 5.109 -6.494 1.00 0.00 C ATOM 1661 O VAL C 30 -6.258 4.482 -6.882 1.00 0.00 O ATOM 1662 CB VAL C 30 -8.521 3.098 -5.659 1.00 0.00 C ATOM 1663 CG1 VAL C 30 -8.114 3.327 -4.208 1.00 0.00 C ATOM 1664 CG2 VAL C 30 -9.879 2.400 -5.653 1.00 0.00 C ATOM 0 H VAL C 30 -8.223 3.913 -8.364 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.307 5.055 -5.853 1.00 0.00 H new ATOM 0 HB VAL C 30 -7.784 2.480 -6.172 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -8.061 2.370 -3.689 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.138 3.811 -4.176 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -8.851 3.964 -3.720 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.799 1.453 -5.119 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.613 3.036 -5.157 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.196 2.212 -6.679 1.00 0.00 H new ATOM 1674 N ARG C 31 -7.196 6.393 -6.138 1.00 0.00 N ATOM 1675 CA ARG C 31 -5.965 7.156 -6.172 1.00 0.00 C ATOM 1676 C ARG C 31 -5.236 6.902 -4.862 1.00 0.00 C ATOM 1677 O ARG C 31 -5.845 6.976 -3.796 1.00 0.00 O ATOM 1678 CB ARG C 31 -6.296 8.633 -6.365 1.00 0.00 C ATOM 1679 CG ARG C 31 -5.045 9.398 -6.796 1.00 0.00 C ATOM 1680 CD ARG C 31 -5.376 10.882 -6.935 1.00 0.00 C ATOM 1681 NE ARG C 31 -6.373 11.131 -7.983 1.00 0.00 N ATOM 1682 CZ ARG C 31 -7.058 12.274 -8.094 1.00 0.00 C ATOM 1683 NH1 ARG C 31 -6.853 13.274 -7.240 1.00 0.00 N ATOM 1684 NH2 ARG C 31 -7.959 12.421 -9.061 1.00 0.00 N ATOM 0 H ARG C 31 -8.007 6.924 -5.821 1.00 0.00 H new ATOM 0 HA ARG C 31 -5.323 6.856 -7.001 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -7.077 8.744 -7.117 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.686 9.051 -5.437 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -4.251 9.259 -6.063 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -4.676 9.007 -7.744 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.749 11.260 -5.983 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -4.465 11.436 -7.163 1.00 0.00 H new ATOM 0 HE ARG C 31 -6.553 10.392 -8.663 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.168 13.173 -6.491 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.381 14.141 -7.334 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.129 11.661 -9.720 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.480 13.294 -9.144 1.00 0.00 H new ATOM 1698 N ILE C 32 -3.940 6.606 -4.933 1.00 0.00 N ATOM 1699 CA ILE C 32 -3.197 6.152 -3.765 1.00 0.00 C ATOM 1700 C ILE C 32 -1.859 6.876 -3.700 1.00 0.00 C ATOM 1701 O ILE C 32 -1.340 7.310 -4.724 1.00 0.00 O ATOM 1702 CB ILE C 32 -2.972 4.633 -3.851 1.00 0.00 C ATOM 1703 CG1 ILE C 32 -4.194 3.920 -4.445 1.00 0.00 C ATOM 1704 CG2 ILE C 32 -2.658 4.088 -2.453 1.00 0.00 C ATOM 1705 CD1 ILE C 32 -4.013 2.402 -4.492 1.00 0.00 C ATOM 0 H ILE C 32 -3.386 6.673 -5.786 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.767 6.374 -2.863 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.129 4.442 -4.515 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.076 4.160 -3.852 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.376 4.294 -5.453 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -2.498 3.011 -2.510 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -1.759 4.569 -2.069 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -3.494 4.296 -1.785 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.904 1.942 -4.920 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.147 2.158 -5.108 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -3.859 2.023 -3.482 1.00 0.00 H new ATOM 1717 N GLY C 33 -1.307 7.001 -2.495 1.00 0.00 N ATOM 1718 CA GLY C 33 -0.006 7.604 -2.288 1.00 0.00 C ATOM 1719 C GLY C 33 0.863 6.679 -1.451 1.00 0.00 C ATOM 1720 O GLY C 33 0.356 5.893 -0.652 1.00 0.00 O ATOM 0 H GLY C 33 -1.757 6.684 -1.636 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.472 7.797 -3.248 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.116 8.566 -1.787 1.00 0.00 H new ATOM 1724 N ILE C 34 2.177 6.780 -1.646 1.00 0.00 N ATOM 1725 CA ILE C 34 3.151 5.924 -0.990 1.00 0.00 C ATOM 1726 C ILE C 34 4.346 6.770 -0.598 1.00 0.00 C ATOM 1727 O ILE C 34 4.709 7.704 -1.311 1.00 0.00 O ATOM 1728 CB ILE C 34 3.586 4.805 -1.952 1.00 0.00 C ATOM 1729 CG1 ILE C 34 2.364 4.035 -2.482 1.00 0.00 C ATOM 1730 CG2 ILE C 34 4.570 3.869 -1.245 1.00 0.00 C ATOM 1731 CD1 ILE C 34 2.750 3.058 -3.588 1.00 0.00 C ATOM 0 H ILE C 34 2.595 7.468 -2.272 1.00 0.00 H new ATOM 0 HA ILE C 34 2.715 5.468 -0.101 1.00 0.00 H new ATOM 0 HB ILE C 34 4.088 5.250 -2.811 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.894 3.491 -1.663 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.625 4.741 -2.861 1.00 0.00 H new ATOM 0 HG21 ILE C 34 4.876 3.078 -1.930 1.00 0.00 H new ATOM 0 HG22 ILE C 34 5.447 4.434 -0.929 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.089 3.428 -0.372 1.00 0.00 H new ATOM 0 HD11 ILE C 34 1.861 2.533 -3.937 1.00 0.00 H new ATOM 0 HD12 ILE C 34 3.197 3.606 -4.418 1.00 0.00 H new ATOM 0 HD13 ILE C 34 3.469 2.336 -3.201 1.00 0.00 H new ATOM 1743 N ASN C 35 4.966 6.443 0.533 1.00 0.00 N ATOM 1744 CA ASN C 35 6.060 7.237 1.048 1.00 0.00 C ATOM 1745 C ASN C 35 7.132 6.322 1.624 1.00 0.00 C ATOM 1746 O ASN C 35 6.952 5.732 2.687 1.00 0.00 O ATOM 1747 CB ASN C 35 5.482 8.199 2.083 1.00 0.00 C ATOM 1748 CG ASN C 35 6.439 9.331 2.424 1.00 0.00 C ATOM 1749 OD1 ASN C 35 7.642 9.124 2.574 1.00 0.00 O ATOM 1750 ND2 ASN C 35 5.909 10.543 2.548 1.00 0.00 N ATOM 0 H ASN C 35 4.724 5.633 1.104 1.00 0.00 H new ATOM 0 HA ASN C 35 6.543 7.819 0.263 1.00 0.00 H new ATOM 0 HB2 ASN C 35 4.549 8.617 1.704 1.00 0.00 H new ATOM 0 HB3 ASN C 35 5.238 7.647 2.991 1.00 0.00 H new ATOM 0 HD21 ASN C 35 6.505 11.339 2.775 1.00 0.00 H new ATOM 0 HD22 ASN C 35 4.906 10.677 2.416 1.00 0.00 H new ATOM 1757 N ALA C 36 8.250 6.212 0.905 1.00 0.00 N ATOM 1758 CA ALA C 36 9.376 5.385 1.304 1.00 0.00 C ATOM 1759 C ALA C 36 10.685 6.002 0.829 1.00 0.00 C ATOM 1760 O ALA C 36 10.701 6.769 -0.136 1.00 0.00 O ATOM 1761 CB ALA C 36 9.223 3.999 0.683 1.00 0.00 C ATOM 0 H ALA C 36 8.395 6.701 0.022 1.00 0.00 H new ATOM 0 HA ALA C 36 9.393 5.312 2.391 1.00 0.00 H new ATOM 0 HB1 ALA C 36 10.065 3.373 0.978 1.00 0.00 H new ATOM 0 HB2 ALA C 36 8.294 3.545 1.030 1.00 0.00 H new ATOM 0 HB3 ALA C 36 9.200 4.087 -0.403 1.00 0.00 H new ATOM 1767 N PRO C 37 11.793 5.674 1.503 1.00 0.00 N ATOM 1768 CA PRO C 37 13.120 6.124 1.132 1.00 0.00 C ATOM 1769 C PRO C 37 13.528 5.576 -0.231 1.00 0.00 C ATOM 1770 O PRO C 37 13.012 4.557 -0.685 1.00 0.00 O ATOM 1771 CB PRO C 37 14.044 5.601 2.231 1.00 0.00 C ATOM 1772 CG PRO C 37 13.286 4.429 2.851 1.00 0.00 C ATOM 1773 CD PRO C 37 11.828 4.832 2.685 1.00 0.00 C ATOM 0 HA PRO C 37 13.166 7.210 1.045 1.00 0.00 H new ATOM 0 HB2 PRO C 37 15.003 5.281 1.823 1.00 0.00 H new ATOM 0 HB3 PRO C 37 14.254 6.373 2.972 1.00 0.00 H new ATOM 0 HG2 PRO C 37 13.506 3.492 2.340 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.548 4.289 3.900 1.00 0.00 H new ATOM 0 HD2 PRO C 37 11.190 3.957 2.563 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.467 5.370 3.561 1.00 0.00 H new ATOM 1781 N LYS C 38 14.472 6.250 -0.895 1.00 0.00 N ATOM 1782 CA LYS C 38 15.008 5.784 -2.167 1.00 0.00 C ATOM 1783 C LYS C 38 15.896 4.563 -1.960 1.00 0.00 C ATOM 1784 O LYS C 38 16.426 3.998 -2.915 1.00 0.00 O ATOM 1785 CB LYS C 38 15.755 6.930 -2.853 1.00 0.00 C ATOM 1786 CG LYS C 38 14.784 8.072 -3.175 1.00 0.00 C ATOM 1787 CD LYS C 38 13.786 7.684 -4.266 1.00 0.00 C ATOM 1788 CE LYS C 38 14.396 7.901 -5.651 1.00 0.00 C ATOM 1789 NZ LYS C 38 13.428 7.578 -6.715 1.00 0.00 N ATOM 0 H LYS C 38 14.880 7.125 -0.566 1.00 0.00 H new ATOM 0 HA LYS C 38 14.191 5.473 -2.818 1.00 0.00 H new ATOM 0 HB2 LYS C 38 16.554 7.293 -2.206 1.00 0.00 H new ATOM 0 HB3 LYS C 38 16.224 6.572 -3.769 1.00 0.00 H new ATOM 0 HG2 LYS C 38 14.243 8.353 -2.272 1.00 0.00 H new ATOM 0 HG3 LYS C 38 15.348 8.948 -3.494 1.00 0.00 H new ATOM 0 HD2 LYS C 38 13.498 6.639 -4.149 1.00 0.00 H new ATOM 0 HD3 LYS C 38 12.878 8.279 -4.165 1.00 0.00 H new ATOM 0 HE2 LYS C 38 14.719 8.937 -5.751 1.00 0.00 H new ATOM 0 HE3 LYS C 38 15.284 7.279 -5.762 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 13.868 7.734 -7.644 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 13.140 6.582 -6.631 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 12.592 8.189 -6.621 1.00 0.00 H new ATOM 1803 N ASP C 39 16.053 4.160 -0.698 1.00 0.00 N ATOM 1804 CA ASP C 39 16.738 2.934 -0.307 1.00 0.00 C ATOM 1805 C ASP C 39 15.900 1.710 -0.678 1.00 0.00 C ATOM 1806 O ASP C 39 16.368 0.579 -0.554 1.00 0.00 O ATOM 1807 CB ASP C 39 16.971 2.957 1.204 1.00 0.00 C ATOM 1808 CG ASP C 39 18.025 3.990 1.584 1.00 0.00 C ATOM 1809 OD1 ASP C 39 19.224 3.653 1.479 1.00 0.00 O ATOM 1810 OD2 ASP C 39 17.629 5.111 1.976 1.00 0.00 O ATOM 0 H ASP C 39 15.698 4.692 0.097 1.00 0.00 H new ATOM 0 HA ASP C 39 17.691 2.873 -0.833 1.00 0.00 H new ATOM 0 HB2 ASP C 39 16.035 3.183 1.715 1.00 0.00 H new ATOM 0 HB3 ASP C 39 17.288 1.970 1.541 1.00 0.00 H new ATOM 1815 N VAL C 40 14.663 1.932 -1.136 1.00 0.00 N ATOM 1816 CA VAL C 40 13.745 0.880 -1.546 1.00 0.00 C ATOM 1817 C VAL C 40 13.012 1.321 -2.809 1.00 0.00 C ATOM 1818 O VAL C 40 13.098 2.487 -3.209 1.00 0.00 O ATOM 1819 CB VAL C 40 12.751 0.544 -0.425 1.00 0.00 C ATOM 1820 CG1 VAL C 40 13.475 0.195 0.876 1.00 0.00 C ATOM 1821 CG2 VAL C 40 11.830 1.725 -0.129 1.00 0.00 C ATOM 0 H VAL C 40 14.271 2.869 -1.231 1.00 0.00 H new ATOM 0 HA VAL C 40 14.313 -0.026 -1.756 1.00 0.00 H new ATOM 0 HB VAL C 40 12.172 -0.310 -0.777 1.00 0.00 H new ATOM 0 HG11 VAL C 40 12.742 -0.038 1.649 1.00 0.00 H new ATOM 0 HG12 VAL C 40 14.118 -0.670 0.714 1.00 0.00 H new ATOM 0 HG13 VAL C 40 14.081 1.043 1.194 1.00 0.00 H new ATOM 0 HG21 VAL C 40 11.138 1.456 0.669 1.00 0.00 H new ATOM 0 HG22 VAL C 40 12.427 2.583 0.182 1.00 0.00 H new ATOM 0 HG23 VAL C 40 11.267 1.981 -1.026 1.00 0.00 H new ATOM 1831 N ALA C 41 12.289 0.402 -3.447 1.00 0.00 N ATOM 1832 CA ALA C 41 11.613 0.695 -4.695 1.00 0.00 C ATOM 1833 C ALA C 41 10.097 0.662 -4.518 1.00 0.00 C ATOM 1834 O ALA C 41 9.591 0.069 -3.571 1.00 0.00 O ATOM 1835 CB ALA C 41 12.058 -0.321 -5.748 1.00 0.00 C ATOM 0 H ALA C 41 12.160 -0.553 -3.113 1.00 0.00 H new ATOM 0 HA ALA C 41 11.880 1.700 -5.022 1.00 0.00 H new ATOM 0 HB1 ALA C 41 11.555 -0.110 -6.692 1.00 0.00 H new ATOM 0 HB2 ALA C 41 13.137 -0.251 -5.888 1.00 0.00 H new ATOM 0 HB3 ALA C 41 11.799 -1.326 -5.416 1.00 0.00 H new ATOM 1841 N VAL C 42 9.380 1.309 -5.438 1.00 0.00 N ATOM 1842 CA VAL C 42 7.923 1.296 -5.477 1.00 0.00 C ATOM 1843 C VAL C 42 7.455 1.600 -6.895 1.00 0.00 C ATOM 1844 O VAL C 42 7.802 2.638 -7.455 1.00 0.00 O ATOM 1845 CB VAL C 42 7.344 2.297 -4.461 1.00 0.00 C ATOM 1846 CG1 VAL C 42 8.084 3.637 -4.455 1.00 0.00 C ATOM 1847 CG2 VAL C 42 5.868 2.570 -4.738 1.00 0.00 C ATOM 0 H VAL C 42 9.802 1.862 -6.184 1.00 0.00 H new ATOM 0 HA VAL C 42 7.559 0.308 -5.196 1.00 0.00 H new ATOM 0 HB VAL C 42 7.469 1.827 -3.486 1.00 0.00 H new ATOM 0 HG11 VAL C 42 7.630 4.300 -3.719 1.00 0.00 H new ATOM 0 HG12 VAL C 42 9.131 3.473 -4.199 1.00 0.00 H new ATOM 0 HG13 VAL C 42 8.019 4.093 -5.443 1.00 0.00 H new ATOM 0 HG21 VAL C 42 5.486 3.280 -4.005 1.00 0.00 H new ATOM 0 HG22 VAL C 42 5.757 2.986 -5.739 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.306 1.639 -4.668 1.00 0.00 H new ATOM 1857 N HIS C 43 6.670 0.688 -7.471 1.00 0.00 N ATOM 1858 CA HIS C 43 6.140 0.841 -8.822 1.00 0.00 C ATOM 1859 C HIS C 43 4.836 0.066 -8.963 1.00 0.00 C ATOM 1860 O HIS C 43 4.405 -0.621 -8.038 1.00 0.00 O ATOM 1861 CB HIS C 43 7.134 0.320 -9.871 1.00 0.00 C ATOM 1862 CG HIS C 43 8.571 0.689 -9.625 1.00 0.00 C ATOM 1863 ND1 HIS C 43 9.222 1.815 -10.139 1.00 0.00 N ATOM 1864 CD2 HIS C 43 9.446 -0.029 -8.864 1.00 0.00 C ATOM 1865 CE1 HIS C 43 10.477 1.740 -9.668 1.00 0.00 C ATOM 1866 NE2 HIS C 43 10.640 0.646 -8.908 1.00 0.00 N ATOM 0 H HIS C 43 6.385 -0.177 -7.012 1.00 0.00 H new ATOM 0 HA HIS C 43 5.968 1.904 -8.990 1.00 0.00 H new ATOM 0 HB2 HIS C 43 7.056 -0.766 -9.915 1.00 0.00 H new ATOM 0 HB3 HIS C 43 6.839 0.701 -10.849 1.00 0.00 H new ATOM 0 HD1 HIS C 43 8.828 2.537 -10.742 1.00 0.00 H new ATOM 0 HD2 HIS C 43 9.240 -0.946 -8.332 1.00 0.00 H new ATOM 0 HE1 HIS C 43 11.252 2.464 -9.873 1.00 0.00 H new ATOM 1874 N ARG C 44 4.206 0.175 -10.135 1.00 0.00 N ATOM 1875 CA ARG C 44 3.005 -0.574 -10.454 1.00 0.00 C ATOM 1876 C ARG C 44 3.408 -2.017 -10.726 1.00 0.00 C ATOM 1877 O ARG C 44 4.577 -2.289 -10.996 1.00 0.00 O ATOM 1878 CB ARG C 44 2.340 0.059 -11.675 1.00 0.00 C ATOM 1879 CG ARG C 44 1.891 1.491 -11.357 1.00 0.00 C ATOM 1880 CD ARG C 44 2.456 2.504 -12.356 1.00 0.00 C ATOM 1881 NE ARG C 44 3.918 2.632 -12.245 1.00 0.00 N ATOM 1882 CZ ARG C 44 4.567 3.739 -11.859 1.00 0.00 C ATOM 1883 NH1 ARG C 44 3.919 4.864 -11.574 1.00 0.00 N ATOM 1884 NH2 ARG C 44 5.891 3.729 -11.757 1.00 0.00 N ATOM 0 H ARG C 44 4.521 0.789 -10.886 1.00 0.00 H new ATOM 0 HA ARG C 44 2.291 -0.555 -9.630 1.00 0.00 H new ATOM 0 HB2 ARG C 44 3.037 0.067 -12.513 1.00 0.00 H new ATOM 0 HB3 ARG C 44 1.481 -0.539 -11.980 1.00 0.00 H new ATOM 0 HG2 ARG C 44 0.802 1.540 -11.367 1.00 0.00 H new ATOM 0 HG3 ARG C 44 2.213 1.757 -10.350 1.00 0.00 H new ATOM 0 HD2 ARG C 44 2.195 2.198 -13.369 1.00 0.00 H new ATOM 0 HD3 ARG C 44 1.993 3.476 -12.187 1.00 0.00 H new ATOM 0 HE ARG C 44 4.481 1.815 -12.480 1.00 0.00 H new ATOM 0 HH11 ARG C 44 2.902 4.899 -11.647 1.00 0.00 H new ATOM 0 HH12 ARG C 44 4.439 5.692 -11.282 1.00 0.00 H new ATOM 0 HH21 ARG C 44 6.413 2.879 -11.972 1.00 0.00 H new ATOM 0 HH22 ARG C 44 6.386 4.571 -11.463 1.00 0.00 H new ATOM 1898 N GLU C 45 2.456 -2.947 -10.662 1.00 0.00 N ATOM 1899 CA GLU C 45 2.761 -4.355 -10.865 1.00 0.00 C ATOM 1900 C GLU C 45 3.347 -4.590 -12.258 1.00 0.00 C ATOM 1901 O GLU C 45 4.069 -5.560 -12.480 1.00 0.00 O ATOM 1902 CB GLU C 45 1.483 -5.169 -10.619 1.00 0.00 C ATOM 1903 CG GLU C 45 1.731 -6.665 -10.403 1.00 0.00 C ATOM 1904 CD GLU C 45 2.055 -7.428 -11.683 1.00 0.00 C ATOM 1905 OE1 GLU C 45 1.354 -7.190 -12.692 1.00 0.00 O ATOM 1906 OE2 GLU C 45 2.999 -8.246 -11.633 1.00 0.00 O ATOM 0 H GLU C 45 1.474 -2.749 -10.472 1.00 0.00 H new ATOM 0 HA GLU C 45 3.523 -4.683 -10.158 1.00 0.00 H new ATOM 0 HB2 GLU C 45 0.970 -4.766 -9.746 1.00 0.00 H new ATOM 0 HB3 GLU C 45 0.813 -5.041 -11.469 1.00 0.00 H new ATOM 0 HG2 GLU C 45 2.554 -6.789 -9.699 1.00 0.00 H new ATOM 0 HG3 GLU C 45 0.848 -7.107 -9.942 1.00 0.00 H new ATOM 1913 N GLU C 46 3.043 -3.695 -13.203 1.00 0.00 N ATOM 1914 CA GLU C 46 3.535 -3.781 -14.565 1.00 0.00 C ATOM 1915 C GLU C 46 5.046 -3.545 -14.616 1.00 0.00 C ATOM 1916 O GLU C 46 5.780 -4.307 -15.242 1.00 0.00 O ATOM 1917 CB GLU C 46 2.825 -2.695 -15.386 1.00 0.00 C ATOM 1918 CG GLU C 46 3.113 -2.803 -16.886 1.00 0.00 C ATOM 1919 CD GLU C 46 2.541 -4.089 -17.483 1.00 0.00 C ATOM 1920 OE1 GLU C 46 1.323 -4.318 -17.313 1.00 0.00 O ATOM 1921 OE2 GLU C 46 3.328 -4.836 -18.108 1.00 0.00 O ATOM 0 H GLU C 46 2.443 -2.887 -13.034 1.00 0.00 H new ATOM 0 HA GLU C 46 3.334 -4.775 -14.965 1.00 0.00 H new ATOM 0 HB2 GLU C 46 1.750 -2.766 -15.221 1.00 0.00 H new ATOM 0 HB3 GLU C 46 3.138 -1.714 -15.030 1.00 0.00 H new ATOM 0 HG2 GLU C 46 2.686 -1.942 -17.401 1.00 0.00 H new ATOM 0 HG3 GLU C 46 4.190 -2.773 -17.052 1.00 0.00 H new ATOM 1928 N ILE C 47 5.512 -2.485 -13.949 1.00 0.00 N ATOM 1929 CA ILE C 47 6.908 -2.075 -14.027 1.00 0.00 C ATOM 1930 C ILE C 47 7.787 -2.971 -13.164 1.00 0.00 C ATOM 1931 O ILE C 47 8.983 -3.103 -13.413 1.00 0.00 O ATOM 1932 CB ILE C 47 7.024 -0.619 -13.557 1.00 0.00 C ATOM 1933 CG1 ILE C 47 5.960 0.284 -14.198 1.00 0.00 C ATOM 1934 CG2 ILE C 47 8.416 -0.067 -13.863 1.00 0.00 C ATOM 1935 CD1 ILE C 47 5.907 0.158 -15.721 1.00 0.00 C ATOM 0 H ILE C 47 4.936 -1.896 -13.348 1.00 0.00 H new ATOM 0 HA ILE C 47 7.248 -2.163 -15.059 1.00 0.00 H new ATOM 0 HB ILE C 47 6.858 -0.619 -12.480 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.983 0.035 -13.784 1.00 0.00 H new ATOM 0 HG13 ILE C 47 6.164 1.321 -13.932 1.00 0.00 H new ATOM 0 HG21 ILE C 47 8.480 0.967 -13.523 1.00 0.00 H new ATOM 0 HG22 ILE C 47 9.166 -0.666 -13.347 1.00 0.00 H new ATOM 0 HG23 ILE C 47 8.595 -0.107 -14.937 1.00 0.00 H new ATOM 0 HD11 ILE C 47 5.136 0.821 -16.114 1.00 0.00 H new ATOM 0 HD12 ILE C 47 6.873 0.435 -16.143 1.00 0.00 H new ATOM 0 HD13 ILE C 47 5.674 -0.871 -15.993 1.00 0.00 H new ATOM 1947 N TYR C 48 7.192 -3.591 -12.143 1.00 0.00 N ATOM 1948 CA TYR C 48 7.904 -4.455 -11.220 1.00 0.00 C ATOM 1949 C TYR C 48 8.516 -5.662 -11.933 1.00 0.00 C ATOM 1950 O TYR C 48 9.535 -6.193 -11.492 1.00 0.00 O ATOM 1951 CB TYR C 48 6.902 -4.898 -10.154 1.00 0.00 C ATOM 1952 CG TYR C 48 7.489 -5.744 -9.054 1.00 0.00 C ATOM 1953 CD1 TYR C 48 8.202 -5.144 -8.003 1.00 0.00 C ATOM 1954 CD2 TYR C 48 7.314 -7.133 -9.083 1.00 0.00 C ATOM 1955 CE1 TYR C 48 8.711 -5.930 -6.960 1.00 0.00 C ATOM 1956 CE2 TYR C 48 7.806 -7.924 -8.040 1.00 0.00 C ATOM 1957 CZ TYR C 48 8.497 -7.325 -6.965 1.00 0.00 C ATOM 1958 OH TYR C 48 8.958 -8.096 -5.945 1.00 0.00 O ATOM 0 H TYR C 48 6.197 -3.502 -11.938 1.00 0.00 H new ATOM 0 HA TYR C 48 8.736 -3.916 -10.768 1.00 0.00 H new ATOM 0 HB2 TYR C 48 6.448 -4.012 -9.710 1.00 0.00 H new ATOM 0 HB3 TYR C 48 6.101 -5.458 -10.637 1.00 0.00 H new ATOM 0 HD1 TYR C 48 8.358 -4.075 -7.999 1.00 0.00 H new ATOM 0 HD2 TYR C 48 6.798 -7.594 -9.912 1.00 0.00 H new ATOM 0 HE1 TYR C 48 9.265 -5.470 -6.155 1.00 0.00 H new ATOM 0 HE2 TYR C 48 7.657 -8.994 -8.057 1.00 0.00 H new ATOM 0 HH TYR C 48 8.721 -9.033 -6.110 1.00 0.00 H new