USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=21 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= -0.428 K(o=-0.43,f=-1.9) 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 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 13 ASN :FLIP amide:sc= -0.0567 F(o=-0.8,f=-0.057) 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= 0.0936 USER MOD Set 4.2: A 21 THR OG1 : rot -72:sc= 0.0976 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.0233 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -159:sc= 1.19 (180deg=0.577) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.431 X(o=-0.43,f=-0.44) USER MOD Single : A 29 GLN : amide:sc= -0.409 K(o=-0.41,f=-2.7!) USER MOD Single : A 35 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.9!) USER MOD Single : A 38 LYS NZ :NH3+ 163:sc= -0.19 (180deg=-0.644) USER MOD Single : A 43 HIS : no HE2:sc= -1.49 K(o=-1.5,f=-2.2) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl -169:sc= -0.182 (180deg=-0.595) USER MOD Single : C 1 MET N :NH3+ 137:sc= 0.026 (180deg=0) USER MOD Single : C 5 THR OG1 : rot -36:sc= 0.676 USER MOD Single : C 7 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.051) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -1.12 X(o=-1.1,f=-0.64) USER MOD Single : C 29 GLN : amide:sc= -0.491 K(o=-0.49,f=-1.3) USER MOD Single : C 35 ASN : amide:sc= -0.182 K(o=-0.18,f=-2.6!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.15 X(o=-1.1,f=-1.6) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.129 10.121 -1.947 1.00 0.00 N ATOM 2 CA MET A 1 6.658 10.084 -2.067 1.00 0.00 C ATOM 3 C MET A 1 6.247 9.773 -3.496 1.00 0.00 C ATOM 4 O MET A 1 6.887 10.242 -4.431 1.00 0.00 O ATOM 5 CB MET A 1 6.052 11.420 -1.615 1.00 0.00 C ATOM 6 CG MET A 1 4.524 11.438 -1.688 1.00 0.00 C ATOM 7 SD MET A 1 3.712 10.299 -0.542 1.00 0.00 S ATOM 8 CE MET A 1 1.998 10.730 -0.930 1.00 0.00 C ATOM 0 H1 MET A 1 8.399 10.774 -1.184 1.00 0.00 H new ATOM 0 H2 MET A 1 8.484 9.168 -1.729 1.00 0.00 H new ATOM 0 H3 MET A 1 8.542 10.447 -2.844 1.00 0.00 H new ATOM 0 HA MET A 1 6.279 9.293 -1.420 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.364 11.626 -0.591 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.450 12.222 -2.237 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.174 12.450 -1.485 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.217 11.192 -2.705 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.324 10.129 -0.319 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.832 11.787 -0.720 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.804 10.535 -1.985 1.00 0.00 H new ATOM 20 N LEU A 2 5.186 8.988 -3.679 1.00 0.00 N ATOM 21 CA LEU A 2 4.652 8.669 -4.989 1.00 0.00 C ATOM 22 C LEU A 2 3.133 8.675 -4.928 1.00 0.00 C ATOM 23 O LEU A 2 2.551 8.419 -3.876 1.00 0.00 O ATOM 24 CB LEU A 2 5.150 7.286 -5.420 1.00 0.00 C ATOM 25 CG LEU A 2 6.243 7.339 -6.486 1.00 0.00 C ATOM 26 CD1 LEU A 2 6.677 5.915 -6.815 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.766 8.010 -7.777 1.00 0.00 C ATOM 0 H LEU A 2 4.673 8.555 -2.911 1.00 0.00 H new ATOM 0 HA LEU A 2 4.987 9.412 -5.713 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.530 6.757 -4.546 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.308 6.708 -5.802 1.00 0.00 H new ATOM 0 HG LEU A 2 7.068 7.928 -6.085 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.458 5.939 -7.575 1.00 0.00 H new ATOM 0 HD12 LEU A 2 7.062 5.435 -5.915 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.822 5.352 -7.190 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.579 8.023 -8.502 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.923 7.453 -8.187 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.455 9.033 -7.562 1.00 0.00 H new ATOM 39 N ILE A 3 2.491 8.969 -6.062 1.00 0.00 N ATOM 40 CA ILE A 3 1.040 8.972 -6.182 1.00 0.00 C ATOM 41 C ILE A 3 0.668 8.226 -7.460 1.00 0.00 C ATOM 42 O ILE A 3 1.397 8.285 -8.449 1.00 0.00 O ATOM 43 CB ILE A 3 0.503 10.413 -6.172 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.719 11.085 -4.813 1.00 0.00 C ATOM 45 CG2 ILE A 3 -1.006 10.421 -6.420 1.00 0.00 C ATOM 46 CD1 ILE A 3 2.084 11.753 -4.696 1.00 0.00 C ATOM 0 H ILE A 3 2.973 9.213 -6.927 1.00 0.00 H new ATOM 0 HA ILE A 3 0.582 8.466 -5.332 1.00 0.00 H new ATOM 0 HB ILE A 3 1.043 10.949 -6.953 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.060 11.830 -4.653 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.615 10.340 -4.024 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.371 11.448 -6.410 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.218 9.970 -7.390 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.506 9.850 -5.638 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.181 12.213 -3.712 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.867 11.006 -4.826 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.181 12.519 -5.465 1.00 0.00 H new ATOM 58 N LEU A 4 -0.469 7.526 -7.432 1.00 0.00 N ATOM 59 CA LEU A 4 -0.929 6.688 -8.526 1.00 0.00 C ATOM 60 C LEU A 4 -2.453 6.700 -8.583 1.00 0.00 C ATOM 61 O LEU A 4 -3.108 7.193 -7.664 1.00 0.00 O ATOM 62 CB LEU A 4 -0.477 5.242 -8.284 1.00 0.00 C ATOM 63 CG LEU A 4 1.037 5.027 -8.310 1.00 0.00 C ATOM 64 CD1 LEU A 4 1.301 3.575 -7.920 1.00 0.00 C ATOM 65 CD2 LEU A 4 1.619 5.279 -9.700 1.00 0.00 C ATOM 0 H LEU A 4 -1.102 7.530 -6.632 1.00 0.00 H new ATOM 0 HA LEU A 4 -0.515 7.070 -9.459 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -0.859 4.914 -7.317 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.933 4.603 -9.040 1.00 0.00 H new ATOM 0 HG LEU A 4 1.509 5.726 -7.620 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.374 3.385 -7.928 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.907 3.389 -6.921 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.810 2.912 -8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.697 5.116 -9.678 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.163 4.594 -10.415 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.413 6.307 -10.000 1.00 0.00 H new ATOM 77 N THR A 5 -3.011 6.150 -9.663 1.00 0.00 N ATOM 78 CA THR A 5 -4.445 5.925 -9.759 1.00 0.00 C ATOM 79 C THR A 5 -4.677 4.532 -10.324 1.00 0.00 C ATOM 80 O THR A 5 -4.617 4.316 -11.534 1.00 0.00 O ATOM 81 CB THR A 5 -5.154 7.006 -10.581 1.00 0.00 C ATOM 82 OG1 THR A 5 -4.547 8.265 -10.387 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.603 7.104 -10.110 1.00 0.00 C ATOM 0 H THR A 5 -2.484 5.853 -10.484 1.00 0.00 H new ATOM 0 HA THR A 5 -4.883 5.991 -8.763 1.00 0.00 H new ATOM 0 HB THR A 5 -5.094 6.737 -11.636 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.015 8.940 -10.922 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.122 7.870 -10.686 1.00 0.00 H new ATOM 0 HG22 THR A 5 -7.098 6.144 -10.254 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.625 7.368 -9.053 1.00 0.00 H new ATOM 91 N ARG A 6 -4.942 3.584 -9.424 1.00 0.00 N ATOM 92 CA ARG A 6 -5.136 2.175 -9.728 1.00 0.00 C ATOM 93 C ARG A 6 -6.626 1.854 -9.649 1.00 0.00 C ATOM 94 O ARG A 6 -7.367 2.634 -9.061 1.00 0.00 O ATOM 95 CB ARG A 6 -4.353 1.406 -8.653 1.00 0.00 C ATOM 96 CG ARG A 6 -4.089 -0.071 -8.941 1.00 0.00 C ATOM 97 CD ARG A 6 -2.987 -0.258 -9.984 1.00 0.00 C ATOM 98 NE ARG A 6 -3.473 0.047 -11.333 1.00 0.00 N ATOM 99 CZ ARG A 6 -2.946 0.944 -12.171 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.903 1.689 -11.815 1.00 0.00 N ATOM 101 NH2 ARG A 6 -3.477 1.088 -13.379 1.00 0.00 N ATOM 0 H ARG A 6 -5.030 3.789 -8.429 1.00 0.00 H new ATOM 0 HA ARG A 6 -4.790 1.907 -10.726 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.394 1.903 -8.505 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -4.899 1.480 -7.712 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -3.805 -0.576 -8.018 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -5.007 -0.542 -9.293 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -2.143 0.389 -9.744 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -2.622 -1.284 -9.950 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.287 -0.473 -11.661 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.492 1.581 -10.888 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -1.515 2.369 -12.469 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -4.276 0.518 -13.656 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -3.086 1.769 -14.030 1.00 0.00 H new ATOM 115 N LYS A 7 -7.097 0.736 -10.216 1.00 0.00 N ATOM 116 CA LYS A 7 -8.497 0.352 -10.042 1.00 0.00 C ATOM 117 C LYS A 7 -8.625 -1.055 -9.484 1.00 0.00 C ATOM 118 O LYS A 7 -7.652 -1.804 -9.413 1.00 0.00 O ATOM 119 CB LYS A 7 -9.339 0.518 -11.314 1.00 0.00 C ATOM 120 CG LYS A 7 -8.792 -0.259 -12.506 1.00 0.00 C ATOM 121 CD LYS A 7 -9.811 -0.192 -13.642 1.00 0.00 C ATOM 122 CE LYS A 7 -9.436 -1.135 -14.787 1.00 0.00 C ATOM 123 NZ LYS A 7 -8.100 -0.835 -15.332 1.00 0.00 N ATOM 0 H LYS A 7 -6.542 0.097 -10.785 1.00 0.00 H new ATOM 0 HA LYS A 7 -8.905 1.051 -9.312 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -10.358 0.189 -11.112 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.390 1.576 -11.572 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.839 0.163 -12.827 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.604 -1.296 -12.227 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.799 -0.454 -13.262 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.874 0.830 -14.016 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -9.460 -2.165 -14.431 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -10.178 -1.055 -15.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -8.022 -1.225 -16.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -7.961 0.195 -15.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -7.373 -1.264 -14.724 1.00 0.00 H new ATOM 137 N VAL A 8 -9.847 -1.404 -9.086 1.00 0.00 N ATOM 138 CA VAL A 8 -10.079 -2.634 -8.348 1.00 0.00 C ATOM 139 C VAL A 8 -9.638 -3.863 -9.133 1.00 0.00 C ATOM 140 O VAL A 8 -9.913 -3.988 -10.328 1.00 0.00 O ATOM 141 CB VAL A 8 -11.535 -2.732 -7.888 1.00 0.00 C ATOM 142 CG1 VAL A 8 -11.927 -1.447 -7.156 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.539 -2.950 -9.011 1.00 0.00 C ATOM 0 H VAL A 8 -10.686 -0.852 -9.264 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.457 -2.604 -7.453 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.576 -3.609 -7.242 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.964 -1.517 -6.828 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.281 -1.311 -6.289 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.816 -0.597 -7.829 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.544 -3.007 -8.594 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.485 -2.119 -9.714 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.308 -3.880 -9.530 1.00 0.00 H new ATOM 153 N GLY A 9 -8.949 -4.769 -8.439 1.00 0.00 N ATOM 154 CA GLY A 9 -8.492 -6.026 -9.012 1.00 0.00 C ATOM 155 C GLY A 9 -7.062 -5.933 -9.542 1.00 0.00 C ATOM 156 O GLY A 9 -6.543 -6.914 -10.072 1.00 0.00 O ATOM 0 H GLY A 9 -8.693 -4.647 -7.459 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.547 -6.809 -8.256 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.160 -6.318 -9.823 1.00 0.00 H new ATOM 160 N GLU A 10 -6.422 -4.768 -9.409 1.00 0.00 N ATOM 161 CA GLU A 10 -5.049 -4.565 -9.861 1.00 0.00 C ATOM 162 C GLU A 10 -4.097 -4.514 -8.662 1.00 0.00 C ATOM 163 O GLU A 10 -4.530 -4.645 -7.520 1.00 0.00 O ATOM 164 CB GLU A 10 -4.988 -3.291 -10.709 1.00 0.00 C ATOM 165 CG GLU A 10 -5.919 -3.405 -11.919 1.00 0.00 C ATOM 166 CD GLU A 10 -5.918 -2.131 -12.762 1.00 0.00 C ATOM 167 OE1 GLU A 10 -5.775 -1.036 -12.171 1.00 0.00 O ATOM 168 OE2 GLU A 10 -6.062 -2.250 -13.998 1.00 0.00 O ATOM 0 H GLU A 10 -6.843 -3.942 -8.985 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.727 -5.401 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.273 -2.431 -10.104 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.965 -3.120 -11.045 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.610 -4.249 -12.536 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.933 -3.614 -11.578 1.00 0.00 H new ATOM 175 N SER A 11 -2.795 -4.323 -8.914 1.00 0.00 N ATOM 176 CA SER A 11 -1.785 -4.429 -7.865 1.00 0.00 C ATOM 177 C SER A 11 -0.624 -3.452 -8.039 1.00 0.00 C ATOM 178 O SER A 11 -0.520 -2.747 -9.042 1.00 0.00 O ATOM 179 CB SER A 11 -1.258 -5.867 -7.818 1.00 0.00 C ATOM 180 OG SER A 11 -2.286 -6.760 -7.445 1.00 0.00 O ATOM 0 H SER A 11 -2.422 -4.095 -9.835 1.00 0.00 H new ATOM 0 HA SER A 11 -2.269 -4.164 -6.925 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.862 -6.147 -8.794 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.434 -5.935 -7.108 1.00 0.00 H new ATOM 0 HG SER A 11 -1.933 -7.674 -7.421 1.00 0.00 H new ATOM 186 N ILE A 12 0.246 -3.430 -7.026 1.00 0.00 N ATOM 187 CA ILE A 12 1.372 -2.518 -6.849 1.00 0.00 C ATOM 188 C ILE A 12 2.412 -3.272 -6.014 1.00 0.00 C ATOM 189 O ILE A 12 2.059 -4.222 -5.318 1.00 0.00 O ATOM 190 CB ILE A 12 0.914 -1.222 -6.138 1.00 0.00 C ATOM 191 CG1 ILE A 12 -0.265 -0.579 -6.889 1.00 0.00 C ATOM 192 CG2 ILE A 12 2.060 -0.204 -6.009 1.00 0.00 C ATOM 193 CD1 ILE A 12 -0.721 0.734 -6.254 1.00 0.00 C ATOM 0 H ILE A 12 0.175 -4.096 -6.257 1.00 0.00 H new ATOM 0 HA ILE A 12 1.794 -2.215 -7.807 1.00 0.00 H new ATOM 0 HB ILE A 12 0.595 -1.503 -5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 12 0.025 -0.396 -7.924 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.101 -1.278 -6.911 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.696 0.691 -5.504 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.873 -0.642 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.424 0.062 -7.001 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.555 1.144 -6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.039 0.551 -5.228 1.00 0.00 H new ATOM 0 HD13 ILE A 12 0.105 1.446 -6.257 1.00 0.00 H new ATOM 205 N ASN A 13 3.687 -2.876 -6.066 1.00 0.00 N ATOM 206 CA ASN A 13 4.759 -3.594 -5.383 1.00 0.00 C ATOM 207 C ASN A 13 5.714 -2.639 -4.670 1.00 0.00 C ATOM 208 O ASN A 13 5.808 -1.460 -5.012 1.00 0.00 O ATOM 209 CB ASN A 13 5.539 -4.452 -6.386 1.00 0.00 C ATOM 210 CG ASN A 13 4.851 -5.779 -6.671 1.00 0.00 C ATOM 211 OD1 ASN A 13 3.669 -5.727 -7.271 1.00 0.00 O flip ATOM 212 ND2 ASN A 13 5.378 -6.841 -6.356 1.00 0.00 N flip ATOM 0 H ASN A 13 4.001 -2.053 -6.581 1.00 0.00 H new ATOM 0 HA ASN A 13 4.300 -4.235 -4.630 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.657 -3.899 -7.318 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.540 -4.641 -5.998 1.00 0.00 H new ATOM 0 HD21 ASN A 13 6.288 -6.842 -5.896 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.906 -7.723 -6.554 1.00 0.00 H new ATOM 219 N ILE A 14 6.419 -3.180 -3.672 1.00 0.00 N ATOM 220 CA ILE A 14 7.384 -2.454 -2.852 1.00 0.00 C ATOM 221 C ILE A 14 8.592 -3.357 -2.597 1.00 0.00 C ATOM 222 O ILE A 14 8.442 -4.571 -2.441 1.00 0.00 O ATOM 223 CB ILE A 14 6.745 -2.045 -1.515 1.00 0.00 C ATOM 224 CG1 ILE A 14 5.539 -1.123 -1.764 1.00 0.00 C ATOM 225 CG2 ILE A 14 7.783 -1.368 -0.608 1.00 0.00 C ATOM 226 CD1 ILE A 14 4.830 -0.729 -0.468 1.00 0.00 C ATOM 0 H ILE A 14 6.329 -4.161 -3.408 1.00 0.00 H new ATOM 0 HA ILE A 14 7.700 -1.551 -3.374 1.00 0.00 H new ATOM 0 HB ILE A 14 6.389 -2.940 -1.005 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.873 -0.223 -2.280 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.831 -1.625 -2.424 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.314 -1.085 0.334 1.00 0.00 H new ATOM 0 HG22 ILE A 14 8.602 -2.060 -0.412 1.00 0.00 H new ATOM 0 HG23 ILE A 14 8.172 -0.477 -1.102 1.00 0.00 H new ATOM 0 HD11 ILE A 14 3.986 -0.078 -0.698 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.470 -1.625 0.037 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.528 -0.202 0.183 1.00 0.00 H new ATOM 238 N GLY A 15 9.787 -2.758 -2.555 1.00 0.00 N ATOM 239 CA GLY A 15 11.021 -3.492 -2.349 1.00 0.00 C ATOM 240 C GLY A 15 11.134 -4.630 -3.358 1.00 0.00 C ATOM 241 O GLY A 15 10.841 -4.453 -4.538 1.00 0.00 O ATOM 0 H GLY A 15 9.916 -1.752 -2.664 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.873 -2.820 -2.451 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.050 -3.891 -1.335 1.00 0.00 H new ATOM 245 N ASP A 16 11.561 -5.802 -2.883 1.00 0.00 N ATOM 246 CA ASP A 16 11.666 -6.999 -3.701 1.00 0.00 C ATOM 247 C ASP A 16 10.983 -8.178 -3.005 1.00 0.00 C ATOM 248 O ASP A 16 11.125 -9.321 -3.436 1.00 0.00 O ATOM 249 CB ASP A 16 13.140 -7.304 -3.995 1.00 0.00 C ATOM 250 CG ASP A 16 13.802 -6.167 -4.771 1.00 0.00 C ATOM 251 OD1 ASP A 16 13.655 -6.151 -6.013 1.00 0.00 O ATOM 252 OD2 ASP A 16 14.453 -5.322 -4.117 1.00 0.00 O ATOM 0 H ASP A 16 11.844 -5.942 -1.913 1.00 0.00 H new ATOM 0 HA ASP A 16 11.157 -6.831 -4.650 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.673 -7.466 -3.058 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.214 -8.229 -4.568 1.00 0.00 H new ATOM 257 N ASP A 17 10.246 -7.898 -1.920 1.00 0.00 N ATOM 258 CA ASP A 17 9.598 -8.919 -1.116 1.00 0.00 C ATOM 259 C ASP A 17 8.218 -8.480 -0.621 1.00 0.00 C ATOM 260 O ASP A 17 7.646 -9.152 0.235 1.00 0.00 O ATOM 261 CB ASP A 17 10.482 -9.274 0.082 1.00 0.00 C ATOM 262 CG ASP A 17 11.851 -9.795 -0.345 1.00 0.00 C ATOM 263 OD1 ASP A 17 11.944 -11.010 -0.629 1.00 0.00 O ATOM 264 OD2 ASP A 17 12.799 -8.978 -0.387 1.00 0.00 O ATOM 0 H ASP A 17 10.088 -6.949 -1.582 1.00 0.00 H new ATOM 0 HA ASP A 17 9.457 -9.792 -1.753 1.00 0.00 H new ATOM 0 HB2 ASP A 17 10.611 -8.393 0.710 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.982 -10.028 0.690 1.00 0.00 H new ATOM 269 N ILE A 18 7.668 -7.368 -1.130 1.00 0.00 N ATOM 270 CA ILE A 18 6.365 -6.887 -0.687 1.00 0.00 C ATOM 271 C ILE A 18 5.468 -6.598 -1.886 1.00 0.00 C ATOM 272 O ILE A 18 5.939 -6.172 -2.940 1.00 0.00 O ATOM 273 CB ILE A 18 6.519 -5.628 0.181 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.417 -5.865 1.399 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.143 -5.161 0.671 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.859 -5.464 1.085 1.00 0.00 C ATOM 0 H ILE A 18 8.109 -6.791 -1.846 1.00 0.00 H new ATOM 0 HA ILE A 18 5.899 -7.666 -0.084 1.00 0.00 H new ATOM 0 HB ILE A 18 6.986 -4.867 -0.444 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.049 -5.288 2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.380 -6.916 1.687 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.259 -4.268 1.286 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.510 -4.931 -0.186 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.680 -5.951 1.262 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.484 -5.639 1.961 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.229 -6.060 0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.893 -4.407 0.820 1.00 0.00 H new ATOM 288 N THR A 19 4.164 -6.829 -1.713 1.00 0.00 N ATOM 289 CA THR A 19 3.159 -6.602 -2.741 1.00 0.00 C ATOM 290 C THR A 19 1.925 -5.969 -2.105 1.00 0.00 C ATOM 291 O THR A 19 1.690 -6.120 -0.909 1.00 0.00 O ATOM 292 CB THR A 19 2.800 -7.934 -3.412 1.00 0.00 C ATOM 293 OG1 THR A 19 3.968 -8.583 -3.867 1.00 0.00 O ATOM 294 CG2 THR A 19 1.862 -7.731 -4.601 1.00 0.00 C ATOM 0 H THR A 19 3.776 -7.185 -0.839 1.00 0.00 H new ATOM 0 HA THR A 19 3.550 -5.926 -3.502 1.00 0.00 H new ATOM 0 HB THR A 19 2.295 -8.545 -2.664 1.00 0.00 H new ATOM 0 HG1 THR A 19 3.726 -9.432 -4.292 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.630 -8.697 -5.051 1.00 0.00 H new ATOM 0 HG22 THR A 19 0.941 -7.258 -4.261 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.345 -7.093 -5.341 1.00 0.00 H new ATOM 302 N ILE A 20 1.139 -5.258 -2.919 1.00 0.00 N ATOM 303 CA ILE A 20 -0.068 -4.562 -2.503 1.00 0.00 C ATOM 304 C ILE A 20 -1.148 -4.820 -3.548 1.00 0.00 C ATOM 305 O ILE A 20 -0.847 -4.931 -4.735 1.00 0.00 O ATOM 306 CB ILE A 20 0.220 -3.054 -2.406 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.345 -2.738 -1.410 1.00 0.00 C ATOM 308 CG2 ILE A 20 -1.049 -2.282 -2.029 1.00 0.00 C ATOM 309 CD1 ILE A 20 0.951 -3.018 0.039 1.00 0.00 C ATOM 0 H ILE A 20 1.337 -5.152 -3.914 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.400 -4.919 -1.528 1.00 0.00 H new ATOM 0 HB ILE A 20 0.555 -2.733 -3.392 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.225 -3.330 -1.663 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.627 -1.690 -1.509 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.822 -1.218 -1.966 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.814 -2.446 -2.788 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -1.415 -2.633 -1.064 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.786 -2.776 0.696 1.00 0.00 H new ATOM 0 HD12 ILE A 20 0.089 -2.406 0.306 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.696 -4.072 0.150 1.00 0.00 H new ATOM 321 N THR A 21 -2.407 -4.914 -3.112 1.00 0.00 N ATOM 322 CA THR A 21 -3.519 -5.170 -4.016 1.00 0.00 C ATOM 323 C THR A 21 -4.750 -4.381 -3.582 1.00 0.00 C ATOM 324 O THR A 21 -4.962 -4.158 -2.391 1.00 0.00 O ATOM 325 CB THR A 21 -3.834 -6.671 -4.024 1.00 0.00 C ATOM 326 OG1 THR A 21 -2.675 -7.412 -4.335 1.00 0.00 O ATOM 327 CG2 THR A 21 -4.907 -7.011 -5.054 1.00 0.00 C ATOM 0 H THR A 21 -2.677 -4.815 -2.133 1.00 0.00 H new ATOM 0 HA THR A 21 -3.242 -4.851 -5.021 1.00 0.00 H new ATOM 0 HB THR A 21 -4.196 -6.929 -3.029 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.453 -7.290 -5.282 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.105 -8.083 -5.033 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.822 -6.468 -4.819 1.00 0.00 H new ATOM 0 HG23 THR A 21 -4.561 -6.726 -6.048 1.00 0.00 H new ATOM 335 N ILE A 22 -5.557 -3.958 -4.555 1.00 0.00 N ATOM 336 CA ILE A 22 -6.797 -3.229 -4.326 1.00 0.00 C ATOM 337 C ILE A 22 -7.959 -4.185 -4.590 1.00 0.00 C ATOM 338 O ILE A 22 -8.420 -4.314 -5.725 1.00 0.00 O ATOM 339 CB ILE A 22 -6.797 -1.947 -5.179 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.156 -1.247 -5.256 1.00 0.00 C ATOM 341 CG2 ILE A 22 -6.328 -2.214 -6.610 1.00 0.00 C ATOM 342 CD1 ILE A 22 -8.741 -0.976 -3.882 1.00 0.00 C ATOM 0 H ILE A 22 -5.360 -4.117 -5.543 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.903 -2.887 -3.296 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.100 -1.288 -4.661 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.048 -0.306 -5.795 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.849 -1.864 -5.828 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.343 -1.283 -7.177 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.313 -2.612 -6.592 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.993 -2.937 -7.082 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.705 -0.478 -3.989 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -8.876 -1.919 -3.352 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.063 -0.336 -3.318 1.00 0.00 H new ATOM 354 N LEU A 23 -8.445 -4.858 -3.546 1.00 0.00 N ATOM 355 CA LEU A 23 -9.466 -5.887 -3.712 1.00 0.00 C ATOM 356 C LEU A 23 -10.762 -5.291 -4.261 1.00 0.00 C ATOM 357 O LEU A 23 -11.475 -5.955 -5.011 1.00 0.00 O ATOM 358 CB LEU A 23 -9.782 -6.596 -2.390 1.00 0.00 C ATOM 359 CG LEU A 23 -8.587 -6.966 -1.506 1.00 0.00 C ATOM 360 CD1 LEU A 23 -9.075 -7.899 -0.392 1.00 0.00 C ATOM 361 CD2 LEU A 23 -7.490 -7.671 -2.301 1.00 0.00 C ATOM 0 H LEU A 23 -8.148 -4.708 -2.582 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.060 -6.611 -4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.448 -5.956 -1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.333 -7.509 -2.616 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.166 -6.048 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.236 -8.172 0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.833 -7.390 0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.504 -8.799 -0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.661 -7.916 -1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.889 -8.587 -2.738 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.137 -7.014 -3.096 1.00 0.00 H new ATOM 373 N GLY A 24 -11.076 -4.042 -3.891 1.00 0.00 N ATOM 374 CA GLY A 24 -12.296 -3.403 -4.364 1.00 0.00 C ATOM 375 C GLY A 24 -12.682 -2.187 -3.531 1.00 0.00 C ATOM 376 O GLY A 24 -11.917 -1.747 -2.675 1.00 0.00 O ATOM 0 H GLY A 24 -10.505 -3.466 -3.273 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.164 -3.100 -5.403 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.112 -4.126 -4.344 1.00 0.00 H new ATOM 380 N VAL A 25 -13.878 -1.646 -3.781 1.00 0.00 N ATOM 381 CA VAL A 25 -14.391 -0.499 -3.039 1.00 0.00 C ATOM 382 C VAL A 25 -15.836 -0.717 -2.606 1.00 0.00 C ATOM 383 O VAL A 25 -16.540 -1.562 -3.160 1.00 0.00 O ATOM 384 CB VAL A 25 -14.290 0.790 -3.870 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.889 0.976 -4.457 1.00 0.00 C ATOM 386 CG2 VAL A 25 -15.320 0.814 -4.998 1.00 0.00 C ATOM 0 H VAL A 25 -14.513 -1.992 -4.501 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.773 -0.394 -2.148 1.00 0.00 H new ATOM 0 HB VAL A 25 -14.496 1.614 -3.187 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.857 1.898 -5.038 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.160 1.031 -3.648 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.650 0.132 -5.104 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.218 1.740 -5.564 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -15.154 -0.036 -5.660 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.323 0.755 -4.576 1.00 0.00 H new ATOM 396 N SER A 26 -16.265 0.056 -1.608 1.00 0.00 N ATOM 397 CA SER A 26 -17.636 0.074 -1.121 1.00 0.00 C ATOM 398 C SER A 26 -17.914 1.470 -0.574 1.00 0.00 C ATOM 399 O SER A 26 -17.708 1.743 0.608 1.00 0.00 O ATOM 400 CB SER A 26 -17.838 -1.015 -0.061 1.00 0.00 C ATOM 401 OG SER A 26 -16.836 -0.950 0.936 1.00 0.00 O ATOM 0 H SER A 26 -15.652 0.700 -1.108 1.00 0.00 H new ATOM 0 HA SER A 26 -18.341 -0.142 -1.924 1.00 0.00 H new ATOM 0 HB2 SER A 26 -18.820 -0.901 0.398 1.00 0.00 H new ATOM 0 HB3 SER A 26 -17.820 -1.996 -0.536 1.00 0.00 H new ATOM 0 HG SER A 26 -16.989 -1.654 1.600 1.00 0.00 H new ATOM 407 N GLY A 27 -18.391 2.373 -1.439 1.00 0.00 N ATOM 408 CA GLY A 27 -18.589 3.755 -1.040 1.00 0.00 C ATOM 409 C GLY A 27 -17.231 4.425 -0.864 1.00 0.00 C ATOM 410 O GLY A 27 -16.444 4.464 -1.808 1.00 0.00 O ATOM 0 H GLY A 27 -18.642 2.167 -2.406 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -19.174 4.283 -1.793 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -19.154 3.800 -0.109 1.00 0.00 H new ATOM 414 N GLN A 28 -16.947 4.950 0.333 1.00 0.00 N ATOM 415 CA GLN A 28 -15.647 5.550 0.607 1.00 0.00 C ATOM 416 C GLN A 28 -14.686 4.485 1.104 1.00 0.00 C ATOM 417 O GLN A 28 -13.475 4.684 1.061 1.00 0.00 O ATOM 418 CB GLN A 28 -15.746 6.631 1.683 1.00 0.00 C ATOM 419 CG GLN A 28 -16.620 7.809 1.267 1.00 0.00 C ATOM 420 CD GLN A 28 -16.146 8.455 -0.033 1.00 0.00 C ATOM 421 OE1 GLN A 28 -15.360 9.395 -0.015 1.00 0.00 O ATOM 422 NE2 GLN A 28 -16.617 7.960 -1.175 1.00 0.00 N ATOM 0 H GLN A 28 -17.597 4.969 1.118 1.00 0.00 H new ATOM 0 HA GLN A 28 -15.291 5.997 -0.321 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -16.149 6.191 2.595 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -14.745 6.994 1.919 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -17.649 7.470 1.147 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -16.621 8.556 2.061 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -17.270 7.177 -1.160 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -16.325 8.364 -2.065 1.00 0.00 H new ATOM 431 N GLN A 29 -15.216 3.355 1.576 1.00 0.00 N ATOM 432 CA GLN A 29 -14.383 2.261 2.029 1.00 0.00 C ATOM 433 C GLN A 29 -13.702 1.646 0.813 1.00 0.00 C ATOM 434 O GLN A 29 -14.270 1.594 -0.279 1.00 0.00 O ATOM 435 CB GLN A 29 -15.232 1.226 2.767 1.00 0.00 C ATOM 436 CG GLN A 29 -15.049 1.304 4.283 1.00 0.00 C ATOM 437 CD GLN A 29 -15.510 2.633 4.874 1.00 0.00 C ATOM 438 OE1 GLN A 29 -14.821 3.218 5.705 1.00 0.00 O ATOM 439 NE2 GLN A 29 -16.674 3.126 4.460 1.00 0.00 N ATOM 0 H GLN A 29 -16.218 3.182 1.651 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.626 2.621 2.725 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -16.283 1.379 2.521 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.966 0.227 2.421 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.605 0.492 4.752 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.997 1.151 4.524 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.226 2.618 3.768 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -17.015 4.012 4.834 1.00 0.00 H new ATOM 448 N VAL A 30 -12.476 1.176 1.016 1.00 0.00 N ATOM 449 CA VAL A 30 -11.646 0.592 -0.015 1.00 0.00 C ATOM 450 C VAL A 30 -10.981 -0.640 0.584 1.00 0.00 C ATOM 451 O VAL A 30 -10.225 -0.533 1.548 1.00 0.00 O ATOM 452 CB VAL A 30 -10.609 1.631 -0.460 1.00 0.00 C ATOM 453 CG1 VAL A 30 -9.695 1.068 -1.541 1.00 0.00 C ATOM 454 CG2 VAL A 30 -11.280 2.878 -1.039 1.00 0.00 C ATOM 0 H VAL A 30 -12.025 1.194 1.931 1.00 0.00 H new ATOM 0 HA VAL A 30 -12.225 0.300 -0.891 1.00 0.00 H new ATOM 0 HB VAL A 30 -10.035 1.890 0.430 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.971 1.827 -1.837 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.169 0.195 -1.154 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -10.291 0.779 -2.407 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -10.516 3.593 -1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -11.882 2.599 -1.904 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -11.920 3.331 -0.282 1.00 0.00 H new ATOM 464 N ARG A 31 -11.269 -1.810 0.009 1.00 0.00 N ATOM 465 CA ARG A 31 -10.671 -3.064 0.437 1.00 0.00 C ATOM 466 C ARG A 31 -9.283 -3.166 -0.164 1.00 0.00 C ATOM 467 O ARG A 31 -9.135 -3.170 -1.383 1.00 0.00 O ATOM 468 CB ARG A 31 -11.529 -4.229 -0.051 1.00 0.00 C ATOM 469 CG ARG A 31 -12.717 -4.427 0.879 1.00 0.00 C ATOM 470 CD ARG A 31 -12.300 -5.312 2.056 1.00 0.00 C ATOM 471 NE ARG A 31 -13.329 -5.303 3.101 1.00 0.00 N ATOM 472 CZ ARG A 31 -14.568 -5.787 2.962 1.00 0.00 C ATOM 473 NH1 ARG A 31 -14.941 -6.388 1.834 1.00 0.00 N ATOM 474 NH2 ARG A 31 -15.439 -5.670 3.957 1.00 0.00 N ATOM 0 H ARG A 31 -11.924 -1.908 -0.766 1.00 0.00 H new ATOM 0 HA ARG A 31 -10.609 -3.099 1.525 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -11.879 -4.034 -1.065 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.932 -5.140 -0.090 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.073 -3.463 1.243 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -13.543 -4.888 0.338 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -12.135 -6.332 1.710 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.354 -4.958 2.467 1.00 0.00 H new ATOM 0 HE ARG A 31 -13.081 -4.896 4.003 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -14.279 -6.483 1.064 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -15.889 -6.753 1.740 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -15.163 -5.212 4.825 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -16.384 -6.038 3.853 1.00 0.00 H new ATOM 488 N ILE A 32 -8.278 -3.252 0.706 1.00 0.00 N ATOM 489 CA ILE A 32 -6.884 -3.297 0.289 1.00 0.00 C ATOM 490 C ILE A 32 -6.221 -4.517 0.914 1.00 0.00 C ATOM 491 O ILE A 32 -6.645 -4.975 1.975 1.00 0.00 O ATOM 492 CB ILE A 32 -6.159 -2.004 0.706 1.00 0.00 C ATOM 493 CG1 ILE A 32 -7.064 -0.779 0.488 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.851 -1.871 -0.081 1.00 0.00 C ATOM 495 CD1 ILE A 32 -6.327 0.550 0.638 1.00 0.00 C ATOM 0 H ILE A 32 -8.410 -3.292 1.717 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.826 -3.375 -0.797 1.00 0.00 H new ATOM 0 HB ILE A 32 -5.923 -2.054 1.769 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -7.503 -0.833 -0.508 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.887 -0.813 1.201 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.339 -0.955 0.216 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.211 -2.728 0.129 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.070 -1.835 -1.148 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -7.023 1.373 0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -5.911 0.624 1.643 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.521 0.603 -0.093 1.00 0.00 H new ATOM 507 N GLY A 33 -5.184 -5.042 0.266 1.00 0.00 N ATOM 508 CA GLY A 33 -4.459 -6.196 0.757 1.00 0.00 C ATOM 509 C GLY A 33 -2.957 -5.964 0.661 1.00 0.00 C ATOM 510 O GLY A 33 -2.498 -5.149 -0.142 1.00 0.00 O ATOM 0 H GLY A 33 -4.827 -4.674 -0.616 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.737 -6.394 1.792 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.734 -7.078 0.179 1.00 0.00 H new ATOM 514 N ILE A 34 -2.202 -6.684 1.490 1.00 0.00 N ATOM 515 CA ILE A 34 -0.761 -6.527 1.602 1.00 0.00 C ATOM 516 C ILE A 34 -0.133 -7.899 1.751 1.00 0.00 C ATOM 517 O ILE A 34 -0.707 -8.781 2.386 1.00 0.00 O ATOM 518 CB ILE A 34 -0.433 -5.671 2.833 1.00 0.00 C ATOM 519 CG1 ILE A 34 -1.218 -4.352 2.809 1.00 0.00 C ATOM 520 CG2 ILE A 34 1.076 -5.404 2.903 1.00 0.00 C ATOM 521 CD1 ILE A 34 -1.091 -3.614 4.138 1.00 0.00 C ATOM 0 H ILE A 34 -2.583 -7.400 2.108 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.368 -6.035 0.712 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.732 -6.221 3.725 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.849 -3.720 2.002 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.269 -4.554 2.600 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.298 -4.796 3.780 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.610 -6.351 2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.394 -4.875 2.005 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.657 -2.683 4.093 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.484 -4.239 4.940 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.042 -3.392 4.332 1.00 0.00 H new ATOM 533 N ASN A 35 1.048 -8.084 1.166 1.00 0.00 N ATOM 534 CA ASN A 35 1.701 -9.374 1.190 1.00 0.00 C ATOM 535 C ASN A 35 3.199 -9.190 1.386 1.00 0.00 C ATOM 536 O ASN A 35 3.898 -8.743 0.479 1.00 0.00 O ATOM 537 CB ASN A 35 1.354 -10.086 -0.118 1.00 0.00 C ATOM 538 CG ASN A 35 1.675 -11.569 -0.063 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.740 -11.973 0.396 1.00 0.00 O ATOM 540 ND2 ASN A 35 0.741 -12.390 -0.540 1.00 0.00 N ATOM 0 H ASN A 35 1.564 -7.355 0.673 1.00 0.00 H new ATOM 0 HA ASN A 35 1.358 -9.988 2.023 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.294 -9.953 -0.333 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.906 -9.626 -0.938 1.00 0.00 H new ATOM 0 HD21 ASN A 35 0.896 -13.398 -0.533 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.130 -12.011 -0.912 1.00 0.00 H new ATOM 547 N ALA A 36 3.685 -9.537 2.579 1.00 0.00 N ATOM 548 CA ALA A 36 5.090 -9.432 2.937 1.00 0.00 C ATOM 549 C ALA A 36 5.448 -10.517 3.947 1.00 0.00 C ATOM 550 O ALA A 36 4.564 -11.038 4.631 1.00 0.00 O ATOM 551 CB ALA A 36 5.343 -8.060 3.568 1.00 0.00 C ATOM 0 H ALA A 36 3.101 -9.903 3.330 1.00 0.00 H new ATOM 0 HA ALA A 36 5.702 -9.553 2.043 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.395 -7.973 3.840 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.087 -7.278 2.853 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.728 -7.951 4.461 1.00 0.00 H new ATOM 557 N PRO A 37 6.735 -10.862 4.046 1.00 0.00 N ATOM 558 CA PRO A 37 7.235 -11.793 5.039 1.00 0.00 C ATOM 559 C PRO A 37 7.056 -11.231 6.444 1.00 0.00 C ATOM 560 O PRO A 37 6.936 -10.022 6.631 1.00 0.00 O ATOM 561 CB PRO A 37 8.722 -11.957 4.718 1.00 0.00 C ATOM 562 CG PRO A 37 9.093 -10.694 3.945 1.00 0.00 C ATOM 563 CD PRO A 37 7.808 -10.369 3.199 1.00 0.00 C ATOM 0 HA PRO A 37 6.700 -12.742 5.010 1.00 0.00 H new ATOM 0 HB2 PRO A 37 9.315 -12.053 5.627 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.902 -12.853 4.123 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.390 -9.884 4.611 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.925 -10.867 3.262 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.713 -9.297 3.029 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.789 -10.850 2.221 1.00 0.00 H new ATOM 571 N LYS A 38 7.045 -12.111 7.452 1.00 0.00 N ATOM 572 CA LYS A 38 7.029 -11.683 8.846 1.00 0.00 C ATOM 573 C LYS A 38 8.363 -11.038 9.215 1.00 0.00 C ATOM 574 O LYS A 38 8.566 -10.597 10.341 1.00 0.00 O ATOM 575 CB LYS A 38 6.692 -12.863 9.760 1.00 0.00 C ATOM 576 CG LYS A 38 5.252 -13.333 9.522 1.00 0.00 C ATOM 577 CD LYS A 38 4.214 -12.307 9.993 1.00 0.00 C ATOM 578 CE LYS A 38 3.748 -12.566 11.426 1.00 0.00 C ATOM 579 NZ LYS A 38 4.821 -12.343 12.414 1.00 0.00 N ATOM 0 H LYS A 38 7.047 -13.123 7.323 1.00 0.00 H new ATOM 0 HA LYS A 38 6.252 -10.931 8.983 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.384 -13.684 9.574 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.818 -12.571 10.802 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.108 -13.529 8.459 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.090 -14.276 10.045 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.641 -11.306 9.928 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.354 -12.331 9.324 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.905 -11.914 11.655 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.389 -13.592 11.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 4.405 -12.246 13.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.476 -13.151 12.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 5.340 -11.474 12.173 1.00 0.00 H new ATOM 593 N ASP A 39 9.276 -10.998 8.241 1.00 0.00 N ATOM 594 CA ASP A 39 10.560 -10.321 8.334 1.00 0.00 C ATOM 595 C ASP A 39 10.373 -8.802 8.428 1.00 0.00 C ATOM 596 O ASP A 39 11.329 -8.077 8.701 1.00 0.00 O ATOM 597 CB ASP A 39 11.355 -10.661 7.074 1.00 0.00 C ATOM 598 CG ASP A 39 12.838 -10.346 7.245 1.00 0.00 C ATOM 599 OD1 ASP A 39 13.440 -10.894 8.195 1.00 0.00 O ATOM 600 OD2 ASP A 39 13.359 -9.559 6.422 1.00 0.00 O ATOM 0 H ASP A 39 9.131 -11.452 7.339 1.00 0.00 H new ATOM 0 HA ASP A 39 11.085 -10.649 9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.232 -11.718 6.839 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.958 -10.098 6.229 1.00 0.00 H new ATOM 605 N VAL A 40 9.146 -8.326 8.201 1.00 0.00 N ATOM 606 CA VAL A 40 8.809 -6.906 8.223 1.00 0.00 C ATOM 607 C VAL A 40 7.469 -6.714 8.927 1.00 0.00 C ATOM 608 O VAL A 40 6.745 -7.679 9.171 1.00 0.00 O ATOM 609 CB VAL A 40 8.756 -6.340 6.798 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.036 -6.676 6.031 1.00 0.00 C ATOM 611 CG2 VAL A 40 7.569 -6.884 6.001 1.00 0.00 C ATOM 0 H VAL A 40 8.349 -8.928 7.994 1.00 0.00 H new ATOM 0 HA VAL A 40 9.581 -6.365 8.769 1.00 0.00 H new ATOM 0 HB VAL A 40 8.647 -5.261 6.905 1.00 0.00 H new ATOM 0 HG11 VAL A 40 9.975 -6.264 5.024 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.894 -6.245 6.548 1.00 0.00 H new ATOM 0 HG13 VAL A 40 10.153 -7.758 5.974 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.575 -6.454 5.000 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.645 -7.969 5.930 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.640 -6.617 6.505 1.00 0.00 H new ATOM 621 N ALA A 41 7.132 -5.466 9.253 1.00 0.00 N ATOM 622 CA ALA A 41 5.907 -5.162 9.974 1.00 0.00 C ATOM 623 C ALA A 41 4.895 -4.488 9.054 1.00 0.00 C ATOM 624 O ALA A 41 5.268 -3.842 8.078 1.00 0.00 O ATOM 625 CB ALA A 41 6.247 -4.247 11.150 1.00 0.00 C ATOM 0 H ALA A 41 7.698 -4.648 9.025 1.00 0.00 H new ATOM 0 HA ALA A 41 5.461 -6.086 10.341 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.337 -4.010 11.701 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.951 -4.751 11.812 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.696 -3.326 10.777 1.00 0.00 H new ATOM 631 N VAL A 42 3.608 -4.636 9.368 1.00 0.00 N ATOM 632 CA VAL A 42 2.543 -3.959 8.638 1.00 0.00 C ATOM 633 C VAL A 42 1.313 -3.831 9.530 1.00 0.00 C ATOM 634 O VAL A 42 0.862 -4.809 10.123 1.00 0.00 O ATOM 635 CB VAL A 42 2.224 -4.710 7.337 1.00 0.00 C ATOM 636 CG1 VAL A 42 2.261 -6.226 7.530 1.00 0.00 C ATOM 637 CG2 VAL A 42 0.854 -4.319 6.784 1.00 0.00 C ATOM 0 H VAL A 42 3.278 -5.226 10.132 1.00 0.00 H new ATOM 0 HA VAL A 42 2.870 -2.956 8.363 1.00 0.00 H new ATOM 0 HB VAL A 42 2.998 -4.423 6.625 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.030 -6.719 6.586 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.255 -6.526 7.862 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.525 -6.515 8.280 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.662 -4.870 5.863 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.084 -4.558 7.517 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.837 -3.249 6.577 1.00 0.00 H new ATOM 647 N HIS A 43 0.767 -2.616 9.618 1.00 0.00 N ATOM 648 CA HIS A 43 -0.423 -2.320 10.410 1.00 0.00 C ATOM 649 C HIS A 43 -1.113 -1.082 9.846 1.00 0.00 C ATOM 650 O HIS A 43 -0.557 -0.403 8.986 1.00 0.00 O ATOM 651 CB HIS A 43 -0.040 -2.036 11.867 1.00 0.00 C ATOM 652 CG HIS A 43 1.052 -2.910 12.423 1.00 0.00 C ATOM 653 ND1 HIS A 43 0.859 -4.070 13.177 1.00 0.00 N ATOM 654 CD2 HIS A 43 2.390 -2.688 12.267 1.00 0.00 C ATOM 655 CE1 HIS A 43 2.094 -4.524 13.446 1.00 0.00 C ATOM 656 NE2 HIS A 43 3.029 -3.717 12.917 1.00 0.00 N ATOM 0 H HIS A 43 1.146 -1.802 9.134 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.088 -3.182 10.369 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.273 -0.995 11.948 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -0.928 -2.151 12.489 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -0.029 -4.483 13.462 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.854 -1.868 11.739 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.307 -5.419 14.012 1.00 0.00 H new ATOM 664 N ARG A 44 -2.325 -0.776 10.324 1.00 0.00 N ATOM 665 CA ARG A 44 -2.982 0.466 9.942 1.00 0.00 C ATOM 666 C ARG A 44 -2.332 1.594 10.739 1.00 0.00 C ATOM 667 O ARG A 44 -1.634 1.340 11.723 1.00 0.00 O ATOM 668 CB ARG A 44 -4.496 0.379 10.167 1.00 0.00 C ATOM 669 CG ARG A 44 -4.853 0.035 11.612 1.00 0.00 C ATOM 670 CD ARG A 44 -6.369 -0.036 11.769 1.00 0.00 C ATOM 671 NE ARG A 44 -6.729 -0.485 13.118 1.00 0.00 N ATOM 672 CZ ARG A 44 -7.559 0.158 13.948 1.00 0.00 C ATOM 673 NH1 ARG A 44 -8.160 1.287 13.587 1.00 0.00 N ATOM 674 NH2 ARG A 44 -7.789 -0.340 15.158 1.00 0.00 N ATOM 0 H ARG A 44 -2.858 -1.364 10.965 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.856 0.661 8.877 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.955 1.331 9.899 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.916 -0.376 9.503 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.405 -0.919 11.889 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.444 0.787 12.286 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.806 0.944 11.578 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.785 -0.720 11.029 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.314 -1.356 13.450 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.993 1.680 12.661 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -8.789 1.760 14.236 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -7.334 -1.206 15.448 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.420 0.144 15.797 1.00 0.00 H new ATOM 688 N GLU A 45 -2.554 2.838 10.327 1.00 0.00 N ATOM 689 CA GLU A 45 -1.883 3.977 10.939 1.00 0.00 C ATOM 690 C GLU A 45 -2.173 4.088 12.436 1.00 0.00 C ATOM 691 O GLU A 45 -1.422 4.722 13.173 1.00 0.00 O ATOM 692 CB GLU A 45 -2.288 5.238 10.164 1.00 0.00 C ATOM 693 CG GLU A 45 -1.343 6.429 10.349 1.00 0.00 C ATOM 694 CD GLU A 45 -1.503 7.138 11.688 1.00 0.00 C ATOM 695 OE1 GLU A 45 -2.667 7.373 12.083 1.00 0.00 O ATOM 696 OE2 GLU A 45 -0.457 7.438 12.305 1.00 0.00 O ATOM 0 H GLU A 45 -3.194 3.082 9.571 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.803 3.844 10.875 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.342 4.995 9.103 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.290 5.534 10.475 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -0.314 6.083 10.252 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.515 7.146 9.546 1.00 0.00 H new ATOM 703 N GLU A 46 -3.263 3.467 12.899 1.00 0.00 N ATOM 704 CA GLU A 46 -3.650 3.515 14.298 1.00 0.00 C ATOM 705 C GLU A 46 -2.695 2.697 15.164 1.00 0.00 C ATOM 706 O GLU A 46 -2.222 3.168 16.196 1.00 0.00 O ATOM 707 CB GLU A 46 -5.067 2.938 14.408 1.00 0.00 C ATOM 708 CG GLU A 46 -5.636 3.087 15.820 1.00 0.00 C ATOM 709 CD GLU A 46 -5.803 4.555 16.215 1.00 0.00 C ATOM 710 OE1 GLU A 46 -6.370 5.319 15.401 1.00 0.00 O ATOM 711 OE2 GLU A 46 -5.362 4.906 17.333 1.00 0.00 O ATOM 0 H GLU A 46 -3.894 2.922 12.312 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.615 4.545 14.652 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.721 3.444 13.698 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.052 1.884 14.132 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.601 2.583 15.878 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.975 2.592 16.532 1.00 0.00 H new ATOM 718 N ILE A 47 -2.408 1.459 14.745 1.00 0.00 N ATOM 719 CA ILE A 47 -1.616 0.532 15.549 1.00 0.00 C ATOM 720 C ILE A 47 -0.132 0.881 15.454 1.00 0.00 C ATOM 721 O ILE A 47 0.645 0.564 16.353 1.00 0.00 O ATOM 722 CB ILE A 47 -1.847 -0.900 15.046 1.00 0.00 C ATOM 723 CG1 ILE A 47 -3.329 -1.207 14.789 1.00 0.00 C ATOM 724 CG2 ILE A 47 -1.269 -1.906 16.044 1.00 0.00 C ATOM 725 CD1 ILE A 47 -4.230 -0.883 15.979 1.00 0.00 C ATOM 0 H ILE A 47 -2.716 1.079 13.850 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.925 0.609 16.591 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.332 -0.989 14.089 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.665 -0.638 13.922 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.436 -2.262 14.538 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.438 -2.919 15.679 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.198 -1.734 16.155 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.759 -1.783 17.010 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.263 -1.124 15.729 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.919 -1.472 16.842 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.152 0.178 16.216 1.00 0.00 H new ATOM 737 N TYR A 48 0.258 1.536 14.361 1.00 0.00 N ATOM 738 CA TYR A 48 1.643 1.897 14.103 1.00 0.00 C ATOM 739 C TYR A 48 2.203 2.832 15.177 1.00 0.00 C ATOM 740 O TYR A 48 3.405 2.835 15.440 1.00 0.00 O ATOM 741 CB TYR A 48 1.681 2.554 12.725 1.00 0.00 C ATOM 742 CG TYR A 48 3.060 2.938 12.245 1.00 0.00 C ATOM 743 CD1 TYR A 48 3.919 1.963 11.714 1.00 0.00 C ATOM 744 CD2 TYR A 48 3.472 4.272 12.332 1.00 0.00 C ATOM 745 CE1 TYR A 48 5.184 2.330 11.236 1.00 0.00 C ATOM 746 CE2 TYR A 48 4.732 4.650 11.851 1.00 0.00 C ATOM 747 CZ TYR A 48 5.593 3.680 11.291 1.00 0.00 C ATOM 748 OH TYR A 48 6.811 4.046 10.805 1.00 0.00 O ATOM 0 H TYR A 48 -0.386 1.831 13.627 1.00 0.00 H new ATOM 0 HA TYR A 48 2.273 1.008 14.129 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.236 1.872 12.000 1.00 0.00 H new ATOM 0 HB3 TYR A 48 1.057 3.448 12.747 1.00 0.00 H new ATOM 0 HD1 TYR A 48 3.605 0.930 11.674 1.00 0.00 H new ATOM 0 HD2 TYR A 48 2.818 5.011 12.770 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.845 1.581 10.826 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.045 5.682 11.908 1.00 0.00 H new ATOM 0 HH TYR A 48 6.933 5.012 10.920 1.00 0.00 H new ATOM 1211 N MET C 1 0.077 -12.541 4.427 1.00 0.00 N ATOM 1212 CA MET C 1 -0.986 -11.765 3.758 1.00 0.00 C ATOM 1213 C MET C 1 -1.812 -11.005 4.787 1.00 0.00 C ATOM 1214 O MET C 1 -2.086 -11.536 5.856 1.00 0.00 O ATOM 1215 CB MET C 1 -1.892 -12.701 2.944 1.00 0.00 C ATOM 1216 CG MET C 1 -3.018 -11.938 2.240 1.00 0.00 C ATOM 1217 SD MET C 1 -2.465 -10.814 0.940 1.00 0.00 S ATOM 1218 CE MET C 1 -4.081 -10.117 0.526 1.00 0.00 C ATOM 0 H1 MET C 1 0.136 -13.488 4.001 1.00 0.00 H new ATOM 0 H2 MET C 1 0.988 -12.052 4.313 1.00 0.00 H new ATOM 0 H3 MET C 1 -0.143 -12.631 5.439 1.00 0.00 H new ATOM 0 HA MET C 1 -0.521 -11.047 3.082 1.00 0.00 H new ATOM 0 HB2 MET C 1 -1.294 -13.231 2.203 1.00 0.00 H new ATOM 0 HB3 MET C 1 -2.322 -13.454 3.604 1.00 0.00 H new ATOM 0 HG2 MET C 1 -3.713 -12.658 1.808 1.00 0.00 H new ATOM 0 HG3 MET C 1 -3.573 -11.367 2.984 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.002 -9.536 -0.393 1.00 0.00 H new ATOM 0 HE2 MET C 1 -4.800 -10.924 0.384 1.00 0.00 H new ATOM 0 HE3 MET C 1 -4.417 -9.470 1.337 1.00 0.00 H new ATOM 1230 N LEU C 2 -2.210 -9.768 4.482 1.00 0.00 N ATOM 1231 CA LEU C 2 -3.106 -9.003 5.329 1.00 0.00 C ATOM 1232 C LEU C 2 -4.135 -8.286 4.465 1.00 0.00 C ATOM 1233 O LEU C 2 -3.879 -8.000 3.298 1.00 0.00 O ATOM 1234 CB LEU C 2 -2.302 -7.971 6.124 1.00 0.00 C ATOM 1235 CG LEU C 2 -2.067 -8.393 7.574 1.00 0.00 C ATOM 1236 CD1 LEU C 2 -1.216 -7.326 8.253 1.00 0.00 C ATOM 1237 CD2 LEU C 2 -3.380 -8.521 8.344 1.00 0.00 C ATOM 0 H LEU C 2 -1.916 -9.275 3.639 1.00 0.00 H new ATOM 0 HA LEU C 2 -3.615 -9.677 6.018 1.00 0.00 H new ATOM 0 HB2 LEU C 2 -1.340 -7.812 5.636 1.00 0.00 H new ATOM 0 HB3 LEU C 2 -2.829 -7.017 6.109 1.00 0.00 H new ATOM 0 HG LEU C 2 -1.572 -9.364 7.573 1.00 0.00 H new ATOM 0 HD11 LEU C 2 -1.037 -7.609 9.290 1.00 0.00 H new ATOM 0 HD12 LEU C 2 -0.263 -7.235 7.732 1.00 0.00 H new ATOM 0 HD13 LEU C 2 -1.739 -6.370 8.223 1.00 0.00 H new ATOM 0 HD21 LEU C 2 -3.172 -8.823 9.371 1.00 0.00 H new ATOM 0 HD22 LEU C 2 -3.896 -7.561 8.345 1.00 0.00 H new ATOM 0 HD23 LEU C 2 -4.010 -9.271 7.866 1.00 0.00 H new ATOM 1249 N ILE C 3 -5.301 -7.994 5.047 1.00 0.00 N ATOM 1250 CA ILE C 3 -6.366 -7.270 4.379 1.00 0.00 C ATOM 1251 C ILE C 3 -6.920 -6.242 5.354 1.00 0.00 C ATOM 1252 O ILE C 3 -6.943 -6.473 6.565 1.00 0.00 O ATOM 1253 CB ILE C 3 -7.476 -8.218 3.885 1.00 0.00 C ATOM 1254 CG1 ILE C 3 -7.039 -9.106 2.714 1.00 0.00 C ATOM 1255 CG2 ILE C 3 -8.664 -7.408 3.371 1.00 0.00 C ATOM 1256 CD1 ILE C 3 -6.352 -10.392 3.165 1.00 0.00 C ATOM 0 H ILE C 3 -5.527 -8.260 6.006 1.00 0.00 H new ATOM 0 HA ILE C 3 -5.969 -6.773 3.494 1.00 0.00 H new ATOM 0 HB ILE C 3 -7.726 -8.842 4.743 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -7.911 -9.359 2.112 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -6.360 -8.544 2.072 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -9.444 -8.086 3.024 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -9.056 -6.786 4.176 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -8.342 -6.773 2.546 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -6.066 -10.978 2.291 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -5.462 -10.145 3.743 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -7.037 -10.973 3.783 1.00 0.00 H new ATOM 1268 N LEU C 4 -7.364 -5.107 4.819 1.00 0.00 N ATOM 1269 CA LEU C 4 -7.922 -4.010 5.587 1.00 0.00 C ATOM 1270 C LEU C 4 -9.042 -3.355 4.790 1.00 0.00 C ATOM 1271 O LEU C 4 -9.170 -3.582 3.590 1.00 0.00 O ATOM 1272 CB LEU C 4 -6.837 -2.958 5.847 1.00 0.00 C ATOM 1273 CG LEU C 4 -5.696 -3.420 6.754 1.00 0.00 C ATOM 1274 CD1 LEU C 4 -4.670 -2.294 6.824 1.00 0.00 C ATOM 1275 CD2 LEU C 4 -6.192 -3.703 8.170 1.00 0.00 C ATOM 0 H LEU C 4 -7.343 -4.926 3.815 1.00 0.00 H new ATOM 0 HA LEU C 4 -8.304 -4.395 6.532 1.00 0.00 H new ATOM 0 HB2 LEU C 4 -6.418 -2.646 4.891 1.00 0.00 H new ATOM 0 HB3 LEU C 4 -7.303 -2.079 6.293 1.00 0.00 H new ATOM 0 HG LEU C 4 -5.269 -4.336 6.347 1.00 0.00 H new ATOM 0 HD11 LEU C 4 -3.842 -2.595 7.466 1.00 0.00 H new ATOM 0 HD12 LEU C 4 -4.294 -2.081 5.823 1.00 0.00 H new ATOM 0 HD13 LEU C 4 -5.139 -1.399 7.233 1.00 0.00 H new ATOM 0 HD21 LEU C 4 -5.357 -4.029 8.790 1.00 0.00 H new ATOM 0 HD22 LEU C 4 -6.624 -2.796 8.592 1.00 0.00 H new ATOM 0 HD23 LEU C 4 -6.950 -4.486 8.140 1.00 0.00 H new ATOM 1287 N THR C 5 -9.849 -2.539 5.469 1.00 0.00 N ATOM 1288 CA THR C 5 -10.848 -1.728 4.795 1.00 0.00 C ATOM 1289 C THR C 5 -10.693 -0.295 5.284 1.00 0.00 C ATOM 1290 O THR C 5 -11.220 0.080 6.331 1.00 0.00 O ATOM 1291 CB THR C 5 -12.267 -2.246 5.024 1.00 0.00 C ATOM 1292 OG1 THR C 5 -12.277 -3.648 5.183 1.00 0.00 O ATOM 1293 CG2 THR C 5 -13.106 -1.883 3.804 1.00 0.00 C ATOM 0 H THR C 5 -9.826 -2.426 6.483 1.00 0.00 H new ATOM 0 HA THR C 5 -10.688 -1.779 3.718 1.00 0.00 H new ATOM 0 HB THR C 5 -12.669 -1.795 5.931 1.00 0.00 H new ATOM 0 HG1 THR C 5 -11.603 -4.049 4.595 1.00 0.00 H new ATOM 0 HG21 THR C 5 -14.125 -2.243 3.943 1.00 0.00 H new ATOM 0 HG22 THR C 5 -13.117 -0.800 3.679 1.00 0.00 H new ATOM 0 HG23 THR C 5 -12.676 -2.346 2.916 1.00 0.00 H new ATOM 1301 N ARG C 6 -9.954 0.496 4.508 1.00 0.00 N ATOM 1302 CA ARG C 6 -9.631 1.882 4.803 1.00 0.00 C ATOM 1303 C ARG C 6 -10.545 2.774 3.963 1.00 0.00 C ATOM 1304 O ARG C 6 -11.129 2.293 2.996 1.00 0.00 O ATOM 1305 CB ARG C 6 -8.166 2.068 4.387 1.00 0.00 C ATOM 1306 CG ARG C 6 -7.505 3.375 4.830 1.00 0.00 C ATOM 1307 CD ARG C 6 -6.955 3.295 6.255 1.00 0.00 C ATOM 1308 NE ARG C 6 -8.006 3.372 7.276 1.00 0.00 N ATOM 1309 CZ ARG C 6 -7.763 3.646 8.560 1.00 0.00 C ATOM 1310 NH1 ARG C 6 -6.517 3.847 8.993 1.00 0.00 N ATOM 1311 NH2 ARG C 6 -8.769 3.723 9.424 1.00 0.00 N ATOM 0 H ARG C 6 -9.552 0.174 3.628 1.00 0.00 H new ATOM 0 HA ARG C 6 -9.769 2.137 5.854 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -7.586 1.236 4.788 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -8.106 2.003 3.301 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -6.695 3.620 4.144 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -8.231 4.186 4.768 1.00 0.00 H new ATOM 0 HD2 ARG C 6 -6.406 2.361 6.376 1.00 0.00 H new ATOM 0 HD3 ARG C 6 -6.243 4.106 6.411 1.00 0.00 H new ATOM 0 HE ARG C 6 -8.971 3.208 6.990 1.00 0.00 H new ATOM 0 HH11 ARG C 6 -5.735 3.792 8.340 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -6.346 4.056 9.977 1.00 0.00 H new ATOM 0 HH21 ARG C 6 -9.727 3.573 9.106 1.00 0.00 H new ATOM 0 HH22 ARG C 6 -8.584 3.932 10.405 1.00 0.00 H new ATOM 1325 N LYS C 7 -10.694 4.061 4.303 1.00 0.00 N ATOM 1326 CA LYS C 7 -11.455 4.974 3.456 1.00 0.00 C ATOM 1327 C LYS C 7 -10.653 6.225 3.149 1.00 0.00 C ATOM 1328 O LYS C 7 -9.620 6.482 3.763 1.00 0.00 O ATOM 1329 CB LYS C 7 -12.832 5.325 4.029 1.00 0.00 C ATOM 1330 CG LYS C 7 -12.784 5.914 5.435 1.00 0.00 C ATOM 1331 CD LYS C 7 -14.171 6.481 5.753 1.00 0.00 C ATOM 1332 CE LYS C 7 -14.217 7.139 7.130 1.00 0.00 C ATOM 1333 NZ LYS C 7 -14.000 6.158 8.212 1.00 0.00 N ATOM 0 H LYS C 7 -10.303 4.484 5.145 1.00 0.00 H new ATOM 0 HA LYS C 7 -11.643 4.443 2.523 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -13.321 6.037 3.364 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -13.449 4.426 4.043 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -12.509 5.149 6.161 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -12.028 6.697 5.495 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -14.447 7.211 4.993 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -14.909 5.680 5.709 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -13.456 7.918 7.187 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -15.182 7.626 7.269 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -14.155 6.616 9.133 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -14.666 5.367 8.102 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -13.025 5.799 8.164 1.00 0.00 H new ATOM 1347 N VAL C 8 -11.143 6.999 2.182 1.00 0.00 N ATOM 1348 CA VAL C 8 -10.389 8.118 1.637 1.00 0.00 C ATOM 1349 C VAL C 8 -9.951 9.098 2.714 1.00 0.00 C ATOM 1350 O VAL C 8 -10.752 9.532 3.544 1.00 0.00 O ATOM 1351 CB VAL C 8 -11.148 8.796 0.494 1.00 0.00 C ATOM 1352 CG1 VAL C 8 -11.619 7.734 -0.501 1.00 0.00 C ATOM 1353 CG2 VAL C 8 -12.366 9.609 0.924 1.00 0.00 C ATOM 0 H VAL C 8 -12.063 6.868 1.761 1.00 0.00 H new ATOM 0 HA VAL C 8 -9.470 7.715 1.212 1.00 0.00 H new ATOM 0 HB VAL C 8 -10.439 9.498 0.055 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -12.160 8.214 -1.316 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -10.756 7.202 -0.902 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -12.277 7.028 0.005 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -12.837 10.050 0.046 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -13.079 8.957 1.429 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -12.053 10.401 1.605 1.00 0.00 H new ATOM 1363 N GLY C 9 -8.662 9.443 2.689 1.00 0.00 N ATOM 1364 CA GLY C 9 -8.084 10.420 3.606 1.00 0.00 C ATOM 1365 C GLY C 9 -7.347 9.768 4.771 1.00 0.00 C ATOM 1366 O GLY C 9 -6.776 10.476 5.600 1.00 0.00 O ATOM 0 H GLY C 9 -7.990 9.050 2.030 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -7.394 11.062 3.059 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -8.876 11.060 3.995 1.00 0.00 H new ATOM 1370 N GLU C 10 -7.348 8.434 4.851 1.00 0.00 N ATOM 1371 CA GLU C 10 -6.677 7.711 5.927 1.00 0.00 C ATOM 1372 C GLU C 10 -5.415 7.012 5.412 1.00 0.00 C ATOM 1373 O GLU C 10 -5.088 7.118 4.229 1.00 0.00 O ATOM 1374 CB GLU C 10 -7.651 6.713 6.561 1.00 0.00 C ATOM 1375 CG GLU C 10 -8.879 7.414 7.150 1.00 0.00 C ATOM 1376 CD GLU C 10 -8.495 8.405 8.247 1.00 0.00 C ATOM 1377 OE1 GLU C 10 -7.654 8.036 9.096 1.00 0.00 O ATOM 1378 OE2 GLU C 10 -9.044 9.532 8.232 1.00 0.00 O ATOM 0 H GLU C 10 -7.813 7.830 4.173 1.00 0.00 H new ATOM 0 HA GLU C 10 -6.362 8.421 6.692 1.00 0.00 H new ATOM 0 HB2 GLU C 10 -7.970 5.990 5.811 1.00 0.00 H new ATOM 0 HB3 GLU C 10 -7.140 6.154 7.345 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -9.413 7.938 6.358 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -9.563 6.669 7.557 1.00 0.00 H new ATOM 1385 N SER C 11 -4.706 6.296 6.295 1.00 0.00 N ATOM 1386 CA SER C 11 -3.401 5.736 5.968 1.00 0.00 C ATOM 1387 C SER C 11 -3.163 4.352 6.570 1.00 0.00 C ATOM 1388 O SER C 11 -3.923 3.883 7.419 1.00 0.00 O ATOM 1389 CB SER C 11 -2.309 6.693 6.451 1.00 0.00 C ATOM 1390 OG SER C 11 -2.490 7.978 5.896 1.00 0.00 O ATOM 0 H SER C 11 -5.022 6.094 7.244 1.00 0.00 H new ATOM 0 HA SER C 11 -3.371 5.616 4.885 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.329 6.755 7.539 1.00 0.00 H new ATOM 0 HB3 SER C 11 -1.329 6.305 6.171 1.00 0.00 H new ATOM 0 HG SER C 11 -1.783 8.576 6.218 1.00 0.00 H new ATOM 1396 N ILE C 12 -2.086 3.709 6.106 1.00 0.00 N ATOM 1397 CA ILE C 12 -1.610 2.392 6.518 1.00 0.00 C ATOM 1398 C ILE C 12 -0.077 2.477 6.565 1.00 0.00 C ATOM 1399 O ILE C 12 0.496 3.408 6.003 1.00 0.00 O ATOM 1400 CB ILE C 12 -2.088 1.329 5.511 1.00 0.00 C ATOM 1401 CG1 ILE C 12 -3.620 1.354 5.390 1.00 0.00 C ATOM 1402 CG2 ILE C 12 -1.636 -0.081 5.920 1.00 0.00 C ATOM 1403 CD1 ILE C 12 -4.123 0.470 4.247 1.00 0.00 C ATOM 0 H ILE C 12 -1.490 4.123 5.389 1.00 0.00 H new ATOM 0 HA ILE C 12 -2.000 2.104 7.494 1.00 0.00 H new ATOM 0 HB ILE C 12 -1.639 1.571 4.548 1.00 0.00 H new ATOM 0 HG12 ILE C 12 -4.063 1.019 6.328 1.00 0.00 H new ATOM 0 HG13 ILE C 12 -3.954 2.379 5.228 1.00 0.00 H new ATOM 0 HG21 ILE C 12 -1.992 -0.804 5.186 1.00 0.00 H new ATOM 0 HG22 ILE C 12 -0.547 -0.115 5.965 1.00 0.00 H new ATOM 0 HG23 ILE C 12 -2.048 -0.325 6.899 1.00 0.00 H new ATOM 0 HD11 ILE C 12 -5.211 0.520 4.200 1.00 0.00 H new ATOM 0 HD12 ILE C 12 -3.703 0.820 3.304 1.00 0.00 H new ATOM 0 HD13 ILE C 12 -3.814 -0.561 4.421 1.00 0.00 H new ATOM 1415 N ASN C 13 0.605 1.533 7.218 1.00 0.00 N ATOM 1416 CA ASN C 13 2.050 1.601 7.377 1.00 0.00 C ATOM 1417 C ASN C 13 2.714 0.238 7.187 1.00 0.00 C ATOM 1418 O ASN C 13 2.094 -0.801 7.401 1.00 0.00 O ATOM 1419 CB ASN C 13 2.380 2.152 8.764 1.00 0.00 C ATOM 1420 CG ASN C 13 1.959 3.610 8.911 1.00 0.00 C ATOM 1421 OD1 ASN C 13 0.784 3.909 9.106 1.00 0.00 O ATOM 1422 ND2 ASN C 13 2.914 4.526 8.817 1.00 0.00 N ATOM 0 H ASN C 13 0.174 0.713 7.644 1.00 0.00 H new ATOM 0 HA ASN C 13 2.442 2.263 6.605 1.00 0.00 H new ATOM 0 HB2 ASN C 13 1.878 1.551 9.522 1.00 0.00 H new ATOM 0 HB3 ASN C 13 3.451 2.063 8.944 1.00 0.00 H new ATOM 0 HD21 ASN C 13 2.682 5.515 8.907 1.00 0.00 H new ATOM 0 HD22 ASN C 13 3.880 4.241 8.655 1.00 0.00 H new ATOM 1429 N ILE C 14 3.987 0.271 6.783 1.00 0.00 N ATOM 1430 CA ILE C 14 4.795 -0.918 6.551 1.00 0.00 C ATOM 1431 C ILE C 14 6.220 -0.652 7.041 1.00 0.00 C ATOM 1432 O ILE C 14 6.705 0.480 6.974 1.00 0.00 O ATOM 1433 CB ILE C 14 4.790 -1.282 5.054 1.00 0.00 C ATOM 1434 CG1 ILE C 14 3.352 -1.416 4.538 1.00 0.00 C ATOM 1435 CG2 ILE C 14 5.562 -2.588 4.823 1.00 0.00 C ATOM 1436 CD1 ILE C 14 3.302 -1.747 3.046 1.00 0.00 C ATOM 0 H ILE C 14 4.488 1.142 6.607 1.00 0.00 H new ATOM 0 HA ILE C 14 4.378 -1.761 7.101 1.00 0.00 H new ATOM 0 HB ILE C 14 5.282 -0.481 4.501 1.00 0.00 H new ATOM 0 HG12 ILE C 14 2.838 -2.196 5.099 1.00 0.00 H new ATOM 0 HG13 ILE C 14 2.814 -0.486 4.720 1.00 0.00 H new ATOM 0 HG21 ILE C 14 5.551 -2.834 3.761 1.00 0.00 H new ATOM 0 HG22 ILE C 14 6.592 -2.465 5.156 1.00 0.00 H new ATOM 0 HG23 ILE C 14 5.092 -3.393 5.387 1.00 0.00 H new ATOM 0 HD11 ILE C 14 2.263 -1.832 2.727 1.00 0.00 H new ATOM 0 HD12 ILE C 14 3.792 -0.954 2.481 1.00 0.00 H new ATOM 0 HD13 ILE C 14 3.815 -2.691 2.865 1.00 0.00 H new ATOM 1448 N GLY C 15 6.895 -1.694 7.532 1.00 0.00 N ATOM 1449 CA GLY C 15 8.245 -1.574 8.059 1.00 0.00 C ATOM 1450 C GLY C 15 8.314 -0.476 9.113 1.00 0.00 C ATOM 1451 O GLY C 15 7.409 -0.337 9.935 1.00 0.00 O ATOM 0 H GLY C 15 6.517 -2.640 7.573 1.00 0.00 H new ATOM 0 HA2 GLY C 15 8.557 -2.523 8.494 1.00 0.00 H new ATOM 0 HA3 GLY C 15 8.939 -1.352 7.249 1.00 0.00 H new ATOM 1455 N ASP C 16 9.394 0.304 9.083 1.00 0.00 N ATOM 1456 CA ASP C 16 9.589 1.435 9.985 1.00 0.00 C ATOM 1457 C ASP C 16 9.980 2.683 9.186 1.00 0.00 C ATOM 1458 O ASP C 16 10.377 3.694 9.763 1.00 0.00 O ATOM 1459 CB ASP C 16 10.653 1.087 11.031 1.00 0.00 C ATOM 1460 CG ASP C 16 10.225 -0.102 11.888 1.00 0.00 C ATOM 1461 OD1 ASP C 16 9.519 0.133 12.893 1.00 0.00 O ATOM 1462 OD2 ASP C 16 10.606 -1.240 11.534 1.00 0.00 O ATOM 0 H ASP C 16 10.163 0.167 8.427 1.00 0.00 H new ATOM 0 HA ASP C 16 8.656 1.649 10.507 1.00 0.00 H new ATOM 0 HB2 ASP C 16 11.594 0.857 10.532 1.00 0.00 H new ATOM 0 HB3 ASP C 16 10.834 1.951 11.670 1.00 0.00 H new ATOM 1467 N ASP C 17 9.861 2.610 7.852 1.00 0.00 N ATOM 1468 CA ASP C 17 10.224 3.700 6.955 1.00 0.00 C ATOM 1469 C ASP C 17 9.237 3.823 5.791 1.00 0.00 C ATOM 1470 O ASP C 17 9.514 4.556 4.842 1.00 0.00 O ATOM 1471 CB ASP C 17 11.644 3.498 6.411 1.00 0.00 C ATOM 1472 CG ASP C 17 12.678 3.361 7.528 1.00 0.00 C ATOM 1473 OD1 ASP C 17 13.141 4.416 8.012 1.00 0.00 O ATOM 1474 OD2 ASP C 17 12.997 2.205 7.891 1.00 0.00 O ATOM 0 H ASP C 17 9.507 1.784 7.369 1.00 0.00 H new ATOM 0 HA ASP C 17 10.187 4.624 7.532 1.00 0.00 H new ATOM 0 HB2 ASP C 17 11.668 2.606 5.785 1.00 0.00 H new ATOM 0 HB3 ASP C 17 11.910 4.341 5.774 1.00 0.00 H new ATOM 1479 N ILE C 18 8.091 3.125 5.837 1.00 0.00 N ATOM 1480 CA ILE C 18 7.123 3.181 4.752 1.00 0.00 C ATOM 1481 C ILE C 18 5.724 3.473 5.285 1.00 0.00 C ATOM 1482 O ILE C 18 5.345 3.022 6.367 1.00 0.00 O ATOM 1483 CB ILE C 18 7.133 1.870 3.944 1.00 0.00 C ATOM 1484 CG1 ILE C 18 8.527 1.529 3.403 1.00 0.00 C ATOM 1485 CG2 ILE C 18 6.165 1.982 2.764 1.00 0.00 C ATOM 1486 CD1 ILE C 18 9.255 0.584 4.358 1.00 0.00 C ATOM 0 H ILE C 18 7.821 2.521 6.613 1.00 0.00 H new ATOM 0 HA ILE C 18 7.409 3.996 4.087 1.00 0.00 H new ATOM 0 HB ILE C 18 6.827 1.074 4.623 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.439 1.066 2.420 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.107 2.443 3.274 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.175 1.052 2.195 1.00 0.00 H new ATOM 0 HG22 ILE C 18 5.158 2.168 3.136 1.00 0.00 H new ATOM 0 HG23 ILE C 18 6.471 2.805 2.119 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.242 0.353 3.958 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.360 1.061 5.332 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.682 -0.337 4.466 1.00 0.00 H new ATOM 1498 N THR C 19 4.957 4.239 4.506 1.00 0.00 N ATOM 1499 CA THR C 19 3.573 4.582 4.795 1.00 0.00 C ATOM 1500 C THR C 19 2.796 4.556 3.484 1.00 0.00 C ATOM 1501 O THR C 19 3.378 4.732 2.414 1.00 0.00 O ATOM 1502 CB THR C 19 3.519 5.967 5.449 1.00 0.00 C ATOM 1503 OG1 THR C 19 4.346 5.987 6.591 1.00 0.00 O ATOM 1504 CG2 THR C 19 2.101 6.349 5.874 1.00 0.00 C ATOM 0 H THR C 19 5.296 4.646 3.634 1.00 0.00 H new ATOM 0 HA THR C 19 3.128 3.868 5.488 1.00 0.00 H new ATOM 0 HB THR C 19 3.863 6.686 4.706 1.00 0.00 H new ATOM 0 HG1 THR C 19 4.310 6.874 7.005 1.00 0.00 H new ATOM 0 HG21 THR C 19 2.112 7.338 6.332 1.00 0.00 H new ATOM 0 HG22 THR C 19 1.450 6.362 5.000 1.00 0.00 H new ATOM 0 HG23 THR C 19 1.728 5.620 6.593 1.00 0.00 H new ATOM 1512 N ILE C 20 1.484 4.342 3.564 1.00 0.00 N ATOM 1513 CA ILE C 20 0.601 4.270 2.410 1.00 0.00 C ATOM 1514 C ILE C 20 -0.624 5.123 2.710 1.00 0.00 C ATOM 1515 O ILE C 20 -1.037 5.220 3.863 1.00 0.00 O ATOM 1516 CB ILE C 20 0.195 2.808 2.166 1.00 0.00 C ATOM 1517 CG1 ILE C 20 1.409 1.891 1.953 1.00 0.00 C ATOM 1518 CG2 ILE C 20 -0.758 2.698 0.973 1.00 0.00 C ATOM 1519 CD1 ILE C 20 2.155 2.181 0.650 1.00 0.00 C ATOM 0 H ILE C 20 0.999 4.212 4.452 1.00 0.00 H new ATOM 0 HA ILE C 20 1.099 4.638 1.513 1.00 0.00 H new ATOM 0 HB ILE C 20 -0.318 2.473 3.067 1.00 0.00 H new ATOM 0 HG12 ILE C 20 2.096 2.006 2.792 1.00 0.00 H new ATOM 0 HG13 ILE C 20 1.077 0.853 1.952 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -1.031 1.654 0.820 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.656 3.283 1.170 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -0.266 3.079 0.078 1.00 0.00 H new ATOM 0 HD11 ILE C 20 3.002 1.501 0.557 1.00 0.00 H new ATOM 0 HD12 ILE C 20 1.481 2.039 -0.195 1.00 0.00 H new ATOM 0 HD13 ILE C 20 2.515 3.210 0.658 1.00 0.00 H new ATOM 1531 N THR C 21 -1.207 5.736 1.678 1.00 0.00 N ATOM 1532 CA THR C 21 -2.339 6.630 1.866 1.00 0.00 C ATOM 1533 C THR C 21 -3.355 6.436 0.748 1.00 0.00 C ATOM 1534 O THR C 21 -2.992 6.157 -0.392 1.00 0.00 O ATOM 1535 CB THR C 21 -1.851 8.083 1.877 1.00 0.00 C ATOM 1536 OG1 THR C 21 -0.724 8.215 2.711 1.00 0.00 O ATOM 1537 CG2 THR C 21 -2.940 9.026 2.396 1.00 0.00 C ATOM 0 H THR C 21 -0.911 5.627 0.708 1.00 0.00 H new ATOM 0 HA THR C 21 -2.817 6.401 2.818 1.00 0.00 H new ATOM 0 HB THR C 21 -1.596 8.348 0.851 1.00 0.00 H new ATOM 0 HG1 THR C 21 -0.422 9.147 2.708 1.00 0.00 H new ATOM 0 HG21 THR C 21 -2.566 10.050 2.393 1.00 0.00 H new ATOM 0 HG22 THR C 21 -3.817 8.958 1.753 1.00 0.00 H new ATOM 0 HG23 THR C 21 -3.213 8.742 3.412 1.00 0.00 H new ATOM 1545 N ILE C 22 -4.638 6.582 1.086 1.00 0.00 N ATOM 1546 CA ILE C 22 -5.738 6.473 0.141 1.00 0.00 C ATOM 1547 C ILE C 22 -6.271 7.878 -0.128 1.00 0.00 C ATOM 1548 O ILE C 22 -7.139 8.375 0.587 1.00 0.00 O ATOM 1549 CB ILE C 22 -6.777 5.471 0.674 1.00 0.00 C ATOM 1550 CG1 ILE C 22 -8.096 5.486 -0.106 1.00 0.00 C ATOM 1551 CG2 ILE C 22 -7.099 5.693 2.151 1.00 0.00 C ATOM 1552 CD1 ILE C 22 -7.866 5.392 -1.607 1.00 0.00 C ATOM 0 H ILE C 22 -4.940 6.782 2.039 1.00 0.00 H new ATOM 0 HA ILE C 22 -5.423 6.069 -0.821 1.00 0.00 H new ATOM 0 HB ILE C 22 -6.300 4.500 0.540 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -8.720 4.653 0.219 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -8.642 6.401 0.121 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -7.837 4.960 2.477 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -6.190 5.581 2.742 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -7.500 6.697 2.289 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -8.826 5.406 -2.124 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -7.264 6.239 -1.937 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -7.343 4.464 -1.838 1.00 0.00 H new ATOM 1564 N LEU C 23 -5.744 8.527 -1.171 1.00 0.00 N ATOM 1565 CA LEU C 23 -6.031 9.929 -1.439 1.00 0.00 C ATOM 1566 C LEU C 23 -7.490 10.158 -1.834 1.00 0.00 C ATOM 1567 O LEU C 23 -8.013 11.250 -1.624 1.00 0.00 O ATOM 1568 CB LEU C 23 -5.110 10.455 -2.547 1.00 0.00 C ATOM 1569 CG LEU C 23 -3.622 10.148 -2.334 1.00 0.00 C ATOM 1570 CD1 LEU C 23 -2.794 10.915 -3.362 1.00 0.00 C ATOM 1571 CD2 LEU C 23 -3.131 10.549 -0.946 1.00 0.00 C ATOM 0 H LEU C 23 -5.112 8.095 -1.845 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.849 10.475 -0.513 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.424 10.026 -3.498 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -5.238 11.535 -2.627 1.00 0.00 H new ATOM 0 HG LEU C 23 -3.504 9.070 -2.443 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.736 10.698 -3.212 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.088 10.611 -4.366 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.966 11.985 -3.242 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -2.072 10.309 -0.851 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -3.274 11.620 -0.805 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -3.696 10.005 -0.189 1.00 0.00 H new ATOM 1583 N GLY C 24 -8.156 9.146 -2.399 1.00 0.00 N ATOM 1584 CA GLY C 24 -9.565 9.252 -2.767 1.00 0.00 C ATOM 1585 C GLY C 24 -9.970 8.217 -3.808 1.00 0.00 C ATOM 1586 O GLY C 24 -9.190 7.324 -4.131 1.00 0.00 O ATOM 0 H GLY C 24 -7.736 8.241 -2.611 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -10.181 9.129 -1.876 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -9.763 10.251 -3.155 1.00 0.00 H new ATOM 1590 N VAL C 25 -11.193 8.326 -4.337 1.00 0.00 N ATOM 1591 CA VAL C 25 -11.664 7.424 -5.385 1.00 0.00 C ATOM 1592 C VAL C 25 -12.326 8.193 -6.526 1.00 0.00 C ATOM 1593 O VAL C 25 -12.739 9.340 -6.362 1.00 0.00 O ATOM 1594 CB VAL C 25 -12.636 6.368 -4.833 1.00 0.00 C ATOM 1595 CG1 VAL C 25 -12.068 5.677 -3.591 1.00 0.00 C ATOM 1596 CG2 VAL C 25 -14.000 6.973 -4.503 1.00 0.00 C ATOM 0 H VAL C 25 -11.873 9.032 -4.054 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.785 6.910 -5.774 1.00 0.00 H new ATOM 0 HB VAL C 25 -12.766 5.625 -5.620 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -12.781 4.937 -3.228 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -11.131 5.183 -3.846 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.887 6.419 -2.813 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -14.659 6.196 -4.116 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -13.880 7.754 -3.752 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -14.436 7.402 -5.405 1.00 0.00 H new ATOM 1606 N SER C 26 -12.417 7.535 -7.685 1.00 0.00 N ATOM 1607 CA SER C 26 -13.091 8.046 -8.867 1.00 0.00 C ATOM 1608 C SER C 26 -13.611 6.848 -9.654 1.00 0.00 C ATOM 1609 O SER C 26 -12.918 6.318 -10.522 1.00 0.00 O ATOM 1610 CB SER C 26 -12.118 8.885 -9.697 1.00 0.00 C ATOM 1611 OG SER C 26 -12.792 9.418 -10.818 1.00 0.00 O ATOM 0 H SER C 26 -12.012 6.609 -7.824 1.00 0.00 H new ATOM 0 HA SER C 26 -13.925 8.693 -8.597 1.00 0.00 H new ATOM 0 HB2 SER C 26 -11.707 9.691 -9.089 1.00 0.00 H new ATOM 0 HB3 SER C 26 -11.278 8.271 -10.022 1.00 0.00 H new ATOM 0 HG SER C 26 -12.169 9.957 -11.349 1.00 0.00 H new ATOM 1617 N GLY C 27 -14.838 6.406 -9.359 1.00 0.00 N ATOM 1618 CA GLY C 27 -15.368 5.203 -9.981 1.00 0.00 C ATOM 1619 C GLY C 27 -14.584 3.991 -9.488 1.00 0.00 C ATOM 1620 O GLY C 27 -14.361 3.850 -8.286 1.00 0.00 O ATOM 0 H GLY C 27 -15.471 6.861 -8.701 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.425 5.090 -9.738 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -15.297 5.279 -11.066 1.00 0.00 H new ATOM 1624 N GLN C 28 -14.163 3.111 -10.402 1.00 0.00 N ATOM 1625 CA GLN C 28 -13.343 1.971 -10.018 1.00 0.00 C ATOM 1626 C GLN C 28 -11.918 2.434 -9.783 1.00 0.00 C ATOM 1627 O GLN C 28 -11.158 1.746 -9.106 1.00 0.00 O ATOM 1628 CB GLN C 28 -13.313 0.905 -11.113 1.00 0.00 C ATOM 1629 CG GLN C 28 -14.680 0.290 -11.381 1.00 0.00 C ATOM 1630 CD GLN C 28 -15.296 -0.321 -10.126 1.00 0.00 C ATOM 1631 OE1 GLN C 28 -15.208 -1.525 -9.914 1.00 0.00 O ATOM 1632 NE2 GLN C 28 -15.920 0.497 -9.283 1.00 0.00 N ATOM 0 H GLN C 28 -14.376 3.169 -11.398 1.00 0.00 H new ATOM 0 HA GLN C 28 -13.777 1.543 -9.114 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -12.933 1.348 -12.034 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -12.616 0.117 -10.827 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.349 1.055 -11.776 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -14.586 -0.479 -12.148 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -15.976 1.495 -9.488 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -16.342 0.127 -8.432 1.00 0.00 H new ATOM 1641 N GLN C 29 -11.546 3.593 -10.340 1.00 0.00 N ATOM 1642 CA GLN C 29 -10.227 4.132 -10.106 1.00 0.00 C ATOM 1643 C GLN C 29 -10.160 4.582 -8.652 1.00 0.00 C ATOM 1644 O GLN C 29 -11.152 5.024 -8.073 1.00 0.00 O ATOM 1645 CB GLN C 29 -9.949 5.291 -11.063 1.00 0.00 C ATOM 1646 CG GLN C 29 -8.755 4.993 -11.977 1.00 0.00 C ATOM 1647 CD GLN C 29 -9.076 3.955 -13.046 1.00 0.00 C ATOM 1648 OE1 GLN C 29 -8.349 2.980 -13.210 1.00 0.00 O ATOM 1649 NE2 GLN C 29 -10.167 4.150 -13.785 1.00 0.00 N ATOM 0 H GLN C 29 -12.140 4.159 -10.946 1.00 0.00 H new ATOM 0 HA GLN C 29 -9.463 3.376 -10.291 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -10.834 5.483 -11.670 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -9.753 6.197 -10.490 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -8.432 5.916 -12.458 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -7.920 4.640 -11.373 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -10.752 4.970 -13.625 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -10.418 3.479 -14.511 1.00 0.00 H new ATOM 1658 N VAL C 30 -8.974 4.461 -8.066 1.00 0.00 N ATOM 1659 CA VAL C 30 -8.706 4.790 -6.681 1.00 0.00 C ATOM 1660 C VAL C 30 -7.379 5.527 -6.672 1.00 0.00 C ATOM 1661 O VAL C 30 -6.376 5.001 -7.147 1.00 0.00 O ATOM 1662 CB VAL C 30 -8.640 3.494 -5.862 1.00 0.00 C ATOM 1663 CG1 VAL C 30 -8.308 3.777 -4.404 1.00 0.00 C ATOM 1664 CG2 VAL C 30 -9.985 2.771 -5.887 1.00 0.00 C ATOM 0 H VAL C 30 -8.150 4.120 -8.562 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.484 5.413 -6.239 1.00 0.00 H new ATOM 0 HB VAL C 30 -7.861 2.879 -6.312 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -8.269 2.839 -3.851 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.341 4.276 -4.341 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -9.076 4.420 -3.974 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.917 1.855 -5.300 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.753 3.417 -5.462 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.246 2.524 -6.916 1.00 0.00 H new ATOM 1674 N ARG C 31 -7.376 6.747 -6.132 1.00 0.00 N ATOM 1675 CA ARG C 31 -6.172 7.556 -6.070 1.00 0.00 C ATOM 1676 C ARG C 31 -5.419 7.164 -4.813 1.00 0.00 C ATOM 1677 O ARG C 31 -5.992 7.156 -3.724 1.00 0.00 O ATOM 1678 CB ARG C 31 -6.559 9.033 -6.055 1.00 0.00 C ATOM 1679 CG ARG C 31 -5.390 9.889 -6.544 1.00 0.00 C ATOM 1680 CD ARG C 31 -5.815 11.357 -6.515 1.00 0.00 C ATOM 1681 NE ARG C 31 -5.021 12.166 -7.445 1.00 0.00 N ATOM 1682 CZ ARG C 31 -5.235 13.464 -7.687 1.00 0.00 C ATOM 1683 NH1 ARG C 31 -6.159 14.149 -7.021 1.00 0.00 N ATOM 1684 NH2 ARG C 31 -4.514 14.089 -8.613 1.00 0.00 N ATOM 0 H ARG C 31 -8.202 7.192 -5.731 1.00 0.00 H new ATOM 0 HA ARG C 31 -5.533 7.391 -6.937 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -7.429 9.195 -6.691 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.842 9.332 -5.046 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -4.517 9.735 -5.910 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.105 9.598 -7.555 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.871 11.436 -6.773 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -5.704 11.749 -5.504 1.00 0.00 H new ATOM 0 HE ARG C 31 -4.255 11.709 -7.940 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.723 13.685 -6.308 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -6.305 15.138 -7.223 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -3.802 13.579 -9.135 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -4.673 15.079 -8.801 1.00 0.00 H new ATOM 1698 N ILE C 32 -4.139 6.839 -4.962 1.00 0.00 N ATOM 1699 CA ILE C 32 -3.364 6.251 -3.876 1.00 0.00 C ATOM 1700 C ILE C 32 -2.009 6.933 -3.789 1.00 0.00 C ATOM 1701 O ILE C 32 -1.518 7.476 -4.776 1.00 0.00 O ATOM 1702 CB ILE C 32 -3.191 4.737 -4.110 1.00 0.00 C ATOM 1703 CG1 ILE C 32 -4.522 4.105 -4.542 1.00 0.00 C ATOM 1704 CG2 ILE C 32 -2.661 4.054 -2.843 1.00 0.00 C ATOM 1705 CD1 ILE C 32 -4.465 2.580 -4.616 1.00 0.00 C ATOM 0 H ILE C 32 -3.615 6.974 -5.827 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.894 6.397 -2.935 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.464 4.593 -4.909 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.302 4.400 -3.840 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.805 4.500 -5.518 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -2.545 2.986 -3.027 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -1.695 4.483 -2.575 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -3.365 4.207 -2.025 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -5.436 2.194 -4.927 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.707 2.279 -5.339 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.212 2.177 -3.635 1.00 0.00 H new ATOM 1717 N GLY C 33 -1.410 6.902 -2.601 1.00 0.00 N ATOM 1718 CA GLY C 33 -0.096 7.469 -2.371 1.00 0.00 C ATOM 1719 C GLY C 33 0.785 6.457 -1.653 1.00 0.00 C ATOM 1720 O GLY C 33 0.290 5.545 -0.991 1.00 0.00 O ATOM 0 H GLY C 33 -1.829 6.480 -1.772 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.359 7.752 -3.320 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.181 8.378 -1.775 1.00 0.00 H new ATOM 1724 N ILE C 34 2.098 6.636 -1.791 1.00 0.00 N ATOM 1725 CA ILE C 34 3.102 5.752 -1.226 1.00 0.00 C ATOM 1726 C ILE C 34 4.222 6.628 -0.704 1.00 0.00 C ATOM 1727 O ILE C 34 4.651 7.558 -1.382 1.00 0.00 O ATOM 1728 CB ILE C 34 3.640 4.811 -2.314 1.00 0.00 C ATOM 1729 CG1 ILE C 34 2.507 4.019 -2.982 1.00 0.00 C ATOM 1730 CG2 ILE C 34 4.671 3.856 -1.702 1.00 0.00 C ATOM 1731 CD1 ILE C 34 3.029 3.234 -4.188 1.00 0.00 C ATOM 0 H ILE C 34 2.496 7.418 -2.311 1.00 0.00 H new ATOM 0 HA ILE C 34 2.679 5.143 -0.427 1.00 0.00 H new ATOM 0 HB ILE C 34 4.117 5.415 -3.086 1.00 0.00 H new ATOM 0 HG12 ILE C 34 2.063 3.333 -2.261 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.719 4.701 -3.300 1.00 0.00 H new ATOM 0 HG21 ILE C 34 5.052 3.188 -2.475 1.00 0.00 H new ATOM 0 HG22 ILE C 34 5.495 4.432 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.200 3.268 -0.915 1.00 0.00 H new ATOM 0 HD11 ILE C 34 2.208 2.681 -4.645 1.00 0.00 H new ATOM 0 HD12 ILE C 34 3.451 3.926 -4.917 1.00 0.00 H new ATOM 0 HD13 ILE C 34 3.800 2.536 -3.862 1.00 0.00 H new ATOM 1743 N ASN C 35 4.700 6.335 0.501 1.00 0.00 N ATOM 1744 CA ASN C 35 5.685 7.180 1.138 1.00 0.00 C ATOM 1745 C ASN C 35 6.794 6.324 1.730 1.00 0.00 C ATOM 1746 O ASN C 35 6.665 5.782 2.824 1.00 0.00 O ATOM 1747 CB ASN C 35 4.975 8.033 2.186 1.00 0.00 C ATOM 1748 CG ASN C 35 5.871 9.119 2.763 1.00 0.00 C ATOM 1749 OD1 ASN C 35 7.088 9.104 2.595 1.00 0.00 O ATOM 1750 ND2 ASN C 35 5.270 10.082 3.456 1.00 0.00 N ATOM 0 H ASN C 35 4.419 5.521 1.048 1.00 0.00 H new ATOM 0 HA ASN C 35 6.158 7.847 0.418 1.00 0.00 H new ATOM 0 HB2 ASN C 35 4.095 8.494 1.738 1.00 0.00 H new ATOM 0 HB3 ASN C 35 4.623 7.391 2.993 1.00 0.00 H new ATOM 0 HD21 ASN C 35 5.822 10.836 3.865 1.00 0.00 H new ATOM 0 HD22 ASN C 35 4.257 10.067 3.578 1.00 0.00 H new ATOM 1757 N ALA C 36 7.886 6.224 0.975 1.00 0.00 N ATOM 1758 CA ALA C 36 9.091 5.522 1.361 1.00 0.00 C ATOM 1759 C ALA C 36 10.272 6.269 0.759 1.00 0.00 C ATOM 1760 O ALA C 36 10.111 6.962 -0.251 1.00 0.00 O ATOM 1761 CB ALA C 36 9.064 4.099 0.811 1.00 0.00 C ATOM 0 H ALA C 36 7.950 6.646 0.049 1.00 0.00 H new ATOM 0 HA ALA C 36 9.170 5.476 2.447 1.00 0.00 H new ATOM 0 HB1 ALA C 36 9.975 3.578 1.106 1.00 0.00 H new ATOM 0 HB2 ALA C 36 8.198 3.571 1.210 1.00 0.00 H new ATOM 0 HB3 ALA C 36 9.000 4.130 -0.277 1.00 0.00 H new ATOM 1767 N PRO C 37 11.458 6.139 1.357 1.00 0.00 N ATOM 1768 CA PRO C 37 12.654 6.741 0.820 1.00 0.00 C ATOM 1769 C PRO C 37 12.936 6.159 -0.559 1.00 0.00 C ATOM 1770 O PRO C 37 12.537 5.036 -0.856 1.00 0.00 O ATOM 1771 CB PRO C 37 13.756 6.401 1.824 1.00 0.00 C ATOM 1772 CG PRO C 37 13.228 5.200 2.608 1.00 0.00 C ATOM 1773 CD PRO C 37 11.721 5.403 2.576 1.00 0.00 C ATOM 0 HA PRO C 37 12.573 7.820 0.690 1.00 0.00 H new ATOM 0 HB2 PRO C 37 14.690 6.160 1.317 1.00 0.00 H new ATOM 0 HB3 PRO C 37 13.960 7.244 2.485 1.00 0.00 H new ATOM 0 HG2 PRO C 37 13.518 4.257 2.144 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.611 5.185 3.628 1.00 0.00 H new ATOM 0 HD2 PRO C 37 11.196 4.448 2.579 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.381 5.957 3.451 1.00 0.00 H new ATOM 1781 N LYS C 38 13.632 6.917 -1.407 1.00 0.00 N ATOM 1782 CA LYS C 38 14.055 6.427 -2.717 1.00 0.00 C ATOM 1783 C LYS C 38 15.027 5.259 -2.551 1.00 0.00 C ATOM 1784 O LYS C 38 15.430 4.613 -3.517 1.00 0.00 O ATOM 1785 CB LYS C 38 14.711 7.563 -3.494 1.00 0.00 C ATOM 1786 CG LYS C 38 13.674 8.432 -4.203 1.00 0.00 C ATOM 1787 CD LYS C 38 12.684 9.183 -3.304 1.00 0.00 C ATOM 1788 CE LYS C 38 13.400 10.207 -2.429 1.00 0.00 C ATOM 1789 NZ LYS C 38 12.443 10.978 -1.609 1.00 0.00 N ATOM 0 H LYS C 38 13.915 7.876 -1.208 1.00 0.00 H new ATOM 0 HA LYS C 38 13.186 6.073 -3.271 1.00 0.00 H new ATOM 0 HB2 LYS C 38 15.298 8.179 -2.813 1.00 0.00 H new ATOM 0 HB3 LYS C 38 15.403 7.150 -4.228 1.00 0.00 H new ATOM 0 HG2 LYS C 38 14.202 9.163 -4.815 1.00 0.00 H new ATOM 0 HG3 LYS C 38 13.105 7.798 -4.883 1.00 0.00 H new ATOM 0 HD2 LYS C 38 11.938 9.685 -3.920 1.00 0.00 H new ATOM 0 HD3 LYS C 38 12.150 8.472 -2.673 1.00 0.00 H new ATOM 0 HE2 LYS C 38 14.111 9.698 -1.779 1.00 0.00 H new ATOM 0 HE3 LYS C 38 13.974 10.888 -3.058 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 12.961 11.666 -1.025 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 11.780 11.482 -2.232 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 11.913 10.330 -0.992 1.00 0.00 H new ATOM 1803 N ASP C 39 15.386 5.010 -1.296 1.00 0.00 N ATOM 1804 CA ASP C 39 16.224 3.906 -0.845 1.00 0.00 C ATOM 1805 C ASP C 39 15.578 2.546 -1.118 1.00 0.00 C ATOM 1806 O ASP C 39 16.236 1.513 -0.984 1.00 0.00 O ATOM 1807 CB ASP C 39 16.425 4.062 0.661 1.00 0.00 C ATOM 1808 CG ASP C 39 17.647 3.291 1.155 1.00 0.00 C ATOM 1809 OD1 ASP C 39 18.763 3.598 0.673 1.00 0.00 O ATOM 1810 OD2 ASP C 39 17.461 2.399 2.013 1.00 0.00 O ATOM 0 H ASP C 39 15.084 5.605 -0.525 1.00 0.00 H new ATOM 0 HA ASP C 39 17.168 3.938 -1.389 1.00 0.00 H new ATOM 0 HB2 ASP C 39 16.539 5.118 0.905 1.00 0.00 H new ATOM 0 HB3 ASP C 39 15.537 3.709 1.184 1.00 0.00 H new ATOM 1815 N VAL C 40 14.299 2.534 -1.502 1.00 0.00 N ATOM 1816 CA VAL C 40 13.566 1.311 -1.812 1.00 0.00 C ATOM 1817 C VAL C 40 12.799 1.521 -3.109 1.00 0.00 C ATOM 1818 O VAL C 40 12.537 2.662 -3.496 1.00 0.00 O ATOM 1819 CB VAL C 40 12.610 0.945 -0.664 1.00 0.00 C ATOM 1820 CG1 VAL C 40 13.350 0.945 0.676 1.00 0.00 C ATOM 1821 CG2 VAL C 40 11.447 1.927 -0.575 1.00 0.00 C ATOM 0 H VAL C 40 13.741 3.382 -1.606 1.00 0.00 H new ATOM 0 HA VAL C 40 14.265 0.483 -1.931 1.00 0.00 H new ATOM 0 HB VAL C 40 12.223 -0.052 -0.876 1.00 0.00 H new ATOM 0 HG11 VAL C 40 12.656 0.684 1.475 1.00 0.00 H new ATOM 0 HG12 VAL C 40 14.159 0.215 0.645 1.00 0.00 H new ATOM 0 HG13 VAL C 40 13.763 1.936 0.864 1.00 0.00 H new ATOM 0 HG21 VAL C 40 10.790 1.640 0.246 1.00 0.00 H new ATOM 0 HG22 VAL C 40 11.832 2.931 -0.398 1.00 0.00 H new ATOM 0 HG23 VAL C 40 10.886 1.913 -1.510 1.00 0.00 H new ATOM 1831 N ALA C 41 12.434 0.433 -3.790 1.00 0.00 N ATOM 1832 CA ALA C 41 11.722 0.547 -5.050 1.00 0.00 C ATOM 1833 C ALA C 41 10.227 0.352 -4.837 1.00 0.00 C ATOM 1834 O ALA C 41 9.825 -0.470 -4.020 1.00 0.00 O ATOM 1835 CB ALA C 41 12.237 -0.515 -6.020 1.00 0.00 C ATOM 0 H ALA C 41 12.620 -0.524 -3.489 1.00 0.00 H new ATOM 0 HA ALA C 41 11.892 1.542 -5.461 1.00 0.00 H new ATOM 0 HB1 ALA C 41 11.704 -0.432 -6.967 1.00 0.00 H new ATOM 0 HB2 ALA C 41 13.303 -0.366 -6.189 1.00 0.00 H new ATOM 0 HB3 ALA C 41 12.071 -1.506 -5.596 1.00 0.00 H new ATOM 1841 N VAL C 42 9.415 1.107 -5.578 1.00 0.00 N ATOM 1842 CA VAL C 42 7.974 0.916 -5.589 1.00 0.00 C ATOM 1843 C VAL C 42 7.451 1.271 -6.975 1.00 0.00 C ATOM 1844 O VAL C 42 7.838 2.284 -7.552 1.00 0.00 O ATOM 1845 CB VAL C 42 7.262 1.751 -4.510 1.00 0.00 C ATOM 1846 CG1 VAL C 42 7.914 1.609 -3.135 1.00 0.00 C ATOM 1847 CG2 VAL C 42 7.228 3.235 -4.853 1.00 0.00 C ATOM 0 H VAL C 42 9.740 1.862 -6.182 1.00 0.00 H new ATOM 0 HA VAL C 42 7.761 -0.128 -5.358 1.00 0.00 H new ATOM 0 HB VAL C 42 6.247 1.355 -4.479 1.00 0.00 H new ATOM 0 HG11 VAL C 42 7.373 2.218 -2.411 1.00 0.00 H new ATOM 0 HG12 VAL C 42 7.884 0.565 -2.824 1.00 0.00 H new ATOM 0 HG13 VAL C 42 8.950 1.943 -3.188 1.00 0.00 H new ATOM 0 HG21 VAL C 42 6.715 3.780 -4.060 1.00 0.00 H new ATOM 0 HG22 VAL C 42 8.247 3.609 -4.950 1.00 0.00 H new ATOM 0 HG23 VAL C 42 6.697 3.379 -5.794 1.00 0.00 H new ATOM 1857 N HIS C 43 6.569 0.428 -7.508 1.00 0.00 N ATOM 1858 CA HIS C 43 5.942 0.659 -8.801 1.00 0.00 C ATOM 1859 C HIS C 43 4.613 -0.082 -8.836 1.00 0.00 C ATOM 1860 O HIS C 43 4.377 -0.945 -7.991 1.00 0.00 O ATOM 1861 CB HIS C 43 6.821 0.115 -9.935 1.00 0.00 C ATOM 1862 CG HIS C 43 8.296 0.384 -9.789 1.00 0.00 C ATOM 1863 ND1 HIS C 43 8.980 1.487 -10.314 1.00 0.00 N ATOM 1864 CD2 HIS C 43 9.178 -0.412 -9.118 1.00 0.00 C ATOM 1865 CE1 HIS C 43 10.258 1.320 -9.941 1.00 0.00 C ATOM 1866 NE2 HIS C 43 10.406 0.192 -9.222 1.00 0.00 N ATOM 0 H HIS C 43 6.271 -0.435 -7.052 1.00 0.00 H new ATOM 0 HA HIS C 43 5.802 1.731 -8.937 1.00 0.00 H new ATOM 0 HB2 HIS C 43 6.670 -0.962 -10.006 1.00 0.00 H new ATOM 0 HB3 HIS C 43 6.481 0.547 -10.876 1.00 0.00 H new ATOM 0 HD1 HIS C 43 8.590 2.253 -10.863 1.00 0.00 H new ATOM 0 HD2 HIS C 43 8.954 -1.336 -8.606 1.00 0.00 H new ATOM 0 HE1 HIS C 43 11.061 2.000 -10.185 1.00 0.00 H new ATOM 1874 N ARG C 44 3.737 0.229 -9.796 1.00 0.00 N ATOM 1875 CA ARG C 44 2.536 -0.573 -9.951 1.00 0.00 C ATOM 1876 C ARG C 44 2.987 -1.950 -10.420 1.00 0.00 C ATOM 1877 O ARG C 44 4.076 -2.088 -10.977 1.00 0.00 O ATOM 1878 CB ARG C 44 1.534 0.093 -10.895 1.00 0.00 C ATOM 1879 CG ARG C 44 2.107 0.291 -12.295 1.00 0.00 C ATOM 1880 CD ARG C 44 1.024 0.906 -13.175 1.00 0.00 C ATOM 1881 NE ARG C 44 1.500 1.126 -14.544 1.00 0.00 N ATOM 1882 CZ ARG C 44 2.325 2.107 -14.907 1.00 0.00 C ATOM 1883 NH1 ARG C 44 2.815 2.959 -14.009 1.00 0.00 N ATOM 1884 NH2 ARG C 44 2.664 2.241 -16.183 1.00 0.00 N ATOM 0 H ARG C 44 3.836 1.003 -10.453 1.00 0.00 H new ATOM 0 HA ARG C 44 1.997 -0.669 -9.008 1.00 0.00 H new ATOM 0 HB2 ARG C 44 0.633 -0.518 -10.956 1.00 0.00 H new ATOM 0 HB3 ARG C 44 1.238 1.059 -10.485 1.00 0.00 H new ATOM 0 HG2 ARG C 44 2.981 0.941 -12.259 1.00 0.00 H new ATOM 0 HG3 ARG C 44 2.436 -0.662 -12.709 1.00 0.00 H new ATOM 0 HD2 ARG C 44 0.153 0.250 -13.193 1.00 0.00 H new ATOM 0 HD3 ARG C 44 0.700 1.854 -12.745 1.00 0.00 H new ATOM 0 HE ARG C 44 1.177 0.484 -15.268 1.00 0.00 H new ATOM 0 HH11 ARG C 44 2.560 2.866 -13.026 1.00 0.00 H new ATOM 0 HH12 ARG C 44 3.446 3.704 -14.304 1.00 0.00 H new ATOM 0 HH21 ARG C 44 2.293 1.595 -16.880 1.00 0.00 H new ATOM 0 HH22 ARG C 44 3.295 2.990 -16.467 1.00 0.00 H new ATOM 1898 N GLU C 45 2.164 -2.975 -10.204 1.00 0.00 N ATOM 1899 CA GLU C 45 2.581 -4.342 -10.482 1.00 0.00 C ATOM 1900 C GLU C 45 2.851 -4.572 -11.972 1.00 0.00 C ATOM 1901 O GLU C 45 3.369 -5.619 -12.351 1.00 0.00 O ATOM 1902 CB GLU C 45 1.547 -5.306 -9.889 1.00 0.00 C ATOM 1903 CG GLU C 45 2.022 -6.750 -10.008 1.00 0.00 C ATOM 1904 CD GLU C 45 1.275 -7.683 -9.062 1.00 0.00 C ATOM 1905 OE1 GLU C 45 1.655 -7.709 -7.872 1.00 0.00 O ATOM 1906 OE2 GLU C 45 0.334 -8.359 -9.534 1.00 0.00 O ATOM 0 H GLU C 45 1.215 -2.884 -9.841 1.00 0.00 H new ATOM 0 HA GLU C 45 3.539 -4.537 -10.000 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.373 -5.061 -8.841 1.00 0.00 H new ATOM 0 HB3 GLU C 45 0.595 -5.188 -10.406 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.886 -7.092 -11.034 1.00 0.00 H new ATOM 0 HG3 GLU C 45 3.090 -6.798 -9.794 1.00 0.00 H new ATOM 1913 N GLU C 46 2.509 -3.602 -12.827 1.00 0.00 N ATOM 1914 CA GLU C 46 2.827 -3.670 -14.244 1.00 0.00 C ATOM 1915 C GLU C 46 4.327 -3.494 -14.470 1.00 0.00 C ATOM 1916 O GLU C 46 4.948 -4.273 -15.191 1.00 0.00 O ATOM 1917 CB GLU C 46 2.077 -2.546 -14.963 1.00 0.00 C ATOM 1918 CG GLU C 46 2.279 -2.627 -16.478 1.00 0.00 C ATOM 1919 CD GLU C 46 1.428 -1.583 -17.200 1.00 0.00 C ATOM 1920 OE1 GLU C 46 1.632 -0.378 -16.931 1.00 0.00 O ATOM 1921 OE2 GLU C 46 0.579 -2.002 -18.020 1.00 0.00 O ATOM 0 H GLU C 46 2.008 -2.757 -12.552 1.00 0.00 H new ATOM 0 HA GLU C 46 2.530 -4.644 -14.632 1.00 0.00 H new ATOM 0 HB2 GLU C 46 1.014 -2.608 -14.731 1.00 0.00 H new ATOM 0 HB3 GLU C 46 2.427 -1.580 -14.598 1.00 0.00 H new ATOM 0 HG2 GLU C 46 3.331 -2.472 -16.717 1.00 0.00 H new ATOM 0 HG3 GLU C 46 2.015 -3.624 -16.831 1.00 0.00 H new ATOM 1928 N ILE C 47 4.916 -2.466 -13.854 1.00 0.00 N ATOM 1929 CA ILE C 47 6.308 -2.120 -14.097 1.00 0.00 C ATOM 1930 C ILE C 47 7.236 -3.059 -13.328 1.00 0.00 C ATOM 1931 O ILE C 47 8.386 -3.257 -13.713 1.00 0.00 O ATOM 1932 CB ILE C 47 6.562 -0.668 -13.671 1.00 0.00 C ATOM 1933 CG1 ILE C 47 5.510 0.302 -14.228 1.00 0.00 C ATOM 1934 CG2 ILE C 47 7.955 -0.220 -14.118 1.00 0.00 C ATOM 1935 CD1 ILE C 47 5.288 0.140 -15.732 1.00 0.00 C ATOM 0 H ILE C 47 4.444 -1.861 -13.182 1.00 0.00 H new ATOM 0 HA ILE C 47 6.515 -2.225 -15.162 1.00 0.00 H new ATOM 0 HB ILE C 47 6.492 -0.643 -12.584 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.566 0.144 -13.707 1.00 0.00 H new ATOM 0 HG13 ILE C 47 5.821 1.326 -14.020 1.00 0.00 H new ATOM 0 HG21 ILE C 47 8.122 0.812 -13.809 1.00 0.00 H new ATOM 0 HG22 ILE C 47 8.708 -0.862 -13.661 1.00 0.00 H new ATOM 0 HG23 ILE C 47 8.029 -0.290 -15.203 1.00 0.00 H new ATOM 0 HD11 ILE C 47 4.534 0.852 -16.067 1.00 0.00 H new ATOM 0 HD12 ILE C 47 6.223 0.326 -16.260 1.00 0.00 H new ATOM 0 HD13 ILE C 47 4.948 -0.874 -15.942 1.00 0.00 H new ATOM 1947 N TYR C 48 6.736 -3.641 -12.237 1.00 0.00 N ATOM 1948 CA TYR C 48 7.520 -4.551 -11.421 1.00 0.00 C ATOM 1949 C TYR C 48 7.955 -5.781 -12.214 1.00 0.00 C ATOM 1950 O TYR C 48 8.997 -6.367 -11.927 1.00 0.00 O ATOM 1951 CB TYR C 48 6.673 -4.950 -10.214 1.00 0.00 C ATOM 1952 CG TYR C 48 7.385 -5.842 -9.221 1.00 0.00 C ATOM 1953 CD1 TYR C 48 8.249 -5.286 -8.272 1.00 0.00 C ATOM 1954 CD2 TYR C 48 7.172 -7.227 -9.255 1.00 0.00 C ATOM 1955 CE1 TYR C 48 8.885 -6.107 -7.330 1.00 0.00 C ATOM 1956 CE2 TYR C 48 7.794 -8.054 -8.313 1.00 0.00 C ATOM 1957 CZ TYR C 48 8.653 -7.498 -7.343 1.00 0.00 C ATOM 1958 OH TYR C 48 9.253 -8.309 -6.426 1.00 0.00 O ATOM 0 H TYR C 48 5.784 -3.493 -11.902 1.00 0.00 H new ATOM 0 HA TYR C 48 8.433 -4.055 -11.093 1.00 0.00 H new ATOM 0 HB2 TYR C 48 6.343 -4.046 -9.702 1.00 0.00 H new ATOM 0 HB3 TYR C 48 5.777 -5.461 -10.567 1.00 0.00 H new ATOM 0 HD1 TYR C 48 8.427 -4.221 -8.265 1.00 0.00 H new ATOM 0 HD2 TYR C 48 6.528 -7.656 -10.008 1.00 0.00 H new ATOM 0 HE1 TYR C 48 9.550 -5.676 -6.597 1.00 0.00 H new ATOM 0 HE2 TYR C 48 7.616 -9.119 -8.329 1.00 0.00 H new ATOM 0 HH TYR C 48 8.980 -9.237 -6.582 1.00 0.00 H new