USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 743 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 Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 74:sc= 0.973 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.274 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= -1.26! USER MOD Single : A 33 ASN :FLIP amide:sc= -0.285 F(o=-0.81,f=-0.28) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot 37:sc= 0.53 USER MOD Single : A 43 THR OG1 : rot 12:sc= 0.739 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0675 USER MOD Single : A 49 GLN : amide:sc= -0.587 K(o=-0.59,f=-2!) USER MOD Single : B 7 SER OG : rot 180:sc= 0.00797 USER MOD Single : B 9 THR OG1 : rot -130:sc= 0.143 USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.218 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 120:sc= 0.56 USER MOD Single : B 33 ASN :FLIP amide:sc= 0.255 F(o=-1.6!,f=0.25) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=-0.0011) USER MOD Single : B 38 THR OG1 : rot 41:sc= 0.159 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.697 USER MOD Single : B 49 GLN : amide:sc= -0.573 X(o=-0.57,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.660 -2.313 1.016 1.00 0.00 N ATOM 17 CA ARG A 3 5.091 -2.501 1.222 1.00 0.00 C ATOM 18 C ARG A 3 5.641 -3.562 0.274 1.00 0.00 C ATOM 19 O ARG A 3 4.976 -4.556 -0.017 1.00 0.00 O ATOM 20 CB ARG A 3 5.370 -2.903 2.672 1.00 0.00 C ATOM 21 CG ARG A 3 6.806 -3.337 2.917 1.00 0.00 C ATOM 22 CD ARG A 3 6.943 -4.852 2.887 1.00 0.00 C ATOM 23 NE ARG A 3 6.132 -5.495 3.917 1.00 0.00 N ATOM 24 CZ ARG A 3 6.453 -5.503 5.206 1.00 0.00 C ATOM 25 NH1 ARG A 3 7.561 -4.906 5.620 1.00 0.00 N ATOM 26 NH2 ARG A 3 5.664 -6.110 6.083 1.00 0.00 N ATOM 0 HA ARG A 3 5.591 -1.556 1.011 1.00 0.00 H new ATOM 0 HB2 ARG A 3 5.137 -2.062 3.325 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.701 -3.717 2.950 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.455 -2.897 2.160 1.00 0.00 H new ATOM 0 HG3 ARG A 3 7.142 -2.959 3.883 1.00 0.00 H new ATOM 0 HD2 ARG A 3 6.645 -5.224 1.907 1.00 0.00 H new ATOM 0 HD3 ARG A 3 7.989 -5.124 3.027 1.00 0.00 H new ATOM 0 HE ARG A 3 5.272 -5.964 3.631 1.00 0.00 H new ATOM 0 HH11 ARG A 3 8.170 -4.439 4.948 1.00 0.00 H new ATOM 0 HH12 ARG A 3 7.805 -4.914 6.610 1.00 0.00 H new ATOM 0 HH21 ARG A 3 4.810 -6.571 5.768 1.00 0.00 H new ATOM 0 HH22 ARG A 3 5.911 -6.116 7.073 1.00 0.00 H new ATOM 40 N VAL A 4 6.861 -3.343 -0.207 1.00 0.00 N ATOM 41 CA VAL A 4 7.502 -4.280 -1.122 1.00 0.00 C ATOM 42 C VAL A 4 8.841 -4.758 -0.571 1.00 0.00 C ATOM 43 O VAL A 4 9.692 -3.952 -0.194 1.00 0.00 O ATOM 44 CB VAL A 4 7.726 -3.646 -2.507 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.386 -4.642 -3.450 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.410 -3.146 -3.083 1.00 0.00 C ATOM 0 H VAL A 4 7.425 -2.525 0.022 1.00 0.00 H new ATOM 0 HA VAL A 4 6.830 -5.132 -1.225 1.00 0.00 H new ATOM 0 HB VAL A 4 8.394 -2.792 -2.393 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.536 -4.176 -4.424 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.349 -4.947 -3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.746 -5.517 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.587 -2.701 -4.062 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.716 -3.981 -3.184 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.982 -2.397 -2.416 1.00 0.00 H new ATOM 56 N ARG A 5 9.021 -6.074 -0.527 1.00 0.00 N ATOM 57 CA ARG A 5 10.256 -6.660 -0.021 1.00 0.00 C ATOM 58 C ARG A 5 10.806 -7.695 -0.997 1.00 0.00 C ATOM 59 O ARG A 5 10.094 -8.610 -1.413 1.00 0.00 O ATOM 60 CB ARG A 5 10.017 -7.306 1.345 1.00 0.00 C ATOM 61 CG ARG A 5 11.208 -8.097 1.861 1.00 0.00 C ATOM 62 CD ARG A 5 10.932 -8.688 3.234 1.00 0.00 C ATOM 63 NE ARG A 5 11.377 -10.075 3.333 1.00 0.00 N ATOM 64 CZ ARG A 5 10.718 -11.098 2.799 1.00 0.00 C ATOM 65 NH1 ARG A 5 9.592 -10.889 2.132 1.00 0.00 N ATOM 66 NH2 ARG A 5 11.186 -12.332 2.932 1.00 0.00 N ATOM 0 H ARG A 5 8.327 -6.755 -0.836 1.00 0.00 H new ATOM 0 HA ARG A 5 10.990 -5.862 0.087 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.768 -6.528 2.067 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.153 -7.968 1.279 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.446 -8.897 1.160 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.082 -7.448 1.912 1.00 0.00 H new ATOM 0 HD2 ARG A 5 11.436 -8.091 3.994 1.00 0.00 H new ATOM 0 HD3 ARG A 5 9.864 -8.634 3.443 1.00 0.00 H new ATOM 0 HE ARG A 5 12.241 -10.269 3.840 1.00 0.00 H new ATOM 0 HH11 ARG A 5 9.229 -9.941 2.028 1.00 0.00 H new ATOM 0 HH12 ARG A 5 9.088 -11.676 1.723 1.00 0.00 H new ATOM 0 HH21 ARG A 5 12.052 -12.496 3.445 1.00 0.00 H new ATOM 0 HH22 ARG A 5 10.679 -13.117 2.522 1.00 0.00 H new ATOM 80 N ILE A 6 12.076 -7.545 -1.358 1.00 0.00 N ATOM 81 CA ILE A 6 12.721 -8.467 -2.285 1.00 0.00 C ATOM 82 C ILE A 6 13.997 -9.047 -1.684 1.00 0.00 C ATOM 83 O ILE A 6 14.851 -8.312 -1.189 1.00 0.00 O ATOM 84 CB ILE A 6 13.062 -7.778 -3.619 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.803 -7.167 -4.239 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.703 -8.770 -4.578 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.062 -6.440 -5.539 1.00 0.00 C ATOM 0 H ILE A 6 12.679 -6.794 -1.023 1.00 0.00 H new ATOM 0 HA ILE A 6 12.012 -9.273 -2.473 1.00 0.00 H new ATOM 0 HB ILE A 6 13.775 -6.976 -3.426 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.073 -7.958 -4.413 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.357 -6.473 -3.527 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.938 -8.268 -5.517 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.619 -9.163 -4.137 1.00 0.00 H new ATOM 0 HG23 ILE A 6 13.011 -9.591 -4.769 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.126 -6.033 -5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.768 -5.627 -5.367 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.479 -7.135 -6.268 1.00 0.00 H new ATOM 99 N SER A 7 14.120 -10.369 -1.734 1.00 0.00 N ATOM 100 CA SER A 7 15.292 -11.048 -1.193 1.00 0.00 C ATOM 101 C SER A 7 16.053 -11.779 -2.295 1.00 0.00 C ATOM 102 O SER A 7 15.455 -12.448 -3.138 1.00 0.00 O ATOM 103 CB SER A 7 14.876 -12.037 -0.102 1.00 0.00 C ATOM 104 OG SER A 7 13.466 -12.096 0.022 1.00 0.00 O ATOM 0 H SER A 7 13.423 -10.991 -2.143 1.00 0.00 H new ATOM 0 HA SER A 7 15.950 -10.295 -0.759 1.00 0.00 H new ATOM 0 HB2 SER A 7 15.265 -13.028 -0.337 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.316 -11.739 0.850 1.00 0.00 H new ATOM 0 HG SER A 7 13.226 -12.736 0.724 1.00 0.00 H new ATOM 110 N ILE A 8 17.375 -11.647 -2.280 1.00 0.00 N ATOM 111 CA ILE A 8 18.218 -12.295 -3.276 1.00 0.00 C ATOM 112 C ILE A 8 19.039 -13.420 -2.654 1.00 0.00 C ATOM 113 O ILE A 8 19.614 -13.262 -1.576 1.00 0.00 O ATOM 114 CB ILE A 8 19.172 -11.289 -3.947 1.00 0.00 C ATOM 115 CG1 ILE A 8 18.382 -10.120 -4.538 1.00 0.00 C ATOM 116 CG2 ILE A 8 19.996 -11.978 -5.025 1.00 0.00 C ATOM 117 CD1 ILE A 8 19.203 -8.862 -4.713 1.00 0.00 C ATOM 0 H ILE A 8 17.885 -11.097 -1.589 1.00 0.00 H new ATOM 0 HA ILE A 8 17.551 -12.710 -4.032 1.00 0.00 H new ATOM 0 HB ILE A 8 19.853 -10.897 -3.192 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.978 -10.418 -5.506 1.00 0.00 H new ATOM 0 HG13 ILE A 8 17.532 -9.902 -3.891 1.00 0.00 H new ATOM 0 HG21 ILE A 8 20.665 -11.254 -5.490 1.00 0.00 H new ATOM 0 HG22 ILE A 8 20.583 -12.780 -4.577 1.00 0.00 H new ATOM 0 HG23 ILE A 8 19.330 -12.395 -5.781 1.00 0.00 H new ATOM 0 HD11 ILE A 8 18.578 -8.076 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 8 19.586 -8.540 -3.745 1.00 0.00 H new ATOM 0 HD13 ILE A 8 20.038 -9.063 -5.384 1.00 0.00 H new ATOM 129 N THR A 9 19.092 -14.557 -3.341 1.00 0.00 N ATOM 130 CA THR A 9 19.843 -15.708 -2.857 1.00 0.00 C ATOM 131 C THR A 9 21.175 -15.842 -3.587 1.00 0.00 C ATOM 132 O THR A 9 21.348 -16.725 -4.426 1.00 0.00 O ATOM 133 CB THR A 9 19.044 -17.013 -3.030 1.00 0.00 C ATOM 134 OG1 THR A 9 17.645 -16.756 -2.866 1.00 0.00 O ATOM 135 CG2 THR A 9 19.493 -18.060 -2.021 1.00 0.00 C ATOM 0 H THR A 9 18.623 -14.705 -4.235 1.00 0.00 H new ATOM 0 HA THR A 9 20.028 -15.541 -1.796 1.00 0.00 H new ATOM 0 HB THR A 9 19.228 -17.395 -4.034 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.304 -16.287 -3.656 1.00 0.00 H new ATOM 0 HG21 THR A 9 18.915 -18.973 -2.162 1.00 0.00 H new ATOM 0 HG22 THR A 9 20.552 -18.275 -2.166 1.00 0.00 H new ATOM 0 HG23 THR A 9 19.335 -17.683 -1.011 1.00 0.00 H new ATOM 143 N ALA A 10 22.114 -14.959 -3.260 1.00 0.00 N ATOM 144 CA ALA A 10 23.432 -14.981 -3.883 1.00 0.00 C ATOM 145 C ALA A 10 24.460 -15.638 -2.968 1.00 0.00 C ATOM 146 O ALA A 10 24.201 -15.861 -1.786 1.00 0.00 O ATOM 147 CB ALA A 10 23.869 -13.569 -4.243 1.00 0.00 C ATOM 0 H ALA A 10 21.986 -14.221 -2.568 1.00 0.00 H new ATOM 0 HA ALA A 10 23.366 -15.573 -4.796 1.00 0.00 H new ATOM 0 HB1 ALA A 10 24.855 -13.600 -4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.153 -13.133 -4.940 1.00 0.00 H new ATOM 0 HB3 ALA A 10 23.913 -12.960 -3.340 1.00 0.00 H new ATOM 153 N ARG A 11 25.628 -15.946 -3.524 1.00 0.00 N ATOM 154 CA ARG A 11 26.695 -16.579 -2.758 1.00 0.00 C ATOM 155 C ARG A 11 27.442 -15.551 -1.913 1.00 0.00 C ATOM 156 O ARG A 11 27.367 -15.568 -0.684 1.00 0.00 O ATOM 157 CB ARG A 11 27.671 -17.291 -3.696 1.00 0.00 C ATOM 158 CG ARG A 11 27.001 -17.937 -4.897 1.00 0.00 C ATOM 159 CD ARG A 11 27.162 -17.087 -6.148 1.00 0.00 C ATOM 160 NE ARG A 11 28.116 -17.670 -7.087 1.00 0.00 N ATOM 161 CZ ARG A 11 28.732 -16.975 -8.036 1.00 0.00 C ATOM 162 NH1 ARG A 11 28.495 -15.677 -8.172 1.00 0.00 N ATOM 163 NH2 ARG A 11 29.588 -17.577 -8.853 1.00 0.00 N ATOM 0 H ARG A 11 25.859 -15.767 -4.501 1.00 0.00 H new ATOM 0 HA ARG A 11 26.243 -17.312 -2.090 1.00 0.00 H new ATOM 0 HB2 ARG A 11 28.413 -16.574 -4.047 1.00 0.00 H new ATOM 0 HB3 ARG A 11 28.208 -18.056 -3.135 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.431 -18.924 -5.068 1.00 0.00 H new ATOM 0 HG3 ARG A 11 25.941 -18.083 -4.689 1.00 0.00 H new ATOM 0 HD2 ARG A 11 26.194 -16.975 -6.637 1.00 0.00 H new ATOM 0 HD3 ARG A 11 27.495 -16.088 -5.867 1.00 0.00 H new ATOM 0 HE ARG A 11 28.321 -18.666 -7.010 1.00 0.00 H new ATOM 0 HH11 ARG A 11 27.838 -15.210 -7.547 1.00 0.00 H new ATOM 0 HH12 ARG A 11 28.970 -15.146 -8.902 1.00 0.00 H new ATOM 0 HH21 ARG A 11 29.773 -18.575 -8.752 1.00 0.00 H new ATOM 0 HH22 ARG A 11 30.060 -17.042 -9.581 1.00 0.00 H new ATOM 177 N THR A 12 28.164 -14.657 -2.581 1.00 0.00 N ATOM 178 CA THR A 12 28.926 -13.623 -1.893 1.00 0.00 C ATOM 179 C THR A 12 28.160 -12.305 -1.859 1.00 0.00 C ATOM 180 O THR A 12 27.193 -12.118 -2.598 1.00 0.00 O ATOM 181 CB THR A 12 30.293 -13.391 -2.565 1.00 0.00 C ATOM 182 OG1 THR A 12 31.014 -12.368 -1.868 1.00 0.00 O ATOM 183 CG2 THR A 12 30.119 -12.992 -4.022 1.00 0.00 C ATOM 0 H THR A 12 28.237 -14.628 -3.598 1.00 0.00 H new ATOM 0 HA THR A 12 29.085 -13.974 -0.873 1.00 0.00 H new ATOM 0 HB THR A 12 30.856 -14.324 -2.525 1.00 0.00 H new ATOM 0 HG1 THR A 12 31.882 -12.228 -2.300 1.00 0.00 H new ATOM 0 HG21 THR A 12 31.098 -12.834 -4.475 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.596 -13.785 -4.556 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.539 -12.071 -4.080 1.00 0.00 H new ATOM 191 N LYS A 13 28.597 -11.394 -0.996 1.00 0.00 N ATOM 192 CA LYS A 13 27.954 -10.092 -0.867 1.00 0.00 C ATOM 193 C LYS A 13 28.129 -9.269 -2.139 1.00 0.00 C ATOM 194 O LYS A 13 27.288 -8.434 -2.472 1.00 0.00 O ATOM 195 CB LYS A 13 28.531 -9.331 0.329 1.00 0.00 C ATOM 196 CG LYS A 13 30.041 -9.173 0.277 1.00 0.00 C ATOM 197 CD LYS A 13 30.642 -9.101 1.671 1.00 0.00 C ATOM 198 CE LYS A 13 32.158 -9.215 1.631 1.00 0.00 C ATOM 199 NZ LYS A 13 32.760 -9.099 2.988 1.00 0.00 N ATOM 0 H LYS A 13 29.394 -11.534 -0.375 1.00 0.00 H new ATOM 0 HA LYS A 13 26.889 -10.256 -0.706 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.072 -8.344 0.377 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.260 -9.853 1.247 1.00 0.00 H new ATOM 0 HG2 LYS A 13 30.477 -10.012 -0.265 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.294 -8.269 -0.277 1.00 0.00 H new ATOM 0 HD2 LYS A 13 30.359 -8.160 2.142 1.00 0.00 H new ATOM 0 HD3 LYS A 13 30.232 -9.901 2.287 1.00 0.00 H new ATOM 0 HE2 LYS A 13 32.439 -10.172 1.190 1.00 0.00 H new ATOM 0 HE3 LYS A 13 32.564 -8.436 0.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 33.794 -9.182 2.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 32.514 -8.176 3.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 32.393 -9.858 3.597 1.00 0.00 H new ATOM 213 N LYS A 14 29.227 -9.510 -2.847 1.00 0.00 N ATOM 214 CA LYS A 14 29.513 -8.794 -4.085 1.00 0.00 C ATOM 215 C LYS A 14 28.401 -9.009 -5.107 1.00 0.00 C ATOM 216 O LYS A 14 27.967 -8.069 -5.771 1.00 0.00 O ATOM 217 CB LYS A 14 30.852 -9.254 -4.667 1.00 0.00 C ATOM 218 CG LYS A 14 31.851 -8.126 -4.858 1.00 0.00 C ATOM 219 CD LYS A 14 32.933 -8.153 -3.791 1.00 0.00 C ATOM 220 CE LYS A 14 32.490 -7.429 -2.529 1.00 0.00 C ATOM 221 NZ LYS A 14 33.498 -6.429 -2.080 1.00 0.00 N ATOM 0 H LYS A 14 29.934 -10.196 -2.584 1.00 0.00 H new ATOM 0 HA LYS A 14 29.570 -7.730 -3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.286 -10.005 -4.008 1.00 0.00 H new ATOM 0 HB3 LYS A 14 30.674 -9.737 -5.628 1.00 0.00 H new ATOM 0 HG2 LYS A 14 32.309 -8.207 -5.844 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.331 -7.169 -4.826 1.00 0.00 H new ATOM 0 HD2 LYS A 14 33.182 -9.186 -3.550 1.00 0.00 H new ATOM 0 HD3 LYS A 14 33.840 -7.689 -4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.539 -6.929 -2.712 1.00 0.00 H new ATOM 0 HE3 LYS A 14 32.320 -8.155 -1.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 33.159 -5.957 -1.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 34.399 -6.909 -1.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.642 -5.721 -2.828 1.00 0.00 H new ATOM 235 N GLU A 15 27.945 -10.252 -5.226 1.00 0.00 N ATOM 236 CA GLU A 15 26.884 -10.589 -6.167 1.00 0.00 C ATOM 237 C GLU A 15 25.575 -9.908 -5.777 1.00 0.00 C ATOM 238 O GLU A 15 24.944 -9.238 -6.594 1.00 0.00 O ATOM 239 CB GLU A 15 26.685 -12.105 -6.225 1.00 0.00 C ATOM 240 CG GLU A 15 27.108 -12.724 -7.547 1.00 0.00 C ATOM 241 CD GLU A 15 26.056 -13.653 -8.119 1.00 0.00 C ATOM 242 OE1 GLU A 15 25.789 -14.702 -7.496 1.00 0.00 O ATOM 243 OE2 GLU A 15 25.499 -13.332 -9.190 1.00 0.00 O ATOM 0 H GLU A 15 28.294 -11.042 -4.683 1.00 0.00 H new ATOM 0 HA GLU A 15 27.181 -10.231 -7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.253 -12.569 -5.418 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.634 -12.332 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 15 27.316 -11.931 -8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 15 28.037 -13.277 -7.404 1.00 0.00 H new ATOM 250 N ALA A 16 25.173 -10.087 -4.523 1.00 0.00 N ATOM 251 CA ALA A 16 23.940 -9.490 -4.023 1.00 0.00 C ATOM 252 C ALA A 16 23.987 -7.969 -4.125 1.00 0.00 C ATOM 253 O ALA A 16 22.987 -7.330 -4.449 1.00 0.00 O ATOM 254 CB ALA A 16 23.692 -9.918 -2.584 1.00 0.00 C ATOM 0 H ALA A 16 25.683 -10.641 -3.835 1.00 0.00 H new ATOM 0 HA ALA A 16 23.116 -9.844 -4.642 1.00 0.00 H new ATOM 0 HB1 ALA A 16 22.768 -9.465 -2.224 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.606 -11.004 -2.537 1.00 0.00 H new ATOM 0 HB3 ALA A 16 24.524 -9.592 -1.959 1.00 0.00 H new ATOM 260 N GLU A 17 25.154 -7.397 -3.844 1.00 0.00 N ATOM 261 CA GLU A 17 25.328 -5.951 -3.903 1.00 0.00 C ATOM 262 C GLU A 17 25.088 -5.431 -5.318 1.00 0.00 C ATOM 263 O GLU A 17 24.475 -4.381 -5.510 1.00 0.00 O ATOM 264 CB GLU A 17 26.734 -5.565 -3.438 1.00 0.00 C ATOM 265 CG GLU A 17 26.868 -5.460 -1.928 1.00 0.00 C ATOM 266 CD GLU A 17 27.150 -4.043 -1.465 1.00 0.00 C ATOM 267 OE1 GLU A 17 28.338 -3.664 -1.405 1.00 0.00 O ATOM 268 OE2 GLU A 17 26.182 -3.315 -1.163 1.00 0.00 O ATOM 0 H GLU A 17 25.992 -7.913 -3.574 1.00 0.00 H new ATOM 0 HA GLU A 17 24.595 -5.495 -3.238 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.445 -6.304 -3.807 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.006 -4.609 -3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 17 25.950 -5.815 -1.460 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.672 -6.115 -1.592 1.00 0.00 H new ATOM 275 N LYS A 18 25.577 -6.173 -6.305 1.00 0.00 N ATOM 276 CA LYS A 18 25.416 -5.790 -7.703 1.00 0.00 C ATOM 277 C LYS A 18 23.940 -5.693 -8.074 1.00 0.00 C ATOM 278 O LYS A 18 23.548 -4.860 -8.892 1.00 0.00 O ATOM 279 CB LYS A 18 26.117 -6.800 -8.614 1.00 0.00 C ATOM 280 CG LYS A 18 27.633 -6.729 -8.549 1.00 0.00 C ATOM 281 CD LYS A 18 28.182 -5.669 -9.489 1.00 0.00 C ATOM 282 CE LYS A 18 29.678 -5.472 -9.294 1.00 0.00 C ATOM 283 NZ LYS A 18 30.412 -5.485 -10.589 1.00 0.00 N ATOM 0 H LYS A 18 26.089 -7.044 -6.163 1.00 0.00 H new ATOM 0 HA LYS A 18 25.872 -4.809 -7.840 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.797 -7.806 -8.341 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.798 -6.632 -9.642 1.00 0.00 H new ATOM 0 HG2 LYS A 18 27.944 -6.508 -7.528 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.055 -7.700 -8.808 1.00 0.00 H new ATOM 0 HD2 LYS A 18 27.983 -5.958 -10.521 1.00 0.00 H new ATOM 0 HD3 LYS A 18 27.664 -4.725 -9.317 1.00 0.00 H new ATOM 0 HE2 LYS A 18 29.856 -4.525 -8.785 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.067 -6.259 -8.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.428 -5.348 -10.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.263 -6.398 -11.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 30.059 -4.718 -11.196 1.00 0.00 H new ATOM 297 N PHE A 19 23.124 -6.549 -7.467 1.00 0.00 N ATOM 298 CA PHE A 19 21.691 -6.559 -7.734 1.00 0.00 C ATOM 299 C PHE A 19 20.980 -5.474 -6.931 1.00 0.00 C ATOM 300 O PHE A 19 20.063 -4.820 -7.426 1.00 0.00 O ATOM 301 CB PHE A 19 21.098 -7.929 -7.398 1.00 0.00 C ATOM 302 CG PHE A 19 21.423 -8.988 -8.413 1.00 0.00 C ATOM 303 CD1 PHE A 19 20.797 -8.998 -9.649 1.00 0.00 C ATOM 304 CD2 PHE A 19 22.354 -9.975 -8.130 1.00 0.00 C ATOM 305 CE1 PHE A 19 21.094 -9.971 -10.585 1.00 0.00 C ATOM 306 CE2 PHE A 19 22.656 -10.949 -9.062 1.00 0.00 C ATOM 307 CZ PHE A 19 22.024 -10.948 -10.291 1.00 0.00 C ATOM 0 H PHE A 19 23.431 -7.244 -6.787 1.00 0.00 H new ATOM 0 HA PHE A 19 21.543 -6.357 -8.795 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.467 -8.246 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.015 -7.837 -7.315 1.00 0.00 H new ATOM 0 HD1 PHE A 19 20.068 -8.236 -9.884 1.00 0.00 H new ATOM 0 HD2 PHE A 19 22.849 -9.983 -7.170 1.00 0.00 H new ATOM 0 HE1 PHE A 19 20.599 -9.967 -11.545 1.00 0.00 H new ATOM 0 HE2 PHE A 19 23.386 -11.711 -8.830 1.00 0.00 H new ATOM 0 HZ PHE A 19 22.257 -11.710 -11.020 1.00 0.00 H new ATOM 317 N ALA A 20 21.410 -5.290 -5.687 1.00 0.00 N ATOM 318 CA ALA A 20 20.817 -4.284 -4.814 1.00 0.00 C ATOM 319 C ALA A 20 20.880 -2.900 -5.451 1.00 0.00 C ATOM 320 O ALA A 20 19.900 -2.155 -5.436 1.00 0.00 O ATOM 321 CB ALA A 20 21.518 -4.278 -3.464 1.00 0.00 C ATOM 0 H ALA A 20 22.167 -5.825 -5.261 1.00 0.00 H new ATOM 0 HA ALA A 20 19.768 -4.540 -4.665 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.065 -3.522 -2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.417 -5.258 -2.997 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.575 -4.050 -3.604 1.00 0.00 H new ATOM 327 N ALA A 21 22.037 -2.562 -6.009 1.00 0.00 N ATOM 328 CA ALA A 21 22.226 -1.267 -6.652 1.00 0.00 C ATOM 329 C ALA A 21 21.120 -0.991 -7.665 1.00 0.00 C ATOM 330 O ALA A 21 20.527 0.088 -7.671 1.00 0.00 O ATOM 331 CB ALA A 21 23.589 -1.207 -7.326 1.00 0.00 C ATOM 0 H ALA A 21 22.858 -3.167 -6.029 1.00 0.00 H new ATOM 0 HA ALA A 21 22.179 -0.496 -5.883 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.717 -0.235 -7.802 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.370 -1.351 -6.580 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.657 -1.992 -8.079 1.00 0.00 H new ATOM 337 N ILE A 22 20.849 -1.971 -8.520 1.00 0.00 N ATOM 338 CA ILE A 22 19.814 -1.832 -9.537 1.00 0.00 C ATOM 339 C ILE A 22 18.430 -1.742 -8.904 1.00 0.00 C ATOM 340 O ILE A 22 17.634 -0.866 -9.246 1.00 0.00 O ATOM 341 CB ILE A 22 19.837 -3.011 -10.528 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.205 -3.109 -11.206 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.736 -2.852 -11.566 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.676 -4.531 -11.415 1.00 0.00 C ATOM 0 H ILE A 22 21.331 -2.870 -8.529 1.00 0.00 H new ATOM 0 HA ILE A 22 20.024 -0.909 -10.077 1.00 0.00 H new ATOM 0 HB ILE A 22 19.659 -3.934 -9.976 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.160 -2.604 -12.171 1.00 0.00 H new ATOM 0 HG13 ILE A 22 21.940 -2.577 -10.602 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.765 -3.693 -12.259 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.767 -2.826 -11.068 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.886 -1.923 -12.116 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.652 -4.523 -11.900 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.754 -5.034 -10.451 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.962 -5.062 -12.045 1.00 0.00 H new ATOM 356 N LEU A 23 18.149 -2.652 -7.978 1.00 0.00 N ATOM 357 CA LEU A 23 16.860 -2.675 -7.294 1.00 0.00 C ATOM 358 C LEU A 23 16.528 -1.304 -6.713 1.00 0.00 C ATOM 359 O LEU A 23 15.383 -0.855 -6.774 1.00 0.00 O ATOM 360 CB LEU A 23 16.870 -3.724 -6.181 1.00 0.00 C ATOM 361 CG LEU A 23 16.008 -4.965 -6.420 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.542 -4.580 -6.543 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.474 -5.705 -7.665 1.00 0.00 C ATOM 0 H LEU A 23 18.796 -3.384 -7.683 1.00 0.00 H new ATOM 0 HA LEU A 23 16.093 -2.936 -8.024 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.899 -4.046 -6.022 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.539 -3.248 -5.258 1.00 0.00 H new ATOM 0 HG LEU A 23 16.117 -5.631 -5.564 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.944 -5.475 -6.713 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.215 -4.094 -5.624 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.415 -3.894 -7.381 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.850 -6.585 -7.820 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.395 -5.047 -8.530 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.512 -6.014 -7.538 1.00 0.00 H new ATOM 375 N ILE A 24 17.536 -0.644 -6.153 1.00 0.00 N ATOM 376 CA ILE A 24 17.350 0.676 -5.565 1.00 0.00 C ATOM 377 C ILE A 24 16.841 1.673 -6.600 1.00 0.00 C ATOM 378 O ILE A 24 15.921 2.447 -6.334 1.00 0.00 O ATOM 379 CB ILE A 24 18.660 1.211 -4.956 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.164 0.265 -3.864 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.453 2.610 -4.398 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.672 0.150 -3.812 1.00 0.00 C ATOM 0 H ILE A 24 18.489 -1.002 -6.094 1.00 0.00 H new ATOM 0 HA ILE A 24 16.608 0.566 -4.774 1.00 0.00 H new ATOM 0 HB ILE A 24 19.414 1.263 -5.742 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.801 0.613 -2.897 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.738 -0.725 -4.027 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.388 2.974 -3.971 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.136 3.278 -5.199 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.687 2.583 -3.623 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.957 -0.537 -3.015 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.041 -0.228 -4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.105 1.131 -3.618 1.00 0.00 H new ATOM 394 N LYS A 25 17.442 1.647 -7.785 1.00 0.00 N ATOM 395 CA LYS A 25 17.048 2.545 -8.864 1.00 0.00 C ATOM 396 C LYS A 25 15.620 2.258 -9.316 1.00 0.00 C ATOM 397 O LYS A 25 14.838 3.178 -9.558 1.00 0.00 O ATOM 398 CB LYS A 25 18.008 2.404 -10.048 1.00 0.00 C ATOM 399 CG LYS A 25 19.463 2.644 -9.684 1.00 0.00 C ATOM 400 CD LYS A 25 19.882 4.075 -9.975 1.00 0.00 C ATOM 401 CE LYS A 25 19.114 5.067 -9.115 1.00 0.00 C ATOM 402 NZ LYS A 25 19.806 6.384 -9.036 1.00 0.00 N ATOM 0 H LYS A 25 18.205 1.013 -8.022 1.00 0.00 H new ATOM 0 HA LYS A 25 17.092 3.567 -8.488 1.00 0.00 H new ATOM 0 HB2 LYS A 25 17.908 1.404 -10.469 1.00 0.00 H new ATOM 0 HB3 LYS A 25 17.716 3.108 -10.827 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.615 2.427 -8.627 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.097 1.957 -10.244 1.00 0.00 H new ATOM 0 HD2 LYS A 25 20.951 4.186 -9.794 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.713 4.298 -11.028 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.114 5.206 -9.526 1.00 0.00 H new ATOM 0 HE3 LYS A 25 18.992 4.660 -8.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.251 7.032 -8.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 20.751 6.255 -8.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.900 6.785 -9.991 1.00 0.00 H new ATOM 416 N VAL A 26 15.285 0.977 -9.427 1.00 0.00 N ATOM 417 CA VAL A 26 13.950 0.569 -9.848 1.00 0.00 C ATOM 418 C VAL A 26 12.901 0.980 -8.821 1.00 0.00 C ATOM 419 O VAL A 26 11.805 1.415 -9.176 1.00 0.00 O ATOM 420 CB VAL A 26 13.871 -0.954 -10.066 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.566 -1.327 -10.753 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.066 -1.439 -10.872 1.00 0.00 C ATOM 0 H VAL A 26 15.920 0.203 -9.231 1.00 0.00 H new ATOM 0 HA VAL A 26 13.747 1.074 -10.792 1.00 0.00 H new ATOM 0 HB VAL A 26 13.895 -1.445 -9.093 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.527 -2.406 -10.899 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.726 -1.014 -10.133 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.508 -0.828 -11.720 1.00 0.00 H new ATOM 0 HG21 VAL A 26 14.994 -2.517 -11.017 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.076 -0.943 -11.842 1.00 0.00 H new ATOM 0 HG23 VAL A 26 15.986 -1.206 -10.336 1.00 0.00 H new ATOM 432 N PHE A 27 13.243 0.839 -7.544 1.00 0.00 N ATOM 433 CA PHE A 27 12.331 1.195 -6.464 1.00 0.00 C ATOM 434 C PHE A 27 12.152 2.708 -6.379 1.00 0.00 C ATOM 435 O PHE A 27 11.041 3.203 -6.197 1.00 0.00 O ATOM 436 CB PHE A 27 12.851 0.656 -5.130 1.00 0.00 C ATOM 437 CG PHE A 27 12.307 -0.699 -4.778 1.00 0.00 C ATOM 438 CD1 PHE A 27 10.940 -0.916 -4.712 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.163 -1.756 -4.513 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.436 -2.162 -4.388 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.665 -3.004 -4.190 1.00 0.00 C ATOM 442 CZ PHE A 27 11.300 -3.207 -4.126 1.00 0.00 C ATOM 0 H PHE A 27 14.146 0.480 -7.232 1.00 0.00 H new ATOM 0 HA PHE A 27 11.362 0.744 -6.677 1.00 0.00 H new ATOM 0 HB2 PHE A 27 13.939 0.603 -5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.593 1.359 -4.338 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.260 -0.102 -4.916 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.231 -1.603 -4.559 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.368 -2.318 -4.340 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.343 -3.820 -3.988 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.909 -4.181 -3.872 1.00 0.00 H new ATOM 452 N ALA A 28 13.256 3.436 -6.512 1.00 0.00 N ATOM 453 CA ALA A 28 13.223 4.892 -6.452 1.00 0.00 C ATOM 454 C ALA A 28 12.360 5.468 -7.570 1.00 0.00 C ATOM 455 O ALA A 28 11.554 6.369 -7.342 1.00 0.00 O ATOM 456 CB ALA A 28 14.634 5.456 -6.527 1.00 0.00 C ATOM 0 H ALA A 28 14.184 3.041 -6.662 1.00 0.00 H new ATOM 0 HA ALA A 28 12.779 5.182 -5.500 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.594 6.544 -6.481 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.222 5.079 -5.690 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.099 5.149 -7.464 1.00 0.00 H new ATOM 462 N GLU A 29 12.537 4.941 -8.778 1.00 0.00 N ATOM 463 CA GLU A 29 11.775 5.406 -9.931 1.00 0.00 C ATOM 464 C GLU A 29 10.303 5.024 -9.801 1.00 0.00 C ATOM 465 O GLU A 29 9.441 5.589 -10.475 1.00 0.00 O ATOM 466 CB GLU A 29 12.353 4.820 -11.221 1.00 0.00 C ATOM 467 CG GLU A 29 11.792 3.452 -11.573 1.00 0.00 C ATOM 468 CD GLU A 29 10.715 3.520 -12.639 1.00 0.00 C ATOM 469 OE1 GLU A 29 10.960 4.142 -13.693 1.00 0.00 O ATOM 470 OE2 GLU A 29 9.626 2.950 -12.417 1.00 0.00 O ATOM 0 H GLU A 29 13.200 4.193 -8.983 1.00 0.00 H new ATOM 0 HA GLU A 29 11.848 6.493 -9.969 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.154 5.507 -12.043 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.436 4.745 -11.123 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.601 2.810 -11.920 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.381 2.990 -10.675 1.00 0.00 H new ATOM 477 N LEU A 30 10.023 4.060 -8.930 1.00 0.00 N ATOM 478 CA LEU A 30 8.656 3.601 -8.710 1.00 0.00 C ATOM 479 C LEU A 30 8.017 4.336 -7.536 1.00 0.00 C ATOM 480 O LEU A 30 6.882 4.052 -7.157 1.00 0.00 O ATOM 481 CB LEU A 30 8.639 2.093 -8.454 1.00 0.00 C ATOM 482 CG LEU A 30 8.527 1.203 -9.692 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.187 -0.144 -9.442 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.069 1.019 -10.087 1.00 0.00 C ATOM 0 H LEU A 30 10.724 3.581 -8.365 1.00 0.00 H new ATOM 0 HA LEU A 30 8.077 3.817 -9.608 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.551 1.825 -7.920 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.803 1.867 -7.792 1.00 0.00 H new ATOM 0 HG LEU A 30 9.047 1.692 -10.516 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.097 -0.764 -10.334 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.241 0.005 -9.208 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.696 -0.640 -8.605 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.009 0.383 -10.970 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.526 0.552 -9.266 1.00 0.00 H new ATOM 0 HD23 LEU A 30 6.627 1.990 -10.309 1.00 0.00 H new ATOM 496 N GLY A 31 8.754 5.284 -6.966 1.00 0.00 N ATOM 497 CA GLY A 31 8.242 6.046 -5.842 1.00 0.00 C ATOM 498 C GLY A 31 8.524 5.378 -4.511 1.00 0.00 C ATOM 499 O GLY A 31 8.042 5.825 -3.470 1.00 0.00 O ATOM 0 H GLY A 31 9.696 5.538 -7.262 1.00 0.00 H new ATOM 0 HA2 GLY A 31 8.689 7.040 -5.848 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.166 6.179 -5.957 1.00 0.00 H new ATOM 503 N TYR A 32 9.304 4.303 -4.545 1.00 0.00 N ATOM 504 CA TYR A 32 9.645 3.569 -3.332 1.00 0.00 C ATOM 505 C TYR A 32 10.978 4.046 -2.763 1.00 0.00 C ATOM 506 O TYR A 32 11.685 3.293 -2.095 1.00 0.00 O ATOM 507 CB TYR A 32 9.709 2.068 -3.621 1.00 0.00 C ATOM 508 CG TYR A 32 8.375 1.467 -4.000 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.775 1.769 -5.217 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.713 0.597 -3.142 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.556 1.222 -5.567 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.494 0.045 -3.485 1.00 0.00 C ATOM 513 CZ TYR A 32 5.919 0.361 -4.698 1.00 0.00 C ATOM 514 OH TYR A 32 4.705 -0.186 -5.044 1.00 0.00 O ATOM 0 H TYR A 32 9.712 3.921 -5.398 1.00 0.00 H new ATOM 0 HA TYR A 32 8.867 3.758 -2.592 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.420 1.892 -4.428 1.00 0.00 H new ATOM 0 HB3 TYR A 32 10.093 1.553 -2.740 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.270 2.443 -5.900 1.00 0.00 H new ATOM 0 HD2 TYR A 32 8.159 0.348 -2.191 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.104 1.467 -6.517 1.00 0.00 H new ATOM 0 HE2 TYR A 32 5.994 -0.630 -2.807 1.00 0.00 H new ATOM 0 HH TYR A 32 4.392 -0.771 -4.323 1.00 0.00 H new ATOM 524 N ASN A 33 11.313 5.303 -3.034 1.00 0.00 N ATOM 525 CA ASN A 33 12.561 5.883 -2.550 1.00 0.00 C ATOM 526 C ASN A 33 12.766 5.574 -1.070 1.00 0.00 C ATOM 527 O ASN A 33 11.819 5.236 -0.359 1.00 0.00 O ATOM 528 CB ASN A 33 12.565 7.396 -2.773 1.00 0.00 C ATOM 529 CG ASN A 33 11.179 8.001 -2.660 1.00 0.00 C ATOM 530 OD1 ASN A 33 10.473 7.667 -1.585 1.00 0.00 O flip ATOM 531 ND2 ASN A 33 10.747 8.759 -3.529 1.00 0.00 N flip ATOM 0 H ASN A 33 10.738 5.940 -3.586 1.00 0.00 H new ATOM 0 HA ASN A 33 13.382 5.438 -3.113 1.00 0.00 H new ATOM 0 HB2 ASN A 33 13.224 7.866 -2.043 1.00 0.00 H new ATOM 0 HB3 ASN A 33 12.974 7.614 -3.759 1.00 0.00 H new ATOM 0 HD21 ASN A 33 11.324 8.988 -4.338 1.00 0.00 H new ATOM 0 HD22 ASN A 33 9.812 9.157 -3.439 1.00 0.00 H new ATOM 538 N ASP A 34 14.007 5.695 -0.612 1.00 0.00 N ATOM 539 CA ASP A 34 14.336 5.431 0.784 1.00 0.00 C ATOM 540 C ASP A 34 14.196 3.946 1.104 1.00 0.00 C ATOM 541 O ASP A 34 13.390 3.557 1.949 1.00 0.00 O ATOM 542 CB ASP A 34 13.434 6.252 1.706 1.00 0.00 C ATOM 543 CG ASP A 34 14.144 6.685 2.974 1.00 0.00 C ATOM 544 OD1 ASP A 34 15.245 6.163 3.246 1.00 0.00 O ATOM 545 OD2 ASP A 34 13.598 7.548 3.693 1.00 0.00 O ATOM 0 H ASP A 34 14.802 5.974 -1.187 1.00 0.00 H new ATOM 0 HA ASP A 34 15.373 5.723 0.949 1.00 0.00 H new ATOM 0 HB2 ASP A 34 13.080 7.134 1.172 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.555 5.663 1.968 1.00 0.00 H new ATOM 550 N ILE A 35 14.986 3.122 0.422 1.00 0.00 N ATOM 551 CA ILE A 35 14.949 1.681 0.635 1.00 0.00 C ATOM 552 C ILE A 35 15.939 1.259 1.716 1.00 0.00 C ATOM 553 O ILE A 35 16.984 1.883 1.892 1.00 0.00 O ATOM 554 CB ILE A 35 15.265 0.913 -0.662 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.083 0.023 -1.054 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.527 0.081 -0.492 1.00 0.00 C ATOM 557 CD1 ILE A 35 13.003 0.755 -1.818 1.00 0.00 C ATOM 0 H ILE A 35 15.658 3.428 -0.282 1.00 0.00 H new ATOM 0 HA ILE A 35 13.937 1.435 0.957 1.00 0.00 H new ATOM 0 HB ILE A 35 15.434 1.634 -1.461 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.448 -0.806 -1.661 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.649 -0.409 -0.152 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.736 -0.456 -1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.365 0.736 -0.255 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.385 -0.634 0.318 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.197 0.063 -2.063 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.610 1.567 -1.205 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.421 1.164 -2.738 1.00 0.00 H new ATOM 569 N ASN A 36 15.602 0.194 2.435 1.00 0.00 N ATOM 570 CA ASN A 36 16.462 -0.313 3.499 1.00 0.00 C ATOM 571 C ASN A 36 16.884 -1.752 3.218 1.00 0.00 C ATOM 572 O ASN A 36 16.043 -2.636 3.056 1.00 0.00 O ATOM 573 CB ASN A 36 15.742 -0.234 4.846 1.00 0.00 C ATOM 574 CG ASN A 36 15.915 1.116 5.516 1.00 0.00 C ATOM 575 OD1 ASN A 36 15.446 2.136 5.011 1.00 0.00 O ATOM 576 ND2 ASN A 36 16.591 1.127 6.659 1.00 0.00 N ATOM 0 H ASN A 36 14.740 -0.335 2.301 1.00 0.00 H new ATOM 0 HA ASN A 36 17.357 0.308 3.536 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.680 -0.430 4.699 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.122 -1.015 5.505 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.739 2.006 7.155 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.962 0.257 7.041 1.00 0.00 H new ATOM 583 N VAL A 37 18.192 -1.980 3.163 1.00 0.00 N ATOM 584 CA VAL A 37 18.726 -3.312 2.904 1.00 0.00 C ATOM 585 C VAL A 37 19.202 -3.973 4.193 1.00 0.00 C ATOM 586 O VAL A 37 19.844 -3.338 5.030 1.00 0.00 O ATOM 587 CB VAL A 37 19.896 -3.262 1.903 1.00 0.00 C ATOM 588 CG1 VAL A 37 21.093 -2.550 2.515 1.00 0.00 C ATOM 589 CG2 VAL A 37 20.273 -4.666 1.455 1.00 0.00 C ATOM 0 H VAL A 37 18.902 -1.259 3.294 1.00 0.00 H new ATOM 0 HA VAL A 37 17.915 -3.901 2.475 1.00 0.00 H new ATOM 0 HB VAL A 37 19.578 -2.698 1.026 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.909 -2.525 1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.813 -1.531 2.782 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.416 -3.084 3.409 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.101 -4.612 0.748 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.573 -5.256 2.321 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.416 -5.137 0.974 1.00 0.00 H new ATOM 599 N THR A 38 18.883 -5.255 4.346 1.00 0.00 N ATOM 600 CA THR A 38 19.276 -6.003 5.533 1.00 0.00 C ATOM 601 C THR A 38 19.817 -7.379 5.161 1.00 0.00 C ATOM 602 O THR A 38 19.081 -8.230 4.660 1.00 0.00 O ATOM 603 CB THR A 38 18.095 -6.174 6.507 1.00 0.00 C ATOM 604 OG1 THR A 38 17.005 -6.826 5.845 1.00 0.00 O ATOM 605 CG2 THR A 38 17.637 -4.827 7.043 1.00 0.00 C ATOM 0 H THR A 38 18.354 -5.796 3.662 1.00 0.00 H new ATOM 0 HA THR A 38 20.061 -5.427 6.024 1.00 0.00 H new ATOM 0 HB THR A 38 18.429 -6.786 7.345 1.00 0.00 H new ATOM 0 HG1 THR A 38 17.354 -7.507 5.232 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.802 -4.973 7.729 1.00 0.00 H new ATOM 0 HG22 THR A 38 18.461 -4.346 7.571 1.00 0.00 H new ATOM 0 HG23 THR A 38 17.319 -4.194 6.214 1.00 0.00 H new ATOM 613 N TRP A 39 21.104 -7.591 5.409 1.00 0.00 N ATOM 614 CA TRP A 39 21.742 -8.866 5.100 1.00 0.00 C ATOM 615 C TRP A 39 21.804 -9.757 6.336 1.00 0.00 C ATOM 616 O TRP A 39 22.158 -9.302 7.424 1.00 0.00 O ATOM 617 CB TRP A 39 23.151 -8.634 4.552 1.00 0.00 C ATOM 618 CG TRP A 39 24.015 -7.814 5.462 1.00 0.00 C ATOM 619 CD1 TRP A 39 24.128 -6.453 5.478 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.887 -8.303 6.487 1.00 0.00 C ATOM 621 NE1 TRP A 39 25.019 -6.067 6.451 1.00 0.00 N ATOM 622 CE2 TRP A 39 25.497 -7.183 7.084 1.00 0.00 C ATOM 623 CE3 TRP A 39 25.211 -9.578 6.959 1.00 0.00 C ATOM 624 CZ2 TRP A 39 26.412 -7.302 8.128 1.00 0.00 C ATOM 625 CZ3 TRP A 39 26.119 -9.694 7.994 1.00 0.00 C ATOM 626 CH2 TRP A 39 26.710 -8.562 8.570 1.00 0.00 C ATOM 0 H TRP A 39 21.727 -6.897 5.823 1.00 0.00 H new ATOM 0 HA TRP A 39 21.143 -9.370 4.342 1.00 0.00 H new ATOM 0 HB2 TRP A 39 23.629 -9.598 4.380 1.00 0.00 H new ATOM 0 HB3 TRP A 39 23.080 -8.136 3.585 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.596 -5.779 4.823 1.00 0.00 H new ATOM 0 HE1 TRP A 39 25.281 -5.105 6.666 1.00 0.00 H new ATOM 0 HE3 TRP A 39 24.760 -10.457 6.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 26.870 -6.431 8.573 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 26.378 -10.675 8.365 1.00 0.00 H new ATOM 0 HH2 TRP A 39 27.415 -8.686 9.379 1.00 0.00 H new ATOM 668 N THR A 43 22.167 -13.930 2.607 1.00 0.00 N ATOM 669 CA THR A 43 21.022 -13.523 1.803 1.00 0.00 C ATOM 670 C THR A 43 20.681 -12.055 2.037 1.00 0.00 C ATOM 671 O THR A 43 20.409 -11.642 3.164 1.00 0.00 O ATOM 672 CB THR A 43 19.782 -14.382 2.115 1.00 0.00 C ATOM 673 OG1 THR A 43 20.162 -15.529 2.884 1.00 0.00 O ATOM 674 CG2 THR A 43 19.097 -14.829 0.833 1.00 0.00 C ATOM 0 HA THR A 43 21.301 -13.667 0.759 1.00 0.00 H new ATOM 0 HB THR A 43 19.082 -13.775 2.689 1.00 0.00 H new ATOM 0 HG1 THR A 43 21.082 -15.418 3.204 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.224 -15.434 1.079 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.783 -13.954 0.264 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.792 -15.420 0.236 1.00 0.00 H new ATOM 682 N VAL A 44 20.696 -11.271 0.964 1.00 0.00 N ATOM 683 CA VAL A 44 20.386 -9.849 1.051 1.00 0.00 C ATOM 684 C VAL A 44 18.907 -9.592 0.790 1.00 0.00 C ATOM 685 O VAL A 44 18.318 -10.163 -0.129 1.00 0.00 O ATOM 686 CB VAL A 44 21.223 -9.029 0.051 1.00 0.00 C ATOM 687 CG1 VAL A 44 20.792 -9.328 -1.376 1.00 0.00 C ATOM 688 CG2 VAL A 44 21.107 -7.543 0.353 1.00 0.00 C ATOM 0 H VAL A 44 20.920 -11.597 0.024 1.00 0.00 H new ATOM 0 HA VAL A 44 20.633 -9.533 2.064 1.00 0.00 H new ATOM 0 HB VAL A 44 22.269 -9.316 0.156 1.00 0.00 H new ATOM 0 HG11 VAL A 44 21.394 -8.740 -2.069 1.00 0.00 H new ATOM 0 HG12 VAL A 44 20.932 -10.389 -1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 44 19.740 -9.070 -1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 44 21.704 -6.979 -0.363 1.00 0.00 H new ATOM 0 HG22 VAL A 44 20.064 -7.237 0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 44 21.470 -7.347 1.362 1.00 0.00 H new ATOM 698 N THR A 45 18.309 -8.727 1.604 1.00 0.00 N ATOM 699 CA THR A 45 16.898 -8.393 1.462 1.00 0.00 C ATOM 700 C THR A 45 16.689 -6.884 1.439 1.00 0.00 C ATOM 701 O THR A 45 17.282 -6.153 2.233 1.00 0.00 O ATOM 702 CB THR A 45 16.059 -8.999 2.603 1.00 0.00 C ATOM 703 OG1 THR A 45 16.307 -10.406 2.699 1.00 0.00 O ATOM 704 CG2 THR A 45 14.576 -8.755 2.374 1.00 0.00 C ATOM 0 H THR A 45 18.781 -8.245 2.369 1.00 0.00 H new ATOM 0 HA THR A 45 16.568 -8.817 0.514 1.00 0.00 H new ATOM 0 HB THR A 45 16.350 -8.514 3.535 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.771 -10.784 3.428 1.00 0.00 H new ATOM 0 HG21 THR A 45 14.005 -9.192 3.193 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.386 -7.683 2.331 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.273 -9.215 1.434 1.00 0.00 H new ATOM 712 N VAL A 46 15.840 -6.421 0.526 1.00 0.00 N ATOM 713 CA VAL A 46 15.551 -4.998 0.402 1.00 0.00 C ATOM 714 C VAL A 46 14.115 -4.691 0.810 1.00 0.00 C ATOM 715 O VAL A 46 13.184 -5.393 0.415 1.00 0.00 O ATOM 716 CB VAL A 46 15.782 -4.502 -1.038 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.717 -5.057 -1.971 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.801 -2.981 -1.080 1.00 0.00 C ATOM 0 H VAL A 46 15.340 -7.012 -0.139 1.00 0.00 H new ATOM 0 HA VAL A 46 16.235 -4.477 1.072 1.00 0.00 H new ATOM 0 HB VAL A 46 16.752 -4.864 -1.378 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.896 -4.696 -2.984 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.757 -6.146 -1.962 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.733 -4.727 -1.637 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.965 -2.647 -2.105 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.847 -2.595 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.605 -2.609 -0.444 1.00 0.00 H new ATOM 728 N GLU A 47 13.942 -3.637 1.602 1.00 0.00 N ATOM 729 CA GLU A 47 12.618 -3.238 2.063 1.00 0.00 C ATOM 730 C GLU A 47 12.311 -1.799 1.658 1.00 0.00 C ATOM 731 O GLU A 47 13.053 -0.877 1.993 1.00 0.00 O ATOM 732 CB GLU A 47 12.517 -3.384 3.583 1.00 0.00 C ATOM 733 CG GLU A 47 12.283 -4.813 4.043 1.00 0.00 C ATOM 734 CD GLU A 47 12.300 -4.949 5.553 1.00 0.00 C ATOM 735 OE1 GLU A 47 12.126 -3.924 6.244 1.00 0.00 O ATOM 736 OE2 GLU A 47 12.486 -6.082 6.044 1.00 0.00 O ATOM 0 H GLU A 47 14.702 -3.045 1.937 1.00 0.00 H new ATOM 0 HA GLU A 47 11.885 -3.894 1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.435 -3.011 4.037 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.703 -2.756 3.947 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.323 -5.161 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 47 13.050 -5.459 3.615 1.00 0.00 H new ATOM 743 N GLY A 48 11.212 -1.616 0.932 1.00 0.00 N ATOM 744 CA GLY A 48 10.827 -0.288 0.491 1.00 0.00 C ATOM 745 C GLY A 48 9.387 0.041 0.833 1.00 0.00 C ATOM 746 O GLY A 48 8.605 -0.847 1.169 1.00 0.00 O ATOM 0 H GLY A 48 10.582 -2.364 0.642 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.484 0.449 0.952 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.968 -0.211 -0.587 1.00 0.00 H new ATOM 750 N GLN A 49 9.038 1.321 0.749 1.00 0.00 N ATOM 751 CA GLN A 49 7.683 1.764 1.054 1.00 0.00 C ATOM 752 C GLN A 49 7.206 2.795 0.037 1.00 0.00 C ATOM 753 O GLN A 49 7.998 3.582 -0.485 1.00 0.00 O ATOM 754 CB GLN A 49 7.623 2.355 2.464 1.00 0.00 C ATOM 755 CG GLN A 49 8.466 3.608 2.634 1.00 0.00 C ATOM 756 CD GLN A 49 9.876 3.304 3.103 1.00 0.00 C ATOM 757 OE1 GLN A 49 10.112 2.315 3.797 1.00 0.00 O ATOM 758 NE2 GLN A 49 10.822 4.155 2.724 1.00 0.00 N ATOM 0 H GLN A 49 9.674 2.069 0.473 1.00 0.00 H new ATOM 0 HA GLN A 49 7.024 0.898 1.002 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.587 2.589 2.707 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.957 1.603 3.179 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.510 4.143 1.685 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.983 4.271 3.352 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.581 4.962 2.149 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.790 4.002 3.008 1.00 0.00 H new ATOM 767 N LEU A 50 5.907 2.786 -0.242 1.00 0.00 N ATOM 768 CA LEU A 50 5.323 3.721 -1.198 1.00 0.00 C ATOM 769 C LEU A 50 4.312 4.637 -0.516 1.00 0.00 C ATOM 770 O LEU A 50 3.518 4.193 0.312 1.00 0.00 O ATOM 771 CB LEU A 50 4.648 2.959 -2.340 1.00 0.00 C ATOM 772 CG LEU A 50 4.876 3.516 -3.745 1.00 0.00 C ATOM 773 CD1 LEU A 50 3.933 2.856 -4.740 1.00 0.00 C ATOM 774 CD2 LEU A 50 4.693 5.027 -3.756 1.00 0.00 C ATOM 0 H LEU A 50 5.238 2.142 0.180 1.00 0.00 H new ATOM 0 HA LEU A 50 6.126 4.335 -1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.998 1.927 -2.319 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.575 2.935 -2.150 1.00 0.00 H new ATOM 0 HG LEU A 50 5.900 3.292 -4.042 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.110 3.265 -5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.112 1.781 -4.753 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.901 3.049 -4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.859 5.406 -4.764 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.680 5.273 -3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.409 5.485 -3.073 1.00 0.00 H new ATOM 910 N ARG B 3 24.232 -19.907 -9.227 1.00 0.00 N ATOM 911 CA ARG B 3 22.815 -19.727 -9.521 1.00 0.00 C ATOM 912 C ARG B 3 22.237 -18.563 -8.721 1.00 0.00 C ATOM 913 O ARG B 3 22.409 -18.486 -7.504 1.00 0.00 O ATOM 914 CB ARG B 3 22.041 -21.009 -9.209 1.00 0.00 C ATOM 915 CG ARG B 3 20.532 -20.843 -9.286 1.00 0.00 C ATOM 916 CD ARG B 3 19.940 -20.490 -7.930 1.00 0.00 C ATOM 917 NE ARG B 3 19.444 -21.670 -7.226 1.00 0.00 N ATOM 918 CZ ARG B 3 19.089 -21.666 -5.946 1.00 0.00 C ATOM 919 NH1 ARG B 3 19.174 -20.551 -5.234 1.00 0.00 N ATOM 920 NH2 ARG B 3 18.648 -22.780 -5.376 1.00 0.00 N ATOM 0 HA ARG B 3 22.716 -19.500 -10.582 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.348 -21.788 -9.907 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.310 -21.352 -8.210 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.287 -20.062 -10.006 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.082 -21.766 -9.652 1.00 0.00 H new ATOM 0 HD2 ARG B 3 20.697 -19.996 -7.321 1.00 0.00 H new ATOM 0 HD3 ARG B 3 19.125 -19.779 -8.064 1.00 0.00 H new ATOM 0 HE ARG B 3 19.366 -22.544 -7.745 1.00 0.00 H new ATOM 0 HH11 ARG B 3 19.513 -19.693 -5.669 1.00 0.00 H new ATOM 0 HH12 ARG B 3 18.901 -20.551 -4.251 1.00 0.00 H new ATOM 0 HH21 ARG B 3 18.582 -23.640 -5.921 1.00 0.00 H new ATOM 0 HH22 ARG B 3 18.376 -22.777 -4.393 1.00 0.00 H new ATOM 934 N VAL B 4 21.552 -17.659 -9.413 1.00 0.00 N ATOM 935 CA VAL B 4 20.948 -16.499 -8.767 1.00 0.00 C ATOM 936 C VAL B 4 19.430 -16.632 -8.707 1.00 0.00 C ATOM 937 O VAL B 4 18.769 -16.783 -9.734 1.00 0.00 O ATOM 938 CB VAL B 4 21.309 -15.195 -9.503 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.729 -13.992 -8.775 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.818 -15.065 -9.645 1.00 0.00 C ATOM 0 H VAL B 4 21.401 -17.707 -10.421 1.00 0.00 H new ATOM 0 HA VAL B 4 21.347 -16.458 -7.753 1.00 0.00 H new ATOM 0 HB VAL B 4 20.874 -15.229 -10.502 1.00 0.00 H new ATOM 0 HG11 VAL B 4 20.995 -13.080 -9.310 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.644 -14.083 -8.729 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.132 -13.950 -7.763 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.056 -14.138 -10.167 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.277 -15.052 -8.656 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.204 -15.911 -10.213 1.00 0.00 H new ATOM 950 N ARG B 5 18.884 -16.574 -7.497 1.00 0.00 N ATOM 951 CA ARG B 5 17.444 -16.688 -7.302 1.00 0.00 C ATOM 952 C ARG B 5 16.923 -15.558 -6.419 1.00 0.00 C ATOM 953 O ARG B 5 17.355 -15.400 -5.277 1.00 0.00 O ATOM 954 CB ARG B 5 17.098 -18.040 -6.675 1.00 0.00 C ATOM 955 CG ARG B 5 15.616 -18.219 -6.392 1.00 0.00 C ATOM 956 CD ARG B 5 15.376 -18.740 -4.984 1.00 0.00 C ATOM 957 NE ARG B 5 14.360 -19.788 -4.953 1.00 0.00 N ATOM 958 CZ ARG B 5 14.564 -21.023 -5.399 1.00 0.00 C ATOM 959 NH1 ARG B 5 15.741 -21.362 -5.906 1.00 0.00 N ATOM 960 NH2 ARG B 5 13.590 -21.922 -5.338 1.00 0.00 N ATOM 0 H ARG B 5 19.417 -16.449 -6.637 1.00 0.00 H new ATOM 0 HA ARG B 5 16.964 -16.614 -8.278 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.431 -18.836 -7.342 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.653 -18.152 -5.744 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.102 -17.266 -6.521 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.188 -18.913 -7.116 1.00 0.00 H new ATOM 0 HD2 ARG B 5 16.310 -19.129 -4.577 1.00 0.00 H new ATOM 0 HD3 ARG B 5 15.067 -17.916 -4.341 1.00 0.00 H new ATOM 0 HE ARG B 5 13.443 -19.560 -4.568 1.00 0.00 H new ATOM 0 HH11 ARG B 5 16.493 -20.674 -5.954 1.00 0.00 H new ATOM 0 HH12 ARG B 5 15.895 -22.311 -6.248 1.00 0.00 H new ATOM 0 HH21 ARG B 5 12.683 -21.666 -4.948 1.00 0.00 H new ATOM 0 HH22 ARG B 5 13.748 -22.870 -5.681 1.00 0.00 H new ATOM 974 N ILE B 6 15.994 -14.774 -6.957 1.00 0.00 N ATOM 975 CA ILE B 6 15.415 -13.660 -6.218 1.00 0.00 C ATOM 976 C ILE B 6 13.918 -13.859 -6.007 1.00 0.00 C ATOM 977 O ILE B 6 13.168 -14.068 -6.961 1.00 0.00 O ATOM 978 CB ILE B 6 15.646 -12.322 -6.944 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.122 -12.167 -7.317 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.189 -11.160 -6.074 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.430 -10.877 -8.044 1.00 0.00 C ATOM 0 H ILE B 6 15.627 -14.890 -7.902 1.00 0.00 H new ATOM 0 HA ILE B 6 15.915 -13.630 -5.250 1.00 0.00 H new ATOM 0 HB ILE B 6 15.056 -12.317 -7.861 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.725 -12.216 -6.410 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.420 -13.008 -7.944 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.359 -10.222 -6.602 1.00 0.00 H new ATOM 0 HG22 ILE B 6 14.127 -11.266 -5.855 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.754 -11.160 -5.142 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.494 -10.836 -8.277 1.00 0.00 H new ATOM 0 HD12 ILE B 6 16.854 -10.834 -8.969 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.164 -10.030 -7.411 1.00 0.00 H new ATOM 993 N SER B 7 13.488 -13.791 -4.751 1.00 0.00 N ATOM 994 CA SER B 7 12.080 -13.966 -4.414 1.00 0.00 C ATOM 995 C SER B 7 11.463 -12.647 -3.958 1.00 0.00 C ATOM 996 O SER B 7 11.963 -12.000 -3.037 1.00 0.00 O ATOM 997 CB SER B 7 11.924 -15.021 -3.317 1.00 0.00 C ATOM 998 OG SER B 7 13.173 -15.327 -2.722 1.00 0.00 O ATOM 0 H SER B 7 14.095 -13.616 -3.950 1.00 0.00 H new ATOM 0 HA SER B 7 11.556 -14.302 -5.309 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.234 -14.659 -2.555 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.487 -15.926 -3.738 1.00 0.00 H new ATOM 0 HG SER B 7 13.046 -16.002 -2.023 1.00 0.00 H new ATOM 1004 N ILE B 8 10.374 -12.255 -4.611 1.00 0.00 N ATOM 1005 CA ILE B 8 9.687 -11.014 -4.273 1.00 0.00 C ATOM 1006 C ILE B 8 8.309 -11.292 -3.682 1.00 0.00 C ATOM 1007 O ILE B 8 7.558 -12.124 -4.192 1.00 0.00 O ATOM 1008 CB ILE B 8 9.531 -10.104 -5.505 1.00 0.00 C ATOM 1009 CG1 ILE B 8 8.557 -10.727 -6.507 1.00 0.00 C ATOM 1010 CG2 ILE B 8 10.884 -9.857 -6.157 1.00 0.00 C ATOM 1011 CD1 ILE B 8 8.536 -10.025 -7.847 1.00 0.00 C ATOM 0 H ILE B 8 9.949 -12.778 -5.376 1.00 0.00 H new ATOM 0 HA ILE B 8 10.302 -10.505 -3.531 1.00 0.00 H new ATOM 0 HB ILE B 8 9.126 -9.146 -5.181 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.824 -11.773 -6.658 1.00 0.00 H new ATOM 0 HG13 ILE B 8 7.553 -10.712 -6.083 1.00 0.00 H new ATOM 0 HG21 ILE B 8 10.757 -9.212 -7.026 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.550 -9.374 -5.442 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.316 -10.807 -6.471 1.00 0.00 H new ATOM 0 HD11 ILE B 8 7.824 -10.521 -8.506 1.00 0.00 H new ATOM 0 HD12 ILE B 8 8.240 -8.985 -7.708 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.530 -10.063 -8.293 1.00 0.00 H new ATOM 1023 N THR B 9 7.981 -10.588 -2.603 1.00 0.00 N ATOM 1024 CA THR B 9 6.693 -10.757 -1.942 1.00 0.00 C ATOM 1025 C THR B 9 5.841 -9.500 -2.067 1.00 0.00 C ATOM 1026 O THR B 9 5.987 -8.560 -1.286 1.00 0.00 O ATOM 1027 CB THR B 9 6.868 -11.099 -0.450 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.134 -11.734 -0.238 1.00 0.00 O ATOM 1029 CG2 THR B 9 5.750 -12.012 0.030 1.00 0.00 C ATOM 0 H THR B 9 8.590 -9.895 -2.168 1.00 0.00 H new ATOM 0 HA THR B 9 6.189 -11.585 -2.440 1.00 0.00 H new ATOM 0 HB THR B 9 6.828 -10.171 0.120 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.005 -12.555 0.282 1.00 0.00 H new ATOM 0 HG21 THR B 9 5.895 -12.240 1.086 1.00 0.00 H new ATOM 0 HG22 THR B 9 4.790 -11.514 -0.106 1.00 0.00 H new ATOM 0 HG23 THR B 9 5.763 -12.937 -0.546 1.00 0.00 H new ATOM 1037 N ALA B 10 4.951 -9.489 -3.054 1.00 0.00 N ATOM 1038 CA ALA B 10 4.074 -8.347 -3.279 1.00 0.00 C ATOM 1039 C ALA B 10 2.672 -8.618 -2.745 1.00 0.00 C ATOM 1040 O ALA B 10 2.341 -9.750 -2.389 1.00 0.00 O ATOM 1041 CB ALA B 10 4.019 -8.008 -4.762 1.00 0.00 C ATOM 0 H ALA B 10 4.819 -10.258 -3.710 1.00 0.00 H new ATOM 0 HA ALA B 10 4.483 -7.494 -2.737 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.360 -7.153 -4.916 1.00 0.00 H new ATOM 0 HB2 ALA B 10 5.020 -7.763 -5.117 1.00 0.00 H new ATOM 0 HB3 ALA B 10 3.637 -8.865 -5.317 1.00 0.00 H new ATOM 1047 N ARG B 11 1.852 -7.574 -2.691 1.00 0.00 N ATOM 1048 CA ARG B 11 0.486 -7.700 -2.198 1.00 0.00 C ATOM 1049 C ARG B 11 -0.381 -8.471 -3.189 1.00 0.00 C ATOM 1050 O ARG B 11 -1.189 -9.315 -2.799 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.117 -6.317 -1.944 1.00 0.00 C ATOM 1052 CG ARG B 11 -0.120 -5.420 -3.171 1.00 0.00 C ATOM 1053 CD ARG B 11 -0.618 -4.022 -2.838 1.00 0.00 C ATOM 1054 NE ARG B 11 -0.756 -3.191 -4.031 1.00 0.00 N ATOM 1055 CZ ARG B 11 -0.970 -1.881 -3.994 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -1.068 -1.255 -2.829 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -1.084 -1.193 -5.123 1.00 0.00 N ATOM 0 H ARG B 11 2.110 -6.631 -2.983 1.00 0.00 H new ATOM 0 HA ARG B 11 0.515 -8.254 -1.260 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -1.141 -6.436 -1.589 1.00 0.00 H new ATOM 0 HB3 ARG B 11 0.442 -5.827 -1.147 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.888 -5.360 -3.582 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.753 -5.859 -3.942 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -1.581 -4.091 -2.331 1.00 0.00 H new ATOM 0 HD3 ARG B 11 0.074 -3.547 -2.143 1.00 0.00 H new ATOM 0 HE ARG B 11 -0.684 -3.642 -4.943 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -0.979 -1.780 -1.959 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -1.232 -0.249 -2.803 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -1.007 -1.670 -6.021 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -1.248 -0.187 -5.093 1.00 0.00 H new ATOM 1071 N THR B 12 -0.209 -8.174 -4.473 1.00 0.00 N ATOM 1072 CA THR B 12 -0.977 -8.837 -5.520 1.00 0.00 C ATOM 1073 C THR B 12 -0.065 -9.346 -6.631 1.00 0.00 C ATOM 1074 O THR B 12 1.068 -8.888 -6.778 1.00 0.00 O ATOM 1075 CB THR B 12 -2.030 -7.893 -6.128 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.656 -8.517 -7.255 1.00 0.00 O ATOM 1077 CG2 THR B 12 -1.396 -6.579 -6.558 1.00 0.00 C ATOM 0 H THR B 12 0.455 -7.479 -4.813 1.00 0.00 H new ATOM 0 HA THR B 12 -1.484 -9.682 -5.054 1.00 0.00 H new ATOM 0 HB THR B 12 -2.780 -7.684 -5.365 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.326 -7.910 -7.635 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.160 -5.929 -6.984 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.946 -6.092 -5.693 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.627 -6.774 -7.305 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.567 -10.296 -7.413 1.00 0.00 N ATOM 1086 CA LYS B 13 0.201 -10.867 -8.513 1.00 0.00 C ATOM 1087 C LYS B 13 0.581 -9.792 -9.527 1.00 0.00 C ATOM 1088 O LYS B 13 1.692 -9.789 -10.057 1.00 0.00 O ATOM 1089 CB LYS B 13 -0.602 -11.972 -9.203 1.00 0.00 C ATOM 1090 CG LYS B 13 -1.958 -11.513 -9.710 1.00 0.00 C ATOM 1091 CD LYS B 13 -2.917 -12.681 -9.873 1.00 0.00 C ATOM 1092 CE LYS B 13 -4.339 -12.289 -9.503 1.00 0.00 C ATOM 1093 NZ LYS B 13 -5.316 -13.360 -9.844 1.00 0.00 N ATOM 0 H LYS B 13 -1.503 -10.687 -7.305 1.00 0.00 H new ATOM 0 HA LYS B 13 1.116 -11.293 -8.101 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -0.023 -12.361 -10.041 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.745 -12.796 -8.504 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.381 -10.788 -9.015 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.837 -11.004 -10.666 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.892 -13.033 -10.904 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -2.592 -13.511 -9.245 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -4.391 -12.077 -8.435 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -4.610 -11.371 -10.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -6.273 -13.055 -9.576 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -5.285 -13.545 -10.867 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -5.073 -14.229 -9.327 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.348 -8.879 -9.791 1.00 0.00 N ATOM 1108 CA LYS B 14 -0.111 -7.797 -10.738 1.00 0.00 C ATOM 1109 C LYS B 14 1.099 -6.967 -10.324 1.00 0.00 C ATOM 1110 O LYS B 14 1.881 -6.529 -11.168 1.00 0.00 O ATOM 1111 CB LYS B 14 -1.347 -6.900 -10.840 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.612 -7.649 -11.222 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.778 -7.731 -12.730 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.182 -9.014 -13.288 1.00 0.00 C ATOM 1115 NZ LYS B 14 -1.577 -8.806 -14.633 1.00 0.00 N ATOM 0 H LYS B 14 -1.273 -8.868 -9.361 1.00 0.00 H new ATOM 0 HA LYS B 14 0.090 -8.240 -11.713 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.504 -6.402 -9.883 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -1.160 -6.120 -11.578 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.581 -8.655 -10.803 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -3.477 -7.149 -10.787 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -3.837 -7.680 -12.984 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -2.297 -6.872 -13.197 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.422 -9.390 -12.602 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -2.958 -9.777 -13.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -1.182 -9.704 -14.979 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -2.307 -8.472 -15.294 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -0.819 -8.097 -14.567 1.00 0.00 H new ATOM 1129 N GLU B 15 1.248 -6.755 -9.020 1.00 0.00 N ATOM 1130 CA GLU B 15 2.364 -5.978 -8.495 1.00 0.00 C ATOM 1131 C GLU B 15 3.687 -6.704 -8.721 1.00 0.00 C ATOM 1132 O GLU B 15 4.634 -6.137 -9.265 1.00 0.00 O ATOM 1133 CB GLU B 15 2.168 -5.705 -7.002 1.00 0.00 C ATOM 1134 CG GLU B 15 1.380 -4.438 -6.713 1.00 0.00 C ATOM 1135 CD GLU B 15 2.262 -3.298 -6.241 1.00 0.00 C ATOM 1136 OE1 GLU B 15 2.739 -3.354 -5.089 1.00 0.00 O ATOM 1137 OE2 GLU B 15 2.474 -2.349 -7.025 1.00 0.00 O ATOM 0 H GLU B 15 0.610 -7.111 -8.308 1.00 0.00 H new ATOM 0 HA GLU B 15 2.394 -5.028 -9.029 1.00 0.00 H new ATOM 0 HB2 GLU B 15 1.654 -6.553 -6.551 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.145 -5.633 -6.523 1.00 0.00 H new ATOM 0 HG2 GLU B 15 0.848 -4.132 -7.614 1.00 0.00 H new ATOM 0 HG3 GLU B 15 0.627 -4.648 -5.954 1.00 0.00 H new ATOM 1144 N ALA B 16 3.744 -7.963 -8.298 1.00 0.00 N ATOM 1145 CA ALA B 16 4.948 -8.768 -8.455 1.00 0.00 C ATOM 1146 C ALA B 16 5.332 -8.901 -9.925 1.00 0.00 C ATOM 1147 O ALA B 16 6.511 -8.848 -10.274 1.00 0.00 O ATOM 1148 CB ALA B 16 4.750 -10.143 -7.833 1.00 0.00 C ATOM 0 H ALA B 16 2.969 -8.447 -7.844 1.00 0.00 H new ATOM 0 HA ALA B 16 5.763 -8.262 -7.938 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.658 -10.733 -7.958 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.532 -10.034 -6.771 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.918 -10.648 -8.324 1.00 0.00 H new ATOM 1154 N GLU B 17 4.330 -9.076 -10.780 1.00 0.00 N ATOM 1155 CA GLU B 17 4.565 -9.218 -12.212 1.00 0.00 C ATOM 1156 C GLU B 17 5.304 -8.003 -12.766 1.00 0.00 C ATOM 1157 O GLU B 17 6.192 -8.133 -13.608 1.00 0.00 O ATOM 1158 CB GLU B 17 3.239 -9.403 -12.953 1.00 0.00 C ATOM 1159 CG GLU B 17 2.803 -10.854 -13.069 1.00 0.00 C ATOM 1160 CD GLU B 17 2.741 -11.331 -14.507 1.00 0.00 C ATOM 1161 OE1 GLU B 17 2.006 -10.714 -15.306 1.00 0.00 O ATOM 1162 OE2 GLU B 17 3.428 -12.322 -14.833 1.00 0.00 O ATOM 0 H GLU B 17 3.348 -9.123 -10.506 1.00 0.00 H new ATOM 0 HA GLU B 17 5.186 -10.101 -12.366 1.00 0.00 H new ATOM 0 HB2 GLU B 17 2.462 -8.839 -12.436 1.00 0.00 H new ATOM 0 HB3 GLU B 17 3.329 -8.979 -13.953 1.00 0.00 H new ATOM 0 HG2 GLU B 17 3.496 -11.483 -12.511 1.00 0.00 H new ATOM 0 HG3 GLU B 17 1.822 -10.973 -12.608 1.00 0.00 H new ATOM 1169 N LYS B 18 4.930 -6.822 -12.286 1.00 0.00 N ATOM 1170 CA LYS B 18 5.556 -5.582 -12.731 1.00 0.00 C ATOM 1171 C LYS B 18 7.041 -5.566 -12.380 1.00 0.00 C ATOM 1172 O LYS B 18 7.854 -4.990 -13.103 1.00 0.00 O ATOM 1173 CB LYS B 18 4.859 -4.377 -12.095 1.00 0.00 C ATOM 1174 CG LYS B 18 3.363 -4.334 -12.355 1.00 0.00 C ATOM 1175 CD LYS B 18 3.005 -3.274 -13.383 1.00 0.00 C ATOM 1176 CE LYS B 18 1.501 -3.179 -13.586 1.00 0.00 C ATOM 1177 NZ LYS B 18 1.059 -1.775 -13.809 1.00 0.00 N ATOM 0 H LYS B 18 4.196 -6.697 -11.589 1.00 0.00 H new ATOM 0 HA LYS B 18 5.455 -5.522 -13.815 1.00 0.00 H new ATOM 0 HB2 LYS B 18 5.032 -4.394 -11.019 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.312 -3.462 -12.477 1.00 0.00 H new ATOM 0 HG2 LYS B 18 3.026 -5.310 -12.705 1.00 0.00 H new ATOM 0 HG3 LYS B 18 2.837 -4.130 -11.423 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.391 -2.307 -13.060 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.487 -3.509 -14.332 1.00 0.00 H new ATOM 0 HE2 LYS B 18 1.210 -3.791 -14.440 1.00 0.00 H new ATOM 0 HE3 LYS B 18 0.990 -3.586 -12.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 0.028 -1.753 -13.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 1.313 -1.196 -12.984 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 1.527 -1.394 -14.656 1.00 0.00 H new ATOM 1191 N PHE B 19 7.388 -6.204 -11.267 1.00 0.00 N ATOM 1192 CA PHE B 19 8.775 -6.264 -10.821 1.00 0.00 C ATOM 1193 C PHE B 19 9.560 -7.300 -11.621 1.00 0.00 C ATOM 1194 O PHE B 19 10.715 -7.077 -11.980 1.00 0.00 O ATOM 1195 CB PHE B 19 8.840 -6.599 -9.330 1.00 0.00 C ATOM 1196 CG PHE B 19 8.753 -5.392 -8.440 1.00 0.00 C ATOM 1197 CD1 PHE B 19 7.523 -4.852 -8.100 1.00 0.00 C ATOM 1198 CD2 PHE B 19 9.901 -4.797 -7.943 1.00 0.00 C ATOM 1199 CE1 PHE B 19 7.441 -3.741 -7.282 1.00 0.00 C ATOM 1200 CE2 PHE B 19 9.825 -3.686 -7.124 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.593 -3.158 -6.792 1.00 0.00 C ATOM 0 H PHE B 19 6.728 -6.687 -10.657 1.00 0.00 H new ATOM 0 HA PHE B 19 9.226 -5.285 -10.986 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.027 -7.282 -9.083 1.00 0.00 H new ATOM 0 HB3 PHE B 19 9.772 -7.126 -9.124 1.00 0.00 H new ATOM 0 HD1 PHE B 19 6.618 -5.304 -8.478 1.00 0.00 H new ATOM 0 HD2 PHE B 19 10.867 -5.206 -8.199 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.476 -3.329 -7.026 1.00 0.00 H new ATOM 0 HE2 PHE B 19 10.728 -3.231 -6.744 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.531 -2.291 -6.151 1.00 0.00 H new ATOM 1211 N ALA B 20 8.922 -8.433 -11.896 1.00 0.00 N ATOM 1212 CA ALA B 20 9.559 -9.503 -12.654 1.00 0.00 C ATOM 1213 C ALA B 20 10.063 -8.996 -14.001 1.00 0.00 C ATOM 1214 O ALA B 20 11.179 -9.310 -14.415 1.00 0.00 O ATOM 1215 CB ALA B 20 8.589 -10.658 -12.852 1.00 0.00 C ATOM 0 H ALA B 20 7.965 -8.634 -11.605 1.00 0.00 H new ATOM 0 HA ALA B 20 10.418 -9.858 -12.084 1.00 0.00 H new ATOM 0 HB1 ALA B 20 9.077 -11.450 -13.419 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.281 -11.045 -11.881 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.713 -10.308 -13.398 1.00 0.00 H new ATOM 1221 N ALA B 21 9.233 -8.212 -14.681 1.00 0.00 N ATOM 1222 CA ALA B 21 9.596 -7.661 -15.981 1.00 0.00 C ATOM 1223 C ALA B 21 10.951 -6.964 -15.923 1.00 0.00 C ATOM 1224 O ALA B 21 11.799 -7.162 -16.795 1.00 0.00 O ATOM 1225 CB ALA B 21 8.524 -6.695 -16.463 1.00 0.00 C ATOM 0 H ALA B 21 8.305 -7.944 -14.353 1.00 0.00 H new ATOM 0 HA ALA B 21 9.671 -8.486 -16.689 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.808 -6.291 -17.435 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.574 -7.221 -16.553 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.421 -5.879 -15.747 1.00 0.00 H new ATOM 1231 N ILE B 22 11.148 -6.149 -14.893 1.00 0.00 N ATOM 1232 CA ILE B 22 12.401 -5.423 -14.722 1.00 0.00 C ATOM 1233 C ILE B 22 13.550 -6.376 -14.413 1.00 0.00 C ATOM 1234 O ILE B 22 14.611 -6.310 -15.035 1.00 0.00 O ATOM 1235 CB ILE B 22 12.297 -4.378 -13.596 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.186 -3.372 -13.904 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.628 -3.665 -13.411 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.499 -2.834 -12.669 1.00 0.00 C ATOM 0 H ILE B 22 10.456 -5.974 -14.164 1.00 0.00 H new ATOM 0 HA ILE B 22 12.601 -4.911 -15.663 1.00 0.00 H new ATOM 0 HB ILE B 22 12.049 -4.891 -12.667 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.607 -2.539 -14.468 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.444 -3.848 -14.545 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.539 -2.929 -12.612 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.397 -4.392 -13.151 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.903 -3.162 -14.338 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.723 -2.127 -12.963 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.048 -3.658 -12.115 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.230 -2.329 -12.037 1.00 0.00 H new ATOM 1250 N LEU B 23 13.332 -7.263 -13.448 1.00 0.00 N ATOM 1251 CA LEU B 23 14.350 -8.232 -13.056 1.00 0.00 C ATOM 1252 C LEU B 23 14.852 -9.014 -14.265 1.00 0.00 C ATOM 1253 O LEU B 23 16.045 -9.295 -14.383 1.00 0.00 O ATOM 1254 CB LEU B 23 13.787 -9.196 -12.009 1.00 0.00 C ATOM 1255 CG LEU B 23 14.392 -9.093 -10.608 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.875 -9.427 -10.641 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.169 -7.702 -10.032 1.00 0.00 C ATOM 0 H LEU B 23 12.460 -7.331 -12.923 1.00 0.00 H new ATOM 0 HA LEU B 23 15.190 -7.686 -12.626 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.712 -9.030 -11.932 1.00 0.00 H new ATOM 0 HB3 LEU B 23 13.927 -10.215 -12.370 1.00 0.00 H new ATOM 0 HG LEU B 23 13.892 -9.816 -9.963 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.288 -9.348 -9.635 1.00 0.00 H new ATOM 0 HD12 LEU B 23 16.011 -10.443 -11.011 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.391 -8.729 -11.301 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.606 -7.647 -9.035 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.642 -6.961 -10.677 1.00 0.00 H new ATOM 0 HD23 LEU B 23 13.100 -7.501 -9.971 1.00 0.00 H new ATOM 1269 N ILE B 24 13.935 -9.360 -15.162 1.00 0.00 N ATOM 1270 CA ILE B 24 14.285 -10.106 -16.364 1.00 0.00 C ATOM 1271 C ILE B 24 15.270 -9.325 -17.228 1.00 0.00 C ATOM 1272 O ILE B 24 16.233 -9.885 -17.752 1.00 0.00 O ATOM 1273 CB ILE B 24 13.038 -10.441 -17.203 1.00 0.00 C ATOM 1274 CG1 ILE B 24 12.068 -11.303 -16.392 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.439 -11.151 -18.488 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.613 -11.015 -16.688 1.00 0.00 C ATOM 0 H ILE B 24 12.944 -9.135 -15.079 1.00 0.00 H new ATOM 0 HA ILE B 24 14.751 -11.035 -16.034 1.00 0.00 H new ATOM 0 HB ILE B 24 12.535 -9.511 -17.467 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.271 -12.354 -16.596 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.253 -11.143 -15.330 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.547 -11.381 -19.070 1.00 0.00 H new ATOM 0 HG22 ILE B 24 14.096 -10.505 -19.071 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.962 -12.076 -18.245 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.983 -11.662 -16.078 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.394 -9.973 -16.457 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.412 -11.203 -17.743 1.00 0.00 H new ATOM 1288 N LYS B 25 15.024 -8.028 -17.371 1.00 0.00 N ATOM 1289 CA LYS B 25 15.890 -7.167 -18.168 1.00 0.00 C ATOM 1290 C LYS B 25 17.271 -7.046 -17.532 1.00 0.00 C ATOM 1291 O LYS B 25 18.289 -7.091 -18.223 1.00 0.00 O ATOM 1292 CB LYS B 25 15.264 -5.779 -18.320 1.00 0.00 C ATOM 1293 CG LYS B 25 13.866 -5.804 -18.914 1.00 0.00 C ATOM 1294 CD LYS B 25 13.894 -5.557 -20.414 1.00 0.00 C ATOM 1295 CE LYS B 25 14.638 -6.663 -21.147 1.00 0.00 C ATOM 1296 NZ LYS B 25 14.450 -6.575 -22.621 1.00 0.00 N ATOM 0 H LYS B 25 14.231 -7.549 -16.945 1.00 0.00 H new ATOM 0 HA LYS B 25 16.001 -7.619 -19.154 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.226 -5.298 -17.343 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.907 -5.167 -18.952 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.401 -6.769 -18.712 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.250 -5.045 -18.431 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.874 -5.491 -20.792 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.372 -4.599 -20.617 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.701 -6.603 -20.912 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.288 -7.633 -20.793 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.972 -7.346 -23.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 13.438 -6.657 -22.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.808 -5.660 -22.963 1.00 0.00 H new ATOM 1310 N VAL B 26 17.299 -6.894 -16.212 1.00 0.00 N ATOM 1311 CA VAL B 26 18.556 -6.770 -15.483 1.00 0.00 C ATOM 1312 C VAL B 26 19.379 -8.049 -15.585 1.00 0.00 C ATOM 1313 O VAL B 26 20.598 -8.003 -15.752 1.00 0.00 O ATOM 1314 CB VAL B 26 18.313 -6.447 -13.997 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.618 -6.072 -13.311 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.287 -5.332 -13.855 1.00 0.00 C ATOM 0 H VAL B 26 16.466 -6.854 -15.625 1.00 0.00 H new ATOM 0 HA VAL B 26 19.108 -5.949 -15.941 1.00 0.00 H new ATOM 0 HB VAL B 26 17.917 -7.338 -13.510 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.426 -5.847 -12.262 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.318 -6.904 -13.382 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.046 -5.195 -13.797 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.127 -5.117 -12.798 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.652 -4.436 -14.357 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.346 -5.644 -14.308 1.00 0.00 H new ATOM 1326 N PHE B 27 18.705 -9.190 -15.486 1.00 0.00 N ATOM 1327 CA PHE B 27 19.375 -10.483 -15.567 1.00 0.00 C ATOM 1328 C PHE B 27 19.898 -10.737 -16.978 1.00 0.00 C ATOM 1329 O PHE B 27 21.009 -11.234 -17.159 1.00 0.00 O ATOM 1330 CB PHE B 27 18.417 -11.603 -15.156 1.00 0.00 C ATOM 1331 CG PHE B 27 18.489 -11.949 -13.696 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.692 -12.321 -13.118 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.355 -11.901 -12.902 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.761 -12.640 -11.775 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.418 -12.218 -11.558 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.623 -12.587 -10.994 1.00 0.00 C ATOM 0 H PHE B 27 17.696 -9.246 -15.350 1.00 0.00 H new ATOM 0 HA PHE B 27 20.223 -10.469 -14.882 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.397 -11.306 -15.401 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.639 -12.494 -15.744 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.585 -12.362 -13.723 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.410 -11.612 -13.338 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.704 -12.931 -11.336 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.526 -12.177 -10.950 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.676 -12.834 -9.944 1.00 0.00 H new ATOM 1346 N ALA B 28 19.088 -10.392 -17.973 1.00 0.00 N ATOM 1347 CA ALA B 28 19.468 -10.581 -19.368 1.00 0.00 C ATOM 1348 C ALA B 28 20.715 -9.773 -19.711 1.00 0.00 C ATOM 1349 O ALA B 28 21.632 -10.275 -20.359 1.00 0.00 O ATOM 1350 CB ALA B 28 18.318 -10.196 -20.286 1.00 0.00 C ATOM 0 H ALA B 28 18.164 -9.980 -17.839 1.00 0.00 H new ATOM 0 HA ALA B 28 19.698 -11.636 -19.516 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.616 -10.342 -21.324 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.452 -10.820 -20.066 1.00 0.00 H new ATOM 0 HB3 ALA B 28 18.060 -9.149 -20.127 1.00 0.00 H new ATOM 1356 N GLU B 29 20.740 -8.518 -19.272 1.00 0.00 N ATOM 1357 CA GLU B 29 21.875 -7.640 -19.536 1.00 0.00 C ATOM 1358 C GLU B 29 23.107 -8.097 -18.760 1.00 0.00 C ATOM 1359 O GLU B 29 24.234 -7.721 -19.086 1.00 0.00 O ATOM 1360 CB GLU B 29 21.529 -6.197 -19.162 1.00 0.00 C ATOM 1361 CG GLU B 29 21.331 -5.986 -17.670 1.00 0.00 C ATOM 1362 CD GLU B 29 21.342 -4.520 -17.283 1.00 0.00 C ATOM 1363 OE1 GLU B 29 20.587 -3.738 -17.898 1.00 0.00 O ATOM 1364 OE2 GLU B 29 22.105 -4.154 -16.364 1.00 0.00 O ATOM 0 H GLU B 29 19.989 -8.087 -18.733 1.00 0.00 H new ATOM 0 HA GLU B 29 22.099 -7.688 -20.602 1.00 0.00 H new ATOM 0 HB2 GLU B 29 22.325 -5.539 -19.511 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.620 -5.903 -19.686 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.384 -6.431 -17.366 1.00 0.00 H new ATOM 0 HG3 GLU B 29 22.118 -6.508 -17.125 1.00 0.00 H new ATOM 1371 N LEU B 30 22.885 -8.909 -17.733 1.00 0.00 N ATOM 1372 CA LEU B 30 23.977 -9.417 -16.909 1.00 0.00 C ATOM 1373 C LEU B 30 24.466 -10.767 -17.426 1.00 0.00 C ATOM 1374 O LEU B 30 25.358 -11.380 -16.842 1.00 0.00 O ATOM 1375 CB LEU B 30 23.525 -9.549 -15.454 1.00 0.00 C ATOM 1376 CG LEU B 30 23.463 -8.249 -14.650 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.982 -8.520 -13.233 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.823 -7.567 -14.633 1.00 0.00 C ATOM 0 H LEU B 30 21.959 -9.230 -17.450 1.00 0.00 H new ATOM 0 HA LEU B 30 24.802 -8.707 -16.964 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.536 -10.008 -15.442 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.201 -10.236 -14.945 1.00 0.00 H new ATOM 0 HG LEU B 30 22.750 -7.580 -15.132 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.944 -7.584 -12.676 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.987 -8.963 -13.265 1.00 0.00 H new ATOM 0 HD13 LEU B 30 23.670 -9.207 -12.741 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.760 -6.644 -14.057 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.557 -8.231 -14.176 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.128 -7.337 -15.654 1.00 0.00 H new ATOM 1390 N GLY B 31 23.876 -11.222 -18.527 1.00 0.00 N ATOM 1391 CA GLY B 31 24.266 -12.495 -19.105 1.00 0.00 C ATOM 1392 C GLY B 31 23.500 -13.660 -18.511 1.00 0.00 C ATOM 1393 O GLY B 31 23.810 -14.820 -18.786 1.00 0.00 O ATOM 0 H GLY B 31 23.135 -10.732 -19.029 1.00 0.00 H new ATOM 0 HA2 GLY B 31 24.101 -12.467 -20.182 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.334 -12.649 -18.950 1.00 0.00 H new ATOM 1397 N TYR B 32 22.498 -13.353 -17.695 1.00 0.00 N ATOM 1398 CA TYR B 32 21.689 -14.385 -17.057 1.00 0.00 C ATOM 1399 C TYR B 32 20.431 -14.671 -17.872 1.00 0.00 C ATOM 1400 O TYR B 32 19.393 -15.037 -17.324 1.00 0.00 O ATOM 1401 CB TYR B 32 21.305 -13.957 -15.640 1.00 0.00 C ATOM 1402 CG TYR B 32 22.479 -13.884 -14.690 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.444 -12.892 -14.823 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.625 -14.806 -13.662 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.519 -12.822 -13.958 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.696 -14.742 -12.792 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.640 -13.749 -12.944 1.00 0.00 C ATOM 1408 OH TYR B 32 25.710 -13.682 -12.080 1.00 0.00 O ATOM 0 H TYR B 32 22.226 -12.398 -17.460 1.00 0.00 H new ATOM 0 HA TYR B 32 22.283 -15.298 -17.006 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.822 -12.981 -15.683 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.571 -14.659 -15.244 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.352 -12.164 -15.616 1.00 0.00 H new ATOM 0 HD2 TYR B 32 21.889 -15.587 -13.541 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.261 -12.046 -14.075 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.793 -15.466 -11.997 1.00 0.00 H new ATOM 0 HH TYR B 32 25.384 -13.561 -11.164 1.00 0.00 H new ATOM 1418 N ASN B 33 20.535 -14.503 -19.187 1.00 0.00 N ATOM 1419 CA ASN B 33 19.407 -14.744 -20.079 1.00 0.00 C ATOM 1420 C ASN B 33 18.786 -16.112 -19.815 1.00 0.00 C ATOM 1421 O ASN B 33 19.411 -16.981 -19.207 1.00 0.00 O ATOM 1422 CB ASN B 33 19.855 -14.647 -21.539 1.00 0.00 C ATOM 1423 CG ASN B 33 21.232 -15.241 -21.761 1.00 0.00 C ATOM 1424 OD1 ASN B 33 22.266 -14.447 -21.507 1.00 0.00 O flip ATOM 1425 ND2 ASN B 33 21.365 -16.399 -22.156 1.00 0.00 N flip ATOM 0 H ASN B 33 21.388 -14.201 -19.658 1.00 0.00 H new ATOM 0 HA ASN B 33 18.654 -13.980 -19.886 1.00 0.00 H new ATOM 0 HB2 ASN B 33 19.133 -15.162 -22.173 1.00 0.00 H new ATOM 0 HB3 ASN B 33 19.859 -13.601 -21.846 1.00 0.00 H new ATOM 0 HD21 ASN B 33 20.542 -16.973 -22.339 1.00 0.00 H new ATOM 0 HD22 ASN B 33 22.298 -16.784 -22.301 1.00 0.00 H new ATOM 1432 N ASP B 34 17.554 -16.296 -20.277 1.00 0.00 N ATOM 1433 CA ASP B 34 16.849 -17.559 -20.093 1.00 0.00 C ATOM 1434 C ASP B 34 16.471 -17.762 -18.629 1.00 0.00 C ATOM 1435 O ASP B 34 16.805 -18.783 -18.027 1.00 0.00 O ATOM 1436 CB ASP B 34 17.714 -18.726 -20.575 1.00 0.00 C ATOM 1437 CG ASP B 34 16.890 -19.846 -21.178 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.264 -19.621 -22.235 1.00 0.00 O ATOM 1439 OD2 ASP B 34 16.872 -20.949 -20.593 1.00 0.00 O ATOM 0 H ASP B 34 17.023 -15.586 -20.782 1.00 0.00 H new ATOM 0 HA ASP B 34 15.934 -17.525 -20.685 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.427 -18.364 -21.316 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.293 -19.115 -19.738 1.00 0.00 H new ATOM 1444 N ILE B 35 15.773 -16.783 -18.063 1.00 0.00 N ATOM 1445 CA ILE B 35 15.349 -16.855 -16.670 1.00 0.00 C ATOM 1446 C ILE B 35 14.055 -17.648 -16.529 1.00 0.00 C ATOM 1447 O ILE B 35 13.217 -17.652 -17.430 1.00 0.00 O ATOM 1448 CB ILE B 35 15.146 -15.450 -16.071 1.00 0.00 C ATOM 1449 CG1 ILE B 35 16.053 -15.255 -14.854 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.688 -15.244 -15.689 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.451 -14.799 -15.211 1.00 0.00 C ATOM 0 H ILE B 35 15.489 -15.931 -18.547 1.00 0.00 H new ATOM 0 HA ILE B 35 16.144 -17.363 -16.124 1.00 0.00 H new ATOM 0 HB ILE B 35 15.414 -14.708 -16.823 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.600 -14.522 -14.186 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.115 -16.193 -14.303 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.560 -14.247 -15.267 1.00 0.00 H new ATOM 0 HG22 ILE B 35 13.062 -15.346 -16.575 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.396 -15.991 -14.950 1.00 0.00 H new ATOM 0 HD11 ILE B 35 18.039 -14.681 -14.301 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.923 -15.542 -15.854 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.400 -13.845 -15.736 1.00 0.00 H new ATOM 1463 N ASN B 36 13.898 -18.317 -15.391 1.00 0.00 N ATOM 1464 CA ASN B 36 12.704 -19.113 -15.131 1.00 0.00 C ATOM 1465 C ASN B 36 12.019 -18.662 -13.845 1.00 0.00 C ATOM 1466 O ASN B 36 12.644 -18.593 -12.787 1.00 0.00 O ATOM 1467 CB ASN B 36 13.066 -20.597 -15.036 1.00 0.00 C ATOM 1468 CG ASN B 36 12.965 -21.303 -16.374 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.689 -20.979 -17.316 1.00 0.00 O ATOM 1470 ND2 ASN B 36 12.063 -22.274 -16.464 1.00 0.00 N ATOM 0 H ASN B 36 14.582 -18.324 -14.635 1.00 0.00 H new ATOM 0 HA ASN B 36 12.012 -18.967 -15.961 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.081 -20.697 -14.651 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.404 -21.085 -14.320 1.00 0.00 H new ATOM 0 HD21 ASN B 36 11.949 -22.785 -17.340 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.484 -22.509 -15.658 1.00 0.00 H new ATOM 1477 N VAL B 37 10.729 -18.356 -13.943 1.00 0.00 N ATOM 1478 CA VAL B 37 9.958 -17.913 -12.788 1.00 0.00 C ATOM 1479 C VAL B 37 9.120 -19.052 -12.218 1.00 0.00 C ATOM 1480 O VAL B 37 8.475 -19.795 -12.958 1.00 0.00 O ATOM 1481 CB VAL B 37 9.030 -16.738 -13.150 1.00 0.00 C ATOM 1482 CG1 VAL B 37 7.953 -17.189 -14.125 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.409 -16.145 -11.894 1.00 0.00 C ATOM 0 H VAL B 37 10.196 -18.407 -14.811 1.00 0.00 H new ATOM 0 HA VAL B 37 10.675 -17.582 -12.036 1.00 0.00 H new ATOM 0 HB VAL B 37 9.624 -15.964 -13.635 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.307 -16.346 -14.369 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.420 -17.564 -15.036 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.359 -17.981 -13.670 1.00 0.00 H new ATOM 0 HG21 VAL B 37 7.756 -15.316 -12.167 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.828 -16.910 -11.379 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.198 -15.783 -11.234 1.00 0.00 H new ATOM 1493 N THR B 38 9.132 -19.184 -10.895 1.00 0.00 N ATOM 1494 CA THR B 38 8.373 -20.232 -10.224 1.00 0.00 C ATOM 1495 C THR B 38 7.535 -19.662 -9.086 1.00 0.00 C ATOM 1496 O THR B 38 8.070 -19.119 -8.119 1.00 0.00 O ATOM 1497 CB THR B 38 9.302 -21.326 -9.664 1.00 0.00 C ATOM 1498 OG1 THR B 38 10.390 -20.728 -8.951 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.844 -22.202 -10.784 1.00 0.00 C ATOM 0 H THR B 38 9.659 -18.578 -10.267 1.00 0.00 H new ATOM 0 HA THR B 38 7.713 -20.672 -10.971 1.00 0.00 H new ATOM 0 HB THR B 38 8.722 -21.950 -8.984 1.00 0.00 H new ATOM 0 HG1 THR B 38 10.059 -19.970 -8.425 1.00 0.00 H new ATOM 0 HG21 THR B 38 10.497 -22.967 -10.364 1.00 0.00 H new ATOM 0 HG22 THR B 38 9.015 -22.680 -11.306 1.00 0.00 H new ATOM 0 HG23 THR B 38 10.409 -21.588 -11.485 1.00 0.00 H new ATOM 1576 N VAL B 44 6.150 -15.125 -5.815 1.00 0.00 N ATOM 1577 CA VAL B 44 6.873 -15.348 -7.061 1.00 0.00 C ATOM 1578 C VAL B 44 8.379 -15.252 -6.846 1.00 0.00 C ATOM 1579 O VAL B 44 8.870 -14.315 -6.216 1.00 0.00 O ATOM 1580 CB VAL B 44 6.454 -14.335 -8.142 1.00 0.00 C ATOM 1581 CG1 VAL B 44 6.528 -12.915 -7.601 1.00 0.00 C ATOM 1582 CG2 VAL B 44 7.323 -14.488 -9.381 1.00 0.00 C ATOM 0 HA VAL B 44 6.620 -16.353 -7.399 1.00 0.00 H new ATOM 0 HB VAL B 44 5.421 -14.537 -8.424 1.00 0.00 H new ATOM 0 HG11 VAL B 44 6.228 -12.213 -8.379 1.00 0.00 H new ATOM 0 HG12 VAL B 44 5.859 -12.816 -6.746 1.00 0.00 H new ATOM 0 HG13 VAL B 44 7.550 -12.697 -7.290 1.00 0.00 H new ATOM 0 HG21 VAL B 44 7.013 -13.764 -10.135 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.366 -14.313 -9.118 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.214 -15.496 -9.780 1.00 0.00 H new ATOM 1592 N THR B 45 9.111 -16.228 -7.376 1.00 0.00 N ATOM 1593 CA THR B 45 10.562 -16.255 -7.243 1.00 0.00 C ATOM 1594 C THR B 45 11.233 -16.490 -8.591 1.00 0.00 C ATOM 1595 O THR B 45 10.940 -17.466 -9.281 1.00 0.00 O ATOM 1596 CB THR B 45 11.015 -17.349 -6.258 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.221 -17.297 -5.068 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.484 -17.180 -5.901 1.00 0.00 C ATOM 0 H THR B 45 8.722 -17.011 -7.902 1.00 0.00 H new ATOM 0 HA THR B 45 10.863 -15.281 -6.856 1.00 0.00 H new ATOM 0 HB THR B 45 10.883 -18.318 -6.740 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.515 -17.997 -4.448 1.00 0.00 H new ATOM 0 HG21 THR B 45 12.782 -17.964 -5.204 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.089 -17.250 -6.805 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.636 -16.205 -5.437 1.00 0.00 H new ATOM 1606 N VAL B 46 12.138 -15.589 -8.962 1.00 0.00 N ATOM 1607 CA VAL B 46 12.853 -15.699 -10.227 1.00 0.00 C ATOM 1608 C VAL B 46 14.134 -16.510 -10.065 1.00 0.00 C ATOM 1609 O VAL B 46 14.860 -16.350 -9.085 1.00 0.00 O ATOM 1610 CB VAL B 46 13.205 -14.312 -10.796 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.293 -13.652 -9.962 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.633 -14.426 -12.252 1.00 0.00 C ATOM 0 H VAL B 46 12.393 -14.775 -8.403 1.00 0.00 H new ATOM 0 HA VAL B 46 12.188 -16.210 -10.923 1.00 0.00 H new ATOM 0 HB VAL B 46 12.315 -13.684 -10.751 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.528 -12.673 -10.380 1.00 0.00 H new ATOM 0 HG12 VAL B 46 13.944 -13.535 -8.936 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.187 -14.275 -9.972 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.878 -13.436 -12.638 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.509 -15.071 -12.324 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.819 -14.853 -12.838 1.00 0.00 H new ATOM 1622 N GLU B 47 14.405 -17.379 -11.034 1.00 0.00 N ATOM 1623 CA GLU B 47 15.599 -18.214 -10.998 1.00 0.00 C ATOM 1624 C GLU B 47 16.375 -18.111 -12.308 1.00 0.00 C ATOM 1625 O GLU B 47 15.810 -18.262 -13.391 1.00 0.00 O ATOM 1626 CB GLU B 47 15.220 -19.673 -10.732 1.00 0.00 C ATOM 1627 CG GLU B 47 15.899 -20.264 -9.508 1.00 0.00 C ATOM 1628 CD GLU B 47 16.446 -21.656 -9.759 1.00 0.00 C ATOM 1629 OE1 GLU B 47 17.438 -21.776 -10.509 1.00 0.00 O ATOM 1630 OE2 GLU B 47 15.883 -22.624 -9.207 1.00 0.00 O ATOM 0 H GLU B 47 13.814 -17.523 -11.853 1.00 0.00 H new ATOM 0 HA GLU B 47 16.236 -17.857 -10.189 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.139 -19.742 -10.607 1.00 0.00 H new ATOM 0 HB3 GLU B 47 15.478 -20.272 -11.605 1.00 0.00 H new ATOM 0 HG2 GLU B 47 16.713 -19.609 -9.197 1.00 0.00 H new ATOM 0 HG3 GLU B 47 15.186 -20.301 -8.684 1.00 0.00 H new ATOM 1637 N GLY B 48 17.675 -17.851 -12.200 1.00 0.00 N ATOM 1638 CA GLY B 48 18.508 -17.731 -13.382 1.00 0.00 C ATOM 1639 C GLY B 48 19.751 -18.595 -13.306 1.00 0.00 C ATOM 1640 O GLY B 48 20.053 -19.167 -12.259 1.00 0.00 O ATOM 0 H GLY B 48 18.165 -17.721 -11.315 1.00 0.00 H new ATOM 0 HA2 GLY B 48 17.928 -18.011 -14.261 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.801 -16.689 -13.512 1.00 0.00 H new ATOM 1644 N GLN B 49 20.473 -18.690 -14.418 1.00 0.00 N ATOM 1645 CA GLN B 49 21.689 -19.492 -14.472 1.00 0.00 C ATOM 1646 C GLN B 49 22.799 -18.751 -15.211 1.00 0.00 C ATOM 1647 O GLN B 49 22.549 -18.072 -16.208 1.00 0.00 O ATOM 1648 CB GLN B 49 21.412 -20.832 -15.156 1.00 0.00 C ATOM 1649 CG GLN B 49 21.015 -20.698 -16.618 1.00 0.00 C ATOM 1650 CD GLN B 49 19.596 -20.196 -16.794 1.00 0.00 C ATOM 1651 OE1 GLN B 49 18.635 -20.879 -16.438 1.00 0.00 O ATOM 1652 NE2 GLN B 49 19.456 -18.996 -17.345 1.00 0.00 N ATOM 0 H GLN B 49 20.237 -18.222 -15.293 1.00 0.00 H new ATOM 0 HA GLN B 49 22.018 -19.675 -13.449 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.302 -21.457 -15.086 1.00 0.00 H new ATOM 0 HB3 GLN B 49 20.617 -21.348 -14.618 1.00 0.00 H new ATOM 0 HG2 GLN B 49 21.703 -20.014 -17.116 1.00 0.00 H new ATOM 0 HG3 GLN B 49 21.117 -21.666 -17.108 1.00 0.00 H new ATOM 0 HE21 GLN B 49 20.280 -18.464 -17.625 1.00 0.00 H new ATOM 0 HE22 GLN B 49 18.524 -18.606 -17.488 1.00 0.00 H new ATOM 1661 N LEU B 50 24.024 -18.884 -14.716 1.00 0.00 N ATOM 1662 CA LEU B 50 25.173 -18.226 -15.329 1.00 0.00 C ATOM 1663 C LEU B 50 26.278 -19.232 -15.632 1.00 0.00 C ATOM 1664 O LEU B 50 26.642 -20.044 -14.782 1.00 0.00 O ATOM 1665 CB LEU B 50 25.706 -17.126 -14.409 1.00 0.00 C ATOM 1666 CG LEU B 50 26.259 -15.881 -15.103 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.522 -16.220 -15.881 1.00 0.00 C ATOM 1668 CD2 LEU B 50 25.211 -15.273 -16.023 1.00 0.00 C ATOM 0 H LEU B 50 24.248 -19.442 -13.892 1.00 0.00 H new ATOM 0 HA LEU B 50 24.847 -17.779 -16.268 1.00 0.00 H new ATOM 0 HB2 LEU B 50 24.902 -16.818 -13.740 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.494 -17.551 -13.786 1.00 0.00 H new ATOM 0 HG LEU B 50 26.513 -15.146 -14.339 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.901 -15.322 -16.368 1.00 0.00 H new ATOM 0 HD12 LEU B 50 28.277 -16.608 -15.198 1.00 0.00 H new ATOM 0 HD13 LEU B 50 27.294 -16.973 -16.635 1.00 0.00 H new ATOM 0 HD21 LEU B 50 25.622 -14.388 -16.508 1.00 0.00 H new ATOM 0 HD22 LEU B 50 24.925 -16.002 -16.781 1.00 0.00 H new ATOM 0 HD23 LEU B 50 24.334 -14.992 -15.440 1.00 0.00 H new