USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 845 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 4 THR OG1 : rot 70:sc= 0.471 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0274 USER MOD Single : A 11 MET CE :methyl -139:sc= 0 (180deg=-0.373) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 172:sc= -0.328 (180deg=-0.592) USER MOD Single : A 26 LYS NZ :NH3+ -146:sc= -0.396 (180deg=-1.77) USER MOD Single : A 28 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=-0.14) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0218 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.711 USER MOD Single : A 42 GLN : amide:sc= -0.0296 K(o=-0.03,f=-1.4) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.659 USER MOD Single : A 51 SER OG : rot 180:sc= 0.0086 USER MOD Single : A 54 SER OG : rot -90:sc= 0.495 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -1.04 K(o=-1,f=-1.7) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot -47:sc= 0.816 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot -42:sc= 0.29 USER MOD Single : A 79 LYS NZ :NH3+ 167:sc= -0.0736 (180deg=-0.341) USER MOD Single : A 87 LYS NZ :NH3+ 160:sc= -0.0242 (180deg=-0.558) USER MOD Single : A 90 HIS : no HE2:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.111 USER MOD Single : A 97 TYR OH : rot -120:sc= -4.06! USER MOD ----------------------------------------------------------------- ATOM 38 N THR A 4 1.285 -8.456 -0.371 1.00 52.24 N ATOM 39 CA THR A 4 1.681 -9.845 -0.175 1.00 52.50 C ATOM 40 C THR A 4 1.243 -10.353 1.194 1.00 51.22 C ATOM 41 O THR A 4 1.951 -11.130 1.834 1.00 31.12 O ATOM 42 CB THR A 4 3.205 -10.019 -0.311 1.00 42.41 C ATOM 43 OG1 THR A 4 3.861 -9.535 0.866 1.00 14.34 O ATOM 44 CG2 THR A 4 3.728 -9.275 -1.531 1.00 0.23 C ATOM 0 HA THR A 4 1.186 -10.428 -0.952 1.00 52.50 H new ATOM 0 HB THR A 4 3.417 -11.081 -0.434 1.00 42.41 H new ATOM 0 HG1 THR A 4 3.665 -10.132 1.618 1.00 14.34 H new ATOM 0 HG21 THR A 4 4.807 -9.413 -1.606 1.00 0.23 H new ATOM 0 HG22 THR A 4 3.249 -9.666 -2.429 1.00 0.23 H new ATOM 0 HG23 THR A 4 3.504 -8.213 -1.433 1.00 0.23 H new ATOM 52 N VAL A 5 0.071 -9.910 1.637 1.00 12.44 N ATOM 53 CA VAL A 5 -0.463 -10.321 2.930 1.00 24.44 C ATOM 54 C VAL A 5 -1.905 -9.860 3.102 1.00 53.41 C ATOM 55 O VAL A 5 -2.219 -8.684 2.908 1.00 21.45 O ATOM 56 CB VAL A 5 0.384 -9.765 4.090 1.00 5.41 C ATOM 57 CG1 VAL A 5 0.410 -8.244 4.051 1.00 63.33 C ATOM 58 CG2 VAL A 5 -0.148 -10.263 5.425 1.00 11.41 C ATOM 0 H VAL A 5 -0.527 -9.266 1.119 1.00 12.44 H new ATOM 0 HA VAL A 5 -0.428 -11.410 2.954 1.00 24.44 H new ATOM 0 HB VAL A 5 1.406 -10.125 3.975 1.00 5.41 H new ATOM 0 HG11 VAL A 5 1.013 -7.869 4.878 1.00 63.33 H new ATOM 0 HG12 VAL A 5 0.842 -7.912 3.107 1.00 63.33 H new ATOM 0 HG13 VAL A 5 -0.606 -7.860 4.140 1.00 63.33 H new ATOM 0 HG21 VAL A 5 0.463 -9.860 6.233 1.00 11.41 H new ATOM 0 HG22 VAL A 5 -1.180 -9.934 5.551 1.00 11.41 H new ATOM 0 HG23 VAL A 5 -0.109 -11.352 5.449 1.00 11.41 H new ATOM 68 N CYS A 6 -2.779 -10.791 3.466 1.00 33.24 N ATOM 69 CA CYS A 6 -4.191 -10.480 3.664 1.00 25.02 C ATOM 70 C CYS A 6 -4.608 -10.742 5.108 1.00 70.25 C ATOM 71 O CYS A 6 -4.648 -11.889 5.556 1.00 54.43 O ATOM 72 CB CYS A 6 -5.055 -11.308 2.712 1.00 0.21 C ATOM 73 SG CYS A 6 -5.795 -10.352 1.367 1.00 31.14 S ATOM 0 H CYS A 6 -2.535 -11.768 3.630 1.00 33.24 H new ATOM 0 HA CYS A 6 -4.339 -9.422 3.449 1.00 25.02 H new ATOM 0 HB2 CYS A 6 -4.445 -12.104 2.285 1.00 0.21 H new ATOM 0 HB3 CYS A 6 -5.850 -11.787 3.283 1.00 0.21 H new ATOM 0 HG CYS A 6 -6.505 -11.139 0.615 1.00 31.14 H new ATOM 79 N THR A 7 -4.917 -9.672 5.833 1.00 42.43 N ATOM 80 CA THR A 7 -5.328 -9.785 7.226 1.00 32.02 C ATOM 81 C THR A 7 -6.824 -10.058 7.337 1.00 22.34 C ATOM 82 O THR A 7 -7.604 -9.654 6.474 1.00 22.25 O ATOM 83 CB THR A 7 -4.991 -8.507 8.017 1.00 32.13 C ATOM 84 OG1 THR A 7 -4.206 -7.624 7.209 1.00 3.53 O ATOM 85 CG2 THR A 7 -4.234 -8.844 9.293 1.00 62.12 C ATOM 0 H THR A 7 -4.890 -8.716 5.478 1.00 42.43 H new ATOM 0 HA THR A 7 -4.776 -10.623 7.652 1.00 32.02 H new ATOM 0 HB THR A 7 -5.926 -8.016 8.288 1.00 32.13 H new ATOM 0 HG1 THR A 7 -3.997 -6.813 7.718 1.00 3.53 H new ATOM 0 HG21 THR A 7 -4.007 -7.926 9.835 1.00 62.12 H new ATOM 0 HG22 THR A 7 -4.847 -9.493 9.919 1.00 62.12 H new ATOM 0 HG23 THR A 7 -3.305 -9.355 9.041 1.00 62.12 H new ATOM 93 N ILE A 8 -7.217 -10.745 8.404 1.00 32.44 N ATOM 94 CA ILE A 8 -8.620 -11.070 8.628 1.00 33.54 C ATOM 95 C ILE A 8 -9.075 -10.619 10.012 1.00 31.11 C ATOM 96 O ILE A 8 -8.351 -9.915 10.715 1.00 15.23 O ATOM 97 CB ILE A 8 -8.878 -12.582 8.483 1.00 11.13 C ATOM 98 CG1 ILE A 8 -7.554 -13.336 8.342 1.00 13.02 C ATOM 99 CG2 ILE A 8 -9.779 -12.853 7.287 1.00 24.35 C ATOM 100 CD1 ILE A 8 -6.933 -13.214 6.969 1.00 42.25 C ATOM 0 H ILE A 8 -6.584 -11.087 9.127 1.00 32.44 H new ATOM 0 HA ILE A 8 -9.192 -10.537 7.868 1.00 33.54 H new ATOM 0 HB ILE A 8 -9.383 -12.938 9.381 1.00 11.13 H new ATOM 0 HG12 ILE A 8 -6.850 -12.960 9.085 1.00 13.02 H new ATOM 0 HG13 ILE A 8 -7.720 -14.390 8.565 1.00 13.02 H new ATOM 0 HG21 ILE A 8 -9.952 -13.925 7.198 1.00 24.35 H new ATOM 0 HG22 ILE A 8 -10.732 -12.342 7.426 1.00 24.35 H new ATOM 0 HG23 ILE A 8 -9.299 -12.486 6.380 1.00 24.35 H new ATOM 0 HD11 ILE A 8 -5.998 -13.773 6.942 1.00 42.25 H new ATOM 0 HD12 ILE A 8 -7.618 -13.616 6.223 1.00 42.25 H new ATOM 0 HD13 ILE A 8 -6.735 -12.165 6.751 1.00 42.25 H new ATOM 112 N ALA A 9 -10.279 -11.031 10.397 1.00 25.31 N ATOM 113 CA ALA A 9 -10.829 -10.673 11.698 1.00 3.34 C ATOM 114 C ALA A 9 -9.792 -10.856 12.802 1.00 74.21 C ATOM 115 O ALA A 9 -9.588 -9.967 13.629 1.00 61.14 O ATOM 116 CB ALA A 9 -12.069 -11.502 11.994 1.00 74.44 C ATOM 0 H ALA A 9 -10.892 -11.613 9.826 1.00 25.31 H new ATOM 0 HA ALA A 9 -11.109 -9.620 11.669 1.00 3.34 H new ATOM 0 HB1 ALA A 9 -12.469 -11.223 12.969 1.00 74.44 H new ATOM 0 HB2 ALA A 9 -12.821 -11.318 11.227 1.00 74.44 H new ATOM 0 HB3 ALA A 9 -11.807 -12.560 11.998 1.00 74.44 H new ATOM 122 N ASP A 10 -9.142 -12.014 12.809 1.00 21.45 N ATOM 123 CA ASP A 10 -8.126 -12.314 13.812 1.00 71.31 C ATOM 124 C ASP A 10 -7.127 -13.338 13.283 1.00 23.52 C ATOM 125 O ASP A 10 -6.966 -14.416 13.856 1.00 44.22 O ATOM 126 CB ASP A 10 -8.781 -12.836 15.092 1.00 4.21 C ATOM 127 CG ASP A 10 -9.862 -11.907 15.609 1.00 22.42 C ATOM 128 OD1 ASP A 10 -10.995 -11.970 15.089 1.00 12.33 O ATOM 129 OD2 ASP A 10 -9.574 -11.118 16.533 1.00 12.33 O ATOM 0 H ASP A 10 -9.300 -12.760 12.132 1.00 21.45 H new ATOM 0 HA ASP A 10 -7.590 -11.392 14.038 1.00 71.31 H new ATOM 0 HB2 ASP A 10 -9.211 -13.819 14.902 1.00 4.21 H new ATOM 0 HB3 ASP A 10 -8.019 -12.965 15.860 1.00 4.21 H new ATOM 134 N MET A 11 -6.459 -12.995 12.187 1.00 41.33 N ATOM 135 CA MET A 11 -5.475 -13.885 11.581 1.00 11.40 C ATOM 136 C MET A 11 -4.680 -13.160 10.499 1.00 32.32 C ATOM 137 O MET A 11 -5.030 -12.051 10.095 1.00 43.14 O ATOM 138 CB MET A 11 -6.165 -15.114 10.987 1.00 54.35 C ATOM 139 CG MET A 11 -5.324 -16.377 11.058 1.00 63.40 C ATOM 140 SD MET A 11 -6.324 -17.872 11.185 1.00 31.03 S ATOM 141 CE MET A 11 -6.802 -18.107 9.475 1.00 4.41 C ATOM 0 H MET A 11 -6.581 -12.107 11.700 1.00 41.33 H new ATOM 0 HA MET A 11 -4.784 -14.207 12.360 1.00 11.40 H new ATOM 0 HB2 MET A 11 -7.104 -15.283 11.513 1.00 54.35 H new ATOM 0 HB3 MET A 11 -6.415 -14.912 9.945 1.00 54.35 H new ATOM 0 HG2 MET A 11 -4.695 -16.440 10.170 1.00 63.40 H new ATOM 0 HG3 MET A 11 -4.657 -16.317 11.918 1.00 63.40 H new ATOM 0 HE1 MET A 11 -7.847 -18.413 9.428 1.00 4.41 H new ATOM 0 HE2 MET A 11 -6.673 -17.172 8.929 1.00 4.41 H new ATOM 0 HE3 MET A 11 -6.177 -18.879 9.025 1.00 4.41 H new ATOM 151 N THR A 12 -3.608 -13.794 10.034 1.00 73.41 N ATOM 152 CA THR A 12 -2.763 -13.210 9.000 1.00 12.04 C ATOM 153 C THR A 12 -2.451 -14.225 7.906 1.00 14.42 C ATOM 154 O THR A 12 -1.607 -15.103 8.083 1.00 74.34 O ATOM 155 CB THR A 12 -1.440 -12.683 9.588 1.00 55.31 C ATOM 156 OG1 THR A 12 -1.709 -11.719 10.613 1.00 72.43 O ATOM 157 CG2 THR A 12 -0.581 -12.051 8.504 1.00 44.23 C ATOM 0 H THR A 12 -3.304 -14.712 10.357 1.00 73.41 H new ATOM 0 HA THR A 12 -3.319 -12.377 8.570 1.00 12.04 H new ATOM 0 HB THR A 12 -0.897 -13.525 10.016 1.00 55.31 H new ATOM 0 HG1 THR A 12 -0.863 -11.390 10.983 1.00 72.43 H new ATOM 0 HG21 THR A 12 0.348 -11.686 8.942 1.00 44.23 H new ATOM 0 HG22 THR A 12 -0.354 -12.795 7.740 1.00 44.23 H new ATOM 0 HG23 THR A 12 -1.120 -11.219 8.052 1.00 44.23 H new ATOM 165 N VAL A 13 -3.137 -14.097 6.775 1.00 73.43 N ATOM 166 CA VAL A 13 -2.932 -15.003 5.650 1.00 1.34 C ATOM 167 C VAL A 13 -1.889 -14.452 4.685 1.00 45.01 C ATOM 168 O VAL A 13 -1.948 -13.288 4.289 1.00 43.24 O ATOM 169 CB VAL A 13 -4.244 -15.252 4.883 1.00 12.14 C ATOM 170 CG1 VAL A 13 -4.005 -16.182 3.704 1.00 51.33 C ATOM 171 CG2 VAL A 13 -5.305 -15.820 5.814 1.00 11.21 C ATOM 0 H VAL A 13 -3.839 -13.375 6.613 1.00 73.43 H new ATOM 0 HA VAL A 13 -2.578 -15.947 6.064 1.00 1.34 H new ATOM 0 HB VAL A 13 -4.605 -14.299 4.496 1.00 12.14 H new ATOM 0 HG11 VAL A 13 -4.943 -16.346 3.174 1.00 51.33 H new ATOM 0 HG12 VAL A 13 -3.280 -15.732 3.026 1.00 51.33 H new ATOM 0 HG13 VAL A 13 -3.620 -17.136 4.065 1.00 51.33 H new ATOM 0 HG21 VAL A 13 -6.226 -15.990 5.256 1.00 11.21 H new ATOM 0 HG22 VAL A 13 -4.955 -16.764 6.232 1.00 11.21 H new ATOM 0 HG23 VAL A 13 -5.496 -15.114 6.622 1.00 11.21 H new ATOM 181 N ASP A 14 -0.934 -15.296 4.310 1.00 60.24 N ATOM 182 CA ASP A 14 0.123 -14.895 3.388 1.00 11.25 C ATOM 183 C ASP A 14 -0.115 -15.481 2.000 1.00 4.03 C ATOM 184 O ASP A 14 -0.213 -16.697 1.838 1.00 51.11 O ATOM 185 CB ASP A 14 1.487 -15.341 3.918 1.00 73.33 C ATOM 186 CG ASP A 14 2.485 -14.202 3.978 1.00 24.33 C ATOM 187 OD1 ASP A 14 2.284 -13.279 4.794 1.00 14.45 O ATOM 188 OD2 ASP A 14 3.469 -14.235 3.210 1.00 2.11 O ATOM 0 H ASP A 14 -0.870 -16.262 4.630 1.00 60.24 H new ATOM 0 HA ASP A 14 0.110 -13.808 3.310 1.00 11.25 H new ATOM 0 HB2 ASP A 14 1.365 -15.766 4.914 1.00 73.33 H new ATOM 0 HB3 ASP A 14 1.881 -16.132 3.280 1.00 73.33 H new ATOM 193 N MET A 15 -0.207 -14.608 1.003 1.00 43.24 N ATOM 194 CA MET A 15 -0.433 -15.039 -0.372 1.00 22.51 C ATOM 195 C MET A 15 0.880 -15.439 -1.039 1.00 15.00 C ATOM 196 O MET A 15 0.884 -16.035 -2.116 1.00 35.51 O ATOM 197 CB MET A 15 -1.108 -13.926 -1.174 1.00 41.43 C ATOM 198 CG MET A 15 -0.171 -12.785 -1.538 1.00 12.13 C ATOM 199 SD MET A 15 -0.985 -11.499 -2.505 1.00 70.20 S ATOM 200 CE MET A 15 -0.020 -11.548 -4.013 1.00 4.21 C ATOM 0 H MET A 15 -0.129 -13.598 1.121 1.00 43.24 H new ATOM 0 HA MET A 15 -1.089 -15.909 -0.350 1.00 22.51 H new ATOM 0 HB2 MET A 15 -1.524 -14.349 -2.088 1.00 41.43 H new ATOM 0 HB3 MET A 15 -1.944 -13.529 -0.597 1.00 41.43 H new ATOM 0 HG2 MET A 15 0.233 -12.347 -0.625 1.00 12.13 H new ATOM 0 HG3 MET A 15 0.673 -13.180 -2.103 1.00 12.13 H new ATOM 0 HE1 MET A 15 -0.403 -10.806 -4.714 1.00 4.21 H new ATOM 0 HE2 MET A 15 1.023 -11.328 -3.785 1.00 4.21 H new ATOM 0 HE3 MET A 15 -0.092 -12.540 -4.459 1.00 4.21 H new ATOM 210 N VAL A 16 1.992 -15.106 -0.393 1.00 23.14 N ATOM 211 CA VAL A 16 3.311 -15.431 -0.923 1.00 71.11 C ATOM 212 C VAL A 16 3.955 -16.567 -0.136 1.00 45.50 C ATOM 213 O VAL A 16 4.720 -17.360 -0.685 1.00 2.11 O ATOM 214 CB VAL A 16 4.245 -14.207 -0.895 1.00 12.55 C ATOM 215 CG1 VAL A 16 3.800 -13.171 -1.916 1.00 73.43 C ATOM 216 CG2 VAL A 16 4.290 -13.604 0.502 1.00 63.33 C ATOM 0 H VAL A 16 2.006 -14.611 0.499 1.00 23.14 H new ATOM 0 HA VAL A 16 3.168 -15.745 -1.957 1.00 71.11 H new ATOM 0 HB VAL A 16 5.251 -14.534 -1.159 1.00 12.55 H new ATOM 0 HG11 VAL A 16 4.472 -12.314 -1.881 1.00 73.43 H new ATOM 0 HG12 VAL A 16 3.823 -13.610 -2.913 1.00 73.43 H new ATOM 0 HG13 VAL A 16 2.785 -12.846 -1.686 1.00 73.43 H new ATOM 0 HG21 VAL A 16 4.955 -12.740 0.504 1.00 63.33 H new ATOM 0 HG22 VAL A 16 3.288 -13.292 0.796 1.00 63.33 H new ATOM 0 HG23 VAL A 16 4.660 -14.348 1.208 1.00 63.33 H new ATOM 226 N ARG A 17 3.641 -16.638 1.153 1.00 21.42 N ATOM 227 CA ARG A 17 4.190 -17.677 2.017 1.00 42.32 C ATOM 228 C ARG A 17 3.171 -18.789 2.245 1.00 61.30 C ATOM 229 O ARG A 17 3.525 -19.893 2.660 1.00 72.14 O ATOM 230 CB ARG A 17 4.619 -17.080 3.359 1.00 72.04 C ATOM 231 CG ARG A 17 5.875 -16.229 3.273 1.00 1.32 C ATOM 232 CD ARG A 17 6.570 -16.124 4.622 1.00 52.12 C ATOM 233 NE ARG A 17 7.310 -17.339 4.952 1.00 11.22 N ATOM 234 CZ ARG A 17 7.814 -17.588 6.156 1.00 73.03 C ATOM 235 NH1 ARG A 17 7.658 -16.711 7.138 1.00 35.30 N ATOM 236 NH2 ARG A 17 8.475 -18.717 6.379 1.00 41.52 N ATOM 0 H ARG A 17 3.010 -15.989 1.622 1.00 21.42 H new ATOM 0 HA ARG A 17 5.062 -18.103 1.521 1.00 42.32 H new ATOM 0 HB2 ARG A 17 3.805 -16.472 3.754 1.00 72.04 H new ATOM 0 HB3 ARG A 17 4.786 -17.889 4.070 1.00 72.04 H new ATOM 0 HG2 ARG A 17 6.559 -16.661 2.543 1.00 1.32 H new ATOM 0 HG3 ARG A 17 5.617 -15.232 2.917 1.00 1.32 H new ATOM 0 HD2 ARG A 17 7.253 -15.275 4.613 1.00 52.12 H new ATOM 0 HD3 ARG A 17 5.829 -15.929 5.397 1.00 52.12 H new ATOM 0 HE ARG A 17 7.447 -18.034 4.218 1.00 11.22 H new ATOM 0 HH11 ARG A 17 7.150 -15.843 6.970 1.00 35.30 H new ATOM 0 HH12 ARG A 17 8.046 -16.905 8.061 1.00 35.30 H new ATOM 0 HH21 ARG A 17 8.596 -19.394 5.626 1.00 41.52 H new ATOM 0 HH22 ARG A 17 8.862 -18.908 7.303 1.00 41.52 H new ATOM 250 N ARG A 18 1.905 -18.490 1.972 1.00 63.20 N ATOM 251 CA ARG A 18 0.835 -19.464 2.149 1.00 31.11 C ATOM 252 C ARG A 18 0.780 -19.954 3.593 1.00 75.50 C ATOM 253 O ARG A 18 0.841 -21.156 3.855 1.00 30.24 O ATOM 254 CB ARG A 18 1.034 -20.650 1.204 1.00 71.13 C ATOM 255 CG ARG A 18 0.641 -20.355 -0.235 1.00 22.03 C ATOM 256 CD ARG A 18 1.772 -19.678 -0.993 1.00 40.21 C ATOM 257 NE ARG A 18 1.727 -19.975 -2.422 1.00 45.03 N ATOM 258 CZ ARG A 18 2.707 -19.672 -3.267 1.00 21.32 C ATOM 259 NH1 ARG A 18 3.802 -19.067 -2.828 1.00 22.44 N ATOM 260 NH2 ARG A 18 2.593 -19.975 -4.554 1.00 32.24 N ATOM 0 H ARG A 18 1.596 -17.581 1.627 1.00 63.20 H new ATOM 0 HA ARG A 18 -0.110 -18.975 1.913 1.00 31.11 H new ATOM 0 HB2 ARG A 18 2.081 -20.954 1.231 1.00 71.13 H new ATOM 0 HB3 ARG A 18 0.448 -21.495 1.566 1.00 71.13 H new ATOM 0 HG2 ARG A 18 0.370 -21.284 -0.737 1.00 22.03 H new ATOM 0 HG3 ARG A 18 -0.242 -19.716 -0.249 1.00 22.03 H new ATOM 0 HD2 ARG A 18 1.713 -18.600 -0.845 1.00 40.21 H new ATOM 0 HD3 ARG A 18 2.729 -20.004 -0.585 1.00 40.21 H new ATOM 0 HE ARG A 18 0.898 -20.440 -2.792 1.00 45.03 H new ATOM 0 HH11 ARG A 18 3.894 -18.833 -1.839 1.00 22.44 H new ATOM 0 HH12 ARG A 18 4.553 -18.836 -3.479 1.00 22.44 H new ATOM 0 HH21 ARG A 18 1.752 -20.441 -4.896 1.00 32.24 H new ATOM 0 HH22 ARG A 18 3.346 -19.742 -5.201 1.00 32.24 H new ATOM 274 N THR A 19 0.663 -19.016 4.527 1.00 5.15 N ATOM 275 CA THR A 19 0.602 -19.352 5.944 1.00 14.43 C ATOM 276 C THR A 19 -0.574 -18.658 6.623 1.00 42.31 C ATOM 277 O THR A 19 -1.221 -17.792 6.034 1.00 72.03 O ATOM 278 CB THR A 19 1.902 -18.962 6.671 1.00 5.23 C ATOM 279 OG1 THR A 19 1.977 -17.539 6.813 1.00 12.24 O ATOM 280 CG2 THR A 19 3.120 -19.465 5.910 1.00 54.32 C ATOM 0 H THR A 19 0.609 -18.017 4.328 1.00 5.15 H new ATOM 0 HA THR A 19 0.470 -20.432 6.007 1.00 14.43 H new ATOM 0 HB THR A 19 1.892 -19.425 7.658 1.00 5.23 H new ATOM 0 HG1 THR A 19 2.806 -17.300 7.278 1.00 12.24 H new ATOM 0 HG21 THR A 19 4.026 -19.177 6.443 1.00 54.32 H new ATOM 0 HG22 THR A 19 3.076 -20.551 5.829 1.00 54.32 H new ATOM 0 HG23 THR A 19 3.132 -19.027 4.912 1.00 54.32 H new ATOM 288 N VAL A 20 -0.845 -19.043 7.866 1.00 2.41 N ATOM 289 CA VAL A 20 -1.942 -18.456 8.626 1.00 10.31 C ATOM 290 C VAL A 20 -1.552 -18.250 10.085 1.00 24.24 C ATOM 291 O VAL A 20 -1.413 -19.211 10.842 1.00 24.44 O ATOM 292 CB VAL A 20 -3.203 -19.337 8.563 1.00 73.42 C ATOM 293 CG1 VAL A 20 -3.945 -19.115 7.254 1.00 72.33 C ATOM 294 CG2 VAL A 20 -2.837 -20.804 8.735 1.00 0.34 C ATOM 0 H VAL A 20 -0.320 -19.759 8.368 1.00 2.41 H new ATOM 0 HA VAL A 20 -2.160 -17.490 8.171 1.00 10.31 H new ATOM 0 HB VAL A 20 -3.865 -19.052 9.381 1.00 73.42 H new ATOM 0 HG11 VAL A 20 -4.833 -19.746 7.228 1.00 72.33 H new ATOM 0 HG12 VAL A 20 -4.241 -18.069 7.176 1.00 72.33 H new ATOM 0 HG13 VAL A 20 -3.293 -19.371 6.418 1.00 72.33 H new ATOM 0 HG21 VAL A 20 -3.740 -21.412 8.688 1.00 0.34 H new ATOM 0 HG22 VAL A 20 -2.155 -21.105 7.939 1.00 0.34 H new ATOM 0 HG23 VAL A 20 -2.353 -20.947 9.701 1.00 0.34 H new ATOM 304 N ILE A 21 -1.377 -16.992 10.474 1.00 45.44 N ATOM 305 CA ILE A 21 -1.004 -16.660 11.843 1.00 3.11 C ATOM 306 C ILE A 21 -2.181 -16.059 12.603 1.00 10.41 C ATOM 307 O ILE A 21 -2.625 -14.950 12.304 1.00 70.10 O ATOM 308 CB ILE A 21 0.177 -15.671 11.882 1.00 75.15 C ATOM 309 CG1 ILE A 21 1.461 -16.358 11.413 1.00 1.12 C ATOM 310 CG2 ILE A 21 0.351 -15.109 13.284 1.00 21.15 C ATOM 311 CD1 ILE A 21 1.572 -16.471 9.909 1.00 50.11 C ATOM 0 H ILE A 21 -1.488 -16.185 9.860 1.00 45.44 H new ATOM 0 HA ILE A 21 -0.703 -17.592 12.322 1.00 3.11 H new ATOM 0 HB ILE A 21 -0.038 -14.844 11.205 1.00 75.15 H new ATOM 0 HG12 ILE A 21 2.319 -15.803 11.792 1.00 1.12 H new ATOM 0 HG13 ILE A 21 1.509 -17.356 11.849 1.00 1.12 H new ATOM 0 HG21 ILE A 21 1.189 -14.412 13.295 1.00 21.15 H new ATOM 0 HG22 ILE A 21 -0.559 -14.588 13.582 1.00 21.15 H new ATOM 0 HG23 ILE A 21 0.547 -15.924 13.981 1.00 21.15 H new ATOM 0 HD11 ILE A 21 2.507 -16.968 9.649 1.00 50.11 H new ATOM 0 HD12 ILE A 21 0.733 -17.052 9.525 1.00 50.11 H new ATOM 0 HD13 ILE A 21 1.556 -15.475 9.467 1.00 50.11 H new ATOM 323 N ARG A 22 -2.681 -16.797 13.589 1.00 51.23 N ATOM 324 CA ARG A 22 -3.807 -16.336 14.393 1.00 63.33 C ATOM 325 C ARG A 22 -3.321 -15.578 15.624 1.00 1.33 C ATOM 326 O ARG A 22 -2.856 -16.179 16.593 1.00 74.02 O ATOM 327 CB ARG A 22 -4.674 -17.522 14.820 1.00 54.40 C ATOM 328 CG ARG A 22 -6.157 -17.195 14.895 1.00 20.14 C ATOM 329 CD ARG A 22 -6.873 -18.087 15.897 1.00 15.13 C ATOM 330 NE ARG A 22 -7.677 -17.315 16.841 1.00 2.52 N ATOM 331 CZ ARG A 22 -7.161 -16.621 17.850 1.00 42.23 C ATOM 332 NH1 ARG A 22 -5.849 -16.603 18.044 1.00 53.32 N ATOM 333 NH2 ARG A 22 -7.957 -15.943 18.666 1.00 11.23 N ATOM 0 H ARG A 22 -2.324 -17.716 13.850 1.00 51.23 H new ATOM 0 HA ARG A 22 -4.404 -15.658 13.783 1.00 63.33 H new ATOM 0 HB2 ARG A 22 -4.526 -18.341 14.117 1.00 54.40 H new ATOM 0 HB3 ARG A 22 -4.338 -17.874 15.795 1.00 54.40 H new ATOM 0 HG2 ARG A 22 -6.287 -16.150 15.178 1.00 20.14 H new ATOM 0 HG3 ARG A 22 -6.608 -17.317 13.910 1.00 20.14 H new ATOM 0 HD2 ARG A 22 -7.514 -18.789 15.364 1.00 15.13 H new ATOM 0 HD3 ARG A 22 -6.139 -18.678 16.445 1.00 15.13 H new ATOM 0 HE ARG A 22 -8.690 -17.308 16.719 1.00 2.52 H new ATOM 0 HH11 ARG A 22 -5.234 -17.123 17.418 1.00 53.32 H new ATOM 0 HH12 ARG A 22 -5.455 -16.070 18.819 1.00 53.32 H new ATOM 0 HH21 ARG A 22 -8.966 -15.954 18.519 1.00 11.23 H new ATOM 0 HH22 ARG A 22 -7.560 -15.411 19.440 1.00 11.23 H new ATOM 347 N SER A 23 -3.431 -14.254 15.579 1.00 10.12 N ATOM 348 CA SER A 23 -2.999 -13.413 16.689 1.00 11.42 C ATOM 349 C SER A 23 -1.566 -13.743 17.095 1.00 11.15 C ATOM 350 O SER A 23 -1.224 -13.725 18.277 1.00 31.21 O ATOM 351 CB SER A 23 -3.935 -13.591 17.886 1.00 23.34 C ATOM 352 OG SER A 23 -3.982 -12.416 18.677 1.00 64.21 O ATOM 0 H SER A 23 -3.816 -13.741 14.786 1.00 10.12 H new ATOM 0 HA SER A 23 -3.035 -12.374 16.361 1.00 11.42 H new ATOM 0 HB2 SER A 23 -4.937 -13.837 17.534 1.00 23.34 H new ATOM 0 HB3 SER A 23 -3.596 -14.429 18.495 1.00 23.34 H new ATOM 0 HG SER A 23 -4.588 -12.556 19.434 1.00 64.21 H new ATOM 358 N GLY A 24 -0.731 -14.044 16.105 1.00 33.54 N ATOM 359 CA GLY A 24 0.655 -14.375 16.379 1.00 41.13 C ATOM 360 C GLY A 24 0.850 -15.846 16.690 1.00 2.50 C ATOM 361 O GLY A 24 1.892 -16.245 17.209 1.00 24.43 O ATOM 0 H GLY A 24 -0.990 -14.064 15.119 1.00 33.54 H new ATOM 0 HA2 GLY A 24 1.267 -14.105 15.518 1.00 41.13 H new ATOM 0 HA3 GLY A 24 1.008 -13.779 17.221 1.00 41.13 H new ATOM 365 N LYS A 25 -0.156 -16.654 16.374 1.00 42.01 N ATOM 366 CA LYS A 25 -0.092 -18.089 16.623 1.00 63.21 C ATOM 367 C LYS A 25 -0.474 -18.876 15.373 1.00 10.22 C ATOM 368 O LYS A 25 -1.651 -18.973 15.024 1.00 64.40 O ATOM 369 CB LYS A 25 -1.018 -18.469 17.780 1.00 11.45 C ATOM 370 CG LYS A 25 -0.631 -17.831 19.103 1.00 11.44 C ATOM 371 CD LYS A 25 -1.436 -16.570 19.371 1.00 33.13 C ATOM 372 CE LYS A 25 -0.774 -15.700 20.429 1.00 72.03 C ATOM 373 NZ LYS A 25 0.580 -15.248 20.007 1.00 64.15 N ATOM 0 H LYS A 25 -1.026 -16.339 15.945 1.00 42.01 H new ATOM 0 HA LYS A 25 0.935 -18.340 16.890 1.00 63.21 H new ATOM 0 HB2 LYS A 25 -2.038 -18.176 17.530 1.00 11.45 H new ATOM 0 HB3 LYS A 25 -1.017 -19.553 17.895 1.00 11.45 H new ATOM 0 HG2 LYS A 25 -0.790 -18.544 19.912 1.00 11.44 H new ATOM 0 HG3 LYS A 25 0.432 -17.590 19.095 1.00 11.44 H new ATOM 0 HD2 LYS A 25 -1.543 -16.002 18.447 1.00 33.13 H new ATOM 0 HD3 LYS A 25 -2.440 -16.841 19.697 1.00 33.13 H new ATOM 0 HE2 LYS A 25 -1.401 -14.831 20.629 1.00 72.03 H new ATOM 0 HE3 LYS A 25 -0.696 -16.258 21.362 1.00 72.03 H new ATOM 0 HZ1 LYS A 25 0.942 -14.552 20.689 1.00 64.15 H new ATOM 0 HZ2 LYS A 25 1.223 -16.064 19.972 1.00 64.15 H new ATOM 0 HZ3 LYS A 25 0.522 -14.812 19.065 1.00 64.15 H new ATOM 387 N LYS A 26 0.527 -19.437 14.704 1.00 41.14 N ATOM 388 CA LYS A 26 0.297 -20.218 13.494 1.00 15.20 C ATOM 389 C LYS A 26 -0.628 -21.397 13.776 1.00 34.51 C ATOM 390 O LYS A 26 -0.397 -22.170 14.706 1.00 33.53 O ATOM 391 CB LYS A 26 1.625 -20.722 12.927 1.00 64.22 C ATOM 392 CG LYS A 26 1.464 -21.761 11.830 1.00 13.33 C ATOM 393 CD LYS A 26 2.773 -22.009 11.100 1.00 53.33 C ATOM 394 CE LYS A 26 2.967 -21.026 9.955 1.00 1.23 C ATOM 395 NZ LYS A 26 2.636 -21.636 8.638 1.00 54.22 N ATOM 0 H LYS A 26 1.507 -19.365 14.979 1.00 41.14 H new ATOM 0 HA LYS A 26 -0.182 -19.571 12.759 1.00 15.20 H new ATOM 0 HB2 LYS A 26 2.187 -19.875 12.534 1.00 64.22 H new ATOM 0 HB3 LYS A 26 2.217 -21.149 13.736 1.00 64.22 H new ATOM 0 HG2 LYS A 26 1.105 -22.695 12.262 1.00 13.33 H new ATOM 0 HG3 LYS A 26 0.708 -21.427 11.120 1.00 13.33 H new ATOM 0 HD2 LYS A 26 3.604 -21.922 11.800 1.00 53.33 H new ATOM 0 HD3 LYS A 26 2.788 -23.028 10.713 1.00 53.33 H new ATOM 0 HE2 LYS A 26 2.339 -20.150 10.118 1.00 1.23 H new ATOM 0 HE3 LYS A 26 4.000 -20.679 9.945 1.00 1.23 H new ATOM 0 HZ1 LYS A 26 3.263 -21.244 7.907 1.00 54.22 H new ATOM 0 HZ2 LYS A 26 2.766 -22.666 8.690 1.00 54.22 H new ATOM 0 HZ3 LYS A 26 1.647 -21.424 8.396 1.00 54.22 H new ATOM 409 N ILE A 27 -1.674 -21.530 12.967 1.00 30.21 N ATOM 410 CA ILE A 27 -2.631 -22.617 13.129 1.00 73.40 C ATOM 411 C ILE A 27 -2.160 -23.877 12.410 1.00 41.44 C ATOM 412 O ILE A 27 -1.593 -23.806 11.319 1.00 62.02 O ATOM 413 CB ILE A 27 -4.023 -22.226 12.597 1.00 23.20 C ATOM 414 CG1 ILE A 27 -4.542 -20.987 13.328 1.00 13.42 C ATOM 415 CG2 ILE A 27 -4.995 -23.386 12.753 1.00 23.20 C ATOM 416 CD1 ILE A 27 -4.689 -21.183 14.821 1.00 50.31 C ATOM 0 H ILE A 27 -1.880 -20.898 12.193 1.00 30.21 H new ATOM 0 HA ILE A 27 -2.702 -22.817 14.198 1.00 73.40 H new ATOM 0 HB ILE A 27 -3.937 -21.990 11.536 1.00 23.20 H new ATOM 0 HG12 ILE A 27 -3.862 -20.155 13.144 1.00 13.42 H new ATOM 0 HG13 ILE A 27 -5.509 -20.707 12.910 1.00 13.42 H new ATOM 0 HG21 ILE A 27 -5.974 -23.094 12.373 1.00 23.20 H new ATOM 0 HG22 ILE A 27 -4.629 -24.245 12.191 1.00 23.20 H new ATOM 0 HG23 ILE A 27 -5.079 -23.651 13.807 1.00 23.20 H new ATOM 0 HD11 ILE A 27 -5.061 -20.264 15.274 1.00 50.31 H new ATOM 0 HD12 ILE A 27 -5.392 -21.993 15.014 1.00 50.31 H new ATOM 0 HD13 ILE A 27 -3.720 -21.433 15.252 1.00 50.31 H new ATOM 428 N HIS A 28 -2.400 -25.029 13.027 1.00 61.21 N ATOM 429 CA HIS A 28 -2.002 -26.306 12.444 1.00 10.22 C ATOM 430 C HIS A 28 -3.134 -26.899 11.611 1.00 32.23 C ATOM 431 O HIS A 28 -4.311 -26.715 11.924 1.00 74.20 O ATOM 432 CB HIS A 28 -1.594 -27.287 13.543 1.00 4.14 C ATOM 433 CG HIS A 28 -0.211 -27.055 14.070 1.00 42.20 C ATOM 434 ND1 HIS A 28 0.888 -26.893 13.253 1.00 2.11 N ATOM 435 CD2 HIS A 28 0.248 -26.956 15.340 1.00 40.04 C ATOM 436 CE1 HIS A 28 1.964 -26.706 13.997 1.00 35.34 C ATOM 437 NE2 HIS A 28 1.602 -26.740 15.267 1.00 2.34 N ATOM 0 H HIS A 28 -2.868 -25.105 13.930 1.00 61.21 H new ATOM 0 HA HIS A 28 -1.148 -26.129 11.790 1.00 10.22 H new ATOM 0 HB2 HIS A 28 -2.305 -27.214 14.366 1.00 4.14 H new ATOM 0 HB3 HIS A 28 -1.660 -28.303 13.154 1.00 4.14 H new ATOM 0 HD2 HIS A 28 -0.341 -27.033 16.242 1.00 40.04 H new ATOM 0 HE1 HIS A 28 2.968 -26.552 13.630 1.00 35.34 H new ATOM 0 HE2 HIS A 28 2.227 -26.624 16.065 1.00 2.34 H new ATOM 445 N LEU A 29 -2.771 -27.611 10.550 1.00 50.52 N ATOM 446 CA LEU A 29 -3.756 -28.231 9.671 1.00 54.32 C ATOM 447 C LEU A 29 -3.132 -29.368 8.870 1.00 63.54 C ATOM 448 O LEU A 29 -1.942 -29.657 9.003 1.00 1.11 O ATOM 449 CB LEU A 29 -4.349 -27.188 8.721 1.00 71.41 C ATOM 450 CG LEU A 29 -3.376 -26.137 8.187 1.00 12.50 C ATOM 451 CD1 LEU A 29 -2.302 -26.789 7.330 1.00 12.23 C ATOM 452 CD2 LEU A 29 -4.122 -25.074 7.393 1.00 72.21 C ATOM 0 H LEU A 29 -1.802 -27.773 10.278 1.00 50.52 H new ATOM 0 HA LEU A 29 -4.552 -28.643 10.292 1.00 54.32 H new ATOM 0 HB2 LEU A 29 -4.792 -27.709 7.872 1.00 71.41 H new ATOM 0 HB3 LEU A 29 -5.160 -26.674 9.238 1.00 71.41 H new ATOM 0 HG LEU A 29 -2.891 -25.655 9.036 1.00 12.50 H new ATOM 0 HD11 LEU A 29 -1.619 -26.025 6.959 1.00 12.23 H new ATOM 0 HD12 LEU A 29 -1.748 -27.512 7.929 1.00 12.23 H new ATOM 0 HD13 LEU A 29 -2.769 -27.299 6.487 1.00 12.23 H new ATOM 0 HD21 LEU A 29 -3.414 -24.334 7.021 1.00 72.21 H new ATOM 0 HD22 LEU A 29 -4.635 -25.541 6.552 1.00 72.21 H new ATOM 0 HD23 LEU A 29 -4.853 -24.585 8.037 1.00 72.21 H new ATOM 464 N THR A 30 -3.942 -30.012 8.034 1.00 2.33 N ATOM 465 CA THR A 30 -3.469 -31.117 7.210 1.00 0.05 C ATOM 466 C THR A 30 -3.450 -30.734 5.735 1.00 20.21 C ATOM 467 O THR A 30 -3.778 -29.605 5.372 1.00 32.43 O ATOM 468 CB THR A 30 -4.347 -32.369 7.393 1.00 71.31 C ATOM 469 OG1 THR A 30 -3.706 -33.507 6.805 1.00 54.12 O ATOM 470 CG2 THR A 30 -5.715 -32.168 6.759 1.00 14.34 C ATOM 0 H THR A 30 -4.929 -29.786 7.910 1.00 2.33 H new ATOM 0 HA THR A 30 -2.454 -31.343 7.536 1.00 0.05 H new ATOM 0 HB THR A 30 -4.481 -32.539 8.461 1.00 71.31 H new ATOM 0 HG1 THR A 30 -4.270 -34.299 6.927 1.00 54.12 H new ATOM 0 HG21 THR A 30 -6.317 -33.065 6.901 1.00 14.34 H new ATOM 0 HG22 THR A 30 -6.212 -31.319 7.228 1.00 14.34 H new ATOM 0 HG23 THR A 30 -5.597 -31.975 5.693 1.00 14.34 H new ATOM 478 N GLY A 31 -3.064 -31.683 4.887 1.00 42.30 N ATOM 479 CA GLY A 31 -3.010 -31.425 3.460 1.00 50.31 C ATOM 480 C GLY A 31 -4.339 -30.951 2.906 1.00 40.31 C ATOM 481 O GLY A 31 -4.412 -29.911 2.250 1.00 62.53 O ATOM 0 H GLY A 31 -2.788 -32.625 5.163 1.00 42.30 H new ATOM 0 HA2 GLY A 31 -2.247 -30.673 3.258 1.00 50.31 H new ATOM 0 HA3 GLY A 31 -2.707 -32.334 2.941 1.00 50.31 H new ATOM 485 N LYS A 32 -5.394 -31.715 3.168 1.00 1.44 N ATOM 486 CA LYS A 32 -6.728 -31.368 2.692 1.00 64.34 C ATOM 487 C LYS A 32 -7.151 -29.997 3.209 1.00 72.24 C ATOM 488 O LYS A 32 -7.544 -29.126 2.433 1.00 20.32 O ATOM 489 CB LYS A 32 -7.740 -32.427 3.133 1.00 35.05 C ATOM 490 CG LYS A 32 -9.129 -32.220 2.553 1.00 23.30 C ATOM 491 CD LYS A 32 -9.906 -33.524 2.489 1.00 33.22 C ATOM 492 CE LYS A 32 -10.356 -33.973 3.871 1.00 31.20 C ATOM 493 NZ LYS A 32 -10.590 -35.443 3.928 1.00 3.21 N ATOM 0 H LYS A 32 -5.351 -32.579 3.708 1.00 1.44 H new ATOM 0 HA LYS A 32 -6.700 -31.332 1.603 1.00 64.34 H new ATOM 0 HB2 LYS A 32 -7.375 -33.411 2.838 1.00 35.05 H new ATOM 0 HB3 LYS A 32 -7.806 -32.424 4.221 1.00 35.05 H new ATOM 0 HG2 LYS A 32 -9.675 -31.500 3.162 1.00 23.30 H new ATOM 0 HG3 LYS A 32 -9.047 -31.795 1.553 1.00 23.30 H new ATOM 0 HD2 LYS A 32 -10.776 -33.399 1.845 1.00 33.22 H new ATOM 0 HD3 LYS A 32 -9.284 -34.298 2.038 1.00 33.22 H new ATOM 0 HE2 LYS A 32 -9.600 -33.697 4.606 1.00 31.20 H new ATOM 0 HE3 LYS A 32 -11.272 -33.449 4.143 1.00 31.20 H new ATOM 0 HZ1 LYS A 32 -10.895 -35.709 4.886 1.00 3.21 H new ATOM 0 HZ2 LYS A 32 -11.329 -35.704 3.244 1.00 3.21 H new ATOM 0 HZ3 LYS A 32 -9.709 -35.944 3.694 1.00 3.21 H new ATOM 507 N GLU A 33 -7.067 -29.813 4.523 1.00 71.25 N ATOM 508 CA GLU A 33 -7.442 -28.547 5.141 1.00 24.14 C ATOM 509 C GLU A 33 -6.653 -27.390 4.534 1.00 20.40 C ATOM 510 O GLU A 33 -7.185 -26.298 4.337 1.00 52.22 O ATOM 511 CB GLU A 33 -7.205 -28.603 6.652 1.00 3.50 C ATOM 512 CG GLU A 33 -8.045 -29.651 7.362 1.00 64.23 C ATOM 513 CD GLU A 33 -7.685 -29.792 8.828 1.00 14.22 C ATOM 514 OE1 GLU A 33 -6.834 -29.013 9.307 1.00 33.11 O ATOM 515 OE2 GLU A 33 -8.254 -30.680 9.497 1.00 54.25 O ATOM 0 H GLU A 33 -6.743 -30.524 5.179 1.00 71.25 H new ATOM 0 HA GLU A 33 -8.502 -28.379 4.952 1.00 24.14 H new ATOM 0 HB2 GLU A 33 -6.151 -28.807 6.838 1.00 3.50 H new ATOM 0 HB3 GLU A 33 -7.421 -27.625 7.081 1.00 3.50 H new ATOM 0 HG2 GLU A 33 -9.099 -29.387 7.274 1.00 64.23 H new ATOM 0 HG3 GLU A 33 -7.915 -30.613 6.866 1.00 64.23 H new ATOM 522 N TYR A 34 -5.382 -27.639 4.240 1.00 4.14 N ATOM 523 CA TYR A 34 -4.518 -26.618 3.658 1.00 20.45 C ATOM 524 C TYR A 34 -4.894 -26.351 2.204 1.00 11.13 C ATOM 525 O TYR A 34 -4.733 -25.238 1.704 1.00 51.23 O ATOM 526 CB TYR A 34 -3.053 -27.049 3.747 1.00 21.10 C ATOM 527 CG TYR A 34 -2.110 -26.149 2.981 1.00 22.02 C ATOM 528 CD1 TYR A 34 -2.155 -24.769 3.137 1.00 71.25 C ATOM 529 CD2 TYR A 34 -1.172 -26.679 2.103 1.00 55.01 C ATOM 530 CE1 TYR A 34 -1.296 -23.943 2.438 1.00 22.22 C ATOM 531 CE2 TYR A 34 -0.308 -25.861 1.401 1.00 12.35 C ATOM 532 CZ TYR A 34 -0.374 -24.494 1.572 1.00 11.42 C ATOM 533 OH TYR A 34 0.485 -23.674 0.876 1.00 74.32 O ATOM 0 H TYR A 34 -4.927 -28.539 4.395 1.00 4.14 H new ATOM 0 HA TYR A 34 -4.654 -25.697 4.224 1.00 20.45 H new ATOM 0 HB2 TYR A 34 -2.752 -27.069 4.794 1.00 21.10 H new ATOM 0 HB3 TYR A 34 -2.959 -28.067 3.368 1.00 21.10 H new ATOM 0 HD1 TYR A 34 -2.874 -24.335 3.816 1.00 71.25 H new ATOM 0 HD2 TYR A 34 -1.118 -27.749 1.967 1.00 55.01 H new ATOM 0 HE1 TYR A 34 -1.346 -22.872 2.569 1.00 22.22 H new ATOM 0 HE2 TYR A 34 0.415 -26.289 0.722 1.00 12.35 H new ATOM 0 HH TYR A 34 1.071 -24.219 0.311 1.00 74.32 H new ATOM 543 N VAL A 35 -5.397 -27.381 1.531 1.00 50.20 N ATOM 544 CA VAL A 35 -5.799 -27.259 0.135 1.00 45.53 C ATOM 545 C VAL A 35 -7.053 -26.403 -0.004 1.00 5.43 C ATOM 546 O VAL A 35 -7.182 -25.618 -0.945 1.00 24.43 O ATOM 547 CB VAL A 35 -6.060 -28.639 -0.497 1.00 51.30 C ATOM 548 CG1 VAL A 35 -6.943 -28.504 -1.729 1.00 4.15 C ATOM 549 CG2 VAL A 35 -4.746 -29.323 -0.845 1.00 15.34 C ATOM 0 H VAL A 35 -5.536 -28.309 1.930 1.00 50.20 H new ATOM 0 HA VAL A 35 -4.974 -26.777 -0.390 1.00 45.53 H new ATOM 0 HB VAL A 35 -6.584 -29.259 0.230 1.00 51.30 H new ATOM 0 HG11 VAL A 35 -7.117 -29.489 -2.162 1.00 4.15 H new ATOM 0 HG12 VAL A 35 -7.897 -28.059 -1.446 1.00 4.15 H new ATOM 0 HG13 VAL A 35 -6.449 -27.867 -2.463 1.00 4.15 H new ATOM 0 HG21 VAL A 35 -4.950 -30.297 -1.290 1.00 15.34 H new ATOM 0 HG22 VAL A 35 -4.192 -28.708 -1.554 1.00 15.34 H new ATOM 0 HG23 VAL A 35 -4.154 -29.455 0.060 1.00 15.34 H new ATOM 559 N LEU A 36 -7.975 -26.558 0.940 1.00 43.42 N ATOM 560 CA LEU A 36 -9.220 -25.798 0.924 1.00 32.14 C ATOM 561 C LEU A 36 -8.986 -24.358 1.370 1.00 24.45 C ATOM 562 O LEU A 36 -9.635 -23.432 0.883 1.00 61.34 O ATOM 563 CB LEU A 36 -10.257 -26.463 1.832 1.00 50.34 C ATOM 564 CG LEU A 36 -11.079 -27.587 1.200 1.00 22.24 C ATOM 565 CD1 LEU A 36 -10.220 -28.825 0.995 1.00 61.24 C ATOM 566 CD2 LEU A 36 -12.289 -27.913 2.064 1.00 42.21 C ATOM 0 H LEU A 36 -7.884 -27.202 1.725 1.00 43.42 H new ATOM 0 HA LEU A 36 -9.596 -25.785 -0.099 1.00 32.14 H new ATOM 0 HB2 LEU A 36 -9.742 -26.863 2.706 1.00 50.34 H new ATOM 0 HB3 LEU A 36 -10.943 -25.695 2.190 1.00 50.34 H new ATOM 0 HG LEU A 36 -11.433 -27.249 0.226 1.00 22.24 H new ATOM 0 HD11 LEU A 36 -10.821 -29.615 0.544 1.00 61.24 H new ATOM 0 HD12 LEU A 36 -9.385 -28.584 0.337 1.00 61.24 H new ATOM 0 HD13 LEU A 36 -9.837 -29.165 1.957 1.00 61.24 H new ATOM 0 HD21 LEU A 36 -12.863 -28.715 1.599 1.00 42.21 H new ATOM 0 HD22 LEU A 36 -11.956 -28.231 3.052 1.00 42.21 H new ATOM 0 HD23 LEU A 36 -12.917 -27.027 2.161 1.00 42.21 H new ATOM 578 N LEU A 37 -8.053 -24.177 2.299 1.00 43.25 N ATOM 579 CA LEU A 37 -7.730 -22.849 2.809 1.00 21.04 C ATOM 580 C LEU A 37 -6.857 -22.083 1.821 1.00 4.20 C ATOM 581 O LEU A 37 -7.158 -20.944 1.466 1.00 72.04 O ATOM 582 CB LEU A 37 -7.017 -22.959 4.158 1.00 31.33 C ATOM 583 CG LEU A 37 -7.890 -22.757 5.397 1.00 0.43 C ATOM 584 CD1 LEU A 37 -8.839 -23.931 5.580 1.00 64.10 C ATOM 585 CD2 LEU A 37 -7.024 -22.570 6.635 1.00 73.31 C ATOM 0 H LEU A 37 -7.508 -24.932 2.714 1.00 43.25 H new ATOM 0 HA LEU A 37 -8.663 -22.301 2.941 1.00 21.04 H new ATOM 0 HB2 LEU A 37 -6.553 -23.943 4.222 1.00 31.33 H new ATOM 0 HB3 LEU A 37 -6.212 -22.225 4.182 1.00 31.33 H new ATOM 0 HG LEU A 37 -8.485 -21.855 5.255 1.00 0.43 H new ATOM 0 HD11 LEU A 37 -9.452 -23.769 6.467 1.00 64.10 H new ATOM 0 HD12 LEU A 37 -9.483 -24.018 4.705 1.00 64.10 H new ATOM 0 HD13 LEU A 37 -8.263 -24.849 5.700 1.00 64.10 H new ATOM 0 HD21 LEU A 37 -7.662 -22.428 7.507 1.00 73.31 H new ATOM 0 HD22 LEU A 37 -6.402 -23.453 6.781 1.00 73.31 H new ATOM 0 HD23 LEU A 37 -6.387 -21.695 6.505 1.00 73.31 H new ATOM 597 N GLU A 38 -5.775 -22.717 1.380 1.00 43.11 N ATOM 598 CA GLU A 38 -4.859 -22.094 0.431 1.00 21.42 C ATOM 599 C GLU A 38 -5.613 -21.561 -0.783 1.00 54.41 C ATOM 600 O GLU A 38 -5.253 -20.526 -1.347 1.00 31.32 O ATOM 601 CB GLU A 38 -3.794 -23.098 -0.017 1.00 1.41 C ATOM 602 CG GLU A 38 -4.323 -24.168 -0.956 1.00 71.23 C ATOM 603 CD GLU A 38 -3.270 -25.195 -1.323 1.00 23.54 C ATOM 604 OE1 GLU A 38 -2.129 -25.076 -0.829 1.00 23.34 O ATOM 605 OE2 GLU A 38 -3.585 -26.118 -2.103 1.00 15.23 O ATOM 0 H GLU A 38 -5.511 -23.660 1.664 1.00 43.11 H new ATOM 0 HA GLU A 38 -4.372 -21.257 0.931 1.00 21.42 H new ATOM 0 HB2 GLU A 38 -2.985 -22.560 -0.512 1.00 1.41 H new ATOM 0 HB3 GLU A 38 -3.366 -23.578 0.863 1.00 1.41 H new ATOM 0 HG2 GLU A 38 -5.168 -24.672 -0.487 1.00 71.23 H new ATOM 0 HG3 GLU A 38 -4.697 -23.696 -1.865 1.00 71.23 H new ATOM 612 N LEU A 39 -6.661 -22.273 -1.181 1.00 35.20 N ATOM 613 CA LEU A 39 -7.468 -21.873 -2.329 1.00 2.41 C ATOM 614 C LEU A 39 -8.436 -20.756 -1.951 1.00 44.33 C ATOM 615 O LEU A 39 -8.638 -19.810 -2.715 1.00 21.43 O ATOM 616 CB LEU A 39 -8.244 -23.072 -2.876 1.00 23.24 C ATOM 617 CG LEU A 39 -8.103 -23.336 -4.375 1.00 45.01 C ATOM 618 CD1 LEU A 39 -8.742 -22.213 -5.177 1.00 74.41 C ATOM 619 CD2 LEU A 39 -6.637 -23.496 -4.753 1.00 11.41 C ATOM 0 H LEU A 39 -6.972 -23.131 -0.726 1.00 35.20 H new ATOM 0 HA LEU A 39 -6.796 -21.501 -3.102 1.00 2.41 H new ATOM 0 HB2 LEU A 39 -7.921 -23.964 -2.339 1.00 23.24 H new ATOM 0 HB3 LEU A 39 -9.301 -22.929 -2.651 1.00 23.24 H new ATOM 0 HG LEU A 39 -8.622 -24.265 -4.611 1.00 45.01 H new ATOM 0 HD11 LEU A 39 -8.632 -22.418 -6.242 1.00 74.41 H new ATOM 0 HD12 LEU A 39 -9.801 -22.145 -4.928 1.00 74.41 H new ATOM 0 HD13 LEU A 39 -8.252 -21.270 -4.937 1.00 74.41 H new ATOM 0 HD21 LEU A 39 -6.556 -23.683 -5.824 1.00 11.41 H new ATOM 0 HD22 LEU A 39 -6.095 -22.584 -4.502 1.00 11.41 H new ATOM 0 HD23 LEU A 39 -6.209 -24.335 -4.204 1.00 11.41 H new ATOM 631 N LEU A 40 -9.030 -20.870 -0.769 1.00 3.43 N ATOM 632 CA LEU A 40 -9.975 -19.868 -0.288 1.00 11.02 C ATOM 633 C LEU A 40 -9.302 -18.506 -0.149 1.00 71.20 C ATOM 634 O LEU A 40 -9.817 -17.495 -0.628 1.00 74.35 O ATOM 635 CB LEU A 40 -10.564 -20.298 1.057 1.00 41.00 C ATOM 636 CG LEU A 40 -11.844 -21.132 0.993 1.00 24.53 C ATOM 637 CD1 LEU A 40 -12.287 -21.538 2.391 1.00 43.45 C ATOM 638 CD2 LEU A 40 -12.948 -20.362 0.284 1.00 62.31 C ATOM 0 H LEU A 40 -8.874 -21.646 -0.126 1.00 3.43 H new ATOM 0 HA LEU A 40 -10.779 -19.782 -1.019 1.00 11.02 H new ATOM 0 HB2 LEU A 40 -9.808 -20.870 1.596 1.00 41.00 H new ATOM 0 HB3 LEU A 40 -10.766 -19.403 1.645 1.00 41.00 H new ATOM 0 HG LEU A 40 -11.637 -22.037 0.422 1.00 24.53 H new ATOM 0 HD11 LEU A 40 -13.199 -22.131 2.326 1.00 43.45 H new ATOM 0 HD12 LEU A 40 -11.503 -22.130 2.864 1.00 43.45 H new ATOM 0 HD13 LEU A 40 -12.476 -20.645 2.986 1.00 43.45 H new ATOM 0 HD21 LEU A 40 -13.851 -20.971 0.248 1.00 62.31 H new ATOM 0 HD22 LEU A 40 -13.154 -19.439 0.826 1.00 62.31 H new ATOM 0 HD23 LEU A 40 -12.631 -20.123 -0.731 1.00 62.31 H new ATOM 650 N LEU A 41 -8.148 -18.487 0.508 1.00 45.04 N ATOM 651 CA LEU A 41 -7.402 -17.249 0.708 1.00 63.33 C ATOM 652 C LEU A 41 -6.849 -16.727 -0.614 1.00 64.14 C ATOM 653 O LEU A 41 -6.945 -15.537 -0.911 1.00 11.42 O ATOM 654 CB LEU A 41 -6.258 -17.474 1.699 1.00 73.33 C ATOM 655 CG LEU A 41 -5.279 -18.595 1.350 1.00 63.41 C ATOM 656 CD1 LEU A 41 -4.059 -18.035 0.635 1.00 21.30 C ATOM 657 CD2 LEU A 41 -4.864 -19.351 2.604 1.00 0.43 C ATOM 0 H LEU A 41 -7.708 -19.314 0.911 1.00 45.04 H new ATOM 0 HA LEU A 41 -8.086 -16.504 1.115 1.00 63.33 H new ATOM 0 HB2 LEU A 41 -5.697 -16.544 1.792 1.00 73.33 H new ATOM 0 HB3 LEU A 41 -6.688 -17.686 2.678 1.00 73.33 H new ATOM 0 HG LEU A 41 -5.780 -19.292 0.679 1.00 63.41 H new ATOM 0 HD11 LEU A 41 -3.373 -18.848 0.395 1.00 21.30 H new ATOM 0 HD12 LEU A 41 -4.372 -17.540 -0.284 1.00 21.30 H new ATOM 0 HD13 LEU A 41 -3.557 -17.316 1.282 1.00 21.30 H new ATOM 0 HD21 LEU A 41 -4.167 -20.145 2.336 1.00 0.43 H new ATOM 0 HD22 LEU A 41 -4.382 -18.664 3.300 1.00 0.43 H new ATOM 0 HD23 LEU A 41 -5.746 -19.786 3.075 1.00 0.43 H new ATOM 669 N GLN A 42 -6.271 -17.626 -1.405 1.00 33.21 N ATOM 670 CA GLN A 42 -5.705 -17.256 -2.696 1.00 45.42 C ATOM 671 C GLN A 42 -6.719 -16.485 -3.535 1.00 2.11 C ATOM 672 O GLN A 42 -6.391 -15.463 -4.139 1.00 31.33 O ATOM 673 CB GLN A 42 -5.243 -18.503 -3.451 1.00 73.25 C ATOM 674 CG GLN A 42 -4.659 -18.203 -4.823 1.00 33.25 C ATOM 675 CD GLN A 42 -4.546 -19.440 -5.692 1.00 52.10 C ATOM 676 OE1 GLN A 42 -4.801 -20.556 -5.239 1.00 64.54 O ATOM 677 NE2 GLN A 42 -4.163 -19.247 -6.949 1.00 21.33 N ATOM 0 H GLN A 42 -6.183 -18.616 -1.174 1.00 33.21 H new ATOM 0 HA GLN A 42 -4.845 -16.611 -2.515 1.00 45.42 H new ATOM 0 HB2 GLN A 42 -4.495 -19.023 -2.853 1.00 73.25 H new ATOM 0 HB3 GLN A 42 -6.088 -19.182 -3.566 1.00 73.25 H new ATOM 0 HG2 GLN A 42 -5.284 -17.466 -5.327 1.00 33.25 H new ATOM 0 HG3 GLN A 42 -3.672 -17.756 -4.704 1.00 33.25 H new ATOM 0 HE21 GLN A 42 -3.962 -18.304 -7.282 1.00 21.33 H new ATOM 0 HE22 GLN A 42 -4.070 -20.042 -7.582 1.00 21.33 H new ATOM 686 N ARG A 43 -7.951 -16.981 -3.568 1.00 31.51 N ATOM 687 CA ARG A 43 -9.013 -16.340 -4.334 1.00 61.20 C ATOM 688 C ARG A 43 -10.017 -15.660 -3.408 1.00 4.31 C ATOM 689 O ARG A 43 -11.185 -15.489 -3.758 1.00 30.21 O ATOM 690 CB ARG A 43 -9.729 -17.368 -5.213 1.00 3.32 C ATOM 691 CG ARG A 43 -9.090 -17.550 -6.580 1.00 31.21 C ATOM 692 CD ARG A 43 -7.617 -17.907 -6.463 1.00 64.43 C ATOM 693 NE ARG A 43 -7.050 -18.317 -7.745 1.00 64.42 N ATOM 694 CZ ARG A 43 -7.298 -19.490 -8.317 1.00 62.31 C ATOM 695 NH1 ARG A 43 -8.099 -20.364 -7.724 1.00 71.40 N ATOM 696 NH2 ARG A 43 -6.744 -19.791 -9.485 1.00 53.31 N ATOM 0 H ARG A 43 -8.239 -17.825 -3.073 1.00 31.51 H new ATOM 0 HA ARG A 43 -8.559 -15.580 -4.971 1.00 61.20 H new ATOM 0 HB2 ARG A 43 -9.743 -18.328 -4.697 1.00 3.32 H new ATOM 0 HB3 ARG A 43 -10.767 -17.062 -5.344 1.00 3.32 H new ATOM 0 HG2 ARG A 43 -9.613 -18.335 -7.126 1.00 31.21 H new ATOM 0 HG3 ARG A 43 -9.198 -16.633 -7.159 1.00 31.21 H new ATOM 0 HD2 ARG A 43 -7.065 -17.048 -6.080 1.00 64.43 H new ATOM 0 HD3 ARG A 43 -7.496 -18.712 -5.739 1.00 64.43 H new ATOM 0 HE ARG A 43 -6.430 -17.667 -8.228 1.00 64.42 H new ATOM 0 HH11 ARG A 43 -8.527 -20.137 -6.826 1.00 71.40 H new ATOM 0 HH12 ARG A 43 -8.288 -21.264 -8.165 1.00 71.40 H new ATOM 0 HH21 ARG A 43 -6.127 -19.121 -9.944 1.00 53.31 H new ATOM 0 HH22 ARG A 43 -6.935 -20.692 -9.923 1.00 53.31 H new ATOM 710 N THR A 44 -9.553 -15.273 -2.223 1.00 54.34 N ATOM 711 CA THR A 44 -10.410 -14.613 -1.246 1.00 41.32 C ATOM 712 C THR A 44 -11.152 -13.437 -1.871 1.00 1.31 C ATOM 713 O THR A 44 -10.555 -12.605 -2.553 1.00 3.24 O ATOM 714 CB THR A 44 -9.599 -14.110 -0.037 1.00 42.42 C ATOM 715 OG1 THR A 44 -10.481 -13.582 0.959 1.00 13.04 O ATOM 716 CG2 THR A 44 -8.605 -13.038 -0.460 1.00 71.33 C ATOM 0 H THR A 44 -8.589 -15.405 -1.917 1.00 54.34 H new ATOM 0 HA THR A 44 -11.132 -15.355 -0.906 1.00 41.32 H new ATOM 0 HB THR A 44 -9.046 -14.953 0.377 1.00 42.42 H new ATOM 0 HG1 THR A 44 -9.958 -13.266 1.725 1.00 13.04 H new ATOM 0 HG21 THR A 44 -8.044 -12.698 0.411 1.00 71.33 H new ATOM 0 HG22 THR A 44 -7.916 -13.451 -1.197 1.00 71.33 H new ATOM 0 HG23 THR A 44 -9.142 -12.196 -0.897 1.00 71.33 H new ATOM 724 N GLY A 45 -12.459 -13.373 -1.633 1.00 24.31 N ATOM 725 CA GLY A 45 -13.261 -12.294 -2.179 1.00 64.33 C ATOM 726 C GLY A 45 -14.238 -12.775 -3.233 1.00 52.13 C ATOM 727 O GLY A 45 -15.276 -12.153 -3.455 1.00 53.30 O ATOM 0 H GLY A 45 -12.976 -14.049 -1.072 1.00 24.31 H new ATOM 0 HA2 GLY A 45 -13.811 -11.810 -1.372 1.00 64.33 H new ATOM 0 HA3 GLY A 45 -12.604 -11.541 -2.614 1.00 64.33 H new ATOM 731 N GLU A 46 -13.905 -13.884 -3.885 1.00 70.44 N ATOM 732 CA GLU A 46 -14.761 -14.446 -4.924 1.00 13.33 C ATOM 733 C GLU A 46 -15.172 -15.874 -4.577 1.00 64.13 C ATOM 734 O GLU A 46 -14.514 -16.545 -3.782 1.00 31.31 O ATOM 735 CB GLU A 46 -14.044 -14.423 -6.275 1.00 23.00 C ATOM 736 CG GLU A 46 -12.627 -14.969 -6.221 1.00 3.21 C ATOM 737 CD GLU A 46 -12.007 -15.120 -7.596 1.00 43.45 C ATOM 738 OE1 GLU A 46 -12.486 -15.973 -8.372 1.00 54.23 O ATOM 739 OE2 GLU A 46 -11.042 -14.385 -7.897 1.00 75.51 O ATOM 0 H GLU A 46 -13.049 -14.411 -3.713 1.00 70.44 H new ATOM 0 HA GLU A 46 -15.660 -13.833 -4.989 1.00 13.33 H new ATOM 0 HB2 GLU A 46 -14.622 -15.005 -6.993 1.00 23.00 H new ATOM 0 HB3 GLU A 46 -14.016 -13.398 -6.644 1.00 23.00 H new ATOM 0 HG2 GLU A 46 -12.008 -14.304 -5.619 1.00 3.21 H new ATOM 0 HG3 GLU A 46 -12.634 -15.938 -5.721 1.00 3.21 H new ATOM 746 N VAL A 47 -16.264 -16.332 -5.180 1.00 70.52 N ATOM 747 CA VAL A 47 -16.763 -17.681 -4.937 1.00 1.31 C ATOM 748 C VAL A 47 -16.139 -18.680 -5.904 1.00 74.44 C ATOM 749 O VAL A 47 -16.166 -18.484 -7.120 1.00 75.31 O ATOM 750 CB VAL A 47 -18.296 -17.744 -5.068 1.00 52.00 C ATOM 751 CG1 VAL A 47 -18.815 -19.101 -4.618 1.00 33.02 C ATOM 752 CG2 VAL A 47 -18.946 -16.624 -4.269 1.00 45.13 C ATOM 0 H VAL A 47 -16.820 -15.789 -5.840 1.00 70.52 H new ATOM 0 HA VAL A 47 -16.482 -17.944 -3.917 1.00 1.31 H new ATOM 0 HB VAL A 47 -18.559 -17.611 -6.117 1.00 52.00 H new ATOM 0 HG11 VAL A 47 -19.900 -19.127 -4.718 1.00 33.02 H new ATOM 0 HG12 VAL A 47 -18.375 -19.883 -5.237 1.00 33.02 H new ATOM 0 HG13 VAL A 47 -18.542 -19.268 -3.576 1.00 33.02 H new ATOM 0 HG21 VAL A 47 -20.029 -16.684 -4.373 1.00 45.13 H new ATOM 0 HG22 VAL A 47 -18.677 -16.723 -3.218 1.00 45.13 H new ATOM 0 HG23 VAL A 47 -18.598 -15.661 -4.643 1.00 45.13 H new ATOM 762 N LEU A 48 -15.578 -19.753 -5.358 1.00 31.14 N ATOM 763 CA LEU A 48 -14.947 -20.786 -6.172 1.00 53.23 C ATOM 764 C LEU A 48 -15.796 -22.053 -6.199 1.00 14.40 C ATOM 765 O LEU A 48 -16.596 -22.312 -5.300 1.00 32.43 O ATOM 766 CB LEU A 48 -13.551 -21.105 -5.635 1.00 32.10 C ATOM 767 CG LEU A 48 -12.852 -19.980 -4.871 1.00 53.44 C ATOM 768 CD1 LEU A 48 -11.531 -20.465 -4.297 1.00 24.14 C ATOM 769 CD2 LEU A 48 -12.632 -18.777 -5.777 1.00 53.14 C ATOM 0 H LEU A 48 -15.547 -19.931 -4.354 1.00 31.14 H new ATOM 0 HA LEU A 48 -14.860 -20.408 -7.191 1.00 53.23 H new ATOM 0 HB2 LEU A 48 -13.626 -21.971 -4.978 1.00 32.10 H new ATOM 0 HB3 LEU A 48 -12.918 -21.395 -6.474 1.00 32.10 H new ATOM 0 HG LEU A 48 -13.494 -19.675 -4.044 1.00 53.44 H new ATOM 0 HD11 LEU A 48 -11.048 -19.651 -3.757 1.00 24.14 H new ATOM 0 HD12 LEU A 48 -11.714 -21.295 -3.615 1.00 24.14 H new ATOM 0 HD13 LEU A 48 -10.882 -20.798 -5.107 1.00 24.14 H new ATOM 0 HD21 LEU A 48 -12.133 -17.986 -5.217 1.00 53.14 H new ATOM 0 HD22 LEU A 48 -12.011 -19.068 -6.624 1.00 53.14 H new ATOM 0 HD23 LEU A 48 -13.594 -18.414 -6.140 1.00 53.14 H new ATOM 781 N PRO A 49 -15.619 -22.862 -7.253 1.00 63.44 N ATOM 782 CA PRO A 49 -16.358 -24.117 -7.421 1.00 64.32 C ATOM 783 C PRO A 49 -15.935 -25.178 -6.411 1.00 20.40 C ATOM 784 O PRO A 49 -15.005 -24.971 -5.631 1.00 61.24 O ATOM 785 CB PRO A 49 -15.993 -24.556 -8.842 1.00 33.13 C ATOM 786 CG PRO A 49 -14.671 -23.922 -9.107 1.00 35.12 C ATOM 787 CD PRO A 49 -14.682 -22.615 -8.363 1.00 33.53 C ATOM 0 HA PRO A 49 -17.428 -23.984 -7.263 1.00 64.32 H new ATOM 0 HB2 PRO A 49 -15.934 -25.642 -8.918 1.00 33.13 H new ATOM 0 HB3 PRO A 49 -16.742 -24.227 -9.563 1.00 33.13 H new ATOM 0 HG2 PRO A 49 -13.856 -24.560 -8.764 1.00 35.12 H new ATOM 0 HG3 PRO A 49 -14.522 -23.762 -10.175 1.00 35.12 H new ATOM 0 HD2 PRO A 49 -13.689 -22.351 -7.999 1.00 33.53 H new ATOM 0 HD3 PRO A 49 -15.018 -21.794 -8.997 1.00 33.53 H new ATOM 795 N ARG A 50 -16.624 -26.315 -6.430 1.00 44.15 N ATOM 796 CA ARG A 50 -16.319 -27.408 -5.515 1.00 75.22 C ATOM 797 C ARG A 50 -15.453 -28.463 -6.197 1.00 73.22 C ATOM 798 O ARG A 50 -14.637 -29.122 -5.553 1.00 34.23 O ATOM 799 CB ARG A 50 -17.612 -28.047 -5.003 1.00 64.20 C ATOM 800 CG ARG A 50 -17.415 -28.914 -3.770 1.00 14.32 C ATOM 801 CD ARG A 50 -17.272 -30.382 -4.138 1.00 24.12 C ATOM 802 NE ARG A 50 -18.564 -31.009 -4.401 1.00 61.50 N ATOM 803 CZ ARG A 50 -18.709 -32.124 -5.109 1.00 72.00 C ATOM 804 NH1 ARG A 50 -17.648 -32.731 -5.621 1.00 44.14 N ATOM 805 NH2 ARG A 50 -19.918 -32.634 -5.305 1.00 54.02 N ATOM 0 H ARG A 50 -17.397 -26.503 -7.069 1.00 44.15 H new ATOM 0 HA ARG A 50 -15.764 -26.998 -4.671 1.00 75.22 H new ATOM 0 HB2 ARG A 50 -18.330 -27.260 -4.773 1.00 64.20 H new ATOM 0 HB3 ARG A 50 -18.047 -28.653 -5.797 1.00 64.20 H new ATOM 0 HG2 ARG A 50 -16.527 -28.585 -3.231 1.00 14.32 H new ATOM 0 HG3 ARG A 50 -18.262 -28.788 -3.096 1.00 14.32 H new ATOM 0 HD2 ARG A 50 -16.638 -30.474 -5.020 1.00 24.12 H new ATOM 0 HD3 ARG A 50 -16.770 -30.911 -3.328 1.00 24.12 H new ATOM 0 HE ARG A 50 -19.401 -30.567 -4.021 1.00 61.50 H new ATOM 0 HH11 ARG A 50 -16.717 -32.342 -5.472 1.00 44.14 H new ATOM 0 HH12 ARG A 50 -17.763 -33.587 -6.164 1.00 44.14 H new ATOM 0 HH21 ARG A 50 -20.737 -32.170 -4.912 1.00 54.02 H new ATOM 0 HH22 ARG A 50 -20.028 -33.490 -5.849 1.00 54.02 H new ATOM 819 N SER A 51 -15.637 -28.618 -7.504 1.00 53.35 N ATOM 820 CA SER A 51 -14.876 -29.595 -8.273 1.00 70.43 C ATOM 821 C SER A 51 -13.394 -29.232 -8.299 1.00 35.02 C ATOM 822 O SER A 51 -12.531 -30.083 -8.083 1.00 24.05 O ATOM 823 CB SER A 51 -15.416 -29.684 -9.702 1.00 63.11 C ATOM 824 OG SER A 51 -15.718 -28.398 -10.214 1.00 15.33 O ATOM 0 H SER A 51 -16.307 -28.079 -8.053 1.00 53.35 H new ATOM 0 HA SER A 51 -14.986 -30.566 -7.789 1.00 70.43 H new ATOM 0 HB2 SER A 51 -14.680 -30.170 -10.343 1.00 63.11 H new ATOM 0 HB3 SER A 51 -16.312 -30.305 -9.718 1.00 63.11 H new ATOM 0 HG SER A 51 -16.060 -28.482 -11.129 1.00 15.33 H new ATOM 830 N LEU A 52 -13.108 -27.962 -8.565 1.00 21.44 N ATOM 831 CA LEU A 52 -11.731 -27.484 -8.619 1.00 23.12 C ATOM 832 C LEU A 52 -10.995 -27.795 -7.320 1.00 23.15 C ATOM 833 O LEU A 52 -9.918 -28.391 -7.332 1.00 65.55 O ATOM 834 CB LEU A 52 -11.703 -25.978 -8.886 1.00 72.21 C ATOM 835 CG LEU A 52 -10.319 -25.354 -9.071 1.00 34.53 C ATOM 836 CD1 LEU A 52 -9.543 -26.089 -10.152 1.00 64.21 C ATOM 837 CD2 LEU A 52 -10.442 -23.876 -9.410 1.00 62.23 C ATOM 0 H LEU A 52 -13.811 -27.245 -8.746 1.00 21.44 H new ATOM 0 HA LEU A 52 -11.225 -28.001 -9.434 1.00 23.12 H new ATOM 0 HB2 LEU A 52 -12.293 -25.777 -9.781 1.00 72.21 H new ATOM 0 HB3 LEU A 52 -12.199 -25.473 -8.057 1.00 72.21 H new ATOM 0 HG LEU A 52 -9.771 -25.446 -8.133 1.00 34.53 H new ATOM 0 HD11 LEU A 52 -8.561 -25.631 -10.270 1.00 64.21 H new ATOM 0 HD12 LEU A 52 -9.424 -27.135 -9.868 1.00 64.21 H new ATOM 0 HD13 LEU A 52 -10.087 -26.029 -11.095 1.00 64.21 H new ATOM 0 HD21 LEU A 52 -9.448 -23.448 -9.538 1.00 62.23 H new ATOM 0 HD22 LEU A 52 -11.009 -23.761 -10.334 1.00 62.23 H new ATOM 0 HD23 LEU A 52 -10.958 -23.359 -8.601 1.00 62.23 H new ATOM 849 N ILE A 53 -11.584 -27.389 -6.200 1.00 72.10 N ATOM 850 CA ILE A 53 -10.986 -27.627 -4.892 1.00 62.55 C ATOM 851 C ILE A 53 -10.694 -29.110 -4.684 1.00 2.55 C ATOM 852 O ILE A 53 -9.625 -29.480 -4.197 1.00 53.41 O ATOM 853 CB ILE A 53 -11.899 -27.131 -3.756 1.00 52.44 C ATOM 854 CG1 ILE A 53 -12.217 -25.645 -3.941 1.00 34.41 C ATOM 855 CG2 ILE A 53 -11.244 -27.373 -2.405 1.00 64.51 C ATOM 856 CD1 ILE A 53 -13.416 -25.181 -3.144 1.00 53.32 C ATOM 0 H ILE A 53 -12.475 -26.893 -6.172 1.00 72.10 H new ATOM 0 HA ILE A 53 -10.051 -27.067 -4.865 1.00 62.55 H new ATOM 0 HB ILE A 53 -12.833 -27.691 -3.790 1.00 52.44 H new ATOM 0 HG12 ILE A 53 -11.347 -25.056 -3.650 1.00 34.41 H new ATOM 0 HG13 ILE A 53 -12.395 -25.449 -4.998 1.00 34.41 H new ATOM 0 HG21 ILE A 53 -11.902 -27.017 -1.613 1.00 64.51 H new ATOM 0 HG22 ILE A 53 -11.063 -28.440 -2.274 1.00 64.51 H new ATOM 0 HG23 ILE A 53 -10.297 -26.836 -2.359 1.00 64.51 H new ATOM 0 HD11 ILE A 53 -13.583 -24.119 -3.323 1.00 53.32 H new ATOM 0 HD12 ILE A 53 -14.297 -25.744 -3.452 1.00 53.32 H new ATOM 0 HD13 ILE A 53 -13.233 -25.346 -2.082 1.00 53.32 H new ATOM 868 N SER A 54 -11.650 -29.954 -5.056 1.00 54.22 N ATOM 869 CA SER A 54 -11.497 -31.396 -4.908 1.00 30.40 C ATOM 870 C SER A 54 -10.337 -31.909 -5.756 1.00 21.33 C ATOM 871 O SER A 54 -9.681 -32.889 -5.402 1.00 73.45 O ATOM 872 CB SER A 54 -12.790 -32.111 -5.306 1.00 64.50 C ATOM 873 OG SER A 54 -12.743 -33.483 -4.952 1.00 53.05 O ATOM 0 H SER A 54 -12.539 -29.664 -5.462 1.00 54.22 H new ATOM 0 HA SER A 54 -11.281 -31.608 -3.861 1.00 30.40 H new ATOM 0 HB2 SER A 54 -13.639 -31.634 -4.816 1.00 64.50 H new ATOM 0 HB3 SER A 54 -12.947 -32.014 -6.380 1.00 64.50 H new ATOM 0 HG SER A 54 -12.362 -33.999 -5.693 1.00 53.05 H new ATOM 879 N SER A 55 -10.090 -31.239 -6.877 1.00 4.04 N ATOM 880 CA SER A 55 -9.011 -31.628 -7.778 1.00 34.11 C ATOM 881 C SER A 55 -7.650 -31.329 -7.157 1.00 70.14 C ATOM 882 O SER A 55 -6.663 -32.010 -7.440 1.00 1.52 O ATOM 883 CB SER A 55 -9.147 -30.897 -9.115 1.00 2.22 C ATOM 884 OG SER A 55 -8.431 -31.567 -10.138 1.00 31.33 O ATOM 0 H SER A 55 -10.622 -30.424 -7.183 1.00 4.04 H new ATOM 0 HA SER A 55 -9.083 -32.702 -7.950 1.00 34.11 H new ATOM 0 HB2 SER A 55 -10.200 -30.827 -9.389 1.00 2.22 H new ATOM 0 HB3 SER A 55 -8.775 -29.877 -9.015 1.00 2.22 H new ATOM 0 HG SER A 55 -8.535 -31.081 -10.982 1.00 31.33 H new ATOM 890 N LEU A 56 -7.605 -30.307 -6.311 1.00 1.45 N ATOM 891 CA LEU A 56 -6.365 -29.916 -5.649 1.00 11.45 C ATOM 892 C LEU A 56 -5.971 -30.935 -4.585 1.00 20.14 C ATOM 893 O LEU A 56 -4.858 -30.902 -4.060 1.00 43.10 O ATOM 894 CB LEU A 56 -6.517 -28.532 -5.014 1.00 60.10 C ATOM 895 CG LEU A 56 -6.077 -27.347 -5.875 1.00 35.14 C ATOM 896 CD1 LEU A 56 -7.287 -26.564 -6.362 1.00 5.43 C ATOM 897 CD2 LEU A 56 -5.133 -26.444 -5.096 1.00 3.43 C ATOM 0 H LEU A 56 -8.412 -29.734 -6.067 1.00 1.45 H new ATOM 0 HA LEU A 56 -5.577 -29.880 -6.401 1.00 11.45 H new ATOM 0 HB2 LEU A 56 -7.564 -28.391 -4.744 1.00 60.10 H new ATOM 0 HB3 LEU A 56 -5.944 -28.515 -4.087 1.00 60.10 H new ATOM 0 HG LEU A 56 -5.544 -27.731 -6.745 1.00 35.14 H new ATOM 0 HD11 LEU A 56 -6.955 -25.725 -6.973 1.00 5.43 H new ATOM 0 HD12 LEU A 56 -7.927 -27.216 -6.957 1.00 5.43 H new ATOM 0 HD13 LEU A 56 -7.847 -26.190 -5.505 1.00 5.43 H new ATOM 0 HD21 LEU A 56 -4.830 -25.606 -5.724 1.00 3.43 H new ATOM 0 HD22 LEU A 56 -5.640 -26.067 -4.208 1.00 3.43 H new ATOM 0 HD23 LEU A 56 -4.251 -27.011 -4.797 1.00 3.43 H new ATOM 909 N VAL A 57 -6.891 -31.842 -4.272 1.00 21.22 N ATOM 910 CA VAL A 57 -6.639 -32.874 -3.273 1.00 43.00 C ATOM 911 C VAL A 57 -6.846 -34.267 -3.857 1.00 42.23 C ATOM 912 O VAL A 57 -5.884 -34.979 -4.145 1.00 71.30 O ATOM 913 CB VAL A 57 -7.554 -32.703 -2.046 1.00 3.21 C ATOM 914 CG1 VAL A 57 -6.775 -32.122 -0.875 1.00 65.45 C ATOM 915 CG2 VAL A 57 -8.747 -31.825 -2.390 1.00 54.12 C ATOM 0 H VAL A 57 -7.818 -31.883 -4.696 1.00 21.22 H new ATOM 0 HA VAL A 57 -5.600 -32.765 -2.961 1.00 43.00 H new ATOM 0 HB VAL A 57 -7.926 -33.685 -1.753 1.00 3.21 H new ATOM 0 HG11 VAL A 57 -7.438 -32.008 -0.017 1.00 65.45 H new ATOM 0 HG12 VAL A 57 -5.956 -32.793 -0.614 1.00 65.45 H new ATOM 0 HG13 VAL A 57 -6.372 -31.148 -1.153 1.00 65.45 H new ATOM 0 HG21 VAL A 57 -9.383 -31.715 -1.512 1.00 54.12 H new ATOM 0 HG22 VAL A 57 -8.396 -30.844 -2.710 1.00 54.12 H new ATOM 0 HG23 VAL A 57 -9.318 -32.286 -3.196 1.00 54.12 H new ATOM 925 N TRP A 58 -8.106 -34.648 -4.030 1.00 70.03 N ATOM 926 CA TRP A 58 -8.440 -35.957 -4.581 1.00 43.43 C ATOM 927 C TRP A 58 -8.475 -35.913 -6.105 1.00 2.11 C ATOM 928 O TRP A 58 -7.562 -36.401 -6.770 1.00 11.20 O ATOM 929 CB TRP A 58 -9.790 -36.431 -4.041 1.00 63.11 C ATOM 930 CG TRP A 58 -10.253 -37.720 -4.650 1.00 32.14 C ATOM 931 CD1 TRP A 58 -11.319 -37.895 -5.486 1.00 25.21 C ATOM 932 CD2 TRP A 58 -9.667 -39.013 -4.467 1.00 61.42 C ATOM 933 NE1 TRP A 58 -11.430 -39.220 -5.834 1.00 42.34 N ATOM 934 CE2 TRP A 58 -10.428 -39.926 -5.223 1.00 70.23 C ATOM 935 CE3 TRP A 58 -8.572 -39.489 -3.741 1.00 30.03 C ATOM 936 CZ2 TRP A 58 -10.128 -41.285 -5.271 1.00 33.12 C ATOM 937 CZ3 TRP A 58 -8.276 -40.838 -3.789 1.00 11.04 C ATOM 938 CH2 TRP A 58 -9.051 -41.723 -4.550 1.00 30.23 C ATOM 0 H TRP A 58 -8.913 -34.070 -3.797 1.00 70.03 H new ATOM 0 HA TRP A 58 -7.667 -36.661 -4.274 1.00 43.43 H new ATOM 0 HB2 TRP A 58 -9.719 -36.553 -2.960 1.00 63.11 H new ATOM 0 HB3 TRP A 58 -10.538 -35.660 -4.226 1.00 63.11 H new ATOM 0 HD1 TRP A 58 -11.977 -37.108 -5.824 1.00 25.21 H new ATOM 0 HE1 TRP A 58 -12.143 -39.614 -6.448 1.00 42.34 H new ATOM 0 HE3 TRP A 58 -7.968 -38.814 -3.153 1.00 30.03 H new ATOM 0 HZ2 TRP A 58 -10.724 -41.969 -5.857 1.00 33.12 H new ATOM 0 HZ3 TRP A 58 -7.433 -41.217 -3.230 1.00 11.04 H new ATOM 0 HH2 TRP A 58 -8.793 -42.772 -4.568 1.00 30.23 H new ATOM 949 N ASN A 59 -9.534 -35.325 -6.652 1.00 31.04 N ATOM 950 CA ASN A 59 -9.687 -35.218 -8.098 1.00 34.20 C ATOM 951 C ASN A 59 -10.889 -34.348 -8.455 1.00 23.01 C ATOM 952 O ASN A 59 -11.681 -33.980 -7.588 1.00 21.51 O ATOM 953 CB ASN A 59 -9.847 -36.607 -8.719 1.00 35.53 C ATOM 954 CG ASN A 59 -8.549 -37.134 -9.299 1.00 73.43 C ATOM 955 OD1 ASN A 59 -7.778 -36.388 -9.902 1.00 60.03 O ATOM 956 ND2 ASN A 59 -8.303 -38.427 -9.120 1.00 4.24 N ATOM 0 H ASN A 59 -10.299 -34.915 -6.116 1.00 31.04 H new ATOM 0 HA ASN A 59 -8.789 -34.749 -8.500 1.00 34.20 H new ATOM 0 HB2 ASN A 59 -10.211 -37.301 -7.961 1.00 35.53 H new ATOM 0 HB3 ASN A 59 -10.602 -36.566 -9.504 1.00 35.53 H new ATOM 0 HD21 ASN A 59 -7.446 -38.839 -9.489 1.00 4.24 H new ATOM 0 HD22 ASN A 59 -8.971 -39.008 -8.613 1.00 4.24 H new ATOM 963 N MET A 60 -11.017 -34.023 -9.737 1.00 62.12 N ATOM 964 CA MET A 60 -12.123 -33.198 -10.209 1.00 44.41 C ATOM 965 C MET A 60 -13.311 -34.062 -10.617 1.00 32.44 C ATOM 966 O MET A 60 -13.893 -33.871 -11.684 1.00 24.32 O ATOM 967 CB MET A 60 -11.675 -32.335 -11.391 1.00 72.51 C ATOM 968 CG MET A 60 -11.241 -33.144 -12.603 1.00 0.10 C ATOM 969 SD MET A 60 -10.075 -32.253 -13.650 1.00 64.15 S ATOM 970 CE MET A 60 -11.032 -32.083 -15.155 1.00 30.13 C ATOM 0 H MET A 60 -10.369 -34.318 -10.467 1.00 62.12 H new ATOM 0 HA MET A 60 -12.434 -32.548 -9.391 1.00 44.41 H new ATOM 0 HB2 MET A 60 -12.493 -31.675 -11.679 1.00 72.51 H new ATOM 0 HB3 MET A 60 -10.849 -31.699 -11.074 1.00 72.51 H new ATOM 0 HG2 MET A 60 -10.785 -34.076 -12.269 1.00 0.10 H new ATOM 0 HG3 MET A 60 -12.120 -33.412 -13.190 1.00 0.10 H new ATOM 0 HE1 MET A 60 -10.444 -31.550 -15.902 1.00 30.13 H new ATOM 0 HE2 MET A 60 -11.291 -33.071 -15.535 1.00 30.13 H new ATOM 0 HE3 MET A 60 -11.944 -31.524 -14.945 1.00 30.13 H new ATOM 980 N ASN A 61 -13.666 -35.014 -9.759 1.00 74.15 N ATOM 981 CA ASN A 61 -14.786 -35.909 -10.032 1.00 4.25 C ATOM 982 C ASN A 61 -16.049 -35.117 -10.355 1.00 42.14 C ATOM 983 O ASN A 61 -16.342 -34.107 -9.716 1.00 15.14 O ATOM 984 CB ASN A 61 -15.037 -36.824 -8.831 1.00 54.24 C ATOM 985 CG ASN A 61 -14.177 -38.072 -8.866 1.00 34.33 C ATOM 986 OD1 ASN A 61 -12.982 -38.008 -9.152 1.00 23.23 O ATOM 987 ND2 ASN A 61 -14.784 -39.217 -8.574 1.00 13.24 N ATOM 0 H ASN A 61 -13.195 -35.185 -8.870 1.00 74.15 H new ATOM 0 HA ASN A 61 -14.530 -36.519 -10.899 1.00 4.25 H new ATOM 0 HB2 ASN A 61 -14.838 -36.274 -7.911 1.00 54.24 H new ATOM 0 HB3 ASN A 61 -16.088 -37.111 -8.810 1.00 54.24 H new ATOM 0 HD21 ASN A 61 -14.257 -40.090 -8.581 1.00 13.24 H new ATOM 0 HD22 ASN A 61 -15.777 -39.223 -8.342 1.00 13.24 H new ATOM 994 N PHE A 62 -16.793 -35.583 -11.353 1.00 11.12 N ATOM 995 CA PHE A 62 -18.025 -34.919 -11.763 1.00 1.45 C ATOM 996 C PHE A 62 -19.238 -35.565 -11.100 1.00 2.15 C ATOM 997 O PHE A 62 -20.349 -35.512 -11.627 1.00 62.44 O ATOM 998 CB PHE A 62 -18.174 -34.969 -13.284 1.00 55.54 C ATOM 999 CG PHE A 62 -17.330 -33.955 -14.003 1.00 74.33 C ATOM 1000 CD1 PHE A 62 -17.408 -32.611 -13.676 1.00 33.45 C ATOM 1001 CD2 PHE A 62 -16.459 -34.347 -15.007 1.00 54.23 C ATOM 1002 CE1 PHE A 62 -16.633 -31.676 -14.335 1.00 24.32 C ATOM 1003 CE2 PHE A 62 -15.681 -33.416 -15.670 1.00 31.53 C ATOM 1004 CZ PHE A 62 -15.769 -32.080 -15.334 1.00 4.50 C ATOM 0 H PHE A 62 -16.564 -36.418 -11.893 1.00 11.12 H new ATOM 0 HA PHE A 62 -17.971 -33.878 -11.444 1.00 1.45 H new ATOM 0 HB2 PHE A 62 -17.907 -35.966 -13.635 1.00 55.54 H new ATOM 0 HB3 PHE A 62 -19.220 -34.809 -13.544 1.00 55.54 H new ATOM 0 HD1 PHE A 62 -18.083 -32.290 -12.896 1.00 33.45 H new ATOM 0 HD2 PHE A 62 -16.387 -35.391 -15.274 1.00 54.23 H new ATOM 0 HE1 PHE A 62 -16.703 -30.631 -14.070 1.00 24.32 H new ATOM 0 HE2 PHE A 62 -15.005 -33.734 -16.450 1.00 31.53 H new ATOM 0 HZ PHE A 62 -15.163 -31.351 -15.852 1.00 4.50 H new ATOM 1014 N ASP A 63 -19.016 -36.174 -9.940 1.00 61.32 N ATOM 1015 CA ASP A 63 -20.090 -36.831 -9.204 1.00 3.13 C ATOM 1016 C ASP A 63 -20.090 -36.397 -7.741 1.00 52.43 C ATOM 1017 O ASP A 63 -19.260 -35.590 -7.323 1.00 12.32 O ATOM 1018 CB ASP A 63 -19.946 -38.351 -9.297 1.00 51.32 C ATOM 1019 CG ASP A 63 -20.089 -38.859 -10.718 1.00 72.42 C ATOM 1020 OD1 ASP A 63 -19.169 -38.623 -11.529 1.00 52.41 O ATOM 1021 OD2 ASP A 63 -21.121 -39.495 -11.019 1.00 62.22 O ATOM 0 H ASP A 63 -18.102 -36.226 -9.489 1.00 61.32 H new ATOM 0 HA ASP A 63 -21.038 -36.536 -9.653 1.00 3.13 H new ATOM 0 HB2 ASP A 63 -18.973 -38.646 -8.905 1.00 51.32 H new ATOM 0 HB3 ASP A 63 -20.700 -38.824 -8.667 1.00 51.32 H new ATOM 1026 N SER A 64 -21.028 -36.937 -6.969 1.00 42.42 N ATOM 1027 CA SER A 64 -21.140 -36.601 -5.554 1.00 64.35 C ATOM 1028 C SER A 64 -19.925 -37.103 -4.780 1.00 2.14 C ATOM 1029 O SER A 64 -19.779 -38.302 -4.540 1.00 53.30 O ATOM 1030 CB SER A 64 -22.418 -37.202 -4.966 1.00 3.42 C ATOM 1031 OG SER A 64 -23.552 -36.424 -5.310 1.00 24.33 O ATOM 0 H SER A 64 -21.721 -37.609 -7.299 1.00 42.42 H new ATOM 0 HA SER A 64 -21.183 -35.516 -5.465 1.00 64.35 H new ATOM 0 HB2 SER A 64 -22.547 -38.220 -5.332 1.00 3.42 H new ATOM 0 HB3 SER A 64 -22.330 -37.262 -3.881 1.00 3.42 H new ATOM 0 HG SER A 64 -24.356 -36.830 -4.924 1.00 24.33 H new ATOM 1037 N ASP A 65 -19.056 -36.177 -4.391 1.00 5.22 N ATOM 1038 CA ASP A 65 -17.853 -36.523 -3.642 1.00 31.21 C ATOM 1039 C ASP A 65 -18.104 -36.436 -2.140 1.00 14.02 C ATOM 1040 O ASP A 65 -17.300 -35.874 -1.396 1.00 1.02 O ATOM 1041 CB ASP A 65 -16.699 -35.599 -4.033 1.00 1.10 C ATOM 1042 CG ASP A 65 -16.131 -35.929 -5.399 1.00 43.53 C ATOM 1043 OD1 ASP A 65 -15.582 -37.039 -5.561 1.00 54.53 O ATOM 1044 OD2 ASP A 65 -16.234 -35.076 -6.306 1.00 65.05 O ATOM 0 H ASP A 65 -19.162 -35.181 -4.582 1.00 5.22 H new ATOM 0 HA ASP A 65 -17.585 -37.550 -3.888 1.00 31.21 H new ATOM 0 HB2 ASP A 65 -17.047 -34.566 -4.027 1.00 1.10 H new ATOM 0 HB3 ASP A 65 -15.909 -35.674 -3.286 1.00 1.10 H new ATOM 1049 N THR A 66 -19.227 -36.995 -1.699 1.00 54.02 N ATOM 1050 CA THR A 66 -19.586 -36.979 -0.287 1.00 13.42 C ATOM 1051 C THR A 66 -19.291 -35.621 0.340 1.00 54.53 C ATOM 1052 O THR A 66 -18.913 -35.534 1.507 1.00 35.12 O ATOM 1053 CB THR A 66 -18.831 -38.068 0.498 1.00 42.05 C ATOM 1054 OG1 THR A 66 -19.314 -38.126 1.844 1.00 32.31 O ATOM 1055 CG2 THR A 66 -17.335 -37.793 0.502 1.00 43.52 C ATOM 0 H THR A 66 -19.904 -37.465 -2.301 1.00 54.02 H new ATOM 0 HA THR A 66 -20.656 -37.178 -0.232 1.00 13.42 H new ATOM 0 HB THR A 66 -19.007 -39.026 0.008 1.00 42.05 H new ATOM 0 HG1 THR A 66 -19.362 -37.220 2.214 1.00 32.31 H new ATOM 0 HG21 THR A 66 -16.823 -38.575 1.062 1.00 43.52 H new ATOM 0 HG22 THR A 66 -16.965 -37.779 -0.523 1.00 43.52 H new ATOM 0 HG23 THR A 66 -17.144 -36.827 0.970 1.00 43.52 H new ATOM 1063 N ASN A 67 -19.467 -34.562 -0.444 1.00 54.31 N ATOM 1064 CA ASN A 67 -19.220 -33.207 0.035 1.00 40.41 C ATOM 1065 C ASN A 67 -17.918 -33.139 0.828 1.00 73.11 C ATOM 1066 O ASN A 67 -17.833 -32.450 1.845 1.00 70.05 O ATOM 1067 CB ASN A 67 -20.385 -32.730 0.904 1.00 12.14 C ATOM 1068 CG ASN A 67 -21.734 -33.044 0.286 1.00 30.13 C ATOM 1069 OD1 ASN A 67 -22.146 -32.411 -0.686 1.00 33.31 O ATOM 1070 ND2 ASN A 67 -22.429 -34.026 0.850 1.00 44.33 N ATOM 0 H ASN A 67 -19.780 -34.616 -1.413 1.00 54.31 H new ATOM 0 HA ASN A 67 -19.131 -32.553 -0.832 1.00 40.41 H new ATOM 0 HB2 ASN A 67 -20.319 -33.201 1.885 1.00 12.14 H new ATOM 0 HB3 ASN A 67 -20.302 -31.654 1.060 1.00 12.14 H new ATOM 0 HD21 ASN A 67 -23.344 -34.282 0.478 1.00 44.33 H new ATOM 0 HD22 ASN A 67 -22.048 -34.524 1.655 1.00 44.33 H new ATOM 1077 N VAL A 68 -16.906 -33.859 0.355 1.00 22.24 N ATOM 1078 CA VAL A 68 -15.608 -33.880 1.019 1.00 64.34 C ATOM 1079 C VAL A 68 -15.061 -32.469 1.202 1.00 13.21 C ATOM 1080 O VAL A 68 -14.304 -32.202 2.136 1.00 62.24 O ATOM 1081 CB VAL A 68 -14.585 -34.715 0.225 1.00 73.40 C ATOM 1082 CG1 VAL A 68 -14.368 -34.120 -1.158 1.00 20.41 C ATOM 1083 CG2 VAL A 68 -13.271 -34.812 0.986 1.00 54.35 C ATOM 0 H VAL A 68 -16.960 -34.435 -0.485 1.00 22.24 H new ATOM 0 HA VAL A 68 -15.760 -34.338 1.997 1.00 64.34 H new ATOM 0 HB VAL A 68 -14.982 -35.723 0.102 1.00 73.40 H new ATOM 0 HG11 VAL A 68 -13.642 -34.723 -1.704 1.00 20.41 H new ATOM 0 HG12 VAL A 68 -15.313 -34.109 -1.702 1.00 20.41 H new ATOM 0 HG13 VAL A 68 -13.993 -33.101 -1.061 1.00 20.41 H new ATOM 0 HG21 VAL A 68 -12.560 -35.405 0.411 1.00 54.35 H new ATOM 0 HG22 VAL A 68 -12.866 -33.812 1.142 1.00 54.35 H new ATOM 0 HG23 VAL A 68 -13.444 -35.288 1.951 1.00 54.35 H new ATOM 1093 N ILE A 69 -15.451 -31.568 0.306 1.00 61.50 N ATOM 1094 CA ILE A 69 -15.001 -30.183 0.370 1.00 33.42 C ATOM 1095 C ILE A 69 -15.665 -29.443 1.526 1.00 33.02 C ATOM 1096 O ILE A 69 -14.989 -28.914 2.408 1.00 3.40 O ATOM 1097 CB ILE A 69 -15.297 -29.434 -0.942 1.00 74.03 C ATOM 1098 CG1 ILE A 69 -14.614 -30.133 -2.119 1.00 43.34 C ATOM 1099 CG2 ILE A 69 -14.840 -27.987 -0.840 1.00 52.54 C ATOM 1100 CD1 ILE A 69 -13.117 -30.275 -1.951 1.00 51.22 C ATOM 0 H ILE A 69 -16.077 -31.773 -0.473 1.00 61.50 H new ATOM 0 HA ILE A 69 -13.923 -30.208 0.529 1.00 33.42 H new ATOM 0 HB ILE A 69 -16.373 -29.443 -1.114 1.00 74.03 H new ATOM 0 HG12 ILE A 69 -15.053 -31.123 -2.248 1.00 43.34 H new ATOM 0 HG13 ILE A 69 -14.818 -29.573 -3.032 1.00 43.34 H new ATOM 0 HG21 ILE A 69 -15.056 -27.470 -1.775 1.00 52.54 H new ATOM 0 HG22 ILE A 69 -15.369 -27.495 -0.023 1.00 52.54 H new ATOM 0 HG23 ILE A 69 -13.767 -27.957 -0.648 1.00 52.54 H new ATOM 0 HD11 ILE A 69 -12.699 -30.779 -2.822 1.00 51.22 H new ATOM 0 HD12 ILE A 69 -12.667 -29.287 -1.853 1.00 51.22 H new ATOM 0 HD13 ILE A 69 -12.905 -30.861 -1.057 1.00 51.22 H new ATOM 1112 N ASP A 70 -16.993 -29.411 1.516 1.00 33.52 N ATOM 1113 CA ASP A 70 -17.750 -28.739 2.566 1.00 50.55 C ATOM 1114 C ASP A 70 -17.490 -29.385 3.923 1.00 74.14 C ATOM 1115 O ASP A 70 -17.466 -28.708 4.950 1.00 2.33 O ATOM 1116 CB ASP A 70 -19.246 -28.774 2.248 1.00 43.43 C ATOM 1117 CG ASP A 70 -19.992 -27.598 2.846 1.00 15.13 C ATOM 1118 OD1 ASP A 70 -19.431 -26.483 2.859 1.00 43.12 O ATOM 1119 OD2 ASP A 70 -21.139 -27.793 3.303 1.00 5.13 O ATOM 0 H ASP A 70 -17.568 -29.843 0.792 1.00 33.52 H new ATOM 0 HA ASP A 70 -17.420 -27.701 2.610 1.00 50.55 H new ATOM 0 HB2 ASP A 70 -19.385 -28.777 1.167 1.00 43.43 H new ATOM 0 HB3 ASP A 70 -19.673 -29.702 2.627 1.00 43.43 H new ATOM 1124 N VAL A 71 -17.298 -30.700 3.919 1.00 72.53 N ATOM 1125 CA VAL A 71 -17.041 -31.439 5.149 1.00 25.11 C ATOM 1126 C VAL A 71 -15.620 -31.199 5.647 1.00 2.41 C ATOM 1127 O VAL A 71 -15.354 -31.257 6.847 1.00 24.21 O ATOM 1128 CB VAL A 71 -17.254 -32.951 4.951 1.00 33.51 C ATOM 1129 CG1 VAL A 71 -16.930 -33.709 6.230 1.00 51.32 C ATOM 1130 CG2 VAL A 71 -18.680 -33.233 4.502 1.00 71.22 C ATOM 0 H VAL A 71 -17.316 -31.276 3.077 1.00 72.53 H new ATOM 0 HA VAL A 71 -17.751 -31.074 5.891 1.00 25.11 H new ATOM 0 HB VAL A 71 -16.576 -33.296 4.171 1.00 33.51 H new ATOM 0 HG11 VAL A 71 -17.087 -34.776 6.070 1.00 51.32 H new ATOM 0 HG12 VAL A 71 -15.890 -33.532 6.504 1.00 51.32 H new ATOM 0 HG13 VAL A 71 -17.581 -33.363 7.033 1.00 51.32 H new ATOM 0 HG21 VAL A 71 -18.813 -34.306 4.367 1.00 71.22 H new ATOM 0 HG22 VAL A 71 -19.377 -32.873 5.258 1.00 71.22 H new ATOM 0 HG23 VAL A 71 -18.872 -32.722 3.559 1.00 71.22 H new ATOM 1140 N ALA A 72 -14.711 -30.927 4.717 1.00 65.34 N ATOM 1141 CA ALA A 72 -13.317 -30.675 5.061 1.00 22.20 C ATOM 1142 C ALA A 72 -13.156 -29.322 5.745 1.00 55.30 C ATOM 1143 O ALA A 72 -12.365 -29.175 6.676 1.00 25.20 O ATOM 1144 CB ALA A 72 -12.444 -30.746 3.817 1.00 74.55 C ATOM 0 H ALA A 72 -14.915 -30.875 3.719 1.00 65.34 H new ATOM 0 HA ALA A 72 -12.997 -31.447 5.760 1.00 22.20 H new ATOM 0 HB1 ALA A 72 -11.406 -30.556 4.090 1.00 74.55 H new ATOM 0 HB2 ALA A 72 -12.526 -31.737 3.371 1.00 74.55 H new ATOM 0 HB3 ALA A 72 -12.774 -29.996 3.098 1.00 74.55 H new ATOM 1150 N VAL A 73 -13.913 -28.334 5.277 1.00 42.12 N ATOM 1151 CA VAL A 73 -13.855 -26.992 5.844 1.00 43.13 C ATOM 1152 C VAL A 73 -14.607 -26.922 7.168 1.00 3.20 C ATOM 1153 O VAL A 73 -14.217 -26.188 8.076 1.00 15.35 O ATOM 1154 CB VAL A 73 -14.443 -25.948 4.876 1.00 0.11 C ATOM 1155 CG1 VAL A 73 -15.886 -26.288 4.536 1.00 11.24 C ATOM 1156 CG2 VAL A 73 -14.342 -24.552 5.473 1.00 65.32 C ATOM 0 H VAL A 73 -14.573 -28.438 4.507 1.00 42.12 H new ATOM 0 HA VAL A 73 -12.803 -26.766 6.015 1.00 43.13 H new ATOM 0 HB VAL A 73 -13.863 -25.967 3.953 1.00 0.11 H new ATOM 0 HG11 VAL A 73 -16.285 -25.539 3.851 1.00 11.24 H new ATOM 0 HG12 VAL A 73 -15.927 -27.270 4.064 1.00 11.24 H new ATOM 0 HG13 VAL A 73 -16.482 -26.299 5.449 1.00 11.24 H new ATOM 0 HG21 VAL A 73 -14.762 -23.827 4.776 1.00 65.32 H new ATOM 0 HG22 VAL A 73 -14.896 -24.516 6.411 1.00 65.32 H new ATOM 0 HG23 VAL A 73 -13.296 -24.311 5.660 1.00 65.32 H new ATOM 1166 N ARG A 74 -15.686 -27.691 7.271 1.00 42.21 N ATOM 1167 CA ARG A 74 -16.493 -27.716 8.484 1.00 15.44 C ATOM 1168 C ARG A 74 -15.789 -28.496 9.590 1.00 32.23 C ATOM 1169 O ARG A 74 -15.818 -28.103 10.756 1.00 14.15 O ATOM 1170 CB ARG A 74 -17.862 -28.337 8.199 1.00 10.30 C ATOM 1171 CG ARG A 74 -18.769 -27.453 7.358 1.00 3.23 C ATOM 1172 CD ARG A 74 -19.298 -26.274 8.161 1.00 62.42 C ATOM 1173 NE ARG A 74 -20.696 -25.985 7.852 1.00 24.41 N ATOM 1174 CZ ARG A 74 -21.714 -26.700 8.317 1.00 21.34 C ATOM 1175 NH1 ARG A 74 -21.491 -27.741 9.109 1.00 52.52 N ATOM 1176 NH2 ARG A 74 -22.958 -26.375 7.992 1.00 54.32 N ATOM 0 H ARG A 74 -16.021 -28.305 6.529 1.00 42.21 H new ATOM 0 HA ARG A 74 -16.631 -26.688 8.819 1.00 15.44 H new ATOM 0 HB2 ARG A 74 -17.720 -29.289 7.687 1.00 10.30 H new ATOM 0 HB3 ARG A 74 -18.357 -28.555 9.145 1.00 10.30 H new ATOM 0 HG2 ARG A 74 -18.220 -27.087 6.491 1.00 3.23 H new ATOM 0 HG3 ARG A 74 -19.605 -28.042 6.981 1.00 3.23 H new ATOM 0 HD2 ARG A 74 -19.198 -26.486 9.225 1.00 62.42 H new ATOM 0 HD3 ARG A 74 -18.691 -25.393 7.954 1.00 62.42 H new ATOM 0 HE ARG A 74 -20.902 -25.191 7.246 1.00 24.41 H new ATOM 0 HH11 ARG A 74 -20.536 -27.994 9.362 1.00 52.52 H new ATOM 0 HH12 ARG A 74 -22.275 -28.288 9.465 1.00 52.52 H new ATOM 0 HH21 ARG A 74 -23.134 -25.575 7.384 1.00 54.32 H new ATOM 0 HH22 ARG A 74 -23.739 -26.925 8.350 1.00 54.32 H new ATOM 1190 N ARG A 75 -15.158 -29.604 9.216 1.00 42.04 N ATOM 1191 CA ARG A 75 -14.448 -30.441 10.176 1.00 41.45 C ATOM 1192 C ARG A 75 -13.208 -29.727 10.707 1.00 54.33 C ATOM 1193 O ARG A 75 -12.898 -29.800 11.897 1.00 74.24 O ATOM 1194 CB ARG A 75 -14.047 -31.768 9.529 1.00 33.02 C ATOM 1195 CG ARG A 75 -12.956 -31.630 8.480 1.00 11.22 C ATOM 1196 CD ARG A 75 -12.649 -32.963 7.816 1.00 32.15 C ATOM 1197 NE ARG A 75 -12.070 -33.921 8.754 1.00 10.05 N ATOM 1198 CZ ARG A 75 -11.907 -35.211 8.481 1.00 0.41 C ATOM 1199 NH1 ARG A 75 -12.277 -35.694 7.303 1.00 11.12 N ATOM 1200 NH2 ARG A 75 -11.372 -36.020 9.387 1.00 52.43 N ATOM 0 H ARG A 75 -15.124 -29.943 8.255 1.00 42.04 H new ATOM 0 HA ARG A 75 -15.118 -30.640 11.012 1.00 41.45 H new ATOM 0 HB2 ARG A 75 -13.707 -32.453 10.306 1.00 33.02 H new ATOM 0 HB3 ARG A 75 -14.927 -32.218 9.069 1.00 33.02 H new ATOM 0 HG2 ARG A 75 -13.266 -30.909 7.724 1.00 11.22 H new ATOM 0 HG3 ARG A 75 -12.051 -31.237 8.944 1.00 11.22 H new ATOM 0 HD2 ARG A 75 -13.565 -33.377 7.394 1.00 32.15 H new ATOM 0 HD3 ARG A 75 -11.959 -32.805 6.987 1.00 32.15 H new ATOM 0 HE ARG A 75 -11.774 -33.581 9.669 1.00 10.05 H new ATOM 0 HH11 ARG A 75 -12.688 -35.075 6.604 1.00 11.12 H new ATOM 0 HH12 ARG A 75 -12.151 -36.685 7.096 1.00 11.12 H new ATOM 0 HH21 ARG A 75 -11.086 -35.652 10.294 1.00 52.43 H new ATOM 0 HH22 ARG A 75 -11.247 -37.010 9.176 1.00 52.43 H new ATOM 1214 N LEU A 76 -12.503 -29.037 9.817 1.00 2.24 N ATOM 1215 CA LEU A 76 -11.296 -28.309 10.196 1.00 73.40 C ATOM 1216 C LEU A 76 -11.643 -27.062 11.003 1.00 61.31 C ATOM 1217 O LEU A 76 -10.901 -26.667 11.903 1.00 72.05 O ATOM 1218 CB LEU A 76 -10.500 -27.919 8.949 1.00 30.35 C ATOM 1219 CG LEU A 76 -10.790 -26.532 8.375 1.00 60.33 C ATOM 1220 CD1 LEU A 76 -10.010 -25.468 9.130 1.00 13.45 C ATOM 1221 CD2 LEU A 76 -10.455 -26.489 6.891 1.00 64.10 C ATOM 0 H LEU A 76 -12.746 -28.966 8.829 1.00 2.24 H new ATOM 0 HA LEU A 76 -10.686 -28.964 10.819 1.00 73.40 H new ATOM 0 HB2 LEU A 76 -9.438 -27.977 9.187 1.00 30.35 H new ATOM 0 HB3 LEU A 76 -10.693 -28.659 8.173 1.00 30.35 H new ATOM 0 HG LEU A 76 -11.854 -26.326 8.494 1.00 60.33 H new ATOM 0 HD11 LEU A 76 -10.229 -24.488 8.707 1.00 13.45 H new ATOM 0 HD12 LEU A 76 -10.298 -25.483 10.181 1.00 13.45 H new ATOM 0 HD13 LEU A 76 -8.942 -25.670 9.044 1.00 13.45 H new ATOM 0 HD21 LEU A 76 -10.667 -25.494 6.499 1.00 64.10 H new ATOM 0 HD22 LEU A 76 -9.398 -26.717 6.750 1.00 64.10 H new ATOM 0 HD23 LEU A 76 -11.059 -27.225 6.360 1.00 64.10 H new ATOM 1233 N ARG A 77 -12.775 -26.448 10.676 1.00 33.22 N ATOM 1234 CA ARG A 77 -13.221 -25.247 11.371 1.00 1.43 C ATOM 1235 C ARG A 77 -13.522 -25.546 12.837 1.00 73.43 C ATOM 1236 O ARG A 77 -13.130 -24.794 13.728 1.00 4.12 O ATOM 1237 CB ARG A 77 -14.464 -24.670 10.691 1.00 10.25 C ATOM 1238 CG ARG A 77 -14.912 -23.337 11.270 1.00 64.41 C ATOM 1239 CD ARG A 77 -15.981 -23.523 12.334 1.00 35.44 C ATOM 1240 NE ARG A 77 -17.205 -24.103 11.786 1.00 44.23 N ATOM 1241 CZ ARG A 77 -18.193 -24.579 12.535 1.00 23.01 C ATOM 1242 NH1 ARG A 77 -18.102 -24.544 13.857 1.00 31.44 N ATOM 1243 NH2 ARG A 77 -19.274 -25.091 11.962 1.00 54.22 N ATOM 0 H ARG A 77 -13.400 -26.763 9.934 1.00 33.22 H new ATOM 0 HA ARG A 77 -12.417 -24.513 11.326 1.00 1.43 H new ATOM 0 HB2 ARG A 77 -14.261 -24.545 9.627 1.00 10.25 H new ATOM 0 HB3 ARG A 77 -15.281 -25.387 10.777 1.00 10.25 H new ATOM 0 HG2 ARG A 77 -14.055 -22.820 11.701 1.00 64.41 H new ATOM 0 HG3 ARG A 77 -15.298 -22.704 10.471 1.00 64.41 H new ATOM 0 HD2 ARG A 77 -15.597 -24.168 13.125 1.00 35.44 H new ATOM 0 HD3 ARG A 77 -16.209 -22.560 12.791 1.00 35.44 H new ATOM 0 HE ARG A 77 -17.306 -24.145 10.772 1.00 44.23 H new ATOM 0 HH11 ARG A 77 -17.272 -24.151 14.301 1.00 31.44 H new ATOM 0 HH12 ARG A 77 -18.862 -24.910 14.430 1.00 31.44 H new ATOM 0 HH21 ARG A 77 -19.347 -25.119 10.945 1.00 54.22 H new ATOM 0 HH22 ARG A 77 -20.032 -25.456 12.538 1.00 54.22 H new ATOM 1257 N SER A 78 -14.222 -26.650 13.078 1.00 73.42 N ATOM 1258 CA SER A 78 -14.580 -27.048 14.434 1.00 13.54 C ATOM 1259 C SER A 78 -13.408 -27.736 15.126 1.00 3.02 C ATOM 1260 O SER A 78 -13.509 -28.151 16.281 1.00 72.42 O ATOM 1261 CB SER A 78 -15.793 -27.980 14.412 1.00 20.02 C ATOM 1262 OG SER A 78 -16.307 -28.179 15.718 1.00 54.14 O ATOM 0 H SER A 78 -14.553 -27.285 12.351 1.00 73.42 H new ATOM 0 HA SER A 78 -14.833 -26.148 14.995 1.00 13.54 H new ATOM 0 HB2 SER A 78 -16.569 -27.558 13.773 1.00 20.02 H new ATOM 0 HB3 SER A 78 -15.511 -28.940 13.979 1.00 20.02 H new ATOM 0 HG SER A 78 -15.565 -28.304 16.346 1.00 54.14 H new ATOM 1268 N LYS A 79 -12.294 -27.854 14.412 1.00 43.44 N ATOM 1269 CA LYS A 79 -11.100 -28.490 14.955 1.00 65.15 C ATOM 1270 C LYS A 79 -10.287 -27.503 15.786 1.00 44.55 C ATOM 1271 O LYS A 79 -9.637 -27.884 16.759 1.00 23.23 O ATOM 1272 CB LYS A 79 -10.237 -29.052 13.822 1.00 5.24 C ATOM 1273 CG LYS A 79 -10.157 -30.569 13.813 1.00 11.43 C ATOM 1274 CD LYS A 79 -9.533 -31.087 12.528 1.00 13.33 C ATOM 1275 CE LYS A 79 -9.365 -32.598 12.560 1.00 32.01 C ATOM 1276 NZ LYS A 79 -10.631 -33.289 12.930 1.00 75.35 N ATOM 0 H LYS A 79 -12.193 -27.517 13.455 1.00 43.44 H new ATOM 0 HA LYS A 79 -11.417 -29.307 15.603 1.00 65.15 H new ATOM 0 HB2 LYS A 79 -10.639 -28.712 12.868 1.00 5.24 H new ATOM 0 HB3 LYS A 79 -9.230 -28.644 13.907 1.00 5.24 H new ATOM 0 HG2 LYS A 79 -9.570 -30.908 14.666 1.00 11.43 H new ATOM 0 HG3 LYS A 79 -11.157 -30.988 13.928 1.00 11.43 H new ATOM 0 HD2 LYS A 79 -10.158 -30.807 11.680 1.00 13.33 H new ATOM 0 HD3 LYS A 79 -8.562 -30.615 12.378 1.00 13.33 H new ATOM 0 HE2 LYS A 79 -9.033 -32.947 11.582 1.00 32.01 H new ATOM 0 HE3 LYS A 79 -8.585 -32.862 13.274 1.00 32.01 H new ATOM 0 HZ1 LYS A 79 -10.543 -34.306 12.730 1.00 75.35 H new ATOM 0 HZ2 LYS A 79 -10.819 -33.151 13.944 1.00 75.35 H new ATOM 0 HZ3 LYS A 79 -11.417 -32.894 12.375 1.00 75.35 H new ATOM 1290 N ILE A 80 -10.329 -26.233 15.396 1.00 41.02 N ATOM 1291 CA ILE A 80 -9.598 -25.191 16.107 1.00 72.41 C ATOM 1292 C ILE A 80 -10.375 -23.879 16.110 1.00 33.33 C ATOM 1293 O ILE A 80 -10.413 -23.171 17.117 1.00 71.04 O ATOM 1294 CB ILE A 80 -8.210 -24.951 15.483 1.00 35.45 C ATOM 1295 CG1 ILE A 80 -7.583 -23.679 16.057 1.00 64.40 C ATOM 1296 CG2 ILE A 80 -8.319 -24.859 13.969 1.00 51.42 C ATOM 1297 CD1 ILE A 80 -7.811 -22.454 15.201 1.00 52.34 C ATOM 0 H ILE A 80 -10.861 -25.901 14.592 1.00 41.02 H new ATOM 0 HA ILE A 80 -9.471 -25.538 17.132 1.00 72.41 H new ATOM 0 HB ILE A 80 -7.565 -25.794 15.730 1.00 35.45 H new ATOM 0 HG12 ILE A 80 -7.992 -23.499 17.051 1.00 64.40 H new ATOM 0 HG13 ILE A 80 -6.511 -23.834 16.177 1.00 64.40 H new ATOM 0 HG21 ILE A 80 -7.330 -24.689 13.543 1.00 51.42 H new ATOM 0 HG22 ILE A 80 -8.729 -25.790 13.576 1.00 51.42 H new ATOM 0 HG23 ILE A 80 -8.976 -24.032 13.701 1.00 51.42 H new ATOM 0 HD11 ILE A 80 -7.339 -21.590 15.669 1.00 52.34 H new ATOM 0 HD12 ILE A 80 -7.377 -22.614 14.214 1.00 52.34 H new ATOM 0 HD13 ILE A 80 -8.881 -22.273 15.102 1.00 52.34 H new ATOM 1309 N ASP A 81 -10.995 -23.563 14.979 1.00 13.50 N ATOM 1310 CA ASP A 81 -11.775 -22.337 14.852 1.00 41.32 C ATOM 1311 C ASP A 81 -13.031 -22.400 15.715 1.00 54.35 C ATOM 1312 O ASP A 81 -13.671 -21.380 15.972 1.00 74.11 O ATOM 1313 CB ASP A 81 -12.156 -22.099 13.390 1.00 74.12 C ATOM 1314 CG ASP A 81 -11.362 -20.972 12.760 1.00 64.32 C ATOM 1315 OD1 ASP A 81 -10.116 -20.999 12.855 1.00 54.24 O ATOM 1316 OD2 ASP A 81 -11.985 -20.064 12.171 1.00 24.33 O ATOM 0 H ASP A 81 -10.973 -24.138 14.137 1.00 13.50 H new ATOM 0 HA ASP A 81 -11.160 -21.507 15.199 1.00 41.32 H new ATOM 0 HB2 ASP A 81 -11.994 -23.015 12.822 1.00 74.12 H new ATOM 0 HB3 ASP A 81 -13.220 -21.869 13.328 1.00 74.12 H new ATOM 1321 N ASP A 82 -13.379 -23.603 16.157 1.00 30.01 N ATOM 1322 CA ASP A 82 -14.559 -23.799 16.991 1.00 32.50 C ATOM 1323 C ASP A 82 -14.552 -22.840 18.177 1.00 32.32 C ATOM 1324 O ASP A 82 -15.607 -22.433 18.665 1.00 24.55 O ATOM 1325 CB ASP A 82 -14.624 -25.244 17.488 1.00 21.51 C ATOM 1326 CG ASP A 82 -16.044 -25.769 17.559 1.00 74.33 C ATOM 1327 OD1 ASP A 82 -16.803 -25.559 16.589 1.00 21.54 O ATOM 1328 OD2 ASP A 82 -16.398 -26.389 18.584 1.00 70.21 O ATOM 0 H ASP A 82 -12.861 -24.457 15.952 1.00 30.01 H new ATOM 0 HA ASP A 82 -15.441 -23.591 16.385 1.00 32.50 H new ATOM 0 HB2 ASP A 82 -14.038 -25.880 16.825 1.00 21.51 H new ATOM 0 HB3 ASP A 82 -14.167 -25.306 18.476 1.00 21.51 H new ATOM 1333 N ASP A 83 -13.358 -22.484 18.636 1.00 4.01 N ATOM 1334 CA ASP A 83 -13.213 -21.573 19.765 1.00 0.44 C ATOM 1335 C ASP A 83 -11.973 -20.699 19.603 1.00 12.40 C ATOM 1336 O ASP A 83 -11.222 -20.486 20.555 1.00 11.40 O ATOM 1337 CB ASP A 83 -13.130 -22.358 21.075 1.00 35.30 C ATOM 1338 CG ASP A 83 -13.302 -21.472 22.293 1.00 23.44 C ATOM 1339 OD1 ASP A 83 -14.226 -20.633 22.291 1.00 41.23 O ATOM 1340 OD2 ASP A 83 -12.511 -21.618 23.249 1.00 31.22 O ATOM 0 H ASP A 83 -12.476 -22.813 18.243 1.00 4.01 H new ATOM 0 HA ASP A 83 -14.090 -20.927 19.792 1.00 0.44 H new ATOM 0 HB2 ASP A 83 -13.898 -23.132 21.081 1.00 35.30 H new ATOM 0 HB3 ASP A 83 -12.167 -22.865 21.131 1.00 35.30 H new ATOM 1345 N PHE A 84 -11.765 -20.196 18.391 1.00 45.13 N ATOM 1346 CA PHE A 84 -10.615 -19.347 18.103 1.00 44.32 C ATOM 1347 C PHE A 84 -11.001 -18.208 17.163 1.00 22.30 C ATOM 1348 O PHE A 84 -10.760 -17.038 17.458 1.00 62.23 O ATOM 1349 CB PHE A 84 -9.486 -20.173 17.484 1.00 64.32 C ATOM 1350 CG PHE A 84 -8.577 -20.804 18.501 1.00 53.35 C ATOM 1351 CD1 PHE A 84 -9.020 -21.854 19.288 1.00 14.23 C ATOM 1352 CD2 PHE A 84 -7.280 -20.346 18.669 1.00 54.32 C ATOM 1353 CE1 PHE A 84 -8.187 -22.436 20.225 1.00 71.55 C ATOM 1354 CE2 PHE A 84 -6.443 -20.925 19.603 1.00 5.30 C ATOM 1355 CZ PHE A 84 -6.897 -21.970 20.383 1.00 63.43 C ATOM 0 H PHE A 84 -12.378 -20.361 17.592 1.00 45.13 H new ATOM 0 HA PHE A 84 -10.268 -18.918 19.043 1.00 44.32 H new ATOM 0 HB2 PHE A 84 -9.919 -20.955 16.860 1.00 64.32 H new ATOM 0 HB3 PHE A 84 -8.896 -19.533 16.828 1.00 64.32 H new ATOM 0 HD1 PHE A 84 -10.028 -22.222 19.168 1.00 14.23 H new ATOM 0 HD2 PHE A 84 -6.920 -19.528 18.063 1.00 54.32 H new ATOM 0 HE1 PHE A 84 -8.545 -23.254 20.833 1.00 71.55 H new ATOM 0 HE2 PHE A 84 -5.434 -20.560 19.723 1.00 5.30 H new ATOM 0 HZ PHE A 84 -6.244 -22.422 21.115 1.00 63.43 H new ATOM 1365 N GLU A 85 -11.601 -18.562 16.031 1.00 50.54 N ATOM 1366 CA GLU A 85 -12.019 -17.570 15.047 1.00 52.30 C ATOM 1367 C GLU A 85 -13.510 -17.698 14.745 1.00 45.21 C ATOM 1368 O GLU A 85 -14.133 -18.729 14.997 1.00 14.21 O ATOM 1369 CB GLU A 85 -11.211 -17.726 13.757 1.00 0.31 C ATOM 1370 CG GLU A 85 -10.059 -16.742 13.638 1.00 53.23 C ATOM 1371 CD GLU A 85 -9.887 -16.214 12.227 1.00 52.42 C ATOM 1372 OE1 GLU A 85 -10.008 -17.012 11.275 1.00 73.43 O ATOM 1373 OE2 GLU A 85 -9.632 -15.001 12.075 1.00 4.52 O ATOM 0 H GLU A 85 -11.808 -19.527 15.773 1.00 50.54 H new ATOM 0 HA GLU A 85 -11.834 -16.581 15.465 1.00 52.30 H new ATOM 0 HB2 GLU A 85 -10.818 -18.741 13.705 1.00 0.31 H new ATOM 0 HB3 GLU A 85 -11.877 -17.598 12.903 1.00 0.31 H new ATOM 0 HG2 GLU A 85 -10.228 -15.906 14.317 1.00 53.23 H new ATOM 0 HG3 GLU A 85 -9.136 -17.228 13.955 1.00 53.23 H new ATOM 1380 N PRO A 86 -14.095 -16.625 14.192 1.00 70.21 N ATOM 1381 CA PRO A 86 -15.519 -16.592 13.843 1.00 25.03 C ATOM 1382 C PRO A 86 -15.848 -17.502 12.665 1.00 50.44 C ATOM 1383 O PRO A 86 -14.975 -18.188 12.133 1.00 21.25 O ATOM 1384 CB PRO A 86 -15.759 -15.127 13.471 1.00 4.34 C ATOM 1385 CG PRO A 86 -14.426 -14.624 13.035 1.00 51.54 C ATOM 1386 CD PRO A 86 -13.412 -15.362 13.864 1.00 74.32 C ATOM 0 HA PRO A 86 -16.147 -16.947 14.660 1.00 25.03 H new ATOM 0 HB2 PRO A 86 -16.496 -15.037 12.673 1.00 4.34 H new ATOM 0 HB3 PRO A 86 -16.138 -14.560 14.321 1.00 4.34 H new ATOM 0 HG2 PRO A 86 -14.269 -14.807 11.972 1.00 51.54 H new ATOM 0 HG3 PRO A 86 -14.346 -13.548 13.188 1.00 51.54 H new ATOM 0 HD2 PRO A 86 -12.490 -15.536 13.310 1.00 74.32 H new ATOM 0 HD3 PRO A 86 -13.144 -14.805 14.762 1.00 74.32 H new ATOM 1394 N LYS A 87 -17.113 -17.502 12.259 1.00 14.12 N ATOM 1395 CA LYS A 87 -17.559 -18.326 11.142 1.00 50.33 C ATOM 1396 C LYS A 87 -17.171 -17.692 9.810 1.00 44.03 C ATOM 1397 O LYS A 87 -17.879 -16.828 9.292 1.00 51.42 O ATOM 1398 CB LYS A 87 -19.075 -18.525 11.201 1.00 12.20 C ATOM 1399 CG LYS A 87 -19.546 -19.241 12.455 1.00 11.42 C ATOM 1400 CD LYS A 87 -19.533 -20.749 12.275 1.00 63.24 C ATOM 1401 CE LYS A 87 -20.868 -21.260 11.757 1.00 75.41 C ATOM 1402 NZ LYS A 87 -20.911 -21.293 10.269 1.00 42.13 N ATOM 0 H LYS A 87 -17.848 -16.940 12.687 1.00 14.12 H new ATOM 0 HA LYS A 87 -17.068 -19.296 11.220 1.00 50.33 H new ATOM 0 HB2 LYS A 87 -19.563 -17.552 11.143 1.00 12.20 H new ATOM 0 HB3 LYS A 87 -19.393 -19.094 10.327 1.00 12.20 H new ATOM 0 HG2 LYS A 87 -18.905 -18.968 13.293 1.00 11.42 H new ATOM 0 HG3 LYS A 87 -20.555 -18.912 12.705 1.00 11.42 H new ATOM 0 HD2 LYS A 87 -18.741 -21.027 11.579 1.00 63.24 H new ATOM 0 HD3 LYS A 87 -19.303 -21.228 13.227 1.00 63.24 H new ATOM 0 HE2 LYS A 87 -21.050 -22.261 12.148 1.00 75.41 H new ATOM 0 HE3 LYS A 87 -21.670 -20.622 12.129 1.00 75.41 H new ATOM 0 HZ1 LYS A 87 -21.664 -21.940 9.958 1.00 42.13 H new ATOM 0 HZ2 LYS A 87 -21.103 -20.338 9.906 1.00 42.13 H new ATOM 0 HZ3 LYS A 87 -19.996 -21.625 9.903 1.00 42.13 H new ATOM 1416 N LEU A 88 -16.043 -18.128 9.259 1.00 1.52 N ATOM 1417 CA LEU A 88 -15.561 -17.604 7.986 1.00 40.32 C ATOM 1418 C LEU A 88 -16.045 -18.466 6.824 1.00 1.22 C ATOM 1419 O LEU A 88 -15.519 -18.381 5.714 1.00 1.31 O ATOM 1420 CB LEU A 88 -14.033 -17.538 7.985 1.00 43.54 C ATOM 1421 CG LEU A 88 -13.412 -16.343 8.710 1.00 31.33 C ATOM 1422 CD1 LEU A 88 -13.420 -16.570 10.214 1.00 1.32 C ATOM 1423 CD2 LEU A 88 -11.995 -16.095 8.214 1.00 72.11 C ATOM 0 H LEU A 88 -15.445 -18.843 9.674 1.00 1.52 H new ATOM 0 HA LEU A 88 -15.962 -16.598 7.860 1.00 40.32 H new ATOM 0 HB2 LEU A 88 -13.650 -18.452 8.439 1.00 43.54 H new ATOM 0 HB3 LEU A 88 -13.690 -17.528 6.950 1.00 43.54 H new ATOM 0 HG LEU A 88 -14.011 -15.459 8.492 1.00 31.33 H new ATOM 0 HD11 LEU A 88 -12.975 -15.710 10.714 1.00 1.32 H new ATOM 0 HD12 LEU A 88 -14.447 -16.698 10.557 1.00 1.32 H new ATOM 0 HD13 LEU A 88 -12.845 -17.465 10.450 1.00 1.32 H new ATOM 0 HD21 LEU A 88 -11.569 -15.241 8.741 1.00 72.11 H new ATOM 0 HD22 LEU A 88 -11.384 -16.978 8.401 1.00 72.11 H new ATOM 0 HD23 LEU A 88 -12.015 -15.888 7.144 1.00 72.11 H new ATOM 1435 N ILE A 89 -17.051 -19.293 7.087 1.00 23.23 N ATOM 1436 CA ILE A 89 -17.608 -20.168 6.063 1.00 44.11 C ATOM 1437 C ILE A 89 -18.878 -19.574 5.465 1.00 74.34 C ATOM 1438 O ILE A 89 -19.947 -19.627 6.074 1.00 55.44 O ATOM 1439 CB ILE A 89 -17.923 -21.566 6.627 1.00 15.31 C ATOM 1440 CG1 ILE A 89 -16.706 -22.130 7.363 1.00 52.24 C ATOM 1441 CG2 ILE A 89 -18.355 -22.503 5.509 1.00 21.01 C ATOM 1442 CD1 ILE A 89 -16.957 -23.478 8.000 1.00 21.51 C ATOM 0 H ILE A 89 -17.497 -19.375 8.001 1.00 23.23 H new ATOM 0 HA ILE A 89 -16.852 -20.263 5.283 1.00 44.11 H new ATOM 0 HB ILE A 89 -18.744 -21.478 7.338 1.00 15.31 H new ATOM 0 HG12 ILE A 89 -15.876 -22.217 6.662 1.00 52.24 H new ATOM 0 HG13 ILE A 89 -16.399 -21.424 8.135 1.00 52.24 H new ATOM 0 HG21 ILE A 89 -18.574 -23.487 5.923 1.00 21.01 H new ATOM 0 HG22 ILE A 89 -19.248 -22.106 5.026 1.00 21.01 H new ATOM 0 HG23 ILE A 89 -17.553 -22.588 4.776 1.00 21.01 H new ATOM 0 HD11 ILE A 89 -16.052 -23.817 8.504 1.00 21.51 H new ATOM 0 HD12 ILE A 89 -17.766 -23.393 8.726 1.00 21.51 H new ATOM 0 HD13 ILE A 89 -17.235 -24.198 7.230 1.00 21.51 H new ATOM 1454 N HIS A 90 -18.755 -19.011 4.267 1.00 71.12 N ATOM 1455 CA HIS A 90 -19.895 -18.409 3.584 1.00 61.40 C ATOM 1456 C HIS A 90 -20.080 -19.017 2.197 1.00 43.34 C ATOM 1457 O HIS A 90 -19.216 -18.885 1.329 1.00 44.00 O ATOM 1458 CB HIS A 90 -19.707 -16.896 3.470 1.00 34.22 C ATOM 1459 CG HIS A 90 -20.089 -16.150 4.712 1.00 71.43 C ATOM 1460 ND1 HIS A 90 -19.422 -16.293 5.910 1.00 14.13 N ATOM 1461 CD2 HIS A 90 -21.074 -15.250 4.936 1.00 54.33 C ATOM 1462 CE1 HIS A 90 -19.982 -15.514 6.818 1.00 12.43 C ATOM 1463 NE2 HIS A 90 -20.987 -14.869 6.252 1.00 22.43 N ATOM 0 H HIS A 90 -17.878 -18.959 3.749 1.00 71.12 H new ATOM 0 HA HIS A 90 -20.789 -18.613 4.173 1.00 61.40 H new ATOM 0 HB2 HIS A 90 -18.664 -16.684 3.235 1.00 34.22 H new ATOM 0 HB3 HIS A 90 -20.303 -16.526 2.636 1.00 34.22 H new ATOM 0 HD1 HIS A 90 -18.622 -16.905 6.070 1.00 14.13 H new ATOM 0 HD2 HIS A 90 -21.795 -14.897 4.214 1.00 54.33 H new ATOM 0 HE1 HIS A 90 -19.671 -15.420 7.848 1.00 12.43 H new ATOM 1471 N THR A 91 -21.212 -19.684 1.994 1.00 43.44 N ATOM 1472 CA THR A 91 -21.509 -20.313 0.713 1.00 10.11 C ATOM 1473 C THR A 91 -22.706 -19.651 0.040 1.00 20.10 C ATOM 1474 O THR A 91 -23.764 -19.492 0.649 1.00 71.31 O ATOM 1475 CB THR A 91 -21.795 -21.817 0.879 1.00 20.34 C ATOM 1476 OG1 THR A 91 -20.634 -22.483 1.387 1.00 24.52 O ATOM 1477 CG2 THR A 91 -22.204 -22.440 -0.447 1.00 21.22 C ATOM 0 H THR A 91 -21.938 -19.802 2.700 1.00 43.44 H new ATOM 0 HA THR A 91 -20.627 -20.185 0.086 1.00 10.11 H new ATOM 0 HB THR A 91 -22.617 -21.932 1.585 1.00 20.34 H new ATOM 0 HG1 THR A 91 -20.824 -23.439 1.491 1.00 24.52 H new ATOM 0 HG21 THR A 91 -22.401 -23.503 -0.304 1.00 21.22 H new ATOM 0 HG22 THR A 91 -23.105 -21.950 -0.816 1.00 21.22 H new ATOM 0 HG23 THR A 91 -21.400 -22.314 -1.172 1.00 21.22 H new ATOM 1485 N VAL A 92 -22.532 -19.267 -1.221 1.00 14.24 N ATOM 1486 CA VAL A 92 -23.600 -18.623 -1.978 1.00 23.54 C ATOM 1487 C VAL A 92 -24.370 -19.639 -2.813 1.00 73.41 C ATOM 1488 O VAL A 92 -23.858 -20.160 -3.804 1.00 24.11 O ATOM 1489 CB VAL A 92 -23.046 -17.526 -2.906 1.00 14.23 C ATOM 1490 CG1 VAL A 92 -24.183 -16.783 -3.591 1.00 11.32 C ATOM 1491 CG2 VAL A 92 -22.163 -16.564 -2.125 1.00 55.22 C ATOM 0 H VAL A 92 -21.662 -19.390 -1.740 1.00 14.24 H new ATOM 0 HA VAL A 92 -24.274 -18.168 -1.252 1.00 23.54 H new ATOM 0 HB VAL A 92 -22.436 -17.998 -3.676 1.00 14.23 H new ATOM 0 HG11 VAL A 92 -23.773 -16.012 -4.243 1.00 11.32 H new ATOM 0 HG12 VAL A 92 -24.771 -17.484 -4.184 1.00 11.32 H new ATOM 0 HG13 VAL A 92 -24.821 -16.320 -2.838 1.00 11.32 H new ATOM 0 HG21 VAL A 92 -21.780 -15.795 -2.796 1.00 55.22 H new ATOM 0 HG22 VAL A 92 -22.747 -16.096 -1.333 1.00 55.22 H new ATOM 0 HG23 VAL A 92 -21.329 -17.111 -1.686 1.00 55.22 H new ATOM 1501 N ARG A 93 -25.605 -19.917 -2.407 1.00 0.41 N ATOM 1502 CA ARG A 93 -26.447 -20.871 -3.118 1.00 21.21 C ATOM 1503 C ARG A 93 -26.533 -20.521 -4.601 1.00 20.34 C ATOM 1504 O ARG A 93 -27.254 -19.605 -4.992 1.00 14.22 O ATOM 1505 CB ARG A 93 -27.849 -20.900 -2.507 1.00 74.15 C ATOM 1506 CG ARG A 93 -28.780 -21.905 -3.166 1.00 63.34 C ATOM 1507 CD ARG A 93 -28.597 -23.298 -2.584 1.00 70.33 C ATOM 1508 NE ARG A 93 -27.451 -23.989 -3.168 1.00 63.52 N ATOM 1509 CZ ARG A 93 -27.172 -25.269 -2.945 1.00 12.01 C ATOM 1510 NH1 ARG A 93 -27.953 -25.993 -2.155 1.00 53.21 N ATOM 1511 NH2 ARG A 93 -26.111 -25.827 -3.513 1.00 24.04 N ATOM 0 H ARG A 93 -26.044 -19.495 -1.589 1.00 0.41 H new ATOM 0 HA ARG A 93 -25.996 -21.858 -3.022 1.00 21.21 H new ATOM 0 HB2 ARG A 93 -27.769 -21.134 -1.445 1.00 74.15 H new ATOM 0 HB3 ARG A 93 -28.290 -19.906 -2.582 1.00 74.15 H new ATOM 0 HG2 ARG A 93 -29.814 -21.587 -3.033 1.00 63.34 H new ATOM 0 HG3 ARG A 93 -28.590 -21.930 -4.239 1.00 63.34 H new ATOM 0 HD2 ARG A 93 -28.465 -23.225 -1.504 1.00 70.33 H new ATOM 0 HD3 ARG A 93 -29.500 -23.884 -2.756 1.00 70.33 H new ATOM 0 HE ARG A 93 -26.830 -23.460 -3.781 1.00 63.52 H new ATOM 0 HH11 ARG A 93 -28.770 -25.568 -1.717 1.00 53.21 H new ATOM 0 HH12 ARG A 93 -27.737 -26.975 -1.985 1.00 53.21 H new ATOM 0 HH21 ARG A 93 -25.508 -25.273 -4.122 1.00 24.04 H new ATOM 0 HH22 ARG A 93 -25.898 -26.810 -3.341 1.00 24.04 H new ATOM 1525 N GLY A 94 -25.791 -21.258 -5.422 1.00 22.44 N ATOM 1526 CA GLY A 94 -25.797 -21.010 -6.851 1.00 71.44 C ATOM 1527 C GLY A 94 -24.443 -20.567 -7.369 1.00 12.32 C ATOM 1528 O GLY A 94 -24.344 -19.982 -8.447 1.00 75.43 O ATOM 0 H GLY A 94 -25.186 -22.022 -5.122 1.00 22.44 H new ATOM 0 HA2 GLY A 94 -26.103 -21.917 -7.373 1.00 71.44 H new ATOM 0 HA3 GLY A 94 -26.538 -20.245 -7.081 1.00 71.44 H new ATOM 1532 N ALA A 95 -23.397 -20.843 -6.597 1.00 60.12 N ATOM 1533 CA ALA A 95 -22.042 -20.469 -6.984 1.00 14.30 C ATOM 1534 C ALA A 95 -21.041 -21.549 -6.591 1.00 22.22 C ATOM 1535 O ALA A 95 -20.554 -22.297 -7.438 1.00 54.44 O ATOM 1536 CB ALA A 95 -21.662 -19.138 -6.352 1.00 23.23 C ATOM 0 H ALA A 95 -23.462 -21.324 -5.700 1.00 60.12 H new ATOM 0 HA ALA A 95 -22.016 -20.365 -8.069 1.00 14.30 H new ATOM 0 HB1 ALA A 95 -20.648 -18.870 -6.649 1.00 23.23 H new ATOM 0 HB2 ALA A 95 -22.354 -18.365 -6.687 1.00 23.23 H new ATOM 0 HB3 ALA A 95 -21.711 -19.223 -5.266 1.00 23.23 H new ATOM 1542 N GLY A 96 -20.736 -21.626 -5.299 1.00 1.52 N ATOM 1543 CA GLY A 96 -19.793 -22.617 -4.816 1.00 62.44 C ATOM 1544 C GLY A 96 -19.484 -22.455 -3.341 1.00 41.34 C ATOM 1545 O GLY A 96 -20.219 -22.951 -2.488 1.00 30.54 O ATOM 0 H GLY A 96 -21.126 -21.019 -4.578 1.00 1.52 H new ATOM 0 HA2 GLY A 96 -20.197 -23.614 -4.992 1.00 62.44 H new ATOM 0 HA3 GLY A 96 -18.868 -22.543 -5.388 1.00 62.44 H new ATOM 1549 N TYR A 97 -18.393 -21.759 -3.040 1.00 52.03 N ATOM 1550 CA TYR A 97 -17.986 -21.536 -1.658 1.00 53.21 C ATOM 1551 C TYR A 97 -16.935 -20.434 -1.571 1.00 3.11 C ATOM 1552 O TYR A 97 -16.054 -20.331 -2.425 1.00 52.21 O ATOM 1553 CB TYR A 97 -17.438 -22.828 -1.051 1.00 34.33 C ATOM 1554 CG TYR A 97 -16.868 -22.650 0.338 1.00 22.32 C ATOM 1555 CD1 TYR A 97 -17.578 -21.971 1.320 1.00 33.35 C ATOM 1556 CD2 TYR A 97 -15.618 -23.160 0.668 1.00 51.01 C ATOM 1557 CE1 TYR A 97 -17.061 -21.806 2.591 1.00 42.54 C ATOM 1558 CE2 TYR A 97 -15.093 -23.000 1.936 1.00 74.33 C ATOM 1559 CZ TYR A 97 -15.818 -22.322 2.893 1.00 33.25 C ATOM 1560 OH TYR A 97 -15.298 -22.160 4.157 1.00 14.22 O ATOM 0 H TYR A 97 -17.775 -21.340 -3.735 1.00 52.03 H new ATOM 0 HA TYR A 97 -18.864 -21.221 -1.094 1.00 53.21 H new ATOM 0 HB2 TYR A 97 -18.236 -23.570 -1.015 1.00 34.33 H new ATOM 0 HB3 TYR A 97 -16.662 -23.226 -1.705 1.00 34.33 H new ATOM 0 HD1 TYR A 97 -18.551 -21.565 1.086 1.00 33.35 H new ATOM 0 HD2 TYR A 97 -15.047 -23.691 -0.080 1.00 51.01 H new ATOM 0 HE1 TYR A 97 -17.627 -21.276 3.343 1.00 42.54 H new ATOM 0 HE2 TYR A 97 -14.120 -23.404 2.176 1.00 74.33 H new ATOM 0 HH TYR A 97 -14.453 -21.666 4.102 1.00 14.22 H new ATOM 1570 N VAL A 98 -17.033 -19.612 -0.531 1.00 12.11 N ATOM 1571 CA VAL A 98 -16.091 -18.518 -0.329 1.00 64.01 C ATOM 1572 C VAL A 98 -15.873 -18.247 1.155 1.00 13.33 C ATOM 1573 O VAL A 98 -16.739 -18.534 1.983 1.00 24.15 O ATOM 1574 CB VAL A 98 -16.577 -17.225 -1.010 1.00 61.13 C ATOM 1575 CG1 VAL A 98 -17.803 -16.675 -0.298 1.00 51.21 C ATOM 1576 CG2 VAL A 98 -15.462 -16.191 -1.047 1.00 12.45 C ATOM 0 H VAL A 98 -17.756 -19.683 0.185 1.00 12.11 H new ATOM 0 HA VAL A 98 -15.148 -18.825 -0.781 1.00 64.01 H new ATOM 0 HB VAL A 98 -16.858 -17.459 -2.037 1.00 61.13 H new ATOM 0 HG11 VAL A 98 -18.132 -15.761 -0.793 1.00 51.21 H new ATOM 0 HG12 VAL A 98 -18.604 -17.414 -0.330 1.00 51.21 H new ATOM 0 HG13 VAL A 98 -17.553 -16.455 0.740 1.00 51.21 H new ATOM 0 HG21 VAL A 98 -15.823 -15.284 -1.532 1.00 12.45 H new ATOM 0 HG22 VAL A 98 -15.148 -15.958 -0.030 1.00 12.45 H new ATOM 0 HG23 VAL A 98 -14.615 -16.589 -1.606 1.00 12.45 H new ATOM 1586 N LEU A 99 -14.713 -17.691 1.486 1.00 42.04 N ATOM 1587 CA LEU A 99 -14.381 -17.379 2.872 1.00 62.34 C ATOM 1588 C LEU A 99 -14.587 -15.896 3.160 1.00 5.24 C ATOM 1589 O LEU A 99 -14.247 -15.042 2.342 1.00 4.13 O ATOM 1590 CB LEU A 99 -12.933 -17.773 3.171 1.00 52.13 C ATOM 1591 CG LEU A 99 -11.870 -16.728 2.830 1.00 24.50 C ATOM 1592 CD1 LEU A 99 -10.512 -17.155 3.365 1.00 24.41 C ATOM 1593 CD2 LEU A 99 -11.806 -16.503 1.326 1.00 24.34 C ATOM 0 H LEU A 99 -13.986 -17.447 0.813 1.00 42.04 H new ATOM 0 HA LEU A 99 -15.047 -17.951 3.518 1.00 62.34 H new ATOM 0 HB2 LEU A 99 -12.854 -18.010 4.232 1.00 52.13 H new ATOM 0 HB3 LEU A 99 -12.705 -18.687 2.622 1.00 52.13 H new ATOM 0 HG LEU A 99 -12.146 -15.787 3.306 1.00 24.50 H new ATOM 0 HD11 LEU A 99 -9.768 -16.400 3.113 1.00 24.41 H new ATOM 0 HD12 LEU A 99 -10.566 -17.264 4.448 1.00 24.41 H new ATOM 0 HD13 LEU A 99 -10.228 -18.108 2.918 1.00 24.41 H new ATOM 0 HD21 LEU A 99 -11.044 -15.756 1.102 1.00 24.34 H new ATOM 0 HD22 LEU A 99 -11.554 -17.439 0.828 1.00 24.34 H new ATOM 0 HD23 LEU A 99 -12.774 -16.152 0.969 1.00 24.34 H new ATOM 1605 N GLU A 100 -15.143 -15.598 4.330 1.00 11.53 N ATOM 1606 CA GLU A 100 -15.392 -14.217 4.727 1.00 53.41 C ATOM 1607 C GLU A 100 -15.850 -14.142 6.181 1.00 72.33 C ATOM 1608 O GLU A 100 -16.755 -14.867 6.595 1.00 31.41 O ATOM 1609 CB GLU A 100 -16.446 -13.583 3.816 1.00 62.11 C ATOM 1610 CG GLU A 100 -15.894 -12.490 2.916 1.00 73.22 C ATOM 1611 CD GLU A 100 -15.142 -11.424 3.687 1.00 2.52 C ATOM 1612 OE1 GLU A 100 -15.753 -10.792 4.574 1.00 1.44 O ATOM 1613 OE2 GLU A 100 -13.943 -11.220 3.404 1.00 23.31 O ATOM 0 H GLU A 100 -15.429 -16.294 5.019 1.00 11.53 H new ATOM 0 HA GLU A 100 -14.457 -13.664 4.630 1.00 53.41 H new ATOM 0 HB2 GLU A 100 -16.894 -14.360 3.197 1.00 62.11 H new ATOM 0 HB3 GLU A 100 -17.243 -13.167 4.432 1.00 62.11 H new ATOM 0 HG2 GLU A 100 -15.229 -12.935 2.176 1.00 73.22 H new ATOM 0 HG3 GLU A 100 -16.715 -12.026 2.369 1.00 73.22 H new ATOM 1620 N ILE A 101 -15.219 -13.262 6.949 1.00 5.44 N ATOM 1621 CA ILE A 101 -15.561 -13.092 8.356 1.00 21.10 C ATOM 1622 C ILE A 101 -16.920 -12.418 8.514 1.00 61.53 C ATOM 1623 O ILE A 101 -17.524 -11.979 7.535 1.00 63.53 O ATOM 1624 CB ILE A 101 -14.499 -12.259 9.098 1.00 64.34 C ATOM 1625 CG1 ILE A 101 -14.726 -10.766 8.851 1.00 61.50 C ATOM 1626 CG2 ILE A 101 -13.102 -12.668 8.655 1.00 24.14 C ATOM 1627 CD1 ILE A 101 -14.761 -10.395 7.385 1.00 2.42 C ATOM 0 H ILE A 101 -14.468 -12.655 6.621 1.00 5.44 H new ATOM 0 HA ILE A 101 -15.599 -14.090 8.793 1.00 21.10 H new ATOM 0 HB ILE A 101 -14.591 -12.449 10.167 1.00 64.34 H new ATOM 0 HG12 ILE A 101 -15.666 -10.468 9.316 1.00 61.50 H new ATOM 0 HG13 ILE A 101 -13.934 -10.200 9.342 1.00 61.50 H new ATOM 0 HG21 ILE A 101 -12.362 -12.071 9.188 1.00 24.14 H new ATOM 0 HG22 ILE A 101 -12.944 -13.724 8.877 1.00 24.14 H new ATOM 0 HG23 ILE A 101 -12.997 -12.503 7.583 1.00 24.14 H new ATOM 0 HD11 ILE A 101 -14.925 -9.322 7.285 1.00 2.42 H new ATOM 0 HD12 ILE A 101 -13.812 -10.662 6.919 1.00 2.42 H new ATOM 0 HD13 ILE A 101 -15.571 -10.933 6.893 1.00 2.42 H new ATOM 1639 N ARG A 102 -17.395 -12.339 9.752 1.00 5.25 N ATOM 1640 CA ARG A 102 -18.682 -11.718 10.039 1.00 51.22 C ATOM 1641 C ARG A 102 -18.514 -10.230 10.335 1.00 75.32 C ATOM 1642 O ARG A 102 -19.408 -9.429 10.063 1.00 72.52 O ATOM 1643 CB ARG A 102 -19.355 -12.412 11.225 1.00 43.15 C ATOM 1644 CG ARG A 102 -20.170 -13.633 10.833 1.00 73.23 C ATOM 1645 CD ARG A 102 -21.616 -13.266 10.538 1.00 33.30 C ATOM 1646 NE ARG A 102 -21.827 -12.962 9.125 1.00 21.03 N ATOM 1647 CZ ARG A 102 -23.019 -12.703 8.599 1.00 63.31 C ATOM 1648 NH1 ARG A 102 -24.101 -12.712 9.365 1.00 51.55 N ATOM 1649 NH2 ARG A 102 -23.129 -12.435 7.304 1.00 35.01 N ATOM 0 H ARG A 102 -16.908 -12.698 10.573 1.00 5.25 H new ATOM 0 HA ARG A 102 -19.314 -11.827 9.157 1.00 51.22 H new ATOM 0 HB2 ARG A 102 -18.590 -12.711 11.942 1.00 43.15 H new ATOM 0 HB3 ARG A 102 -20.005 -11.699 11.731 1.00 43.15 H new ATOM 0 HG2 ARG A 102 -19.726 -14.102 9.955 1.00 73.23 H new ATOM 0 HG3 ARG A 102 -20.137 -14.368 11.637 1.00 73.23 H new ATOM 0 HD2 ARG A 102 -22.266 -14.090 10.832 1.00 33.30 H new ATOM 0 HD3 ARG A 102 -21.901 -12.404 11.141 1.00 33.30 H new ATOM 0 HE ARG A 102 -21.015 -12.948 8.508 1.00 21.03 H new ATOM 0 HH11 ARG A 102 -24.019 -12.918 10.361 1.00 51.55 H new ATOM 0 HH12 ARG A 102 -25.015 -12.513 8.959 1.00 51.55 H new ATOM 0 HH21 ARG A 102 -22.298 -12.428 6.712 1.00 35.01 H new ATOM 0 HH22 ARG A 102 -24.044 -12.236 6.900 1.00 35.01 H new ATOM 1663 N GLU A 103 -17.364 -9.869 10.894 1.00 64.32 N ATOM 1664 CA GLU A 103 -17.080 -8.478 11.228 1.00 74.43 C ATOM 1665 C GLU A 103 -17.335 -7.569 10.029 1.00 1.43 C ATOM 1666 O GLU A 103 -17.684 -6.399 10.188 1.00 31.54 O ATOM 1667 CB GLU A 103 -15.632 -8.328 11.697 1.00 21.24 C ATOM 1668 CG GLU A 103 -15.202 -6.884 11.892 1.00 42.11 C ATOM 1669 CD GLU A 103 -14.019 -6.749 12.831 1.00 13.15 C ATOM 1670 OE1 GLU A 103 -12.999 -7.432 12.602 1.00 40.51 O ATOM 1671 OE2 GLU A 103 -14.114 -5.961 13.796 1.00 60.42 O ATOM 0 H GLU A 103 -16.614 -10.520 11.125 1.00 64.32 H new ATOM 0 HA GLU A 103 -17.748 -8.181 12.037 1.00 74.43 H new ATOM 0 HB2 GLU A 103 -15.506 -8.866 12.637 1.00 21.24 H new ATOM 0 HB3 GLU A 103 -14.972 -8.800 10.969 1.00 21.24 H new ATOM 0 HG2 GLU A 103 -14.945 -6.452 10.925 1.00 42.11 H new ATOM 0 HG3 GLU A 103 -16.040 -6.309 12.285 1.00 42.11 H new ATOM 1678 N GLU A 104 -17.156 -8.115 8.830 1.00 14.25 N ATOM 1679 CA GLU A 104 -17.365 -7.352 7.605 1.00 13.04 C ATOM 1680 C GLU A 104 -18.735 -6.680 7.610 1.00 12.30 C ATOM 1681 O GLU A 104 -19.755 -7.325 7.367 1.00 4.31 O ATOM 1682 CB GLU A 104 -17.236 -8.263 6.383 1.00 52.12 C ATOM 1683 CG GLU A 104 -17.692 -7.612 5.088 1.00 41.32 C ATOM 1684 CD GLU A 104 -17.081 -6.240 4.878 1.00 65.01 C ATOM 1685 OE1 GLU A 104 -17.676 -5.247 5.345 1.00 4.22 O ATOM 1686 OE2 GLU A 104 -16.006 -6.160 4.246 1.00 31.51 O ATOM 0 H GLU A 104 -16.867 -9.082 8.681 1.00 14.25 H new ATOM 0 HA GLU A 104 -16.600 -6.577 7.554 1.00 13.04 H new ATOM 0 HB2 GLU A 104 -16.196 -8.571 6.278 1.00 52.12 H new ATOM 0 HB3 GLU A 104 -17.821 -9.167 6.551 1.00 52.12 H new ATOM 0 HG2 GLU A 104 -17.427 -8.256 4.249 1.00 41.32 H new ATOM 0 HG3 GLU A 104 -18.779 -7.525 5.092 1.00 41.32 H new