USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 912 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 SER OG : rot 180:sc= -3.43! USER MOD Set 1.2: A 105 ASN : amide:sc= -5.74! C(o=-9.2!,f=-19!) USER MOD Single : A 8 MET CE :methyl 169:sc=-0.00137 (180deg=-0.117) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 160:sc= -2.31 USER MOD Single : A 24 TYR OH : rot 30:sc= 0 USER MOD Single : A 31 THR OG1 : rot 173:sc= -0.889! USER MOD Single : A 42 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.516) USER MOD Single : A 43 SER OG : rot 139:sc= -1.62! USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.224 K(o=0.22,f=-0.74) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc=0.000333 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 62 LYS NZ :NH3+ -141:sc= -0.908 (180deg=-2.36!) USER MOD Single : A 65 ASN :FLIP amide:sc= -3.09 F(o=-4.1!,f=-3.1) USER MOD Single : A 67 LYS NZ :NH3+ -113:sc= -7.45! (180deg=-13!) USER MOD Single : A 77 TYR OH : rot 133:sc= 0.777 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 CYS SG : rot -157:sc= -2.55 USER MOD Single : A 90 LYS NZ :NH3+ -146:sc= -1.19 (180deg=-2.46!) USER MOD Single : A 91 THR OG1 : rot 70:sc= -1.56! USER MOD Single : A 94 SER OG : rot -176:sc= -0.549 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -152:sc= -0.383 (180deg=-1.59!) USER MOD Single : A 125 SER OG : rot 180:sc= -0.602 USER MOD ----------------------------------------------------------------- ATOM 102 N MET A 8 -4.021 6.617 -11.396 1.00 0.00 N ATOM 103 CA MET A 8 -2.786 7.105 -10.792 1.00 0.00 C ATOM 104 C MET A 8 -2.045 5.972 -10.090 1.00 0.00 C ATOM 105 O MET A 8 -2.508 5.448 -9.078 1.00 0.00 O ATOM 106 CB MET A 8 -3.081 8.234 -9.803 1.00 0.00 C ATOM 107 CG MET A 8 -1.940 9.230 -9.661 1.00 0.00 C ATOM 108 SD MET A 8 -2.360 10.866 -10.294 1.00 0.00 S ATOM 109 CE MET A 8 -2.790 11.716 -8.777 1.00 0.00 C ATOM 0 HA MET A 8 -2.151 7.495 -11.587 1.00 0.00 H new ATOM 0 HB2 MET A 8 -3.977 8.764 -10.126 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.300 7.803 -8.826 1.00 0.00 H new ATOM 0 HG2 MET A 8 -1.663 9.312 -8.610 1.00 0.00 H new ATOM 0 HG3 MET A 8 -1.066 8.853 -10.192 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.883 12.784 -8.972 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.738 11.332 -8.401 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.011 11.550 -8.033 1.00 0.00 H new ATOM 119 N ARG A 9 -0.897 5.589 -10.643 1.00 0.00 N ATOM 120 CA ARG A 9 -0.102 4.504 -10.070 1.00 0.00 C ATOM 121 C ARG A 9 1.223 5.000 -9.496 1.00 0.00 C ATOM 122 O ARG A 9 1.851 5.912 -10.035 1.00 0.00 O ATOM 123 CB ARG A 9 0.154 3.418 -11.124 1.00 0.00 C ATOM 124 CG ARG A 9 1.379 3.669 -11.998 1.00 0.00 C ATOM 125 CD ARG A 9 2.603 2.939 -11.465 1.00 0.00 C ATOM 126 NE ARG A 9 3.532 2.579 -12.533 1.00 0.00 N ATOM 127 CZ ARG A 9 3.249 1.710 -13.500 1.00 0.00 C ATOM 128 NH1 ARG A 9 2.067 1.108 -13.536 1.00 0.00 N ATOM 129 NH2 ARG A 9 4.151 1.440 -14.434 1.00 0.00 N ATOM 0 H ARG A 9 -0.498 6.010 -11.482 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.678 4.082 -9.246 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.272 2.459 -10.620 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.724 3.335 -11.764 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.174 3.341 -13.017 1.00 0.00 H new ATOM 0 HG3 ARG A 9 1.583 4.739 -12.042 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.114 3.570 -10.738 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.288 2.038 -10.939 1.00 0.00 H new ATOM 0 HE ARG A 9 4.452 3.020 -12.538 1.00 0.00 H new ATOM 0 HH11 ARG A 9 1.370 1.311 -12.820 1.00 0.00 H new ATOM 0 HH12 ARG A 9 1.856 0.443 -14.280 1.00 0.00 H new ATOM 0 HH21 ARG A 9 5.062 1.899 -14.411 1.00 0.00 H new ATOM 0 HH22 ARG A 9 3.934 0.774 -15.175 1.00 0.00 H new ATOM 143 N LEU A 10 1.650 4.360 -8.409 1.00 0.00 N ATOM 144 CA LEU A 10 2.918 4.695 -7.762 1.00 0.00 C ATOM 145 C LEU A 10 3.855 3.495 -7.824 1.00 0.00 C ATOM 146 O LEU A 10 3.423 2.375 -8.093 1.00 0.00 O ATOM 147 CB LEU A 10 2.732 5.140 -6.297 1.00 0.00 C ATOM 148 CG LEU A 10 1.294 5.149 -5.767 1.00 0.00 C ATOM 149 CD1 LEU A 10 1.285 5.296 -4.248 1.00 0.00 C ATOM 150 CD2 LEU A 10 0.501 6.274 -6.413 1.00 0.00 C ATOM 0 H LEU A 10 1.135 3.605 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 10 3.349 5.538 -8.302 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.326 4.483 -5.662 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.142 6.144 -6.190 1.00 0.00 H new ATOM 0 HG LEU A 10 0.824 4.200 -6.024 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.256 5.301 -3.889 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.822 4.461 -3.798 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.770 6.232 -3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.518 6.269 -6.027 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.971 7.230 -6.182 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.481 6.131 -7.493 1.00 0.00 H new ATOM 162 N ARG A 11 5.137 3.730 -7.579 1.00 0.00 N ATOM 163 CA ARG A 11 6.122 2.658 -7.616 1.00 0.00 C ATOM 164 C ARG A 11 6.645 2.345 -6.217 1.00 0.00 C ATOM 165 O ARG A 11 6.773 3.235 -5.377 1.00 0.00 O ATOM 166 CB ARG A 11 7.281 3.039 -8.539 1.00 0.00 C ATOM 167 CG ARG A 11 7.670 1.941 -9.516 1.00 0.00 C ATOM 168 CD ARG A 11 8.149 0.692 -8.792 1.00 0.00 C ATOM 169 NE ARG A 11 9.289 0.074 -9.465 1.00 0.00 N ATOM 170 CZ ARG A 11 10.525 0.568 -9.434 1.00 0.00 C ATOM 171 NH1 ARG A 11 10.783 1.687 -8.768 1.00 0.00 N ATOM 172 NH2 ARG A 11 11.505 -0.058 -10.072 1.00 0.00 N ATOM 0 H ARG A 11 5.518 4.649 -7.354 1.00 0.00 H new ATOM 0 HA ARG A 11 5.636 1.763 -8.005 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.008 3.933 -9.100 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.148 3.297 -7.931 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.815 1.693 -10.145 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.457 2.303 -10.177 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.427 0.949 -7.770 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.332 -0.027 -8.729 1.00 0.00 H new ATOM 0 HE ARG A 11 9.129 -0.786 -9.989 1.00 0.00 H new ATOM 0 HH11 ARG A 11 10.033 2.173 -8.277 1.00 0.00 H new ATOM 0 HH12 ARG A 11 11.732 2.061 -8.747 1.00 0.00 H new ATOM 0 HH21 ARG A 11 11.312 -0.917 -10.586 1.00 0.00 H new ATOM 0 HH22 ARG A 11 12.452 0.320 -10.049 1.00 0.00 H new ATOM 186 N ILE A 12 6.956 1.075 -5.980 1.00 0.00 N ATOM 187 CA ILE A 12 7.477 0.639 -4.691 1.00 0.00 C ATOM 188 C ILE A 12 8.506 -0.468 -4.905 1.00 0.00 C ATOM 189 O ILE A 12 8.158 -1.612 -5.192 1.00 0.00 O ATOM 190 CB ILE A 12 6.332 0.175 -3.742 1.00 0.00 C ATOM 191 CG1 ILE A 12 6.029 1.271 -2.720 1.00 0.00 C ATOM 192 CG2 ILE A 12 6.665 -1.131 -3.026 1.00 0.00 C ATOM 193 CD1 ILE A 12 4.587 1.287 -2.261 1.00 0.00 C ATOM 0 H ILE A 12 6.856 0.328 -6.667 1.00 0.00 H new ATOM 0 HA ILE A 12 7.965 1.484 -4.206 1.00 0.00 H new ATOM 0 HB ILE A 12 5.452 -0.010 -4.358 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.676 1.137 -1.853 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.274 2.240 -3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 12 5.836 -1.412 -2.377 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.832 -1.917 -3.762 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.566 -0.998 -2.427 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.444 2.089 -1.537 1.00 0.00 H new ATOM 0 HD12 ILE A 12 3.934 1.451 -3.118 1.00 0.00 H new ATOM 0 HD13 ILE A 12 4.342 0.332 -1.796 1.00 0.00 H new ATOM 205 N ARG A 13 9.780 -0.109 -4.785 1.00 0.00 N ATOM 206 CA ARG A 13 10.861 -1.069 -4.986 1.00 0.00 C ATOM 207 C ARG A 13 11.440 -1.544 -3.659 1.00 0.00 C ATOM 208 O ARG A 13 11.343 -0.860 -2.641 1.00 0.00 O ATOM 209 CB ARG A 13 11.972 -0.467 -5.852 1.00 0.00 C ATOM 210 CG ARG A 13 12.567 0.808 -5.279 1.00 0.00 C ATOM 211 CD ARG A 13 13.936 1.101 -5.873 1.00 0.00 C ATOM 212 NE ARG A 13 13.940 2.331 -6.662 1.00 0.00 N ATOM 213 CZ ARG A 13 14.940 2.698 -7.462 1.00 0.00 C ATOM 214 NH1 ARG A 13 16.016 1.931 -7.582 1.00 0.00 N ATOM 215 NH2 ARG A 13 14.861 3.833 -8.143 1.00 0.00 N ATOM 0 H ARG A 13 10.089 0.834 -4.551 1.00 0.00 H new ATOM 0 HA ARG A 13 10.436 -1.930 -5.502 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.765 -1.205 -5.975 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.574 -0.258 -6.845 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.897 1.644 -5.477 1.00 0.00 H new ATOM 0 HG3 ARG A 13 12.651 0.717 -4.196 1.00 0.00 H new ATOM 0 HD2 ARG A 13 14.669 1.183 -5.071 1.00 0.00 H new ATOM 0 HD3 ARG A 13 14.244 0.266 -6.502 1.00 0.00 H new ATOM 0 HE ARG A 13 13.128 2.945 -6.596 1.00 0.00 H new ATOM 0 HH11 ARG A 13 16.080 1.057 -7.061 1.00 0.00 H new ATOM 0 HH12 ARG A 13 16.779 2.216 -8.196 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.035 4.425 -8.054 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.626 4.114 -8.756 1.00 0.00 H new ATOM 229 N PHE A 14 12.047 -2.721 -3.692 1.00 0.00 N ATOM 230 CA PHE A 14 12.659 -3.315 -2.513 1.00 0.00 C ATOM 231 C PHE A 14 13.997 -3.941 -2.887 1.00 0.00 C ATOM 232 O PHE A 14 14.123 -4.580 -3.930 1.00 0.00 O ATOM 233 CB PHE A 14 11.737 -4.376 -1.909 1.00 0.00 C ATOM 234 CG PHE A 14 10.766 -3.829 -0.903 1.00 0.00 C ATOM 235 CD1 PHE A 14 9.627 -3.154 -1.314 1.00 0.00 C ATOM 236 CD2 PHE A 14 10.991 -3.991 0.454 1.00 0.00 C ATOM 237 CE1 PHE A 14 8.731 -2.652 -0.390 1.00 0.00 C ATOM 238 CE2 PHE A 14 10.100 -3.490 1.382 1.00 0.00 C ATOM 239 CZ PHE A 14 8.969 -2.819 0.960 1.00 0.00 C ATOM 0 H PHE A 14 12.129 -3.290 -4.535 1.00 0.00 H new ATOM 0 HA PHE A 14 12.822 -2.533 -1.771 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.181 -4.861 -2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.345 -5.145 -1.433 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.438 -3.019 -2.369 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.873 -4.515 0.790 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.846 -2.130 -0.723 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.287 -3.623 2.437 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.272 -2.425 1.685 1.00 0.00 H new ATOM 249 N GLU A 15 14.995 -3.740 -2.037 1.00 0.00 N ATOM 250 CA GLU A 15 16.337 -4.273 -2.284 1.00 0.00 C ATOM 251 C GLU A 15 16.299 -5.722 -2.767 1.00 0.00 C ATOM 252 O GLU A 15 17.197 -6.165 -3.486 1.00 0.00 O ATOM 253 CB GLU A 15 17.198 -4.189 -1.017 1.00 0.00 C ATOM 254 CG GLU A 15 18.137 -2.993 -0.978 1.00 0.00 C ATOM 255 CD GLU A 15 17.537 -1.743 -1.595 1.00 0.00 C ATOM 256 OE1 GLU A 15 16.882 -0.973 -0.860 1.00 0.00 O ATOM 257 OE2 GLU A 15 17.723 -1.533 -2.811 1.00 0.00 O ATOM 0 H GLU A 15 14.905 -3.212 -1.169 1.00 0.00 H new ATOM 0 HA GLU A 15 16.777 -3.659 -3.070 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.542 -4.150 -0.148 1.00 0.00 H new ATOM 0 HB3 GLU A 15 17.787 -5.102 -0.931 1.00 0.00 H new ATOM 0 HG2 GLU A 15 18.408 -2.785 0.057 1.00 0.00 H new ATOM 0 HG3 GLU A 15 19.058 -3.244 -1.504 1.00 0.00 H new ATOM 264 N SER A 16 15.277 -6.462 -2.358 1.00 0.00 N ATOM 265 CA SER A 16 15.156 -7.863 -2.743 1.00 0.00 C ATOM 266 C SER A 16 13.807 -8.159 -3.390 1.00 0.00 C ATOM 267 O SER A 16 13.363 -9.308 -3.402 1.00 0.00 O ATOM 268 CB SER A 16 15.346 -8.759 -1.519 1.00 0.00 C ATOM 269 OG SER A 16 14.191 -8.755 -0.699 1.00 0.00 O ATOM 0 H SER A 16 14.523 -6.119 -1.763 1.00 0.00 H new ATOM 0 HA SER A 16 15.933 -8.070 -3.478 1.00 0.00 H new ATOM 0 HB2 SER A 16 15.564 -9.777 -1.840 1.00 0.00 H new ATOM 0 HB3 SER A 16 16.206 -8.416 -0.943 1.00 0.00 H new ATOM 0 HG SER A 16 14.338 -9.337 0.076 1.00 0.00 H new ATOM 275 N ALA A 17 13.152 -7.134 -3.934 1.00 0.00 N ATOM 276 CA ALA A 17 11.850 -7.341 -4.577 1.00 0.00 C ATOM 277 C ALA A 17 11.315 -6.070 -5.235 1.00 0.00 C ATOM 278 O ALA A 17 11.656 -4.958 -4.837 1.00 0.00 O ATOM 279 CB ALA A 17 10.840 -7.879 -3.567 1.00 0.00 C ATOM 0 H ALA A 17 13.490 -6.172 -3.945 1.00 0.00 H new ATOM 0 HA ALA A 17 11.997 -8.075 -5.369 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.878 -8.028 -4.058 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.195 -8.829 -3.169 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.724 -7.164 -2.752 1.00 0.00 H new ATOM 285 N GLU A 18 10.467 -6.255 -6.249 1.00 0.00 N ATOM 286 CA GLU A 18 9.866 -5.132 -6.974 1.00 0.00 C ATOM 287 C GLU A 18 8.355 -5.319 -7.111 1.00 0.00 C ATOM 288 O GLU A 18 7.876 -6.440 -7.269 1.00 0.00 O ATOM 289 CB GLU A 18 10.501 -4.995 -8.360 1.00 0.00 C ATOM 290 CG GLU A 18 10.435 -6.269 -9.188 1.00 0.00 C ATOM 291 CD GLU A 18 10.993 -6.084 -10.585 1.00 0.00 C ATOM 292 OE1 GLU A 18 11.824 -5.173 -10.777 1.00 0.00 O ATOM 293 OE2 GLU A 18 10.598 -6.852 -11.487 1.00 0.00 O ATOM 0 H GLU A 18 10.180 -7.173 -6.588 1.00 0.00 H new ATOM 0 HA GLU A 18 10.052 -4.222 -6.404 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.000 -4.193 -8.902 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.544 -4.700 -8.245 1.00 0.00 H new ATOM 0 HG2 GLU A 18 10.990 -7.058 -8.680 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.399 -6.601 -9.255 1.00 0.00 H new ATOM 300 N CYS A 19 7.603 -4.215 -7.046 1.00 0.00 N ATOM 301 CA CYS A 19 6.140 -4.289 -7.162 1.00 0.00 C ATOM 302 C CYS A 19 5.531 -2.920 -7.472 1.00 0.00 C ATOM 303 O CYS A 19 6.058 -1.888 -7.054 1.00 0.00 O ATOM 304 CB CYS A 19 5.508 -4.861 -5.876 1.00 0.00 C ATOM 305 SG CYS A 19 6.652 -5.079 -4.490 1.00 0.00 S ATOM 0 H CYS A 19 7.974 -3.274 -6.916 1.00 0.00 H new ATOM 0 HA CYS A 19 5.920 -4.961 -7.992 1.00 0.00 H new ATOM 0 HB2 CYS A 19 4.701 -4.199 -5.561 1.00 0.00 H new ATOM 0 HB3 CYS A 19 5.056 -5.825 -6.109 1.00 0.00 H new ATOM 0 HG CYS A 19 5.980 -5.147 -3.379 1.00 0.00 H new ATOM 311 N GLU A 20 4.408 -2.918 -8.198 1.00 0.00 N ATOM 312 CA GLU A 20 3.724 -1.677 -8.553 1.00 0.00 C ATOM 313 C GLU A 20 2.258 -1.746 -8.134 1.00 0.00 C ATOM 314 O GLU A 20 1.703 -2.832 -7.970 1.00 0.00 O ATOM 315 CB GLU A 20 3.827 -1.412 -10.060 1.00 0.00 C ATOM 316 CG GLU A 20 5.101 -1.950 -10.692 1.00 0.00 C ATOM 317 CD GLU A 20 5.346 -1.386 -12.079 1.00 0.00 C ATOM 318 OE1 GLU A 20 4.726 -1.887 -13.041 1.00 0.00 O ATOM 319 OE2 GLU A 20 6.157 -0.445 -12.203 1.00 0.00 O ATOM 0 H GLU A 20 3.956 -3.762 -8.549 1.00 0.00 H new ATOM 0 HA GLU A 20 4.208 -0.856 -8.024 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.968 -1.861 -10.558 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.771 -0.338 -10.235 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.950 -1.711 -10.051 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.042 -3.037 -10.751 1.00 0.00 H new ATOM 326 N VAL A 21 1.635 -0.586 -7.952 1.00 0.00 N ATOM 327 CA VAL A 21 0.235 -0.533 -7.541 1.00 0.00 C ATOM 328 C VAL A 21 -0.444 0.744 -8.038 1.00 0.00 C ATOM 329 O VAL A 21 0.132 1.831 -7.983 1.00 0.00 O ATOM 330 CB VAL A 21 0.089 -0.652 -5.997 1.00 0.00 C ATOM 331 CG1 VAL A 21 1.450 -0.599 -5.318 1.00 0.00 C ATOM 332 CG2 VAL A 21 -0.833 0.423 -5.429 1.00 0.00 C ATOM 0 H VAL A 21 2.074 0.326 -8.082 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.263 -1.388 -7.998 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.367 -1.620 -5.790 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.322 -0.684 -4.239 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.068 -1.423 -5.676 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.937 0.348 -5.552 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.908 0.304 -4.348 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.428 1.408 -5.659 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.823 0.325 -5.874 1.00 0.00 H new ATOM 342 N GLU A 22 -1.678 0.595 -8.514 1.00 0.00 N ATOM 343 CA GLU A 22 -2.453 1.726 -9.013 1.00 0.00 C ATOM 344 C GLU A 22 -3.311 2.312 -7.898 1.00 0.00 C ATOM 345 O GLU A 22 -3.261 1.841 -6.762 1.00 0.00 O ATOM 346 CB GLU A 22 -3.339 1.289 -10.181 1.00 0.00 C ATOM 347 CG GLU A 22 -2.569 0.636 -11.318 1.00 0.00 C ATOM 348 CD GLU A 22 -2.839 -0.853 -11.425 1.00 0.00 C ATOM 349 OE1 GLU A 22 -2.413 -1.601 -10.521 1.00 0.00 O ATOM 350 OE2 GLU A 22 -3.476 -1.271 -12.416 1.00 0.00 O ATOM 0 H GLU A 22 -2.163 -0.301 -8.564 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.761 2.492 -9.364 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.091 0.590 -9.814 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.872 2.158 -10.566 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.837 1.119 -12.258 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.501 0.798 -11.169 1.00 0.00 H new ATOM 357 N LEU A 23 -4.098 3.336 -8.216 1.00 0.00 N ATOM 358 CA LEU A 23 -4.954 3.961 -7.215 1.00 0.00 C ATOM 359 C LEU A 23 -6.185 4.593 -7.856 1.00 0.00 C ATOM 360 O LEU A 23 -6.130 5.094 -8.979 1.00 0.00 O ATOM 361 CB LEU A 23 -4.158 5.001 -6.408 1.00 0.00 C ATOM 362 CG LEU A 23 -4.979 6.103 -5.717 1.00 0.00 C ATOM 363 CD1 LEU A 23 -5.670 5.569 -4.467 1.00 0.00 C ATOM 364 CD2 LEU A 23 -4.079 7.276 -5.360 1.00 0.00 C ATOM 0 H LEU A 23 -4.160 3.746 -9.148 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.302 3.186 -6.533 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.582 4.475 -5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.441 5.477 -7.077 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.749 6.441 -6.410 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.243 6.369 -3.998 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.341 4.755 -4.742 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.921 5.201 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.669 8.051 -4.871 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.292 6.939 -4.685 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.630 7.680 -6.268 1.00 0.00 H new ATOM 376 N TYR A 24 -7.295 4.564 -7.124 1.00 0.00 N ATOM 377 CA TYR A 24 -8.549 5.134 -7.608 1.00 0.00 C ATOM 378 C TYR A 24 -9.076 6.189 -6.633 1.00 0.00 C ATOM 379 O TYR A 24 -8.880 6.082 -5.422 1.00 0.00 O ATOM 380 CB TYR A 24 -9.591 4.027 -7.831 1.00 0.00 C ATOM 381 CG TYR A 24 -9.111 2.910 -8.733 1.00 0.00 C ATOM 382 CD1 TYR A 24 -8.248 3.165 -9.793 1.00 0.00 C ATOM 383 CD2 TYR A 24 -9.518 1.599 -8.523 1.00 0.00 C ATOM 384 CE1 TYR A 24 -7.807 2.147 -10.616 1.00 0.00 C ATOM 385 CE2 TYR A 24 -9.081 0.576 -9.341 1.00 0.00 C ATOM 386 CZ TYR A 24 -8.227 0.854 -10.387 1.00 0.00 C ATOM 387 OH TYR A 24 -7.790 -0.163 -11.203 1.00 0.00 O ATOM 0 H TYR A 24 -7.352 4.152 -6.193 1.00 0.00 H new ATOM 0 HA TYR A 24 -8.359 5.623 -8.564 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.873 3.606 -6.866 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.490 4.468 -8.261 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -7.917 4.177 -9.976 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -10.188 1.376 -7.706 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.137 2.363 -11.435 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -9.407 -0.438 -9.162 1.00 0.00 H new ATOM 0 HH TYR A 24 -6.897 0.053 -11.545 1.00 0.00 H new ATOM 397 N GLU A 25 -9.729 7.219 -7.174 1.00 0.00 N ATOM 398 CA GLU A 25 -10.268 8.316 -6.358 1.00 0.00 C ATOM 399 C GLU A 25 -11.246 7.841 -5.276 1.00 0.00 C ATOM 400 O GLU A 25 -11.651 8.631 -4.425 1.00 0.00 O ATOM 401 CB GLU A 25 -10.963 9.358 -7.237 1.00 0.00 C ATOM 402 CG GLU A 25 -10.025 10.121 -8.163 1.00 0.00 C ATOM 403 CD GLU A 25 -10.744 10.711 -9.359 1.00 0.00 C ATOM 404 OE1 GLU A 25 -11.839 10.215 -9.697 1.00 0.00 O ATOM 405 OE2 GLU A 25 -10.213 11.670 -9.959 1.00 0.00 O ATOM 0 H GLU A 25 -9.899 7.319 -8.175 1.00 0.00 H new ATOM 0 HA GLU A 25 -9.409 8.760 -5.855 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -11.723 8.860 -7.839 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -11.481 10.071 -6.595 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.539 10.921 -7.604 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.238 9.451 -8.510 1.00 0.00 H new ATOM 412 N GLU A 26 -11.639 6.567 -5.309 1.00 0.00 N ATOM 413 CA GLU A 26 -12.585 6.033 -4.325 1.00 0.00 C ATOM 414 C GLU A 26 -12.218 6.463 -2.900 1.00 0.00 C ATOM 415 O GLU A 26 -13.087 6.558 -2.034 1.00 0.00 O ATOM 416 CB GLU A 26 -12.641 4.504 -4.417 1.00 0.00 C ATOM 417 CG GLU A 26 -11.412 3.802 -3.855 1.00 0.00 C ATOM 418 CD GLU A 26 -11.315 2.357 -4.302 1.00 0.00 C ATOM 419 OE1 GLU A 26 -11.824 2.037 -5.395 1.00 0.00 O ATOM 420 OE2 GLU A 26 -10.728 1.545 -3.556 1.00 0.00 O ATOM 0 H GLU A 26 -11.320 5.889 -6.001 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.569 6.442 -4.555 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.524 4.151 -3.884 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.764 4.218 -5.462 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.516 4.337 -4.169 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.441 3.841 -2.766 1.00 0.00 H new ATOM 427 N TRP A 27 -10.938 6.746 -2.670 1.00 0.00 N ATOM 428 CA TRP A 27 -10.480 7.192 -1.361 1.00 0.00 C ATOM 429 C TRP A 27 -10.759 8.687 -1.208 1.00 0.00 C ATOM 430 O TRP A 27 -11.456 9.102 -0.282 1.00 0.00 O ATOM 431 CB TRP A 27 -8.982 6.892 -1.187 1.00 0.00 C ATOM 432 CG TRP A 27 -8.372 7.467 0.056 1.00 0.00 C ATOM 433 CD1 TRP A 27 -9.020 8.064 1.099 1.00 0.00 C ATOM 434 CD2 TRP A 27 -6.980 7.487 0.383 1.00 0.00 C ATOM 435 NE1 TRP A 27 -8.112 8.459 2.053 1.00 0.00 N ATOM 436 CE2 TRP A 27 -6.852 8.113 1.636 1.00 0.00 C ATOM 437 CE3 TRP A 27 -5.828 7.033 -0.264 1.00 0.00 C ATOM 438 CZ2 TRP A 27 -5.617 8.299 2.253 1.00 0.00 C ATOM 439 CZ3 TRP A 27 -4.602 7.217 0.349 1.00 0.00 C ATOM 440 CH2 TRP A 27 -4.505 7.845 1.596 1.00 0.00 C ATOM 0 H TRP A 27 -10.202 6.674 -3.373 1.00 0.00 H new ATOM 0 HA TRP A 27 -11.021 6.652 -0.584 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -8.839 5.811 -1.180 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -8.444 7.279 -2.053 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -10.089 8.205 1.165 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.338 8.932 2.928 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.894 6.547 -1.226 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.540 8.784 3.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -3.705 6.870 -0.143 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -3.533 7.974 2.049 1.00 0.00 H new ATOM 451 N ALA A 28 -10.235 9.483 -2.147 1.00 0.00 N ATOM 452 CA ALA A 28 -10.440 10.937 -2.150 1.00 0.00 C ATOM 453 C ALA A 28 -9.290 11.666 -2.847 1.00 0.00 C ATOM 454 O ALA A 28 -8.152 11.628 -2.379 1.00 0.00 O ATOM 455 CB ALA A 28 -10.607 11.481 -0.735 1.00 0.00 C ATOM 0 H ALA A 28 -9.662 9.142 -2.919 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.359 11.121 -2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.757 12.560 -0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.471 11.012 -0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.713 11.260 -0.152 1.00 0.00 H new ATOM 461 N PRO A 29 -9.569 12.351 -3.977 1.00 0.00 N ATOM 462 CA PRO A 29 -8.546 13.089 -4.723 1.00 0.00 C ATOM 463 C PRO A 29 -7.670 13.953 -3.815 1.00 0.00 C ATOM 464 O PRO A 29 -6.513 14.229 -4.134 1.00 0.00 O ATOM 465 CB PRO A 29 -9.343 13.982 -5.689 1.00 0.00 C ATOM 466 CG PRO A 29 -10.795 13.714 -5.429 1.00 0.00 C ATOM 467 CD PRO A 29 -10.891 12.454 -4.612 1.00 0.00 C ATOM 0 HA PRO A 29 -7.862 12.407 -5.228 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -9.109 15.034 -5.525 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -9.088 13.756 -6.724 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -11.248 14.550 -4.896 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -11.337 13.603 -6.368 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -11.688 12.517 -3.871 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -11.104 11.587 -5.237 1.00 0.00 H new ATOM 475 N GLU A 30 -8.230 14.384 -2.687 1.00 0.00 N ATOM 476 CA GLU A 30 -7.497 15.224 -1.740 1.00 0.00 C ATOM 477 C GLU A 30 -6.364 14.449 -1.073 1.00 0.00 C ATOM 478 O GLU A 30 -5.255 14.963 -0.925 1.00 0.00 O ATOM 479 CB GLU A 30 -8.441 15.785 -0.667 1.00 0.00 C ATOM 480 CG GLU A 30 -9.244 17.001 -1.113 1.00 0.00 C ATOM 481 CD GLU A 30 -8.737 18.291 -0.496 1.00 0.00 C ATOM 482 OE1 GLU A 30 -8.365 18.273 0.695 1.00 0.00 O ATOM 483 OE2 GLU A 30 -8.712 19.318 -1.206 1.00 0.00 O ATOM 0 H GLU A 30 -9.186 14.167 -2.406 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.066 16.051 -2.304 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.132 15.000 -0.361 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.855 16.054 0.212 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.203 17.081 -2.199 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -10.291 16.860 -0.843 1.00 0.00 H new ATOM 490 N THR A 31 -6.644 13.214 -0.670 1.00 0.00 N ATOM 491 CA THR A 31 -5.633 12.380 -0.013 1.00 0.00 C ATOM 492 C THR A 31 -4.556 11.954 -1.009 1.00 0.00 C ATOM 493 O THR A 31 -3.364 12.039 -0.721 1.00 0.00 O ATOM 494 CB THR A 31 -6.277 11.143 0.630 1.00 0.00 C ATOM 495 OG1 THR A 31 -7.629 11.010 0.224 1.00 0.00 O ATOM 496 CG2 THR A 31 -6.253 11.163 2.148 1.00 0.00 C ATOM 0 H THR A 31 -7.554 12.767 -0.784 1.00 0.00 H new ATOM 0 HA THR A 31 -5.167 12.975 0.773 1.00 0.00 H new ATOM 0 HB THR A 31 -5.675 10.301 0.288 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.985 10.156 0.548 1.00 0.00 H new ATOM 0 HG21 THR A 31 -6.725 10.258 2.531 1.00 0.00 H new ATOM 0 HG22 THR A 31 -5.221 11.209 2.495 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.796 12.036 2.509 1.00 0.00 H new ATOM 504 N VAL A 32 -4.986 11.503 -2.186 1.00 0.00 N ATOM 505 CA VAL A 32 -4.061 11.071 -3.229 1.00 0.00 C ATOM 506 C VAL A 32 -2.944 12.090 -3.434 1.00 0.00 C ATOM 507 O VAL A 32 -1.831 11.738 -3.826 1.00 0.00 O ATOM 508 CB VAL A 32 -4.796 10.856 -4.566 1.00 0.00 C ATOM 509 CG1 VAL A 32 -3.865 10.244 -5.602 1.00 0.00 C ATOM 510 CG2 VAL A 32 -6.027 9.985 -4.366 1.00 0.00 C ATOM 0 H VAL A 32 -5.971 11.428 -2.440 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.627 10.127 -2.900 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.122 11.828 -4.936 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.406 10.101 -6.538 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.019 10.910 -5.770 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.503 9.281 -5.242 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.533 9.845 -5.321 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.726 9.016 -3.969 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.706 10.470 -3.664 1.00 0.00 H new ATOM 520 N ARG A 33 -3.251 13.357 -3.168 1.00 0.00 N ATOM 521 CA ARG A 33 -2.276 14.433 -3.324 1.00 0.00 C ATOM 522 C ARG A 33 -1.062 14.214 -2.422 1.00 0.00 C ATOM 523 O ARG A 33 0.071 14.487 -2.819 1.00 0.00 O ATOM 524 CB ARG A 33 -2.922 15.787 -3.015 1.00 0.00 C ATOM 525 CG ARG A 33 -2.183 16.974 -3.616 1.00 0.00 C ATOM 526 CD ARG A 33 -2.668 18.286 -3.024 1.00 0.00 C ATOM 527 NE ARG A 33 -1.670 19.346 -3.149 1.00 0.00 N ATOM 528 CZ ARG A 33 -0.624 19.480 -2.338 1.00 0.00 C ATOM 529 NH1 ARG A 33 -0.432 18.622 -1.343 1.00 0.00 N ATOM 530 NH2 ARG A 33 0.235 20.473 -2.523 1.00 0.00 N ATOM 0 H ARG A 33 -4.168 13.664 -2.843 1.00 0.00 H new ATOM 0 HA ARG A 33 -1.936 14.429 -4.360 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -3.947 15.783 -3.387 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.976 15.915 -1.934 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.113 16.866 -3.438 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.327 16.985 -4.696 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -3.586 18.592 -3.525 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -2.912 18.140 -1.972 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.782 20.024 -3.903 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.088 17.855 -1.197 1.00 0.00 H new ATOM 0 HH12 ARG A 33 0.372 18.730 -0.724 1.00 0.00 H new ATOM 0 HH21 ARG A 33 0.094 21.134 -3.287 1.00 0.00 H new ATOM 0 HH22 ARG A 33 1.037 20.576 -1.901 1.00 0.00 H new ATOM 544 N ALA A 34 -1.301 13.723 -1.208 1.00 0.00 N ATOM 545 CA ALA A 34 -0.220 13.474 -0.261 1.00 0.00 C ATOM 546 C ALA A 34 0.701 12.371 -0.762 1.00 0.00 C ATOM 547 O ALA A 34 1.923 12.520 -0.754 1.00 0.00 O ATOM 548 CB ALA A 34 -0.779 13.122 1.107 1.00 0.00 C ATOM 0 H ALA A 34 -2.231 13.491 -0.859 1.00 0.00 H new ATOM 0 HA ALA A 34 0.366 14.388 -0.170 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.043 12.940 1.800 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.387 13.948 1.475 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.394 12.225 1.029 1.00 0.00 H new ATOM 554 N ILE A 35 0.112 11.267 -1.211 1.00 0.00 N ATOM 555 CA ILE A 35 0.902 10.150 -1.728 1.00 0.00 C ATOM 556 C ILE A 35 1.818 10.644 -2.852 1.00 0.00 C ATOM 557 O ILE A 35 3.023 10.390 -2.840 1.00 0.00 O ATOM 558 CB ILE A 35 0.036 8.989 -2.278 1.00 0.00 C ATOM 559 CG1 ILE A 35 -1.421 9.099 -1.816 1.00 0.00 C ATOM 560 CG2 ILE A 35 0.622 7.651 -1.852 1.00 0.00 C ATOM 561 CD1 ILE A 35 -1.586 9.040 -0.312 1.00 0.00 C ATOM 0 H ILE A 35 -0.897 11.120 -1.229 1.00 0.00 H new ATOM 0 HA ILE A 35 1.476 9.764 -0.886 1.00 0.00 H new ATOM 0 HB ILE A 35 0.044 9.057 -3.366 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.840 10.036 -2.183 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.999 8.293 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.005 6.842 -2.244 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.635 7.557 -2.242 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.646 7.594 -0.764 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.643 9.124 -0.058 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.198 8.092 0.060 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.036 9.862 0.147 1.00 0.00 H new ATOM 573 N ALA A 36 1.235 11.369 -3.819 1.00 0.00 N ATOM 574 CA ALA A 36 2.001 11.912 -4.935 1.00 0.00 C ATOM 575 C ALA A 36 3.030 12.919 -4.433 1.00 0.00 C ATOM 576 O ALA A 36 4.069 13.121 -5.052 1.00 0.00 O ATOM 577 CB ALA A 36 1.076 12.560 -5.951 1.00 0.00 C ATOM 0 H ALA A 36 0.239 11.588 -3.845 1.00 0.00 H new ATOM 0 HA ALA A 36 2.528 11.092 -5.423 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.665 12.960 -6.776 1.00 0.00 H new ATOM 0 HB2 ALA A 36 0.376 11.817 -6.332 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.523 13.370 -5.475 1.00 0.00 H new ATOM 583 N ASP A 37 2.738 13.549 -3.302 1.00 0.00 N ATOM 584 CA ASP A 37 3.661 14.521 -2.725 1.00 0.00 C ATOM 585 C ASP A 37 4.871 13.816 -2.101 1.00 0.00 C ATOM 586 O ASP A 37 5.940 14.410 -1.951 1.00 0.00 O ATOM 587 CB ASP A 37 2.951 15.370 -1.669 1.00 0.00 C ATOM 588 CG ASP A 37 3.618 16.717 -1.467 1.00 0.00 C ATOM 589 OD1 ASP A 37 4.609 16.781 -0.710 1.00 0.00 O ATOM 590 OD2 ASP A 37 3.148 17.708 -2.066 1.00 0.00 O ATOM 0 H ASP A 37 1.879 13.407 -2.770 1.00 0.00 H new ATOM 0 HA ASP A 37 4.012 15.172 -3.526 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.913 15.522 -1.966 1.00 0.00 H new ATOM 0 HB3 ASP A 37 2.935 14.830 -0.723 1.00 0.00 H new ATOM 595 N ALA A 38 4.689 12.548 -1.730 1.00 0.00 N ATOM 596 CA ALA A 38 5.739 11.752 -1.113 1.00 0.00 C ATOM 597 C ALA A 38 6.447 10.851 -2.132 1.00 0.00 C ATOM 598 O ALA A 38 6.631 9.657 -1.894 1.00 0.00 O ATOM 599 CB ALA A 38 5.137 10.916 0.006 1.00 0.00 C ATOM 0 H ALA A 38 3.808 12.048 -1.851 1.00 0.00 H new ATOM 0 HA ALA A 38 6.491 12.429 -0.708 1.00 0.00 H new ATOM 0 HB1 ALA A 38 5.918 10.317 0.473 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.690 11.574 0.751 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.371 10.258 -0.403 1.00 0.00 H new ATOM 605 N LEU A 39 6.860 11.436 -3.254 1.00 0.00 N ATOM 606 CA LEU A 39 7.570 10.691 -4.301 1.00 0.00 C ATOM 607 C LEU A 39 8.896 10.137 -3.734 1.00 0.00 C ATOM 608 O LEU A 39 8.998 10.003 -2.517 1.00 0.00 O ATOM 609 CB LEU A 39 7.756 11.578 -5.542 1.00 0.00 C ATOM 610 CG LEU A 39 6.456 12.135 -6.145 1.00 0.00 C ATOM 611 CD1 LEU A 39 6.674 12.523 -7.598 1.00 0.00 C ATOM 612 CD2 LEU A 39 5.317 11.118 -6.038 1.00 0.00 C ATOM 0 H LEU A 39 6.717 12.424 -3.465 1.00 0.00 H new ATOM 0 HA LEU A 39 6.983 9.831 -4.624 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.404 12.414 -5.278 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.276 11.001 -6.307 1.00 0.00 H new ATOM 0 HG LEU A 39 6.174 13.022 -5.577 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.746 12.916 -8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.450 13.286 -7.658 1.00 0.00 H new ATOM 0 HD13 LEU A 39 6.983 11.646 -8.166 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.411 11.540 -6.472 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.589 10.210 -6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.140 10.879 -4.989 1.00 0.00 H new ATOM 624 N PRO A 40 9.929 9.764 -4.554 1.00 0.00 N ATOM 625 CA PRO A 40 11.178 9.206 -4.030 1.00 0.00 C ATOM 626 C PRO A 40 11.531 9.682 -2.623 1.00 0.00 C ATOM 627 O PRO A 40 11.950 10.822 -2.420 1.00 0.00 O ATOM 628 CB PRO A 40 12.201 9.685 -5.045 1.00 0.00 C ATOM 629 CG PRO A 40 11.467 9.662 -6.346 1.00 0.00 C ATOM 630 CD PRO A 40 9.992 9.825 -6.032 1.00 0.00 C ATOM 0 HA PRO A 40 11.122 8.123 -3.918 1.00 0.00 H new ATOM 0 HB2 PRO A 40 12.558 10.687 -4.807 1.00 0.00 H new ATOM 0 HB3 PRO A 40 13.074 9.032 -5.069 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.813 10.465 -6.997 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.647 8.725 -6.873 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.606 10.772 -6.409 1.00 0.00 H new ATOM 0 HD3 PRO A 40 9.397 9.034 -6.489 1.00 0.00 H new ATOM 638 N ILE A 41 11.361 8.780 -1.663 1.00 0.00 N ATOM 639 CA ILE A 41 11.656 9.061 -0.262 1.00 0.00 C ATOM 640 C ILE A 41 12.102 7.776 0.433 1.00 0.00 C ATOM 641 O ILE A 41 11.689 6.683 0.047 1.00 0.00 O ATOM 642 CB ILE A 41 10.430 9.666 0.469 1.00 0.00 C ATOM 643 CG1 ILE A 41 10.199 11.112 0.014 1.00 0.00 C ATOM 644 CG2 ILE A 41 10.619 9.622 1.982 1.00 0.00 C ATOM 645 CD1 ILE A 41 9.059 11.805 0.731 1.00 0.00 C ATOM 0 H ILE A 41 11.016 7.835 -1.833 1.00 0.00 H new ATOM 0 HA ILE A 41 12.458 9.798 -0.223 1.00 0.00 H new ATOM 0 HB ILE A 41 9.556 9.067 0.213 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.114 11.683 0.171 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.999 11.118 -1.057 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.745 10.052 2.471 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.742 8.588 2.303 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.506 10.194 2.255 1.00 0.00 H new ATOM 0 HD11 ILE A 41 8.958 12.823 0.355 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.132 11.259 0.554 1.00 0.00 H new ATOM 0 HD13 ILE A 41 9.265 11.832 1.801 1.00 0.00 H new ATOM 657 N LYS A 42 12.959 7.904 1.439 1.00 0.00 N ATOM 658 CA LYS A 42 13.463 6.735 2.153 1.00 0.00 C ATOM 659 C LYS A 42 12.525 6.306 3.282 1.00 0.00 C ATOM 660 O LYS A 42 12.051 7.132 4.063 1.00 0.00 O ATOM 661 CB LYS A 42 14.862 7.014 2.708 1.00 0.00 C ATOM 662 CG LYS A 42 15.973 6.766 1.700 1.00 0.00 C ATOM 663 CD LYS A 42 17.275 6.372 2.380 1.00 0.00 C ATOM 664 CE LYS A 42 18.093 7.596 2.763 1.00 0.00 C ATOM 665 NZ LYS A 42 17.577 8.243 4.000 1.00 0.00 N ATOM 0 H LYS A 42 13.318 8.797 1.777 1.00 0.00 H new ATOM 0 HA LYS A 42 13.515 5.914 1.438 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.911 8.050 3.044 1.00 0.00 H new ATOM 0 HB3 LYS A 42 15.029 6.386 3.583 1.00 0.00 H new ATOM 0 HG2 LYS A 42 15.670 5.978 1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 42 16.131 7.665 1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 42 17.058 5.784 3.272 1.00 0.00 H new ATOM 0 HD3 LYS A 42 17.858 5.737 1.713 1.00 0.00 H new ATOM 0 HE2 LYS A 42 19.133 7.306 2.912 1.00 0.00 H new ATOM 0 HE3 LYS A 42 18.077 8.315 1.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 18.336 8.798 4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 16.784 8.871 3.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 17.250 7.512 4.663 1.00 0.00 H new ATOM 679 N SER A 43 12.264 5.000 3.356 1.00 0.00 N ATOM 680 CA SER A 43 11.389 4.434 4.376 1.00 0.00 C ATOM 681 C SER A 43 11.883 3.051 4.799 1.00 0.00 C ATOM 682 O SER A 43 12.480 2.328 4.002 1.00 0.00 O ATOM 683 CB SER A 43 9.950 4.346 3.864 1.00 0.00 C ATOM 684 OG SER A 43 9.696 3.109 3.229 1.00 0.00 O ATOM 0 H SER A 43 12.652 4.310 2.713 1.00 0.00 H new ATOM 0 HA SER A 43 11.409 5.092 5.244 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.259 4.476 4.697 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.762 5.160 3.164 1.00 0.00 H new ATOM 0 HG SER A 43 8.806 2.787 3.485 1.00 0.00 H new ATOM 690 N THR A 44 11.633 2.685 6.054 1.00 0.00 N ATOM 691 CA THR A 44 12.063 1.380 6.566 1.00 0.00 C ATOM 692 C THR A 44 10.883 0.413 6.600 1.00 0.00 C ATOM 693 O THR A 44 9.791 0.763 7.047 1.00 0.00 O ATOM 694 CB THR A 44 12.672 1.523 7.965 1.00 0.00 C ATOM 695 OG1 THR A 44 12.961 2.880 8.251 1.00 0.00 O ATOM 696 CG2 THR A 44 13.953 0.733 8.146 1.00 0.00 C ATOM 0 H THR A 44 11.140 3.266 6.732 1.00 0.00 H new ATOM 0 HA THR A 44 12.826 0.981 5.898 1.00 0.00 H new ATOM 0 HB THR A 44 11.920 1.127 8.648 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.347 2.950 9.149 1.00 0.00 H new ATOM 0 HG21 THR A 44 14.331 0.879 9.158 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.754 -0.326 7.982 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.697 1.077 7.428 1.00 0.00 H new ATOM 704 N ALA A 45 11.105 -0.794 6.090 1.00 0.00 N ATOM 705 CA ALA A 45 10.056 -1.807 6.018 1.00 0.00 C ATOM 706 C ALA A 45 9.996 -2.706 7.248 1.00 0.00 C ATOM 707 O ALA A 45 11.019 -3.180 7.742 1.00 0.00 O ATOM 708 CB ALA A 45 10.252 -2.666 4.777 1.00 0.00 C ATOM 0 H ALA A 45 12.006 -1.096 5.719 1.00 0.00 H new ATOM 0 HA ALA A 45 9.110 -1.268 5.970 1.00 0.00 H new ATOM 0 HB1 ALA A 45 9.466 -3.420 4.729 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.206 -2.037 3.888 1.00 0.00 H new ATOM 0 HB3 ALA A 45 11.224 -3.157 4.824 1.00 0.00 H new ATOM 714 N ASN A 46 8.772 -2.967 7.702 1.00 0.00 N ATOM 715 CA ASN A 46 8.542 -3.852 8.842 1.00 0.00 C ATOM 716 C ASN A 46 7.962 -5.182 8.342 1.00 0.00 C ATOM 717 O ASN A 46 6.908 -5.197 7.706 1.00 0.00 O ATOM 718 CB ASN A 46 7.581 -3.201 9.839 1.00 0.00 C ATOM 719 CG ASN A 46 8.296 -2.306 10.832 1.00 0.00 C ATOM 720 OD1 ASN A 46 9.354 -2.660 11.355 1.00 0.00 O ATOM 721 ND2 ASN A 46 7.722 -1.138 11.098 1.00 0.00 N ATOM 0 H ASN A 46 7.921 -2.577 7.296 1.00 0.00 H new ATOM 0 HA ASN A 46 9.489 -4.036 9.349 1.00 0.00 H new ATOM 0 HB2 ASN A 46 6.839 -2.616 9.295 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.040 -3.978 10.379 1.00 0.00 H new ATOM 0 HD21 ASN A 46 8.158 -0.494 11.758 1.00 0.00 H new ATOM 0 HD22 ASN A 46 6.845 -0.885 10.642 1.00 0.00 H new ATOM 728 N ARG A 47 8.656 -6.296 8.599 1.00 0.00 N ATOM 729 CA ARG A 47 8.194 -7.604 8.132 1.00 0.00 C ATOM 730 C ARG A 47 7.181 -8.238 9.097 1.00 0.00 C ATOM 731 O ARG A 47 7.450 -8.377 10.290 1.00 0.00 O ATOM 732 CB ARG A 47 9.393 -8.540 7.949 1.00 0.00 C ATOM 733 CG ARG A 47 9.851 -8.699 6.501 1.00 0.00 C ATOM 734 CD ARG A 47 10.528 -7.445 5.970 1.00 0.00 C ATOM 735 NE ARG A 47 9.568 -6.418 5.569 1.00 0.00 N ATOM 736 CZ ARG A 47 9.592 -5.791 4.393 1.00 0.00 C ATOM 737 NH1 ARG A 47 10.528 -6.075 3.494 1.00 0.00 N ATOM 738 NH2 ARG A 47 8.687 -4.862 4.119 1.00 0.00 N ATOM 0 H ARG A 47 9.531 -6.317 9.123 1.00 0.00 H new ATOM 0 HA ARG A 47 7.688 -7.454 7.178 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.227 -8.164 8.542 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.136 -9.522 8.347 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.541 -9.540 6.431 1.00 0.00 H new ATOM 0 HG3 ARG A 47 8.992 -8.939 5.875 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.189 -7.040 6.737 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.153 -7.707 5.116 1.00 0.00 H new ATOM 0 HE ARG A 47 8.834 -6.165 6.231 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.237 -6.779 3.701 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.538 -5.590 2.597 1.00 0.00 H new ATOM 0 HH21 ARG A 47 7.973 -4.627 4.808 1.00 0.00 H new ATOM 0 HH22 ARG A 47 8.705 -4.382 3.219 1.00 0.00 H new ATOM 752 N TRP A 48 6.023 -8.640 8.561 1.00 0.00 N ATOM 753 CA TRP A 48 4.976 -9.283 9.357 1.00 0.00 C ATOM 754 C TRP A 48 4.240 -10.309 8.495 1.00 0.00 C ATOM 755 O TRP A 48 4.127 -10.129 7.284 1.00 0.00 O ATOM 756 CB TRP A 48 3.990 -8.249 9.912 1.00 0.00 C ATOM 757 CG TRP A 48 2.890 -8.857 10.730 1.00 0.00 C ATOM 758 CD1 TRP A 48 1.850 -9.615 10.271 1.00 0.00 C ATOM 759 CD2 TRP A 48 2.720 -8.757 12.149 1.00 0.00 C ATOM 760 NE1 TRP A 48 1.046 -9.994 11.318 1.00 0.00 N ATOM 761 CE2 TRP A 48 1.557 -9.479 12.480 1.00 0.00 C ATOM 762 CE3 TRP A 48 3.437 -8.128 13.170 1.00 0.00 C ATOM 763 CZ2 TRP A 48 1.097 -9.589 13.791 1.00 0.00 C ATOM 764 CZ3 TRP A 48 2.979 -8.238 14.470 1.00 0.00 C ATOM 765 CH2 TRP A 48 1.819 -8.963 14.771 1.00 0.00 C ATOM 0 H TRP A 48 5.788 -8.530 7.574 1.00 0.00 H new ATOM 0 HA TRP A 48 5.442 -9.786 10.204 1.00 0.00 H new ATOM 0 HB2 TRP A 48 4.534 -7.531 10.525 1.00 0.00 H new ATOM 0 HB3 TRP A 48 3.552 -7.693 9.083 1.00 0.00 H new ATOM 0 HD1 TRP A 48 1.684 -9.878 9.237 1.00 0.00 H new ATOM 0 HE1 TRP A 48 0.205 -10.566 11.243 1.00 0.00 H new ATOM 0 HE3 TRP A 48 4.332 -7.566 12.948 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 0.203 -10.148 14.025 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 3.525 -7.756 15.267 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.488 -9.029 15.797 1.00 0.00 H new ATOM 776 N GLY A 49 3.756 -11.389 9.121 1.00 0.00 N ATOM 777 CA GLY A 49 3.049 -12.436 8.391 1.00 0.00 C ATOM 778 C GLY A 49 2.225 -11.905 7.233 1.00 0.00 C ATOM 779 O GLY A 49 1.075 -11.507 7.413 1.00 0.00 O ATOM 0 H GLY A 49 3.842 -11.556 10.124 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.773 -13.158 8.013 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.394 -12.971 9.079 1.00 0.00 H new ATOM 783 N ASP A 50 2.825 -11.885 6.045 1.00 0.00 N ATOM 784 CA ASP A 50 2.159 -11.388 4.841 1.00 0.00 C ATOM 785 C ASP A 50 2.008 -9.866 4.869 1.00 0.00 C ATOM 786 O ASP A 50 2.148 -9.204 3.841 1.00 0.00 O ATOM 787 CB ASP A 50 0.786 -12.044 4.663 1.00 0.00 C ATOM 788 CG ASP A 50 0.076 -11.553 3.419 1.00 0.00 C ATOM 789 OD1 ASP A 50 0.706 -11.543 2.342 1.00 0.00 O ATOM 790 OD2 ASP A 50 -1.109 -11.170 3.523 1.00 0.00 O ATOM 0 H ASP A 50 3.779 -12.210 5.889 1.00 0.00 H new ATOM 0 HA ASP A 50 2.790 -11.654 3.993 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.906 -13.126 4.608 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.169 -11.836 5.537 1.00 0.00 H new ATOM 795 N GLU A 51 1.716 -9.314 6.043 1.00 0.00 N ATOM 796 CA GLU A 51 1.542 -7.877 6.186 1.00 0.00 C ATOM 797 C GLU A 51 2.889 -7.171 6.247 1.00 0.00 C ATOM 798 O GLU A 51 3.825 -7.645 6.888 1.00 0.00 O ATOM 799 CB GLU A 51 0.726 -7.563 7.443 1.00 0.00 C ATOM 800 CG GLU A 51 -0.445 -6.626 7.188 1.00 0.00 C ATOM 801 CD GLU A 51 -0.083 -5.167 7.384 1.00 0.00 C ATOM 802 OE1 GLU A 51 1.111 -4.876 7.615 1.00 0.00 O ATOM 803 OE2 GLU A 51 -0.993 -4.315 7.307 1.00 0.00 O ATOM 0 H GLU A 51 1.595 -9.842 6.907 1.00 0.00 H new ATOM 0 HA GLU A 51 1.002 -7.512 5.313 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.350 -8.495 7.865 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.382 -7.117 8.190 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.807 -6.772 6.170 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.265 -6.885 7.858 1.00 0.00 H new ATOM 810 N ILE A 52 2.975 -6.029 5.579 1.00 0.00 N ATOM 811 CA ILE A 52 4.201 -5.244 5.556 1.00 0.00 C ATOM 812 C ILE A 52 3.859 -3.759 5.540 1.00 0.00 C ATOM 813 O ILE A 52 3.302 -3.254 4.566 1.00 0.00 O ATOM 814 CB ILE A 52 5.082 -5.612 4.329 1.00 0.00 C ATOM 815 CG1 ILE A 52 6.125 -6.683 4.712 1.00 0.00 C ATOM 816 CG2 ILE A 52 5.774 -4.381 3.746 1.00 0.00 C ATOM 817 CD1 ILE A 52 6.039 -7.974 3.915 1.00 0.00 C ATOM 0 H ILE A 52 2.207 -5.624 5.044 1.00 0.00 H new ATOM 0 HA ILE A 52 4.774 -5.472 6.455 1.00 0.00 H new ATOM 0 HB ILE A 52 4.424 -6.020 3.562 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.122 -6.260 4.585 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.011 -6.918 5.770 1.00 0.00 H new ATOM 0 HG21 ILE A 52 6.381 -4.676 2.890 1.00 0.00 H new ATOM 0 HG22 ILE A 52 5.023 -3.659 3.426 1.00 0.00 H new ATOM 0 HG23 ILE A 52 6.412 -3.929 4.505 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.811 -8.664 4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.058 -8.427 4.060 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.186 -7.759 2.857 1.00 0.00 H new ATOM 829 N TYR A 53 4.180 -3.069 6.624 1.00 0.00 N ATOM 830 CA TYR A 53 3.883 -1.640 6.730 1.00 0.00 C ATOM 831 C TYR A 53 5.130 -0.819 7.018 1.00 0.00 C ATOM 832 O TYR A 53 5.985 -1.212 7.812 1.00 0.00 O ATOM 833 CB TYR A 53 2.832 -1.387 7.820 1.00 0.00 C ATOM 834 CG TYR A 53 3.282 -1.792 9.209 1.00 0.00 C ATOM 835 CD1 TYR A 53 4.076 -0.950 9.981 1.00 0.00 C ATOM 836 CD2 TYR A 53 2.911 -3.019 9.750 1.00 0.00 C ATOM 837 CE1 TYR A 53 4.487 -1.319 11.247 1.00 0.00 C ATOM 838 CE2 TYR A 53 3.319 -3.393 11.016 1.00 0.00 C ATOM 839 CZ TYR A 53 4.105 -2.541 11.759 1.00 0.00 C ATOM 840 OH TYR A 53 4.514 -2.911 13.021 1.00 0.00 O ATOM 0 H TYR A 53 4.643 -3.468 7.440 1.00 0.00 H new ATOM 0 HA TYR A 53 3.488 -1.323 5.765 1.00 0.00 H new ATOM 0 HB2 TYR A 53 2.576 -0.328 7.826 1.00 0.00 H new ATOM 0 HB3 TYR A 53 1.923 -1.933 7.569 1.00 0.00 H new ATOM 0 HD1 TYR A 53 4.376 0.008 9.584 1.00 0.00 H new ATOM 0 HD2 TYR A 53 2.294 -3.690 9.171 1.00 0.00 H new ATOM 0 HE1 TYR A 53 5.104 -0.654 11.833 1.00 0.00 H new ATOM 0 HE2 TYR A 53 3.023 -4.349 11.421 1.00 0.00 H new ATOM 0 HH TYR A 53 4.159 -3.800 13.233 1.00 0.00 H new ATOM 850 N PHE A 54 5.217 0.334 6.366 1.00 0.00 N ATOM 851 CA PHE A 54 6.343 1.237 6.540 1.00 0.00 C ATOM 852 C PHE A 54 5.868 2.688 6.540 1.00 0.00 C ATOM 853 O PHE A 54 4.956 3.050 5.797 1.00 0.00 O ATOM 854 CB PHE A 54 7.381 1.015 5.433 1.00 0.00 C ATOM 855 CG PHE A 54 6.909 1.401 4.053 1.00 0.00 C ATOM 856 CD1 PHE A 54 6.687 2.729 3.721 1.00 0.00 C ATOM 857 CD2 PHE A 54 6.690 0.431 3.085 1.00 0.00 C ATOM 858 CE1 PHE A 54 6.256 3.081 2.456 1.00 0.00 C ATOM 859 CE2 PHE A 54 6.257 0.779 1.819 1.00 0.00 C ATOM 860 CZ PHE A 54 6.040 2.105 1.506 1.00 0.00 C ATOM 0 H PHE A 54 4.513 0.666 5.707 1.00 0.00 H new ATOM 0 HA PHE A 54 6.810 1.026 7.502 1.00 0.00 H new ATOM 0 HB2 PHE A 54 8.277 1.588 5.671 1.00 0.00 H new ATOM 0 HB3 PHE A 54 7.668 -0.037 5.425 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.853 3.498 4.461 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.860 -0.609 3.324 1.00 0.00 H new ATOM 0 HE1 PHE A 54 6.088 4.120 2.212 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.089 0.014 1.076 1.00 0.00 H new ATOM 0 HZ PHE A 54 5.701 2.378 0.518 1.00 0.00 H new ATOM 870 N THR A 55 6.489 3.517 7.373 1.00 0.00 N ATOM 871 CA THR A 55 6.120 4.929 7.455 1.00 0.00 C ATOM 872 C THR A 55 6.967 5.754 6.488 1.00 0.00 C ATOM 873 O THR A 55 8.133 5.437 6.255 1.00 0.00 O ATOM 874 CB THR A 55 6.300 5.446 8.884 1.00 0.00 C ATOM 875 OG1 THR A 55 6.327 4.370 9.806 1.00 0.00 O ATOM 876 CG2 THR A 55 5.205 6.395 9.320 1.00 0.00 C ATOM 0 H THR A 55 7.246 3.239 7.998 1.00 0.00 H new ATOM 0 HA THR A 55 5.071 5.029 7.177 1.00 0.00 H new ATOM 0 HB THR A 55 7.246 5.987 8.878 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.444 4.720 10.714 1.00 0.00 H new ATOM 0 HG21 THR A 55 5.394 6.723 10.342 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.189 7.261 8.658 1.00 0.00 H new ATOM 0 HG23 THR A 55 4.243 5.885 9.275 1.00 0.00 H new ATOM 884 N THR A 56 6.380 6.805 5.919 1.00 0.00 N ATOM 885 CA THR A 56 7.099 7.653 4.972 1.00 0.00 C ATOM 886 C THR A 56 7.184 9.102 5.452 1.00 0.00 C ATOM 887 O THR A 56 7.679 9.970 4.734 1.00 0.00 O ATOM 888 CB THR A 56 6.429 7.598 3.598 1.00 0.00 C ATOM 889 OG1 THR A 56 5.193 6.909 3.666 1.00 0.00 O ATOM 890 CG2 THR A 56 7.279 6.915 2.546 1.00 0.00 C ATOM 0 H THR A 56 5.416 7.088 6.096 1.00 0.00 H new ATOM 0 HA THR A 56 8.116 7.268 4.897 1.00 0.00 H new ATOM 0 HB THR A 56 6.283 8.638 3.307 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.781 6.887 2.777 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.746 6.909 1.595 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.219 7.454 2.432 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.484 5.889 2.853 1.00 0.00 H new ATOM 898 N GLN A 57 6.702 9.356 6.668 1.00 0.00 N ATOM 899 CA GLN A 57 6.727 10.701 7.253 1.00 0.00 C ATOM 900 C GLN A 57 5.550 11.554 6.772 1.00 0.00 C ATOM 901 O GLN A 57 5.335 12.655 7.278 1.00 0.00 O ATOM 902 CB GLN A 57 8.052 11.422 6.950 1.00 0.00 C ATOM 903 CG GLN A 57 9.273 10.517 7.022 1.00 0.00 C ATOM 904 CD GLN A 57 10.284 10.977 8.054 1.00 0.00 C ATOM 905 OE1 GLN A 57 10.678 12.143 8.077 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.708 10.061 8.916 1.00 0.00 N ATOM 0 H GLN A 57 6.287 8.646 7.272 1.00 0.00 H new ATOM 0 HA GLN A 57 6.638 10.572 8.332 1.00 0.00 H new ATOM 0 HB2 GLN A 57 7.996 11.863 5.955 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.178 12.243 7.656 1.00 0.00 H new ATOM 0 HG2 GLN A 57 8.954 9.502 7.259 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.751 10.480 6.043 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.354 9.106 8.860 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.387 10.312 9.634 1.00 0.00 H new ATOM 915 N VAL A 58 4.779 11.047 5.810 1.00 0.00 N ATOM 916 CA VAL A 58 3.628 11.788 5.305 1.00 0.00 C ATOM 917 C VAL A 58 2.408 11.525 6.179 1.00 0.00 C ATOM 918 O VAL A 58 1.930 10.394 6.270 1.00 0.00 O ATOM 919 CB VAL A 58 3.308 11.431 3.835 1.00 0.00 C ATOM 920 CG1 VAL A 58 2.960 9.955 3.684 1.00 0.00 C ATOM 921 CG2 VAL A 58 2.179 12.303 3.306 1.00 0.00 C ATOM 0 H VAL A 58 4.929 10.139 5.371 1.00 0.00 H new ATOM 0 HA VAL A 58 3.882 12.847 5.341 1.00 0.00 H new ATOM 0 HB VAL A 58 4.203 11.624 3.244 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.740 9.738 2.639 1.00 0.00 H new ATOM 0 HG12 VAL A 58 3.803 9.347 4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 58 2.087 9.723 4.294 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.968 12.037 2.270 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.285 12.147 3.910 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.474 13.351 3.359 1.00 0.00 H new ATOM 931 N ALA A 59 1.912 12.572 6.834 1.00 0.00 N ATOM 932 CA ALA A 59 0.753 12.433 7.714 1.00 0.00 C ATOM 933 C ALA A 59 -0.528 12.903 7.037 1.00 0.00 C ATOM 934 O ALA A 59 -0.860 14.088 7.062 1.00 0.00 O ATOM 935 CB ALA A 59 0.963 13.186 9.023 1.00 0.00 C ATOM 0 H ALA A 59 2.290 13.518 6.774 1.00 0.00 H new ATOM 0 HA ALA A 59 0.647 11.371 7.936 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.085 13.065 9.657 1.00 0.00 H new ATOM 0 HB2 ALA A 59 1.839 12.788 9.535 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.116 14.245 8.813 1.00 0.00 H new ATOM 941 N VAL A 60 -1.250 11.958 6.448 1.00 0.00 N ATOM 942 CA VAL A 60 -2.508 12.259 5.777 1.00 0.00 C ATOM 943 C VAL A 60 -3.632 11.394 6.344 1.00 0.00 C ATOM 944 O VAL A 60 -3.689 10.193 6.083 1.00 0.00 O ATOM 945 CB VAL A 60 -2.396 12.029 4.251 1.00 0.00 C ATOM 946 CG1 VAL A 60 -1.924 10.610 3.947 1.00 0.00 C ATOM 947 CG2 VAL A 60 -3.720 12.317 3.553 1.00 0.00 C ATOM 0 H VAL A 60 -0.985 10.973 6.422 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.736 13.310 5.953 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.653 12.726 3.864 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.853 10.473 2.868 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.945 10.448 4.398 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.636 9.894 4.357 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.611 12.147 2.482 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.491 11.656 3.949 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.006 13.354 3.728 1.00 0.00 H new ATOM 957 N GLU A 61 -4.518 12.002 7.133 1.00 0.00 N ATOM 958 CA GLU A 61 -5.621 11.262 7.736 1.00 0.00 C ATOM 959 C GLU A 61 -6.944 12.007 7.580 1.00 0.00 C ATOM 960 O GLU A 61 -7.033 13.203 7.854 1.00 0.00 O ATOM 961 CB GLU A 61 -5.334 11.006 9.220 1.00 0.00 C ATOM 962 CG GLU A 61 -4.940 9.569 9.520 1.00 0.00 C ATOM 963 CD GLU A 61 -4.460 9.385 10.947 1.00 0.00 C ATOM 964 OE1 GLU A 61 -3.855 10.328 11.497 1.00 0.00 O ATOM 965 OE2 GLU A 61 -4.690 8.296 11.514 1.00 0.00 O ATOM 0 H GLU A 61 -4.493 12.995 7.366 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.709 10.309 7.215 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.534 11.670 9.547 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.219 11.261 9.803 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.794 8.916 9.340 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.153 9.260 8.832 1.00 0.00 H new ATOM 972 N LYS A 62 -7.970 11.282 7.142 1.00 0.00 N ATOM 973 CA LYS A 62 -9.295 11.859 6.952 1.00 0.00 C ATOM 974 C LYS A 62 -10.369 10.792 7.172 1.00 0.00 C ATOM 975 O LYS A 62 -10.073 9.598 7.167 1.00 0.00 O ATOM 976 CB LYS A 62 -9.416 12.449 5.542 1.00 0.00 C ATOM 977 CG LYS A 62 -10.361 13.640 5.439 1.00 0.00 C ATOM 978 CD LYS A 62 -9.650 14.949 5.746 1.00 0.00 C ATOM 979 CE LYS A 62 -9.558 15.199 7.242 1.00 0.00 C ATOM 980 NZ LYS A 62 -10.865 14.983 7.923 1.00 0.00 N ATOM 0 H LYS A 62 -7.907 10.290 6.912 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.439 12.658 7.680 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.426 12.755 5.203 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.759 11.669 4.863 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.785 13.683 4.436 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.192 13.506 6.131 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.648 14.928 5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.183 15.773 5.271 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -8.809 14.536 7.675 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.221 16.220 7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -10.996 15.705 8.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -11.635 15.054 7.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -10.878 14.038 8.358 1.00 0.00 H new ATOM 994 N GLU A 63 -11.616 11.222 7.363 1.00 0.00 N ATOM 995 CA GLU A 63 -12.713 10.286 7.582 1.00 0.00 C ATOM 996 C GLU A 63 -13.408 9.951 6.267 1.00 0.00 C ATOM 997 O GLU A 63 -14.379 10.602 5.882 1.00 0.00 O ATOM 998 CB GLU A 63 -13.728 10.866 8.567 1.00 0.00 C ATOM 999 CG GLU A 63 -13.100 11.678 9.690 1.00 0.00 C ATOM 1000 CD GLU A 63 -13.058 13.163 9.383 1.00 0.00 C ATOM 1001 OE1 GLU A 63 -13.945 13.642 8.646 1.00 0.00 O ATOM 1002 OE2 GLU A 63 -12.136 13.845 9.880 1.00 0.00 O ATOM 0 H GLU A 63 -11.888 12.205 7.370 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.294 9.372 8.002 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -14.429 11.499 8.022 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -14.306 10.050 9.001 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -13.663 11.517 10.609 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -12.087 11.319 9.870 1.00 0.00 H new ATOM 1009 N GLU A 64 -12.903 8.933 5.583 1.00 0.00 N ATOM 1010 CA GLU A 64 -13.474 8.513 4.307 1.00 0.00 C ATOM 1011 C GLU A 64 -12.869 7.180 3.850 1.00 0.00 C ATOM 1012 O GLU A 64 -11.703 6.897 4.128 1.00 0.00 O ATOM 1013 CB GLU A 64 -13.233 9.591 3.248 1.00 0.00 C ATOM 1014 CG GLU A 64 -11.761 9.875 2.993 1.00 0.00 C ATOM 1015 CD GLU A 64 -11.496 11.326 2.648 1.00 0.00 C ATOM 1016 OE1 GLU A 64 -12.332 12.183 3.008 1.00 0.00 O ATOM 1017 OE2 GLU A 64 -10.455 11.607 2.018 1.00 0.00 O ATOM 0 H GLU A 64 -12.100 8.383 5.888 1.00 0.00 H new ATOM 0 HA GLU A 64 -14.547 8.373 4.439 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -13.702 9.282 2.314 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -13.723 10.513 3.561 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -11.185 9.605 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -11.409 9.242 2.178 1.00 0.00 H new ATOM 1024 N ASN A 65 -13.659 6.362 3.144 1.00 0.00 N ATOM 1025 CA ASN A 65 -13.184 5.071 2.655 1.00 0.00 C ATOM 1026 C ASN A 65 -13.030 4.074 3.803 1.00 0.00 C ATOM 1027 O ASN A 65 -13.928 3.271 4.057 1.00 0.00 O ATOM 1028 CB ASN A 65 -11.857 5.231 1.903 1.00 0.00 C ATOM 1029 CG ASN A 65 -11.571 4.058 0.985 1.00 0.00 C ATOM 1030 OD1 ASN A 65 -10.607 4.229 0.088 1.00 0.00 O flip ATOM 1031 ND2 ASN A 65 -12.210 3.010 1.081 1.00 0.00 N flip ATOM 0 H ASN A 65 -14.627 6.574 2.901 1.00 0.00 H new ATOM 0 HA ASN A 65 -13.929 4.680 1.962 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -11.882 6.150 1.318 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.044 5.333 2.622 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -12.943 2.922 1.785 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -12.007 2.230 0.456 1.00 0.00 H new ATOM 1038 N SER A 66 -11.891 4.143 4.494 1.00 0.00 N ATOM 1039 CA SER A 66 -11.590 3.264 5.631 1.00 0.00 C ATOM 1040 C SER A 66 -12.388 1.952 5.596 1.00 0.00 C ATOM 1041 O SER A 66 -13.406 1.826 6.277 1.00 0.00 O ATOM 1042 CB SER A 66 -11.877 3.999 6.941 1.00 0.00 C ATOM 1043 OG SER A 66 -11.455 5.350 6.871 1.00 0.00 O ATOM 0 H SER A 66 -11.149 4.810 4.283 1.00 0.00 H new ATOM 0 HA SER A 66 -10.534 3.003 5.562 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.944 3.959 7.158 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.366 3.497 7.763 1.00 0.00 H new ATOM 0 HG SER A 66 -11.651 5.798 7.720 1.00 0.00 H new ATOM 1049 N LYS A 67 -11.917 0.970 4.824 1.00 0.00 N ATOM 1050 CA LYS A 67 -12.607 -0.326 4.751 1.00 0.00 C ATOM 1051 C LYS A 67 -11.911 -1.348 5.649 1.00 0.00 C ATOM 1052 O LYS A 67 -10.772 -1.140 6.067 1.00 0.00 O ATOM 1053 CB LYS A 67 -12.708 -0.857 3.308 1.00 0.00 C ATOM 1054 CG LYS A 67 -11.405 -0.853 2.525 1.00 0.00 C ATOM 1055 CD LYS A 67 -10.559 -2.074 2.849 1.00 0.00 C ATOM 1056 CE LYS A 67 -9.174 -1.975 2.234 1.00 0.00 C ATOM 1057 NZ LYS A 67 -8.256 -3.031 2.751 1.00 0.00 N ATOM 0 H LYS A 67 -11.077 1.041 4.250 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.626 -0.170 5.106 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.092 -1.877 3.339 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.440 -0.257 2.767 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.621 -0.831 1.457 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.843 0.052 2.755 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.471 -2.179 3.930 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.058 -2.971 2.481 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -9.252 -2.061 1.150 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.752 -0.993 2.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.504 -2.590 3.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.792 -3.697 3.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.832 -3.544 1.952 1.00 0.00 H new ATOM 1071 N ASP A 68 -12.605 -2.441 5.966 1.00 0.00 N ATOM 1072 CA ASP A 68 -12.038 -3.471 6.843 1.00 0.00 C ATOM 1073 C ASP A 68 -11.999 -4.852 6.182 1.00 0.00 C ATOM 1074 O ASP A 68 -11.543 -5.818 6.795 1.00 0.00 O ATOM 1075 CB ASP A 68 -12.840 -3.548 8.142 1.00 0.00 C ATOM 1076 CG ASP A 68 -14.334 -3.648 7.897 1.00 0.00 C ATOM 1077 OD1 ASP A 68 -14.734 -4.380 6.966 1.00 0.00 O ATOM 1078 OD2 ASP A 68 -15.102 -2.994 8.632 1.00 0.00 O ATOM 0 H ASP A 68 -13.549 -2.637 5.634 1.00 0.00 H new ATOM 0 HA ASP A 68 -11.008 -3.181 7.052 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -12.511 -4.413 8.718 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -12.632 -2.665 8.746 1.00 0.00 H new ATOM 1083 N VAL A 69 -12.466 -4.951 4.943 1.00 0.00 N ATOM 1084 CA VAL A 69 -12.458 -6.233 4.235 1.00 0.00 C ATOM 1085 C VAL A 69 -12.038 -6.054 2.780 1.00 0.00 C ATOM 1086 O VAL A 69 -12.357 -5.042 2.156 1.00 0.00 O ATOM 1087 CB VAL A 69 -13.838 -6.926 4.284 1.00 0.00 C ATOM 1088 CG1 VAL A 69 -13.777 -8.288 3.608 1.00 0.00 C ATOM 1089 CG2 VAL A 69 -14.322 -7.061 5.722 1.00 0.00 C ATOM 0 H VAL A 69 -12.851 -4.171 4.410 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.733 -6.866 4.746 1.00 0.00 H new ATOM 0 HB VAL A 69 -14.551 -6.306 3.741 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -14.758 -8.761 3.653 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -13.481 -8.164 2.566 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -13.048 -8.916 4.120 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -15.295 -7.551 5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.609 -7.657 6.292 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.409 -6.072 6.171 1.00 0.00 H new ATOM 1099 N VAL A 70 -11.325 -7.045 2.246 1.00 0.00 N ATOM 1100 CA VAL A 70 -10.860 -6.992 0.859 1.00 0.00 C ATOM 1101 C VAL A 70 -10.541 -8.383 0.313 1.00 0.00 C ATOM 1102 O VAL A 70 -10.299 -9.318 1.074 1.00 0.00 O ATOM 1103 CB VAL A 70 -9.605 -6.103 0.713 1.00 0.00 C ATOM 1104 CG1 VAL A 70 -9.923 -4.661 1.073 1.00 0.00 C ATOM 1105 CG2 VAL A 70 -8.442 -6.626 1.559 1.00 0.00 C ATOM 0 H VAL A 70 -11.057 -7.891 2.749 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.678 -6.560 0.282 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.296 -6.140 -0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -9.026 -4.052 0.963 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.701 -4.283 0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.271 -4.612 2.105 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -7.577 -5.975 1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -8.733 -6.639 2.609 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -8.186 -7.637 1.241 1.00 0.00 H new ATOM 1115 N GLU A 71 -10.542 -8.510 -1.017 1.00 0.00 N ATOM 1116 CA GLU A 71 -10.250 -9.792 -1.663 1.00 0.00 C ATOM 1117 C GLU A 71 -8.775 -9.907 -2.031 1.00 0.00 C ATOM 1118 O GLU A 71 -8.100 -8.914 -2.294 1.00 0.00 O ATOM 1119 CB GLU A 71 -11.114 -9.995 -2.915 1.00 0.00 C ATOM 1120 CG GLU A 71 -12.525 -9.463 -2.768 1.00 0.00 C ATOM 1121 CD GLU A 71 -13.216 -9.256 -4.101 1.00 0.00 C ATOM 1122 OE1 GLU A 71 -13.581 -10.264 -4.744 1.00 0.00 O ATOM 1123 OE2 GLU A 71 -13.391 -8.087 -4.503 1.00 0.00 O ATOM 0 H GLU A 71 -10.740 -7.746 -1.663 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.490 -10.573 -0.942 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.635 -9.503 -3.761 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.158 -11.059 -3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.109 -10.158 -2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.497 -8.517 -2.227 1.00 0.00 H new ATOM 1130 N LEU A 72 -8.290 -11.137 -2.042 1.00 0.00 N ATOM 1131 CA LEU A 72 -6.890 -11.429 -2.368 1.00 0.00 C ATOM 1132 C LEU A 72 -6.429 -10.691 -3.629 1.00 0.00 C ATOM 1133 O LEU A 72 -7.030 -10.835 -4.694 1.00 0.00 O ATOM 1134 CB LEU A 72 -6.718 -12.944 -2.574 1.00 0.00 C ATOM 1135 CG LEU A 72 -5.310 -13.420 -2.957 1.00 0.00 C ATOM 1136 CD1 LEU A 72 -4.577 -13.949 -1.734 1.00 0.00 C ATOM 1137 CD2 LEU A 72 -5.389 -14.497 -4.030 1.00 0.00 C ATOM 0 H LEU A 72 -8.847 -11.964 -1.827 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.276 -11.085 -1.536 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.013 -13.450 -1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.411 -13.265 -3.351 1.00 0.00 H new ATOM 0 HG LEU A 72 -4.755 -12.571 -3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.580 -14.282 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.493 -13.157 -0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.132 -14.787 -1.312 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.383 -14.825 -4.291 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.960 -15.345 -3.653 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.880 -14.093 -4.915 1.00 0.00 H new ATOM 1149 N GLY A 73 -5.342 -9.923 -3.514 1.00 0.00 N ATOM 1150 CA GLY A 73 -4.815 -9.211 -4.675 1.00 0.00 C ATOM 1151 C GLY A 73 -4.897 -7.694 -4.582 1.00 0.00 C ATOM 1152 O GLY A 73 -4.075 -6.996 -5.175 1.00 0.00 O ATOM 0 H GLY A 73 -4.821 -9.782 -2.648 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.773 -9.497 -4.817 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.359 -9.537 -5.562 1.00 0.00 H new ATOM 1156 N ASP A 74 -5.890 -7.174 -3.869 1.00 0.00 N ATOM 1157 CA ASP A 74 -6.055 -5.725 -3.749 1.00 0.00 C ATOM 1158 C ASP A 74 -5.083 -5.122 -2.735 1.00 0.00 C ATOM 1159 O ASP A 74 -4.591 -5.809 -1.841 1.00 0.00 O ATOM 1160 CB ASP A 74 -7.497 -5.372 -3.376 1.00 0.00 C ATOM 1161 CG ASP A 74 -8.058 -6.272 -2.297 1.00 0.00 C ATOM 1162 OD1 ASP A 74 -7.339 -6.536 -1.311 1.00 0.00 O ATOM 1163 OD2 ASP A 74 -9.217 -6.715 -2.439 1.00 0.00 O ATOM 0 H ASP A 74 -6.588 -7.725 -3.369 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.827 -5.294 -4.724 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.537 -4.337 -3.037 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -8.125 -5.441 -4.264 1.00 0.00 H new ATOM 1168 N VAL A 75 -4.818 -3.826 -2.892 1.00 0.00 N ATOM 1169 CA VAL A 75 -3.904 -3.100 -1.995 1.00 0.00 C ATOM 1170 C VAL A 75 -4.682 -2.094 -1.136 1.00 0.00 C ATOM 1171 O VAL A 75 -5.735 -1.612 -1.554 1.00 0.00 O ATOM 1172 CB VAL A 75 -2.812 -2.339 -2.796 1.00 0.00 C ATOM 1173 CG1 VAL A 75 -1.752 -1.750 -1.873 1.00 0.00 C ATOM 1174 CG2 VAL A 75 -2.170 -3.255 -3.826 1.00 0.00 C ATOM 0 H VAL A 75 -5.221 -3.251 -3.632 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.423 -3.839 -1.355 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.298 -1.513 -3.316 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.004 -1.225 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.221 -1.052 -1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.272 -2.552 -1.312 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.408 -2.705 -4.377 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.710 -4.105 -3.321 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.931 -3.613 -4.519 1.00 0.00 H new ATOM 1184 N ALA A 76 -4.179 -1.772 0.065 1.00 0.00 N ATOM 1185 CA ALA A 76 -4.869 -0.825 0.936 1.00 0.00 C ATOM 1186 C ALA A 76 -3.890 -0.046 1.808 1.00 0.00 C ATOM 1187 O ALA A 76 -2.821 -0.543 2.159 1.00 0.00 O ATOM 1188 CB ALA A 76 -5.892 -1.547 1.802 1.00 0.00 C ATOM 0 H ALA A 76 -3.311 -2.149 0.446 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.387 -0.108 0.299 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.397 -0.827 2.445 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -6.625 -2.041 1.164 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.387 -2.291 2.418 1.00 0.00 H new ATOM 1194 N TYR A 77 -4.270 1.182 2.152 1.00 0.00 N ATOM 1195 CA TYR A 77 -3.438 2.040 2.982 1.00 0.00 C ATOM 1196 C TYR A 77 -4.006 2.124 4.399 1.00 0.00 C ATOM 1197 O TYR A 77 -5.201 2.356 4.584 1.00 0.00 O ATOM 1198 CB TYR A 77 -3.337 3.435 2.346 1.00 0.00 C ATOM 1199 CG TYR A 77 -3.378 4.585 3.329 1.00 0.00 C ATOM 1200 CD1 TYR A 77 -2.291 4.863 4.141 1.00 0.00 C ATOM 1201 CD2 TYR A 77 -4.504 5.392 3.440 1.00 0.00 C ATOM 1202 CE1 TYR A 77 -2.319 5.908 5.036 1.00 0.00 C ATOM 1203 CE2 TYR A 77 -4.541 6.443 4.336 1.00 0.00 C ATOM 1204 CZ TYR A 77 -3.445 6.697 5.132 1.00 0.00 C ATOM 1205 OH TYR A 77 -3.475 7.742 6.026 1.00 0.00 O ATOM 0 H TYR A 77 -5.153 1.604 1.866 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.437 1.614 3.048 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -2.408 3.494 1.778 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.154 3.554 1.634 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -1.406 4.249 4.071 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.363 5.195 2.816 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -1.462 6.109 5.661 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.423 7.062 4.412 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.817 8.545 5.580 1.00 0.00 H new ATOM 1215 N TRP A 78 -3.145 1.934 5.393 1.00 0.00 N ATOM 1216 CA TRP A 78 -3.570 1.988 6.789 1.00 0.00 C ATOM 1217 C TRP A 78 -3.881 3.424 7.210 1.00 0.00 C ATOM 1218 O TRP A 78 -2.985 4.263 7.281 1.00 0.00 O ATOM 1219 CB TRP A 78 -2.485 1.403 7.697 1.00 0.00 C ATOM 1220 CG TRP A 78 -3.012 0.863 8.990 1.00 0.00 C ATOM 1221 CD1 TRP A 78 -4.276 1.005 9.479 1.00 0.00 C ATOM 1222 CD2 TRP A 78 -2.291 0.093 9.960 1.00 0.00 C ATOM 1223 NE1 TRP A 78 -4.388 0.376 10.695 1.00 0.00 N ATOM 1224 CE2 TRP A 78 -3.182 -0.193 11.012 1.00 0.00 C ATOM 1225 CE3 TRP A 78 -0.978 -0.382 10.040 1.00 0.00 C ATOM 1226 CZ2 TRP A 78 -2.801 -0.933 12.129 1.00 0.00 C ATOM 1227 CZ3 TRP A 78 -0.602 -1.116 11.150 1.00 0.00 C ATOM 1228 CH2 TRP A 78 -1.511 -1.385 12.180 1.00 0.00 C ATOM 0 H TRP A 78 -2.152 1.742 5.260 1.00 0.00 H new ATOM 0 HA TRP A 78 -4.479 1.394 6.889 1.00 0.00 H new ATOM 0 HB2 TRP A 78 -1.968 0.605 7.164 1.00 0.00 H new ATOM 0 HB3 TRP A 78 -1.746 2.175 7.910 1.00 0.00 H new ATOM 0 HD1 TRP A 78 -5.075 1.536 8.982 1.00 0.00 H new ATOM 0 HE1 TRP A 78 -5.231 0.338 11.268 1.00 0.00 H new ATOM 0 HE3 TRP A 78 -0.271 -0.179 9.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 -3.499 -1.142 12.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 0.409 -1.488 11.223 1.00 0.00 H new ATOM 0 HH2 TRP A 78 -1.187 -1.962 13.033 1.00 0.00 H new ATOM 1239 N ILE A 79 -5.156 3.704 7.492 1.00 0.00 N ATOM 1240 CA ILE A 79 -5.558 5.044 7.906 1.00 0.00 C ATOM 1241 C ILE A 79 -4.993 5.373 9.294 1.00 0.00 C ATOM 1242 O ILE A 79 -4.140 6.251 9.416 1.00 0.00 O ATOM 1243 CB ILE A 79 -7.102 5.216 7.864 1.00 0.00 C ATOM 1244 CG1 ILE A 79 -7.538 5.643 6.456 1.00 0.00 C ATOM 1245 CG2 ILE A 79 -7.585 6.223 8.906 1.00 0.00 C ATOM 1246 CD1 ILE A 79 -8.806 6.479 6.421 1.00 0.00 C ATOM 0 H ILE A 79 -5.917 3.027 7.441 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.139 5.755 7.194 1.00 0.00 H new ATOM 0 HB ILE A 79 -7.558 4.256 8.106 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.730 6.210 5.994 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.688 4.751 5.849 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.669 6.317 8.846 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.305 5.879 9.902 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.126 7.193 8.715 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.043 6.738 5.389 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.630 5.909 6.850 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.656 7.391 6.999 1.00 0.00 H new ATOM 1258 N PRO A 80 -5.436 4.673 10.362 1.00 0.00 N ATOM 1259 CA PRO A 80 -4.929 4.920 11.716 1.00 0.00 C ATOM 1260 C PRO A 80 -3.432 4.632 11.819 1.00 0.00 C ATOM 1261 O PRO A 80 -3.023 3.570 12.287 1.00 0.00 O ATOM 1262 CB PRO A 80 -5.719 3.944 12.597 1.00 0.00 C ATOM 1263 CG PRO A 80 -6.893 3.534 11.776 1.00 0.00 C ATOM 1264 CD PRO A 80 -6.441 3.596 10.346 1.00 0.00 C ATOM 0 HA PRO A 80 -5.054 5.962 12.011 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.111 3.082 12.872 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.035 4.420 13.525 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.220 2.528 12.038 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.740 4.199 11.947 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.013 2.649 10.017 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.266 3.824 9.671 1.00 0.00 H new ATOM 1272 N GLY A 81 -2.621 5.584 11.373 1.00 0.00 N ATOM 1273 CA GLY A 81 -1.179 5.416 11.414 1.00 0.00 C ATOM 1274 C GLY A 81 -0.493 5.942 10.161 1.00 0.00 C ATOM 1275 O GLY A 81 0.736 6.010 10.108 1.00 0.00 O ATOM 0 H GLY A 81 -2.937 6.472 10.983 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.781 5.934 12.286 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.943 4.359 11.536 1.00 0.00 H new ATOM 1279 N LYS A 82 -1.283 6.317 9.151 1.00 0.00 N ATOM 1280 CA LYS A 82 -0.727 6.845 7.896 1.00 0.00 C ATOM 1281 C LYS A 82 0.350 5.915 7.336 1.00 0.00 C ATOM 1282 O LYS A 82 1.357 6.370 6.792 1.00 0.00 O ATOM 1283 CB LYS A 82 -0.130 8.244 8.105 1.00 0.00 C ATOM 1284 CG LYS A 82 -0.770 9.050 9.230 1.00 0.00 C ATOM 1285 CD LYS A 82 0.130 9.100 10.454 1.00 0.00 C ATOM 1286 CE LYS A 82 -0.630 9.547 11.692 1.00 0.00 C ATOM 1287 NZ LYS A 82 -0.045 10.778 12.289 1.00 0.00 N ATOM 0 H LYS A 82 -2.301 6.267 9.174 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.547 6.909 7.181 1.00 0.00 H new ATOM 0 HB2 LYS A 82 0.936 8.142 8.311 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.223 8.806 7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.974 10.063 8.884 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.729 8.606 9.499 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.562 8.115 10.628 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.959 9.784 10.269 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -1.672 9.730 11.431 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -0.622 8.746 12.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -0.592 11.049 13.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 0.942 10.596 12.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -0.075 11.550 11.593 1.00 0.00 H new ATOM 1301 N ALA A 83 0.135 4.614 7.482 1.00 0.00 N ATOM 1302 CA ALA A 83 1.091 3.617 7.003 1.00 0.00 C ATOM 1303 C ALA A 83 0.491 2.737 5.900 1.00 0.00 C ATOM 1304 O ALA A 83 -0.653 2.303 5.999 1.00 0.00 O ATOM 1305 CB ALA A 83 1.563 2.761 8.173 1.00 0.00 C ATOM 0 H ALA A 83 -0.694 4.221 7.929 1.00 0.00 H new ATOM 0 HA ALA A 83 1.942 4.142 6.568 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.276 2.018 7.816 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.043 3.396 8.918 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.708 2.257 8.623 1.00 0.00 H new ATOM 1311 N ILE A 84 1.277 2.468 4.853 1.00 0.00 N ATOM 1312 CA ILE A 84 0.817 1.625 3.745 1.00 0.00 C ATOM 1313 C ILE A 84 1.097 0.153 4.043 1.00 0.00 C ATOM 1314 O ILE A 84 2.076 -0.168 4.712 1.00 0.00 O ATOM 1315 CB ILE A 84 1.507 1.991 2.412 1.00 0.00 C ATOM 1316 CG1 ILE A 84 1.721 3.505 2.296 1.00 0.00 C ATOM 1317 CG2 ILE A 84 0.694 1.473 1.235 1.00 0.00 C ATOM 1318 CD1 ILE A 84 2.377 3.927 0.995 1.00 0.00 C ATOM 0 H ILE A 84 2.229 2.819 4.749 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.255 1.797 3.645 1.00 0.00 H new ATOM 0 HB ILE A 84 2.487 1.514 2.396 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.758 4.008 2.388 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.337 3.842 3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.193 1.739 0.303 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.606 0.389 1.303 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.300 1.920 1.255 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.497 5.010 0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.355 3.453 0.910 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.751 3.622 0.156 1.00 0.00 H new ATOM 1330 N CYS A 85 0.235 -0.743 3.557 1.00 0.00 N ATOM 1331 CA CYS A 85 0.424 -2.180 3.807 1.00 0.00 C ATOM 1332 C CYS A 85 0.033 -3.047 2.602 1.00 0.00 C ATOM 1333 O CYS A 85 -1.048 -2.887 2.035 1.00 0.00 O ATOM 1334 CB CYS A 85 -0.381 -2.607 5.045 1.00 0.00 C ATOM 1335 SG CYS A 85 -0.406 -1.383 6.377 1.00 0.00 S ATOM 0 H CYS A 85 -0.586 -0.509 2.999 1.00 0.00 H new ATOM 0 HA CYS A 85 1.488 -2.338 3.983 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -1.407 -2.818 4.742 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.035 -3.538 5.431 1.00 0.00 H new ATOM 0 HG CYS A 85 -0.652 -1.976 7.507 1.00 0.00 H new ATOM 1341 N LEU A 86 0.920 -3.985 2.228 1.00 0.00 N ATOM 1342 CA LEU A 86 0.665 -4.897 1.103 1.00 0.00 C ATOM 1343 C LEU A 86 -0.104 -6.128 1.580 1.00 0.00 C ATOM 1344 O LEU A 86 -0.100 -6.447 2.769 1.00 0.00 O ATOM 1345 CB LEU A 86 1.986 -5.342 0.457 1.00 0.00 C ATOM 1346 CG LEU A 86 2.152 -4.984 -1.025 1.00 0.00 C ATOM 1347 CD1 LEU A 86 3.534 -4.407 -1.290 1.00 0.00 C ATOM 1348 CD2 LEU A 86 1.921 -6.210 -1.896 1.00 0.00 C ATOM 0 H LEU A 86 1.818 -4.130 2.689 1.00 0.00 H new ATOM 0 HA LEU A 86 0.069 -4.362 0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.810 -4.897 1.014 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.076 -6.423 0.564 1.00 0.00 H new ATOM 0 HG LEU A 86 1.409 -4.228 -1.277 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.629 -4.161 -2.348 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.672 -3.505 -0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.293 -5.141 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.042 -5.939 -2.945 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.643 -6.983 -1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.911 -6.587 -1.733 1.00 0.00 H new ATOM 1360 N PHE A 87 -0.759 -6.823 0.651 1.00 0.00 N ATOM 1361 CA PHE A 87 -1.518 -8.020 0.999 1.00 0.00 C ATOM 1362 C PHE A 87 -1.291 -9.146 0.000 1.00 0.00 C ATOM 1363 O PHE A 87 -1.367 -8.948 -1.212 1.00 0.00 O ATOM 1364 CB PHE A 87 -3.009 -7.703 1.080 1.00 0.00 C ATOM 1365 CG PHE A 87 -3.310 -6.487 1.897 1.00 0.00 C ATOM 1366 CD1 PHE A 87 -3.116 -6.491 3.268 1.00 0.00 C ATOM 1367 CD2 PHE A 87 -3.782 -5.340 1.293 1.00 0.00 C ATOM 1368 CE1 PHE A 87 -3.390 -5.368 4.023 1.00 0.00 C ATOM 1369 CE2 PHE A 87 -4.057 -4.215 2.040 1.00 0.00 C ATOM 1370 CZ PHE A 87 -3.861 -4.227 3.407 1.00 0.00 C ATOM 0 H PHE A 87 -0.779 -6.580 -0.339 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.162 -8.354 1.974 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.399 -7.561 0.072 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.533 -8.558 1.507 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.746 -7.383 3.752 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.938 -5.324 0.224 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.236 -5.383 5.092 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.426 -3.323 1.556 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.076 -3.345 3.992 1.00 0.00 H new ATOM 1380 N PHE A 88 -1.028 -10.334 0.527 1.00 0.00 N ATOM 1381 CA PHE A 88 -0.807 -11.513 -0.300 1.00 0.00 C ATOM 1382 C PHE A 88 -0.893 -12.775 0.554 1.00 0.00 C ATOM 1383 O PHE A 88 -0.195 -13.758 0.306 1.00 0.00 O ATOM 1384 CB PHE A 88 0.552 -11.431 -0.999 1.00 0.00 C ATOM 1385 CG PHE A 88 0.458 -11.065 -2.454 1.00 0.00 C ATOM 1386 CD1 PHE A 88 0.158 -12.025 -3.407 1.00 0.00 C ATOM 1387 CD2 PHE A 88 0.668 -9.758 -2.866 1.00 0.00 C ATOM 1388 CE1 PHE A 88 0.070 -11.689 -4.744 1.00 0.00 C ATOM 1389 CE2 PHE A 88 0.580 -9.417 -4.202 1.00 0.00 C ATOM 1390 CZ PHE A 88 0.280 -10.383 -5.142 1.00 0.00 C ATOM 0 H PHE A 88 -0.962 -10.507 1.530 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.583 -11.554 -1.065 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.171 -10.694 -0.487 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.058 -12.392 -0.906 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.009 -13.047 -3.101 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.903 -8.998 -2.135 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.163 -12.447 -5.478 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.746 -8.395 -4.511 1.00 0.00 H new ATOM 0 HZ PHE A 88 0.210 -10.118 -6.187 1.00 0.00 H new ATOM 1400 N GLY A 89 -1.755 -12.729 1.568 1.00 0.00 N ATOM 1401 CA GLY A 89 -1.924 -13.864 2.457 1.00 0.00 C ATOM 1402 C GLY A 89 -2.533 -13.468 3.792 1.00 0.00 C ATOM 1403 O GLY A 89 -3.303 -12.510 3.870 1.00 0.00 O ATOM 0 H GLY A 89 -2.340 -11.923 1.789 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.560 -14.607 1.976 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.956 -14.336 2.628 1.00 0.00 H new ATOM 1407 N LYS A 90 -2.193 -14.212 4.843 1.00 0.00 N ATOM 1408 CA LYS A 90 -2.712 -13.946 6.182 1.00 0.00 C ATOM 1409 C LYS A 90 -2.484 -12.499 6.610 1.00 0.00 C ATOM 1410 O LYS A 90 -2.038 -11.660 5.827 1.00 0.00 O ATOM 1411 CB LYS A 90 -2.065 -14.889 7.199 1.00 0.00 C ATOM 1412 CG LYS A 90 -0.641 -14.509 7.580 1.00 0.00 C ATOM 1413 CD LYS A 90 -0.601 -13.703 8.869 1.00 0.00 C ATOM 1414 CE LYS A 90 0.326 -14.339 9.891 1.00 0.00 C ATOM 1415 NZ LYS A 90 0.886 -13.333 10.836 1.00 0.00 N ATOM 0 H LYS A 90 -1.557 -15.008 4.792 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.788 -14.120 6.149 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.678 -14.910 8.100 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.063 -15.900 6.791 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.042 -15.412 7.697 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.191 -13.930 6.774 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.267 -12.688 8.655 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.606 -13.627 9.284 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.218 -15.099 10.451 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.142 -14.846 9.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.854 -13.607 11.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.904 -12.399 10.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.292 -13.290 11.689 1.00 0.00 H new ATOM 1429 N THR A 91 -2.796 -12.232 7.874 1.00 0.00 N ATOM 1430 CA THR A 91 -2.637 -10.908 8.458 1.00 0.00 C ATOM 1431 C THR A 91 -2.590 -11.024 9.982 1.00 0.00 C ATOM 1432 O THR A 91 -2.607 -12.134 10.515 1.00 0.00 O ATOM 1433 CB THR A 91 -3.788 -10.000 8.016 1.00 0.00 C ATOM 1434 OG1 THR A 91 -4.737 -10.728 7.257 1.00 0.00 O ATOM 1435 CG2 THR A 91 -3.330 -8.828 7.176 1.00 0.00 C ATOM 0 H THR A 91 -3.166 -12.928 8.521 1.00 0.00 H new ATOM 0 HA THR A 91 -1.702 -10.466 8.113 1.00 0.00 H new ATOM 0 HB THR A 91 -4.229 -9.619 8.937 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.214 -11.353 7.842 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.192 -8.223 6.895 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.632 -8.219 7.750 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.836 -9.196 6.277 1.00 0.00 H new ATOM 1443 N PRO A 92 -2.526 -9.896 10.719 1.00 0.00 N ATOM 1444 CA PRO A 92 -2.473 -9.920 12.184 1.00 0.00 C ATOM 1445 C PRO A 92 -3.424 -10.948 12.801 1.00 0.00 C ATOM 1446 O PRO A 92 -3.191 -11.428 13.910 1.00 0.00 O ATOM 1447 CB PRO A 92 -2.885 -8.500 12.557 1.00 0.00 C ATOM 1448 CG PRO A 92 -2.359 -7.669 11.440 1.00 0.00 C ATOM 1449 CD PRO A 92 -2.494 -8.512 10.197 1.00 0.00 C ATOM 0 HA PRO A 92 -1.491 -10.212 12.556 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.967 -8.409 12.647 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -2.459 -8.199 13.514 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -2.922 -6.741 11.345 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -1.319 -7.394 11.614 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -3.402 -8.270 9.645 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -1.657 -8.359 9.516 1.00 0.00 H new ATOM 1457 N ILE A 93 -4.491 -11.289 12.079 1.00 0.00 N ATOM 1458 CA ILE A 93 -5.457 -12.266 12.571 1.00 0.00 C ATOM 1459 C ILE A 93 -6.056 -13.092 11.431 1.00 0.00 C ATOM 1460 O ILE A 93 -7.247 -12.989 11.133 1.00 0.00 O ATOM 1461 CB ILE A 93 -6.598 -11.592 13.362 1.00 0.00 C ATOM 1462 CG1 ILE A 93 -7.251 -10.480 12.534 1.00 0.00 C ATOM 1463 CG2 ILE A 93 -6.077 -11.049 14.686 1.00 0.00 C ATOM 1464 CD1 ILE A 93 -6.388 -9.245 12.363 1.00 0.00 C ATOM 0 H ILE A 93 -4.706 -10.906 11.159 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.908 -12.930 13.239 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.360 -12.342 13.575 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.501 -10.874 11.549 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -8.189 -10.192 13.009 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -6.894 -10.577 15.232 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -5.669 -11.867 15.279 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.295 -10.314 14.495 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -6.923 -8.507 11.765 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -6.159 -8.823 13.341 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -5.460 -9.516 11.859 1.00 0.00 H new ATOM 1476 N SER A 94 -5.227 -13.926 10.803 1.00 0.00 N ATOM 1477 CA SER A 94 -5.681 -14.783 9.705 1.00 0.00 C ATOM 1478 C SER A 94 -6.932 -15.560 10.115 1.00 0.00 C ATOM 1479 O SER A 94 -8.046 -15.235 9.706 1.00 0.00 O ATOM 1480 CB SER A 94 -4.583 -15.767 9.297 1.00 0.00 C ATOM 1481 OG SER A 94 -3.413 -15.593 10.079 1.00 0.00 O ATOM 0 H SER A 94 -4.239 -14.027 11.035 1.00 0.00 H new ATOM 0 HA SER A 94 -5.918 -14.142 8.856 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.948 -16.788 9.409 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.342 -15.628 8.243 1.00 0.00 H new ATOM 0 HG SER A 94 -2.710 -16.193 9.753 1.00 0.00 H new ATOM 1533 N ILE A 98 -9.002 -13.093 5.931 1.00 0.00 N ATOM 1534 CA ILE A 98 -7.914 -12.126 5.983 1.00 0.00 C ATOM 1535 C ILE A 98 -8.397 -10.791 6.538 1.00 0.00 C ATOM 1536 O ILE A 98 -9.235 -10.122 5.934 1.00 0.00 O ATOM 1537 CB ILE A 98 -7.299 -11.902 4.583 1.00 0.00 C ATOM 1538 CG1 ILE A 98 -6.516 -13.133 4.134 1.00 0.00 C ATOM 1539 CG2 ILE A 98 -6.395 -10.675 4.565 1.00 0.00 C ATOM 1540 CD1 ILE A 98 -6.093 -13.058 2.686 1.00 0.00 C ATOM 0 HA ILE A 98 -7.151 -12.535 6.645 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.121 -11.732 3.887 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -5.632 -13.245 4.761 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -7.128 -14.023 4.284 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -5.978 -10.545 3.566 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.975 -9.792 4.834 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.585 -10.809 5.282 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.540 -13.959 2.421 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.976 -12.975 2.053 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.457 -12.185 2.538 1.00 0.00 H new ATOM 1552 N ARG A 99 -7.848 -10.402 7.683 1.00 0.00 N ATOM 1553 CA ARG A 99 -8.211 -9.133 8.304 1.00 0.00 C ATOM 1554 C ARG A 99 -6.989 -8.222 8.385 1.00 0.00 C ATOM 1555 O ARG A 99 -6.153 -8.371 9.276 1.00 0.00 O ATOM 1556 CB ARG A 99 -8.786 -9.361 9.705 1.00 0.00 C ATOM 1557 CG ARG A 99 -9.591 -10.645 9.840 1.00 0.00 C ATOM 1558 CD ARG A 99 -10.100 -10.838 11.259 1.00 0.00 C ATOM 1559 NE ARG A 99 -11.481 -11.313 11.283 1.00 0.00 N ATOM 1560 CZ ARG A 99 -11.835 -12.577 11.066 1.00 0.00 C ATOM 1561 NH1 ARG A 99 -10.913 -13.496 10.808 1.00 0.00 N ATOM 1562 NH2 ARG A 99 -13.114 -12.924 11.110 1.00 0.00 N ATOM 0 H ARG A 99 -7.154 -10.943 8.198 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.974 -8.655 7.690 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.967 -9.380 10.424 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -9.422 -8.516 9.968 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.435 -10.621 9.150 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.971 -11.496 9.556 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -9.462 -11.552 11.780 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.031 -9.895 11.801 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.218 -10.635 11.478 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -9.928 -13.235 10.775 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -11.190 -14.464 10.642 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -13.826 -12.222 11.310 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -13.386 -13.893 10.944 1.00 0.00 H new ATOM 1576 N PRO A 100 -6.862 -7.268 7.446 1.00 0.00 N ATOM 1577 CA PRO A 100 -5.727 -6.338 7.412 1.00 0.00 C ATOM 1578 C PRO A 100 -5.756 -5.338 8.561 1.00 0.00 C ATOM 1579 O PRO A 100 -4.710 -4.895 9.035 1.00 0.00 O ATOM 1580 CB PRO A 100 -5.897 -5.627 6.067 1.00 0.00 C ATOM 1581 CG PRO A 100 -7.357 -5.700 5.793 1.00 0.00 C ATOM 1582 CD PRO A 100 -7.806 -7.024 6.337 1.00 0.00 C ATOM 0 HA PRO A 100 -4.772 -6.853 7.519 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.553 -4.594 6.117 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.320 -6.117 5.283 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -7.887 -4.879 6.275 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -7.559 -5.627 4.724 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.838 -6.987 6.687 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.753 -7.809 5.582 1.00 0.00 H new ATOM 1590 N ALA A 101 -6.957 -4.979 9.004 1.00 0.00 N ATOM 1591 CA ALA A 101 -7.109 -4.022 10.100 1.00 0.00 C ATOM 1592 C ALA A 101 -8.585 -3.749 10.381 1.00 0.00 C ATOM 1593 O ALA A 101 -9.454 -4.530 9.995 1.00 0.00 O ATOM 1594 CB ALA A 101 -6.378 -2.726 9.770 1.00 0.00 C ATOM 0 H ALA A 101 -7.836 -5.333 8.625 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.669 -4.453 10.999 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -6.498 -2.021 10.593 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.318 -2.934 9.622 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -6.794 -2.295 8.859 1.00 0.00 H new ATOM 1600 N SER A 102 -8.860 -2.638 11.057 1.00 0.00 N ATOM 1601 CA SER A 102 -10.229 -2.268 11.388 1.00 0.00 C ATOM 1602 C SER A 102 -10.670 -1.012 10.634 1.00 0.00 C ATOM 1603 O SER A 102 -11.829 -0.609 10.724 1.00 0.00 O ATOM 1604 CB SER A 102 -10.368 -2.042 12.897 1.00 0.00 C ATOM 1605 OG SER A 102 -9.205 -2.464 13.588 1.00 0.00 O ATOM 0 H SER A 102 -8.153 -1.980 11.385 1.00 0.00 H new ATOM 0 HA SER A 102 -10.875 -3.091 11.083 1.00 0.00 H new ATOM 0 HB2 SER A 102 -10.548 -0.985 13.094 1.00 0.00 H new ATOM 0 HB3 SER A 102 -11.234 -2.588 13.271 1.00 0.00 H new ATOM 0 HG SER A 102 -9.320 -2.307 14.548 1.00 0.00 H new ATOM 1611 N ALA A 103 -9.751 -0.389 9.896 1.00 0.00 N ATOM 1612 CA ALA A 103 -10.087 0.819 9.150 1.00 0.00 C ATOM 1613 C ALA A 103 -8.995 1.216 8.157 1.00 0.00 C ATOM 1614 O ALA A 103 -8.273 2.189 8.374 1.00 0.00 O ATOM 1615 CB ALA A 103 -10.355 1.963 10.116 1.00 0.00 C ATOM 0 H ALA A 103 -8.783 -0.696 9.800 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.985 0.604 8.570 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.605 2.863 9.554 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.187 1.700 10.769 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.465 2.147 10.718 1.00 0.00 H new ATOM 1621 N VAL A 104 -8.890 0.474 7.054 1.00 0.00 N ATOM 1622 CA VAL A 104 -7.892 0.785 6.024 1.00 0.00 C ATOM 1623 C VAL A 104 -8.543 0.983 4.656 1.00 0.00 C ATOM 1624 O VAL A 104 -9.487 0.282 4.299 1.00 0.00 O ATOM 1625 CB VAL A 104 -6.782 -0.286 5.937 1.00 0.00 C ATOM 1626 CG1 VAL A 104 -6.105 -0.451 7.286 1.00 0.00 C ATOM 1627 CG2 VAL A 104 -7.331 -1.620 5.454 1.00 0.00 C ATOM 0 H VAL A 104 -9.474 -0.337 6.850 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.424 1.722 6.326 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.046 0.054 5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.325 -1.209 7.211 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.662 0.498 7.589 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.842 -0.761 8.027 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.523 -2.350 5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.095 -1.971 6.147 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.769 -1.496 4.463 1.00 0.00 H new ATOM 1637 N ASN A 105 -8.039 1.968 3.911 1.00 0.00 N ATOM 1638 CA ASN A 105 -8.573 2.310 2.589 1.00 0.00 C ATOM 1639 C ASN A 105 -7.989 1.450 1.472 1.00 0.00 C ATOM 1640 O ASN A 105 -6.832 1.038 1.533 1.00 0.00 O ATOM 1641 CB ASN A 105 -8.262 3.773 2.267 1.00 0.00 C ATOM 1642 CG ASN A 105 -8.498 4.705 3.435 1.00 0.00 C ATOM 1643 OD1 ASN A 105 -9.305 4.424 4.320 1.00 0.00 O ATOM 1644 ND2 ASN A 105 -7.785 5.824 3.439 1.00 0.00 N ATOM 0 H ASN A 105 -7.253 2.549 4.204 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.647 2.130 2.635 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -7.222 3.855 1.950 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.878 4.092 1.426 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -7.894 6.495 4.199 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.128 6.013 2.682 1.00 0.00 H new ATOM 1651 N VAL A 106 -8.784 1.238 0.418 1.00 0.00 N ATOM 1652 CA VAL A 106 -8.327 0.486 -0.746 1.00 0.00 C ATOM 1653 C VAL A 106 -7.582 1.433 -1.675 1.00 0.00 C ATOM 1654 O VAL A 106 -8.194 2.212 -2.406 1.00 0.00 O ATOM 1655 CB VAL A 106 -9.481 -0.183 -1.535 1.00 0.00 C ATOM 1656 CG1 VAL A 106 -9.400 -1.695 -1.415 1.00 0.00 C ATOM 1657 CG2 VAL A 106 -10.844 0.325 -1.081 1.00 0.00 C ATOM 0 H VAL A 106 -9.744 1.577 0.351 1.00 0.00 H new ATOM 0 HA VAL A 106 -7.683 -0.314 -0.381 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.367 0.090 -2.584 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.218 -2.149 -1.975 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.448 -2.041 -1.818 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.476 -1.981 -0.366 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -11.627 -0.168 -1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -10.980 0.105 -0.022 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -10.901 1.402 -1.238 1.00 0.00 H new ATOM 1667 N ILE A 107 -6.260 1.389 -1.615 1.00 0.00 N ATOM 1668 CA ILE A 107 -5.429 2.269 -2.419 1.00 0.00 C ATOM 1669 C ILE A 107 -5.178 1.719 -3.825 1.00 0.00 C ATOM 1670 O ILE A 107 -4.223 2.114 -4.492 1.00 0.00 O ATOM 1671 CB ILE A 107 -4.085 2.527 -1.712 1.00 0.00 C ATOM 1672 CG1 ILE A 107 -3.411 3.774 -2.293 1.00 0.00 C ATOM 1673 CG2 ILE A 107 -3.177 1.306 -1.820 1.00 0.00 C ATOM 1674 CD1 ILE A 107 -1.902 3.713 -2.286 1.00 0.00 C ATOM 0 H ILE A 107 -5.739 0.750 -1.015 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.975 3.206 -2.529 1.00 0.00 H new ATOM 0 HB ILE A 107 -4.274 2.706 -0.654 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.754 3.917 -3.318 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.732 4.647 -1.725 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.233 1.509 -1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -3.662 0.449 -1.353 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.986 1.086 -2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.499 4.631 -2.713 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.547 3.602 -1.261 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.570 2.861 -2.879 1.00 0.00 H new ATOM 1686 N GLY A 108 -6.044 0.817 -4.277 1.00 0.00 N ATOM 1687 CA GLY A 108 -5.891 0.254 -5.608 1.00 0.00 C ATOM 1688 C GLY A 108 -5.597 -1.234 -5.597 1.00 0.00 C ATOM 1689 O GLY A 108 -6.297 -2.006 -4.943 1.00 0.00 O ATOM 0 H GLY A 108 -6.844 0.467 -3.750 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.802 0.434 -6.178 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -5.084 0.773 -6.125 1.00 0.00 H new ATOM 1693 N ARG A 109 -4.554 -1.638 -6.323 1.00 0.00 N ATOM 1694 CA ARG A 109 -4.173 -3.042 -6.388 1.00 0.00 C ATOM 1695 C ARG A 109 -2.825 -3.224 -7.081 1.00 0.00 C ATOM 1696 O ARG A 109 -2.307 -2.303 -7.715 1.00 0.00 O ATOM 1697 CB ARG A 109 -5.244 -3.881 -7.103 1.00 0.00 C ATOM 1698 CG ARG A 109 -6.101 -3.121 -8.109 1.00 0.00 C ATOM 1699 CD ARG A 109 -7.110 -4.039 -8.778 1.00 0.00 C ATOM 1700 NE ARG A 109 -7.826 -3.369 -9.862 1.00 0.00 N ATOM 1701 CZ ARG A 109 -8.468 -4.011 -10.836 1.00 0.00 C ATOM 1702 NH1 ARG A 109 -8.489 -5.338 -10.864 1.00 0.00 N ATOM 1703 NH2 ARG A 109 -9.090 -3.324 -11.783 1.00 0.00 N ATOM 0 H ARG A 109 -3.963 -1.013 -6.871 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.084 -3.393 -5.360 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.752 -4.705 -7.619 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.899 -4.321 -6.351 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.624 -2.308 -7.604 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -5.461 -2.667 -8.866 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.597 -4.917 -9.171 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.825 -4.394 -8.036 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.834 -2.349 -9.873 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.012 -5.871 -10.137 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -8.982 -5.825 -11.612 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -9.077 -2.304 -11.765 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -9.582 -3.815 -12.530 1.00 0.00 H new ATOM 1717 N ILE A 110 -2.268 -4.426 -6.957 1.00 0.00 N ATOM 1718 CA ILE A 110 -0.983 -4.756 -7.565 1.00 0.00 C ATOM 1719 C ILE A 110 -1.184 -5.382 -8.945 1.00 0.00 C ATOM 1720 O ILE A 110 -1.765 -6.459 -9.067 1.00 0.00 O ATOM 1721 CB ILE A 110 -0.188 -5.738 -6.673 1.00 0.00 C ATOM 1722 CG1 ILE A 110 -0.009 -5.154 -5.264 1.00 0.00 C ATOM 1723 CG2 ILE A 110 1.166 -6.059 -7.293 1.00 0.00 C ATOM 1724 CD1 ILE A 110 -0.792 -5.881 -4.188 1.00 0.00 C ATOM 0 H ILE A 110 -2.692 -5.194 -6.436 1.00 0.00 H new ATOM 0 HA ILE A 110 -0.419 -3.829 -7.668 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.755 -6.666 -6.597 1.00 0.00 H new ATOM 0 HG12 ILE A 110 1.050 -5.176 -5.005 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -0.313 -4.107 -5.275 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.707 -6.751 -6.648 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.019 -6.515 -8.272 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.742 -5.141 -7.404 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.611 -5.407 -3.223 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.856 -5.837 -4.420 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.472 -6.922 -4.146 1.00 0.00 H new ATOM 1736 N VAL A 111 -0.700 -4.703 -9.984 1.00 0.00 N ATOM 1737 CA VAL A 111 -0.838 -5.209 -11.351 1.00 0.00 C ATOM 1738 C VAL A 111 0.076 -6.410 -11.586 1.00 0.00 C ATOM 1739 O VAL A 111 -0.364 -7.558 -11.508 1.00 0.00 O ATOM 1740 CB VAL A 111 -0.545 -4.133 -12.433 1.00 0.00 C ATOM 1741 CG1 VAL A 111 -1.838 -3.659 -13.087 1.00 0.00 C ATOM 1742 CG2 VAL A 111 0.232 -2.955 -11.858 1.00 0.00 C ATOM 0 H VAL A 111 -0.213 -3.810 -9.908 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.882 -5.507 -11.450 1.00 0.00 H new ATOM 0 HB VAL A 111 0.079 -4.597 -13.197 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.609 -2.906 -13.841 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.339 -4.505 -13.559 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.492 -3.227 -12.329 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.418 -2.223 -12.644 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.348 -2.491 -11.060 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.183 -3.307 -11.457 1.00 0.00 H new ATOM 1816 N LEU A 117 5.903 -9.987 -2.606 1.00 0.00 N ATOM 1817 CA LEU A 117 6.698 -9.163 -1.700 1.00 0.00 C ATOM 1818 C LEU A 117 6.672 -9.726 -0.281 1.00 0.00 C ATOM 1819 O LEU A 117 7.700 -9.758 0.398 1.00 0.00 O ATOM 1820 CB LEU A 117 6.205 -7.714 -1.690 1.00 0.00 C ATOM 1821 CG LEU A 117 6.937 -6.800 -0.698 1.00 0.00 C ATOM 1822 CD1 LEU A 117 8.105 -6.085 -1.365 1.00 0.00 C ATOM 1823 CD2 LEU A 117 5.979 -5.793 -0.076 1.00 0.00 C ATOM 0 HA LEU A 117 7.724 -9.179 -2.066 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.312 -7.300 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 117 5.141 -7.707 -1.454 1.00 0.00 H new ATOM 0 HG LEU A 117 7.336 -7.430 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.604 -5.445 -0.637 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.813 -6.821 -1.746 1.00 0.00 H new ATOM 0 HD13 LEU A 117 7.736 -5.476 -2.190 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.523 -5.157 0.623 1.00 0.00 H new ATOM 0 HD22 LEU A 117 5.539 -5.177 -0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 117 5.188 -6.323 0.455 1.00 0.00 H new ATOM 1835 N LYS A 118 5.492 -10.153 0.172 1.00 0.00 N ATOM 1836 CA LYS A 118 5.335 -10.702 1.523 1.00 0.00 C ATOM 1837 C LYS A 118 6.477 -11.652 1.914 1.00 0.00 C ATOM 1838 O LYS A 118 6.716 -11.878 3.102 1.00 0.00 O ATOM 1839 CB LYS A 118 3.988 -11.422 1.670 1.00 0.00 C ATOM 1840 CG LYS A 118 3.580 -12.259 0.465 1.00 0.00 C ATOM 1841 CD LYS A 118 3.657 -13.749 0.765 1.00 0.00 C ATOM 1842 CE LYS A 118 4.947 -14.361 0.246 1.00 0.00 C ATOM 1843 NZ LYS A 118 5.219 -13.976 -1.167 1.00 0.00 N ATOM 0 H LYS A 118 4.631 -10.130 -0.375 1.00 0.00 H new ATOM 0 HA LYS A 118 5.368 -9.851 2.204 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.030 -12.068 2.547 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.213 -10.679 1.859 1.00 0.00 H new ATOM 0 HG2 LYS A 118 2.564 -11.999 0.168 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.229 -12.023 -0.379 1.00 0.00 H new ATOM 0 HD2 LYS A 118 3.586 -13.908 1.841 1.00 0.00 H new ATOM 0 HD3 LYS A 118 2.805 -14.256 0.311 1.00 0.00 H new ATOM 0 HE2 LYS A 118 5.778 -14.042 0.875 1.00 0.00 H new ATOM 0 HE3 LYS A 118 4.889 -15.447 0.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 5.778 -14.722 -1.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 4.319 -13.854 -1.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.751 -13.083 -1.187 1.00 0.00 H new ATOM 1857 N GLY A 119 7.187 -12.205 0.926 1.00 0.00 N ATOM 1858 CA GLY A 119 8.288 -13.110 1.221 1.00 0.00 C ATOM 1859 C GLY A 119 9.617 -12.388 1.370 1.00 0.00 C ATOM 1860 O GLY A 119 10.672 -12.943 1.065 1.00 0.00 O ATOM 0 H GLY A 119 7.019 -12.042 -0.067 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.070 -13.654 2.140 1.00 0.00 H new ATOM 0 HA3 GLY A 119 8.368 -13.850 0.424 1.00 0.00 H new ATOM 1864 N VAL A 120 9.561 -11.146 1.840 1.00 0.00 N ATOM 1865 CA VAL A 120 10.759 -10.331 2.034 1.00 0.00 C ATOM 1866 C VAL A 120 11.459 -10.675 3.349 1.00 0.00 C ATOM 1867 O VAL A 120 10.819 -11.132 4.297 1.00 0.00 O ATOM 1868 CB VAL A 120 10.425 -8.824 2.037 1.00 0.00 C ATOM 1869 CG1 VAL A 120 10.186 -8.320 0.622 1.00 0.00 C ATOM 1870 CG2 VAL A 120 9.223 -8.534 2.932 1.00 0.00 C ATOM 0 H VAL A 120 8.692 -10.677 2.096 1.00 0.00 H new ATOM 0 HA VAL A 120 11.422 -10.553 1.198 1.00 0.00 H new ATOM 0 HB VAL A 120 11.282 -8.288 2.444 1.00 0.00 H new ATOM 0 HG11 VAL A 120 9.952 -7.256 0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 120 11.082 -8.479 0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.352 -8.863 0.178 1.00 0.00 H new ATOM 0 HG21 VAL A 120 9.008 -7.466 2.917 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.356 -9.084 2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.446 -8.845 3.953 1.00 0.00 H new ATOM 1880 N ALA A 121 12.772 -10.443 3.410 1.00 0.00 N ATOM 1881 CA ALA A 121 13.536 -10.722 4.622 1.00 0.00 C ATOM 1882 C ALA A 121 13.229 -9.675 5.692 1.00 0.00 C ATOM 1883 O ALA A 121 13.020 -8.507 5.380 1.00 0.00 O ATOM 1884 CB ALA A 121 15.029 -10.754 4.322 1.00 0.00 C ATOM 0 H ALA A 121 13.323 -10.065 2.639 1.00 0.00 H new ATOM 0 HA ALA A 121 13.243 -11.703 4.997 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.580 -10.963 5.239 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.236 -11.533 3.588 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.341 -9.788 3.924 1.00 0.00 H new ATOM 1890 N ASP A 122 13.182 -10.101 6.951 1.00 0.00 N ATOM 1891 CA ASP A 122 12.872 -9.197 8.055 1.00 0.00 C ATOM 1892 C ASP A 122 13.735 -7.936 8.044 1.00 0.00 C ATOM 1893 O ASP A 122 14.959 -8.001 7.931 1.00 0.00 O ATOM 1894 CB ASP A 122 13.030 -9.920 9.393 1.00 0.00 C ATOM 1895 CG ASP A 122 14.471 -10.289 9.689 1.00 0.00 C ATOM 1896 OD1 ASP A 122 14.900 -11.387 9.273 1.00 0.00 O ATOM 1897 OD2 ASP A 122 15.171 -9.482 10.337 1.00 0.00 O ATOM 0 H ASP A 122 13.355 -11.066 7.232 1.00 0.00 H new ATOM 0 HA ASP A 122 11.836 -8.883 7.924 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.650 -9.284 10.193 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.421 -10.824 9.388 1.00 0.00 H new ATOM 1902 N GLY A 123 13.075 -6.787 8.193 1.00 0.00 N ATOM 1903 CA GLY A 123 13.772 -5.509 8.231 1.00 0.00 C ATOM 1904 C GLY A 123 14.589 -5.203 6.985 1.00 0.00 C ATOM 1905 O GLY A 123 15.711 -5.689 6.836 1.00 0.00 O ATOM 0 H GLY A 123 12.062 -6.719 8.289 1.00 0.00 H new ATOM 0 HA2 GLY A 123 13.041 -4.714 8.376 1.00 0.00 H new ATOM 0 HA3 GLY A 123 14.433 -5.495 9.097 1.00 0.00 H new ATOM 1909 N GLU A 124 14.033 -4.374 6.103 1.00 0.00 N ATOM 1910 CA GLU A 124 14.720 -3.976 4.873 1.00 0.00 C ATOM 1911 C GLU A 124 14.325 -2.554 4.470 1.00 0.00 C ATOM 1912 O GLU A 124 13.246 -2.079 4.818 1.00 0.00 O ATOM 1913 CB GLU A 124 14.401 -4.945 3.728 1.00 0.00 C ATOM 1914 CG GLU A 124 14.170 -6.379 4.175 1.00 0.00 C ATOM 1915 CD GLU A 124 15.457 -7.092 4.540 1.00 0.00 C ATOM 1916 OE1 GLU A 124 16.486 -6.836 3.879 1.00 0.00 O ATOM 1917 OE2 GLU A 124 15.436 -7.905 5.487 1.00 0.00 O ATOM 0 H GLU A 124 13.106 -3.963 6.217 1.00 0.00 H new ATOM 0 HA GLU A 124 15.792 -4.006 5.068 1.00 0.00 H new ATOM 0 HB2 GLU A 124 13.513 -4.592 3.204 1.00 0.00 H new ATOM 0 HB3 GLU A 124 15.222 -4.927 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 124 13.500 -6.384 5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 124 13.669 -6.928 3.378 1.00 0.00 H new ATOM 1924 N SER A 125 15.211 -1.884 3.737 1.00 0.00 N ATOM 1925 CA SER A 125 14.962 -0.517 3.289 1.00 0.00 C ATOM 1926 C SER A 125 13.757 -0.447 2.354 1.00 0.00 C ATOM 1927 O SER A 125 13.255 -1.471 1.891 1.00 0.00 O ATOM 1928 CB SER A 125 16.199 0.043 2.583 1.00 0.00 C ATOM 1929 OG SER A 125 15.884 1.214 1.852 1.00 0.00 O ATOM 0 H SER A 125 16.109 -2.267 3.441 1.00 0.00 H new ATOM 0 HA SER A 125 14.744 0.086 4.170 1.00 0.00 H new ATOM 0 HB2 SER A 125 16.971 0.267 3.319 1.00 0.00 H new ATOM 0 HB3 SER A 125 16.609 -0.710 1.910 1.00 0.00 H new ATOM 0 HG SER A 125 16.692 1.552 1.412 1.00 0.00 H new ATOM 1935 N VAL A 126 13.302 0.775 2.084 1.00 0.00 N ATOM 1936 CA VAL A 126 12.156 1.004 1.205 1.00 0.00 C ATOM 1937 C VAL A 126 12.176 2.425 0.639 1.00 0.00 C ATOM 1938 O VAL A 126 12.293 3.394 1.387 1.00 0.00 O ATOM 1939 CB VAL A 126 10.818 0.791 1.953 1.00 0.00 C ATOM 1940 CG1 VAL A 126 9.632 0.964 1.018 1.00 0.00 C ATOM 1941 CG2 VAL A 126 10.781 -0.573 2.611 1.00 0.00 C ATOM 0 H VAL A 126 13.713 1.628 2.464 1.00 0.00 H new ATOM 0 HA VAL A 126 12.233 0.282 0.392 1.00 0.00 H new ATOM 0 HB VAL A 126 10.748 1.551 2.731 1.00 0.00 H new ATOM 0 HG11 VAL A 126 8.706 0.808 1.572 1.00 0.00 H new ATOM 0 HG12 VAL A 126 9.641 1.971 0.602 1.00 0.00 H new ATOM 0 HG13 VAL A 126 9.697 0.236 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.831 -0.701 3.131 1.00 0.00 H new ATOM 0 HG22 VAL A 126 10.885 -1.347 1.850 1.00 0.00 H new ATOM 0 HG23 VAL A 126 11.600 -0.654 3.326 1.00 0.00 H new ATOM 1951 N VAL A 127 12.049 2.547 -0.681 1.00 0.00 N ATOM 1952 CA VAL A 127 12.040 3.858 -1.323 1.00 0.00 C ATOM 1953 C VAL A 127 10.788 4.031 -2.181 1.00 0.00 C ATOM 1954 O VAL A 127 10.665 3.435 -3.249 1.00 0.00 O ATOM 1955 CB VAL A 127 13.294 4.083 -2.194 1.00 0.00 C ATOM 1956 CG1 VAL A 127 14.550 4.122 -1.331 1.00 0.00 C ATOM 1957 CG2 VAL A 127 13.402 3.012 -3.268 1.00 0.00 C ATOM 0 H VAL A 127 11.952 1.760 -1.322 1.00 0.00 H new ATOM 0 HA VAL A 127 12.041 4.601 -0.525 1.00 0.00 H new ATOM 0 HB VAL A 127 13.198 5.048 -2.691 1.00 0.00 H new ATOM 0 HG11 VAL A 127 15.422 4.281 -1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 127 14.471 4.936 -0.611 1.00 0.00 H new ATOM 0 HG13 VAL A 127 14.656 3.176 -0.800 1.00 0.00 H new ATOM 0 HG21 VAL A 127 14.293 3.190 -3.871 1.00 0.00 H new ATOM 0 HG22 VAL A 127 13.471 2.031 -2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 127 12.519 3.047 -3.906 1.00 0.00 H new ATOM 1967 N VAL A 128 9.859 4.848 -1.693 1.00 0.00 N ATOM 1968 CA VAL A 128 8.602 5.101 -2.399 1.00 0.00 C ATOM 1969 C VAL A 128 8.794 6.161 -3.492 1.00 0.00 C ATOM 1970 O VAL A 128 9.331 7.235 -3.223 1.00 0.00 O ATOM 1971 CB VAL A 128 7.492 5.589 -1.434 1.00 0.00 C ATOM 1972 CG1 VAL A 128 6.138 4.998 -1.801 1.00 0.00 C ATOM 1973 CG2 VAL A 128 7.829 5.259 0.016 1.00 0.00 C ATOM 0 H VAL A 128 9.951 5.349 -0.809 1.00 0.00 H new ATOM 0 HA VAL A 128 8.298 4.154 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 128 7.436 6.673 -1.537 1.00 0.00 H new ATOM 0 HG11 VAL A 128 5.382 5.360 -1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.872 5.299 -2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.189 3.911 -1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 128 7.029 5.615 0.666 1.00 0.00 H new ATOM 0 HG22 VAL A 128 7.934 4.180 0.129 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.765 5.746 0.292 1.00 0.00 H new ATOM 1983 N GLU A 129 8.356 5.865 -4.716 1.00 0.00 N ATOM 1984 CA GLU A 129 8.489 6.807 -5.822 1.00 0.00 C ATOM 1985 C GLU A 129 7.378 6.611 -6.857 1.00 0.00 C ATOM 1986 O GLU A 129 7.169 5.504 -7.351 1.00 0.00 O ATOM 1987 CB GLU A 129 9.856 6.642 -6.490 1.00 0.00 C ATOM 1988 CG GLU A 129 10.169 5.209 -6.887 1.00 0.00 C ATOM 1989 CD GLU A 129 11.650 4.893 -6.811 1.00 0.00 C ATOM 1990 OE1 GLU A 129 12.430 5.514 -7.565 1.00 0.00 O ATOM 1991 OE2 GLU A 129 12.030 4.025 -5.997 1.00 0.00 O ATOM 0 H GLU A 129 7.908 4.983 -4.964 1.00 0.00 H new ATOM 0 HA GLU A 129 8.402 7.815 -5.417 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.896 7.273 -7.378 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.629 6.999 -5.810 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.622 4.528 -6.235 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.815 5.032 -7.903 1.00 0.00 H new ATOM 1998 N ARG A 130 6.673 7.694 -7.186 1.00 0.00 N ATOM 1999 CA ARG A 130 5.591 7.638 -8.165 1.00 0.00 C ATOM 2000 C ARG A 130 6.147 7.518 -9.582 1.00 0.00 C ATOM 2001 O ARG A 130 6.430 8.522 -10.234 1.00 0.00 O ATOM 2002 CB ARG A 130 4.716 8.890 -8.052 1.00 0.00 C ATOM 2003 CG ARG A 130 3.624 8.982 -9.106 1.00 0.00 C ATOM 2004 CD ARG A 130 4.040 9.872 -10.269 1.00 0.00 C ATOM 2005 NE ARG A 130 3.137 11.006 -10.439 1.00 0.00 N ATOM 2006 CZ ARG A 130 3.100 11.767 -11.531 1.00 0.00 C ATOM 2007 NH1 ARG A 130 3.911 11.515 -12.551 1.00 0.00 N ATOM 2008 NH2 ARG A 130 2.250 12.782 -11.603 1.00 0.00 N ATOM 0 H ARG A 130 6.833 8.619 -6.788 1.00 0.00 H new ATOM 0 HA ARG A 130 4.985 6.756 -7.956 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.255 8.910 -7.064 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.352 9.772 -8.125 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.390 7.984 -9.477 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.714 9.375 -8.654 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.053 10.237 -10.102 1.00 0.00 H new ATOM 0 HD3 ARG A 130 4.060 9.284 -11.187 1.00 0.00 H new ATOM 0 HE ARG A 130 2.497 11.229 -9.677 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.567 10.735 -12.501 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.879 12.101 -13.385 1.00 0.00 H new ATOM 0 HH21 ARG A 130 1.625 12.980 -10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 130 2.222 13.365 -12.439 1.00 0.00 H new ATOM 2022 N ALA A 131 6.297 6.281 -10.051 1.00 0.00 N ATOM 2023 CA ALA A 131 6.816 6.020 -11.394 1.00 0.00 C ATOM 2024 C ALA A 131 8.006 6.918 -11.725 1.00 0.00 C ATOM 2025 O ALA A 131 7.787 7.997 -12.312 1.00 0.00 O ATOM 2026 CB ALA A 131 5.714 6.201 -12.422 1.00 0.00 C ATOM 2027 OXT ALA A 131 9.147 6.533 -11.391 1.00 0.00 O ATOM 0 H ALA A 131 6.066 5.441 -9.520 1.00 0.00 H new ATOM 0 HA ALA A 131 7.167 4.988 -11.422 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.110 6.005 -13.418 1.00 0.00 H new ATOM 0 HB2 ALA A 131 4.902 5.506 -12.211 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.338 7.223 -12.376 1.00 0.00 H new