USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 660 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 102 ASN : amide:sc= -5.3! C(o=-5.3!,f=-14!) USER MOD Set 1.2: A 103 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 86 THR OG1 : rot 180:sc= 0.0145 USER MOD Set 2.2: A 87 ASN : amide:sc= -0.135 X(o=-0.12,f=-0.018) USER MOD Set 3.1: A 62 HIS : no HE2:sc= -0.346 K(o=-0.51,f=-2.9) USER MOD Set 3.2: A 96 GLN : amide:sc= -0.162 K(o=-0.51,f=-4.1!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 101 MET CE :methyl -165:sc= -2.62! (180deg=-3.23) USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 172:sc= -0.431 (180deg=-0.632) USER MOD Single : A 112 ASN : amide:sc= 0.382 X(o=0.38,f=-0.00036) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.193 USER MOD Single : A 115 THR OG1 : rot 78:sc= 0.8 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.946 K(o=0.95,f=-5.2!) USER MOD Single : A 131 SER OG : rot 170:sc= 0.591 USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 133 HIS : no HD1:sc= -0.0287 X(o=-0.029,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.306) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -7.278 10.965 -1.764 1.00 0.00 N ATOM 114 CA SER A 58 -6.630 11.620 -2.909 1.00 0.00 C ATOM 115 C SER A 58 -5.851 10.679 -3.856 1.00 0.00 C ATOM 116 O SER A 58 -6.407 10.244 -4.867 1.00 0.00 O ATOM 117 CB SER A 58 -5.799 12.813 -2.416 1.00 0.00 C ATOM 118 OG SER A 58 -5.243 13.534 -3.500 1.00 0.00 O ATOM 0 HA SER A 58 -7.429 11.987 -3.553 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.427 13.475 -1.820 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.001 12.458 -1.764 1.00 0.00 H new ATOM 0 HG SER A 58 -4.721 14.289 -3.157 1.00 0.00 H new ATOM 124 N ARG A 59 -4.564 10.407 -3.586 1.00 0.00 N ATOM 125 CA ARG A 59 -3.567 10.009 -4.602 1.00 0.00 C ATOM 126 C ARG A 59 -2.574 8.902 -4.210 1.00 0.00 C ATOM 127 O ARG A 59 -1.900 8.400 -5.110 1.00 0.00 O ATOM 128 CB ARG A 59 -2.815 11.277 -5.049 1.00 0.00 C ATOM 129 CG ARG A 59 -3.495 12.023 -6.221 1.00 0.00 C ATOM 130 CD ARG A 59 -3.023 13.480 -6.319 1.00 0.00 C ATOM 131 NE ARG A 59 -1.557 13.565 -6.238 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.835 14.495 -5.651 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.298 15.654 -5.290 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.402 14.270 -5.365 1.00 0.00 N ATOM 0 H ARG A 59 -4.178 10.457 -2.643 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.136 9.548 -5.409 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.728 11.955 -4.200 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.802 11.003 -5.343 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.277 11.507 -7.156 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.577 11.999 -6.088 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.365 13.914 -7.258 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.470 14.066 -5.516 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.038 12.813 -6.691 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.277 15.887 -5.458 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.683 16.331 -4.838 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.823 13.369 -5.594 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.960 14.993 -4.910 1.00 0.00 H new ATOM 148 N VAL A 60 -2.504 8.464 -2.944 1.00 0.00 N ATOM 149 CA VAL A 60 -1.740 7.257 -2.550 1.00 0.00 C ATOM 150 C VAL A 60 -2.653 6.085 -2.211 1.00 0.00 C ATOM 151 O VAL A 60 -3.603 6.211 -1.446 1.00 0.00 O ATOM 152 CB VAL A 60 -0.623 7.487 -1.512 1.00 0.00 C ATOM 153 CG1 VAL A 60 -0.925 8.200 -0.193 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.108 6.181 -1.225 1.00 0.00 C ATOM 0 H VAL A 60 -2.970 8.929 -2.165 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.184 6.980 -3.446 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.016 8.229 -2.031 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.014 8.266 0.402 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.297 9.204 -0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.679 7.640 0.359 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.894 6.358 -0.491 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.597 5.448 -0.833 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.551 5.802 -2.146 1.00 0.00 H new ATOM 164 N ILE A 61 -2.344 4.928 -2.790 1.00 0.00 N ATOM 165 CA ILE A 61 -2.919 3.605 -2.515 1.00 0.00 C ATOM 166 C ILE A 61 -1.851 2.753 -1.820 1.00 0.00 C ATOM 167 O ILE A 61 -0.663 3.006 -1.986 1.00 0.00 O ATOM 168 CB ILE A 61 -3.385 3.012 -3.858 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.573 3.811 -4.434 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.745 1.518 -3.849 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.489 3.869 -5.957 1.00 0.00 C ATOM 0 H ILE A 61 -1.632 4.882 -3.519 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.782 3.649 -1.850 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.503 3.099 -4.492 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.512 3.346 -4.133 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.572 4.821 -4.025 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.058 1.213 -4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.874 0.936 -3.549 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.558 1.344 -3.144 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.334 4.436 -6.347 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.559 4.355 -6.252 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.513 2.857 -6.362 1.00 0.00 H new ATOM 183 N HIS A 62 -2.246 1.741 -1.056 1.00 0.00 N ATOM 184 CA HIS A 62 -1.361 0.839 -0.325 1.00 0.00 C ATOM 185 C HIS A 62 -1.633 -0.623 -0.715 1.00 0.00 C ATOM 186 O HIS A 62 -2.791 -1.038 -0.852 1.00 0.00 O ATOM 187 CB HIS A 62 -1.512 1.130 1.175 1.00 0.00 C ATOM 188 CG HIS A 62 -0.942 0.091 2.117 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.375 -1.212 2.265 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.003 0.319 3.085 1.00 0.00 C ATOM 191 CE1 HIS A 62 -0.683 -1.763 3.280 1.00 0.00 C ATOM 192 NE2 HIS A 62 0.174 -0.870 3.806 1.00 0.00 N ATOM 0 H HIS A 62 -3.232 1.517 -0.923 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.317 1.009 -0.589 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.033 2.086 1.389 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.573 1.248 1.396 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.091 -1.674 1.705 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.512 1.252 3.263 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.800 -2.780 3.624 1.00 0.00 H new ATOM 200 N ILE A 63 -0.556 -1.401 -0.876 1.00 0.00 N ATOM 201 CA ILE A 63 -0.528 -2.775 -1.402 1.00 0.00 C ATOM 202 C ILE A 63 0.105 -3.717 -0.365 1.00 0.00 C ATOM 203 O ILE A 63 1.178 -3.389 0.135 1.00 0.00 O ATOM 204 CB ILE A 63 0.284 -2.862 -2.723 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.171 -1.616 -3.639 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.137 -4.144 -3.460 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.026 -1.698 -4.912 1.00 0.00 C ATOM 0 H ILE A 63 0.376 -1.070 -0.628 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.557 -3.073 -1.606 1.00 0.00 H new ATOM 0 HB ILE A 63 1.340 -2.893 -2.456 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.873 -1.480 -3.923 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.465 -0.733 -3.072 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.421 -4.227 -4.393 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.074 -5.010 -2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.204 -4.105 -3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.892 -0.789 -5.499 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.076 -1.802 -4.639 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.717 -2.561 -5.503 1.00 0.00 H new ATOM 219 N ARG A 64 -0.498 -4.875 -0.060 1.00 0.00 N ATOM 220 CA ARG A 64 0.010 -5.896 0.898 1.00 0.00 C ATOM 221 C ARG A 64 0.487 -7.193 0.210 1.00 0.00 C ATOM 222 O ARG A 64 0.296 -7.372 -0.993 1.00 0.00 O ATOM 223 CB ARG A 64 -0.985 -6.176 2.068 1.00 0.00 C ATOM 224 CG ARG A 64 -2.242 -5.297 2.140 1.00 0.00 C ATOM 225 CD ARG A 64 -3.133 -5.508 3.376 1.00 0.00 C ATOM 226 NE ARG A 64 -4.020 -4.340 3.529 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.283 -4.205 3.167 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.093 -5.206 2.990 1.00 0.00 N ATOM 229 NH2 ARG A 64 -5.774 -3.016 2.995 1.00 0.00 N ATOM 0 H ARG A 64 -1.386 -5.146 -0.483 1.00 0.00 H new ATOM 0 HA ARG A 64 0.898 -5.453 1.348 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.303 -7.216 2.001 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.442 -6.069 3.007 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -1.934 -4.252 2.111 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.841 -5.478 1.248 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.723 -6.418 3.265 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.518 -5.634 4.267 1.00 0.00 H new ATOM 0 HE ARG A 64 -3.601 -3.524 3.976 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.763 -6.161 3.131 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.059 -5.037 2.710 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.186 -2.195 3.139 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.748 -2.902 2.715 1.00 0.00 H new ATOM 243 N LYS A 65 1.076 -8.112 0.994 1.00 0.00 N ATOM 244 CA LYS A 65 1.508 -9.496 0.651 1.00 0.00 C ATOM 245 C LYS A 65 2.632 -9.623 -0.385 1.00 0.00 C ATOM 246 O LYS A 65 2.845 -10.703 -0.938 1.00 0.00 O ATOM 247 CB LYS A 65 0.311 -10.391 0.263 1.00 0.00 C ATOM 248 CG LYS A 65 -0.964 -10.177 1.078 1.00 0.00 C ATOM 249 CD LYS A 65 -0.852 -10.438 2.585 1.00 0.00 C ATOM 250 CE LYS A 65 -1.230 -11.882 2.915 1.00 0.00 C ATOM 251 NZ LYS A 65 -0.867 -12.233 4.314 1.00 0.00 N ATOM 0 H LYS A 65 1.284 -7.897 1.969 1.00 0.00 H new ATOM 0 HA LYS A 65 1.952 -9.852 1.581 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.081 -10.223 -0.789 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.613 -11.434 0.361 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.297 -9.149 0.931 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.742 -10.825 0.674 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.166 -10.239 2.919 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.505 -9.753 3.127 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.301 -12.021 2.770 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.724 -12.558 2.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.137 -13.219 4.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.159 -12.123 4.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.369 -11.603 4.971 1.00 0.00 H new ATOM 265 N LEU A 66 3.355 -8.539 -0.658 1.00 0.00 N ATOM 266 CA LEU A 66 4.471 -8.527 -1.609 1.00 0.00 C ATOM 267 C LEU A 66 5.598 -9.490 -1.139 1.00 0.00 C ATOM 268 O LEU A 66 5.862 -9.541 0.060 1.00 0.00 O ATOM 269 CB LEU A 66 4.972 -7.076 -1.801 1.00 0.00 C ATOM 270 CG LEU A 66 3.892 -6.059 -2.225 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.571 -4.747 -2.591 1.00 0.00 C ATOM 272 CD2 LEU A 66 3.095 -6.481 -3.457 1.00 0.00 C ATOM 0 H LEU A 66 3.183 -7.633 -0.222 1.00 0.00 H new ATOM 0 HA LEU A 66 4.134 -8.891 -2.579 1.00 0.00 H new ATOM 0 HB2 LEU A 66 5.421 -6.737 -0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.762 -7.078 -2.552 1.00 0.00 H new ATOM 0 HG LEU A 66 3.209 -5.979 -1.379 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.818 -4.019 -2.893 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.117 -4.367 -1.728 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.265 -4.914 -3.415 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.356 -5.715 -3.692 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.771 -6.605 -4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.588 -7.425 -3.257 1.00 0.00 H new ATOM 284 N PRO A 67 6.287 -10.233 -2.031 1.00 0.00 N ATOM 285 CA PRO A 67 7.340 -11.209 -1.702 1.00 0.00 C ATOM 286 C PRO A 67 8.277 -10.827 -0.542 1.00 0.00 C ATOM 287 O PRO A 67 8.322 -11.500 0.489 1.00 0.00 O ATOM 288 CB PRO A 67 8.104 -11.383 -3.021 1.00 0.00 C ATOM 289 CG PRO A 67 6.983 -11.321 -4.048 1.00 0.00 C ATOM 290 CD PRO A 67 6.028 -10.276 -3.462 1.00 0.00 C ATOM 0 HA PRO A 67 6.889 -12.126 -1.323 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.840 -10.594 -3.173 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.640 -12.331 -3.060 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.352 -11.023 -5.029 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.495 -12.288 -4.171 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.196 -9.299 -3.916 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.990 -10.545 -3.660 1.00 0.00 H new ATOM 298 N ILE A 68 9.010 -9.732 -0.748 1.00 0.00 N ATOM 299 CA ILE A 68 9.915 -9.012 0.167 1.00 0.00 C ATOM 300 C ILE A 68 10.001 -7.540 -0.258 1.00 0.00 C ATOM 301 O ILE A 68 9.981 -6.631 0.572 1.00 0.00 O ATOM 302 CB ILE A 68 11.343 -9.624 0.198 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.948 -9.965 -1.189 1.00 0.00 C ATOM 304 CG2 ILE A 68 11.340 -10.882 1.071 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.434 -10.355 -1.144 1.00 0.00 C ATOM 0 H ILE A 68 8.985 -9.273 -1.658 1.00 0.00 H new ATOM 0 HA ILE A 68 9.501 -9.100 1.172 1.00 0.00 H new ATOM 0 HB ILE A 68 11.982 -8.844 0.612 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.381 -10.785 -1.630 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.828 -9.105 -1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 68 12.341 -11.312 1.093 1.00 0.00 H new ATOM 0 HG22 ILE A 68 11.035 -10.621 2.084 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.642 -11.610 0.658 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.782 -10.579 -2.152 1.00 0.00 H new ATOM 0 HD12 ILE A 68 14.015 -9.529 -0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 68 13.560 -11.235 -0.513 1.00 0.00 H new ATOM 317 N ASP A 69 10.102 -7.326 -1.574 1.00 0.00 N ATOM 318 CA ASP A 69 10.389 -6.028 -2.208 1.00 0.00 C ATOM 319 C ASP A 69 9.824 -5.913 -3.642 1.00 0.00 C ATOM 320 O ASP A 69 9.868 -4.838 -4.236 1.00 0.00 O ATOM 321 CB ASP A 69 11.920 -5.856 -2.214 1.00 0.00 C ATOM 322 CG ASP A 69 12.381 -4.426 -2.550 1.00 0.00 C ATOM 323 OD1 ASP A 69 12.134 -3.507 -1.733 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.066 -4.234 -3.582 1.00 0.00 O ATOM 0 H ASP A 69 9.982 -8.077 -2.254 1.00 0.00 H new ATOM 0 HA ASP A 69 9.897 -5.239 -1.639 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.312 -6.134 -1.236 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.352 -6.547 -2.938 1.00 0.00 H new ATOM 329 N VAL A 70 9.292 -7.017 -4.198 1.00 0.00 N ATOM 330 CA VAL A 70 8.971 -7.230 -5.624 1.00 0.00 C ATOM 331 C VAL A 70 9.980 -6.519 -6.541 1.00 0.00 C ATOM 332 O VAL A 70 11.183 -6.774 -6.430 1.00 0.00 O ATOM 333 CB VAL A 70 7.457 -7.000 -5.862 1.00 0.00 C ATOM 334 CG1 VAL A 70 6.919 -5.576 -5.664 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.021 -7.547 -7.216 1.00 0.00 C ATOM 0 H VAL A 70 9.061 -7.833 -3.632 1.00 0.00 H new ATOM 0 HA VAL A 70 9.113 -8.269 -5.921 1.00 0.00 H new ATOM 0 HB VAL A 70 7.000 -7.564 -5.049 1.00 0.00 H new ATOM 0 HG11 VAL A 70 5.848 -5.561 -5.864 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.102 -5.258 -4.638 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.425 -4.897 -6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 70 5.954 -7.370 -7.353 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.577 -7.044 -8.008 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.220 -8.618 -7.257 1.00 0.00 H new ATOM 345 N THR A 71 9.543 -5.622 -7.419 1.00 0.00 N ATOM 346 CA THR A 71 10.352 -4.510 -7.913 1.00 0.00 C ATOM 347 C THR A 71 9.442 -3.333 -8.220 1.00 0.00 C ATOM 348 O THR A 71 8.362 -3.467 -8.803 1.00 0.00 O ATOM 349 CB THR A 71 11.251 -4.902 -9.103 1.00 0.00 C ATOM 350 OG1 THR A 71 11.738 -3.743 -9.749 1.00 0.00 O ATOM 351 CG2 THR A 71 10.553 -5.767 -10.147 1.00 0.00 C ATOM 0 H THR A 71 8.603 -5.646 -7.814 1.00 0.00 H new ATOM 0 HA THR A 71 11.052 -4.214 -7.132 1.00 0.00 H new ATOM 0 HB THR A 71 12.061 -5.492 -8.673 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.309 -4.004 -10.502 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.251 -6.000 -10.951 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.211 -6.692 -9.683 1.00 0.00 H new ATOM 0 HG23 THR A 71 9.698 -5.227 -10.554 1.00 0.00 H new ATOM 359 N GLU A 72 9.879 -2.156 -7.794 1.00 0.00 N ATOM 360 CA GLU A 72 9.180 -0.897 -8.016 1.00 0.00 C ATOM 361 C GLU A 72 8.889 -0.631 -9.506 1.00 0.00 C ATOM 362 O GLU A 72 7.840 -0.083 -9.846 1.00 0.00 O ATOM 363 CB GLU A 72 9.972 0.241 -7.345 1.00 0.00 C ATOM 364 CG GLU A 72 11.427 0.371 -7.806 1.00 0.00 C ATOM 365 CD GLU A 72 12.221 1.470 -7.056 1.00 0.00 C ATOM 366 OE1 GLU A 72 11.624 2.401 -6.463 1.00 0.00 O ATOM 367 OE2 GLU A 72 13.476 1.413 -7.069 1.00 0.00 O ATOM 0 H GLU A 72 10.749 -2.047 -7.273 1.00 0.00 H new ATOM 0 HA GLU A 72 8.195 -0.955 -7.553 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.459 1.184 -7.537 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.960 0.086 -6.266 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.930 -0.586 -7.668 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.443 0.588 -8.874 1.00 0.00 H new ATOM 374 N GLY A 73 9.763 -1.116 -10.399 1.00 0.00 N ATOM 375 CA GLY A 73 9.568 -1.106 -11.853 1.00 0.00 C ATOM 376 C GLY A 73 8.331 -1.885 -12.326 1.00 0.00 C ATOM 377 O GLY A 73 7.619 -1.447 -13.230 1.00 0.00 O ATOM 0 H GLY A 73 10.649 -1.537 -10.121 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.484 -0.073 -12.190 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.453 -1.526 -12.330 1.00 0.00 H new ATOM 381 N GLU A 74 8.031 -3.022 -11.692 1.00 0.00 N ATOM 382 CA GLU A 74 6.793 -3.778 -11.944 1.00 0.00 C ATOM 383 C GLU A 74 5.583 -3.019 -11.409 1.00 0.00 C ATOM 384 O GLU A 74 4.581 -2.882 -12.108 1.00 0.00 O ATOM 385 CB GLU A 74 6.849 -5.203 -11.356 1.00 0.00 C ATOM 386 CG GLU A 74 7.483 -6.188 -12.348 1.00 0.00 C ATOM 387 CD GLU A 74 7.346 -7.645 -11.865 1.00 0.00 C ATOM 388 OE1 GLU A 74 8.228 -8.136 -11.122 1.00 0.00 O ATOM 389 OE2 GLU A 74 6.355 -8.320 -12.242 1.00 0.00 O ATOM 0 H GLU A 74 8.636 -3.447 -10.990 1.00 0.00 H new ATOM 0 HA GLU A 74 6.693 -3.882 -13.024 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.424 -5.195 -10.430 1.00 0.00 H new ATOM 0 HB3 GLU A 74 5.842 -5.535 -11.103 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.007 -6.081 -13.323 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.537 -5.945 -12.480 1.00 0.00 H new ATOM 396 N VAL A 75 5.689 -2.482 -10.192 1.00 0.00 N ATOM 397 CA VAL A 75 4.592 -1.780 -9.509 1.00 0.00 C ATOM 398 C VAL A 75 4.065 -0.584 -10.330 1.00 0.00 C ATOM 399 O VAL A 75 2.865 -0.520 -10.613 1.00 0.00 O ATOM 400 CB VAL A 75 5.003 -1.432 -8.069 1.00 0.00 C ATOM 401 CG1 VAL A 75 3.924 -0.646 -7.319 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.254 -2.730 -7.292 1.00 0.00 C ATOM 0 H VAL A 75 6.548 -2.521 -9.643 1.00 0.00 H new ATOM 0 HA VAL A 75 3.735 -2.449 -9.433 1.00 0.00 H new ATOM 0 HB VAL A 75 5.898 -0.813 -8.135 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.269 -0.428 -6.308 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.724 0.288 -7.843 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.010 -1.238 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.546 -2.491 -6.269 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.343 -3.328 -7.279 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.052 -3.295 -7.775 1.00 0.00 H new ATOM 412 N ILE A 76 4.919 0.337 -10.793 1.00 0.00 N ATOM 413 CA ILE A 76 4.460 1.462 -11.631 1.00 0.00 C ATOM 414 C ILE A 76 4.216 1.099 -13.097 1.00 0.00 C ATOM 415 O ILE A 76 3.366 1.724 -13.720 1.00 0.00 O ATOM 416 CB ILE A 76 5.349 2.714 -11.523 1.00 0.00 C ATOM 417 CG1 ILE A 76 6.485 2.883 -12.550 1.00 0.00 C ATOM 418 CG2 ILE A 76 5.840 2.919 -10.090 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.520 1.769 -12.488 1.00 0.00 C ATOM 0 H ILE A 76 5.922 0.330 -10.607 1.00 0.00 H new ATOM 0 HA ILE A 76 3.488 1.710 -11.204 1.00 0.00 H new ATOM 0 HB ILE A 76 4.670 3.518 -11.806 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.058 2.918 -13.552 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.980 3.839 -12.381 1.00 0.00 H new ATOM 0 HG21 ILE A 76 6.466 3.810 -10.044 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.984 3.041 -9.426 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.421 2.052 -9.777 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.292 1.948 -13.236 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.973 1.748 -11.497 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.037 0.812 -12.686 1.00 0.00 H new ATOM 431 N SER A 77 4.873 0.075 -13.646 1.00 0.00 N ATOM 432 CA SER A 77 4.515 -0.451 -14.976 1.00 0.00 C ATOM 433 C SER A 77 3.089 -0.995 -14.971 1.00 0.00 C ATOM 434 O SER A 77 2.374 -0.895 -15.970 1.00 0.00 O ATOM 435 CB SER A 77 5.523 -1.513 -15.432 1.00 0.00 C ATOM 436 OG SER A 77 5.228 -2.009 -16.726 1.00 0.00 O ATOM 0 H SER A 77 5.652 -0.408 -13.198 1.00 0.00 H new ATOM 0 HA SER A 77 4.555 0.367 -15.695 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.526 -1.085 -15.428 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.526 -2.338 -14.720 1.00 0.00 H new ATOM 0 HG SER A 77 5.895 -2.681 -16.978 1.00 0.00 H new ATOM 442 N LEU A 78 2.634 -1.462 -13.805 1.00 0.00 N ATOM 443 CA LEU A 78 1.245 -1.824 -13.584 1.00 0.00 C ATOM 444 C LEU A 78 0.336 -0.631 -13.246 1.00 0.00 C ATOM 445 O LEU A 78 -0.861 -0.709 -13.526 1.00 0.00 O ATOM 446 CB LEU A 78 1.174 -2.904 -12.496 1.00 0.00 C ATOM 447 CG LEU A 78 1.513 -4.298 -13.032 1.00 0.00 C ATOM 448 CD1 LEU A 78 1.892 -5.229 -11.882 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.287 -4.860 -13.751 1.00 0.00 C ATOM 0 H LEU A 78 3.229 -1.598 -12.987 1.00 0.00 H new ATOM 0 HA LEU A 78 0.858 -2.214 -14.526 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.863 -2.650 -11.691 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.172 -2.917 -12.066 1.00 0.00 H new ATOM 0 HG LEU A 78 2.356 -4.225 -13.719 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.131 -6.217 -12.277 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.760 -4.827 -11.360 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.056 -5.308 -11.187 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.515 -5.853 -14.138 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.547 -4.926 -13.052 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.016 -4.202 -14.577 1.00 0.00 H new ATOM 461 N GLY A 79 0.874 0.478 -12.723 1.00 0.00 N ATOM 462 CA GLY A 79 0.107 1.694 -12.434 1.00 0.00 C ATOM 463 C GLY A 79 0.022 2.689 -13.598 1.00 0.00 C ATOM 464 O GLY A 79 -0.740 3.654 -13.540 1.00 0.00 O ATOM 0 H GLY A 79 1.863 0.556 -12.487 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.904 1.409 -12.143 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.556 2.196 -11.577 1.00 0.00 H new ATOM 468 N LEU A 80 0.802 2.504 -14.663 1.00 0.00 N ATOM 469 CA LEU A 80 0.873 3.452 -15.768 1.00 0.00 C ATOM 470 C LEU A 80 -0.269 3.471 -16.809 1.00 0.00 C ATOM 471 O LEU A 80 -0.391 4.504 -17.472 1.00 0.00 O ATOM 472 CB LEU A 80 2.254 3.390 -16.435 1.00 0.00 C ATOM 473 CG LEU A 80 3.265 4.319 -15.733 1.00 0.00 C ATOM 474 CD1 LEU A 80 4.658 4.104 -16.320 1.00 0.00 C ATOM 475 CD2 LEU A 80 2.876 5.795 -15.879 1.00 0.00 C ATOM 0 H LEU A 80 1.403 1.689 -14.781 1.00 0.00 H new ATOM 0 HA LEU A 80 0.715 4.410 -15.273 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.624 2.365 -16.412 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.165 3.674 -17.484 1.00 0.00 H new ATOM 0 HG LEU A 80 3.262 4.070 -14.672 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.369 4.763 -15.821 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.959 3.067 -16.172 1.00 0.00 H new ATOM 0 HD13 LEU A 80 4.642 4.329 -17.386 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.613 6.417 -15.371 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.844 6.060 -16.936 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.894 5.958 -15.434 1.00 0.00 H new ATOM 487 N PRO A 81 -1.150 2.459 -16.953 1.00 0.00 N ATOM 488 CA PRO A 81 -2.357 2.564 -17.787 1.00 0.00 C ATOM 489 C PRO A 81 -3.367 3.653 -17.427 1.00 0.00 C ATOM 490 O PRO A 81 -4.353 3.806 -18.156 1.00 0.00 O ATOM 491 CB PRO A 81 -3.001 1.171 -17.787 1.00 0.00 C ATOM 492 CG PRO A 81 -1.857 0.234 -17.412 1.00 0.00 C ATOM 493 CD PRO A 81 -1.007 1.089 -16.478 1.00 0.00 C ATOM 0 HA PRO A 81 -2.037 2.892 -18.776 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.819 1.110 -17.069 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -3.416 0.923 -18.764 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -2.219 -0.667 -16.917 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.295 -0.088 -18.289 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -1.346 0.996 -15.446 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.036 0.774 -16.501 1.00 0.00 H new ATOM 501 N PHE A 82 -3.137 4.417 -16.355 1.00 0.00 N ATOM 502 CA PHE A 82 -4.163 5.275 -15.771 1.00 0.00 C ATOM 503 C PHE A 82 -3.826 6.764 -15.755 1.00 0.00 C ATOM 504 O PHE A 82 -4.679 7.593 -16.085 1.00 0.00 O ATOM 505 CB PHE A 82 -4.459 4.773 -14.354 1.00 0.00 C ATOM 506 CG PHE A 82 -4.684 3.280 -14.325 1.00 0.00 C ATOM 507 CD1 PHE A 82 -5.738 2.711 -15.065 1.00 0.00 C ATOM 508 CD2 PHE A 82 -3.734 2.452 -13.706 1.00 0.00 C ATOM 509 CE1 PHE A 82 -5.861 1.316 -15.160 1.00 0.00 C ATOM 510 CE2 PHE A 82 -3.841 1.060 -13.823 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.888 0.496 -14.568 1.00 0.00 C ATOM 0 H PHE A 82 -2.239 4.456 -15.873 1.00 0.00 H new ATOM 0 HA PHE A 82 -5.040 5.203 -16.414 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.628 5.028 -13.697 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -5.341 5.281 -13.965 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.454 3.350 -15.561 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -2.923 2.887 -13.141 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.697 0.877 -15.684 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.117 0.421 -13.340 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.945 -0.576 -14.687 1.00 0.00 H new ATOM 521 N GLY A 83 -2.595 7.108 -15.364 1.00 0.00 N ATOM 522 CA GLY A 83 -2.123 8.485 -15.290 1.00 0.00 C ATOM 523 C GLY A 83 -0.624 8.575 -15.520 1.00 0.00 C ATOM 524 O GLY A 83 -0.141 8.400 -16.643 1.00 0.00 O ATOM 0 H GLY A 83 -1.891 6.424 -15.087 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.643 9.089 -16.034 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.368 8.902 -14.313 1.00 0.00 H new ATOM 528 N LYS A 84 0.103 8.867 -14.441 1.00 0.00 N ATOM 529 CA LYS A 84 1.537 9.185 -14.473 1.00 0.00 C ATOM 530 C LYS A 84 2.359 8.648 -13.296 1.00 0.00 C ATOM 531 O LYS A 84 3.577 8.566 -13.419 1.00 0.00 O ATOM 532 CB LYS A 84 1.696 10.712 -14.660 1.00 0.00 C ATOM 533 CG LYS A 84 3.069 11.164 -15.173 1.00 0.00 C ATOM 534 CD LYS A 84 3.528 10.451 -16.455 1.00 0.00 C ATOM 535 CE LYS A 84 4.754 11.118 -17.095 1.00 0.00 C ATOM 536 NZ LYS A 84 5.975 10.985 -16.256 1.00 0.00 N ATOM 0 H LYS A 84 -0.293 8.890 -13.501 1.00 0.00 H new ATOM 0 HA LYS A 84 1.965 8.651 -15.322 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.933 11.059 -15.357 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.503 11.202 -13.706 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.040 12.238 -15.358 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.810 10.995 -14.392 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.763 9.412 -16.224 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.708 10.440 -17.174 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.938 10.672 -18.072 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.544 12.175 -17.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.775 11.451 -16.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.812 11.433 -15.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 6.193 9.978 -16.118 1.00 0.00 H new ATOM 550 N VAL A 85 1.702 8.233 -12.202 1.00 0.00 N ATOM 551 CA VAL A 85 2.260 7.587 -10.986 1.00 0.00 C ATOM 552 C VAL A 85 3.663 8.102 -10.605 1.00 0.00 C ATOM 553 O VAL A 85 4.702 7.535 -10.952 1.00 0.00 O ATOM 554 CB VAL A 85 2.150 6.052 -10.981 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.868 5.342 -9.649 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.757 5.427 -12.318 1.00 0.00 C ATOM 0 H VAL A 85 0.691 8.345 -12.131 1.00 0.00 H new ATOM 0 HA VAL A 85 1.603 7.912 -10.179 1.00 0.00 H new ATOM 0 HB VAL A 85 3.181 5.701 -10.950 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.820 4.266 -9.813 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.666 5.566 -8.941 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.917 5.690 -9.245 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.706 4.343 -12.212 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.783 5.808 -12.625 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.501 5.683 -13.072 1.00 0.00 H new ATOM 566 N THR A 86 3.690 9.243 -9.921 1.00 0.00 N ATOM 567 CA THR A 86 4.908 10.017 -9.648 1.00 0.00 C ATOM 568 C THR A 86 5.847 9.294 -8.693 1.00 0.00 C ATOM 569 O THR A 86 7.065 9.387 -8.864 1.00 0.00 O ATOM 570 CB THR A 86 4.588 11.399 -9.057 1.00 0.00 C ATOM 571 OG1 THR A 86 3.805 11.271 -7.889 1.00 0.00 O ATOM 572 CG2 THR A 86 3.805 12.270 -10.037 1.00 0.00 C ATOM 0 H THR A 86 2.849 9.669 -9.530 1.00 0.00 H new ATOM 0 HA THR A 86 5.399 10.137 -10.613 1.00 0.00 H new ATOM 0 HB THR A 86 5.547 11.867 -8.835 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.612 12.160 -7.525 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.600 13.238 -9.580 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.392 12.415 -10.944 1.00 0.00 H new ATOM 0 HG23 THR A 86 2.864 11.780 -10.288 1.00 0.00 H new ATOM 580 N ASN A 87 5.308 8.571 -7.701 1.00 0.00 N ATOM 581 CA ASN A 87 6.107 7.882 -6.697 1.00 0.00 C ATOM 582 C ASN A 87 5.527 6.541 -6.219 1.00 0.00 C ATOM 583 O ASN A 87 4.356 6.213 -6.377 1.00 0.00 O ATOM 584 CB ASN A 87 6.330 8.821 -5.487 1.00 0.00 C ATOM 585 CG ASN A 87 7.106 10.093 -5.786 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.322 10.148 -5.680 1.00 0.00 O ATOM 587 ND2 ASN A 87 6.427 11.170 -6.117 1.00 0.00 N ATOM 0 H ASN A 87 4.302 8.452 -7.579 1.00 0.00 H new ATOM 0 HA ASN A 87 7.050 7.632 -7.183 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.358 9.096 -5.078 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.858 8.267 -4.711 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.916 12.049 -6.285 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.412 11.126 -6.206 1.00 0.00 H new ATOM 594 N LEU A 88 6.369 5.772 -5.542 1.00 0.00 N ATOM 595 CA LEU A 88 6.017 4.655 -4.677 1.00 0.00 C ATOM 596 C LEU A 88 7.028 4.455 -3.541 1.00 0.00 C ATOM 597 O LEU A 88 8.106 5.057 -3.514 1.00 0.00 O ATOM 598 CB LEU A 88 5.841 3.399 -5.540 1.00 0.00 C ATOM 599 CG LEU A 88 7.105 2.763 -6.144 1.00 0.00 C ATOM 600 CD1 LEU A 88 6.578 1.559 -6.909 1.00 0.00 C ATOM 601 CD2 LEU A 88 7.901 3.672 -7.082 1.00 0.00 C ATOM 0 H LEU A 88 7.377 5.921 -5.585 1.00 0.00 H new ATOM 0 HA LEU A 88 5.073 4.873 -4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.342 2.643 -4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.166 3.647 -6.359 1.00 0.00 H new ATOM 0 HG LEU A 88 7.815 2.526 -5.351 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.410 1.035 -7.380 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.067 0.886 -6.221 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.879 1.893 -7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.772 3.135 -7.456 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.271 3.971 -7.920 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.227 4.559 -6.539 1.00 0.00 H new ATOM 613 N LEU A 89 6.654 3.605 -2.590 1.00 0.00 N ATOM 614 CA LEU A 89 7.359 3.302 -1.344 1.00 0.00 C ATOM 615 C LEU A 89 7.138 1.829 -1.007 1.00 0.00 C ATOM 616 O LEU A 89 6.105 1.271 -1.362 1.00 0.00 O ATOM 617 CB LEU A 89 6.885 4.328 -0.296 1.00 0.00 C ATOM 618 CG LEU A 89 6.703 3.920 1.173 1.00 0.00 C ATOM 619 CD1 LEU A 89 6.130 5.151 1.863 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.711 2.814 1.446 1.00 0.00 C ATOM 0 H LEU A 89 5.789 3.071 -2.673 1.00 0.00 H new ATOM 0 HA LEU A 89 8.442 3.409 -1.401 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.594 5.156 -0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.928 4.720 -0.641 1.00 0.00 H new ATOM 0 HG LEU A 89 7.672 3.558 1.515 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.972 4.935 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.828 5.982 1.762 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.179 5.417 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.672 2.617 2.517 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.724 3.116 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.021 1.910 0.922 1.00 0.00 H new ATOM 632 N MET A 90 8.088 1.193 -0.318 1.00 0.00 N ATOM 633 CA MET A 90 8.116 -0.262 -0.117 1.00 0.00 C ATOM 634 C MET A 90 8.399 -0.631 1.349 1.00 0.00 C ATOM 635 O MET A 90 9.553 -0.674 1.783 1.00 0.00 O ATOM 636 CB MET A 90 9.101 -0.893 -1.115 1.00 0.00 C ATOM 637 CG MET A 90 8.785 -0.435 -2.552 1.00 0.00 C ATOM 638 SD MET A 90 9.442 -1.486 -3.860 1.00 0.00 S ATOM 639 CE MET A 90 7.856 -1.938 -4.601 1.00 0.00 C ATOM 0 H MET A 90 8.870 1.678 0.122 1.00 0.00 H new ATOM 0 HA MET A 90 7.130 -0.678 -0.322 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.121 -0.612 -0.854 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.044 -1.980 -1.053 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.703 -0.375 -2.666 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.176 0.573 -2.688 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.026 -2.601 -5.449 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.240 -2.448 -3.860 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.344 -1.038 -4.941 1.00 0.00 H new ATOM 649 N LEU A 91 7.340 -0.868 2.131 1.00 0.00 N ATOM 650 CA LEU A 91 7.405 -1.328 3.523 1.00 0.00 C ATOM 651 C LEU A 91 7.840 -2.807 3.609 1.00 0.00 C ATOM 652 O LEU A 91 7.030 -3.723 3.763 1.00 0.00 O ATOM 653 CB LEU A 91 6.063 -1.129 4.271 1.00 0.00 C ATOM 654 CG LEU A 91 5.439 0.272 4.434 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.460 1.403 4.511 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.358 0.518 3.388 1.00 0.00 C ATOM 0 H LEU A 91 6.383 -0.741 1.802 1.00 0.00 H new ATOM 0 HA LEU A 91 8.157 -0.711 4.014 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.323 -1.750 3.767 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.194 -1.538 5.273 1.00 0.00 H new ATOM 0 HG LEU A 91 4.958 0.279 5.412 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.941 2.355 4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 91 7.116 1.243 5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.053 1.421 3.597 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.936 1.513 3.528 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.793 0.445 2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.571 -0.228 3.496 1.00 0.00 H new ATOM 668 N LYS A 92 9.154 -3.036 3.583 1.00 0.00 N ATOM 669 CA LYS A 92 9.787 -4.339 3.841 1.00 0.00 C ATOM 670 C LYS A 92 9.551 -4.919 5.255 1.00 0.00 C ATOM 671 O LYS A 92 9.833 -6.095 5.487 1.00 0.00 O ATOM 672 CB LYS A 92 11.275 -4.293 3.452 1.00 0.00 C ATOM 673 CG LYS A 92 12.226 -3.498 4.371 1.00 0.00 C ATOM 674 CD LYS A 92 12.160 -1.964 4.271 1.00 0.00 C ATOM 675 CE LYS A 92 12.432 -1.398 2.865 1.00 0.00 C ATOM 676 NZ LYS A 92 13.829 -1.640 2.412 1.00 0.00 N ATOM 0 H LYS A 92 9.831 -2.301 3.376 1.00 0.00 H new ATOM 0 HA LYS A 92 9.278 -5.055 3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.640 -5.318 3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.348 -3.874 2.449 1.00 0.00 H new ATOM 0 HG2 LYS A 92 12.018 -3.781 5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 92 13.248 -3.810 4.155 1.00 0.00 H new ATOM 0 HD2 LYS A 92 11.173 -1.635 4.596 1.00 0.00 H new ATOM 0 HD3 LYS A 92 12.883 -1.537 4.966 1.00 0.00 H new ATOM 0 HE2 LYS A 92 11.740 -1.851 2.155 1.00 0.00 H new ATOM 0 HE3 LYS A 92 12.234 -0.326 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.960 -1.240 1.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.492 -1.186 3.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.013 -2.663 2.385 1.00 0.00 H new ATOM 690 N GLY A 93 9.011 -4.122 6.184 1.00 0.00 N ATOM 691 CA GLY A 93 8.664 -4.499 7.563 1.00 0.00 C ATOM 692 C GLY A 93 7.625 -5.623 7.673 1.00 0.00 C ATOM 693 O GLY A 93 7.883 -6.647 8.312 1.00 0.00 O ATOM 0 H GLY A 93 8.792 -3.146 5.986 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.572 -4.809 8.081 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.285 -3.619 8.082 1.00 0.00 H new ATOM 697 N LYS A 94 6.450 -5.429 7.060 1.00 0.00 N ATOM 698 CA LYS A 94 5.285 -6.346 7.091 1.00 0.00 C ATOM 699 C LYS A 94 4.807 -6.726 5.676 1.00 0.00 C ATOM 700 O LYS A 94 3.666 -7.149 5.488 1.00 0.00 O ATOM 701 CB LYS A 94 4.164 -5.735 7.969 1.00 0.00 C ATOM 702 CG LYS A 94 4.544 -5.645 9.458 1.00 0.00 C ATOM 703 CD LYS A 94 3.779 -4.534 10.189 1.00 0.00 C ATOM 704 CE LYS A 94 4.338 -3.155 9.802 1.00 0.00 C ATOM 705 NZ LYS A 94 3.674 -2.075 10.573 1.00 0.00 N ATOM 0 H LYS A 94 6.270 -4.594 6.502 1.00 0.00 H new ATOM 0 HA LYS A 94 5.590 -7.287 7.549 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.925 -4.737 7.600 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.261 -6.337 7.866 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.341 -6.601 9.941 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.615 -5.464 9.547 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.720 -4.588 9.938 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.859 -4.677 11.267 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.412 -3.130 9.986 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.193 -2.987 8.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.070 -1.155 10.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.653 -2.087 10.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.834 -2.225 11.590 1.00 0.00 H new ATOM 719 N ASN A 95 5.698 -6.609 4.683 1.00 0.00 N ATOM 720 CA ASN A 95 5.488 -6.881 3.255 1.00 0.00 C ATOM 721 C ASN A 95 4.348 -6.060 2.624 1.00 0.00 C ATOM 722 O ASN A 95 3.426 -6.605 2.007 1.00 0.00 O ATOM 723 CB ASN A 95 5.338 -8.397 3.029 1.00 0.00 C ATOM 724 CG ASN A 95 6.622 -9.190 3.239 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.731 -8.676 3.199 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.515 -10.478 3.470 1.00 0.00 N ATOM 0 H ASN A 95 6.652 -6.300 4.870 1.00 0.00 H new ATOM 0 HA ASN A 95 6.377 -6.541 2.723 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.573 -8.780 3.705 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.981 -8.568 2.014 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.353 -11.042 3.614 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.594 -10.915 3.505 1.00 0.00 H new ATOM 733 N GLN A 96 4.440 -4.732 2.736 1.00 0.00 N ATOM 734 CA GLN A 96 3.514 -3.799 2.086 1.00 0.00 C ATOM 735 C GLN A 96 4.236 -2.688 1.295 1.00 0.00 C ATOM 736 O GLN A 96 5.460 -2.684 1.188 1.00 0.00 O ATOM 737 CB GLN A 96 2.388 -3.311 3.030 1.00 0.00 C ATOM 738 CG GLN A 96 2.330 -3.872 4.457 1.00 0.00 C ATOM 739 CD GLN A 96 3.346 -3.156 5.317 1.00 0.00 C ATOM 740 OE1 GLN A 96 4.467 -3.590 5.532 1.00 0.00 O ATOM 741 NE2 GLN A 96 3.027 -1.972 5.771 1.00 0.00 N ATOM 0 H GLN A 96 5.165 -4.270 3.285 1.00 0.00 H new ATOM 0 HA GLN A 96 2.986 -4.365 1.319 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.465 -2.226 3.104 1.00 0.00 H new ATOM 0 HB3 GLN A 96 1.435 -3.531 2.549 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.330 -3.742 4.871 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.534 -4.943 4.448 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.095 -1.594 5.600 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.710 -1.426 6.296 1.00 0.00 H new ATOM 750 N ALA A 97 3.489 -1.778 0.675 1.00 0.00 N ATOM 751 CA ALA A 97 3.967 -0.682 -0.174 1.00 0.00 C ATOM 752 C ALA A 97 2.910 0.434 -0.257 1.00 0.00 C ATOM 753 O ALA A 97 1.737 0.205 0.037 1.00 0.00 O ATOM 754 CB ALA A 97 4.208 -1.270 -1.579 1.00 0.00 C ATOM 0 H ALA A 97 2.472 -1.784 0.755 1.00 0.00 H new ATOM 0 HA ALA A 97 4.880 -0.252 0.238 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.566 -0.485 -2.245 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.954 -2.063 -1.519 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.275 -1.678 -1.967 1.00 0.00 H new ATOM 760 N PHE A 98 3.316 1.612 -0.725 1.00 0.00 N ATOM 761 CA PHE A 98 2.459 2.702 -1.208 1.00 0.00 C ATOM 762 C PHE A 98 2.662 2.825 -2.724 1.00 0.00 C ATOM 763 O PHE A 98 3.775 2.604 -3.196 1.00 0.00 O ATOM 764 CB PHE A 98 2.873 4.058 -0.613 1.00 0.00 C ATOM 765 CG PHE A 98 2.514 4.400 0.824 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.226 3.408 1.783 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.494 5.757 1.220 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.958 3.767 3.108 1.00 0.00 C ATOM 769 CE2 PHE A 98 2.179 6.120 2.531 1.00 0.00 C ATOM 770 CZ PHE A 98 1.934 5.120 3.471 1.00 0.00 C ATOM 0 H PHE A 98 4.306 1.849 -0.782 1.00 0.00 H new ATOM 0 HA PHE A 98 1.432 2.473 -0.924 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.957 4.134 -0.703 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.445 4.834 -1.247 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.212 2.368 1.494 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.726 6.525 0.497 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.770 3.004 3.849 1.00 0.00 H new ATOM 0 HE2 PHE A 98 2.126 7.161 2.813 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.723 5.392 4.494 1.00 0.00 H new ATOM 780 N ILE A 99 1.663 3.292 -3.471 1.00 0.00 N ATOM 781 CA ILE A 99 1.770 3.711 -4.869 1.00 0.00 C ATOM 782 C ILE A 99 1.042 5.065 -5.019 1.00 0.00 C ATOM 783 O ILE A 99 -0.184 5.157 -4.923 1.00 0.00 O ATOM 784 CB ILE A 99 1.341 2.555 -5.805 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.521 2.964 -7.278 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.067 2.013 -5.508 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.185 1.854 -8.286 1.00 0.00 C ATOM 0 H ILE A 99 0.717 3.393 -3.104 1.00 0.00 H new ATOM 0 HA ILE A 99 2.795 3.906 -5.185 1.00 0.00 H new ATOM 0 HB ILE A 99 2.005 1.715 -5.602 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.890 3.829 -7.483 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.553 3.279 -7.432 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.300 1.206 -6.202 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.103 1.635 -4.486 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.797 2.814 -5.625 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.338 2.224 -9.300 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.834 0.996 -8.111 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.144 1.554 -8.163 1.00 0.00 H new ATOM 799 N GLU A 100 1.833 6.134 -5.118 1.00 0.00 N ATOM 800 CA GLU A 100 1.450 7.551 -5.160 1.00 0.00 C ATOM 801 C GLU A 100 1.407 8.057 -6.598 1.00 0.00 C ATOM 802 O GLU A 100 2.385 7.957 -7.344 1.00 0.00 O ATOM 803 CB GLU A 100 2.485 8.370 -4.382 1.00 0.00 C ATOM 804 CG GLU A 100 2.513 9.896 -4.643 1.00 0.00 C ATOM 805 CD GLU A 100 1.286 10.656 -4.119 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.781 10.313 -3.029 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.875 11.644 -4.770 1.00 0.00 O ATOM 0 H GLU A 100 2.845 6.024 -5.176 1.00 0.00 H new ATOM 0 HA GLU A 100 0.460 7.658 -4.717 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.312 8.211 -3.318 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.473 7.969 -4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.408 10.314 -4.181 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.599 10.066 -5.716 1.00 0.00 H new ATOM 814 N MET A 101 0.292 8.666 -6.983 1.00 0.00 N ATOM 815 CA MET A 101 0.093 9.069 -8.361 1.00 0.00 C ATOM 816 C MET A 101 -0.283 10.534 -8.583 1.00 0.00 C ATOM 817 O MET A 101 -0.731 11.245 -7.689 1.00 0.00 O ATOM 818 CB MET A 101 -0.765 7.969 -8.989 1.00 0.00 C ATOM 819 CG MET A 101 -1.593 8.285 -10.213 1.00 0.00 C ATOM 820 SD MET A 101 -2.627 6.862 -10.561 1.00 0.00 S ATOM 821 CE MET A 101 -1.417 5.827 -11.373 1.00 0.00 C ATOM 0 H MET A 101 -0.483 8.889 -6.359 1.00 0.00 H new ATOM 0 HA MET A 101 1.031 9.123 -8.914 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.102 7.143 -9.246 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.445 7.604 -8.219 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.206 9.169 -10.041 1.00 0.00 H new ATOM 0 HG3 MET A 101 -0.948 8.505 -11.064 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.924 5.016 -11.896 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.851 6.423 -12.089 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.737 5.410 -10.630 1.00 0.00 H new ATOM 831 N ASN A 102 -0.007 10.999 -9.802 1.00 0.00 N ATOM 832 CA ASN A 102 -0.103 12.386 -10.259 1.00 0.00 C ATOM 833 C ASN A 102 -1.475 13.032 -10.031 1.00 0.00 C ATOM 834 O ASN A 102 -1.563 14.232 -9.773 1.00 0.00 O ATOM 835 CB ASN A 102 0.256 12.381 -11.762 1.00 0.00 C ATOM 836 CG ASN A 102 -0.647 11.495 -12.631 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.993 10.381 -12.290 1.00 0.00 O ATOM 838 ND2 ASN A 102 -1.037 11.877 -13.815 1.00 0.00 N ATOM 0 H ASN A 102 0.310 10.376 -10.545 1.00 0.00 H new ATOM 0 HA ASN A 102 0.583 12.995 -9.671 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.209 13.403 -12.137 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.288 12.047 -11.875 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.598 11.252 -14.393 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.781 12.801 -14.163 1.00 0.00 H new ATOM 845 N THR A 103 -2.537 12.245 -10.200 1.00 0.00 N ATOM 846 CA THR A 103 -3.902 12.742 -10.396 1.00 0.00 C ATOM 847 C THR A 103 -4.908 11.859 -9.654 1.00 0.00 C ATOM 848 O THR A 103 -4.804 10.629 -9.638 1.00 0.00 O ATOM 849 CB THR A 103 -4.235 12.844 -11.901 1.00 0.00 C ATOM 850 OG1 THR A 103 -4.180 11.584 -12.521 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.276 13.757 -12.678 1.00 0.00 C ATOM 0 H THR A 103 -2.474 11.227 -10.205 1.00 0.00 H new ATOM 0 HA THR A 103 -3.971 13.745 -9.976 1.00 0.00 H new ATOM 0 HB THR A 103 -5.240 13.265 -11.932 1.00 0.00 H new ATOM 0 HG1 THR A 103 -4.396 11.678 -13.472 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.568 13.782 -13.728 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.318 14.765 -12.265 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.259 13.373 -12.594 1.00 0.00 H new ATOM 859 N GLU A 104 -5.884 12.502 -9.003 1.00 0.00 N ATOM 860 CA GLU A 104 -6.906 11.825 -8.193 1.00 0.00 C ATOM 861 C GLU A 104 -7.731 10.836 -9.019 1.00 0.00 C ATOM 862 O GLU A 104 -8.037 9.748 -8.541 1.00 0.00 O ATOM 863 CB GLU A 104 -7.834 12.854 -7.534 1.00 0.00 C ATOM 864 CG GLU A 104 -7.122 13.684 -6.458 1.00 0.00 C ATOM 865 CD GLU A 104 -8.085 14.710 -5.828 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.911 14.325 -4.966 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.031 15.908 -6.202 1.00 0.00 O ATOM 0 H GLU A 104 -5.989 13.516 -9.023 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.383 11.260 -7.422 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.232 13.521 -8.298 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.684 12.338 -7.087 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.730 13.024 -5.684 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.269 14.202 -6.897 1.00 0.00 H new ATOM 874 N GLU A 105 -8.066 11.172 -10.271 1.00 0.00 N ATOM 875 CA GLU A 105 -8.872 10.296 -11.124 1.00 0.00 C ATOM 876 C GLU A 105 -8.104 9.085 -11.657 1.00 0.00 C ATOM 877 O GLU A 105 -8.672 7.994 -11.694 1.00 0.00 O ATOM 878 CB GLU A 105 -9.478 11.069 -12.302 1.00 0.00 C ATOM 879 CG GLU A 105 -10.552 12.068 -11.848 1.00 0.00 C ATOM 880 CD GLU A 105 -11.216 12.751 -13.059 1.00 0.00 C ATOM 881 OE1 GLU A 105 -10.683 13.774 -13.556 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.281 12.273 -13.522 1.00 0.00 O ATOM 0 H GLU A 105 -7.789 12.048 -10.715 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.666 9.921 -10.479 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.687 11.603 -12.830 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.915 10.365 -13.010 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.308 11.551 -11.257 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.103 12.822 -11.202 1.00 0.00 H new ATOM 889 N ALA A 106 -6.822 9.231 -12.016 1.00 0.00 N ATOM 890 CA ALA A 106 -5.982 8.078 -12.321 1.00 0.00 C ATOM 891 C ALA A 106 -5.933 7.128 -11.133 1.00 0.00 C ATOM 892 O ALA A 106 -6.173 5.941 -11.304 1.00 0.00 O ATOM 893 CB ALA A 106 -4.571 8.505 -12.703 1.00 0.00 C ATOM 0 H ALA A 106 -6.351 10.132 -12.100 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.424 7.563 -13.174 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.971 7.622 -12.924 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.611 9.147 -13.583 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.120 9.052 -11.875 1.00 0.00 H new ATOM 899 N ALA A 107 -5.675 7.613 -9.920 1.00 0.00 N ATOM 900 CA ALA A 107 -5.585 6.722 -8.774 1.00 0.00 C ATOM 901 C ALA A 107 -6.942 6.149 -8.332 1.00 0.00 C ATOM 902 O ALA A 107 -7.027 4.973 -7.998 1.00 0.00 O ATOM 903 CB ALA A 107 -4.907 7.482 -7.665 1.00 0.00 C ATOM 0 H ALA A 107 -5.528 8.600 -9.711 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.002 5.844 -9.052 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -4.822 6.844 -6.786 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.912 7.788 -7.989 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.496 8.365 -7.416 1.00 0.00 H new ATOM 909 N ASN A 108 -8.026 6.926 -8.392 1.00 0.00 N ATOM 910 CA ASN A 108 -9.389 6.423 -8.218 1.00 0.00 C ATOM 911 C ASN A 108 -9.687 5.281 -9.203 1.00 0.00 C ATOM 912 O ASN A 108 -10.074 4.186 -8.789 1.00 0.00 O ATOM 913 CB ASN A 108 -10.376 7.588 -8.359 1.00 0.00 C ATOM 914 CG ASN A 108 -11.818 7.140 -8.199 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.499 6.798 -9.153 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.323 7.106 -6.989 1.00 0.00 N ATOM 0 H ASN A 108 -7.981 7.930 -8.564 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.499 6.000 -7.219 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.148 8.348 -7.611 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.248 8.054 -9.336 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.284 6.794 -6.846 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -11.755 7.391 -6.191 1.00 0.00 H new ATOM 923 N THR A 109 -9.424 5.484 -10.494 1.00 0.00 N ATOM 924 CA THR A 109 -9.538 4.399 -11.467 1.00 0.00 C ATOM 925 C THR A 109 -8.524 3.288 -11.188 1.00 0.00 C ATOM 926 O THR A 109 -8.834 2.141 -11.482 1.00 0.00 O ATOM 927 CB THR A 109 -9.475 4.909 -12.923 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.515 4.308 -13.664 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.175 4.624 -13.671 1.00 0.00 C ATOM 0 H THR A 109 -9.134 6.380 -10.887 1.00 0.00 H new ATOM 0 HA THR A 109 -10.528 3.960 -11.347 1.00 0.00 H new ATOM 0 HB THR A 109 -9.560 5.993 -12.840 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.484 4.627 -14.590 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.241 5.026 -14.682 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.343 5.095 -13.147 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.011 3.547 -13.718 1.00 0.00 H new ATOM 937 N MET A 110 -7.361 3.566 -10.577 1.00 0.00 N ATOM 938 CA MET A 110 -6.313 2.579 -10.326 1.00 0.00 C ATOM 939 C MET A 110 -6.749 1.608 -9.224 1.00 0.00 C ATOM 940 O MET A 110 -6.660 0.393 -9.382 1.00 0.00 O ATOM 941 CB MET A 110 -4.942 3.204 -9.968 1.00 0.00 C ATOM 942 CG MET A 110 -3.889 2.121 -10.251 1.00 0.00 C ATOM 943 SD MET A 110 -2.152 2.580 -10.073 1.00 0.00 S ATOM 944 CE MET A 110 -2.229 3.353 -8.459 1.00 0.00 C ATOM 0 H MET A 110 -7.124 4.499 -10.240 1.00 0.00 H new ATOM 0 HA MET A 110 -6.173 2.042 -11.264 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.753 4.096 -10.565 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.915 3.509 -8.922 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.084 1.280 -9.586 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.040 1.763 -11.270 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.219 3.576 -8.114 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.802 4.278 -8.525 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.712 2.676 -7.754 1.00 0.00 H new ATOM 954 N VAL A 111 -7.263 2.135 -8.113 1.00 0.00 N ATOM 955 CA VAL A 111 -7.792 1.335 -7.004 1.00 0.00 C ATOM 956 C VAL A 111 -9.004 0.515 -7.443 1.00 0.00 C ATOM 957 O VAL A 111 -9.119 -0.656 -7.091 1.00 0.00 O ATOM 958 CB VAL A 111 -8.090 2.233 -5.791 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.472 2.860 -5.737 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.895 1.449 -4.494 1.00 0.00 C ATOM 0 H VAL A 111 -7.325 3.141 -7.954 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.033 0.617 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.383 3.054 -5.906 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.560 3.469 -4.837 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.622 3.487 -6.616 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.227 2.074 -5.719 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.109 2.095 -3.643 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.572 0.595 -4.480 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.865 1.097 -4.433 1.00 0.00 H new ATOM 970 N ASN A 112 -9.888 1.106 -8.253 1.00 0.00 N ATOM 971 CA ASN A 112 -11.070 0.431 -8.792 1.00 0.00 C ATOM 972 C ASN A 112 -10.665 -0.674 -9.781 1.00 0.00 C ATOM 973 O ASN A 112 -11.092 -1.817 -9.626 1.00 0.00 O ATOM 974 CB ASN A 112 -12.013 1.475 -9.410 1.00 0.00 C ATOM 975 CG ASN A 112 -12.859 2.171 -8.351 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.051 1.933 -8.228 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.283 3.024 -7.533 1.00 0.00 N ATOM 0 H ASN A 112 -9.801 2.076 -8.555 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.612 -0.069 -7.989 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.428 2.217 -9.953 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.666 0.990 -10.136 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.831 3.481 -6.804 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.288 3.229 -7.628 1.00 0.00 H new ATOM 984 N TYR A 113 -9.757 -0.375 -10.716 1.00 0.00 N ATOM 985 CA TYR A 113 -9.063 -1.335 -11.579 1.00 0.00 C ATOM 986 C TYR A 113 -8.482 -2.518 -10.795 1.00 0.00 C ATOM 987 O TYR A 113 -8.653 -3.660 -11.205 1.00 0.00 O ATOM 988 CB TYR A 113 -7.962 -0.602 -12.365 1.00 0.00 C ATOM 989 CG TYR A 113 -6.931 -1.505 -13.001 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.237 -2.139 -14.217 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.682 -1.712 -12.378 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.312 -3.030 -14.801 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.771 -2.624 -12.948 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.078 -3.279 -14.162 1.00 0.00 C ATOM 995 OH TYR A 113 -4.173 -4.117 -14.737 1.00 0.00 O ATOM 0 H TYR A 113 -9.473 0.587 -10.900 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.792 -1.758 -12.271 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.430 -0.002 -13.145 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.454 0.089 -11.693 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.181 -1.944 -14.705 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.427 -1.178 -11.475 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.547 -3.520 -15.734 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.832 -2.824 -12.454 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.377 -4.178 -14.169 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.879 -2.301 -9.627 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.248 -3.355 -8.844 1.00 0.00 C ATOM 1007 C TYR A 114 -8.233 -4.083 -7.942 1.00 0.00 C ATOM 1008 O TYR A 114 -7.988 -5.217 -7.527 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.106 -2.776 -8.025 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.839 -2.481 -8.795 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.265 -3.451 -9.647 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.170 -1.272 -8.530 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -2.954 -3.225 -10.128 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.872 -1.056 -9.009 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.252 -2.047 -9.790 1.00 0.00 C ATOM 1016 OH TYR A 114 -0.976 -1.861 -10.209 1.00 0.00 O ATOM 0 H TYR A 114 -7.816 -1.379 -9.196 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.859 -4.093 -9.545 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.449 -1.854 -7.556 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.868 -3.473 -7.221 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.812 -4.340 -9.923 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.662 -0.504 -7.952 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.484 -3.963 -10.762 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.352 -0.137 -8.781 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.648 -0.996 -9.886 1.00 0.00 H new ATOM 1026 N THR A 115 -9.385 -3.458 -7.714 1.00 0.00 N ATOM 1027 CA THR A 115 -10.531 -4.073 -7.060 1.00 0.00 C ATOM 1028 C THR A 115 -11.284 -4.987 -8.052 1.00 0.00 C ATOM 1029 O THR A 115 -12.038 -5.881 -7.664 1.00 0.00 O ATOM 1030 CB THR A 115 -11.405 -2.986 -6.401 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.649 -2.351 -5.390 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.661 -3.512 -5.713 1.00 0.00 C ATOM 0 H THR A 115 -9.549 -2.489 -7.986 1.00 0.00 H new ATOM 0 HA THR A 115 -10.206 -4.726 -6.250 1.00 0.00 H new ATOM 0 HB THR A 115 -11.711 -2.327 -7.213 1.00 0.00 H new ATOM 0 HG1 THR A 115 -10.025 -1.716 -5.799 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.214 -2.679 -5.278 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.289 -4.023 -6.443 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.379 -4.211 -4.925 1.00 0.00 H new ATOM 1040 N SER A 116 -11.007 -4.802 -9.347 1.00 0.00 N ATOM 1041 CA SER A 116 -11.503 -5.539 -10.514 1.00 0.00 C ATOM 1042 C SER A 116 -10.596 -6.715 -10.905 1.00 0.00 C ATOM 1043 O SER A 116 -11.044 -7.857 -11.033 1.00 0.00 O ATOM 1044 CB SER A 116 -11.534 -4.554 -11.696 1.00 0.00 C ATOM 1045 OG SER A 116 -12.802 -4.549 -12.336 1.00 0.00 O ATOM 0 H SER A 116 -10.368 -4.060 -9.632 1.00 0.00 H new ATOM 0 HA SER A 116 -12.484 -5.946 -10.269 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.301 -3.550 -11.341 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.762 -4.825 -12.417 1.00 0.00 H new ATOM 0 HG SER A 116 -12.790 -3.912 -13.081 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.323 -6.404 -11.175 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.423 -7.171 -12.052 1.00 0.00 C ATOM 1053 C VAL A 117 -7.874 -8.451 -11.404 1.00 0.00 C ATOM 1054 O VAL A 117 -7.757 -9.481 -12.062 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.264 -6.251 -12.522 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.246 -5.946 -11.454 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.569 -6.814 -13.759 1.00 0.00 C ATOM 0 H VAL A 117 -8.872 -5.581 -10.775 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.012 -7.506 -12.906 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.743 -5.305 -12.773 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.471 -5.298 -11.864 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.734 -5.444 -10.619 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.795 -6.875 -11.105 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.763 -6.144 -14.060 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.157 -7.797 -13.529 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.289 -6.903 -14.572 1.00 0.00 H new ATOM 1067 N THR A 118 -7.520 -8.332 -10.120 1.00 0.00 N ATOM 1068 CA THR A 118 -6.285 -8.797 -9.446 1.00 0.00 C ATOM 1069 C THR A 118 -5.140 -9.270 -10.371 1.00 0.00 C ATOM 1070 O THR A 118 -5.288 -10.280 -11.055 1.00 0.00 O ATOM 1071 CB THR A 118 -6.518 -9.825 -8.322 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.836 -9.800 -7.803 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.580 -9.456 -7.171 1.00 0.00 C ATOM 0 H THR A 118 -8.142 -7.867 -9.459 1.00 0.00 H new ATOM 0 HA THR A 118 -5.941 -7.869 -8.990 1.00 0.00 H new ATOM 0 HB THR A 118 -6.340 -10.816 -8.739 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.922 -10.474 -7.096 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.714 -10.162 -6.352 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.547 -9.494 -7.517 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.810 -8.449 -6.823 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.982 -8.574 -10.428 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.976 -8.758 -11.486 1.00 0.00 C ATOM 1083 C PRO A 119 -2.147 -10.044 -11.310 1.00 0.00 C ATOM 1084 O PRO A 119 -1.553 -10.537 -12.269 1.00 0.00 O ATOM 1085 CB PRO A 119 -2.063 -7.515 -11.417 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.698 -6.615 -10.359 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.430 -7.615 -9.485 1.00 0.00 C ATOM 0 HA PRO A 119 -3.467 -8.863 -12.453 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -1.044 -7.789 -11.142 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.009 -7.011 -12.382 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.949 -6.055 -9.798 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -3.377 -5.885 -10.800 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -2.754 -8.096 -8.778 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.214 -7.134 -8.900 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.146 -10.586 -10.082 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.448 -11.773 -9.561 1.00 0.00 C ATOM 1097 C VAL A 120 0.077 -11.661 -9.653 1.00 0.00 C ATOM 1098 O VAL A 120 0.668 -11.668 -10.733 1.00 0.00 O ATOM 1099 CB VAL A 120 -1.998 -13.070 -10.175 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.521 -14.298 -9.401 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.526 -13.083 -10.102 1.00 0.00 C ATOM 0 H VAL A 120 -2.700 -10.152 -9.344 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.663 -11.819 -8.493 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.643 -13.104 -11.205 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -1.928 -15.199 -9.861 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.432 -14.340 -9.421 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -1.863 -14.232 -8.368 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -3.903 -14.007 -10.540 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -3.841 -13.020 -9.060 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -3.924 -12.231 -10.653 1.00 0.00 H new ATOM 1111 N LEU A 121 0.725 -11.528 -8.494 1.00 0.00 N ATOM 1112 CA LEU A 121 2.164 -11.330 -8.339 1.00 0.00 C ATOM 1113 C LEU A 121 2.898 -12.655 -8.601 1.00 0.00 C ATOM 1114 O LEU A 121 3.201 -13.413 -7.681 1.00 0.00 O ATOM 1115 CB LEU A 121 2.417 -10.702 -6.953 1.00 0.00 C ATOM 1116 CG LEU A 121 3.719 -9.891 -6.856 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.643 -8.971 -5.636 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.950 -10.785 -6.763 1.00 0.00 C ATOM 0 H LEU A 121 0.237 -11.557 -7.599 1.00 0.00 H new ATOM 0 HA LEU A 121 2.569 -10.633 -9.073 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.578 -10.052 -6.702 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.440 -11.495 -6.206 1.00 0.00 H new ATOM 0 HG LEU A 121 3.821 -9.303 -7.768 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.563 -8.392 -5.559 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.796 -8.294 -5.743 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.516 -9.571 -4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.845 -10.166 -6.696 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.877 -11.414 -5.876 1.00 0.00 H new ATOM 0 HD23 LEU A 121 5.010 -11.415 -7.650 1.00 0.00 H new ATOM 1130 N ARG A 122 3.072 -12.963 -9.892 1.00 0.00 N ATOM 1131 CA ARG A 122 3.519 -14.199 -10.581 1.00 0.00 C ATOM 1132 C ARG A 122 2.907 -15.551 -10.159 1.00 0.00 C ATOM 1133 O ARG A 122 3.057 -16.527 -10.893 1.00 0.00 O ATOM 1134 CB ARG A 122 5.056 -14.236 -10.723 1.00 0.00 C ATOM 1135 CG ARG A 122 5.903 -14.295 -9.440 1.00 0.00 C ATOM 1136 CD ARG A 122 5.660 -15.538 -8.573 1.00 0.00 C ATOM 1137 NE ARG A 122 6.744 -15.717 -7.587 1.00 0.00 N ATOM 1138 CZ ARG A 122 6.839 -16.656 -6.664 1.00 0.00 C ATOM 1139 NH1 ARG A 122 5.937 -17.586 -6.526 1.00 0.00 N ATOM 1140 NH2 ARG A 122 7.857 -16.682 -5.852 1.00 0.00 N ATOM 0 H ARG A 122 2.874 -12.245 -10.589 1.00 0.00 H new ATOM 0 HA ARG A 122 3.065 -14.096 -11.567 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.313 -15.103 -11.332 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.360 -13.351 -11.282 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.957 -14.259 -9.714 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.698 -13.406 -8.844 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.705 -15.444 -8.056 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.592 -16.421 -9.208 1.00 0.00 H new ATOM 0 HE ARG A 122 7.505 -15.039 -7.623 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.125 -17.604 -7.143 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.043 -18.296 -5.801 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.587 -15.974 -5.927 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.924 -17.410 -5.141 1.00 0.00 H new ATOM 1154 N GLY A 123 2.203 -15.624 -9.029 1.00 0.00 N ATOM 1155 CA GLY A 123 1.581 -16.850 -8.507 1.00 0.00 C ATOM 1156 C GLY A 123 0.693 -16.692 -7.261 1.00 0.00 C ATOM 1157 O GLY A 123 0.207 -17.703 -6.750 1.00 0.00 O ATOM 0 H GLY A 123 2.043 -14.812 -8.432 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.979 -17.292 -9.301 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.373 -17.562 -8.274 1.00 0.00 H new ATOM 1161 N GLN A 124 0.472 -15.468 -6.757 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.296 -15.160 -5.549 1.00 0.00 C ATOM 1163 C GLN A 124 -1.160 -13.902 -5.794 1.00 0.00 C ATOM 1164 O GLN A 124 -0.682 -12.967 -6.447 1.00 0.00 O ATOM 1165 CB GLN A 124 0.713 -14.924 -4.417 1.00 0.00 C ATOM 1166 CG GLN A 124 0.127 -14.647 -3.032 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.327 -15.909 -2.297 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -1.072 -16.739 -2.804 1.00 0.00 O ATOM 1169 NE2 GLN A 124 0.094 -16.113 -1.069 1.00 0.00 N ATOM 0 H GLN A 124 0.843 -14.630 -7.204 1.00 0.00 H new ATOM 0 HA GLN A 124 -0.968 -15.976 -5.284 1.00 0.00 H new ATOM 0 HB2 GLN A 124 1.358 -15.800 -4.346 1.00 0.00 H new ATOM 0 HB3 GLN A 124 1.347 -14.082 -4.694 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.874 -14.133 -2.427 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.722 -13.971 -3.134 1.00 0.00 H new ATOM 0 HE21 GLN A 124 0.715 -15.437 -0.624 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -0.200 -16.947 -0.561 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.412 -13.844 -5.300 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.264 -12.655 -5.386 1.00 0.00 C ATOM 1180 C PRO A 125 -2.640 -11.410 -4.733 1.00 0.00 C ATOM 1181 O PRO A 125 -1.697 -11.504 -3.944 1.00 0.00 O ATOM 1182 CB PRO A 125 -4.583 -13.043 -4.697 1.00 0.00 C ATOM 1183 CG PRO A 125 -4.599 -14.568 -4.740 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.118 -14.919 -4.626 1.00 0.00 C ATOM 0 HA PRO A 125 -3.409 -12.370 -6.428 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -4.619 -12.674 -3.672 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.443 -12.622 -5.218 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.180 -14.991 -3.920 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.035 -14.943 -5.666 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -2.812 -14.996 -3.583 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -2.906 -15.881 -5.092 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.191 -10.231 -5.036 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.664 -8.928 -4.598 1.00 0.00 C ATOM 1194 C ILE A 126 -3.758 -8.100 -3.923 1.00 0.00 C ATOM 1195 O ILE A 126 -4.950 -8.231 -4.207 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.969 -8.131 -5.730 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.402 -9.065 -6.816 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.867 -7.245 -5.107 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.466 -8.383 -7.795 1.00 0.00 C ATOM 0 H ILE A 126 -4.034 -10.150 -5.605 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.885 -9.141 -3.866 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.702 -7.496 -6.227 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.870 -9.885 -6.333 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.231 -9.505 -7.370 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.369 -6.678 -5.893 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.315 -6.556 -4.391 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.138 -7.875 -4.597 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.112 -9.110 -8.526 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -0.997 -7.582 -8.308 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.385 -7.967 -7.255 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.331 -7.301 -2.953 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.146 -6.849 -1.834 1.00 0.00 C ATOM 1213 C TYR A 127 -4.090 -5.326 -1.731 1.00 0.00 C ATOM 1214 O TYR A 127 -3.088 -4.798 -1.250 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.582 -7.458 -0.545 1.00 0.00 C ATOM 1216 CG TYR A 127 -3.844 -8.911 -0.216 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -3.688 -9.966 -1.141 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.154 -9.202 1.126 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -3.963 -11.289 -0.739 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.418 -10.516 1.531 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.341 -11.568 0.593 1.00 0.00 C ATOM 1222 OH TYR A 127 -4.565 -12.846 1.003 1.00 0.00 O ATOM 0 H TYR A 127 -2.378 -6.939 -2.923 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.180 -7.159 -1.984 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.501 -7.321 -0.568 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -3.961 -6.864 0.287 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.360 -9.761 -2.149 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.189 -8.403 1.851 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -3.884 -12.094 -1.454 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.680 -10.724 2.558 1.00 0.00 H new ATOM 0 HH TYR A 127 -4.815 -12.847 1.951 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.121 -4.612 -2.186 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.114 -3.150 -2.257 1.00 0.00 C ATOM 1234 C ILE A 128 -6.229 -2.472 -1.443 1.00 0.00 C ATOM 1235 O ILE A 128 -7.336 -2.995 -1.311 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.090 -2.736 -3.754 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.778 -1.975 -3.988 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.336 -1.949 -4.212 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.541 -1.569 -5.438 1.00 0.00 C ATOM 0 H ILE A 128 -5.989 -5.034 -2.517 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.211 -2.782 -1.769 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.129 -3.630 -4.376 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.775 -1.080 -3.367 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.946 -2.596 -3.656 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.240 -1.698 -5.268 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.227 -2.559 -4.063 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.422 -1.033 -3.628 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.593 -1.036 -5.516 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.510 -2.460 -6.065 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.351 -0.920 -5.771 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.936 -1.259 -0.967 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.897 -0.191 -0.638 1.00 0.00 C ATOM 1253 C GLN A 129 -6.209 1.168 -0.779 1.00 0.00 C ATOM 1254 O GLN A 129 -4.985 1.256 -0.733 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.420 -0.346 0.807 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.863 -0.868 0.864 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.205 -1.507 2.212 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -8.480 -2.345 2.740 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.333 -1.178 2.806 1.00 0.00 N ATOM 0 H GLN A 129 -4.972 -0.976 -0.790 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.741 -0.261 -1.324 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.769 -1.029 1.353 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.367 0.618 1.313 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.551 -0.045 0.671 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.012 -1.600 0.071 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.949 -0.484 2.383 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.591 -1.617 3.690 1.00 0.00 H new ATOM 1268 N PHE A 130 -6.982 2.250 -0.885 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.455 3.605 -0.701 1.00 0.00 C ATOM 1270 C PHE A 130 -5.703 3.764 0.644 1.00 0.00 C ATOM 1271 O PHE A 130 -5.995 3.087 1.637 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.597 4.616 -0.801 1.00 0.00 C ATOM 1273 CG PHE A 130 -7.836 5.238 -2.165 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -6.834 6.020 -2.764 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.107 5.163 -2.762 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.086 6.709 -3.963 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.366 5.872 -3.948 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.359 6.642 -4.553 1.00 0.00 C ATOM 0 H PHE A 130 -7.979 2.215 -1.098 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.729 3.793 -1.492 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.517 4.124 -0.485 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.405 5.419 -0.089 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -5.862 6.092 -2.299 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -9.882 4.562 -2.310 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.303 7.288 -4.429 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.347 5.824 -4.397 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.562 7.180 -5.467 1.00 0.00 H new ATOM 1288 N SER A 131 -4.726 4.674 0.676 1.00 0.00 N ATOM 1289 CA SER A 131 -3.910 4.955 1.859 1.00 0.00 C ATOM 1290 C SER A 131 -4.722 5.618 2.983 1.00 0.00 C ATOM 1291 O SER A 131 -5.693 6.337 2.731 1.00 0.00 O ATOM 1292 CB SER A 131 -2.714 5.829 1.461 1.00 0.00 C ATOM 1293 OG SER A 131 -1.930 6.239 2.563 1.00 0.00 O ATOM 0 H SER A 131 -4.476 5.245 -0.132 1.00 0.00 H new ATOM 0 HA SER A 131 -3.551 4.005 2.254 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.086 5.276 0.762 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.077 6.711 0.934 1.00 0.00 H new ATOM 0 HG SER A 131 -1.102 6.652 2.240 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.275 5.441 4.231 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.713 6.231 5.387 1.00 0.00 C ATOM 1301 C ASN A 132 -4.326 7.726 5.275 1.00 0.00 C ATOM 1302 O ASN A 132 -4.879 8.564 5.995 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.096 5.639 6.667 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.521 4.211 6.972 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.677 3.825 6.879 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.598 3.388 7.405 1.00 0.00 N ATOM 0 H ASN A 132 -3.584 4.730 4.471 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.801 6.182 5.420 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.010 5.670 6.579 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.366 6.273 7.512 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -3.846 2.433 7.662 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.631 3.703 7.485 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.389 8.065 4.384 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.813 9.393 4.156 1.00 0.00 C ATOM 1315 C HIS A 133 -3.246 9.988 2.799 1.00 0.00 C ATOM 1316 O HIS A 133 -3.994 9.373 2.031 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.275 9.290 4.212 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.727 8.487 5.369 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.670 8.879 6.689 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.192 7.230 5.285 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.095 7.883 7.388 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.217 6.864 6.569 1.00 0.00 N ATOM 0 H HIS A 133 -2.985 7.368 3.759 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.180 10.060 4.936 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.922 8.845 3.282 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.861 10.297 4.261 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.103 6.631 4.390 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.089 7.900 8.452 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.668 5.988 6.835 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.714 11.174 2.481 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.620 11.734 1.125 1.00 0.00 C ATOM 1332 C LYS A 134 -1.227 12.321 0.869 1.00 0.00 C ATOM 1333 O LYS A 134 -0.559 12.755 1.808 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.749 12.759 0.891 1.00 0.00 C ATOM 1335 CG LYS A 134 -3.731 13.961 1.851 1.00 0.00 C ATOM 1336 CD LYS A 134 -4.884 14.925 1.546 1.00 0.00 C ATOM 1337 CE LYS A 134 -4.835 16.124 2.503 1.00 0.00 C ATOM 1338 NZ LYS A 134 -5.921 17.095 2.215 1.00 0.00 N ATOM 0 H LYS A 134 -2.321 11.795 3.188 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.756 10.933 0.399 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.681 13.127 -0.133 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.709 12.251 0.984 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.808 13.610 2.880 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.780 14.487 1.764 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -4.817 15.270 0.514 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.838 14.407 1.647 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -4.922 15.774 3.532 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -3.869 16.621 2.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -5.859 17.893 2.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -5.823 17.447 1.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -6.843 16.626 2.322 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.837 12.350 -0.402 1.00 0.00 N ATOM 1353 CA GLU A 135 0.443 12.827 -0.954 1.00 0.00 C ATOM 1354 C GLU A 135 1.703 12.341 -0.209 1.00 0.00 C ATOM 1355 O GLU A 135 2.179 12.951 0.747 1.00 0.00 O ATOM 1356 CB GLU A 135 0.422 14.343 -1.153 1.00 0.00 C ATOM 1357 CG GLU A 135 1.605 14.821 -2.009 1.00 0.00 C ATOM 1358 CD GLU A 135 1.384 16.256 -2.513 1.00 0.00 C ATOM 1359 OE1 GLU A 135 1.707 17.220 -1.779 1.00 0.00 O ATOM 1360 OE2 GLU A 135 0.898 16.415 -3.664 1.00 0.00 O ATOM 0 H GLU A 135 -1.455 12.014 -1.141 1.00 0.00 H new ATOM 0 HA GLU A 135 0.531 12.353 -1.932 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.514 14.634 -1.630 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.452 14.838 -0.182 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.523 14.776 -1.423 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.737 14.151 -2.859 1.00 0.00 H new ATOM 1367 N LEU A 136 2.262 11.239 -0.699 1.00 0.00 N ATOM 1368 CA LEU A 136 3.529 10.620 -0.286 1.00 0.00 C ATOM 1369 C LEU A 136 4.721 11.599 -0.382 1.00 0.00 C ATOM 1370 O LEU A 136 5.277 11.827 -1.460 1.00 0.00 O ATOM 1371 CB LEU A 136 3.714 9.348 -1.137 1.00 0.00 C ATOM 1372 CG LEU A 136 5.060 8.604 -1.067 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.449 8.255 0.358 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.983 7.303 -1.865 1.00 0.00 C ATOM 0 H LEU A 136 1.814 10.713 -1.449 1.00 0.00 H new ATOM 0 HA LEU A 136 3.495 10.349 0.769 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.931 8.644 -0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.539 9.618 -2.178 1.00 0.00 H new ATOM 0 HG LEU A 136 5.811 9.276 -1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.405 7.731 0.356 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.537 9.169 0.945 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.685 7.614 0.797 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.940 6.785 -1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.201 6.667 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.753 7.528 -2.906 1.00 0.00 H new ATOM 1386 N LYS A 137 5.123 12.169 0.756 1.00 0.00 N ATOM 1387 CA LYS A 137 6.311 13.013 0.947 1.00 0.00 C ATOM 1388 C LYS A 137 7.550 12.122 1.118 1.00 0.00 C ATOM 1389 O LYS A 137 7.834 11.631 2.211 1.00 0.00 O ATOM 1390 CB LYS A 137 6.112 13.963 2.154 1.00 0.00 C ATOM 1391 CG LYS A 137 4.774 14.733 2.198 1.00 0.00 C ATOM 1392 CD LYS A 137 4.381 15.550 0.950 1.00 0.00 C ATOM 1393 CE LYS A 137 4.967 16.970 0.892 1.00 0.00 C ATOM 1394 NZ LYS A 137 6.419 16.993 0.581 1.00 0.00 N ATOM 0 H LYS A 137 4.598 12.048 1.622 1.00 0.00 H new ATOM 0 HA LYS A 137 6.461 13.639 0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.202 13.378 3.069 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.926 14.688 2.158 1.00 0.00 H new ATOM 0 HG2 LYS A 137 3.978 14.014 2.394 1.00 0.00 H new ATOM 0 HG3 LYS A 137 4.805 15.413 3.049 1.00 0.00 H new ATOM 0 HD2 LYS A 137 4.701 15.005 0.062 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.294 15.620 0.907 1.00 0.00 H new ATOM 0 HE2 LYS A 137 4.432 17.546 0.137 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.799 17.464 1.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 6.697 17.952 0.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 6.959 16.717 1.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.619 16.326 -0.191 1.00 0.00 H new