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 62 HIS : no HE2:sc= -0.114 K(o=-0.34,f=-2.3) USER MOD Set 1.2: A 96 GLN : amide:sc= -0.223 X(o=-0.34,f=-0.29) USER MOD Single : A 58 SER OG : rot 28:sc= 0.061 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 90:sc= 1.2 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.421 K(o=0.42,f=-2.3!) USER MOD Single : A 90 MET CE :methyl 164:sc= -0.132 (180deg=-0.415) 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= 1.16 K(o=1.2,f=-0.0078) USER MOD Single : A 101 MET CE :methyl 166:sc= -4.24! (180deg=-5.23!) USER MOD Single : A 102 ASN : amide:sc= -6.36! C(o=-6.4!,f=-5!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.409 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 179:sc= -1.31 (180deg=-1.31) USER MOD Single : A 112 ASN : amide:sc= 0.0978 X(o=0.098,f=-0.0088) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.109 USER MOD Single : A 115 THR OG1 : rot 78:sc= 0.77 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 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 131 SER OG : rot 180:sc= 0.283 USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 133 HIS : no HD1:sc= -0.104 X(o=-0.1,f=0.0034) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -7.552 9.745 -1.163 1.00 0.00 N ATOM 114 CA SER A 58 -6.570 10.585 -1.883 1.00 0.00 C ATOM 115 C SER A 58 -5.586 9.795 -2.773 1.00 0.00 C ATOM 116 O SER A 58 -5.614 8.569 -2.836 1.00 0.00 O ATOM 117 CB SER A 58 -5.795 11.446 -0.872 1.00 0.00 C ATOM 118 OG SER A 58 -6.680 12.279 -0.138 1.00 0.00 O ATOM 0 HA SER A 58 -7.145 11.210 -2.566 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.242 10.803 -0.188 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.062 12.059 -1.396 1.00 0.00 H new ATOM 0 HG SER A 58 -7.561 11.852 -0.083 1.00 0.00 H new ATOM 124 N ARG A 59 -4.708 10.522 -3.477 1.00 0.00 N ATOM 125 CA ARG A 59 -3.778 10.108 -4.555 1.00 0.00 C ATOM 126 C ARG A 59 -2.768 8.973 -4.287 1.00 0.00 C ATOM 127 O ARG A 59 -2.123 8.526 -5.240 1.00 0.00 O ATOM 128 CB ARG A 59 -3.013 11.367 -4.996 1.00 0.00 C ATOM 129 CG ARG A 59 -3.776 12.183 -6.054 1.00 0.00 C ATOM 130 CD ARG A 59 -3.216 13.604 -6.151 1.00 0.00 C ATOM 131 NE ARG A 59 -1.754 13.576 -6.318 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.876 14.465 -5.894 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.195 15.661 -5.494 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.376 14.158 -5.808 1.00 0.00 N ATOM 0 H ARG A 59 -4.616 11.521 -3.292 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.424 9.662 -5.311 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.823 11.995 -4.126 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.042 11.076 -5.398 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.701 11.691 -7.024 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.835 12.221 -5.797 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.673 14.124 -6.993 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.474 14.164 -5.252 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.374 12.774 -6.821 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.171 15.956 -5.497 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.469 16.303 -5.177 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.691 13.224 -6.069 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.049 14.850 -5.479 1.00 0.00 H new ATOM 148 N VAL A 60 -2.638 8.479 -3.053 1.00 0.00 N ATOM 149 CA VAL A 60 -1.867 7.261 -2.738 1.00 0.00 C ATOM 150 C VAL A 60 -2.782 6.069 -2.430 1.00 0.00 C ATOM 151 O VAL A 60 -3.748 6.176 -1.679 1.00 0.00 O ATOM 152 CB VAL A 60 -0.752 7.496 -1.706 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.078 8.233 -0.405 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.015 6.201 -1.411 1.00 0.00 C ATOM 0 H VAL A 60 -3.066 8.912 -2.235 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.326 6.984 -3.643 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.124 8.222 -2.223 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.178 8.310 0.205 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.447 9.232 -0.636 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.842 7.682 0.144 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.770 6.388 -0.679 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.715 5.466 -1.013 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.429 5.818 -2.330 1.00 0.00 H new ATOM 164 N ILE A 61 -2.459 4.913 -3.008 1.00 0.00 N ATOM 165 CA ILE A 61 -3.007 3.586 -2.677 1.00 0.00 C ATOM 166 C ILE A 61 -1.946 2.799 -1.914 1.00 0.00 C ATOM 167 O ILE A 61 -0.757 2.984 -2.150 1.00 0.00 O ATOM 168 CB ILE A 61 -3.424 2.873 -3.981 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.673 3.563 -4.571 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.700 1.359 -3.872 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.600 3.534 -6.089 1.00 0.00 C ATOM 0 H ILE A 61 -1.772 4.868 -3.761 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.891 3.672 -2.046 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.552 2.961 -4.629 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.576 3.057 -4.230 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.733 4.593 -4.219 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.984 0.970 -4.850 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.801 0.849 -3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.510 1.187 -3.164 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.482 4.021 -6.505 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.705 4.060 -6.420 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.561 2.500 -6.432 1.00 0.00 H new ATOM 183 N HIS A 62 -2.364 1.898 -1.031 1.00 0.00 N ATOM 184 CA HIS A 62 -1.504 0.960 -0.320 1.00 0.00 C ATOM 185 C HIS A 62 -1.809 -0.484 -0.749 1.00 0.00 C ATOM 186 O HIS A 62 -2.956 -0.869 -1.001 1.00 0.00 O ATOM 187 CB HIS A 62 -1.638 1.208 1.190 1.00 0.00 C ATOM 188 CG HIS A 62 -1.178 0.074 2.083 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.809 -1.140 2.264 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.146 0.126 2.982 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.149 -1.811 3.224 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.110 -1.088 3.676 1.00 0.00 N ATOM 0 H HIS A 62 -3.348 1.798 -0.782 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.457 1.121 -0.578 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.068 2.102 1.445 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.683 1.422 1.414 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.631 -1.470 1.759 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.524 0.960 3.130 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.416 -2.794 3.582 1.00 0.00 H new ATOM 200 N ILE A 63 -0.753 -1.292 -0.814 1.00 0.00 N ATOM 201 CA ILE A 63 -0.746 -2.678 -1.280 1.00 0.00 C ATOM 202 C ILE A 63 -0.296 -3.576 -0.121 1.00 0.00 C ATOM 203 O ILE A 63 0.572 -3.190 0.661 1.00 0.00 O ATOM 204 CB ILE A 63 0.174 -2.840 -2.523 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.076 -1.658 -3.530 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.154 -4.168 -3.227 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.027 -1.750 -4.731 1.00 0.00 C ATOM 0 H ILE A 63 0.174 -0.979 -0.526 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.748 -2.972 -1.593 1.00 0.00 H new ATOM 0 HB ILE A 63 1.202 -2.841 -2.161 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.948 -1.599 -3.900 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.276 -0.729 -2.997 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.489 -4.286 -4.099 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.014 -4.996 -2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.197 -4.164 -3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.885 -0.882 -5.375 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.058 -1.775 -4.378 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.815 -2.659 -5.294 1.00 0.00 H new ATOM 219 N ARG A 64 -0.856 -4.786 -0.027 1.00 0.00 N ATOM 220 CA ARG A 64 -0.441 -5.910 0.838 1.00 0.00 C ATOM 221 C ARG A 64 -0.329 -7.189 0.002 1.00 0.00 C ATOM 222 O ARG A 64 -0.813 -7.244 -1.131 1.00 0.00 O ATOM 223 CB ARG A 64 -1.358 -6.086 2.086 1.00 0.00 C ATOM 224 CG ARG A 64 -2.646 -5.238 2.103 1.00 0.00 C ATOM 225 CD ARG A 64 -3.562 -5.489 3.312 1.00 0.00 C ATOM 226 NE ARG A 64 -4.973 -5.224 2.959 1.00 0.00 N ATOM 227 CZ ARG A 64 -6.046 -5.920 3.294 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.036 -6.862 4.193 1.00 0.00 N ATOM 229 NH2 ARG A 64 -7.181 -5.680 2.706 1.00 0.00 N ATOM 0 H ARG A 64 -1.670 -5.030 -0.591 1.00 0.00 H new ATOM 0 HA ARG A 64 0.543 -5.679 1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.637 -7.137 2.162 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.777 -5.846 2.976 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.371 -4.183 2.085 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.208 -5.437 1.191 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.453 -6.520 3.650 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.262 -4.848 4.141 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.140 -4.399 2.383 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.170 -7.095 4.678 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.895 -7.367 4.412 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.241 -4.957 1.989 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.011 -6.215 2.962 1.00 0.00 H new ATOM 243 N LYS A 65 0.272 -8.244 0.567 1.00 0.00 N ATOM 244 CA LYS A 65 0.446 -9.567 -0.081 1.00 0.00 C ATOM 245 C LYS A 65 1.259 -9.501 -1.390 1.00 0.00 C ATOM 246 O LYS A 65 1.102 -10.339 -2.277 1.00 0.00 O ATOM 247 CB LYS A 65 -0.919 -10.277 -0.253 1.00 0.00 C ATOM 248 CG LYS A 65 -1.895 -10.109 0.920 1.00 0.00 C ATOM 249 CD LYS A 65 -1.419 -10.595 2.295 1.00 0.00 C ATOM 250 CE LYS A 65 -2.060 -11.932 2.708 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.667 -13.058 1.816 1.00 0.00 N ATOM 0 H LYS A 65 0.662 -8.209 1.509 1.00 0.00 H new ATOM 0 HA LYS A 65 1.051 -10.177 0.590 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.395 -9.900 -1.158 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.740 -11.341 -0.407 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.147 -9.052 1.003 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.816 -10.638 0.673 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.335 -10.706 2.281 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.653 -9.838 3.044 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.771 -12.168 3.732 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.145 -11.828 2.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.126 -13.933 2.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.965 -12.850 0.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.634 -13.178 1.843 1.00 0.00 H new ATOM 265 N LEU A 66 2.150 -8.512 -1.492 1.00 0.00 N ATOM 266 CA LEU A 66 3.244 -8.458 -2.475 1.00 0.00 C ATOM 267 C LEU A 66 4.270 -9.575 -2.178 1.00 0.00 C ATOM 268 O LEU A 66 4.169 -10.255 -1.152 1.00 0.00 O ATOM 269 CB LEU A 66 3.927 -7.067 -2.385 1.00 0.00 C ATOM 270 CG LEU A 66 3.160 -5.889 -2.996 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.021 -4.636 -2.908 1.00 0.00 C ATOM 272 CD2 LEU A 66 2.936 -6.076 -4.488 1.00 0.00 C ATOM 0 H LEU A 66 2.133 -7.700 -0.875 1.00 0.00 H new ATOM 0 HA LEU A 66 2.849 -8.608 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.113 -6.845 -1.334 1.00 0.00 H new ATOM 0 HB3 LEU A 66 4.899 -7.132 -2.874 1.00 0.00 H new ATOM 0 HG LEU A 66 2.216 -5.818 -2.456 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.482 -3.793 -3.341 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.248 -4.423 -1.863 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.950 -4.793 -3.457 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.389 -5.220 -4.884 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.899 -6.157 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.359 -6.985 -4.658 1.00 0.00 H new ATOM 284 N PRO A 67 5.323 -9.735 -2.997 1.00 0.00 N ATOM 285 CA PRO A 67 6.630 -10.204 -2.538 1.00 0.00 C ATOM 286 C PRO A 67 7.205 -9.423 -1.335 1.00 0.00 C ATOM 287 O PRO A 67 6.571 -8.561 -0.726 1.00 0.00 O ATOM 288 CB PRO A 67 7.557 -10.099 -3.756 1.00 0.00 C ATOM 289 CG PRO A 67 6.598 -10.173 -4.940 1.00 0.00 C ATOM 290 CD PRO A 67 5.356 -9.443 -4.421 1.00 0.00 C ATOM 0 HA PRO A 67 6.536 -11.223 -2.163 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.120 -9.166 -3.753 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.285 -10.910 -3.778 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.011 -9.689 -5.825 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.375 -11.204 -5.215 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.422 -8.370 -4.604 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.453 -9.796 -4.918 1.00 0.00 H new ATOM 298 N ILE A 68 8.460 -9.733 -1.021 1.00 0.00 N ATOM 299 CA ILE A 68 9.258 -9.210 0.104 1.00 0.00 C ATOM 300 C ILE A 68 9.419 -7.684 0.009 1.00 0.00 C ATOM 301 O ILE A 68 9.292 -6.945 0.988 1.00 0.00 O ATOM 302 CB ILE A 68 10.671 -9.851 0.090 1.00 0.00 C ATOM 303 CG1 ILE A 68 10.741 -11.323 -0.377 1.00 0.00 C ATOM 304 CG2 ILE A 68 11.356 -9.658 1.449 1.00 0.00 C ATOM 305 CD1 ILE A 68 10.136 -12.351 0.589 1.00 0.00 C ATOM 0 H ILE A 68 8.990 -10.402 -1.579 1.00 0.00 H new ATOM 0 HA ILE A 68 8.733 -9.459 1.026 1.00 0.00 H new ATOM 0 HB ILE A 68 11.218 -9.312 -0.684 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.230 -11.407 -1.336 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.786 -11.582 -0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 68 12.346 -10.113 1.425 1.00 0.00 H new ATOM 0 HG22 ILE A 68 11.451 -8.593 1.661 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.758 -10.131 2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.237 -13.351 0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 68 10.660 -12.306 1.544 1.00 0.00 H new ATOM 0 HD13 ILE A 68 9.080 -12.127 0.744 1.00 0.00 H new ATOM 317 N ASP A 69 9.777 -7.267 -1.205 1.00 0.00 N ATOM 318 CA ASP A 69 10.354 -5.985 -1.613 1.00 0.00 C ATOM 319 C ASP A 69 10.063 -5.675 -3.103 1.00 0.00 C ATOM 320 O ASP A 69 10.344 -4.574 -3.571 1.00 0.00 O ATOM 321 CB ASP A 69 11.867 -6.135 -1.358 1.00 0.00 C ATOM 322 CG ASP A 69 12.699 -4.918 -1.797 1.00 0.00 C ATOM 323 OD1 ASP A 69 12.505 -3.820 -1.226 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.605 -5.080 -2.649 1.00 0.00 O ATOM 0 H ASP A 69 9.658 -7.882 -2.010 1.00 0.00 H new ATOM 0 HA ASP A 69 9.924 -5.153 -1.056 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.030 -6.309 -0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.228 -7.018 -1.885 1.00 0.00 H new ATOM 329 N VAL A 70 9.487 -6.642 -3.840 1.00 0.00 N ATOM 330 CA VAL A 70 9.320 -6.716 -5.306 1.00 0.00 C ATOM 331 C VAL A 70 10.380 -5.915 -6.085 1.00 0.00 C ATOM 332 O VAL A 70 11.574 -6.134 -5.869 1.00 0.00 O ATOM 333 CB VAL A 70 7.831 -6.498 -5.646 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.275 -5.091 -5.403 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.499 -6.957 -7.060 1.00 0.00 C ATOM 0 H VAL A 70 9.091 -7.465 -3.386 1.00 0.00 H new ATOM 0 HA VAL A 70 9.550 -7.714 -5.679 1.00 0.00 H new ATOM 0 HB VAL A 70 7.321 -7.129 -4.918 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.221 -5.064 -5.679 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.381 -4.835 -4.349 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.827 -4.372 -6.008 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.441 -6.786 -7.259 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.098 -6.394 -7.775 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.720 -8.020 -7.159 1.00 0.00 H new ATOM 345 N THR A 71 10.001 -5.023 -7.004 1.00 0.00 N ATOM 346 CA THR A 71 10.875 -3.980 -7.544 1.00 0.00 C ATOM 347 C THR A 71 10.047 -2.797 -8.045 1.00 0.00 C ATOM 348 O THR A 71 8.935 -2.947 -8.567 1.00 0.00 O ATOM 349 CB THR A 71 11.830 -4.542 -8.610 1.00 0.00 C ATOM 350 OG1 THR A 71 12.661 -3.508 -9.091 1.00 0.00 O ATOM 351 CG2 THR A 71 11.111 -5.214 -9.780 1.00 0.00 C ATOM 0 H THR A 71 9.061 -5.006 -7.400 1.00 0.00 H new ATOM 0 HA THR A 71 11.512 -3.606 -6.742 1.00 0.00 H new ATOM 0 HB THR A 71 12.422 -5.318 -8.124 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.271 -3.867 -9.769 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.846 -5.587 -10.493 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.511 -6.045 -9.409 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.462 -4.490 -10.273 1.00 0.00 H new ATOM 359 N GLU A 72 10.582 -1.592 -7.858 1.00 0.00 N ATOM 360 CA GLU A 72 9.898 -0.344 -8.190 1.00 0.00 C ATOM 361 C GLU A 72 9.508 -0.272 -9.666 1.00 0.00 C ATOM 362 O GLU A 72 8.383 0.114 -9.975 1.00 0.00 O ATOM 363 CB GLU A 72 10.752 0.850 -7.718 1.00 0.00 C ATOM 364 CG GLU A 72 10.590 2.155 -8.515 1.00 0.00 C ATOM 365 CD GLU A 72 11.486 2.263 -9.773 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.550 1.603 -9.846 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.152 3.053 -10.687 1.00 0.00 O ATOM 0 H GLU A 72 11.514 -1.453 -7.467 1.00 0.00 H new ATOM 0 HA GLU A 72 8.949 -0.304 -7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.511 1.053 -6.675 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.801 0.556 -7.751 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.548 2.251 -8.819 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.809 2.996 -7.857 1.00 0.00 H new ATOM 374 N GLY A 73 10.398 -0.697 -10.565 1.00 0.00 N ATOM 375 CA GLY A 73 10.166 -0.686 -12.012 1.00 0.00 C ATOM 376 C GLY A 73 8.899 -1.451 -12.409 1.00 0.00 C ATOM 377 O GLY A 73 8.154 -1.005 -13.276 1.00 0.00 O ATOM 0 H GLY A 73 11.314 -1.064 -10.305 1.00 0.00 H new ATOM 0 HA2 GLY A 73 10.087 0.345 -12.356 1.00 0.00 H new ATOM 0 HA3 GLY A 73 11.026 -1.126 -12.518 1.00 0.00 H new ATOM 381 N GLU A 74 8.620 -2.570 -11.738 1.00 0.00 N ATOM 382 CA GLU A 74 7.382 -3.342 -11.890 1.00 0.00 C ATOM 383 C GLU A 74 6.174 -2.602 -11.337 1.00 0.00 C ATOM 384 O GLU A 74 5.196 -2.408 -12.058 1.00 0.00 O ATOM 385 CB GLU A 74 7.544 -4.721 -11.234 1.00 0.00 C ATOM 386 CG GLU A 74 8.280 -5.654 -12.198 1.00 0.00 C ATOM 387 CD GLU A 74 7.311 -6.329 -13.189 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.767 -7.414 -12.868 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.097 -5.787 -14.301 1.00 0.00 O ATOM 0 H GLU A 74 9.263 -2.975 -11.057 1.00 0.00 H new ATOM 0 HA GLU A 74 7.197 -3.479 -12.955 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.101 -4.630 -10.301 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.567 -5.135 -10.983 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.030 -5.088 -12.751 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.811 -6.418 -11.631 1.00 0.00 H new ATOM 396 N VAL A 75 6.235 -2.156 -10.079 1.00 0.00 N ATOM 397 CA VAL A 75 5.104 -1.492 -9.409 1.00 0.00 C ATOM 398 C VAL A 75 4.651 -0.229 -10.154 1.00 0.00 C ATOM 399 O VAL A 75 3.461 -0.055 -10.435 1.00 0.00 O ATOM 400 CB VAL A 75 5.450 -1.217 -7.938 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.331 -0.490 -7.188 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.718 -2.545 -7.227 1.00 0.00 C ATOM 0 H VAL A 75 7.066 -2.243 -9.494 1.00 0.00 H new ATOM 0 HA VAL A 75 4.249 -2.167 -9.430 1.00 0.00 H new ATOM 0 HB VAL A 75 6.329 -0.573 -7.935 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.634 -0.324 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.135 0.469 -7.667 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.426 -1.097 -7.208 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.964 -2.355 -6.182 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.829 -3.173 -7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.552 -3.054 -7.710 1.00 0.00 H new ATOM 412 N ILE A 76 5.581 0.641 -10.558 1.00 0.00 N ATOM 413 CA ILE A 76 5.248 1.845 -11.322 1.00 0.00 C ATOM 414 C ILE A 76 4.863 1.534 -12.764 1.00 0.00 C ATOM 415 O ILE A 76 3.974 2.206 -13.285 1.00 0.00 O ATOM 416 CB ILE A 76 6.362 2.900 -11.248 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.655 2.538 -12.006 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.696 3.157 -9.782 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.654 3.110 -13.416 1.00 0.00 C ATOM 0 H ILE A 76 6.577 0.532 -10.367 1.00 0.00 H new ATOM 0 HA ILE A 76 4.365 2.273 -10.848 1.00 0.00 H new ATOM 0 HB ILE A 76 5.970 3.788 -11.745 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.517 2.918 -11.459 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.760 1.454 -12.052 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.486 3.905 -9.715 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.808 3.520 -9.265 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.033 2.230 -9.318 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.580 2.835 -13.921 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.806 2.709 -13.971 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.575 4.196 -13.368 1.00 0.00 H new ATOM 431 N SER A 77 5.449 0.511 -13.412 1.00 0.00 N ATOM 432 CA SER A 77 4.992 0.150 -14.772 1.00 0.00 C ATOM 433 C SER A 77 3.596 -0.461 -14.751 1.00 0.00 C ATOM 434 O SER A 77 2.870 -0.398 -15.747 1.00 0.00 O ATOM 435 CB SER A 77 5.937 -0.800 -15.502 1.00 0.00 C ATOM 436 OG SER A 77 7.214 -0.215 -15.676 1.00 0.00 O ATOM 0 H SER A 77 6.207 -0.060 -13.039 1.00 0.00 H new ATOM 0 HA SER A 77 4.977 1.091 -15.321 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.032 -1.728 -14.938 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.517 -1.060 -16.474 1.00 0.00 H new ATOM 0 HG SER A 77 7.782 -0.436 -14.909 1.00 0.00 H new ATOM 442 N LEU A 78 3.191 -0.981 -13.594 1.00 0.00 N ATOM 443 CA LEU A 78 1.828 -1.411 -13.342 1.00 0.00 C ATOM 444 C LEU A 78 0.868 -0.249 -13.060 1.00 0.00 C ATOM 445 O LEU A 78 -0.309 -0.358 -13.404 1.00 0.00 O ATOM 446 CB LEU A 78 1.842 -2.444 -12.203 1.00 0.00 C ATOM 447 CG LEU A 78 1.965 -3.881 -12.732 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.421 -4.812 -11.610 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.622 -4.372 -13.289 1.00 0.00 C ATOM 0 H LEU A 78 3.814 -1.115 -12.797 1.00 0.00 H new ATOM 0 HA LEU A 78 1.439 -1.873 -14.249 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.674 -2.232 -11.532 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.928 -2.350 -11.617 1.00 0.00 H new ATOM 0 HG LEU A 78 2.702 -3.888 -13.535 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.506 -5.829 -11.993 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.390 -4.483 -11.236 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.692 -4.789 -10.800 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.732 -5.392 -13.658 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.129 -4.351 -12.499 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.308 -3.722 -14.106 1.00 0.00 H new ATOM 461 N GLY A 79 1.348 0.881 -12.523 1.00 0.00 N ATOM 462 CA GLY A 79 0.502 2.057 -12.294 1.00 0.00 C ATOM 463 C GLY A 79 0.447 3.038 -13.467 1.00 0.00 C ATOM 464 O GLY A 79 -0.479 3.842 -13.569 1.00 0.00 O ATOM 0 H GLY A 79 2.320 1.004 -12.239 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.511 1.722 -12.069 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.866 2.585 -11.412 1.00 0.00 H new ATOM 468 N LEU A 80 1.429 3.012 -14.362 1.00 0.00 N ATOM 469 CA LEU A 80 1.608 4.030 -15.388 1.00 0.00 C ATOM 470 C LEU A 80 0.504 4.180 -16.455 1.00 0.00 C ATOM 471 O LEU A 80 0.199 5.325 -16.793 1.00 0.00 O ATOM 472 CB LEU A 80 2.993 3.867 -16.028 1.00 0.00 C ATOM 473 CG LEU A 80 4.011 4.872 -15.479 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.377 4.582 -16.101 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.576 6.301 -15.829 1.00 0.00 C ATOM 0 H LEU A 80 2.131 2.273 -14.395 1.00 0.00 H new ATOM 0 HA LEU A 80 1.523 4.974 -14.849 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.355 2.854 -15.852 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.909 3.992 -17.108 1.00 0.00 H new ATOM 0 HG LEU A 80 4.070 4.778 -14.395 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.110 5.292 -15.717 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.685 3.568 -15.845 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.311 4.679 -17.185 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.305 7.010 -15.435 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.514 6.408 -16.912 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.599 6.502 -15.389 1.00 0.00 H new ATOM 487 N PRO A 81 -0.144 3.107 -16.959 1.00 0.00 N ATOM 488 CA PRO A 81 -1.319 3.200 -17.839 1.00 0.00 C ATOM 489 C PRO A 81 -2.526 3.958 -17.298 1.00 0.00 C ATOM 490 O PRO A 81 -3.500 4.140 -18.035 1.00 0.00 O ATOM 491 CB PRO A 81 -1.685 1.757 -18.207 1.00 0.00 C ATOM 492 CG PRO A 81 -0.373 0.999 -18.025 1.00 0.00 C ATOM 493 CD PRO A 81 0.280 1.717 -16.848 1.00 0.00 C ATOM 0 HA PRO A 81 -1.040 3.811 -18.698 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.469 1.364 -17.559 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.052 1.685 -19.231 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.543 -0.056 -17.810 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.247 1.046 -18.920 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.037 1.284 -15.899 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.366 1.633 -16.890 1.00 0.00 H new ATOM 501 N PHE A 82 -2.479 4.415 -16.047 1.00 0.00 N ATOM 502 CA PHE A 82 -3.645 4.918 -15.345 1.00 0.00 C ATOM 503 C PHE A 82 -3.649 6.437 -15.181 1.00 0.00 C ATOM 504 O PHE A 82 -4.708 7.061 -15.278 1.00 0.00 O ATOM 505 CB PHE A 82 -3.770 4.197 -13.996 1.00 0.00 C ATOM 506 CG PHE A 82 -3.929 2.700 -14.159 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.861 1.869 -14.569 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.209 2.154 -14.006 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.106 0.515 -14.867 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.462 0.818 -14.334 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.410 0.001 -14.766 1.00 0.00 C ATOM 0 H PHE A 82 -1.622 4.444 -15.494 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.521 4.702 -15.957 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.886 4.403 -13.393 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.627 4.594 -13.452 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.862 2.271 -14.653 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.011 2.772 -13.630 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.293 -0.127 -15.173 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.462 0.419 -14.255 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.602 -1.030 -15.023 1.00 0.00 H new ATOM 521 N GLY A 83 -2.471 7.039 -14.983 1.00 0.00 N ATOM 522 CA GLY A 83 -2.297 8.482 -14.971 1.00 0.00 C ATOM 523 C GLY A 83 -0.876 8.888 -15.344 1.00 0.00 C ATOM 524 O GLY A 83 -0.431 8.772 -16.485 1.00 0.00 O ATOM 0 H GLY A 83 -1.605 6.524 -14.825 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.999 8.938 -15.669 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.536 8.868 -13.980 1.00 0.00 H new ATOM 528 N LYS A 84 -0.176 9.352 -14.314 1.00 0.00 N ATOM 529 CA LYS A 84 1.220 9.761 -14.228 1.00 0.00 C ATOM 530 C LYS A 84 1.613 9.446 -12.785 1.00 0.00 C ATOM 531 O LYS A 84 0.872 9.829 -11.882 1.00 0.00 O ATOM 532 CB LYS A 84 1.278 11.269 -14.560 1.00 0.00 C ATOM 533 CG LYS A 84 2.601 11.745 -15.168 1.00 0.00 C ATOM 534 CD LYS A 84 2.951 11.046 -16.492 1.00 0.00 C ATOM 535 CE LYS A 84 4.162 11.721 -17.145 1.00 0.00 C ATOM 536 NZ LYS A 84 4.514 11.076 -18.436 1.00 0.00 N ATOM 0 H LYS A 84 -0.632 9.463 -13.408 1.00 0.00 H new ATOM 0 HA LYS A 84 1.901 9.259 -14.916 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.471 11.505 -15.253 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.090 11.835 -13.647 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.549 12.821 -15.336 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.404 11.573 -14.452 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.167 9.993 -16.309 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.097 11.083 -17.168 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.946 12.776 -17.311 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.015 11.673 -16.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.337 11.557 -18.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.744 10.075 -18.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.708 11.144 -19.089 1.00 0.00 H new ATOM 550 N VAL A 85 2.628 8.624 -12.536 1.00 0.00 N ATOM 551 CA VAL A 85 2.786 7.954 -11.220 1.00 0.00 C ATOM 552 C VAL A 85 4.193 8.180 -10.688 1.00 0.00 C ATOM 553 O VAL A 85 5.130 7.418 -10.934 1.00 0.00 O ATOM 554 CB VAL A 85 2.234 6.511 -11.189 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.199 5.878 -9.788 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.046 6.381 -12.132 1.00 0.00 C ATOM 0 H VAL A 85 3.356 8.398 -13.214 1.00 0.00 H new ATOM 0 HA VAL A 85 2.132 8.428 -10.488 1.00 0.00 H new ATOM 0 HB VAL A 85 2.948 5.812 -11.624 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.799 4.866 -9.856 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.209 5.842 -9.380 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.564 6.476 -9.134 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.667 5.360 -12.101 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.260 7.070 -11.824 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.360 6.620 -13.148 1.00 0.00 H new ATOM 566 N THR A 86 4.326 9.344 -10.048 1.00 0.00 N ATOM 567 CA THR A 86 5.578 10.027 -9.717 1.00 0.00 C ATOM 568 C THR A 86 6.261 9.444 -8.477 1.00 0.00 C ATOM 569 O THR A 86 7.476 9.591 -8.336 1.00 0.00 O ATOM 570 CB THR A 86 5.323 11.539 -9.572 1.00 0.00 C ATOM 571 OG1 THR A 86 6.523 12.280 -9.503 1.00 0.00 O ATOM 572 CG2 THR A 86 4.492 11.889 -8.339 1.00 0.00 C ATOM 0 H THR A 86 3.511 9.867 -9.727 1.00 0.00 H new ATOM 0 HA THR A 86 6.275 9.864 -10.539 1.00 0.00 H new ATOM 0 HB THR A 86 4.767 11.808 -10.470 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.314 13.233 -9.413 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.347 12.968 -8.293 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.523 11.395 -8.401 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.013 11.554 -7.442 1.00 0.00 H new ATOM 580 N ASN A 87 5.519 8.741 -7.605 1.00 0.00 N ATOM 581 CA ASN A 87 6.124 8.082 -6.455 1.00 0.00 C ATOM 582 C ASN A 87 5.534 6.707 -6.114 1.00 0.00 C ATOM 583 O ASN A 87 4.415 6.357 -6.484 1.00 0.00 O ATOM 584 CB ASN A 87 6.091 9.035 -5.229 1.00 0.00 C ATOM 585 CG ASN A 87 7.357 8.974 -4.387 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.258 8.181 -4.609 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.470 9.808 -3.381 1.00 0.00 N ATOM 0 H ASN A 87 4.509 8.620 -7.680 1.00 0.00 H new ATOM 0 HA ASN A 87 7.156 7.868 -6.734 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.942 10.058 -5.576 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.234 8.783 -4.604 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.304 9.789 -2.794 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.724 10.475 -3.185 1.00 0.00 H new ATOM 594 N LEU A 88 6.295 5.941 -5.339 1.00 0.00 N ATOM 595 CA LEU A 88 5.888 4.768 -4.573 1.00 0.00 C ATOM 596 C LEU A 88 6.747 4.628 -3.300 1.00 0.00 C ATOM 597 O LEU A 88 7.754 5.318 -3.134 1.00 0.00 O ATOM 598 CB LEU A 88 5.982 3.544 -5.492 1.00 0.00 C ATOM 599 CG LEU A 88 7.381 2.919 -5.576 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.228 1.648 -6.374 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.447 3.785 -6.243 1.00 0.00 C ATOM 0 H LEU A 88 7.289 6.139 -5.221 1.00 0.00 H new ATOM 0 HA LEU A 88 4.858 4.865 -4.230 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.280 2.787 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.666 3.833 -6.494 1.00 0.00 H new ATOM 0 HG LEU A 88 7.734 2.771 -4.555 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.197 1.158 -6.467 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.531 0.981 -5.866 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.845 1.885 -7.367 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.397 3.251 -6.251 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.147 4.007 -7.267 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.559 4.716 -5.688 1.00 0.00 H new ATOM 613 N LEU A 89 6.382 3.701 -2.418 1.00 0.00 N ATOM 614 CA LEU A 89 7.151 3.313 -1.228 1.00 0.00 C ATOM 615 C LEU A 89 7.008 1.807 -1.020 1.00 0.00 C ATOM 616 O LEU A 89 6.016 1.216 -1.435 1.00 0.00 O ATOM 617 CB LEU A 89 6.690 4.192 -0.046 1.00 0.00 C ATOM 618 CG LEU A 89 6.591 3.629 1.377 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.656 2.470 1.584 1.00 0.00 C ATOM 620 CD2 LEU A 89 7.932 3.440 2.093 1.00 0.00 C ATOM 0 H LEU A 89 5.512 3.178 -2.512 1.00 0.00 H new ATOM 0 HA LEU A 89 8.221 3.491 -1.335 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.366 5.046 -0.003 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.704 4.579 -0.304 1.00 0.00 H new ATOM 0 HG LEU A 89 6.092 4.456 1.883 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.678 2.167 2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.643 2.767 1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.968 1.634 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.758 3.038 3.091 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.553 2.747 1.526 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.441 4.401 2.172 1.00 0.00 H new ATOM 632 N MET A 90 7.990 1.191 -0.363 1.00 0.00 N ATOM 633 CA MET A 90 8.071 -0.256 -0.147 1.00 0.00 C ATOM 634 C MET A 90 8.290 -0.564 1.339 1.00 0.00 C ATOM 635 O MET A 90 9.383 -0.347 1.868 1.00 0.00 O ATOM 636 CB MET A 90 9.164 -0.856 -1.050 1.00 0.00 C ATOM 637 CG MET A 90 9.034 -0.293 -2.474 1.00 0.00 C ATOM 638 SD MET A 90 9.803 -1.265 -3.782 1.00 0.00 S ATOM 639 CE MET A 90 8.289 -1.546 -4.720 1.00 0.00 C ATOM 0 H MET A 90 8.775 1.698 0.046 1.00 0.00 H new ATOM 0 HA MET A 90 7.128 -0.726 -0.425 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.149 -0.623 -0.646 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.076 -1.942 -1.070 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.974 -0.184 -2.705 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.468 0.707 -2.489 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.541 -1.886 -5.725 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.687 -2.305 -4.221 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.722 -0.617 -4.783 1.00 0.00 H new ATOM 649 N LEU A 91 7.249 -1.041 2.033 1.00 0.00 N ATOM 650 CA LEU A 91 7.331 -1.520 3.420 1.00 0.00 C ATOM 651 C LEU A 91 8.027 -2.891 3.477 1.00 0.00 C ATOM 652 O LEU A 91 7.406 -3.928 3.737 1.00 0.00 O ATOM 653 CB LEU A 91 5.937 -1.577 4.079 1.00 0.00 C ATOM 654 CG LEU A 91 5.104 -0.302 4.327 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.949 0.904 4.705 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.157 0.045 3.188 1.00 0.00 C ATOM 0 H LEU A 91 6.310 -1.106 1.640 1.00 0.00 H new ATOM 0 HA LEU A 91 7.930 -0.808 3.987 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.325 -2.240 3.467 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.065 -2.064 5.046 1.00 0.00 H new ATOM 0 HG LEU A 91 4.487 -0.556 5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.302 1.766 4.865 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.501 0.689 5.620 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.652 1.122 3.901 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.607 0.953 3.436 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.730 0.206 2.275 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.455 -0.775 3.036 1.00 0.00 H new ATOM 668 N LYS A 92 9.344 -2.885 3.238 1.00 0.00 N ATOM 669 CA LYS A 92 10.209 -4.070 3.157 1.00 0.00 C ATOM 670 C LYS A 92 10.010 -4.996 4.361 1.00 0.00 C ATOM 671 O LYS A 92 10.209 -4.582 5.506 1.00 0.00 O ATOM 672 CB LYS A 92 11.675 -3.623 2.989 1.00 0.00 C ATOM 673 CG LYS A 92 12.627 -4.817 2.799 1.00 0.00 C ATOM 674 CD LYS A 92 14.100 -4.402 2.655 1.00 0.00 C ATOM 675 CE LYS A 92 14.378 -3.695 1.320 1.00 0.00 C ATOM 676 NZ LYS A 92 15.815 -3.350 1.166 1.00 0.00 N ATOM 0 H LYS A 92 9.859 -2.017 3.089 1.00 0.00 H new ATOM 0 HA LYS A 92 9.931 -4.658 2.282 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.754 -2.957 2.130 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.982 -3.051 3.865 1.00 0.00 H new ATOM 0 HG2 LYS A 92 12.528 -5.491 3.650 1.00 0.00 H new ATOM 0 HG3 LYS A 92 12.326 -5.376 1.913 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.371 -3.740 3.478 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.734 -5.285 2.735 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.069 -4.339 0.497 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.778 -2.787 1.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.962 -2.874 0.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 16.104 -2.715 1.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 16.386 -4.219 1.200 1.00 0.00 H new ATOM 690 N GLY A 93 9.578 -6.228 4.099 1.00 0.00 N ATOM 691 CA GLY A 93 9.372 -7.269 5.111 1.00 0.00 C ATOM 692 C GLY A 93 7.972 -7.330 5.747 1.00 0.00 C ATOM 693 O GLY A 93 7.700 -8.292 6.471 1.00 0.00 O ATOM 0 H GLY A 93 9.355 -6.540 3.154 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.584 -8.236 4.656 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.104 -7.124 5.906 1.00 0.00 H new ATOM 697 N LYS A 94 7.062 -6.377 5.459 1.00 0.00 N ATOM 698 CA LYS A 94 5.617 -6.517 5.769 1.00 0.00 C ATOM 699 C LYS A 94 4.795 -7.060 4.588 1.00 0.00 C ATOM 700 O LYS A 94 3.594 -7.261 4.741 1.00 0.00 O ATOM 701 CB LYS A 94 4.983 -5.214 6.316 1.00 0.00 C ATOM 702 CG LYS A 94 5.493 -4.775 7.704 1.00 0.00 C ATOM 703 CD LYS A 94 6.362 -3.513 7.795 1.00 0.00 C ATOM 704 CE LYS A 94 7.793 -3.736 7.302 1.00 0.00 C ATOM 705 NZ LYS A 94 8.704 -2.627 7.706 1.00 0.00 N ATOM 0 H LYS A 94 7.301 -5.494 5.008 1.00 0.00 H new ATOM 0 HA LYS A 94 5.579 -7.261 6.565 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.171 -4.410 5.605 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.902 -5.347 6.368 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.624 -4.627 8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.064 -5.603 8.125 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.901 -2.718 7.208 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.389 -3.171 8.830 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.170 -4.678 7.700 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.792 -3.826 6.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.663 -2.819 7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.359 -1.731 7.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.726 -2.556 8.743 1.00 0.00 H new ATOM 719 N ASN A 95 5.414 -7.288 3.420 1.00 0.00 N ATOM 720 CA ASN A 95 4.762 -7.559 2.123 1.00 0.00 C ATOM 721 C ASN A 95 3.905 -6.384 1.615 1.00 0.00 C ATOM 722 O ASN A 95 2.917 -6.601 0.906 1.00 0.00 O ATOM 723 CB ASN A 95 3.962 -8.876 2.162 1.00 0.00 C ATOM 724 CG ASN A 95 4.816 -10.101 2.420 1.00 0.00 C ATOM 725 OD1 ASN A 95 5.201 -10.414 3.536 1.00 0.00 O ATOM 726 ND2 ASN A 95 5.122 -10.845 1.385 1.00 0.00 N ATOM 0 H ASN A 95 6.431 -7.289 3.347 1.00 0.00 H new ATOM 0 HA ASN A 95 5.565 -7.675 1.396 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.200 -8.805 2.938 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.440 -9.002 1.214 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.683 -11.688 1.511 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.799 -10.581 0.454 1.00 0.00 H new ATOM 733 N GLN A 96 4.237 -5.149 2.000 1.00 0.00 N ATOM 734 CA GLN A 96 3.380 -3.988 1.804 1.00 0.00 C ATOM 735 C GLN A 96 4.093 -2.857 1.030 1.00 0.00 C ATOM 736 O GLN A 96 5.320 -2.844 0.917 1.00 0.00 O ATOM 737 CB GLN A 96 2.861 -3.540 3.171 1.00 0.00 C ATOM 738 CG GLN A 96 1.845 -4.517 3.769 1.00 0.00 C ATOM 739 CD GLN A 96 1.567 -4.216 5.232 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.411 -5.091 6.069 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.477 -2.958 5.581 1.00 0.00 N ATOM 0 H GLN A 96 5.120 -4.930 2.462 1.00 0.00 H new ATOM 0 HA GLN A 96 2.532 -4.260 1.175 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.702 -3.432 3.856 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.400 -2.557 3.075 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.914 -4.465 3.204 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.220 -5.536 3.672 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.607 -2.225 4.884 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.277 -2.711 6.550 1.00 0.00 H new ATOM 750 N ALA A 97 3.340 -1.884 0.514 1.00 0.00 N ATOM 751 CA ALA A 97 3.823 -0.741 -0.276 1.00 0.00 C ATOM 752 C ALA A 97 2.761 0.358 -0.365 1.00 0.00 C ATOM 753 O ALA A 97 1.597 0.146 -0.027 1.00 0.00 O ATOM 754 CB ALA A 97 4.105 -1.267 -1.702 1.00 0.00 C ATOM 0 H ALA A 97 2.328 -1.867 0.639 1.00 0.00 H new ATOM 0 HA ALA A 97 4.711 -0.318 0.193 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.467 -0.450 -2.326 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.860 -2.052 -1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.187 -1.671 -2.129 1.00 0.00 H new ATOM 760 N PHE A 98 3.167 1.511 -0.893 1.00 0.00 N ATOM 761 CA PHE A 98 2.312 2.591 -1.382 1.00 0.00 C ATOM 762 C PHE A 98 2.561 2.751 -2.892 1.00 0.00 C ATOM 763 O PHE A 98 3.676 2.500 -3.348 1.00 0.00 O ATOM 764 CB PHE A 98 2.720 3.930 -0.749 1.00 0.00 C ATOM 765 CG PHE A 98 2.344 4.262 0.686 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.088 3.265 1.645 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.270 5.619 1.075 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.739 3.620 2.953 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.884 5.977 2.364 1.00 0.00 C ATOM 770 CZ PHE A 98 1.612 4.973 3.290 1.00 0.00 C ATOM 0 H PHE A 98 4.158 1.729 -0.997 1.00 0.00 H new ATOM 0 HA PHE A 98 1.277 2.349 -1.142 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.806 3.999 -0.819 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.309 4.719 -1.378 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.161 2.223 1.371 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.517 6.391 0.361 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.569 2.856 3.697 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.797 7.017 2.641 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.297 5.243 4.287 1.00 0.00 H new ATOM 780 N ILE A 99 1.606 3.298 -3.647 1.00 0.00 N ATOM 781 CA ILE A 99 1.807 3.811 -5.008 1.00 0.00 C ATOM 782 C ILE A 99 1.046 5.139 -5.164 1.00 0.00 C ATOM 783 O ILE A 99 -0.144 5.227 -4.865 1.00 0.00 O ATOM 784 CB ILE A 99 1.470 2.720 -6.049 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.716 3.248 -7.478 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.051 2.163 -5.874 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.646 2.163 -8.564 1.00 0.00 C ATOM 0 H ILE A 99 0.645 3.400 -3.322 1.00 0.00 H new ATOM 0 HA ILE A 99 2.854 4.048 -5.195 1.00 0.00 H new ATOM 0 HB ILE A 99 2.142 1.879 -5.879 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.979 4.020 -7.701 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.696 3.723 -7.515 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.136 1.400 -6.630 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.047 1.723 -4.882 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.673 2.970 -5.986 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.829 2.613 -9.540 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.401 1.402 -8.367 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.658 1.704 -8.556 1.00 0.00 H new ATOM 799 N GLU A 100 1.761 6.193 -5.559 1.00 0.00 N ATOM 800 CA GLU A 100 1.366 7.603 -5.492 1.00 0.00 C ATOM 801 C GLU A 100 1.408 8.258 -6.862 1.00 0.00 C ATOM 802 O GLU A 100 2.435 8.314 -7.548 1.00 0.00 O ATOM 803 CB GLU A 100 2.288 8.342 -4.509 1.00 0.00 C ATOM 804 CG GLU A 100 2.420 9.871 -4.697 1.00 0.00 C ATOM 805 CD GLU A 100 1.119 10.631 -4.412 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.511 10.392 -3.345 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.751 11.508 -5.228 1.00 0.00 O ATOM 0 H GLU A 100 2.692 6.079 -5.960 1.00 0.00 H new ATOM 0 HA GLU A 100 0.337 7.660 -5.138 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.928 8.153 -3.498 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.283 7.903 -4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.203 10.245 -4.038 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.738 10.079 -5.719 1.00 0.00 H new ATOM 814 N MET A 101 0.246 8.777 -7.233 1.00 0.00 N ATOM 815 CA MET A 101 -0.027 9.182 -8.598 1.00 0.00 C ATOM 816 C MET A 101 -0.658 10.568 -8.693 1.00 0.00 C ATOM 817 O MET A 101 -1.224 11.119 -7.755 1.00 0.00 O ATOM 818 CB MET A 101 -0.780 8.076 -9.329 1.00 0.00 C ATOM 819 CG MET A 101 -1.726 7.237 -8.483 1.00 0.00 C ATOM 820 SD MET A 101 -2.749 6.145 -9.492 1.00 0.00 S ATOM 821 CE MET A 101 -1.648 5.676 -10.843 1.00 0.00 C ATOM 0 H MET A 101 -0.533 8.928 -6.592 1.00 0.00 H new ATOM 0 HA MET A 101 0.919 9.309 -9.124 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.353 8.528 -10.138 1.00 0.00 H new ATOM 0 HB3 MET A 101 -0.050 7.410 -9.789 1.00 0.00 H new ATOM 0 HG2 MET A 101 -1.148 6.641 -7.776 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.367 7.895 -7.896 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.072 4.827 -11.380 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.532 6.517 -11.527 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.674 5.400 -10.439 1.00 0.00 H new ATOM 831 N ASN A 102 -0.490 11.158 -9.865 1.00 0.00 N ATOM 832 CA ASN A 102 -0.600 12.600 -10.097 1.00 0.00 C ATOM 833 C ASN A 102 -2.039 13.145 -10.030 1.00 0.00 C ATOM 834 O ASN A 102 -2.226 14.350 -9.859 1.00 0.00 O ATOM 835 CB ASN A 102 0.064 12.890 -11.454 1.00 0.00 C ATOM 836 CG ASN A 102 -0.853 12.707 -12.643 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.003 13.590 -13.472 1.00 0.00 O ATOM 838 ND2 ASN A 102 -1.449 11.544 -12.794 1.00 0.00 N ATOM 0 H ASN A 102 -0.266 10.635 -10.712 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.092 13.126 -9.288 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.438 13.914 -11.452 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.928 12.235 -11.571 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -2.041 11.376 -13.608 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.319 10.810 -12.097 1.00 0.00 H new ATOM 845 N THR A 103 -3.042 12.266 -10.172 1.00 0.00 N ATOM 846 CA THR A 103 -4.463 12.624 -10.210 1.00 0.00 C ATOM 847 C THR A 103 -5.314 11.652 -9.395 1.00 0.00 C ATOM 848 O THR A 103 -5.102 10.431 -9.366 1.00 0.00 O ATOM 849 CB THR A 103 -5.026 12.744 -11.641 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.225 11.485 -12.244 1.00 0.00 O ATOM 851 CG2 THR A 103 -4.159 13.565 -12.597 1.00 0.00 C ATOM 0 H THR A 103 -2.881 11.263 -10.266 1.00 0.00 H new ATOM 0 HA THR A 103 -4.521 13.613 -9.756 1.00 0.00 H new ATOM 0 HB THR A 103 -5.973 13.263 -11.491 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.584 11.608 -13.148 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.630 13.597 -13.579 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.053 14.579 -12.212 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.175 13.105 -12.682 1.00 0.00 H new ATOM 859 N GLU A 104 -6.318 12.226 -8.741 1.00 0.00 N ATOM 860 CA GLU A 104 -7.316 11.514 -7.949 1.00 0.00 C ATOM 861 C GLU A 104 -8.079 10.504 -8.818 1.00 0.00 C ATOM 862 O GLU A 104 -8.380 9.398 -8.373 1.00 0.00 O ATOM 863 CB GLU A 104 -8.305 12.508 -7.305 1.00 0.00 C ATOM 864 CG GLU A 104 -7.661 13.747 -6.653 1.00 0.00 C ATOM 865 CD GLU A 104 -7.627 14.958 -7.609 1.00 0.00 C ATOM 866 OE1 GLU A 104 -6.749 14.996 -8.504 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.472 15.877 -7.466 1.00 0.00 O ATOM 0 H GLU A 104 -6.465 13.235 -8.748 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.797 10.972 -7.159 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -9.007 12.843 -8.069 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.885 11.980 -6.548 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.217 14.012 -5.753 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.645 13.504 -6.341 1.00 0.00 H new ATOM 874 N GLU A 105 -8.360 10.865 -10.075 1.00 0.00 N ATOM 875 CA GLU A 105 -9.063 10.013 -11.037 1.00 0.00 C ATOM 876 C GLU A 105 -8.233 8.835 -11.543 1.00 0.00 C ATOM 877 O GLU A 105 -8.780 7.736 -11.646 1.00 0.00 O ATOM 878 CB GLU A 105 -9.553 10.820 -12.243 1.00 0.00 C ATOM 879 CG GLU A 105 -10.667 11.805 -11.864 1.00 0.00 C ATOM 880 CD GLU A 105 -11.194 12.541 -13.109 1.00 0.00 C ATOM 881 OE1 GLU A 105 -10.654 13.619 -13.462 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.163 12.055 -13.746 1.00 0.00 O ATOM 0 H GLU A 105 -8.100 11.774 -10.458 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.909 9.608 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.716 11.369 -12.676 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.918 10.138 -13.011 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.484 11.269 -11.380 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.289 12.528 -11.142 1.00 0.00 H new ATOM 889 N ALA A 106 -6.934 9.016 -11.820 1.00 0.00 N ATOM 890 CA ALA A 106 -6.047 7.892 -12.090 1.00 0.00 C ATOM 891 C ALA A 106 -6.101 6.899 -10.944 1.00 0.00 C ATOM 892 O ALA A 106 -6.376 5.730 -11.180 1.00 0.00 O ATOM 893 CB ALA A 106 -4.605 8.338 -12.302 1.00 0.00 C ATOM 0 H ALA A 106 -6.482 9.929 -11.861 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.393 7.422 -13.010 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.980 7.467 -12.500 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.556 9.020 -13.151 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.246 8.846 -11.407 1.00 0.00 H new ATOM 899 N ALA A 107 -5.900 7.333 -9.702 1.00 0.00 N ATOM 900 CA ALA A 107 -5.924 6.370 -8.605 1.00 0.00 C ATOM 901 C ALA A 107 -7.301 5.758 -8.331 1.00 0.00 C ATOM 902 O ALA A 107 -7.395 4.564 -8.072 1.00 0.00 O ATOM 903 CB ALA A 107 -5.400 7.055 -7.378 1.00 0.00 C ATOM 0 H ALA A 107 -5.726 8.302 -9.436 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.297 5.527 -8.894 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.407 6.357 -6.541 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.380 7.395 -7.559 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.032 7.911 -7.142 1.00 0.00 H new ATOM 909 N ASN A 108 -8.375 6.541 -8.437 1.00 0.00 N ATOM 910 CA ASN A 108 -9.733 6.017 -8.369 1.00 0.00 C ATOM 911 C ASN A 108 -9.956 4.923 -9.425 1.00 0.00 C ATOM 912 O ASN A 108 -10.403 3.828 -9.087 1.00 0.00 O ATOM 913 CB ASN A 108 -10.715 7.182 -8.501 1.00 0.00 C ATOM 914 CG ASN A 108 -12.153 6.707 -8.389 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.605 6.266 -7.344 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.918 6.764 -9.459 1.00 0.00 N ATOM 0 H ASN A 108 -8.325 7.551 -8.572 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.903 5.536 -7.406 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.512 7.921 -7.726 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.567 7.678 -9.460 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.884 6.440 -9.413 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.544 7.132 -10.334 1.00 0.00 H new ATOM 923 N THR A 109 -9.575 5.163 -10.681 1.00 0.00 N ATOM 924 CA THR A 109 -9.626 4.127 -11.715 1.00 0.00 C ATOM 925 C THR A 109 -8.658 2.985 -11.403 1.00 0.00 C ATOM 926 O THR A 109 -9.010 1.839 -11.651 1.00 0.00 O ATOM 927 CB THR A 109 -9.426 4.716 -13.129 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.402 4.168 -13.993 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.072 4.444 -13.777 1.00 0.00 C ATOM 0 H THR A 109 -9.228 6.065 -11.007 1.00 0.00 H new ATOM 0 HA THR A 109 -10.628 3.697 -11.708 1.00 0.00 H new ATOM 0 HB THR A 109 -9.503 5.795 -12.992 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.286 4.536 -14.894 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.043 4.903 -14.765 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.281 4.866 -13.157 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.924 3.368 -13.872 1.00 0.00 H new ATOM 937 N MET A 110 -7.484 3.252 -10.808 1.00 0.00 N ATOM 938 CA MET A 110 -6.446 2.258 -10.538 1.00 0.00 C ATOM 939 C MET A 110 -6.919 1.262 -9.478 1.00 0.00 C ATOM 940 O MET A 110 -6.839 0.052 -9.656 1.00 0.00 O ATOM 941 CB MET A 110 -5.097 2.901 -10.113 1.00 0.00 C ATOM 942 CG MET A 110 -3.997 1.925 -10.562 1.00 0.00 C ATOM 943 SD MET A 110 -2.273 2.355 -10.238 1.00 0.00 S ATOM 944 CE MET A 110 -2.368 2.810 -8.505 1.00 0.00 C ATOM 0 H MET A 110 -7.229 4.189 -10.496 1.00 0.00 H new ATOM 0 HA MET A 110 -6.266 1.729 -11.474 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.966 3.877 -10.581 1.00 0.00 H new ATOM 0 HB3 MET A 110 -5.063 3.057 -9.035 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.193 0.964 -10.086 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.105 1.777 -11.637 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.376 3.086 -8.146 1.00 0.00 H new ATOM 0 HE2 MET A 110 -3.045 3.657 -8.388 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.741 1.965 -7.927 1.00 0.00 H new ATOM 954 N VAL A 111 -7.459 1.776 -8.372 1.00 0.00 N ATOM 955 CA VAL A 111 -8.000 0.988 -7.264 1.00 0.00 C ATOM 956 C VAL A 111 -9.235 0.194 -7.684 1.00 0.00 C ATOM 957 O VAL A 111 -9.356 -0.974 -7.335 1.00 0.00 O ATOM 958 CB VAL A 111 -8.265 1.900 -6.053 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.655 2.509 -5.967 1.00 0.00 C ATOM 960 CG2 VAL A 111 -8.021 1.134 -4.753 1.00 0.00 C ATOM 0 H VAL A 111 -7.534 2.782 -8.218 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.259 0.247 -6.966 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.570 2.727 -6.196 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.725 3.131 -5.075 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.840 3.120 -6.851 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.398 1.713 -5.914 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.212 1.789 -3.903 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.690 0.275 -4.706 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.987 0.791 -4.722 1.00 0.00 H new ATOM 970 N ASN A 112 -10.126 0.789 -8.484 1.00 0.00 N ATOM 971 CA ASN A 112 -11.323 0.118 -8.997 1.00 0.00 C ATOM 972 C ASN A 112 -10.941 -0.991 -9.986 1.00 0.00 C ATOM 973 O ASN A 112 -11.393 -2.126 -9.847 1.00 0.00 O ATOM 974 CB ASN A 112 -12.273 1.155 -9.615 1.00 0.00 C ATOM 975 CG ASN A 112 -13.111 1.867 -8.559 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.313 1.674 -8.467 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.524 2.688 -7.715 1.00 0.00 N ATOM 0 H ASN A 112 -10.035 1.756 -8.795 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.851 -0.366 -8.175 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.693 1.890 -10.173 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.933 0.661 -10.329 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -13.073 3.156 -6.993 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.520 2.857 -7.782 1.00 0.00 H new ATOM 984 N TYR A 113 -10.020 -0.706 -10.909 1.00 0.00 N ATOM 985 CA TYR A 113 -9.345 -1.679 -11.767 1.00 0.00 C ATOM 986 C TYR A 113 -8.742 -2.849 -10.969 1.00 0.00 C ATOM 987 O TYR A 113 -8.880 -3.996 -11.377 1.00 0.00 O ATOM 988 CB TYR A 113 -8.278 -0.957 -12.606 1.00 0.00 C ATOM 989 CG TYR A 113 -7.252 -1.864 -13.237 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.578 -2.583 -14.398 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.979 -1.988 -12.652 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.653 -3.496 -14.939 1.00 0.00 C ATOM 993 CE2 TYR A 113 -5.069 -2.926 -13.171 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.398 -3.682 -14.319 1.00 0.00 C ATOM 995 OH TYR A 113 -4.510 -4.573 -14.841 1.00 0.00 O ATOM 0 H TYR A 113 -9.712 0.250 -11.086 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.086 -2.124 -12.431 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.776 -0.391 -13.393 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.764 -0.235 -11.972 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.536 -2.436 -14.875 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.703 -1.368 -11.812 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.903 -4.055 -15.829 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -4.113 -3.070 -12.690 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.695 -4.580 -14.297 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.174 -2.628 -9.785 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.546 -3.679 -8.986 1.00 0.00 C ATOM 1007 C TYR A 114 -8.521 -4.373 -8.053 1.00 0.00 C ATOM 1008 O TYR A 114 -8.278 -5.496 -7.613 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.364 -3.117 -8.214 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.120 -2.894 -9.034 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.624 -3.933 -9.847 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.397 -1.699 -8.877 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.357 -3.802 -10.435 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.147 -1.549 -9.495 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.619 -2.608 -10.259 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.408 -2.461 -10.845 1.00 0.00 O ATOM 0 H TYR A 114 -8.136 -1.707 -9.349 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.191 -4.440 -9.681 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.660 -2.169 -7.764 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.126 -3.797 -7.396 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.214 -4.822 -10.016 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.804 -0.896 -8.280 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.946 -4.611 -11.021 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.593 -0.628 -9.386 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.041 -1.581 -10.621 1.00 0.00 H new ATOM 1026 N THR A 115 -9.672 -3.740 -7.834 1.00 0.00 N ATOM 1027 CA THR A 115 -10.816 -4.325 -7.149 1.00 0.00 C ATOM 1028 C THR A 115 -11.587 -5.248 -8.112 1.00 0.00 C ATOM 1029 O THR A 115 -12.297 -6.162 -7.694 1.00 0.00 O ATOM 1030 CB THR A 115 -11.671 -3.214 -6.508 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.898 -2.557 -5.526 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.935 -3.706 -5.799 1.00 0.00 C ATOM 0 H THR A 115 -9.836 -2.780 -8.138 1.00 0.00 H new ATOM 0 HA THR A 115 -10.489 -4.960 -6.325 1.00 0.00 H new ATOM 0 HB THR A 115 -11.978 -2.573 -7.334 1.00 0.00 H new ATOM 0 HG1 THR A 115 -10.273 -1.940 -5.961 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.472 -2.855 -5.380 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.576 -4.222 -6.514 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.659 -4.392 -4.998 1.00 0.00 H new ATOM 1040 N SER A 116 -11.353 -5.064 -9.417 1.00 0.00 N ATOM 1041 CA SER A 116 -11.747 -5.890 -10.554 1.00 0.00 C ATOM 1042 C SER A 116 -10.793 -7.077 -10.751 1.00 0.00 C ATOM 1043 O SER A 116 -11.211 -8.237 -10.748 1.00 0.00 O ATOM 1044 CB SER A 116 -11.692 -5.003 -11.811 1.00 0.00 C ATOM 1045 OG SER A 116 -12.939 -4.972 -12.488 1.00 0.00 O ATOM 0 H SER A 116 -10.828 -4.247 -9.730 1.00 0.00 H new ATOM 0 HA SER A 116 -12.746 -6.288 -10.375 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.406 -3.990 -11.529 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.921 -5.376 -12.486 1.00 0.00 H new ATOM 0 HG SER A 116 -12.867 -4.398 -13.279 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.513 -6.767 -10.993 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.585 -7.628 -11.738 1.00 0.00 C ATOM 1053 C VAL A 117 -7.853 -8.637 -10.841 1.00 0.00 C ATOM 1054 O VAL A 117 -7.794 -9.828 -11.143 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.607 -6.736 -12.549 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.352 -6.299 -11.841 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -7.232 -7.379 -13.874 1.00 0.00 C ATOM 0 H VAL A 117 -9.086 -5.898 -10.672 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.163 -8.241 -12.430 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.186 -5.826 -12.704 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.752 -5.682 -12.511 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.616 -5.721 -10.955 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.778 -7.176 -11.544 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.546 -6.726 -14.414 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.749 -8.339 -13.689 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -8.131 -7.534 -14.470 1.00 0.00 H new ATOM 1067 N THR A 118 -7.317 -8.116 -9.735 1.00 0.00 N ATOM 1068 CA THR A 118 -6.104 -8.514 -8.993 1.00 0.00 C ATOM 1069 C THR A 118 -4.888 -8.840 -9.891 1.00 0.00 C ATOM 1070 O THR A 118 -5.006 -9.666 -10.798 1.00 0.00 O ATOM 1071 CB THR A 118 -6.364 -9.653 -7.992 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.621 -9.530 -7.355 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.319 -9.573 -6.880 1.00 0.00 C ATOM 0 H THR A 118 -7.766 -7.319 -9.284 1.00 0.00 H new ATOM 0 HA THR A 118 -5.837 -7.622 -8.427 1.00 0.00 H new ATOM 0 HB THR A 118 -6.326 -10.587 -8.552 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.745 -10.274 -6.730 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.490 -10.375 -6.162 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.322 -9.677 -7.309 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.398 -8.610 -6.375 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.703 -8.211 -9.705 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.597 -8.366 -10.657 1.00 0.00 C ATOM 1083 C PRO A 119 -1.954 -9.755 -10.644 1.00 0.00 C ATOM 1084 O PRO A 119 -1.576 -10.266 -11.698 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.569 -7.284 -10.313 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.899 -6.839 -8.891 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.345 -7.272 -8.649 1.00 0.00 C ATOM 0 HA PRO A 119 -2.985 -8.256 -11.670 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.553 -7.675 -10.375 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.632 -6.448 -11.010 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.226 -7.302 -8.169 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.790 -5.760 -8.783 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.447 -7.739 -7.670 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.011 -6.409 -8.661 1.00 0.00 H new ATOM 1095 N VAL A 120 -1.882 -10.362 -9.453 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.297 -11.671 -9.124 1.00 0.00 C ATOM 1097 C VAL A 120 0.147 -11.814 -9.593 1.00 0.00 C ATOM 1098 O VAL A 120 0.480 -11.986 -10.767 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.171 -12.847 -9.532 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.697 -14.106 -8.805 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.635 -12.563 -9.176 1.00 0.00 C ATOM 0 H VAL A 120 -2.264 -9.912 -8.621 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.262 -11.702 -8.035 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.093 -12.996 -10.609 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.322 -14.951 -9.095 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.661 -14.312 -9.072 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -1.770 -13.954 -7.728 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.253 -13.411 -9.472 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -3.724 -12.407 -8.101 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -3.970 -11.669 -9.701 1.00 0.00 H new ATOM 1111 N LEU A 121 1.016 -11.670 -8.606 1.00 0.00 N ATOM 1112 CA LEU A 121 2.344 -11.089 -8.761 1.00 0.00 C ATOM 1113 C LEU A 121 3.375 -12.108 -8.266 1.00 0.00 C ATOM 1114 O LEU A 121 4.064 -12.734 -9.072 1.00 0.00 O ATOM 1115 CB LEU A 121 2.326 -9.732 -8.025 1.00 0.00 C ATOM 1116 CG LEU A 121 3.550 -8.816 -8.244 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.472 -7.677 -7.227 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.909 -9.510 -8.097 1.00 0.00 C ATOM 0 H LEU A 121 0.814 -11.961 -7.649 1.00 0.00 H new ATOM 0 HA LEU A 121 2.628 -10.879 -9.792 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.433 -9.188 -8.333 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.230 -9.924 -6.956 1.00 0.00 H new ATOM 0 HG LEU A 121 3.501 -8.472 -9.277 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.326 -7.013 -7.359 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.549 -7.117 -7.378 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.485 -8.089 -6.218 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.707 -8.787 -8.268 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.001 -9.921 -7.091 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.987 -10.316 -8.827 1.00 0.00 H new ATOM 1130 N ARG A 122 3.434 -12.318 -6.942 1.00 0.00 N ATOM 1131 CA ARG A 122 4.234 -13.386 -6.324 1.00 0.00 C ATOM 1132 C ARG A 122 3.758 -14.769 -6.785 1.00 0.00 C ATOM 1133 O ARG A 122 4.568 -15.639 -7.100 1.00 0.00 O ATOM 1134 CB ARG A 122 4.202 -13.217 -4.792 1.00 0.00 C ATOM 1135 CG ARG A 122 5.412 -13.883 -4.130 1.00 0.00 C ATOM 1136 CD ARG A 122 5.206 -15.387 -3.882 1.00 0.00 C ATOM 1137 NE ARG A 122 6.455 -16.151 -4.059 1.00 0.00 N ATOM 1138 CZ ARG A 122 7.430 -16.346 -3.187 1.00 0.00 C ATOM 1139 NH1 ARG A 122 7.394 -15.855 -1.981 1.00 0.00 N ATOM 1140 NH2 ARG A 122 8.476 -17.047 -3.519 1.00 0.00 N ATOM 0 H ARG A 122 2.925 -11.748 -6.266 1.00 0.00 H new ATOM 0 HA ARG A 122 5.272 -13.308 -6.648 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.187 -12.156 -4.542 1.00 0.00 H new ATOM 0 HB3 ARG A 122 3.284 -13.651 -4.396 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.289 -13.741 -4.761 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.619 -13.388 -3.181 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.828 -15.540 -2.871 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.448 -15.767 -4.567 1.00 0.00 H new ATOM 0 HE ARG A 122 6.584 -16.586 -4.973 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.594 -15.298 -1.681 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.166 -16.027 -1.337 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.545 -17.448 -4.454 1.00 0.00 H new ATOM 0 HH22 ARG A 122 9.226 -17.195 -2.844 1.00 0.00 H new ATOM 1154 N GLY A 123 2.435 -14.943 -6.839 1.00 0.00 N ATOM 1155 CA GLY A 123 1.766 -16.138 -7.373 1.00 0.00 C ATOM 1156 C GLY A 123 0.330 -16.381 -6.894 1.00 0.00 C ATOM 1157 O GLY A 123 -0.288 -17.349 -7.341 1.00 0.00 O ATOM 0 H GLY A 123 1.779 -14.238 -6.504 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.757 -16.068 -8.461 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.366 -17.011 -7.114 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.217 -15.549 -5.999 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.579 -15.647 -5.482 1.00 0.00 C ATOM 1163 C GLN A 124 -2.152 -14.255 -5.155 1.00 0.00 C ATOM 1164 O GLN A 124 -1.399 -13.284 -5.233 1.00 0.00 O ATOM 1165 CB GLN A 124 -1.566 -16.617 -4.281 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.916 -16.032 -3.016 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.829 -17.063 -1.892 1.00 0.00 C ATOM 1168 OE1 GLN A 124 0.187 -17.714 -1.684 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -1.883 -17.265 -1.124 1.00 0.00 N ATOM 0 H GLN A 124 0.299 -14.763 -5.604 1.00 0.00 H new ATOM 0 HA GLN A 124 -2.254 -16.053 -6.236 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -2.591 -16.908 -4.050 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -1.033 -17.525 -4.565 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.084 -15.671 -3.256 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.493 -15.172 -2.676 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -2.738 -16.732 -1.282 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -1.842 -17.954 -0.373 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.462 -14.114 -4.867 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.148 -12.827 -4.823 1.00 0.00 C ATOM 1180 C PRO A 125 -3.493 -11.728 -3.969 1.00 0.00 C ATOM 1181 O PRO A 125 -3.383 -11.832 -2.746 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.580 -13.137 -4.382 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.814 -14.512 -5.000 1.00 0.00 C ATOM 1184 CD PRO A 125 -4.454 -15.184 -4.814 1.00 0.00 C ATOM 0 HA PRO A 125 -4.099 -12.376 -5.814 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.677 -13.156 -3.297 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.290 -12.397 -4.753 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.610 -15.057 -4.492 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.094 -14.444 -6.051 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -4.407 -15.712 -3.861 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -4.274 -15.921 -5.596 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.077 -10.659 -4.649 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.519 -9.420 -4.075 1.00 0.00 C ATOM 1194 C ILE A 126 -3.663 -8.575 -3.489 1.00 0.00 C ATOM 1195 O ILE A 126 -4.788 -8.631 -3.984 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.723 -8.633 -5.153 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -0.956 -9.530 -6.153 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.715 -7.670 -4.517 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.016 -10.557 -5.519 1.00 0.00 C ATOM 0 H ILE A 126 -3.120 -10.626 -5.668 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.823 -9.666 -3.273 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.488 -8.087 -5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.681 -10.058 -6.772 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.375 -8.891 -6.818 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.177 -7.137 -5.301 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.243 -6.954 -3.888 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.007 -8.234 -3.909 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.473 -11.135 -6.303 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.738 -10.042 -4.924 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.589 -11.227 -4.878 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.409 -7.783 -2.448 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.441 -6.995 -1.762 1.00 0.00 C ATOM 1213 C TYR A 127 -4.188 -5.489 -1.943 1.00 0.00 C ATOM 1214 O TYR A 127 -3.060 -5.030 -1.780 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.423 -7.334 -0.265 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.907 -8.683 0.241 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -5.298 -9.741 -0.602 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.912 -8.876 1.637 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -5.695 -10.976 -0.052 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.312 -10.106 2.192 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.703 -11.164 1.348 1.00 0.00 C ATOM 1222 OH TYR A 127 -6.059 -12.361 1.891 1.00 0.00 O ATOM 0 H TYR A 127 -2.476 -7.667 -2.052 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.412 -7.240 -2.193 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.394 -7.216 0.076 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.016 -6.572 0.241 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.294 -9.605 -1.673 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.605 -8.071 2.288 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -5.995 -11.783 -0.704 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.319 -10.239 3.264 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.005 -12.306 2.868 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.233 -4.701 -2.222 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.178 -3.239 -2.349 1.00 0.00 C ATOM 1234 C ILE A 128 -6.304 -2.539 -1.558 1.00 0.00 C ATOM 1235 O ILE A 128 -7.414 -3.066 -1.457 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.179 -2.893 -3.866 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.853 -2.200 -4.209 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.405 -2.079 -4.330 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.692 -1.866 -5.695 1.00 0.00 C ATOM 0 H ILE A 128 -6.170 -5.075 -2.370 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.261 -2.857 -1.900 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.265 -3.826 -4.422 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.775 -1.280 -3.630 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.028 -2.842 -3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.327 -1.881 -5.399 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.314 -2.646 -4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.441 -1.134 -3.788 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.730 -1.379 -5.856 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.736 -2.784 -6.281 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.494 -1.197 -6.007 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.039 -1.323 -1.069 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.016 -0.250 -0.789 1.00 0.00 C ATOM 1253 C GLN A 129 -6.321 1.120 -0.885 1.00 0.00 C ATOM 1254 O GLN A 129 -5.096 1.208 -0.829 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.651 -0.378 0.617 1.00 0.00 C ATOM 1256 CG GLN A 129 -9.004 -1.106 0.617 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.718 -0.985 1.963 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.129 -1.075 3.033 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -11.022 -0.792 1.979 1.00 0.00 N ATOM 0 H GLN A 129 -5.086 -1.039 -0.843 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.810 -0.342 -1.531 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.961 -0.911 1.271 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.784 0.618 1.039 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.638 -0.694 -0.168 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.849 -2.159 0.382 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.537 -0.713 1.102 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.516 -0.721 2.868 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.084 2.214 -0.969 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.549 3.570 -0.804 1.00 0.00 C ATOM 1270 C PHE A 130 -5.756 3.739 0.510 1.00 0.00 C ATOM 1271 O PHE A 130 -6.012 3.061 1.511 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.700 4.577 -0.865 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.055 5.082 -2.251 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.118 5.838 -2.976 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.351 4.897 -2.774 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.475 6.421 -4.203 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.711 5.493 -3.997 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.774 6.259 -4.710 1.00 0.00 C ATOM 0 H PHE A 130 -8.087 2.186 -1.153 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.847 3.753 -1.617 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.586 4.116 -0.427 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.444 5.433 -0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.119 5.971 -2.588 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.069 4.297 -2.235 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.748 6.996 -4.758 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.709 5.361 -4.388 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.052 6.722 -5.645 1.00 0.00 H new ATOM 1288 N SER A 131 -4.791 4.662 0.511 1.00 0.00 N ATOM 1289 CA SER A 131 -3.940 4.948 1.669 1.00 0.00 C ATOM 1290 C SER A 131 -4.654 5.771 2.753 1.00 0.00 C ATOM 1291 O SER A 131 -5.606 6.513 2.483 1.00 0.00 O ATOM 1292 CB SER A 131 -2.653 5.637 1.200 1.00 0.00 C ATOM 1293 OG SER A 131 -1.852 6.125 2.257 1.00 0.00 O ATOM 0 H SER A 131 -4.576 5.239 -0.302 1.00 0.00 H new ATOM 0 HA SER A 131 -3.692 3.997 2.140 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.069 4.932 0.609 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.914 6.465 0.542 1.00 0.00 H new ATOM 0 HG SER A 131 -1.049 6.550 1.890 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.149 5.689 3.986 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.501 6.551 5.116 1.00 0.00 C ATOM 1301 C ASN A 132 -4.020 8.015 4.954 1.00 0.00 C ATOM 1302 O ASN A 132 -4.446 8.880 5.723 1.00 0.00 O ATOM 1303 CB ASN A 132 -3.903 5.939 6.399 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.468 4.574 6.754 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.646 4.288 6.600 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.651 3.694 7.287 1.00 0.00 N ATOM 0 H ASN A 132 -3.452 4.988 4.235 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.589 6.598 5.167 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -2.823 5.854 6.279 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.079 6.621 7.231 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.001 2.779 7.569 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.667 3.926 7.418 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.152 8.307 3.978 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.456 9.591 3.811 1.00 0.00 C ATOM 1315 C HIS A 133 -2.779 10.279 2.467 1.00 0.00 C ATOM 1316 O HIS A 133 -3.562 9.777 1.654 1.00 0.00 O ATOM 1317 CB HIS A 133 -0.944 9.371 3.981 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.557 8.511 5.163 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.401 8.907 6.478 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.291 7.174 5.103 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.036 7.821 7.190 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.063 6.750 6.385 1.00 0.00 N ATOM 0 H HIS A 133 -2.905 7.631 3.255 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.815 10.272 4.582 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.553 8.912 3.073 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.459 10.342 4.082 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.345 6.554 4.220 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.150 7.814 8.254 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.343 5.808 6.658 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.158 11.446 2.230 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.272 12.281 1.022 1.00 0.00 C ATOM 1332 C LYS A 134 -0.892 12.798 0.589 1.00 0.00 C ATOM 1333 O LYS A 134 -0.209 13.440 1.381 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.247 13.437 1.323 1.00 0.00 C ATOM 1335 CG LYS A 134 -3.446 14.389 0.131 1.00 0.00 C ATOM 1336 CD LYS A 134 -4.510 15.449 0.446 1.00 0.00 C ATOM 1337 CE LYS A 134 -4.702 16.377 -0.757 1.00 0.00 C ATOM 1338 NZ LYS A 134 -5.738 17.407 -0.485 1.00 0.00 N ATOM 0 H LYS A 134 -1.525 11.856 2.917 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.661 11.693 0.191 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -4.212 13.023 1.614 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -2.874 14.005 2.175 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -2.502 14.877 -0.111 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -3.745 13.819 -0.749 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -5.454 14.965 0.696 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -4.209 16.029 1.318 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -3.757 16.864 -0.998 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.990 15.790 -1.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -5.845 18.020 -1.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -6.645 16.941 -0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -5.450 17.981 0.333 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.520 12.535 -0.664 1.00 0.00 N ATOM 1353 CA GLU A 135 0.755 12.894 -1.308 1.00 0.00 C ATOM 1354 C GLU A 135 1.995 12.328 -0.596 1.00 0.00 C ATOM 1355 O GLU A 135 2.556 12.916 0.334 1.00 0.00 O ATOM 1356 CB GLU A 135 0.844 14.396 -1.580 1.00 0.00 C ATOM 1357 CG GLU A 135 1.983 14.731 -2.552 1.00 0.00 C ATOM 1358 CD GLU A 135 1.827 16.156 -3.115 1.00 0.00 C ATOM 1359 OE1 GLU A 135 2.288 17.129 -2.472 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.245 16.295 -4.220 1.00 0.00 O ATOM 0 H GLU A 135 -1.138 12.033 -1.302 1.00 0.00 H new ATOM 0 HA GLU A 135 0.757 12.397 -2.278 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.102 14.748 -1.993 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.999 14.927 -0.641 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.941 14.641 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.991 14.011 -3.371 1.00 0.00 H new ATOM 1367 N LEU A 136 2.424 11.155 -1.058 1.00 0.00 N ATOM 1368 CA LEU A 136 3.599 10.418 -0.568 1.00 0.00 C ATOM 1369 C LEU A 136 4.907 11.194 -0.818 1.00 0.00 C ATOM 1370 O LEU A 136 5.368 11.307 -1.958 1.00 0.00 O ATOM 1371 CB LEU A 136 3.607 9.022 -1.209 1.00 0.00 C ATOM 1372 CG LEU A 136 4.894 8.202 -1.054 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.247 7.934 0.398 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.758 6.869 -1.762 1.00 0.00 C ATOM 0 H LEU A 136 1.946 10.667 -1.816 1.00 0.00 H new ATOM 0 HA LEU A 136 3.534 10.304 0.514 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.784 8.447 -0.784 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.401 9.135 -2.273 1.00 0.00 H new ATOM 0 HG LEU A 136 5.691 8.799 -1.498 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.166 7.350 0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.390 8.881 0.918 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.438 7.378 0.872 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.679 6.298 -1.643 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.927 6.311 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.570 7.038 -2.822 1.00 0.00 H new ATOM 1386 N LYS A 137 5.530 11.672 0.263 1.00 0.00 N ATOM 1387 CA LYS A 137 6.837 12.350 0.285 1.00 0.00 C ATOM 1388 C LYS A 137 7.905 11.434 0.896 1.00 0.00 C ATOM 1389 O LYS A 137 7.976 11.273 2.114 1.00 0.00 O ATOM 1390 CB LYS A 137 6.723 13.693 1.029 1.00 0.00 C ATOM 1391 CG LYS A 137 5.877 14.712 0.243 1.00 0.00 C ATOM 1392 CD LYS A 137 5.677 16.035 0.998 1.00 0.00 C ATOM 1393 CE LYS A 137 6.988 16.819 1.146 1.00 0.00 C ATOM 1394 NZ LYS A 137 6.762 18.139 1.791 1.00 0.00 N ATOM 0 H LYS A 137 5.120 11.595 1.194 1.00 0.00 H new ATOM 0 HA LYS A 137 7.150 12.568 -0.736 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.276 13.529 2.009 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.720 14.101 1.198 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.359 14.915 -0.713 1.00 0.00 H new ATOM 0 HG3 LYS A 137 4.903 14.275 0.023 1.00 0.00 H new ATOM 0 HD2 LYS A 137 4.947 16.647 0.469 1.00 0.00 H new ATOM 0 HD3 LYS A 137 5.265 15.829 1.986 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.695 16.239 1.739 1.00 0.00 H new ATOM 0 HE3 LYS A 137 7.439 16.965 0.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.668 18.643 1.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 6.106 18.701 1.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.354 17.998 2.737 1.00 0.00 H new