USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1051 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 17 HIS : no HD1:sc= -0.665 K(o=-1.7,f=-12!) USER MOD Set 1.2: B 85 ASN : amide:sc= -1.04 K(o=-1.7,f=-1.1) USER MOD Set 2.1: B 71 GLN : amide:sc= 0.151 K(o=1.8,f=-1) USER MOD Set 2.2: B 75 THR OG1 : rot 73:sc= 1.62 USER MOD Set 3.1: B 35 LYS NZ :NH3+ 167:sc= 0.741 (180deg=1.11) USER MOD Set 3.2: B 66 GLN : amide:sc= 0.808 K(o=1.5,f=0.86) USER MOD Set 4.1: B 27 HIS : no HE2:sc= -0.573 K(o=1.2,f=-2.6!) USER MOD Set 4.2: B 28 THR OG1 : rot 116:sc= 1.29 USER MOD Set 4.3: B 30 SER OG : rot -78:sc= 0.451 USER MOD Set 5.1: B 20 SER OG : rot 60:sc= 0.735 USER MOD Set 5.2: B 26 LYS NZ :NH3+ 176:sc= 2.59 (180deg=1.19) USER MOD Set 6.1: B 19 TYR OH : rot 30:sc= 1.07 USER MOD Set 6.2: B 40 LYS NZ :NH3+ -170:sc= 1.83 (180deg=0.433) USER MOD Set 7.1: A 71 GLN : amide:sc= 0.485 K(o=2.3,f=0.95) USER MOD Set 7.2: A 75 THR OG1 : rot 68:sc= 1.82 USER MOD Set 8.1: A 69 ASN : amide:sc= 1.23 K(o=1.2,f=-4.5!) USER MOD Set 8.2: B 82 MET CE :methyl 159:sc= -0.0619 (180deg=-0.323) USER MOD Set 9.1: A 63 ASN : amide:sc= 1.4 K(o=4.4,f=-0.44!) USER MOD Set 9.2: A 66 GLN : amide:sc= 2.98 K(o=4.4,f=-6.7!) USER MOD Set10.1: A 27 HIS : no HE2:sc= 0.174 K(o=1.7,f=-6.4!) USER MOD Set10.2: A 28 THR OG1 : rot 38:sc= 1.56 USER MOD Single : A 18 LYS NZ :NH3+ 151:sc= 1.08 (180deg=-0.44) USER MOD Single : A 19 TYR OH : rot 156:sc= 0.55 USER MOD Single : A 20 SER OG : rot 12:sc= 0.791 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 87:sc= 0.00923 USER MOD Single : A 31 LYS NZ :NH3+ 167:sc= 2.52 (180deg=2.15) USER MOD Single : A 32 LYS NZ :NH3+ 164:sc= 0.917 (180deg=-0.332!) USER MOD Single : A 35 LYS NZ :NH3+ 171:sc= 0.623 (180deg=0.203!) USER MOD Single : A 39 GLN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 153:sc= 1.82 (180deg=-1.06!) USER MOD Single : A 43 THR OG1 : rot 65:sc= 0.922 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 160:sc= 2.24 (180deg=1.24!) USER MOD Single : A 73 TYR OH : rot 180:sc= -0.125 USER MOD Single : A 82 MET CE :methyl 173:sc= 0 (180deg=-0.0702) USER MOD Single : A 84 TYR OH : rot 180:sc= -0.582 USER MOD Single : A 85 ASN : amide:sc= 0.366! K(o=0.37!,f=-0.18) USER MOD Single : B 17 HIS : no HE2:sc= -4.16! C(o=-4.2!,f=-6.1!) USER MOD Single : B 18 LYS NZ :NH3+ -173:sc= 0.925 (180deg=0.494) USER MOD Single : B 31 LYS NZ :NH3+ -176:sc= 2.37 (180deg=2.16) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0.586 (180deg=0.586) USER MOD Single : B 39 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.13) USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.0524 USER MOD Single : B 63 ASN : amide:sc= 1.22 K(o=1.2,f=-0.11) USER MOD Single : B 64 LYS NZ :NH3+ -158:sc= 2.47 (180deg=1.49!) USER MOD Single : B 69 ASN : amide:sc= 1.73 K(o=1.7,f=-4.8!) USER MOD Single : B 73 TYR OH : rot 143:sc= 1.11 USER MOD Single : B 84 TYR OH : rot -152:sc= 1.3 USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 4.266 -7.616 -8.053 1.00 0.00 N ATOM 114 CA ILE A 9 3.305 -7.104 -7.082 1.00 0.00 C ATOM 115 C ILE A 9 3.980 -6.937 -5.718 1.00 0.00 C ATOM 116 O ILE A 9 4.041 -5.831 -5.173 1.00 0.00 O ATOM 117 CB ILE A 9 2.093 -8.058 -7.018 1.00 0.00 C ATOM 118 CG1 ILE A 9 1.279 -7.977 -8.322 1.00 0.00 C ATOM 119 CG2 ILE A 9 1.183 -7.812 -5.805 1.00 0.00 C ATOM 120 CD1 ILE A 9 0.381 -9.204 -8.503 1.00 0.00 C ATOM 0 HA ILE A 9 2.946 -6.121 -7.387 1.00 0.00 H new ATOM 0 HB ILE A 9 2.499 -9.062 -6.898 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.667 -7.075 -8.314 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.958 -7.894 -9.171 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.353 -8.518 -5.824 1.00 0.00 H new ATOM 0 HG22 ILE A 9 1.755 -7.949 -4.887 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.795 -6.794 -5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -0.178 -9.111 -9.434 1.00 0.00 H new ATOM 0 HD12 ILE A 9 0.996 -10.103 -8.537 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.315 -9.272 -7.667 1.00 0.00 H new ATOM 132 N GLY A 10 4.509 -8.043 -5.191 1.00 0.00 N ATOM 133 CA GLY A 10 5.216 -8.059 -3.924 1.00 0.00 C ATOM 134 C GLY A 10 6.395 -7.093 -3.957 1.00 0.00 C ATOM 135 O GLY A 10 6.599 -6.323 -3.020 1.00 0.00 O ATOM 0 H GLY A 10 4.454 -8.957 -5.641 1.00 0.00 H new ATOM 0 HA2 GLY A 10 4.536 -7.784 -3.118 1.00 0.00 H new ATOM 0 HA3 GLY A 10 5.571 -9.068 -3.712 1.00 0.00 H new ATOM 139 N LEU A 11 7.175 -7.127 -5.039 1.00 0.00 N ATOM 140 CA LEU A 11 8.362 -6.305 -5.187 1.00 0.00 C ATOM 141 C LEU A 11 8.032 -4.816 -5.071 1.00 0.00 C ATOM 142 O LEU A 11 8.648 -4.157 -4.247 1.00 0.00 O ATOM 143 CB LEU A 11 9.121 -6.648 -6.477 1.00 0.00 C ATOM 144 CG LEU A 11 9.793 -8.034 -6.441 1.00 0.00 C ATOM 145 CD1 LEU A 11 10.258 -8.418 -7.851 1.00 0.00 C ATOM 146 CD2 LEU A 11 11.013 -8.057 -5.508 1.00 0.00 C ATOM 0 H LEU A 11 6.993 -7.733 -5.839 1.00 0.00 H new ATOM 0 HA LEU A 11 9.035 -6.534 -4.361 1.00 0.00 H new ATOM 0 HB2 LEU A 11 8.429 -6.610 -7.318 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.882 -5.888 -6.655 1.00 0.00 H new ATOM 0 HG LEU A 11 9.054 -8.742 -6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 11 10.733 -9.399 -7.823 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.399 -8.450 -8.521 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.973 -7.679 -8.212 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.456 -9.053 -5.513 1.00 0.00 H new ATOM 0 HD22 LEU A 11 11.749 -7.331 -5.853 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.701 -7.804 -4.495 1.00 0.00 H new ATOM 158 N LEU A 12 7.081 -4.259 -5.833 1.00 0.00 N ATOM 159 CA LEU A 12 6.719 -2.839 -5.707 1.00 0.00 C ATOM 160 C LEU A 12 6.468 -2.468 -4.241 1.00 0.00 C ATOM 161 O LEU A 12 7.057 -1.512 -3.748 1.00 0.00 O ATOM 162 CB LEU A 12 5.518 -2.488 -6.598 1.00 0.00 C ATOM 163 CG LEU A 12 5.890 -2.080 -8.043 1.00 0.00 C ATOM 164 CD1 LEU A 12 6.588 -0.722 -8.140 1.00 0.00 C ATOM 165 CD2 LEU A 12 6.713 -3.126 -8.801 1.00 0.00 C ATOM 0 H LEU A 12 6.550 -4.767 -6.541 1.00 0.00 H new ATOM 0 HA LEU A 12 7.562 -2.243 -6.057 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.848 -3.346 -6.637 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.964 -1.672 -6.135 1.00 0.00 H new ATOM 0 HG LEU A 12 4.917 -2.004 -8.529 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.818 -0.505 -9.183 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.932 0.053 -7.744 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.512 -0.746 -7.562 1.00 0.00 H new ATOM 0 HD21 LEU A 12 6.930 -2.760 -9.805 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.648 -3.308 -8.271 1.00 0.00 H new ATOM 0 HD23 LEU A 12 6.147 -4.055 -8.868 1.00 0.00 H new ATOM 177 N ILE A 13 5.631 -3.222 -3.525 1.00 0.00 N ATOM 178 CA ILE A 13 5.391 -3.006 -2.099 1.00 0.00 C ATOM 179 C ILE A 13 6.697 -3.074 -1.294 1.00 0.00 C ATOM 180 O ILE A 13 7.005 -2.156 -0.529 1.00 0.00 O ATOM 181 CB ILE A 13 4.331 -3.999 -1.581 1.00 0.00 C ATOM 182 CG1 ILE A 13 3.007 -3.726 -2.311 1.00 0.00 C ATOM 183 CG2 ILE A 13 4.140 -3.854 -0.062 1.00 0.00 C ATOM 184 CD1 ILE A 13 1.895 -4.720 -1.966 1.00 0.00 C ATOM 0 H ILE A 13 5.101 -3.999 -3.919 1.00 0.00 H new ATOM 0 HA ILE A 13 4.997 -1.999 -1.960 1.00 0.00 H new ATOM 0 HB ILE A 13 4.663 -5.018 -1.778 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.670 -2.719 -2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.184 -3.752 -3.386 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.388 -4.565 0.280 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.084 -4.054 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.812 -2.840 0.168 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.992 -4.462 -2.520 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.211 -5.728 -2.236 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.689 -4.679 -0.896 1.00 0.00 H new ATOM 196 N GLY A 14 7.446 -4.169 -1.433 1.00 0.00 N ATOM 197 CA GLY A 14 8.674 -4.406 -0.690 1.00 0.00 C ATOM 198 C GLY A 14 9.667 -3.270 -0.915 1.00 0.00 C ATOM 199 O GLY A 14 10.067 -2.598 0.031 1.00 0.00 O ATOM 0 H GLY A 14 7.209 -4.924 -2.076 1.00 0.00 H new ATOM 0 HA2 GLY A 14 8.450 -4.495 0.373 1.00 0.00 H new ATOM 0 HA3 GLY A 14 9.118 -5.351 -1.003 1.00 0.00 H new ATOM 203 N ILE A 15 10.031 -3.050 -2.179 1.00 0.00 N ATOM 204 CA ILE A 15 10.860 -1.955 -2.660 1.00 0.00 C ATOM 205 C ILE A 15 10.351 -0.650 -2.054 1.00 0.00 C ATOM 206 O ILE A 15 11.098 0.008 -1.350 1.00 0.00 O ATOM 207 CB ILE A 15 10.860 -1.928 -4.202 1.00 0.00 C ATOM 208 CG1 ILE A 15 11.545 -3.189 -4.764 1.00 0.00 C ATOM 209 CG2 ILE A 15 11.577 -0.681 -4.741 1.00 0.00 C ATOM 210 CD1 ILE A 15 11.209 -3.422 -6.241 1.00 0.00 C ATOM 0 H ILE A 15 9.736 -3.669 -2.934 1.00 0.00 H new ATOM 0 HA ILE A 15 11.895 -2.093 -2.348 1.00 0.00 H new ATOM 0 HB ILE A 15 9.820 -1.901 -4.527 1.00 0.00 H new ATOM 0 HG12 ILE A 15 12.625 -3.095 -4.649 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.237 -4.058 -4.182 1.00 0.00 H new ATOM 0 HG21 ILE A 15 11.559 -0.693 -5.831 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.071 0.214 -4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 15 12.611 -0.678 -4.395 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.715 -4.322 -6.592 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.132 -3.544 -6.354 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.541 -2.566 -6.829 1.00 0.00 H new ATOM 222 N PHE A 16 9.090 -0.288 -2.292 1.00 0.00 N ATOM 223 CA PHE A 16 8.433 0.862 -1.679 1.00 0.00 C ATOM 224 C PHE A 16 8.791 0.999 -0.188 1.00 0.00 C ATOM 225 O PHE A 16 9.390 2.000 0.209 1.00 0.00 O ATOM 226 CB PHE A 16 6.944 0.846 -2.056 1.00 0.00 C ATOM 227 CG PHE A 16 6.168 1.946 -1.407 1.00 0.00 C ATOM 228 CD1 PHE A 16 5.868 1.781 -0.057 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.079 3.216 -1.998 1.00 0.00 C ATOM 230 CE1 PHE A 16 5.924 2.891 0.782 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.862 4.333 -1.179 1.00 0.00 C ATOM 232 CZ PHE A 16 5.889 4.183 0.220 1.00 0.00 C ATOM 0 H PHE A 16 8.484 -0.801 -2.933 1.00 0.00 H new ATOM 0 HA PHE A 16 8.813 1.802 -2.080 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.848 0.930 -3.138 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.512 -0.113 -1.771 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.597 0.811 0.332 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.176 3.331 -3.067 1.00 0.00 H new ATOM 0 HE1 PHE A 16 5.994 2.763 1.852 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.675 5.302 -1.619 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.883 5.053 0.860 1.00 0.00 H new ATOM 242 N HIS A 17 8.480 0.006 0.651 1.00 0.00 N ATOM 243 CA HIS A 17 8.729 0.167 2.083 1.00 0.00 C ATOM 244 C HIS A 17 10.227 0.163 2.441 1.00 0.00 C ATOM 245 O HIS A 17 10.647 0.896 3.335 1.00 0.00 O ATOM 246 CB HIS A 17 7.894 -0.799 2.929 1.00 0.00 C ATOM 247 CG HIS A 17 6.437 -0.409 2.995 1.00 0.00 C ATOM 248 ND1 HIS A 17 5.963 0.756 3.568 1.00 0.00 N ATOM 249 CD2 HIS A 17 5.448 -0.900 2.190 1.00 0.00 C ATOM 250 CE1 HIS A 17 4.737 0.982 3.057 1.00 0.00 C ATOM 251 NE2 HIS A 17 4.363 -0.053 2.283 1.00 0.00 N ATOM 0 H HIS A 17 8.070 -0.886 0.376 1.00 0.00 H new ATOM 0 HA HIS A 17 8.383 1.167 2.345 1.00 0.00 H new ATOM 0 HB2 HIS A 17 7.978 -1.804 2.515 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.302 -0.836 3.939 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.506 -1.794 1.587 1.00 0.00 H new ATOM 0 HE1 HIS A 17 4.142 1.864 3.242 1.00 0.00 H new ATOM 0 HE2 HIS A 17 3.450 -0.186 1.848 1.00 0.00 H new ATOM 259 N LYS A 18 11.047 -0.630 1.750 1.00 0.00 N ATOM 260 CA LYS A 18 12.495 -0.651 1.954 1.00 0.00 C ATOM 261 C LYS A 18 13.120 0.691 1.552 1.00 0.00 C ATOM 262 O LYS A 18 14.084 1.151 2.172 1.00 0.00 O ATOM 263 CB LYS A 18 13.108 -1.834 1.177 1.00 0.00 C ATOM 264 CG LYS A 18 14.626 -1.756 0.926 1.00 0.00 C ATOM 265 CD LYS A 18 15.471 -1.628 2.207 1.00 0.00 C ATOM 266 CE LYS A 18 16.795 -0.879 1.971 1.00 0.00 C ATOM 267 NZ LYS A 18 16.589 0.510 1.501 1.00 0.00 N ATOM 0 H LYS A 18 10.724 -1.278 1.031 1.00 0.00 H new ATOM 0 HA LYS A 18 12.712 -0.794 3.013 1.00 0.00 H new ATOM 0 HB2 LYS A 18 12.896 -2.753 1.724 1.00 0.00 H new ATOM 0 HB3 LYS A 18 12.603 -1.913 0.214 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.940 -2.648 0.385 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.833 -0.902 0.281 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.893 -1.105 2.968 1.00 0.00 H new ATOM 0 HD3 LYS A 18 15.685 -2.623 2.597 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.369 -0.864 2.897 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.389 -1.422 1.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.384 1.103 1.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 16.535 0.521 0.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.703 0.883 1.898 1.00 0.00 H new ATOM 281 N TYR A 19 12.625 1.289 0.472 1.00 0.00 N ATOM 282 CA TYR A 19 13.121 2.539 -0.071 1.00 0.00 C ATOM 283 C TYR A 19 12.574 3.701 0.759 1.00 0.00 C ATOM 284 O TYR A 19 13.181 4.770 0.770 1.00 0.00 O ATOM 285 CB TYR A 19 12.866 2.644 -1.580 1.00 0.00 C ATOM 286 CG TYR A 19 13.814 1.840 -2.472 1.00 0.00 C ATOM 287 CD1 TYR A 19 14.074 0.475 -2.242 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.424 2.468 -3.576 1.00 0.00 C ATOM 289 CE1 TYR A 19 14.949 -0.235 -3.083 1.00 0.00 C ATOM 290 CE2 TYR A 19 15.206 1.730 -4.479 1.00 0.00 C ATOM 291 CZ TYR A 19 15.487 0.382 -4.224 1.00 0.00 C ATOM 292 OH TYR A 19 16.218 -0.347 -5.108 1.00 0.00 O ATOM 0 H TYR A 19 11.846 0.902 -0.061 1.00 0.00 H new ATOM 0 HA TYR A 19 14.207 2.581 0.012 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.845 2.319 -1.781 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.929 3.693 -1.868 1.00 0.00 H new ATOM 0 HD1 TYR A 19 13.598 -0.030 -1.414 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.289 3.528 -3.729 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.208 -1.257 -2.851 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.591 2.202 -5.371 1.00 0.00 H new ATOM 0 HH TYR A 19 16.192 0.084 -5.988 1.00 0.00 H new ATOM 302 N SER A 20 11.474 3.521 1.503 1.00 0.00 N ATOM 303 CA SER A 20 11.147 4.464 2.567 1.00 0.00 C ATOM 304 C SER A 20 12.094 4.165 3.729 1.00 0.00 C ATOM 305 O SER A 20 11.659 3.729 4.793 1.00 0.00 O ATOM 306 CB SER A 20 9.669 4.407 2.981 1.00 0.00 C ATOM 307 OG SER A 20 9.217 3.122 3.339 1.00 0.00 O ATOM 0 H SER A 20 10.815 2.751 1.389 1.00 0.00 H new ATOM 0 HA SER A 20 11.285 5.487 2.217 1.00 0.00 H new ATOM 0 HB2 SER A 20 9.513 5.082 3.823 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.059 4.778 2.158 1.00 0.00 H new ATOM 0 HG SER A 20 9.985 2.523 3.448 1.00 0.00 H new ATOM 376 N LYS A 26 8.054 4.075 8.496 1.00 0.00 N ATOM 377 CA LYS A 26 8.445 3.175 7.409 1.00 0.00 C ATOM 378 C LYS A 26 7.422 3.213 6.268 1.00 0.00 C ATOM 379 O LYS A 26 7.044 2.194 5.679 1.00 0.00 O ATOM 380 CB LYS A 26 8.716 1.770 7.974 1.00 0.00 C ATOM 381 CG LYS A 26 9.702 1.741 9.166 1.00 0.00 C ATOM 382 CD LYS A 26 11.191 1.516 8.835 1.00 0.00 C ATOM 383 CE LYS A 26 11.917 2.573 7.985 1.00 0.00 C ATOM 384 NZ LYS A 26 12.031 3.908 8.616 1.00 0.00 N ATOM 0 HA LYS A 26 9.379 3.512 6.959 1.00 0.00 H new ATOM 0 HB2 LYS A 26 7.770 1.330 8.290 1.00 0.00 H new ATOM 0 HB3 LYS A 26 9.110 1.140 7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.613 2.685 9.703 1.00 0.00 H new ATOM 0 HG3 LYS A 26 9.384 0.954 9.850 1.00 0.00 H new ATOM 0 HD2 LYS A 26 11.730 1.420 9.777 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.276 0.559 8.320 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.918 2.209 7.756 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.391 2.679 7.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.533 4.554 7.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.080 4.282 8.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.560 3.827 9.508 1.00 0.00 H new ATOM 398 N HIS A 27 6.992 4.430 5.940 1.00 0.00 N ATOM 399 CA HIS A 27 6.231 4.780 4.757 1.00 0.00 C ATOM 400 C HIS A 27 6.909 6.023 4.203 1.00 0.00 C ATOM 401 O HIS A 27 7.827 6.544 4.835 1.00 0.00 O ATOM 402 CB HIS A 27 4.758 5.050 5.097 1.00 0.00 C ATOM 403 CG HIS A 27 4.518 6.212 6.036 1.00 0.00 C ATOM 404 ND1 HIS A 27 4.929 7.531 5.873 1.00 0.00 N ATOM 405 CD2 HIS A 27 3.991 6.091 7.289 1.00 0.00 C ATOM 406 CE1 HIS A 27 4.671 8.181 7.021 1.00 0.00 C ATOM 407 NE2 HIS A 27 4.098 7.327 7.887 1.00 0.00 N ATOM 0 H HIS A 27 7.180 5.240 6.531 1.00 0.00 H new ATOM 0 HA HIS A 27 6.218 3.968 4.030 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.215 5.234 4.170 1.00 0.00 H new ATOM 0 HB3 HIS A 27 4.333 4.150 5.542 1.00 0.00 H new ATOM 0 HD1 HIS A 27 5.350 7.932 5.035 1.00 0.00 H new ATOM 0 HD2 HIS A 27 3.571 5.198 7.727 1.00 0.00 H new ATOM 0 HE1 HIS A 27 4.889 9.221 7.216 1.00 0.00 H new ATOM 415 N THR A 28 6.396 6.535 3.087 1.00 0.00 N ATOM 416 CA THR A 28 6.942 7.669 2.350 1.00 0.00 C ATOM 417 C THR A 28 8.406 7.439 1.933 1.00 0.00 C ATOM 418 O THR A 28 9.335 7.441 2.735 1.00 0.00 O ATOM 419 CB THR A 28 6.702 9.005 3.058 1.00 0.00 C ATOM 420 OG1 THR A 28 6.860 8.913 4.459 1.00 0.00 O ATOM 421 CG2 THR A 28 5.288 9.524 2.798 1.00 0.00 C ATOM 0 H THR A 28 5.554 6.155 2.655 1.00 0.00 H new ATOM 0 HA THR A 28 6.381 7.742 1.418 1.00 0.00 H new ATOM 0 HB THR A 28 7.449 9.686 2.650 1.00 0.00 H new ATOM 0 HG1 THR A 28 7.600 8.305 4.665 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.148 10.474 3.314 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.145 9.668 1.727 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.561 8.800 3.167 1.00 0.00 H new ATOM 429 N LEU A 29 8.570 7.183 0.643 1.00 0.00 N ATOM 430 CA LEU A 29 9.768 6.726 -0.032 1.00 0.00 C ATOM 431 C LEU A 29 10.860 7.797 0.031 1.00 0.00 C ATOM 432 O LEU A 29 10.606 8.970 -0.241 1.00 0.00 O ATOM 433 CB LEU A 29 9.351 6.342 -1.456 1.00 0.00 C ATOM 434 CG LEU A 29 10.224 5.262 -2.099 1.00 0.00 C ATOM 435 CD1 LEU A 29 9.448 4.671 -3.277 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.555 5.843 -2.584 1.00 0.00 C ATOM 0 H LEU A 29 7.797 7.302 -0.012 1.00 0.00 H new ATOM 0 HA LEU A 29 10.208 5.853 0.450 1.00 0.00 H new ATOM 0 HB2 LEU A 29 8.318 5.995 -1.438 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.377 7.234 -2.082 1.00 0.00 H new ATOM 0 HG LEU A 29 10.454 4.491 -1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.047 3.897 -3.756 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.515 4.237 -2.917 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.228 5.457 -3.999 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.154 5.052 -3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 29 11.365 6.622 -3.323 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.095 6.269 -1.739 1.00 0.00 H new ATOM 448 N SER A 30 12.075 7.403 0.427 1.00 0.00 N ATOM 449 CA SER A 30 13.187 8.322 0.567 1.00 0.00 C ATOM 450 C SER A 30 13.665 8.786 -0.815 1.00 0.00 C ATOM 451 O SER A 30 14.022 7.985 -1.675 1.00 0.00 O ATOM 452 CB SER A 30 14.287 7.653 1.398 1.00 0.00 C ATOM 453 OG SER A 30 13.737 7.218 2.633 1.00 0.00 O ATOM 0 H SER A 30 12.305 6.436 0.657 1.00 0.00 H new ATOM 0 HA SER A 30 12.880 9.222 1.100 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.707 6.807 0.854 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.103 8.354 1.576 1.00 0.00 H new ATOM 0 HG SER A 30 13.364 6.318 2.526 1.00 0.00 H new ATOM 459 N LYS A 31 13.656 10.103 -1.024 1.00 0.00 N ATOM 460 CA LYS A 31 13.951 10.756 -2.293 1.00 0.00 C ATOM 461 C LYS A 31 15.304 10.362 -2.901 1.00 0.00 C ATOM 462 O LYS A 31 15.453 10.359 -4.120 1.00 0.00 O ATOM 463 CB LYS A 31 13.831 12.279 -2.126 1.00 0.00 C ATOM 464 CG LYS A 31 14.443 12.850 -0.833 1.00 0.00 C ATOM 465 CD LYS A 31 13.342 13.204 0.179 1.00 0.00 C ATOM 466 CE LYS A 31 13.920 13.807 1.465 1.00 0.00 C ATOM 467 NZ LYS A 31 12.842 14.266 2.363 1.00 0.00 N ATOM 0 H LYS A 31 13.434 10.767 -0.283 1.00 0.00 H new ATOM 0 HA LYS A 31 13.211 10.404 -3.011 1.00 0.00 H new ATOM 0 HB2 LYS A 31 14.310 12.760 -2.979 1.00 0.00 H new ATOM 0 HB3 LYS A 31 12.776 12.549 -2.159 1.00 0.00 H new ATOM 0 HG2 LYS A 31 15.126 12.122 -0.395 1.00 0.00 H new ATOM 0 HG3 LYS A 31 15.031 13.738 -1.064 1.00 0.00 H new ATOM 0 HD2 LYS A 31 12.647 13.911 -0.273 1.00 0.00 H new ATOM 0 HD3 LYS A 31 12.771 12.308 0.423 1.00 0.00 H new ATOM 0 HE2 LYS A 31 14.533 13.064 1.976 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.573 14.644 1.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.236 14.464 3.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.414 15.132 1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 12.115 13.526 2.440 1.00 0.00 H new ATOM 481 N LYS A 32 16.299 10.057 -2.067 1.00 0.00 N ATOM 482 CA LYS A 32 17.587 9.557 -2.529 1.00 0.00 C ATOM 483 C LYS A 32 17.392 8.168 -3.135 1.00 0.00 C ATOM 484 O LYS A 32 17.656 7.965 -4.318 1.00 0.00 O ATOM 485 CB LYS A 32 18.582 9.600 -1.353 1.00 0.00 C ATOM 486 CG LYS A 32 19.725 8.577 -1.437 1.00 0.00 C ATOM 487 CD LYS A 32 20.799 8.796 -0.359 1.00 0.00 C ATOM 488 CE LYS A 32 20.264 8.992 1.070 1.00 0.00 C ATOM 489 NZ LYS A 32 19.300 7.952 1.489 1.00 0.00 N ATOM 0 H LYS A 32 16.231 10.151 -1.054 1.00 0.00 H new ATOM 0 HA LYS A 32 18.010 10.178 -3.319 1.00 0.00 H new ATOM 0 HB2 LYS A 32 19.012 10.600 -1.296 1.00 0.00 H new ATOM 0 HB3 LYS A 32 18.034 9.435 -0.425 1.00 0.00 H new ATOM 0 HG2 LYS A 32 19.315 7.572 -1.337 1.00 0.00 H new ATOM 0 HG3 LYS A 32 20.188 8.636 -2.422 1.00 0.00 H new ATOM 0 HD2 LYS A 32 21.474 7.940 -0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 32 21.391 9.670 -0.631 1.00 0.00 H new ATOM 0 HE2 LYS A 32 21.103 8.999 1.765 1.00 0.00 H new ATOM 0 HE3 LYS A 32 19.785 9.969 1.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 19.188 7.979 2.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 18.381 8.128 1.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 19.653 7.016 1.203 1.00 0.00 H new ATOM 503 N GLU A 33 16.908 7.227 -2.327 1.00 0.00 N ATOM 504 CA GLU A 33 16.608 5.864 -2.726 1.00 0.00 C ATOM 505 C GLU A 33 15.778 5.866 -4.018 1.00 0.00 C ATOM 506 O GLU A 33 16.054 5.099 -4.940 1.00 0.00 O ATOM 507 CB GLU A 33 15.889 5.161 -1.562 1.00 0.00 C ATOM 508 CG GLU A 33 16.795 4.774 -0.377 1.00 0.00 C ATOM 509 CD GLU A 33 17.605 5.900 0.248 1.00 0.00 C ATOM 510 OE1 GLU A 33 17.129 7.062 0.312 1.00 0.00 O ATOM 511 OE2 GLU A 33 18.749 5.631 0.675 1.00 0.00 O ATOM 0 H GLU A 33 16.709 7.405 -1.343 1.00 0.00 H new ATOM 0 HA GLU A 33 17.523 5.312 -2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 33 15.097 5.814 -1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.409 4.260 -1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 33 16.172 4.329 0.399 1.00 0.00 H new ATOM 0 HG3 GLU A 33 17.486 4.001 -0.713 1.00 0.00 H new ATOM 518 N LEU A 34 14.793 6.764 -4.120 1.00 0.00 N ATOM 519 CA LEU A 34 14.013 6.943 -5.341 1.00 0.00 C ATOM 520 C LEU A 34 14.900 7.029 -6.591 1.00 0.00 C ATOM 521 O LEU A 34 14.586 6.406 -7.606 1.00 0.00 O ATOM 522 CB LEU A 34 13.126 8.191 -5.251 1.00 0.00 C ATOM 523 CG LEU A 34 12.054 8.165 -6.354 1.00 0.00 C ATOM 524 CD1 LEU A 34 10.798 7.414 -5.897 1.00 0.00 C ATOM 525 CD2 LEU A 34 11.689 9.583 -6.780 1.00 0.00 C ATOM 0 H LEU A 34 14.517 7.384 -3.359 1.00 0.00 H new ATOM 0 HA LEU A 34 13.382 6.060 -5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 34 12.649 8.237 -4.272 1.00 0.00 H new ATOM 0 HB3 LEU A 34 13.737 9.088 -5.350 1.00 0.00 H new ATOM 0 HG LEU A 34 12.474 7.634 -7.208 1.00 0.00 H new ATOM 0 HD11 LEU A 34 10.061 7.415 -6.700 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.060 6.386 -5.646 1.00 0.00 H new ATOM 0 HD13 LEU A 34 10.379 7.906 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.929 9.544 -7.561 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.300 10.132 -5.922 1.00 0.00 H new ATOM 0 HD23 LEU A 34 12.576 10.088 -7.162 1.00 0.00 H new ATOM 537 N LYS A 35 16.002 7.791 -6.540 1.00 0.00 N ATOM 538 CA LYS A 35 16.848 7.964 -7.714 1.00 0.00 C ATOM 539 C LYS A 35 17.446 6.626 -8.160 1.00 0.00 C ATOM 540 O LYS A 35 17.625 6.391 -9.355 1.00 0.00 O ATOM 541 CB LYS A 35 17.928 9.024 -7.451 1.00 0.00 C ATOM 542 CG LYS A 35 18.748 9.397 -8.700 1.00 0.00 C ATOM 543 CD LYS A 35 17.867 9.927 -9.840 1.00 0.00 C ATOM 544 CE LYS A 35 18.692 10.554 -10.972 1.00 0.00 C ATOM 545 NZ LYS A 35 17.811 11.227 -11.945 1.00 0.00 N ATOM 0 H LYS A 35 16.319 8.288 -5.708 1.00 0.00 H new ATOM 0 HA LYS A 35 16.232 8.327 -8.537 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.454 9.923 -7.057 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.605 8.657 -6.680 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.487 10.153 -8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.297 8.521 -9.046 1.00 0.00 H new ATOM 0 HD2 LYS A 35 17.266 9.111 -10.241 1.00 0.00 H new ATOM 0 HD3 LYS A 35 17.174 10.669 -9.445 1.00 0.00 H new ATOM 0 HE2 LYS A 35 19.401 11.271 -10.558 1.00 0.00 H new ATOM 0 HE3 LYS A 35 19.275 9.783 -11.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 18.388 11.772 -12.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 17.257 10.515 -12.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 17.165 11.869 -11.443 1.00 0.00 H new ATOM 559 N GLU A 36 17.753 5.738 -7.210 1.00 0.00 N ATOM 560 CA GLU A 36 18.146 4.374 -7.533 1.00 0.00 C ATOM 561 C GLU A 36 16.959 3.671 -8.194 1.00 0.00 C ATOM 562 O GLU A 36 17.065 3.110 -9.286 1.00 0.00 O ATOM 563 CB GLU A 36 18.622 3.663 -6.254 1.00 0.00 C ATOM 564 CG GLU A 36 19.222 2.286 -6.553 1.00 0.00 C ATOM 565 CD GLU A 36 19.539 1.497 -5.290 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.639 2.123 -4.216 1.00 0.00 O ATOM 567 OE2 GLU A 36 19.652 0.260 -5.439 1.00 0.00 O ATOM 0 H GLU A 36 17.735 5.945 -6.211 1.00 0.00 H new ATOM 0 HA GLU A 36 18.979 4.357 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.366 4.281 -5.751 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.783 3.552 -5.567 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.525 1.716 -7.167 1.00 0.00 H new ATOM 0 HG3 GLU A 36 20.134 2.410 -7.137 1.00 0.00 H new ATOM 574 N LEU A 37 15.823 3.738 -7.503 1.00 0.00 N ATOM 575 CA LEU A 37 14.578 3.063 -7.845 1.00 0.00 C ATOM 576 C LEU A 37 14.214 3.278 -9.312 1.00 0.00 C ATOM 577 O LEU A 37 14.003 2.314 -10.046 1.00 0.00 O ATOM 578 CB LEU A 37 13.452 3.545 -6.913 1.00 0.00 C ATOM 579 CG LEU A 37 12.423 2.461 -6.558 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.550 2.988 -5.423 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.483 2.130 -7.716 1.00 0.00 C ATOM 0 H LEU A 37 15.744 4.291 -6.650 1.00 0.00 H new ATOM 0 HA LEU A 37 14.713 1.991 -7.704 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.895 3.925 -5.993 1.00 0.00 H new ATOM 0 HB3 LEU A 37 12.935 4.380 -7.387 1.00 0.00 H new ATOM 0 HG LEU A 37 12.980 1.562 -6.294 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.810 2.234 -5.153 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.174 3.211 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.041 3.896 -5.747 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.779 1.358 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 37 10.934 3.026 -8.006 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.064 1.770 -8.565 1.00 0.00 H new ATOM 593 N ILE A 38 14.119 4.537 -9.748 1.00 0.00 N ATOM 594 CA ILE A 38 13.716 4.824 -11.120 1.00 0.00 C ATOM 595 C ILE A 38 14.675 4.185 -12.119 1.00 0.00 C ATOM 596 O ILE A 38 14.238 3.573 -13.091 1.00 0.00 O ATOM 597 CB ILE A 38 13.479 6.326 -11.348 1.00 0.00 C ATOM 598 CG1 ILE A 38 12.872 6.616 -12.740 1.00 0.00 C ATOM 599 CG2 ILE A 38 14.707 7.195 -11.054 1.00 0.00 C ATOM 600 CD1 ILE A 38 13.856 6.797 -13.903 1.00 0.00 C ATOM 0 H ILE A 38 14.313 5.360 -9.178 1.00 0.00 H new ATOM 0 HA ILE A 38 12.747 4.358 -11.297 1.00 0.00 H new ATOM 0 HB ILE A 38 12.735 6.620 -10.607 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.196 5.799 -12.992 1.00 0.00 H new ATOM 0 HG13 ILE A 38 12.266 7.519 -12.664 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.464 8.242 -11.237 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.002 7.068 -10.012 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.529 6.894 -11.703 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.302 6.994 -14.821 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.519 7.636 -13.692 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.447 5.889 -14.024 1.00 0.00 H new ATOM 612 N GLN A 39 15.981 4.318 -11.877 1.00 0.00 N ATOM 613 CA GLN A 39 16.984 3.798 -12.788 1.00 0.00 C ATOM 614 C GLN A 39 16.888 2.273 -12.882 1.00 0.00 C ATOM 615 O GLN A 39 16.808 1.744 -13.990 1.00 0.00 O ATOM 616 CB GLN A 39 18.376 4.278 -12.364 1.00 0.00 C ATOM 617 CG GLN A 39 18.515 5.790 -12.596 1.00 0.00 C ATOM 618 CD GLN A 39 19.865 6.305 -12.120 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.764 6.554 -12.918 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.019 6.473 -10.812 1.00 0.00 N ATOM 0 H GLN A 39 16.362 4.784 -11.053 1.00 0.00 H new ATOM 0 HA GLN A 39 16.800 4.184 -13.791 1.00 0.00 H new ATOM 0 HB2 GLN A 39 18.542 4.048 -11.311 1.00 0.00 H new ATOM 0 HB3 GLN A 39 19.140 3.745 -12.931 1.00 0.00 H new ATOM 0 HG2 GLN A 39 18.394 6.009 -13.657 1.00 0.00 H new ATOM 0 HG3 GLN A 39 17.718 6.315 -12.069 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.251 6.256 -10.176 1.00 0.00 H new ATOM 0 HE22 GLN A 39 20.905 6.819 -10.443 1.00 0.00 H new ATOM 629 N LYS A 40 16.925 1.573 -11.742 1.00 0.00 N ATOM 630 CA LYS A 40 16.822 0.114 -11.722 1.00 0.00 C ATOM 631 C LYS A 40 15.371 -0.360 -11.556 1.00 0.00 C ATOM 632 O LYS A 40 14.716 -0.673 -12.550 1.00 0.00 O ATOM 633 CB LYS A 40 17.842 -0.559 -10.777 1.00 0.00 C ATOM 634 CG LYS A 40 18.561 0.371 -9.788 1.00 0.00 C ATOM 635 CD LYS A 40 19.746 -0.323 -9.090 1.00 0.00 C ATOM 636 CE LYS A 40 19.362 -1.568 -8.280 1.00 0.00 C ATOM 637 NZ LYS A 40 18.419 -1.250 -7.194 1.00 0.00 N ATOM 0 H LYS A 40 17.026 1.998 -10.820 1.00 0.00 H new ATOM 0 HA LYS A 40 17.121 -0.240 -12.709 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.325 -1.332 -10.208 1.00 0.00 H new ATOM 0 HB3 LYS A 40 18.594 -1.061 -11.385 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.920 1.253 -10.318 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.851 0.717 -9.036 1.00 0.00 H new ATOM 0 HD2 LYS A 40 20.481 -0.607 -9.844 1.00 0.00 H new ATOM 0 HD3 LYS A 40 20.231 0.393 -8.426 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.915 -2.308 -8.943 1.00 0.00 H new ATOM 0 HE3 LYS A 40 20.261 -2.018 -7.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.845 -2.089 -6.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 18.949 -0.964 -6.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 17.796 -0.472 -7.492 1.00 0.00 H new ATOM 651 N GLU A 41 14.871 -0.449 -10.319 1.00 0.00 N ATOM 652 CA GLU A 41 13.609 -1.107 -9.990 1.00 0.00 C ATOM 653 C GLU A 41 12.416 -0.758 -10.892 1.00 0.00 C ATOM 654 O GLU A 41 11.685 -1.666 -11.289 1.00 0.00 O ATOM 655 CB GLU A 41 13.274 -0.885 -8.511 1.00 0.00 C ATOM 656 CG GLU A 41 14.049 -1.840 -7.591 1.00 0.00 C ATOM 657 CD GLU A 41 15.548 -1.632 -7.631 1.00 0.00 C ATOM 658 OE1 GLU A 41 15.983 -0.457 -7.734 1.00 0.00 O ATOM 659 OE2 GLU A 41 16.298 -2.620 -7.485 1.00 0.00 O ATOM 0 H GLU A 41 15.344 -0.057 -9.505 1.00 0.00 H new ATOM 0 HA GLU A 41 13.778 -2.166 -10.186 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.504 0.145 -8.239 1.00 0.00 H new ATOM 0 HB3 GLU A 41 12.204 -1.024 -8.358 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.699 -1.709 -6.567 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.825 -2.868 -7.876 1.00 0.00 H new ATOM 666 N LEU A 42 12.173 0.515 -11.226 1.00 0.00 N ATOM 667 CA LEU A 42 11.023 0.851 -12.072 1.00 0.00 C ATOM 668 C LEU A 42 11.110 0.213 -13.465 1.00 0.00 C ATOM 669 O LEU A 42 10.093 0.123 -14.147 1.00 0.00 O ATOM 670 CB LEU A 42 10.764 2.364 -12.170 1.00 0.00 C ATOM 671 CG LEU A 42 10.308 3.054 -10.867 1.00 0.00 C ATOM 672 CD1 LEU A 42 9.776 4.456 -11.186 1.00 0.00 C ATOM 673 CD2 LEU A 42 9.184 2.288 -10.152 1.00 0.00 C ATOM 0 H LEU A 42 12.741 1.310 -10.933 1.00 0.00 H new ATOM 0 HA LEU A 42 10.161 0.417 -11.566 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.678 2.848 -12.514 1.00 0.00 H new ATOM 0 HB3 LEU A 42 10.005 2.535 -12.934 1.00 0.00 H new ATOM 0 HG LEU A 42 11.180 3.089 -10.213 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.454 4.942 -10.265 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.565 5.047 -11.652 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.930 4.377 -11.869 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.903 2.819 -9.242 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.319 2.214 -10.810 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.532 1.287 -9.895 1.00 0.00 H new ATOM 685 N THR A 43 12.285 -0.267 -13.885 1.00 0.00 N ATOM 686 CA THR A 43 12.439 -1.079 -15.085 1.00 0.00 C ATOM 687 C THR A 43 12.023 -0.295 -16.334 1.00 0.00 C ATOM 688 O THR A 43 11.166 -0.718 -17.106 1.00 0.00 O ATOM 689 CB THR A 43 11.700 -2.423 -14.925 1.00 0.00 C ATOM 690 OG1 THR A 43 12.031 -3.012 -13.681 1.00 0.00 O ATOM 691 CG2 THR A 43 12.114 -3.441 -15.996 1.00 0.00 C ATOM 0 H THR A 43 13.162 -0.098 -13.392 1.00 0.00 H new ATOM 0 HA THR A 43 13.493 -1.322 -15.223 1.00 0.00 H new ATOM 0 HB THR A 43 10.637 -2.198 -15.008 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.694 -2.449 -12.953 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.568 -4.372 -15.843 1.00 0.00 H new ATOM 0 HG22 THR A 43 11.884 -3.043 -16.984 1.00 0.00 H new ATOM 0 HG23 THR A 43 13.185 -3.632 -15.922 1.00 0.00 H new ATOM 699 N ILE A 44 12.673 0.850 -16.557 1.00 0.00 N ATOM 700 CA ILE A 44 12.546 1.575 -17.818 1.00 0.00 C ATOM 701 C ILE A 44 13.105 0.683 -18.934 1.00 0.00 C ATOM 702 O ILE A 44 12.481 0.501 -19.985 1.00 0.00 O ATOM 703 CB ILE A 44 13.301 2.919 -17.740 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.942 3.757 -16.496 1.00 0.00 C ATOM 705 CG2 ILE A 44 13.082 3.734 -19.024 1.00 0.00 C ATOM 706 CD1 ILE A 44 11.454 4.093 -16.369 1.00 0.00 C ATOM 0 H ILE A 44 13.292 1.293 -15.878 1.00 0.00 H new ATOM 0 HA ILE A 44 11.501 1.805 -18.025 1.00 0.00 H new ATOM 0 HB ILE A 44 14.358 2.671 -17.643 1.00 0.00 H new ATOM 0 HG12 ILE A 44 13.257 3.215 -15.604 1.00 0.00 H new ATOM 0 HG13 ILE A 44 13.511 4.686 -16.522 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.621 4.678 -18.952 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.451 3.170 -19.880 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.018 3.933 -19.152 1.00 0.00 H new ATOM 0 HD11 ILE A 44 11.290 4.684 -15.468 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.134 4.664 -17.240 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.877 3.171 -16.308 1.00 0.00 H new ATOM 888 N LEU A 56 17.177 12.815 -16.309 1.00 0.00 N ATOM 889 CA LEU A 56 17.159 14.199 -15.858 1.00 0.00 C ATOM 890 C LEU A 56 15.775 14.547 -15.305 1.00 0.00 C ATOM 891 O LEU A 56 15.659 15.224 -14.287 1.00 0.00 O ATOM 892 CB LEU A 56 17.559 15.115 -17.027 1.00 0.00 C ATOM 893 CG LEU A 56 17.555 16.615 -16.684 1.00 0.00 C ATOM 894 CD1 LEU A 56 18.540 16.958 -15.559 1.00 0.00 C ATOM 895 CD2 LEU A 56 17.924 17.413 -17.939 1.00 0.00 C ATOM 0 HA LEU A 56 17.878 14.344 -15.052 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.555 14.835 -17.369 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.876 14.942 -17.859 1.00 0.00 H new ATOM 0 HG LEU A 56 16.555 16.875 -16.336 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.500 18.028 -15.354 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.271 16.406 -14.659 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.550 16.685 -15.864 1.00 0.00 H new ATOM 0 HD21 LEU A 56 17.924 18.478 -17.706 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.916 17.116 -18.280 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.195 17.213 -18.725 1.00 0.00 H new ATOM 907 N MET A 57 14.723 14.142 -16.022 1.00 0.00 N ATOM 908 CA MET A 57 13.355 14.538 -15.716 1.00 0.00 C ATOM 909 C MET A 57 12.844 13.835 -14.457 1.00 0.00 C ATOM 910 O MET A 57 12.169 14.447 -13.631 1.00 0.00 O ATOM 911 CB MET A 57 12.468 14.232 -16.931 1.00 0.00 C ATOM 912 CG MET A 57 11.024 14.700 -16.720 1.00 0.00 C ATOM 913 SD MET A 57 9.946 14.470 -18.155 1.00 0.00 S ATOM 914 CE MET A 57 8.396 15.111 -17.484 1.00 0.00 C ATOM 0 H MET A 57 14.802 13.528 -16.833 1.00 0.00 H new ATOM 0 HA MET A 57 13.324 15.608 -15.511 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.882 14.719 -17.814 1.00 0.00 H new ATOM 0 HB3 MET A 57 12.477 13.160 -17.125 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.600 14.161 -15.873 1.00 0.00 H new ATOM 0 HG3 MET A 57 11.033 15.757 -16.453 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.616 15.044 -18.242 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.106 14.524 -16.613 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.529 16.153 -17.192 1.00 0.00 H new ATOM 924 N ASP A 58 13.124 12.536 -14.359 1.00 0.00 N ATOM 925 CA ASP A 58 12.659 11.609 -13.337 1.00 0.00 C ATOM 926 C ASP A 58 12.523 12.228 -11.943 1.00 0.00 C ATOM 927 O ASP A 58 11.464 12.134 -11.320 1.00 0.00 O ATOM 928 CB ASP A 58 13.553 10.356 -13.314 1.00 0.00 C ATOM 929 CG ASP A 58 15.024 10.627 -13.013 1.00 0.00 C ATOM 930 OD1 ASP A 58 15.447 11.801 -13.011 1.00 0.00 O ATOM 931 OD2 ASP A 58 15.778 9.666 -12.748 1.00 0.00 O ATOM 0 H ASP A 58 13.725 12.075 -15.042 1.00 0.00 H new ATOM 0 HA ASP A 58 11.644 11.325 -13.616 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.165 9.663 -12.567 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.480 9.857 -14.280 1.00 0.00 H new ATOM 936 N ASP A 59 13.585 12.877 -11.464 1.00 0.00 N ATOM 937 CA ASP A 59 13.674 13.476 -10.137 1.00 0.00 C ATOM 938 C ASP A 59 12.495 14.405 -9.809 1.00 0.00 C ATOM 939 O ASP A 59 12.231 14.666 -8.637 1.00 0.00 O ATOM 940 CB ASP A 59 15.002 14.241 -10.001 1.00 0.00 C ATOM 941 CG ASP A 59 16.172 13.335 -9.655 1.00 0.00 C ATOM 942 OD1 ASP A 59 16.122 12.711 -8.575 1.00 0.00 O ATOM 943 OD2 ASP A 59 17.115 13.271 -10.472 1.00 0.00 O ATOM 0 H ASP A 59 14.436 13.003 -12.011 1.00 0.00 H new ATOM 0 HA ASP A 59 13.633 12.658 -9.418 1.00 0.00 H new ATOM 0 HB2 ASP A 59 15.214 14.760 -10.936 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.899 15.004 -9.229 1.00 0.00 H new ATOM 948 N LEU A 60 11.770 14.892 -10.820 1.00 0.00 N ATOM 949 CA LEU A 60 10.504 15.603 -10.691 1.00 0.00 C ATOM 950 C LEU A 60 9.602 14.944 -9.648 1.00 0.00 C ATOM 951 O LEU A 60 8.965 15.637 -8.854 1.00 0.00 O ATOM 952 CB LEU A 60 9.831 15.653 -12.072 1.00 0.00 C ATOM 953 CG LEU A 60 8.453 16.337 -12.083 1.00 0.00 C ATOM 954 CD1 LEU A 60 8.255 17.056 -13.423 1.00 0.00 C ATOM 955 CD2 LEU A 60 7.298 15.338 -11.908 1.00 0.00 C ATOM 0 H LEU A 60 12.066 14.795 -11.791 1.00 0.00 H new ATOM 0 HA LEU A 60 10.687 16.619 -10.342 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.489 16.178 -12.765 1.00 0.00 H new ATOM 0 HB3 LEU A 60 9.721 14.635 -12.446 1.00 0.00 H new ATOM 0 HG LEU A 60 8.436 17.034 -11.245 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.279 17.542 -13.434 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.035 17.806 -13.552 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.309 16.332 -14.236 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.349 15.873 -11.923 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.318 14.612 -12.721 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.407 14.819 -10.956 1.00 0.00 H new ATOM 967 N ASP A 61 9.549 13.609 -9.629 1.00 0.00 N ATOM 968 CA ASP A 61 8.758 12.894 -8.635 1.00 0.00 C ATOM 969 C ASP A 61 9.118 13.353 -7.223 1.00 0.00 C ATOM 970 O ASP A 61 8.244 13.685 -6.429 1.00 0.00 O ATOM 971 CB ASP A 61 8.991 11.395 -8.775 1.00 0.00 C ATOM 972 CG ASP A 61 8.090 10.595 -7.837 1.00 0.00 C ATOM 973 OD1 ASP A 61 6.904 10.971 -7.729 1.00 0.00 O ATOM 974 OD2 ASP A 61 8.586 9.606 -7.261 1.00 0.00 O ATOM 0 H ASP A 61 10.043 13.008 -10.289 1.00 0.00 H new ATOM 0 HA ASP A 61 7.704 13.113 -8.805 1.00 0.00 H new ATOM 0 HB2 ASP A 61 8.805 11.092 -9.805 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.035 11.167 -8.560 1.00 0.00 H new ATOM 979 N ARG A 62 10.418 13.465 -6.937 1.00 0.00 N ATOM 980 CA ARG A 62 10.922 13.923 -5.643 1.00 0.00 C ATOM 981 C ARG A 62 11.130 15.440 -5.601 1.00 0.00 C ATOM 982 O ARG A 62 11.937 15.914 -4.801 1.00 0.00 O ATOM 983 CB ARG A 62 12.152 13.111 -5.189 1.00 0.00 C ATOM 984 CG ARG A 62 13.323 12.995 -6.173 1.00 0.00 C ATOM 985 CD ARG A 62 14.196 14.253 -6.276 1.00 0.00 C ATOM 986 NE ARG A 62 15.063 14.422 -5.099 1.00 0.00 N ATOM 987 CZ ARG A 62 15.234 15.545 -4.382 1.00 0.00 C ATOM 988 NH1 ARG A 62 14.460 16.615 -4.542 1.00 0.00 N ATOM 989 NH2 ARG A 62 16.198 15.620 -3.463 1.00 0.00 N ATOM 0 H ARG A 62 11.155 13.238 -7.604 1.00 0.00 H new ATOM 0 HA ARG A 62 10.147 13.725 -4.902 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.529 13.556 -4.268 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.818 12.103 -4.942 1.00 0.00 H new ATOM 0 HG2 ARG A 62 13.951 12.156 -5.873 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.928 12.760 -7.162 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.811 14.194 -7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 62 13.557 15.129 -6.384 1.00 0.00 H new ATOM 0 HE ARG A 62 15.588 13.602 -4.796 1.00 0.00 H new ATOM 0 HH11 ARG A 62 13.705 16.601 -5.228 1.00 0.00 H new ATOM 0 HH12 ARG A 62 14.621 17.450 -3.978 1.00 0.00 H new ATOM 0 HH21 ARG A 62 16.811 14.821 -3.301 1.00 0.00 H new ATOM 0 HH22 ARG A 62 16.322 16.476 -2.922 1.00 0.00 H new ATOM 1003 N ASN A 63 10.435 16.193 -6.466 1.00 0.00 N ATOM 1004 CA ASN A 63 10.631 17.614 -6.752 1.00 0.00 C ATOM 1005 C ASN A 63 11.258 18.391 -5.591 1.00 0.00 C ATOM 1006 O ASN A 63 12.481 18.537 -5.573 1.00 0.00 O ATOM 1007 CB ASN A 63 9.312 18.256 -7.223 1.00 0.00 C ATOM 1008 CG ASN A 63 8.106 17.830 -6.384 1.00 0.00 C ATOM 1009 OD1 ASN A 63 7.805 18.463 -5.375 1.00 0.00 O ATOM 1010 ND2 ASN A 63 7.429 16.753 -6.774 1.00 0.00 N ATOM 0 H ASN A 63 9.674 15.797 -7.017 1.00 0.00 H new ATOM 0 HA ASN A 63 11.357 17.673 -7.563 1.00 0.00 H new ATOM 0 HB2 ASN A 63 9.409 19.341 -7.185 1.00 0.00 H new ATOM 0 HB3 ASN A 63 9.136 17.988 -8.265 1.00 0.00 H new ATOM 0 HD21 ASN A 63 6.630 16.428 -6.229 1.00 0.00 H new ATOM 0 HD22 ASN A 63 7.709 16.253 -7.618 1.00 0.00 H new ATOM 1017 N LYS A 64 10.483 18.875 -4.613 1.00 0.00 N ATOM 1018 CA LYS A 64 11.029 19.666 -3.517 1.00 0.00 C ATOM 1019 C LYS A 64 11.374 18.807 -2.303 1.00 0.00 C ATOM 1020 O LYS A 64 11.147 19.230 -1.167 1.00 0.00 O ATOM 1021 CB LYS A 64 10.124 20.875 -3.197 1.00 0.00 C ATOM 1022 CG LYS A 64 10.685 22.186 -3.769 1.00 0.00 C ATOM 1023 CD LYS A 64 12.069 22.636 -3.249 1.00 0.00 C ATOM 1024 CE LYS A 64 12.215 22.759 -1.720 1.00 0.00 C ATOM 1025 NZ LYS A 64 12.566 21.489 -1.046 1.00 0.00 N ATOM 0 H LYS A 64 9.475 18.729 -4.563 1.00 0.00 H new ATOM 0 HA LYS A 64 11.982 20.084 -3.842 1.00 0.00 H new ATOM 0 HB2 LYS A 64 9.128 20.699 -3.604 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.015 20.969 -2.117 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.745 22.086 -4.853 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.969 22.981 -3.562 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.816 21.929 -3.609 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.304 23.603 -3.694 1.00 0.00 H new ATOM 0 HE2 LYS A 64 12.982 23.501 -1.497 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.279 23.133 -1.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.973 21.693 -0.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.711 20.908 -0.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.262 20.972 -1.621 1.00 0.00 H new ATOM 1039 N ASP A 65 12.018 17.659 -2.527 1.00 0.00 N ATOM 1040 CA ASP A 65 12.632 16.856 -1.482 1.00 0.00 C ATOM 1041 C ASP A 65 11.589 16.382 -0.467 1.00 0.00 C ATOM 1042 O ASP A 65 11.912 16.140 0.700 1.00 0.00 O ATOM 1043 CB ASP A 65 13.764 17.644 -0.794 1.00 0.00 C ATOM 1044 CG ASP A 65 14.588 18.501 -1.742 1.00 0.00 C ATOM 1045 OD1 ASP A 65 15.408 17.903 -2.475 1.00 0.00 O ATOM 1046 OD2 ASP A 65 14.337 19.727 -1.765 1.00 0.00 O ATOM 0 H ASP A 65 12.126 17.259 -3.459 1.00 0.00 H new ATOM 0 HA ASP A 65 13.067 15.969 -1.942 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.331 18.284 -0.025 1.00 0.00 H new ATOM 0 HB3 ASP A 65 14.426 16.941 -0.288 1.00 0.00 H new ATOM 1051 N GLN A 66 10.341 16.231 -0.906 1.00 0.00 N ATOM 1052 CA GLN A 66 9.262 15.758 -0.064 1.00 0.00 C ATOM 1053 C GLN A 66 9.410 14.254 0.170 1.00 0.00 C ATOM 1054 O GLN A 66 10.141 13.569 -0.545 1.00 0.00 O ATOM 1055 CB GLN A 66 7.897 16.184 -0.634 1.00 0.00 C ATOM 1056 CG GLN A 66 7.304 15.334 -1.771 1.00 0.00 C ATOM 1057 CD GLN A 66 7.982 15.457 -3.137 1.00 0.00 C ATOM 1058 OE1 GLN A 66 9.046 16.053 -3.294 1.00 0.00 O ATOM 1059 NE2 GLN A 66 7.352 14.869 -4.141 1.00 0.00 N ATOM 0 H GLN A 66 10.056 16.437 -1.863 1.00 0.00 H new ATOM 0 HA GLN A 66 9.317 16.226 0.919 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.179 16.196 0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 66 7.988 17.209 -0.993 1.00 0.00 H new ATOM 0 HG2 GLN A 66 7.335 14.288 -1.467 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.254 15.602 -1.886 1.00 0.00 H new ATOM 0 HE21 GLN A 66 6.471 14.383 -3.975 1.00 0.00 H new ATOM 0 HE22 GLN A 66 7.748 14.902 -5.081 1.00 0.00 H new ATOM 1068 N GLU A 67 8.737 13.748 1.202 1.00 0.00 N ATOM 1069 CA GLU A 67 8.728 12.332 1.521 1.00 0.00 C ATOM 1070 C GLU A 67 7.710 11.678 0.575 1.00 0.00 C ATOM 1071 O GLU A 67 6.512 11.707 0.836 1.00 0.00 O ATOM 1072 CB GLU A 67 8.426 12.171 3.024 1.00 0.00 C ATOM 1073 CG GLU A 67 9.400 11.204 3.717 1.00 0.00 C ATOM 1074 CD GLU A 67 10.739 11.861 4.028 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.503 12.120 3.073 1.00 0.00 O ATOM 1076 OE2 GLU A 67 10.985 12.120 5.226 1.00 0.00 O ATOM 0 H GLU A 67 8.181 14.317 1.841 1.00 0.00 H new ATOM 0 HA GLU A 67 9.684 11.833 1.365 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.479 13.146 3.509 1.00 0.00 H new ATOM 0 HB3 GLU A 67 7.406 11.808 3.150 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.952 10.840 4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 67 9.563 10.336 3.079 1.00 0.00 H new ATOM 1083 N VAL A 68 8.196 11.137 -0.545 1.00 0.00 N ATOM 1084 CA VAL A 68 7.390 10.696 -1.680 1.00 0.00 C ATOM 1085 C VAL A 68 6.415 9.576 -1.292 1.00 0.00 C ATOM 1086 O VAL A 68 6.816 8.463 -0.961 1.00 0.00 O ATOM 1087 CB VAL A 68 8.324 10.243 -2.811 1.00 0.00 C ATOM 1088 CG1 VAL A 68 7.572 9.840 -4.083 1.00 0.00 C ATOM 1089 CG2 VAL A 68 9.346 11.323 -3.190 1.00 0.00 C ATOM 0 H VAL A 68 9.195 10.990 -0.689 1.00 0.00 H new ATOM 0 HA VAL A 68 6.781 11.534 -2.020 1.00 0.00 H new ATOM 0 HB VAL A 68 8.838 9.371 -2.407 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.287 9.530 -4.845 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.897 9.013 -3.860 1.00 0.00 H new ATOM 0 HG13 VAL A 68 6.996 10.690 -4.450 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.983 10.955 -3.994 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.822 12.219 -3.524 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.960 11.564 -2.322 1.00 0.00 H new ATOM 1099 N ASN A 69 5.118 9.843 -1.354 1.00 0.00 N ATOM 1100 CA ASN A 69 4.073 8.873 -1.048 1.00 0.00 C ATOM 1101 C ASN A 69 3.961 7.842 -2.172 1.00 0.00 C ATOM 1102 O ASN A 69 4.319 8.132 -3.314 1.00 0.00 O ATOM 1103 CB ASN A 69 2.730 9.592 -0.856 1.00 0.00 C ATOM 1104 CG ASN A 69 2.710 10.450 0.405 1.00 0.00 C ATOM 1105 OD1 ASN A 69 2.265 9.996 1.455 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.193 11.684 0.327 1.00 0.00 N ATOM 0 H ASN A 69 4.754 10.757 -1.623 1.00 0.00 H new ATOM 0 HA ASN A 69 4.334 8.356 -0.125 1.00 0.00 H new ATOM 0 HB2 ASN A 69 2.529 10.220 -1.724 1.00 0.00 H new ATOM 0 HB3 ASN A 69 1.929 8.854 -0.804 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.201 12.282 1.153 1.00 0.00 H new ATOM 0 HD22 ASN A 69 3.556 12.034 -0.559 1.00 0.00 H new ATOM 1113 N PHE A 70 3.403 6.655 -1.878 1.00 0.00 N ATOM 1114 CA PHE A 70 3.059 5.678 -2.912 1.00 0.00 C ATOM 1115 C PHE A 70 2.231 6.356 -4.013 1.00 0.00 C ATOM 1116 O PHE A 70 2.416 6.035 -5.178 1.00 0.00 O ATOM 1117 CB PHE A 70 2.376 4.421 -2.337 1.00 0.00 C ATOM 1118 CG PHE A 70 2.551 3.143 -3.156 1.00 0.00 C ATOM 1119 CD1 PHE A 70 1.958 3.024 -4.426 1.00 0.00 C ATOM 1120 CD2 PHE A 70 3.249 2.037 -2.625 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.111 1.841 -5.174 1.00 0.00 C ATOM 1122 CE2 PHE A 70 3.512 0.902 -3.426 1.00 0.00 C ATOM 1123 CZ PHE A 70 2.907 0.795 -4.684 1.00 0.00 C ATOM 0 H PHE A 70 3.182 6.353 -0.929 1.00 0.00 H new ATOM 0 HA PHE A 70 3.984 5.314 -3.360 1.00 0.00 H new ATOM 0 HB2 PHE A 70 2.764 4.245 -1.334 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.310 4.623 -2.235 1.00 0.00 H new ATOM 0 HD1 PHE A 70 1.383 3.844 -4.829 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.585 2.058 -1.599 1.00 0.00 H new ATOM 0 HE1 PHE A 70 1.614 1.739 -6.127 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.173 0.125 -3.071 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.053 -0.095 -5.278 1.00 0.00 H new ATOM 1133 N GLN A 71 1.356 7.313 -3.667 1.00 0.00 N ATOM 1134 CA GLN A 71 0.648 8.140 -4.645 1.00 0.00 C ATOM 1135 C GLN A 71 1.611 8.796 -5.632 1.00 0.00 C ATOM 1136 O GLN A 71 1.439 8.663 -6.842 1.00 0.00 O ATOM 1137 CB GLN A 71 -0.198 9.210 -3.932 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.855 10.216 -4.904 1.00 0.00 C ATOM 1139 CD GLN A 71 -0.040 11.497 -5.091 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.131 12.251 -4.139 1.00 0.00 O ATOM 1141 NE2 GLN A 71 0.453 11.782 -6.293 1.00 0.00 N ATOM 0 H GLN A 71 1.122 7.532 -2.699 1.00 0.00 H new ATOM 0 HA GLN A 71 -0.013 7.485 -5.213 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.976 8.719 -3.348 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.433 9.754 -3.229 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.993 9.737 -5.873 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.846 10.475 -4.532 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.300 11.142 -7.072 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.984 12.641 -6.436 1.00 0.00 H new ATOM 1150 N GLU A 72 2.587 9.547 -5.121 1.00 0.00 N ATOM 1151 CA GLU A 72 3.511 10.324 -5.931 1.00 0.00 C ATOM 1152 C GLU A 72 4.328 9.366 -6.795 1.00 0.00 C ATOM 1153 O GLU A 72 4.261 9.432 -8.023 1.00 0.00 O ATOM 1154 CB GLU A 72 4.376 11.184 -5.005 1.00 0.00 C ATOM 1155 CG GLU A 72 3.519 12.207 -4.249 1.00 0.00 C ATOM 1156 CD GLU A 72 4.321 12.881 -3.152 1.00 0.00 C ATOM 1157 OE1 GLU A 72 4.955 13.913 -3.450 1.00 0.00 O ATOM 1158 OE2 GLU A 72 4.311 12.325 -2.033 1.00 0.00 O ATOM 0 H GLU A 72 2.756 9.630 -4.119 1.00 0.00 H new ATOM 0 HA GLU A 72 2.987 11.002 -6.604 1.00 0.00 H new ATOM 0 HB2 GLU A 72 4.900 10.546 -4.293 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.137 11.702 -5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.144 12.958 -4.944 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.650 11.711 -3.817 1.00 0.00 H new ATOM 1165 N TYR A 73 4.971 8.399 -6.134 1.00 0.00 N ATOM 1166 CA TYR A 73 5.648 7.267 -6.753 1.00 0.00 C ATOM 1167 C TYR A 73 4.813 6.706 -7.909 1.00 0.00 C ATOM 1168 O TYR A 73 5.308 6.549 -9.024 1.00 0.00 O ATOM 1169 CB TYR A 73 5.884 6.218 -5.660 1.00 0.00 C ATOM 1170 CG TYR A 73 6.281 4.820 -6.097 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.640 4.514 -6.288 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.336 3.773 -6.049 1.00 0.00 C ATOM 1173 CE1 TYR A 73 8.061 3.177 -6.295 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.773 2.435 -6.014 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.141 2.152 -6.052 1.00 0.00 C ATOM 1176 OH TYR A 73 7.578 0.905 -5.739 1.00 0.00 O ATOM 0 H TYR A 73 5.034 8.387 -5.116 1.00 0.00 H new ATOM 0 HA TYR A 73 6.603 7.572 -7.181 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.662 6.595 -4.996 1.00 0.00 H new ATOM 0 HB3 TYR A 73 4.971 6.138 -5.069 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.358 5.308 -6.429 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.280 3.998 -6.039 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.096 2.938 -6.488 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.054 1.631 -5.958 1.00 0.00 H new ATOM 0 HH TYR A 73 6.809 0.314 -5.600 1.00 0.00 H new ATOM 1186 N ILE A 74 3.535 6.420 -7.652 1.00 0.00 N ATOM 1187 CA ILE A 74 2.628 5.904 -8.660 1.00 0.00 C ATOM 1188 C ILE A 74 2.408 6.914 -9.780 1.00 0.00 C ATOM 1189 O ILE A 74 2.400 6.530 -10.941 1.00 0.00 O ATOM 1190 CB ILE A 74 1.285 5.459 -8.043 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.327 3.974 -7.664 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.092 5.734 -8.958 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.148 3.016 -8.850 1.00 0.00 C ATOM 0 H ILE A 74 3.106 6.543 -6.735 1.00 0.00 H new ATOM 0 HA ILE A 74 3.098 5.022 -9.095 1.00 0.00 H new ATOM 0 HB ILE A 74 1.145 6.058 -7.143 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.280 3.761 -7.180 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.546 3.776 -6.930 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.824 5.400 -8.471 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.027 6.803 -9.160 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.221 5.195 -9.896 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.190 1.986 -8.495 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.183 3.198 -9.322 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.944 3.183 -9.576 1.00 0.00 H new ATOM 1205 N THR A 75 2.147 8.179 -9.456 1.00 0.00 N ATOM 1206 CA THR A 75 1.833 9.200 -10.449 1.00 0.00 C ATOM 1207 C THR A 75 3.003 9.289 -11.433 1.00 0.00 C ATOM 1208 O THR A 75 2.837 9.268 -12.650 1.00 0.00 O ATOM 1209 CB THR A 75 1.566 10.533 -9.728 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.544 10.362 -8.760 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.142 11.630 -10.708 1.00 0.00 C ATOM 0 H THR A 75 2.148 8.524 -8.496 1.00 0.00 H new ATOM 0 HA THR A 75 0.935 8.950 -11.014 1.00 0.00 H new ATOM 0 HB THR A 75 2.496 10.838 -9.247 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.871 9.787 -8.037 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.962 12.556 -10.162 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.933 11.789 -11.441 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.228 11.327 -11.220 1.00 0.00 H new ATOM 1219 N PHE A 76 4.204 9.338 -10.864 1.00 0.00 N ATOM 1220 CA PHE A 76 5.469 9.293 -11.566 1.00 0.00 C ATOM 1221 C PHE A 76 5.597 8.050 -12.438 1.00 0.00 C ATOM 1222 O PHE A 76 5.715 8.169 -13.655 1.00 0.00 O ATOM 1223 CB PHE A 76 6.563 9.365 -10.503 1.00 0.00 C ATOM 1224 CG PHE A 76 7.898 8.758 -10.866 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.661 9.339 -11.887 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.506 7.856 -9.973 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.060 9.311 -11.790 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.911 7.825 -9.880 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.674 8.686 -10.692 1.00 0.00 C ATOM 0 H PHE A 76 4.320 9.414 -9.853 1.00 0.00 H new ATOM 0 HA PHE A 76 5.553 10.131 -12.258 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.723 10.413 -10.249 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.197 8.871 -9.603 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.179 9.801 -12.736 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.903 7.196 -9.367 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.664 9.769 -12.559 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.398 7.148 -9.193 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.717 8.863 -10.474 1.00 0.00 H new ATOM 1239 N LEU A 77 5.586 6.861 -11.831 1.00 0.00 N ATOM 1240 CA LEU A 77 5.765 5.610 -12.560 1.00 0.00 C ATOM 1241 C LEU A 77 4.695 5.515 -13.664 1.00 0.00 C ATOM 1242 O LEU A 77 4.954 5.125 -14.801 1.00 0.00 O ATOM 1243 CB LEU A 77 5.857 4.442 -11.549 1.00 0.00 C ATOM 1244 CG LEU A 77 4.579 3.690 -11.152 1.00 0.00 C ATOM 1245 CD1 LEU A 77 4.171 2.624 -12.170 1.00 0.00 C ATOM 1246 CD2 LEU A 77 4.835 2.979 -9.814 1.00 0.00 C ATOM 0 H LEU A 77 5.453 6.742 -10.827 1.00 0.00 H new ATOM 0 HA LEU A 77 6.709 5.559 -13.103 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.555 3.710 -11.956 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.304 4.834 -10.635 1.00 0.00 H new ATOM 0 HG LEU A 77 3.776 4.425 -11.093 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.261 2.128 -11.833 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.991 3.094 -13.137 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.970 1.889 -12.267 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.938 2.437 -9.512 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.662 2.278 -9.927 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.087 3.717 -9.052 1.00 0.00 H new ATOM 1258 N GLY A 78 3.498 5.997 -13.338 1.00 0.00 N ATOM 1259 CA GLY A 78 2.356 6.187 -14.208 1.00 0.00 C ATOM 1260 C GLY A 78 2.680 6.953 -15.490 1.00 0.00 C ATOM 1261 O GLY A 78 2.076 6.678 -16.521 1.00 0.00 O ATOM 0 H GLY A 78 3.293 6.285 -12.381 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.945 5.212 -14.472 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.580 6.723 -13.662 1.00 0.00 H new ATOM 1265 N ALA A 79 3.644 7.876 -15.507 1.00 0.00 N ATOM 1266 CA ALA A 79 4.010 8.525 -16.764 1.00 0.00 C ATOM 1267 C ALA A 79 4.535 7.533 -17.812 1.00 0.00 C ATOM 1268 O ALA A 79 4.405 7.779 -19.008 1.00 0.00 O ATOM 1269 CB ALA A 79 5.009 9.653 -16.500 1.00 0.00 C ATOM 0 H ALA A 79 4.171 8.183 -14.690 1.00 0.00 H new ATOM 0 HA ALA A 79 3.104 8.955 -17.191 1.00 0.00 H new ATOM 0 HB1 ALA A 79 5.276 10.131 -17.443 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.559 10.390 -15.835 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.905 9.244 -16.034 1.00 0.00 H new ATOM 1275 N LEU A 80 5.092 6.397 -17.381 1.00 0.00 N ATOM 1276 CA LEU A 80 5.536 5.325 -18.269 1.00 0.00 C ATOM 1277 C LEU A 80 4.398 4.321 -18.523 1.00 0.00 C ATOM 1278 O LEU A 80 4.595 3.327 -19.226 1.00 0.00 O ATOM 1279 CB LEU A 80 6.719 4.605 -17.610 1.00 0.00 C ATOM 1280 CG LEU A 80 8.013 5.406 -17.368 1.00 0.00 C ATOM 1281 CD1 LEU A 80 8.617 5.907 -18.683 1.00 0.00 C ATOM 1282 CD2 LEU A 80 7.885 6.566 -16.375 1.00 0.00 C ATOM 0 H LEU A 80 5.248 6.196 -16.393 1.00 0.00 H new ATOM 0 HA LEU A 80 5.835 5.751 -19.227 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.381 4.219 -16.648 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.971 3.743 -18.228 1.00 0.00 H new ATOM 0 HG LEU A 80 8.686 4.688 -16.900 1.00 0.00 H new ATOM 0 HD11 LEU A 80 9.528 6.468 -18.475 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.853 5.056 -19.323 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.901 6.554 -19.189 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.848 7.066 -16.274 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.144 7.277 -16.740 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.572 6.181 -15.404 1.00 0.00 H new ATOM 1294 N ALA A 81 3.213 4.568 -17.950 1.00 0.00 N ATOM 1295 CA ALA A 81 2.103 3.636 -17.878 1.00 0.00 C ATOM 1296 C ALA A 81 1.826 2.910 -19.175 1.00 0.00 C ATOM 1297 O ALA A 81 2.133 1.734 -19.299 1.00 0.00 O ATOM 1298 CB ALA A 81 0.815 4.333 -17.411 1.00 0.00 C ATOM 0 H ALA A 81 3.003 5.463 -17.508 1.00 0.00 H new ATOM 0 HA ALA A 81 2.414 2.890 -17.146 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.003 3.607 -17.368 1.00 0.00 H new ATOM 0 HB2 ALA A 81 0.972 4.761 -16.421 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.556 5.126 -18.112 1.00 0.00 H new ATOM 1304 N MET A 82 1.209 3.588 -20.138 1.00 0.00 N ATOM 1305 CA MET A 82 0.689 2.878 -21.301 1.00 0.00 C ATOM 1306 C MET A 82 1.799 2.226 -22.145 1.00 0.00 C ATOM 1307 O MET A 82 1.508 1.378 -22.982 1.00 0.00 O ATOM 1308 CB MET A 82 -0.279 3.773 -22.083 1.00 0.00 C ATOM 1309 CG MET A 82 -1.549 4.036 -21.249 1.00 0.00 C ATOM 1310 SD MET A 82 -2.794 5.134 -21.976 1.00 0.00 S ATOM 1311 CE MET A 82 -3.256 4.201 -23.452 1.00 0.00 C ATOM 0 H MET A 82 1.060 4.597 -20.139 1.00 0.00 H new ATOM 0 HA MET A 82 0.102 2.026 -20.957 1.00 0.00 H new ATOM 0 HB2 MET A 82 0.206 4.718 -22.330 1.00 0.00 H new ATOM 0 HB3 MET A 82 -0.546 3.296 -23.026 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.023 3.077 -21.041 1.00 0.00 H new ATOM 0 HG3 MET A 82 -1.244 4.456 -20.290 1.00 0.00 H new ATOM 0 HE1 MET A 82 -4.102 4.686 -23.939 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.411 4.167 -24.140 1.00 0.00 H new ATOM 0 HE3 MET A 82 -3.534 3.186 -23.169 1.00 0.00 H new ATOM 1321 N ILE A 83 3.068 2.566 -21.886 1.00 0.00 N ATOM 1322 CA ILE A 83 4.216 1.869 -22.446 1.00 0.00 C ATOM 1323 C ILE A 83 4.430 0.555 -21.673 1.00 0.00 C ATOM 1324 O ILE A 83 4.300 -0.531 -22.242 1.00 0.00 O ATOM 1325 CB ILE A 83 5.451 2.797 -22.445 1.00 0.00 C ATOM 1326 CG1 ILE A 83 5.130 4.089 -23.222 1.00 0.00 C ATOM 1327 CG2 ILE A 83 6.658 2.080 -23.066 1.00 0.00 C ATOM 1328 CD1 ILE A 83 6.295 5.081 -23.248 1.00 0.00 C ATOM 0 H ILE A 83 3.321 3.342 -21.274 1.00 0.00 H new ATOM 0 HA ILE A 83 4.040 1.603 -23.488 1.00 0.00 H new ATOM 0 HB ILE A 83 5.701 3.057 -21.416 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.857 3.832 -24.245 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.262 4.570 -22.772 1.00 0.00 H new ATOM 0 HG21 ILE A 83 7.521 2.746 -23.058 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.886 1.184 -22.488 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.425 1.799 -24.093 1.00 0.00 H new ATOM 0 HD11 ILE A 83 6.005 5.969 -23.810 1.00 0.00 H new ATOM 0 HD12 ILE A 83 6.553 5.366 -22.228 1.00 0.00 H new ATOM 0 HD13 ILE A 83 7.158 4.616 -23.724 1.00 0.00 H new ATOM 1340 N TYR A 84 4.760 0.620 -20.377 1.00 0.00 N ATOM 1341 CA TYR A 84 5.040 -0.556 -19.539 1.00 0.00 C ATOM 1342 C TYR A 84 3.819 -1.134 -18.816 1.00 0.00 C ATOM 1343 O TYR A 84 3.938 -1.687 -17.725 1.00 0.00 O ATOM 1344 CB TYR A 84 6.322 -0.404 -18.717 1.00 0.00 C ATOM 1345 CG TYR A 84 6.399 0.617 -17.606 1.00 0.00 C ATOM 1346 CD1 TYR A 84 5.249 1.149 -16.993 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.669 0.869 -17.053 1.00 0.00 C ATOM 1348 CE1 TYR A 84 5.366 1.852 -15.784 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.787 1.627 -15.883 1.00 0.00 C ATOM 1350 CZ TYR A 84 6.635 2.067 -15.219 1.00 0.00 C ATOM 1351 OH TYR A 84 6.763 2.747 -14.053 1.00 0.00 O ATOM 0 H TYR A 84 4.842 1.503 -19.873 1.00 0.00 H new ATOM 0 HA TYR A 84 5.274 -1.370 -20.225 1.00 0.00 H new ATOM 0 HB2 TYR A 84 6.540 -1.377 -18.277 1.00 0.00 H new ATOM 0 HB3 TYR A 84 7.129 -0.182 -19.416 1.00 0.00 H new ATOM 0 HD1 TYR A 84 4.280 1.017 -17.451 1.00 0.00 H new ATOM 0 HD2 TYR A 84 8.553 0.477 -17.533 1.00 0.00 H new ATOM 0 HE1 TYR A 84 4.483 2.227 -15.289 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.764 1.872 -15.493 1.00 0.00 H new ATOM 0 HH TYR A 84 7.710 2.801 -13.808 1.00 0.00 H new ATOM 1361 N ASN A 85 2.644 -0.920 -19.408 1.00 0.00 N ATOM 1362 CA ASN A 85 1.313 -1.120 -18.855 1.00 0.00 C ATOM 1363 C ASN A 85 1.197 -2.193 -17.785 1.00 0.00 C ATOM 1364 O ASN A 85 0.708 -1.911 -16.697 1.00 0.00 O ATOM 1365 CB ASN A 85 0.307 -1.335 -19.994 1.00 0.00 C ATOM 1366 CG ASN A 85 -1.136 -1.040 -19.588 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -1.986 -0.806 -20.440 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -1.452 -1.011 -18.297 1.00 0.00 N ATOM 0 H ASN A 85 2.600 -0.574 -20.366 1.00 0.00 H new ATOM 0 HA ASN A 85 1.076 -0.204 -18.314 1.00 0.00 H new ATOM 0 HB2 ASN A 85 0.578 -0.697 -20.835 1.00 0.00 H new ATOM 0 HB3 ASN A 85 0.376 -2.366 -20.341 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -2.406 -0.793 -18.010 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -0.740 -1.207 -17.593 1.00 0.00 H new ATOM 1375 N GLU A 86 1.588 -3.412 -18.101 1.00 0.00 N ATOM 1376 CA GLU A 86 1.523 -4.576 -17.233 1.00 0.00 C ATOM 1377 C GLU A 86 2.113 -4.350 -15.842 1.00 0.00 C ATOM 1378 O GLU A 86 1.629 -4.919 -14.862 1.00 0.00 O ATOM 1379 CB GLU A 86 2.188 -5.745 -17.985 1.00 0.00 C ATOM 1380 CG GLU A 86 3.678 -5.540 -18.363 1.00 0.00 C ATOM 1381 CD GLU A 86 3.989 -4.554 -19.497 1.00 0.00 C ATOM 1382 OE1 GLU A 86 3.061 -4.128 -20.218 1.00 0.00 O ATOM 1383 OE2 GLU A 86 5.177 -4.211 -19.675 1.00 0.00 O ATOM 0 H GLU A 86 1.980 -3.631 -19.017 1.00 0.00 H new ATOM 0 HA GLU A 86 0.479 -4.806 -17.021 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.108 -6.641 -17.370 1.00 0.00 H new ATOM 0 HB3 GLU A 86 1.623 -5.934 -18.898 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.209 -5.206 -17.471 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.093 -6.510 -18.637 1.00 0.00 H new ATOM 1552 N ALA B 8 -3.646 -11.176 -13.698 1.00 0.00 N ATOM 1553 CA ALA B 8 -2.938 -9.975 -13.280 1.00 0.00 C ATOM 1554 C ALA B 8 -3.110 -8.858 -14.312 1.00 0.00 C ATOM 1555 O ALA B 8 -3.588 -7.778 -13.978 1.00 0.00 O ATOM 1556 CB ALA B 8 -1.465 -10.304 -13.019 1.00 0.00 C ATOM 0 HA ALA B 8 -3.366 -9.609 -12.347 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -0.940 -9.401 -12.707 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -1.394 -11.056 -12.233 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -1.011 -10.690 -13.932 1.00 0.00 H new ATOM 1562 N ILE B 9 -2.761 -9.124 -15.573 1.00 0.00 N ATOM 1563 CA ILE B 9 -2.950 -8.195 -16.685 1.00 0.00 C ATOM 1564 C ILE B 9 -4.415 -7.744 -16.725 1.00 0.00 C ATOM 1565 O ILE B 9 -4.709 -6.542 -16.722 1.00 0.00 O ATOM 1566 CB ILE B 9 -2.486 -8.868 -17.992 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -0.961 -9.096 -17.949 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -2.833 -8.001 -19.209 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -0.476 -10.083 -19.016 1.00 0.00 C ATOM 0 H ILE B 9 -2.332 -10.006 -15.853 1.00 0.00 H new ATOM 0 HA ILE B 9 -2.345 -7.298 -16.555 1.00 0.00 H new ATOM 0 HB ILE B 9 -3.002 -9.824 -18.084 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -0.452 -8.142 -18.086 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -0.682 -9.468 -16.963 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -2.495 -8.498 -20.118 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -3.912 -7.854 -19.255 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -2.339 -7.034 -19.119 1.00 0.00 H new ATOM 0 HD11 ILE B 9 0.604 -10.203 -18.936 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -0.960 -11.048 -18.866 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -0.727 -9.701 -20.006 1.00 0.00 H new ATOM 1581 N GLY B 10 -5.335 -8.713 -16.722 1.00 0.00 N ATOM 1582 CA GLY B 10 -6.765 -8.471 -16.637 1.00 0.00 C ATOM 1583 C GLY B 10 -7.098 -7.447 -15.552 1.00 0.00 C ATOM 1584 O GLY B 10 -7.849 -6.504 -15.791 1.00 0.00 O ATOM 0 H GLY B 10 -5.095 -9.703 -16.780 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -7.132 -8.115 -17.599 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -7.281 -9.407 -16.425 1.00 0.00 H new ATOM 1588 N LEU B 11 -6.518 -7.591 -14.363 1.00 0.00 N ATOM 1589 CA LEU B 11 -6.830 -6.731 -13.236 1.00 0.00 C ATOM 1590 C LEU B 11 -6.355 -5.289 -13.431 1.00 0.00 C ATOM 1591 O LEU B 11 -6.788 -4.394 -12.702 1.00 0.00 O ATOM 1592 CB LEU B 11 -6.301 -7.382 -11.945 1.00 0.00 C ATOM 1593 CG LEU B 11 -6.603 -6.631 -10.636 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -8.107 -6.436 -10.421 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -6.021 -7.423 -9.460 1.00 0.00 C ATOM 0 H LEU B 11 -5.821 -8.307 -14.159 1.00 0.00 H new ATOM 0 HA LEU B 11 -7.913 -6.640 -13.155 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -6.720 -8.385 -11.870 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -5.221 -7.494 -12.035 1.00 0.00 H new ATOM 0 HG LEU B 11 -6.146 -5.643 -10.700 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -8.275 -5.902 -9.486 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -8.521 -5.859 -11.248 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -8.597 -7.408 -10.376 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -6.231 -6.898 -8.528 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -6.475 -8.413 -9.428 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -4.943 -7.522 -9.586 1.00 0.00 H new ATOM 1607 N LEU B 12 -5.504 -5.020 -14.422 1.00 0.00 N ATOM 1608 CA LEU B 12 -5.245 -3.646 -14.801 1.00 0.00 C ATOM 1609 C LEU B 12 -6.253 -3.237 -15.862 1.00 0.00 C ATOM 1610 O LEU B 12 -7.122 -2.396 -15.631 1.00 0.00 O ATOM 1611 CB LEU B 12 -3.877 -3.457 -15.450 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.640 -3.559 -14.579 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.363 -5.014 -14.213 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -1.499 -3.114 -15.486 1.00 0.00 C ATOM 0 H LEU B 12 -4.997 -5.722 -14.961 1.00 0.00 H new ATOM 0 HA LEU B 12 -5.303 -3.056 -13.886 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.783 -4.196 -16.246 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -3.868 -2.475 -15.924 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.752 -2.975 -13.666 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.472 -5.069 -13.588 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.215 -5.420 -13.667 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.204 -5.594 -15.122 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.559 -3.156 -14.936 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.443 -3.775 -16.351 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -1.678 -2.092 -15.821 1.00 0.00 H new ATOM 1626 N ILE B 13 -6.063 -3.809 -17.053 1.00 0.00 N ATOM 1627 CA ILE B 13 -6.675 -3.348 -18.281 1.00 0.00 C ATOM 1628 C ILE B 13 -8.031 -4.002 -18.533 1.00 0.00 C ATOM 1629 O ILE B 13 -8.934 -3.360 -19.069 1.00 0.00 O ATOM 1630 CB ILE B 13 -5.714 -3.482 -19.486 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -4.506 -4.409 -19.262 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -5.153 -2.107 -19.896 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -3.609 -4.521 -20.500 1.00 0.00 C ATOM 0 H ILE B 13 -5.464 -4.624 -17.183 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.874 -2.283 -18.159 1.00 0.00 H new ATOM 0 HB ILE B 13 -6.337 -3.926 -20.262 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.917 -4.036 -18.424 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -4.861 -5.401 -18.985 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.480 -2.227 -20.745 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.975 -1.447 -20.175 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.607 -1.673 -19.059 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -2.773 -5.187 -20.285 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -4.187 -4.921 -21.333 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.228 -3.534 -20.764 1.00 0.00 H new ATOM 1645 N GLY B 14 -8.197 -5.259 -18.132 1.00 0.00 N ATOM 1646 CA GLY B 14 -9.485 -5.920 -18.265 1.00 0.00 C ATOM 1647 C GLY B 14 -10.496 -5.156 -17.421 1.00 0.00 C ATOM 1648 O GLY B 14 -11.538 -4.730 -17.915 1.00 0.00 O ATOM 0 H GLY B 14 -7.463 -5.833 -17.717 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -9.797 -5.939 -19.309 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -9.417 -6.956 -17.933 1.00 0.00 H new ATOM 1652 N ILE B 15 -10.153 -4.939 -16.149 1.00 0.00 N ATOM 1653 CA ILE B 15 -11.022 -4.227 -15.230 1.00 0.00 C ATOM 1654 C ILE B 15 -11.197 -2.768 -15.678 1.00 0.00 C ATOM 1655 O ILE B 15 -12.336 -2.319 -15.748 1.00 0.00 O ATOM 1656 CB ILE B 15 -10.596 -4.462 -13.768 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -11.833 -4.605 -12.864 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -9.643 -3.380 -13.257 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -11.478 -5.176 -11.487 1.00 0.00 C ATOM 0 H ILE B 15 -9.273 -5.251 -15.738 1.00 0.00 H new ATOM 0 HA ILE B 15 -12.033 -4.634 -15.262 1.00 0.00 H new ATOM 0 HB ILE B 15 -10.038 -5.398 -13.735 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -12.306 -3.631 -12.741 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -12.562 -5.255 -13.348 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.373 -3.592 -12.222 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.743 -3.368 -13.872 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -10.133 -2.408 -13.312 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -12.382 -5.259 -10.884 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.030 -6.162 -11.607 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -10.770 -4.513 -10.990 1.00 0.00 H new ATOM 1671 N PHE B 16 -10.118 -2.057 -16.059 1.00 0.00 N ATOM 1672 CA PHE B 16 -10.198 -0.754 -16.734 1.00 0.00 C ATOM 1673 C PHE B 16 -11.332 -0.784 -17.745 1.00 0.00 C ATOM 1674 O PHE B 16 -12.359 -0.133 -17.544 1.00 0.00 O ATOM 1675 CB PHE B 16 -8.845 -0.408 -17.362 1.00 0.00 C ATOM 1676 CG PHE B 16 -8.657 0.937 -18.030 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -9.633 1.482 -18.880 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -7.362 1.478 -18.047 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -9.333 2.549 -19.720 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -7.023 2.484 -18.964 1.00 0.00 C ATOM 1681 CZ PHE B 16 -8.020 3.055 -19.779 1.00 0.00 C ATOM 0 H PHE B 16 -9.162 -2.376 -15.904 1.00 0.00 H new ATOM 0 HA PHE B 16 -10.421 0.037 -16.018 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -8.090 -0.493 -16.580 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -8.623 -1.175 -18.104 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -10.630 1.067 -18.881 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -6.621 1.117 -17.349 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -10.109 2.990 -20.328 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -6.000 2.820 -19.045 1.00 0.00 H new ATOM 0 HZ PHE B 16 -7.780 3.873 -20.442 1.00 0.00 H new ATOM 1691 N HIS B 17 -11.154 -1.494 -18.862 1.00 0.00 N ATOM 1692 CA HIS B 17 -12.118 -1.346 -19.937 1.00 0.00 C ATOM 1693 C HIS B 17 -13.369 -2.208 -19.713 1.00 0.00 C ATOM 1694 O HIS B 17 -14.102 -2.470 -20.666 1.00 0.00 O ATOM 1695 CB HIS B 17 -11.494 -1.423 -21.337 1.00 0.00 C ATOM 1696 CG HIS B 17 -10.272 -0.582 -21.604 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -10.265 0.616 -22.282 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -9.005 -0.798 -21.151 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -9.018 1.111 -22.219 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -8.229 0.264 -21.542 1.00 0.00 N ATOM 0 H HIS B 17 -10.388 -2.145 -19.036 1.00 0.00 H new ATOM 0 HA HIS B 17 -12.486 -0.321 -19.900 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -11.235 -2.464 -21.532 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -12.259 -1.144 -22.062 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -11.062 1.049 -22.748 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -8.671 -1.654 -20.584 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -8.699 2.049 -22.649 1.00 0.00 H new ATOM 1708 N LYS B 18 -13.648 -2.643 -18.474 1.00 0.00 N ATOM 1709 CA LYS B 18 -14.976 -3.136 -18.125 1.00 0.00 C ATOM 1710 C LYS B 18 -15.877 -1.920 -18.291 1.00 0.00 C ATOM 1711 O LYS B 18 -16.973 -2.011 -18.832 1.00 0.00 O ATOM 1712 CB LYS B 18 -15.017 -3.612 -16.658 1.00 0.00 C ATOM 1713 CG LYS B 18 -16.384 -4.079 -16.107 1.00 0.00 C ATOM 1714 CD LYS B 18 -17.443 -2.963 -15.968 1.00 0.00 C ATOM 1715 CE LYS B 18 -18.417 -3.176 -14.799 1.00 0.00 C ATOM 1716 NZ LYS B 18 -19.549 -2.220 -14.833 1.00 0.00 N ATOM 0 H LYS B 18 -12.974 -2.661 -17.708 1.00 0.00 H new ATOM 0 HA LYS B 18 -15.275 -3.984 -18.742 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -14.310 -4.434 -16.549 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -14.659 -2.798 -16.028 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -16.778 -4.855 -16.763 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -16.229 -4.537 -15.130 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -16.935 -2.007 -15.837 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -18.012 -2.897 -16.895 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -18.803 -4.195 -14.831 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -17.880 -3.068 -13.857 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -20.114 -2.321 -13.966 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -19.182 -1.249 -14.896 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -20.146 -2.419 -15.661 1.00 0.00 H new ATOM 1730 N TYR B 19 -15.395 -0.772 -17.807 1.00 0.00 N ATOM 1731 CA TYR B 19 -16.150 0.452 -17.640 1.00 0.00 C ATOM 1732 C TYR B 19 -16.356 1.207 -18.952 1.00 0.00 C ATOM 1733 O TYR B 19 -15.954 2.358 -19.111 1.00 0.00 O ATOM 1734 CB TYR B 19 -15.453 1.256 -16.539 1.00 0.00 C ATOM 1735 CG TYR B 19 -15.535 0.562 -15.193 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -16.747 0.583 -14.482 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.440 -0.155 -14.677 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -16.856 -0.092 -13.258 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.528 -0.767 -13.412 1.00 0.00 C ATOM 1740 CZ TYR B 19 -15.755 -0.781 -12.732 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.862 -1.368 -11.505 1.00 0.00 O ATOM 0 H TYR B 19 -14.424 -0.676 -17.511 1.00 0.00 H new ATOM 0 HA TYR B 19 -17.173 0.241 -17.330 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -14.407 1.407 -16.806 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -15.909 2.243 -16.467 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -17.596 1.120 -14.879 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -13.530 -0.236 -15.253 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -17.792 -0.081 -12.719 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -13.656 -1.223 -12.968 1.00 0.00 H new ATOM 0 HH TYR B 19 -16.791 -1.639 -11.352 1.00 0.00 H new ATOM 1751 N SER B 20 -17.038 0.529 -19.869 1.00 0.00 N ATOM 1752 CA SER B 20 -17.624 1.043 -21.088 1.00 0.00 C ATOM 1753 C SER B 20 -19.140 1.051 -20.884 1.00 0.00 C ATOM 1754 O SER B 20 -19.814 1.946 -21.383 1.00 0.00 O ATOM 1755 CB SER B 20 -17.213 0.163 -22.266 1.00 0.00 C ATOM 1756 OG SER B 20 -17.119 -1.186 -21.851 1.00 0.00 O ATOM 0 H SER B 20 -17.205 -0.472 -19.765 1.00 0.00 H new ATOM 0 HA SER B 20 -17.279 2.053 -21.311 1.00 0.00 H new ATOM 0 HB2 SER B 20 -17.942 0.255 -23.071 1.00 0.00 H new ATOM 0 HB3 SER B 20 -16.255 0.498 -22.664 1.00 0.00 H new ATOM 0 HG SER B 20 -17.988 -1.485 -21.511 1.00 0.00 H new ATOM 1762 N GLY B 21 -19.700 0.083 -20.149 1.00 0.00 N ATOM 1763 CA GLY B 21 -21.098 0.069 -19.736 1.00 0.00 C ATOM 1764 C GLY B 21 -21.998 -0.412 -20.871 1.00 0.00 C ATOM 1765 O GLY B 21 -22.773 -1.351 -20.714 1.00 0.00 O ATOM 0 H GLY B 21 -19.177 -0.729 -19.820 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -21.219 -0.582 -18.870 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -21.400 1.070 -19.427 1.00 0.00 H new ATOM 1825 N LYS B 26 -15.474 0.088 -26.026 1.00 0.00 N ATOM 1826 CA LYS B 26 -14.250 -0.128 -25.263 1.00 0.00 C ATOM 1827 C LYS B 26 -13.248 1.007 -25.510 1.00 0.00 C ATOM 1828 O LYS B 26 -12.609 1.051 -26.557 1.00 0.00 O ATOM 1829 CB LYS B 26 -13.630 -1.494 -25.616 1.00 0.00 C ATOM 1830 CG LYS B 26 -14.509 -2.710 -25.274 1.00 0.00 C ATOM 1831 CD LYS B 26 -15.002 -2.624 -23.826 1.00 0.00 C ATOM 1832 CE LYS B 26 -15.603 -3.916 -23.257 1.00 0.00 C ATOM 1833 NZ LYS B 26 -16.120 -3.663 -21.897 1.00 0.00 N ATOM 0 HA LYS B 26 -14.501 -0.130 -24.202 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.409 -1.512 -26.683 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.679 -1.592 -25.092 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -15.361 -2.753 -25.953 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.941 -3.629 -25.417 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -14.167 -2.322 -23.193 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -15.752 -1.836 -23.762 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -16.406 -4.271 -23.903 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -14.846 -4.700 -23.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -16.587 -4.520 -21.538 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -15.332 -3.409 -21.268 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -16.805 -2.881 -21.926 1.00 0.00 H new ATOM 1847 N HIS B 27 -13.085 1.917 -24.541 1.00 0.00 N ATOM 1848 CA HIS B 27 -12.141 3.029 -24.628 1.00 0.00 C ATOM 1849 C HIS B 27 -11.866 3.583 -23.228 1.00 0.00 C ATOM 1850 O HIS B 27 -11.789 2.796 -22.287 1.00 0.00 O ATOM 1851 CB HIS B 27 -12.687 4.087 -25.613 1.00 0.00 C ATOM 1852 CG HIS B 27 -14.083 4.579 -25.282 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -14.570 4.883 -24.019 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -15.154 4.545 -26.136 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -15.902 4.971 -24.100 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -16.274 4.814 -25.374 1.00 0.00 N ATOM 0 H HIS B 27 -13.612 1.898 -23.668 1.00 0.00 H new ATOM 0 HA HIS B 27 -11.181 2.695 -25.022 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -12.007 4.939 -25.628 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -12.691 3.665 -26.618 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -14.010 5.016 -23.177 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -15.128 4.347 -27.197 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -16.570 5.142 -23.269 1.00 0.00 H new ATOM 1864 N THR B 28 -11.729 4.903 -23.078 1.00 0.00 N ATOM 1865 CA THR B 28 -11.641 5.610 -21.811 1.00 0.00 C ATOM 1866 C THR B 28 -12.806 5.236 -20.893 1.00 0.00 C ATOM 1867 O THR B 28 -13.854 4.802 -21.377 1.00 0.00 O ATOM 1868 CB THR B 28 -11.725 7.108 -22.138 1.00 0.00 C ATOM 1869 OG1 THR B 28 -12.723 7.292 -23.133 1.00 0.00 O ATOM 1870 CG2 THR B 28 -10.381 7.609 -22.679 1.00 0.00 C ATOM 0 H THR B 28 -11.674 5.532 -23.879 1.00 0.00 H new ATOM 0 HA THR B 28 -10.714 5.351 -21.299 1.00 0.00 H new ATOM 0 HB THR B 28 -11.971 7.666 -21.235 1.00 0.00 H new ATOM 0 HG1 THR B 28 -13.453 7.834 -22.768 1.00 0.00 H new ATOM 0 HG21 THR B 28 -10.454 8.672 -22.907 1.00 0.00 H new ATOM 0 HG22 THR B 28 -9.605 7.451 -21.930 1.00 0.00 H new ATOM 0 HG23 THR B 28 -10.126 7.060 -23.586 1.00 0.00 H new ATOM 1878 N LEU B 29 -12.647 5.439 -19.584 1.00 0.00 N ATOM 1879 CA LEU B 29 -13.780 5.327 -18.679 1.00 0.00 C ATOM 1880 C LEU B 29 -14.542 6.646 -18.793 1.00 0.00 C ATOM 1881 O LEU B 29 -14.146 7.638 -18.183 1.00 0.00 O ATOM 1882 CB LEU B 29 -13.346 5.028 -17.239 1.00 0.00 C ATOM 1883 CG LEU B 29 -12.437 3.793 -17.111 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.951 4.125 -17.294 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -12.566 3.215 -15.705 1.00 0.00 C ATOM 0 H LEU B 29 -11.761 5.677 -19.138 1.00 0.00 H new ATOM 0 HA LEU B 29 -14.416 4.485 -18.953 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -12.823 5.896 -16.839 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -14.234 4.880 -16.625 1.00 0.00 H new ATOM 0 HG LEU B 29 -12.755 3.100 -17.890 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -10.360 3.215 -17.193 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -10.793 4.552 -18.284 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -10.643 4.844 -16.535 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -11.923 2.340 -15.611 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -12.266 3.966 -14.974 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -13.601 2.926 -15.524 1.00 0.00 H new ATOM 1897 N SER B 30 -15.582 6.674 -19.632 1.00 0.00 N ATOM 1898 CA SER B 30 -16.269 7.893 -20.039 1.00 0.00 C ATOM 1899 C SER B 30 -17.175 8.495 -18.970 1.00 0.00 C ATOM 1900 O SER B 30 -18.391 8.637 -19.157 1.00 0.00 O ATOM 1901 CB SER B 30 -17.025 7.637 -21.340 1.00 0.00 C ATOM 1902 OG SER B 30 -16.111 7.162 -22.300 1.00 0.00 O ATOM 0 H SER B 30 -15.974 5.831 -20.053 1.00 0.00 H new ATOM 0 HA SER B 30 -15.501 8.650 -20.198 1.00 0.00 H new ATOM 0 HB2 SER B 30 -17.819 6.908 -21.180 1.00 0.00 H new ATOM 0 HB3 SER B 30 -17.500 8.554 -21.689 1.00 0.00 H new ATOM 0 HG SER B 30 -15.594 7.913 -22.659 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.547 8.954 -17.888 1.00 0.00 N ATOM 1909 CA LYS B 31 -17.138 9.666 -16.771 1.00 0.00 C ATOM 1910 C LYS B 31 -18.092 8.776 -15.978 1.00 0.00 C ATOM 1911 O LYS B 31 -17.785 8.373 -14.861 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.774 11.018 -17.192 1.00 0.00 C ATOM 1913 CG LYS B 31 -17.317 11.587 -18.550 1.00 0.00 C ATOM 1914 CD LYS B 31 -17.851 13.010 -18.779 1.00 0.00 C ATOM 1915 CE LYS B 31 -17.748 13.430 -20.254 1.00 0.00 C ATOM 1916 NZ LYS B 31 -16.417 13.158 -20.834 1.00 0.00 N ATOM 0 H LYS B 31 -15.542 8.826 -17.767 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.325 9.929 -16.094 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.857 10.895 -17.218 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -17.556 11.755 -16.420 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -16.228 11.596 -18.593 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.662 10.935 -19.352 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.891 13.063 -18.458 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.290 13.712 -18.162 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.506 12.901 -20.832 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -17.966 14.494 -20.340 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -16.382 13.522 -21.808 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -15.686 13.628 -20.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -16.244 12.132 -20.841 1.00 0.00 H new ATOM 1930 N LYS B 32 -19.246 8.457 -16.552 1.00 0.00 N ATOM 1931 CA LYS B 32 -20.330 7.748 -15.887 1.00 0.00 C ATOM 1932 C LYS B 32 -19.795 6.423 -15.344 1.00 0.00 C ATOM 1933 O LYS B 32 -19.884 6.113 -14.156 1.00 0.00 O ATOM 1934 CB LYS B 32 -21.470 7.498 -16.892 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.853 8.717 -17.756 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.717 8.335 -18.969 1.00 0.00 C ATOM 1937 CE LYS B 32 -22.135 7.225 -19.868 1.00 0.00 C ATOM 1938 NZ LYS B 32 -20.698 7.379 -20.192 1.00 0.00 N ATOM 0 H LYS B 32 -19.458 8.692 -17.522 1.00 0.00 H new ATOM 0 HA LYS B 32 -20.719 8.343 -15.060 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.180 6.680 -17.552 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -22.352 7.168 -16.344 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -22.394 9.437 -17.142 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -20.945 9.211 -18.102 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -23.695 8.014 -18.611 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -22.876 9.226 -19.576 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -22.281 6.264 -19.375 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -22.702 7.196 -20.799 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -20.392 6.591 -20.798 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -20.549 8.279 -20.692 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -20.142 7.375 -19.313 1.00 0.00 H new ATOM 1952 N GLU B 33 -19.183 5.670 -16.251 1.00 0.00 N ATOM 1953 CA GLU B 33 -18.589 4.384 -16.005 1.00 0.00 C ATOM 1954 C GLU B 33 -17.450 4.525 -14.982 1.00 0.00 C ATOM 1955 O GLU B 33 -17.245 3.639 -14.154 1.00 0.00 O ATOM 1956 CB GLU B 33 -18.141 3.784 -17.349 1.00 0.00 C ATOM 1957 CG GLU B 33 -19.223 3.721 -18.455 1.00 0.00 C ATOM 1958 CD GLU B 33 -19.327 4.951 -19.352 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -18.975 6.047 -18.873 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -19.851 4.874 -20.494 1.00 0.00 O ATOM 0 H GLU B 33 -19.089 5.965 -17.223 1.00 0.00 H new ATOM 0 HA GLU B 33 -19.307 3.692 -15.565 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -17.300 4.368 -17.723 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -17.773 2.774 -17.169 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -19.024 2.852 -19.083 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -20.191 3.557 -17.981 1.00 0.00 H new ATOM 1967 N LEU B 34 -16.730 5.656 -14.967 1.00 0.00 N ATOM 1968 CA LEU B 34 -15.751 5.868 -13.911 1.00 0.00 C ATOM 1969 C LEU B 34 -16.464 6.023 -12.566 1.00 0.00 C ATOM 1970 O LEU B 34 -16.054 5.419 -11.577 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.890 7.092 -14.213 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.781 7.273 -13.167 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -12.573 6.384 -13.471 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -13.447 8.760 -13.142 1.00 0.00 C ATOM 0 H LEU B 34 -16.807 6.409 -15.651 1.00 0.00 H new ATOM 0 HA LEU B 34 -15.093 5.001 -13.860 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -14.445 6.989 -15.203 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -15.518 7.983 -14.237 1.00 0.00 H new ATOM 0 HG LEU B 34 -14.109 6.956 -12.177 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -11.807 6.538 -12.711 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.881 5.338 -13.469 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -12.169 6.642 -14.450 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.660 8.944 -12.411 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.106 9.073 -14.129 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -14.336 9.328 -12.869 1.00 0.00 H new ATOM 1986 N LYS B 35 -17.530 6.828 -12.505 1.00 0.00 N ATOM 1987 CA LYS B 35 -18.248 6.990 -11.249 1.00 0.00 C ATOM 1988 C LYS B 35 -18.862 5.653 -10.796 1.00 0.00 C ATOM 1989 O LYS B 35 -19.093 5.468 -9.603 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.223 8.175 -11.278 1.00 0.00 C ATOM 1991 CG LYS B 35 -18.641 9.486 -11.853 1.00 0.00 C ATOM 1992 CD LYS B 35 -17.249 9.928 -11.347 1.00 0.00 C ATOM 1993 CE LYS B 35 -16.669 10.994 -12.299 1.00 0.00 C ATOM 1994 NZ LYS B 35 -15.438 11.650 -11.801 1.00 0.00 N ATOM 0 H LYS B 35 -17.902 7.362 -13.290 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.533 7.264 -10.473 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -20.096 7.894 -11.867 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.571 8.364 -10.263 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -18.589 9.384 -12.937 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.347 10.289 -11.642 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -17.329 10.332 -10.338 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -16.580 9.069 -11.295 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -16.455 10.528 -13.261 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -17.427 11.757 -12.477 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -14.991 12.182 -12.575 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -15.680 12.301 -11.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -14.777 10.927 -11.451 1.00 0.00 H new ATOM 2008 N GLU B 36 -19.084 4.701 -11.713 1.00 0.00 N ATOM 2009 CA GLU B 36 -19.383 3.328 -11.315 1.00 0.00 C ATOM 2010 C GLU B 36 -18.153 2.743 -10.607 1.00 0.00 C ATOM 2011 O GLU B 36 -18.222 2.279 -9.468 1.00 0.00 O ATOM 2012 CB GLU B 36 -19.808 2.465 -12.519 1.00 0.00 C ATOM 2013 CG GLU B 36 -20.447 1.135 -12.071 1.00 0.00 C ATOM 2014 CD GLU B 36 -20.346 0.018 -13.106 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -19.936 0.269 -14.261 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.569 -1.155 -12.732 1.00 0.00 O ATOM 0 H GLU B 36 -19.062 4.858 -12.721 1.00 0.00 H new ATOM 0 HA GLU B 36 -20.229 3.329 -10.628 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -20.517 3.021 -13.133 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -18.939 2.259 -13.144 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -19.968 0.806 -11.149 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -21.498 1.308 -11.840 1.00 0.00 H new ATOM 2023 N LEU B 37 -17.015 2.780 -11.302 1.00 0.00 N ATOM 2024 CA LEU B 37 -15.751 2.200 -10.887 1.00 0.00 C ATOM 2025 C LEU B 37 -15.408 2.570 -9.461 1.00 0.00 C ATOM 2026 O LEU B 37 -15.094 1.684 -8.663 1.00 0.00 O ATOM 2027 CB LEU B 37 -14.626 2.601 -11.857 1.00 0.00 C ATOM 2028 CG LEU B 37 -13.327 1.832 -11.578 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -12.412 1.847 -12.800 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -12.486 2.406 -10.432 1.00 0.00 C ATOM 0 H LEU B 37 -16.954 3.238 -12.211 1.00 0.00 H new ATOM 0 HA LEU B 37 -15.855 1.115 -10.919 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -14.946 2.413 -12.882 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -14.439 3.672 -11.773 1.00 0.00 H new ATOM 0 HG LEU B 37 -13.668 0.831 -11.313 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -11.498 1.296 -12.577 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.922 1.379 -13.642 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -12.161 2.877 -13.054 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -11.587 1.803 -10.303 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -12.204 3.432 -10.667 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -13.068 2.391 -9.511 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.438 3.870 -9.150 1.00 0.00 N ATOM 2043 CA ILE B 38 -14.942 4.354 -7.870 1.00 0.00 C ATOM 2044 C ILE B 38 -15.576 3.616 -6.685 1.00 0.00 C ATOM 2045 O ILE B 38 -14.911 3.380 -5.679 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.052 5.884 -7.747 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -16.495 6.372 -7.555 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -14.379 6.601 -8.927 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -16.588 7.894 -7.408 1.00 0.00 C ATOM 0 H ILE B 38 -15.799 4.597 -9.767 1.00 0.00 H new ATOM 0 HA ILE B 38 -13.878 4.121 -7.836 1.00 0.00 H new ATOM 0 HB ILE B 38 -14.511 6.147 -6.838 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -17.098 6.055 -8.406 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -16.920 5.899 -6.670 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -14.479 7.679 -8.802 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -13.322 6.336 -8.959 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.858 6.298 -9.858 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -17.630 8.184 -7.275 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -16.010 8.212 -6.541 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -16.190 8.371 -8.304 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.849 3.221 -6.800 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.557 2.517 -5.739 1.00 0.00 C ATOM 2063 C GLN B 39 -16.932 1.141 -5.460 1.00 0.00 C ATOM 2064 O GLN B 39 -17.048 0.623 -4.345 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.038 2.408 -6.137 1.00 0.00 C ATOM 2066 CG GLN B 39 -19.949 1.822 -5.046 1.00 0.00 C ATOM 2067 CD GLN B 39 -19.864 2.573 -3.718 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -19.651 1.966 -2.671 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.004 3.894 -3.743 1.00 0.00 N ATOM 0 H GLN B 39 -17.413 3.383 -7.634 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.475 3.076 -4.807 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.403 3.400 -6.404 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -19.117 1.788 -7.030 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -20.981 1.836 -5.398 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -19.682 0.778 -4.882 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -20.180 4.372 -4.627 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -19.935 4.431 -2.878 1.00 0.00 H new ATOM 2078 N LYS B 40 -16.309 0.532 -6.474 1.00 0.00 N ATOM 2079 CA LYS B 40 -15.779 -0.818 -6.415 1.00 0.00 C ATOM 2080 C LYS B 40 -14.317 -0.858 -5.953 1.00 0.00 C ATOM 2081 O LYS B 40 -14.057 -1.290 -4.834 1.00 0.00 O ATOM 2082 CB LYS B 40 -15.983 -1.522 -7.767 1.00 0.00 C ATOM 2083 CG LYS B 40 -15.701 -3.030 -7.643 1.00 0.00 C ATOM 2084 CD LYS B 40 -15.814 -3.782 -8.979 1.00 0.00 C ATOM 2085 CE LYS B 40 -14.480 -3.891 -9.735 1.00 0.00 C ATOM 2086 NZ LYS B 40 -13.917 -2.577 -10.095 1.00 0.00 N ATOM 0 H LYS B 40 -16.160 0.982 -7.377 1.00 0.00 H new ATOM 0 HA LYS B 40 -16.338 -1.366 -5.656 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.004 -1.365 -8.114 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.322 -1.084 -8.514 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -14.700 -3.173 -7.237 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -16.400 -3.466 -6.929 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -16.199 -4.784 -8.791 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.541 -3.274 -9.612 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -13.762 -4.432 -9.119 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -14.628 -4.478 -10.641 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -13.115 -2.709 -10.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -14.648 -2.002 -10.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -13.591 -2.092 -9.235 1.00 0.00 H new ATOM 2100 N GLU B 41 -13.364 -0.505 -6.832 1.00 0.00 N ATOM 2101 CA GLU B 41 -11.944 -0.770 -6.585 1.00 0.00 C ATOM 2102 C GLU B 41 -11.137 0.345 -5.905 1.00 0.00 C ATOM 2103 O GLU B 41 -10.923 0.296 -4.697 1.00 0.00 O ATOM 2104 CB GLU B 41 -11.248 -1.397 -7.813 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.193 -0.581 -9.114 1.00 0.00 C ATOM 2106 CD GLU B 41 -10.706 -1.439 -10.272 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -9.473 -1.601 -10.410 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -11.599 -1.961 -10.969 1.00 0.00 O ATOM 0 H GLU B 41 -13.555 -0.036 -7.718 1.00 0.00 H new ATOM 0 HA GLU B 41 -11.955 -1.526 -5.800 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -10.224 -1.638 -7.528 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.748 -2.340 -8.033 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.182 -0.184 -9.341 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -10.529 0.273 -8.984 1.00 0.00 H new ATOM 2115 N LEU B 42 -10.682 1.324 -6.696 1.00 0.00 N ATOM 2116 CA LEU B 42 -9.623 2.276 -6.364 1.00 0.00 C ATOM 2117 C LEU B 42 -9.419 2.652 -4.895 1.00 0.00 C ATOM 2118 O LEU B 42 -8.670 1.957 -4.215 1.00 0.00 O ATOM 2119 CB LEU B 42 -9.497 3.423 -7.376 1.00 0.00 C ATOM 2120 CG LEU B 42 -10.762 4.097 -7.917 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -11.431 5.053 -6.929 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -10.361 4.826 -9.206 1.00 0.00 C ATOM 0 H LEU B 42 -11.063 1.479 -7.630 1.00 0.00 H new ATOM 0 HA LEU B 42 -8.725 1.672 -6.494 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -8.886 4.199 -6.915 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -8.938 3.043 -8.232 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.515 3.331 -8.102 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -12.318 5.488 -7.388 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -11.718 4.506 -6.031 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -10.734 5.847 -6.662 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -11.234 5.323 -9.629 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -9.594 5.567 -8.981 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -9.970 4.106 -9.925 1.00 0.00 H new ATOM 2134 N THR B 43 -9.997 3.745 -4.392 1.00 0.00 N ATOM 2135 CA THR B 43 -9.762 4.249 -3.047 1.00 0.00 C ATOM 2136 C THR B 43 -10.501 3.386 -2.025 1.00 0.00 C ATOM 2137 O THR B 43 -11.423 3.846 -1.357 1.00 0.00 O ATOM 2138 CB THR B 43 -10.172 5.722 -3.018 1.00 0.00 C ATOM 2139 OG1 THR B 43 -11.425 5.875 -3.650 1.00 0.00 O ATOM 2140 CG2 THR B 43 -9.151 6.589 -3.762 1.00 0.00 C ATOM 0 H THR B 43 -10.655 4.313 -4.925 1.00 0.00 H new ATOM 0 HA THR B 43 -8.708 4.189 -2.774 1.00 0.00 H new ATOM 0 HB THR B 43 -10.223 6.038 -1.976 1.00 0.00 H new ATOM 0 HG1 THR B 43 -11.688 6.819 -3.630 1.00 0.00 H new ATOM 0 HG21 THR B 43 -9.465 7.632 -3.727 1.00 0.00 H new ATOM 0 HG22 THR B 43 -8.174 6.488 -3.289 1.00 0.00 H new ATOM 0 HG23 THR B 43 -9.086 6.264 -4.800 1.00 0.00 H new ATOM 2148 N ILE B 44 -10.103 2.114 -1.936 1.00 0.00 N ATOM 2149 CA ILE B 44 -10.797 1.054 -1.224 1.00 0.00 C ATOM 2150 C ILE B 44 -12.311 1.206 -1.400 1.00 0.00 C ATOM 2151 O ILE B 44 -13.094 1.404 -0.468 1.00 0.00 O ATOM 2152 CB ILE B 44 -10.241 0.863 0.187 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -10.923 -0.312 0.909 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -10.238 2.143 1.028 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -10.001 -0.940 1.957 1.00 0.00 C ATOM 0 H ILE B 44 -9.246 1.787 -2.382 1.00 0.00 H new ATOM 0 HA ILE B 44 -10.593 0.078 -1.665 1.00 0.00 H new ATOM 0 HB ILE B 44 -9.189 0.606 0.062 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -11.837 0.037 1.390 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -11.215 -1.068 0.180 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -9.830 1.928 2.016 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -9.624 2.899 0.538 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -11.258 2.514 1.130 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -10.516 -1.766 2.447 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -9.098 -1.312 1.472 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -9.731 -0.190 2.700 1.00 0.00 H new ATOM 2167 N GLY B 45 -12.675 1.159 -2.678 1.00 0.00 N ATOM 2168 CA GLY B 45 -14.010 1.352 -3.219 1.00 0.00 C ATOM 2169 C GLY B 45 -14.639 2.685 -2.823 1.00 0.00 C ATOM 2170 O GLY B 45 -15.850 2.748 -2.626 1.00 0.00 O ATOM 0 H GLY B 45 -11.993 0.971 -3.413 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -13.966 1.289 -4.306 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -14.653 0.540 -2.878 1.00 0.00 H new ATOM 2373 N ASP B 58 -10.129 14.178 -5.388 1.00 0.00 N ATOM 2374 CA ASP B 58 -9.830 12.897 -6.029 1.00 0.00 C ATOM 2375 C ASP B 58 -10.731 12.506 -7.194 1.00 0.00 C ATOM 2376 O ASP B 58 -10.412 11.594 -7.951 1.00 0.00 O ATOM 2377 CB ASP B 58 -9.732 11.839 -4.927 1.00 0.00 C ATOM 2378 CG ASP B 58 -9.392 10.458 -5.454 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -8.264 10.297 -5.963 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -10.267 9.580 -5.278 1.00 0.00 O ATOM 0 HA ASP B 58 -8.874 12.992 -6.543 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -8.973 12.143 -4.207 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -10.680 11.793 -4.391 1.00 0.00 H new ATOM 2385 N ASP B 59 -11.762 13.297 -7.467 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.491 13.302 -8.735 1.00 0.00 C ATOM 2387 C ASP B 59 -11.541 13.868 -9.824 1.00 0.00 C ATOM 2388 O ASP B 59 -11.986 14.493 -10.776 1.00 0.00 O ATOM 2389 CB ASP B 59 -13.763 14.146 -8.505 1.00 0.00 C ATOM 2390 CG ASP B 59 -14.572 14.582 -9.725 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -15.259 13.716 -10.308 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.593 15.812 -9.976 1.00 0.00 O ATOM 0 H ASP B 59 -12.126 13.973 -6.795 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.803 12.315 -9.077 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -14.426 13.578 -7.852 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -13.472 15.044 -7.960 1.00 0.00 H new ATOM 2397 N LEU B 60 -10.209 13.748 -9.670 1.00 0.00 N ATOM 2398 CA LEU B 60 -9.183 14.410 -10.463 1.00 0.00 C ATOM 2399 C LEU B 60 -9.198 13.977 -11.920 1.00 0.00 C ATOM 2400 O LEU B 60 -8.489 14.556 -12.732 1.00 0.00 O ATOM 2401 CB LEU B 60 -7.800 14.313 -9.799 1.00 0.00 C ATOM 2402 CG LEU B 60 -7.143 12.923 -9.803 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -6.464 12.595 -11.145 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -6.076 12.890 -8.702 1.00 0.00 C ATOM 0 H LEU B 60 -9.809 13.151 -8.946 1.00 0.00 H new ATOM 0 HA LEU B 60 -9.428 15.472 -10.487 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -7.129 15.011 -10.300 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -7.892 14.646 -8.765 1.00 0.00 H new ATOM 0 HG LEU B 60 -7.926 12.184 -9.636 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -6.016 11.603 -11.093 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -7.206 12.617 -11.943 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -5.688 13.333 -11.350 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -5.597 11.911 -8.688 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.327 13.657 -8.898 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -6.544 13.079 -7.736 1.00 0.00 H new ATOM 2416 N ASP B 61 -10.026 12.991 -12.271 1.00 0.00 N ATOM 2417 CA ASP B 61 -10.401 12.705 -13.648 1.00 0.00 C ATOM 2418 C ASP B 61 -10.930 13.983 -14.325 1.00 0.00 C ATOM 2419 O ASP B 61 -10.831 14.167 -15.542 1.00 0.00 O ATOM 2420 CB ASP B 61 -11.458 11.606 -13.618 1.00 0.00 C ATOM 2421 CG ASP B 61 -12.695 11.928 -12.803 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -13.555 12.679 -13.306 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -12.866 11.350 -11.709 1.00 0.00 O ATOM 0 H ASP B 61 -10.458 12.363 -11.594 1.00 0.00 H new ATOM 0 HA ASP B 61 -9.542 12.368 -14.228 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -11.762 11.388 -14.642 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -11.005 10.698 -13.220 1.00 0.00 H new ATOM 2428 N ARG B 62 -11.427 14.902 -13.491 1.00 0.00 N ATOM 2429 CA ARG B 62 -11.763 16.290 -13.810 1.00 0.00 C ATOM 2430 C ARG B 62 -10.630 17.011 -14.570 1.00 0.00 C ATOM 2431 O ARG B 62 -10.890 17.995 -15.256 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.088 16.983 -12.483 1.00 0.00 C ATOM 2433 CG ARG B 62 -12.648 18.406 -12.586 1.00 0.00 C ATOM 2434 CD ARG B 62 -12.650 19.047 -11.191 1.00 0.00 C ATOM 2435 NE ARG B 62 -13.328 18.199 -10.192 1.00 0.00 N ATOM 2436 CZ ARG B 62 -13.156 18.253 -8.865 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -12.269 19.067 -8.290 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -13.882 17.458 -8.092 1.00 0.00 N ATOM 0 H ARG B 62 -11.617 14.680 -12.514 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.619 16.323 -14.484 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.808 16.369 -11.942 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -11.180 17.014 -11.881 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -12.043 18.999 -13.272 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -13.660 18.384 -12.991 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -11.623 19.229 -10.874 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -13.145 20.017 -11.239 1.00 0.00 H new ATOM 0 HE ARG B 62 -13.989 17.507 -10.545 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -11.691 19.679 -8.865 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -12.169 19.077 -7.275 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.558 16.819 -8.510 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -13.765 17.485 -7.079 1.00 0.00 H new ATOM 2452 N ASN B 63 -9.396 16.501 -14.463 1.00 0.00 N ATOM 2453 CA ASN B 63 -8.161 16.911 -15.125 1.00 0.00 C ATOM 2454 C ASN B 63 -8.391 17.569 -16.482 1.00 0.00 C ATOM 2455 O ASN B 63 -7.884 18.664 -16.719 1.00 0.00 O ATOM 2456 CB ASN B 63 -7.289 15.651 -15.300 1.00 0.00 C ATOM 2457 CG ASN B 63 -6.151 15.820 -16.301 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -5.380 16.769 -16.218 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -6.015 14.896 -17.249 1.00 0.00 N ATOM 0 H ASN B 63 -9.226 15.708 -13.844 1.00 0.00 H new ATOM 0 HA ASN B 63 -7.674 17.663 -14.505 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -6.870 15.374 -14.333 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -7.923 14.825 -15.622 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -5.256 14.969 -17.927 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -6.669 14.115 -17.298 1.00 0.00 H new ATOM 2466 N LYS B 64 -9.115 16.890 -17.375 1.00 0.00 N ATOM 2467 CA LYS B 64 -9.317 17.372 -18.734 1.00 0.00 C ATOM 2468 C LYS B 64 -10.787 17.241 -19.164 1.00 0.00 C ATOM 2469 O LYS B 64 -11.360 18.204 -19.667 1.00 0.00 O ATOM 2470 CB LYS B 64 -8.286 16.704 -19.671 1.00 0.00 C ATOM 2471 CG LYS B 64 -8.599 15.229 -19.931 1.00 0.00 C ATOM 2472 CD LYS B 64 -7.461 14.404 -20.543 1.00 0.00 C ATOM 2473 CE LYS B 64 -7.972 13.028 -21.015 1.00 0.00 C ATOM 2474 NZ LYS B 64 -8.811 12.357 -20.000 1.00 0.00 N ATOM 0 H LYS B 64 -9.572 16.000 -17.175 1.00 0.00 H new ATOM 0 HA LYS B 64 -9.127 18.444 -18.794 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -8.262 17.240 -20.620 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -7.292 16.789 -19.232 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -8.891 14.767 -18.988 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -9.462 15.172 -20.595 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -7.027 14.944 -21.385 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -6.668 14.269 -19.808 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -8.547 13.153 -21.932 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -7.121 12.391 -21.257 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -8.821 11.333 -20.180 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -8.422 12.538 -19.053 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -9.781 12.727 -20.052 1.00 0.00 H new ATOM 2488 N ASP B 65 -11.398 16.063 -18.975 1.00 0.00 N ATOM 2489 CA ASP B 65 -12.703 15.734 -19.547 1.00 0.00 C ATOM 2490 C ASP B 65 -13.424 14.584 -18.827 1.00 0.00 C ATOM 2491 O ASP B 65 -14.516 14.201 -19.251 1.00 0.00 O ATOM 2492 CB ASP B 65 -12.503 15.339 -21.019 1.00 0.00 C ATOM 2493 CG ASP B 65 -11.550 14.162 -21.188 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -11.173 13.552 -20.158 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -11.110 13.936 -22.330 1.00 0.00 O ATOM 0 H ASP B 65 -10.995 15.310 -18.417 1.00 0.00 H new ATOM 0 HA ASP B 65 -13.330 16.619 -19.436 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -13.468 15.085 -21.457 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -12.117 16.196 -21.572 1.00 0.00 H new ATOM 2500 N GLN B 66 -12.838 13.995 -17.779 1.00 0.00 N ATOM 2501 CA GLN B 66 -13.344 12.795 -17.126 1.00 0.00 C ATOM 2502 C GLN B 66 -13.403 11.559 -18.044 1.00 0.00 C ATOM 2503 O GLN B 66 -13.998 10.551 -17.666 1.00 0.00 O ATOM 2504 CB GLN B 66 -14.664 13.083 -16.393 1.00 0.00 C ATOM 2505 CG GLN B 66 -14.621 14.425 -15.652 1.00 0.00 C ATOM 2506 CD GLN B 66 -15.774 14.609 -14.670 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -16.884 14.957 -15.062 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -15.505 14.404 -13.386 1.00 0.00 N ATOM 0 H GLN B 66 -11.981 14.351 -17.356 1.00 0.00 H new ATOM 0 HA GLN B 66 -12.611 12.516 -16.369 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -15.485 13.090 -17.110 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -14.868 12.282 -15.683 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -13.677 14.504 -15.112 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -14.641 15.235 -16.381 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -14.569 14.115 -13.101 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -16.234 14.535 -12.685 1.00 0.00 H new ATOM 2517 N GLU B 67 -12.774 11.603 -19.225 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.542 10.443 -20.076 1.00 0.00 C ATOM 2519 C GLU B 67 -11.238 9.828 -19.593 1.00 0.00 C ATOM 2520 O GLU B 67 -10.171 10.078 -20.160 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.417 10.848 -21.554 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.715 11.421 -22.123 1.00 0.00 C ATOM 2523 CD GLU B 67 -14.807 10.370 -22.122 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -14.499 9.227 -22.533 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -15.917 10.720 -21.656 1.00 0.00 O ATOM 0 H GLU B 67 -12.406 12.469 -19.619 1.00 0.00 H new ATOM 0 HA GLU B 67 -13.375 9.743 -20.012 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.623 11.587 -21.657 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.121 9.978 -22.141 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -14.030 12.281 -21.531 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.547 11.778 -23.139 1.00 0.00 H new ATOM 2532 N VAL B 68 -11.309 9.077 -18.499 1.00 0.00 N ATOM 2533 CA VAL B 68 -10.105 8.621 -17.827 1.00 0.00 C ATOM 2534 C VAL B 68 -9.346 7.639 -18.711 1.00 0.00 C ATOM 2535 O VAL B 68 -9.920 6.656 -19.189 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.468 8.004 -16.476 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -9.319 7.285 -15.765 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -10.969 9.109 -15.554 1.00 0.00 C ATOM 0 H VAL B 68 -12.181 8.775 -18.064 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.447 9.470 -17.643 1.00 0.00 H new ATOM 0 HB VAL B 68 -11.224 7.248 -16.689 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.674 6.881 -14.817 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.955 6.471 -16.392 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.509 7.990 -15.579 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.232 8.683 -14.586 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -10.186 9.855 -15.422 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -11.848 9.580 -15.994 1.00 0.00 H new ATOM 2548 N ASN B 69 -8.059 7.928 -18.905 1.00 0.00 N ATOM 2549 CA ASN B 69 -7.082 7.022 -19.498 1.00 0.00 C ATOM 2550 C ASN B 69 -6.279 6.351 -18.377 1.00 0.00 C ATOM 2551 O ASN B 69 -6.421 6.714 -17.207 1.00 0.00 O ATOM 2552 CB ASN B 69 -6.164 7.770 -20.478 1.00 0.00 C ATOM 2553 CG ASN B 69 -4.887 8.288 -19.818 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.830 7.677 -19.940 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -4.968 9.385 -19.080 1.00 0.00 N ATOM 0 H ASN B 69 -7.658 8.829 -18.644 1.00 0.00 H new ATOM 0 HA ASN B 69 -7.599 6.253 -20.072 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.898 7.104 -21.299 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -6.709 8.609 -20.911 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -4.141 9.738 -18.599 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -5.857 9.877 -18.993 1.00 0.00 H new ATOM 2562 N PHE B 70 -5.407 5.396 -18.731 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.598 4.692 -17.743 1.00 0.00 C ATOM 2564 C PHE B 70 -3.877 5.659 -16.804 1.00 0.00 C ATOM 2565 O PHE B 70 -3.904 5.454 -15.595 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.602 3.701 -18.375 1.00 0.00 C ATOM 2567 CG PHE B 70 -3.437 2.448 -17.532 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.957 2.573 -16.218 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -3.954 1.209 -17.959 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -3.002 1.484 -15.335 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -4.086 0.146 -17.042 1.00 0.00 C ATOM 2572 CZ PHE B 70 -3.532 0.264 -15.757 1.00 0.00 C ATOM 0 H PHE B 70 -5.249 5.098 -19.694 1.00 0.00 H new ATOM 0 HA PHE B 70 -5.300 4.103 -17.153 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.947 3.425 -19.371 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.634 4.187 -18.496 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -2.550 3.516 -15.884 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -4.249 1.073 -18.989 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.626 1.590 -14.328 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -4.610 -0.754 -17.326 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.516 -0.589 -15.095 1.00 0.00 H new ATOM 2582 N GLN B 71 -3.223 6.697 -17.339 1.00 0.00 N ATOM 2583 CA GLN B 71 -2.436 7.611 -16.520 1.00 0.00 C ATOM 2584 C GLN B 71 -3.304 8.182 -15.387 1.00 0.00 C ATOM 2585 O GLN B 71 -2.943 8.118 -14.211 1.00 0.00 O ATOM 2586 CB GLN B 71 -1.823 8.726 -17.392 1.00 0.00 C ATOM 2587 CG GLN B 71 -0.422 9.141 -16.916 1.00 0.00 C ATOM 2588 CD GLN B 71 -0.367 9.379 -15.413 1.00 0.00 C ATOM 2589 OE1 GLN B 71 0.103 8.529 -14.667 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -0.906 10.499 -14.944 1.00 0.00 N ATOM 0 H GLN B 71 -3.226 6.920 -18.334 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.610 7.065 -16.064 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -1.766 8.385 -18.426 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.480 9.596 -17.379 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.295 8.365 -17.185 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -0.119 10.049 -17.436 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -1.290 11.189 -15.589 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.936 10.669 -13.939 1.00 0.00 H new ATOM 2599 N GLU B 72 -4.468 8.722 -15.747 1.00 0.00 N ATOM 2600 CA GLU B 72 -5.412 9.296 -14.805 1.00 0.00 C ATOM 2601 C GLU B 72 -5.872 8.228 -13.799 1.00 0.00 C ATOM 2602 O GLU B 72 -5.769 8.439 -12.589 1.00 0.00 O ATOM 2603 CB GLU B 72 -6.568 9.909 -15.604 1.00 0.00 C ATOM 2604 CG GLU B 72 -6.109 11.149 -16.390 1.00 0.00 C ATOM 2605 CD GLU B 72 -7.033 11.461 -17.556 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -7.290 10.536 -18.361 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -7.441 12.635 -17.703 1.00 0.00 O ATOM 0 H GLU B 72 -4.781 8.771 -16.717 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.950 10.087 -14.214 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.970 9.167 -16.294 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.376 10.184 -14.926 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.069 12.008 -15.720 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.097 10.988 -16.763 1.00 0.00 H new ATOM 2614 N TYR B 73 -6.344 7.080 -14.306 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.775 5.934 -13.504 1.00 0.00 C ATOM 2616 C TYR B 73 -5.729 5.605 -12.439 1.00 0.00 C ATOM 2617 O TYR B 73 -6.017 5.652 -11.243 1.00 0.00 O ATOM 2618 CB TYR B 73 -7.049 4.742 -14.442 1.00 0.00 C ATOM 2619 CG TYR B 73 -7.135 3.343 -13.845 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -8.341 2.891 -13.274 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -6.130 2.400 -14.151 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -8.545 1.513 -13.071 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -6.405 1.021 -14.113 1.00 0.00 C ATOM 2624 CZ TYR B 73 -7.621 0.585 -13.575 1.00 0.00 C ATOM 2625 OH TYR B 73 -7.893 -0.745 -13.555 1.00 0.00 O ATOM 0 H TYR B 73 -6.437 6.922 -15.309 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.698 6.171 -12.974 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.988 4.938 -14.959 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -6.264 4.730 -15.199 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -9.106 3.599 -12.993 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -5.140 2.741 -14.417 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -9.413 1.170 -12.527 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -5.688 0.309 -14.494 1.00 0.00 H new ATOM 0 HH TYR B 73 -7.546 -1.162 -14.371 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.512 5.270 -12.873 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.475 4.821 -11.962 1.00 0.00 C ATOM 2637 C ILE B 74 -3.102 5.959 -10.999 1.00 0.00 C ATOM 2638 O ILE B 74 -2.966 5.730 -9.799 1.00 0.00 O ATOM 2639 CB ILE B 74 -2.274 4.228 -12.726 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.353 3.373 -11.842 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -1.388 5.272 -13.416 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.015 2.144 -11.220 1.00 0.00 C ATOM 0 H ILE B 74 -4.227 5.304 -13.852 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.853 4.002 -11.351 1.00 0.00 H new ATOM 0 HB ILE B 74 -2.759 3.609 -13.481 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.502 3.046 -12.439 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.959 3.999 -11.042 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -0.568 4.771 -13.930 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.981 5.832 -14.139 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.985 5.957 -12.670 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.286 1.605 -10.615 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -2.848 2.458 -10.591 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.384 1.490 -12.010 1.00 0.00 H new ATOM 2654 N THR B 75 -2.965 7.191 -11.509 1.00 0.00 N ATOM 2655 CA THR B 75 -2.655 8.355 -10.686 1.00 0.00 C ATOM 2656 C THR B 75 -3.628 8.457 -9.512 1.00 0.00 C ATOM 2657 O THR B 75 -3.203 8.453 -8.357 1.00 0.00 O ATOM 2658 CB THR B 75 -2.658 9.641 -11.531 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.571 9.608 -12.430 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.523 10.908 -10.682 1.00 0.00 C ATOM 0 H THR B 75 -3.067 7.402 -12.502 1.00 0.00 H new ATOM 0 HA THR B 75 -1.651 8.232 -10.279 1.00 0.00 H new ATOM 0 HB THR B 75 -3.616 9.676 -12.050 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.757 8.963 -13.144 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.531 11.784 -11.331 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.356 10.967 -9.982 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.585 10.876 -10.127 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.930 8.562 -9.793 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.882 8.796 -8.716 1.00 0.00 C ATOM 2670 C PHE B 76 -6.064 7.556 -7.851 1.00 0.00 C ATOM 2671 O PHE B 76 -6.120 7.678 -6.630 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.164 9.448 -9.215 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.319 8.538 -9.524 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -9.179 8.199 -8.468 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.767 8.441 -10.847 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.543 7.980 -8.726 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.138 8.303 -11.101 1.00 0.00 C ATOM 2678 CZ PHE B 76 -11.039 8.159 -10.030 1.00 0.00 C ATOM 0 H PHE B 76 -5.335 8.491 -10.727 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.463 9.539 -8.037 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.492 10.168 -8.465 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.928 10.013 -10.117 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.795 8.107 -7.463 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.062 8.472 -11.665 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -11.206 7.676 -7.929 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.503 8.307 -12.118 1.00 0.00 H new ATOM 0 HZ PHE B 76 -12.104 8.186 -10.208 1.00 0.00 H new ATOM 2688 N LEU B 77 -6.063 6.353 -8.438 1.00 0.00 N ATOM 2689 CA LEU B 77 -6.039 5.149 -7.611 1.00 0.00 C ATOM 2690 C LEU B 77 -4.857 5.169 -6.637 1.00 0.00 C ATOM 2691 O LEU B 77 -4.992 4.733 -5.494 1.00 0.00 O ATOM 2692 CB LEU B 77 -6.222 3.859 -8.436 1.00 0.00 C ATOM 2693 CG LEU B 77 -5.002 3.075 -8.934 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -4.381 2.158 -7.872 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -5.499 2.196 -10.092 1.00 0.00 C ATOM 0 H LEU B 77 -6.078 6.192 -9.445 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.919 5.148 -6.968 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.821 3.175 -7.835 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.817 4.119 -9.312 1.00 0.00 H new ATOM 0 HG LEU B 77 -4.228 3.788 -9.219 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.524 1.637 -8.298 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.056 2.756 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.122 1.429 -7.543 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -4.668 1.612 -10.488 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.276 1.523 -9.730 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -5.906 2.829 -10.881 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.725 5.742 -7.060 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.585 6.044 -6.211 1.00 0.00 C ATOM 2709 C GLY B 78 -2.946 6.764 -4.903 1.00 0.00 C ATOM 2710 O GLY B 78 -2.321 6.495 -3.880 1.00 0.00 O ATOM 0 H GLY B 78 -3.580 6.013 -8.032 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -2.069 5.114 -5.970 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.883 6.662 -6.771 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.924 7.679 -4.913 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.226 8.595 -3.811 1.00 0.00 C ATOM 2716 C ALA B 79 -4.166 7.951 -2.425 1.00 0.00 C ATOM 2717 O ALA B 79 -3.293 8.275 -1.623 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.571 9.288 -4.055 1.00 0.00 C ATOM 0 H ALA B 79 -4.544 7.804 -5.713 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.432 9.342 -3.804 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -5.786 9.967 -3.230 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -5.526 9.852 -4.986 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.359 8.538 -4.123 1.00 0.00 H new ATOM 2724 N LEU B 80 -5.089 7.034 -2.136 1.00 0.00 N ATOM 2725 CA LEU B 80 -5.124 6.334 -0.855 1.00 0.00 C ATOM 2726 C LEU B 80 -4.300 5.047 -0.887 1.00 0.00 C ATOM 2727 O LEU B 80 -4.319 4.289 0.081 1.00 0.00 O ATOM 2728 CB LEU B 80 -6.568 5.974 -0.514 1.00 0.00 C ATOM 2729 CG LEU B 80 -7.530 7.153 -0.301 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -8.798 6.614 0.372 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -6.945 8.261 0.583 1.00 0.00 C ATOM 0 H LEU B 80 -5.829 6.757 -2.781 1.00 0.00 H new ATOM 0 HA LEU B 80 -4.698 7.000 -0.104 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -6.964 5.350 -1.315 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.565 5.367 0.391 1.00 0.00 H new ATOM 0 HG LEU B 80 -7.731 7.594 -1.277 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -9.499 7.432 0.535 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.259 5.863 -0.269 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -8.538 6.163 1.330 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -7.675 9.063 0.693 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -6.703 7.854 1.565 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -6.040 8.655 0.121 1.00 0.00 H new ATOM 2743 N ALA B 81 -3.593 4.774 -1.981 1.00 0.00 N ATOM 2744 CA ALA B 81 -2.905 3.511 -2.198 1.00 0.00 C ATOM 2745 C ALA B 81 -1.985 3.192 -1.036 1.00 0.00 C ATOM 2746 O ALA B 81 -2.001 2.083 -0.513 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.131 3.546 -3.512 1.00 0.00 C ATOM 0 H ALA B 81 -3.483 5.435 -2.750 1.00 0.00 H new ATOM 0 HA ALA B 81 -3.651 2.719 -2.261 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -1.622 2.594 -3.660 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.822 3.720 -4.337 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -1.395 4.350 -3.480 1.00 0.00 H new ATOM 2753 N MET B 82 -1.209 4.185 -0.605 1.00 0.00 N ATOM 2754 CA MET B 82 -0.299 4.000 0.508 1.00 0.00 C ATOM 2755 C MET B 82 -1.044 3.577 1.786 1.00 0.00 C ATOM 2756 O MET B 82 -0.483 2.859 2.610 1.00 0.00 O ATOM 2757 CB MET B 82 0.514 5.282 0.717 1.00 0.00 C ATOM 2758 CG MET B 82 1.816 4.946 1.447 1.00 0.00 C ATOM 2759 SD MET B 82 2.914 6.345 1.795 1.00 0.00 S ATOM 2760 CE MET B 82 1.849 7.294 2.907 1.00 0.00 C ATOM 0 H MET B 82 -1.197 5.120 -1.012 1.00 0.00 H new ATOM 0 HA MET B 82 0.387 3.186 0.273 1.00 0.00 H new ATOM 0 HB2 MET B 82 0.733 5.747 -0.244 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.065 6.002 1.296 1.00 0.00 H new ATOM 0 HG2 MET B 82 1.566 4.462 2.391 1.00 0.00 H new ATOM 0 HG3 MET B 82 2.366 4.217 0.851 1.00 0.00 H new ATOM 0 HE1 MET B 82 2.459 7.970 3.506 1.00 0.00 H new ATOM 0 HE2 MET B 82 1.135 7.873 2.321 1.00 0.00 H new ATOM 0 HE3 MET B 82 1.310 6.612 3.565 1.00 0.00 H new ATOM 2770 N ILE B 83 -2.292 4.026 1.954 1.00 0.00 N ATOM 2771 CA ILE B 83 -3.120 3.716 3.111 1.00 0.00 C ATOM 2772 C ILE B 83 -3.715 2.317 2.937 1.00 0.00 C ATOM 2773 O ILE B 83 -3.480 1.439 3.763 1.00 0.00 O ATOM 2774 CB ILE B 83 -4.208 4.792 3.304 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -3.654 6.230 3.249 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -4.973 4.556 4.615 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -2.530 6.514 4.252 1.00 0.00 C ATOM 0 H ILE B 83 -2.758 4.626 1.274 1.00 0.00 H new ATOM 0 HA ILE B 83 -2.513 3.720 4.016 1.00 0.00 H new ATOM 0 HB ILE B 83 -4.895 4.693 2.464 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -3.284 6.426 2.242 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -4.471 6.928 3.430 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -5.736 5.325 4.734 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -5.447 3.575 4.588 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -4.279 4.601 5.454 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -2.199 7.547 4.145 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -2.898 6.354 5.266 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -1.693 5.843 4.060 1.00 0.00 H new ATOM 2789 N TYR B 84 -4.446 2.078 1.843 1.00 0.00 N ATOM 2790 CA TYR B 84 -5.127 0.809 1.586 1.00 0.00 C ATOM 2791 C TYR B 84 -4.165 -0.305 1.139 1.00 0.00 C ATOM 2792 O TYR B 84 -4.644 -1.341 0.692 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.303 1.021 0.593 1.00 0.00 C ATOM 2794 CG TYR B 84 -6.003 1.380 -0.868 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -5.371 0.440 -1.708 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -6.598 2.513 -1.471 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -5.251 0.661 -3.083 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -6.335 2.810 -2.828 1.00 0.00 C ATOM 2799 CZ TYR B 84 -5.696 1.861 -3.639 1.00 0.00 C ATOM 2800 OH TYR B 84 -5.450 2.119 -4.950 1.00 0.00 O ATOM 0 H TYR B 84 -4.582 2.769 1.105 1.00 0.00 H new ATOM 0 HA TYR B 84 -5.545 0.459 2.530 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -6.896 0.107 0.589 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.936 1.810 1.000 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -4.972 -0.468 -1.281 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -7.253 3.151 -0.895 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -4.814 -0.097 -3.715 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -6.626 3.766 -3.239 1.00 0.00 H new ATOM 0 HH TYR B 84 -5.390 3.088 -5.087 1.00 0.00 H new ATOM 2810 N ASN B 85 -2.862 -0.219 1.447 1.00 0.00 N ATOM 2811 CA ASN B 85 -1.759 -0.883 0.752 1.00 0.00 C ATOM 2812 C ASN B 85 -2.176 -2.041 -0.153 1.00 0.00 C ATOM 2813 O ASN B 85 -2.576 -1.764 -1.288 1.00 0.00 O ATOM 2814 CB ASN B 85 -0.620 -1.198 1.748 1.00 0.00 C ATOM 2815 CG ASN B 85 0.757 -1.385 1.093 1.00 0.00 C ATOM 2816 OD1 ASN B 85 1.721 -0.678 1.404 1.00 0.00 O ATOM 2817 ND2 ASN B 85 0.897 -2.352 0.193 1.00 0.00 N ATOM 0 H ASN B 85 -2.537 0.347 2.231 1.00 0.00 H new ATOM 0 HA ASN B 85 -1.358 -0.180 0.022 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -0.556 -0.390 2.477 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -0.874 -2.104 2.298 1.00 0.00 H new ATOM 0 HD21 ASN B 85 1.804 -2.514 -0.245 1.00 0.00 H new ATOM 0 HD22 ASN B 85 0.098 -2.933 -0.060 1.00 0.00 H new ATOM 2824 N GLU B 86 -2.029 -3.306 0.241 1.00 0.00 N ATOM 2825 CA GLU B 86 -2.214 -4.365 -0.732 1.00 0.00 C ATOM 2826 C GLU B 86 -3.646 -4.343 -1.263 1.00 0.00 C ATOM 2827 O GLU B 86 -4.622 -4.384 -0.518 1.00 0.00 O ATOM 2828 CB GLU B 86 -1.718 -5.750 -0.310 1.00 0.00 C ATOM 2829 CG GLU B 86 -1.795 -6.738 -1.497 1.00 0.00 C ATOM 2830 CD GLU B 86 -1.017 -6.329 -2.756 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -1.473 -5.403 -3.473 1.00 0.00 O ATOM 2832 OE2 GLU B 86 0.003 -6.989 -3.029 1.00 0.00 O ATOM 0 H GLU B 86 -1.793 -3.608 1.186 1.00 0.00 H new ATOM 0 HA GLU B 86 -1.542 -4.143 -1.561 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -0.691 -5.681 0.048 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -2.320 -6.121 0.519 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -1.426 -7.708 -1.163 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -2.843 -6.872 -1.767 1.00 0.00 H new