USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=29 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 71 GLN : amide:sc= -0.463 K(o=0.68,f=1.4) USER MOD Set 1.2: A 75 THR OG1 : rot -26:sc= 1.11 USER MOD Set 1.3: B 71 GLN : amide:sc= -2.24 X(o=0.68,f=0.69) USER MOD Set 1.4: B 75 THR OG1 : rot 83:sc= 2.27 USER MOD Set 2.1: B 20 SER OG : rot -75:sc= 0.622 USER MOD Set 2.2: B 28 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: B 30 SER OG : rot 180:sc= 0.584 USER MOD Set 3.1: A 30 SER OG : rot 180:sc= 0.893 USER MOD Set 3.2: A 32 LYS NZ :NH3+ 156:sc= 2.67 (180deg=-1.22) USER MOD Set 4.1: A 27 HIS : no HD1:sc= -0.327 X(o=-0.33,f=0.16) USER MOD Set 4.2: A 28 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 20 SER OG : rot -175:sc= 2.32 USER MOD Set 5.2: A 26 LYS NZ :NH3+ -168:sc= 1.45 (180deg=0.0345) USER MOD Single : A 17 HIS : no HD1:sc= 0.881 K(o=0.88,f=-5.9!) USER MOD Single : A 18 LYS NZ :NH3+ 169:sc= 1.27 (180deg=1.04) USER MOD Single : A 19 TYR OH : rot -29:sc= 1.23 USER MOD Single : A 31 LYS NZ :NH3+ -167:sc= 1.81 (180deg=1.41) USER MOD Single : A 35 LYS NZ :NH3+ 162:sc= 0.519 (180deg=-0.947!) USER MOD Single : A 39 GLN : amide:sc= 0.849 K(o=0.85,f=-0.012) USER MOD Single : A 40 LYS NZ :NH3+ 159:sc= 1.18 (180deg=-0.53) USER MOD Single : A 43 THR OG1 : rot 136:sc= 1.34 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= 0.993 K(o=0.99,f=-0.13) USER MOD Single : A 64 LYS NZ :NH3+ -161:sc= 3.05 (180deg=2.65) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.501 K(o=0.5,f=-5!) USER MOD Single : A 73 TYR OH : rot -19:sc= 1.11 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 30:sc= 0.983 USER MOD Single : A 85 ASN : amide:sc= 0.223 K(o=0.22,f=-0.28) USER MOD Single : B 17 HIS : no HD1:sc= -2.52 K(o=-2.5,f=-4.1!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot -155:sc= 1.22 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HE2:sc= -0.136 K(o=-0.14,f=-3!) USER MOD Single : B 31 LYS NZ :NH3+ -161:sc= 2.07 (180deg=1.31) USER MOD Single : B 32 LYS NZ :NH3+ -153:sc= 0.802 (180deg=-1.23!) USER MOD Single : B 35 LYS NZ :NH3+ -172:sc= 2.17 (180deg=1.97) USER MOD Single : B 39 GLN : amide:sc= 0.666 K(o=0.67,f=-0.055) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 1.96 (180deg=1.96) USER MOD Single : B 43 THR OG1 : rot 56:sc= 0.557 USER MOD Single : B 63 ASN : amide:sc= -0.0673 K(o=-0.067,f=-0.79) USER MOD Single : B 64 LYS NZ :NH3+ 162:sc= 0.926 (180deg=-0.397!) USER MOD Single : B 66 GLN : amide:sc= -1.01 K(o=-1,f=-2.3) USER MOD Single : B 69 ASN : amide:sc= -0.539 K(o=-0.54,f=-1.6) USER MOD Single : B 73 TYR OH : rot 157:sc= 0.942 USER MOD Single : B 82 MET CE :methyl 176:sc= -0.0337 (180deg=-0.0621) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -1.7 K(o=-1.7,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 -1.433 -3.745 -6.940 1.00 0.00 N ATOM 114 CA ILE A 9 -1.042 -2.575 -6.164 1.00 0.00 C ATOM 115 C ILE A 9 -0.024 -3.034 -5.108 1.00 0.00 C ATOM 116 O ILE A 9 1.055 -2.457 -4.973 1.00 0.00 O ATOM 117 CB ILE A 9 -2.306 -1.911 -5.572 1.00 0.00 C ATOM 118 CG1 ILE A 9 -2.815 -0.770 -6.475 1.00 0.00 C ATOM 119 CG2 ILE A 9 -2.052 -1.328 -4.179 1.00 0.00 C ATOM 120 CD1 ILE A 9 -3.242 -1.228 -7.873 1.00 0.00 C ATOM 0 HA ILE A 9 -0.560 -1.811 -6.775 1.00 0.00 H new ATOM 0 HB ILE A 9 -3.053 -2.702 -5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.661 -0.285 -5.988 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.030 -0.020 -6.573 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.968 -0.872 -3.803 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.739 -2.124 -3.503 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -1.268 -0.573 -4.238 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.588 -0.369 -8.448 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.393 -1.687 -8.381 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -4.049 -1.955 -7.787 1.00 0.00 H new ATOM 132 N GLY A 10 -0.379 -4.098 -4.391 1.00 0.00 N ATOM 133 CA GLY A 10 0.367 -4.741 -3.325 1.00 0.00 C ATOM 134 C GLY A 10 1.829 -4.933 -3.689 1.00 0.00 C ATOM 135 O GLY A 10 2.700 -4.633 -2.881 1.00 0.00 O ATOM 0 H GLY A 10 -1.269 -4.567 -4.559 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.295 -4.140 -2.419 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.081 -5.709 -3.102 1.00 0.00 H new ATOM 139 N LEU A 11 2.111 -5.400 -4.908 1.00 0.00 N ATOM 140 CA LEU A 11 3.479 -5.551 -5.392 1.00 0.00 C ATOM 141 C LEU A 11 4.248 -4.226 -5.221 1.00 0.00 C ATOM 142 O LEU A 11 5.311 -4.169 -4.599 1.00 0.00 O ATOM 143 CB LEU A 11 3.418 -6.033 -6.855 1.00 0.00 C ATOM 144 CG LEU A 11 4.644 -6.804 -7.376 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.948 -6.013 -7.267 1.00 0.00 C ATOM 146 CD2 LEU A 11 4.799 -8.171 -6.698 1.00 0.00 C ATOM 0 H LEU A 11 1.399 -5.682 -5.582 1.00 0.00 H new ATOM 0 HA LEU A 11 4.026 -6.295 -4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.541 -6.670 -6.968 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.265 -5.164 -7.494 1.00 0.00 H new ATOM 0 HG LEU A 11 4.448 -6.962 -8.437 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.772 -6.615 -7.651 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.866 -5.095 -7.849 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.137 -5.765 -6.223 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.677 -8.678 -7.098 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.918 -8.033 -5.623 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.912 -8.775 -6.890 1.00 0.00 H new ATOM 158 N LEU A 12 3.677 -3.134 -5.737 1.00 0.00 N ATOM 159 CA LEU A 12 4.299 -1.817 -5.705 1.00 0.00 C ATOM 160 C LEU A 12 4.346 -1.272 -4.275 1.00 0.00 C ATOM 161 O LEU A 12 5.318 -0.617 -3.903 1.00 0.00 O ATOM 162 CB LEU A 12 3.571 -0.851 -6.651 1.00 0.00 C ATOM 163 CG LEU A 12 4.008 -0.986 -8.120 1.00 0.00 C ATOM 164 CD1 LEU A 12 3.717 -2.370 -8.712 1.00 0.00 C ATOM 165 CD2 LEU A 12 3.287 0.077 -8.952 1.00 0.00 C ATOM 0 H LEU A 12 2.764 -3.144 -6.191 1.00 0.00 H new ATOM 0 HA LEU A 12 5.327 -1.913 -6.055 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.498 -1.027 -6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.748 0.172 -6.320 1.00 0.00 H new ATOM 0 HG LEU A 12 5.089 -0.848 -8.149 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.049 -2.399 -9.750 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.249 -3.130 -8.139 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.646 -2.567 -8.668 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.590 -0.010 -9.995 1.00 0.00 H new ATOM 0 HD22 LEU A 12 2.210 -0.069 -8.874 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.547 1.068 -8.580 1.00 0.00 H new ATOM 177 N ILE A 13 3.316 -1.516 -3.466 1.00 0.00 N ATOM 178 CA ILE A 13 3.341 -1.159 -2.047 1.00 0.00 C ATOM 179 C ILE A 13 4.484 -1.889 -1.331 1.00 0.00 C ATOM 180 O ILE A 13 5.208 -1.282 -0.542 1.00 0.00 O ATOM 181 CB ILE A 13 1.962 -1.416 -1.417 1.00 0.00 C ATOM 182 CG1 ILE A 13 0.918 -0.394 -1.907 1.00 0.00 C ATOM 183 CG2 ILE A 13 2.031 -1.413 0.111 1.00 0.00 C ATOM 184 CD1 ILE A 13 0.994 0.962 -1.191 1.00 0.00 C ATOM 0 H ILE A 13 2.450 -1.961 -3.770 1.00 0.00 H new ATOM 0 HA ILE A 13 3.543 -0.094 -1.935 1.00 0.00 H new ATOM 0 HB ILE A 13 1.647 -2.408 -1.740 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.052 -0.237 -2.977 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.079 -0.812 -1.768 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.038 -1.598 0.520 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.713 -2.195 0.446 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.392 -0.444 0.457 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.229 1.628 -1.590 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.830 0.819 -0.123 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.978 1.403 -1.351 1.00 0.00 H new ATOM 196 N GLY A 14 4.667 -3.176 -1.625 1.00 0.00 N ATOM 197 CA GLY A 14 5.767 -3.983 -1.129 1.00 0.00 C ATOM 198 C GLY A 14 7.093 -3.302 -1.444 1.00 0.00 C ATOM 199 O GLY A 14 7.868 -2.992 -0.540 1.00 0.00 O ATOM 0 H GLY A 14 4.033 -3.695 -2.232 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.668 -4.126 -0.053 1.00 0.00 H new ATOM 0 HA3 GLY A 14 5.739 -4.972 -1.586 1.00 0.00 H new ATOM 203 N ILE A 15 7.335 -3.048 -2.733 1.00 0.00 N ATOM 204 CA ILE A 15 8.552 -2.392 -3.198 1.00 0.00 C ATOM 205 C ILE A 15 8.745 -1.029 -2.517 1.00 0.00 C ATOM 206 O ILE A 15 9.838 -0.720 -2.052 1.00 0.00 O ATOM 207 CB ILE A 15 8.515 -2.284 -4.740 1.00 0.00 C ATOM 208 CG1 ILE A 15 8.691 -3.688 -5.349 1.00 0.00 C ATOM 209 CG2 ILE A 15 9.599 -1.335 -5.274 1.00 0.00 C ATOM 210 CD1 ILE A 15 8.499 -3.717 -6.869 1.00 0.00 C ATOM 0 H ILE A 15 6.688 -3.294 -3.483 1.00 0.00 H new ATOM 0 HA ILE A 15 9.418 -2.992 -2.920 1.00 0.00 H new ATOM 0 HB ILE A 15 7.550 -1.868 -5.031 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.687 -4.059 -5.108 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.977 -4.369 -4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.538 -1.288 -6.361 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.447 -0.339 -4.859 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.582 -1.704 -4.981 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.637 -4.735 -7.234 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.493 -3.376 -7.115 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.230 -3.061 -7.341 1.00 0.00 H new ATOM 222 N PHE A 16 7.693 -0.209 -2.471 1.00 0.00 N ATOM 223 CA PHE A 16 7.751 1.199 -2.099 1.00 0.00 C ATOM 224 C PHE A 16 8.716 1.547 -0.961 1.00 0.00 C ATOM 225 O PHE A 16 9.667 2.299 -1.159 1.00 0.00 O ATOM 226 CB PHE A 16 6.337 1.726 -1.850 1.00 0.00 C ATOM 227 CG PHE A 16 6.290 3.154 -1.354 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.666 4.218 -2.194 1.00 0.00 C ATOM 229 CD2 PHE A 16 5.860 3.419 -0.044 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.608 5.539 -1.720 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.721 4.743 0.400 1.00 0.00 C ATOM 232 CZ PHE A 16 6.119 5.806 -0.428 1.00 0.00 C ATOM 0 H PHE A 16 6.749 -0.520 -2.700 1.00 0.00 H new ATOM 0 HA PHE A 16 8.190 1.716 -2.952 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.766 1.655 -2.776 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.844 1.083 -1.121 1.00 0.00 H new ATOM 0 HD1 PHE A 16 6.999 4.019 -3.202 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.635 2.601 0.624 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.940 6.352 -2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.308 4.945 1.377 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.050 6.824 -0.074 1.00 0.00 H new ATOM 242 N HIS A 17 8.479 1.014 0.237 1.00 0.00 N ATOM 243 CA HIS A 17 9.267 1.369 1.421 1.00 0.00 C ATOM 244 C HIS A 17 10.586 0.590 1.529 1.00 0.00 C ATOM 245 O HIS A 17 11.251 0.680 2.556 1.00 0.00 O ATOM 246 CB HIS A 17 8.412 1.259 2.698 1.00 0.00 C ATOM 247 CG HIS A 17 7.471 0.082 2.710 1.00 0.00 C ATOM 248 ND1 HIS A 17 7.780 -1.196 2.278 1.00 0.00 N ATOM 249 CD2 HIS A 17 6.110 0.179 2.829 1.00 0.00 C ATOM 250 CE1 HIS A 17 6.617 -1.837 2.079 1.00 0.00 C ATOM 251 NE2 HIS A 17 5.591 -1.044 2.451 1.00 0.00 N ATOM 0 H HIS A 17 7.743 0.330 0.416 1.00 0.00 H new ATOM 0 HA HIS A 17 9.564 2.411 1.305 1.00 0.00 H new ATOM 0 HB2 HIS A 17 9.074 1.189 3.561 1.00 0.00 H new ATOM 0 HB3 HIS A 17 7.832 2.175 2.814 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.551 1.044 3.155 1.00 0.00 H new ATOM 0 HE1 HIS A 17 6.518 -2.836 1.681 1.00 0.00 H new ATOM 0 HE2 HIS A 17 4.604 -1.302 2.453 1.00 0.00 H new ATOM 259 N LYS A 18 10.988 -0.159 0.497 1.00 0.00 N ATOM 260 CA LYS A 18 12.190 -0.983 0.547 1.00 0.00 C ATOM 261 C LYS A 18 13.465 -0.146 0.693 1.00 0.00 C ATOM 262 O LYS A 18 14.440 -0.600 1.301 1.00 0.00 O ATOM 263 CB LYS A 18 12.250 -1.850 -0.722 1.00 0.00 C ATOM 264 CG LYS A 18 13.414 -2.848 -0.800 1.00 0.00 C ATOM 265 CD LYS A 18 13.235 -4.044 0.150 1.00 0.00 C ATOM 266 CE LYS A 18 14.416 -4.221 1.114 1.00 0.00 C ATOM 267 NZ LYS A 18 14.463 -3.151 2.129 1.00 0.00 N ATOM 0 H LYS A 18 10.488 -0.208 -0.391 1.00 0.00 H new ATOM 0 HA LYS A 18 12.136 -1.617 1.432 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.315 -2.405 -0.804 1.00 0.00 H new ATOM 0 HB3 LYS A 18 12.305 -1.189 -1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 18 13.507 -3.213 -1.823 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.345 -2.334 -0.559 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.319 -3.911 0.726 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.112 -4.954 -0.438 1.00 0.00 H new ATOM 0 HE2 LYS A 18 14.338 -5.189 1.610 1.00 0.00 H new ATOM 0 HE3 LYS A 18 15.348 -4.227 0.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.152 -3.402 2.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.748 -2.258 1.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.522 -3.038 2.558 1.00 0.00 H new ATOM 281 N TYR A 19 13.472 1.035 0.084 1.00 0.00 N ATOM 282 CA TYR A 19 14.667 1.838 -0.126 1.00 0.00 C ATOM 283 C TYR A 19 15.212 2.491 1.137 1.00 0.00 C ATOM 284 O TYR A 19 14.496 2.660 2.123 1.00 0.00 O ATOM 285 CB TYR A 19 14.407 2.820 -1.271 1.00 0.00 C ATOM 286 CG TYR A 19 14.026 2.084 -2.541 1.00 0.00 C ATOM 287 CD1 TYR A 19 15.036 1.462 -3.292 1.00 0.00 C ATOM 288 CD2 TYR A 19 12.686 1.719 -2.762 1.00 0.00 C ATOM 289 CE1 TYR A 19 14.726 0.428 -4.186 1.00 0.00 C ATOM 290 CE2 TYR A 19 12.375 0.668 -3.638 1.00 0.00 C ATOM 291 CZ TYR A 19 13.396 0.007 -4.340 1.00 0.00 C ATOM 292 OH TYR A 19 13.077 -0.877 -5.322 1.00 0.00 O ATOM 0 H TYR A 19 12.626 1.469 -0.285 1.00 0.00 H new ATOM 0 HA TYR A 19 15.480 1.172 -0.416 1.00 0.00 H new ATOM 0 HB2 TYR A 19 13.609 3.507 -0.991 1.00 0.00 H new ATOM 0 HB3 TYR A 19 15.298 3.422 -1.448 1.00 0.00 H new ATOM 0 HD1 TYR A 19 16.061 1.783 -3.180 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.893 2.250 -2.256 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.511 -0.045 -4.757 1.00 0.00 H new ATOM 0 HE2 TYR A 19 11.347 0.366 -3.773 1.00 0.00 H new ATOM 0 HH TYR A 19 13.698 -0.771 -6.072 1.00 0.00 H new ATOM 302 N SER A 20 16.512 2.797 1.093 1.00 0.00 N ATOM 303 CA SER A 20 17.355 3.317 2.158 1.00 0.00 C ATOM 304 C SER A 20 17.091 2.717 3.541 1.00 0.00 C ATOM 305 O SER A 20 17.146 3.442 4.534 1.00 0.00 O ATOM 306 CB SER A 20 17.333 4.852 2.157 1.00 0.00 C ATOM 307 OG SER A 20 16.053 5.350 2.504 1.00 0.00 O ATOM 0 H SER A 20 17.043 2.674 0.231 1.00 0.00 H new ATOM 0 HA SER A 20 18.369 2.986 1.932 1.00 0.00 H new ATOM 0 HB2 SER A 20 18.075 5.229 2.861 1.00 0.00 H new ATOM 0 HB3 SER A 20 17.614 5.221 1.170 1.00 0.00 H new ATOM 0 HG SER A 20 16.046 6.326 2.413 1.00 0.00 H new ATOM 376 N LYS A 26 8.777 4.467 6.002 1.00 0.00 N ATOM 377 CA LYS A 26 9.522 5.172 4.975 1.00 0.00 C ATOM 378 C LYS A 26 8.409 5.862 4.192 1.00 0.00 C ATOM 379 O LYS A 26 8.289 5.750 2.975 1.00 0.00 O ATOM 380 CB LYS A 26 10.397 4.251 4.119 1.00 0.00 C ATOM 381 CG LYS A 26 11.471 3.507 4.916 1.00 0.00 C ATOM 382 CD LYS A 26 12.462 4.409 5.676 1.00 0.00 C ATOM 383 CE LYS A 26 13.495 5.105 4.787 1.00 0.00 C ATOM 384 NZ LYS A 26 14.465 4.144 4.241 1.00 0.00 N ATOM 0 HA LYS A 26 10.259 5.869 5.375 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.760 3.523 3.617 1.00 0.00 H new ATOM 0 HB3 LYS A 26 10.879 4.843 3.341 1.00 0.00 H new ATOM 0 HG2 LYS A 26 10.979 2.849 5.633 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.033 2.871 4.233 1.00 0.00 H new ATOM 0 HD2 LYS A 26 11.900 5.168 6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 26 12.986 3.807 6.418 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.988 5.617 3.969 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.020 5.867 5.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.262 4.659 3.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.816 3.533 5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.004 3.559 3.515 1.00 0.00 H new ATOM 398 N HIS A 27 7.536 6.508 4.975 1.00 0.00 N ATOM 399 CA HIS A 27 6.267 7.080 4.568 1.00 0.00 C ATOM 400 C HIS A 27 6.449 7.992 3.356 1.00 0.00 C ATOM 401 O HIS A 27 5.610 7.999 2.461 1.00 0.00 O ATOM 402 CB HIS A 27 5.628 7.782 5.780 1.00 0.00 C ATOM 403 CG HIS A 27 6.564 8.700 6.534 1.00 0.00 C ATOM 404 ND1 HIS A 27 7.325 8.387 7.651 1.00 0.00 N ATOM 405 CD2 HIS A 27 6.902 9.964 6.143 1.00 0.00 C ATOM 406 CE1 HIS A 27 8.115 9.442 7.917 1.00 0.00 C ATOM 407 NE2 HIS A 27 7.878 10.412 7.011 1.00 0.00 N ATOM 0 H HIS A 27 7.717 6.648 5.969 1.00 0.00 H new ATOM 0 HA HIS A 27 5.580 6.299 4.242 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.769 8.359 5.439 1.00 0.00 H new ATOM 0 HB3 HIS A 27 5.251 7.024 6.466 1.00 0.00 H new ATOM 0 HD2 HIS A 27 6.484 10.511 5.311 1.00 0.00 H new ATOM 0 HE1 HIS A 27 8.826 9.503 8.727 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.340 11.320 6.973 1.00 0.00 H new ATOM 415 N THR A 28 7.554 8.737 3.334 1.00 0.00 N ATOM 416 CA THR A 28 8.026 9.484 2.187 1.00 0.00 C ATOM 417 C THR A 28 9.524 9.205 2.085 1.00 0.00 C ATOM 418 O THR A 28 10.170 8.924 3.098 1.00 0.00 O ATOM 419 CB THR A 28 7.721 10.980 2.357 1.00 0.00 C ATOM 420 OG1 THR A 28 8.180 11.461 3.609 1.00 0.00 O ATOM 421 CG2 THR A 28 6.215 11.241 2.266 1.00 0.00 C ATOM 0 H THR A 28 8.161 8.835 4.148 1.00 0.00 H new ATOM 0 HA THR A 28 7.524 9.181 1.268 1.00 0.00 H new ATOM 0 HB THR A 28 8.240 11.503 1.554 1.00 0.00 H new ATOM 0 HG1 THR A 28 7.974 12.416 3.688 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.022 12.307 2.389 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.848 10.916 1.293 1.00 0.00 H new ATOM 0 HG23 THR A 28 5.701 10.686 3.051 1.00 0.00 H new ATOM 429 N LEU A 29 10.056 9.239 0.865 1.00 0.00 N ATOM 430 CA LEU A 29 11.468 9.113 0.546 1.00 0.00 C ATOM 431 C LEU A 29 11.981 10.496 0.119 1.00 0.00 C ATOM 432 O LEU A 29 11.208 11.454 0.072 1.00 0.00 O ATOM 433 CB LEU A 29 11.658 8.096 -0.589 1.00 0.00 C ATOM 434 CG LEU A 29 11.163 6.649 -0.372 1.00 0.00 C ATOM 435 CD1 LEU A 29 11.296 6.157 1.072 1.00 0.00 C ATOM 436 CD2 LEU A 29 9.711 6.472 -0.832 1.00 0.00 C ATOM 0 H LEU A 29 9.480 9.362 0.032 1.00 0.00 H new ATOM 0 HA LEU A 29 12.027 8.760 1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 29 11.157 8.489 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.722 8.051 -0.819 1.00 0.00 H new ATOM 0 HG LEU A 29 11.823 6.037 -0.987 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.928 5.134 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 29 12.344 6.187 1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 29 10.711 6.799 1.731 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.399 5.441 -0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.066 7.144 -0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 29 9.635 6.705 -1.894 1.00 0.00 H new ATOM 448 N SER A 30 13.269 10.631 -0.214 1.00 0.00 N ATOM 449 CA SER A 30 13.840 11.916 -0.589 1.00 0.00 C ATOM 450 C SER A 30 15.121 11.711 -1.402 1.00 0.00 C ATOM 451 O SER A 30 16.192 11.532 -0.827 1.00 0.00 O ATOM 452 CB SER A 30 14.055 12.783 0.665 1.00 0.00 C ATOM 453 OG SER A 30 14.696 12.078 1.721 1.00 0.00 O ATOM 0 H SER A 30 13.934 9.858 -0.229 1.00 0.00 H new ATOM 0 HA SER A 30 13.145 12.456 -1.233 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.654 13.654 0.400 1.00 0.00 H new ATOM 0 HB3 SER A 30 13.091 13.153 1.014 1.00 0.00 H new ATOM 0 HG SER A 30 14.809 12.674 2.491 1.00 0.00 H new ATOM 459 N LYS A 31 15.004 11.761 -2.734 1.00 0.00 N ATOM 460 CA LYS A 31 16.060 11.697 -3.748 1.00 0.00 C ATOM 461 C LYS A 31 16.943 10.440 -3.719 1.00 0.00 C ATOM 462 O LYS A 31 16.988 9.701 -4.703 1.00 0.00 O ATOM 463 CB LYS A 31 16.847 13.019 -3.868 1.00 0.00 C ATOM 464 CG LYS A 31 17.864 13.338 -2.759 1.00 0.00 C ATOM 465 CD LYS A 31 18.543 14.702 -2.952 1.00 0.00 C ATOM 466 CE LYS A 31 17.857 15.839 -2.177 1.00 0.00 C ATOM 467 NZ LYS A 31 16.555 16.220 -2.752 1.00 0.00 N ATOM 0 H LYS A 31 14.085 11.856 -3.167 1.00 0.00 H new ATOM 0 HA LYS A 31 15.520 11.575 -4.687 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.378 13.010 -4.820 1.00 0.00 H new ATOM 0 HB3 LYS A 31 16.128 13.837 -3.912 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.359 13.321 -1.793 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.625 12.558 -2.734 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.583 14.631 -2.633 1.00 0.00 H new ATOM 0 HD3 LYS A 31 18.551 14.949 -4.014 1.00 0.00 H new ATOM 0 HE2 LYS A 31 17.715 15.532 -1.141 1.00 0.00 H new ATOM 0 HE3 LYS A 31 18.512 16.710 -2.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 16.242 17.121 -2.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 16.649 16.328 -3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.854 15.481 -2.544 1.00 0.00 H new ATOM 481 N LYS A 32 17.667 10.200 -2.624 1.00 0.00 N ATOM 482 CA LYS A 32 18.663 9.142 -2.535 1.00 0.00 C ATOM 483 C LYS A 32 18.013 7.784 -2.824 1.00 0.00 C ATOM 484 O LYS A 32 18.540 6.984 -3.595 1.00 0.00 O ATOM 485 CB LYS A 32 19.428 9.245 -1.196 1.00 0.00 C ATOM 486 CG LYS A 32 18.756 8.561 0.006 1.00 0.00 C ATOM 487 CD LYS A 32 18.942 9.277 1.351 1.00 0.00 C ATOM 488 CE LYS A 32 18.032 10.507 1.543 1.00 0.00 C ATOM 489 NZ LYS A 32 16.589 10.196 1.416 1.00 0.00 N ATOM 0 H LYS A 32 17.573 10.744 -1.766 1.00 0.00 H new ATOM 0 HA LYS A 32 19.427 9.257 -3.304 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.419 8.812 -1.330 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.570 10.299 -0.959 1.00 0.00 H new ATOM 0 HG2 LYS A 32 17.689 8.473 -0.196 1.00 0.00 H new ATOM 0 HG3 LYS A 32 19.149 7.548 0.094 1.00 0.00 H new ATOM 0 HD2 LYS A 32 18.751 8.568 2.157 1.00 0.00 H new ATOM 0 HD3 LYS A 32 19.982 9.591 1.442 1.00 0.00 H new ATOM 0 HE2 LYS A 32 18.218 10.938 2.527 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.299 11.266 0.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 16.034 10.908 1.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 16.319 10.207 0.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 16.400 9.254 1.815 1.00 0.00 H new ATOM 503 N GLU A 33 16.814 7.567 -2.272 1.00 0.00 N ATOM 504 CA GLU A 33 16.034 6.379 -2.533 1.00 0.00 C ATOM 505 C GLU A 33 15.723 6.298 -4.013 1.00 0.00 C ATOM 506 O GLU A 33 15.863 5.246 -4.611 1.00 0.00 O ATOM 507 CB GLU A 33 14.714 6.431 -1.767 1.00 0.00 C ATOM 508 CG GLU A 33 14.921 6.412 -0.250 1.00 0.00 C ATOM 509 CD GLU A 33 15.289 7.757 0.355 1.00 0.00 C ATOM 510 OE1 GLU A 33 15.274 8.782 -0.369 1.00 0.00 O ATOM 511 OE2 GLU A 33 15.677 7.782 1.544 1.00 0.00 O ATOM 0 H GLU A 33 16.366 8.221 -1.630 1.00 0.00 H new ATOM 0 HA GLU A 33 16.608 5.509 -2.213 1.00 0.00 H new ATOM 0 HB2 GLU A 33 14.170 7.333 -2.046 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.094 5.583 -2.058 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.007 6.053 0.224 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.706 5.694 -0.013 1.00 0.00 H new ATOM 518 N LEU A 34 15.282 7.400 -4.618 1.00 0.00 N ATOM 519 CA LEU A 34 14.886 7.375 -6.014 1.00 0.00 C ATOM 520 C LEU A 34 16.080 6.967 -6.876 1.00 0.00 C ATOM 521 O LEU A 34 15.926 6.153 -7.783 1.00 0.00 O ATOM 522 CB LEU A 34 14.231 8.697 -6.433 1.00 0.00 C ATOM 523 CG LEU A 34 12.746 8.786 -6.022 1.00 0.00 C ATOM 524 CD1 LEU A 34 11.854 7.926 -6.929 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.486 8.437 -4.550 1.00 0.00 C ATOM 0 H LEU A 34 15.193 8.309 -4.164 1.00 0.00 H new ATOM 0 HA LEU A 34 14.114 6.621 -6.167 1.00 0.00 H new ATOM 0 HB2 LEU A 34 14.778 9.526 -5.984 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.311 8.810 -7.514 1.00 0.00 H new ATOM 0 HG LEU A 34 12.483 9.836 -6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 34 10.816 8.015 -6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.946 8.268 -7.960 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.166 6.884 -6.864 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.420 8.523 -4.339 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.814 7.416 -4.355 1.00 0.00 H new ATOM 0 HD23 LEU A 34 13.039 9.124 -3.910 1.00 0.00 H new ATOM 537 N LYS A 35 17.282 7.457 -6.558 1.00 0.00 N ATOM 538 CA LYS A 35 18.498 6.982 -7.210 1.00 0.00 C ATOM 539 C LYS A 35 18.735 5.485 -6.957 1.00 0.00 C ATOM 540 O LYS A 35 19.040 4.751 -7.897 1.00 0.00 O ATOM 541 CB LYS A 35 19.698 7.855 -6.814 1.00 0.00 C ATOM 542 CG LYS A 35 19.502 9.345 -7.144 1.00 0.00 C ATOM 543 CD LYS A 35 19.111 9.570 -8.612 1.00 0.00 C ATOM 544 CE LYS A 35 18.989 11.059 -8.959 1.00 0.00 C ATOM 545 NZ LYS A 35 18.494 11.223 -10.337 1.00 0.00 N ATOM 0 H LYS A 35 17.435 8.180 -5.855 1.00 0.00 H new ATOM 0 HA LYS A 35 18.371 7.082 -8.288 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.879 7.748 -5.745 1.00 0.00 H new ATOM 0 HB3 LYS A 35 20.588 7.491 -7.326 1.00 0.00 H new ATOM 0 HG2 LYS A 35 18.729 9.760 -6.497 1.00 0.00 H new ATOM 0 HG3 LYS A 35 20.423 9.887 -6.928 1.00 0.00 H new ATOM 0 HD2 LYS A 35 19.856 9.108 -9.259 1.00 0.00 H new ATOM 0 HD3 LYS A 35 18.162 9.073 -8.813 1.00 0.00 H new ATOM 0 HE2 LYS A 35 18.310 11.548 -8.261 1.00 0.00 H new ATOM 0 HE3 LYS A 35 19.959 11.545 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 18.129 12.189 -10.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 19.272 11.057 -11.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 17.731 10.539 -10.516 1.00 0.00 H new ATOM 559 N GLU A 36 18.577 5.021 -5.714 1.00 0.00 N ATOM 560 CA GLU A 36 18.639 3.598 -5.376 1.00 0.00 C ATOM 561 C GLU A 36 17.626 2.779 -6.203 1.00 0.00 C ATOM 562 O GLU A 36 17.876 1.635 -6.586 1.00 0.00 O ATOM 563 CB GLU A 36 18.407 3.448 -3.857 1.00 0.00 C ATOM 564 CG GLU A 36 18.794 2.084 -3.261 1.00 0.00 C ATOM 565 CD GLU A 36 18.259 1.906 -1.838 1.00 0.00 C ATOM 566 OE1 GLU A 36 18.001 2.929 -1.166 1.00 0.00 O ATOM 567 OE2 GLU A 36 18.038 0.739 -1.453 1.00 0.00 O ATOM 0 H GLU A 36 18.402 5.625 -4.911 1.00 0.00 H new ATOM 0 HA GLU A 36 19.622 3.200 -5.627 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.973 4.224 -3.342 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.353 3.631 -3.648 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.406 1.288 -3.896 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.880 1.986 -3.255 1.00 0.00 H new ATOM 574 N LEU A 37 16.467 3.379 -6.458 1.00 0.00 N ATOM 575 CA LEU A 37 15.268 2.775 -6.995 1.00 0.00 C ATOM 576 C LEU A 37 15.248 2.809 -8.526 1.00 0.00 C ATOM 577 O LEU A 37 15.541 1.802 -9.168 1.00 0.00 O ATOM 578 CB LEU A 37 14.083 3.515 -6.343 1.00 0.00 C ATOM 579 CG LEU A 37 12.728 2.818 -6.362 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.746 3.587 -5.466 1.00 0.00 C ATOM 581 CD2 LEU A 37 12.127 2.684 -7.749 1.00 0.00 C ATOM 0 H LEU A 37 16.340 4.375 -6.278 1.00 0.00 H new ATOM 0 HA LEU A 37 15.213 1.713 -6.758 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.343 3.719 -5.304 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.973 4.479 -6.839 1.00 0.00 H new ATOM 0 HG LEU A 37 12.898 1.807 -5.992 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.776 3.090 -5.479 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.128 3.612 -4.445 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.636 4.606 -5.837 1.00 0.00 H new ATOM 0 HD21 LEU A 37 11.164 2.178 -7.681 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.987 3.674 -8.182 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.798 2.103 -8.382 1.00 0.00 H new ATOM 593 N ILE A 38 14.910 3.957 -9.124 1.00 0.00 N ATOM 594 CA ILE A 38 14.582 4.067 -10.545 1.00 0.00 C ATOM 595 C ILE A 38 15.685 3.517 -11.446 1.00 0.00 C ATOM 596 O ILE A 38 15.408 2.918 -12.483 1.00 0.00 O ATOM 597 CB ILE A 38 14.178 5.506 -10.938 1.00 0.00 C ATOM 598 CG1 ILE A 38 15.379 6.455 -11.129 1.00 0.00 C ATOM 599 CG2 ILE A 38 13.143 6.073 -9.955 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.985 7.856 -11.603 1.00 0.00 C ATOM 0 H ILE A 38 14.857 4.846 -8.626 1.00 0.00 H new ATOM 0 HA ILE A 38 13.709 3.435 -10.707 1.00 0.00 H new ATOM 0 HB ILE A 38 13.711 5.438 -11.921 1.00 0.00 H new ATOM 0 HG12 ILE A 38 15.919 6.538 -10.186 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.067 6.016 -11.852 1.00 0.00 H new ATOM 0 HG21 ILE A 38 12.875 7.087 -10.253 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.252 5.445 -9.962 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.566 6.090 -8.951 1.00 0.00 H new ATOM 0 HD11 ILE A 38 15.880 8.467 -11.715 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.472 7.785 -12.562 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.322 8.315 -10.870 1.00 0.00 H new ATOM 612 N GLN A 39 16.938 3.746 -11.055 1.00 0.00 N ATOM 613 CA GLN A 39 18.094 3.376 -11.852 1.00 0.00 C ATOM 614 C GLN A 39 18.233 1.852 -11.931 1.00 0.00 C ATOM 615 O GLN A 39 18.760 1.338 -12.913 1.00 0.00 O ATOM 616 CB GLN A 39 19.350 4.035 -11.267 1.00 0.00 C ATOM 617 CG GLN A 39 19.194 5.564 -11.205 1.00 0.00 C ATOM 618 CD GLN A 39 20.460 6.260 -10.718 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.977 7.157 -11.375 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.954 5.877 -9.547 1.00 0.00 N ATOM 0 H GLN A 39 17.175 4.196 -10.171 1.00 0.00 H new ATOM 0 HA GLN A 39 17.963 3.736 -12.872 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.537 3.644 -10.267 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.217 3.779 -11.877 1.00 0.00 H new ATOM 0 HG2 GLN A 39 18.934 5.940 -12.195 1.00 0.00 H new ATOM 0 HG3 GLN A 39 18.367 5.815 -10.541 1.00 0.00 H new ATOM 0 HE21 GLN A 39 20.502 5.128 -9.023 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.786 6.332 -9.171 1.00 0.00 H new ATOM 629 N LYS A 40 17.787 1.136 -10.893 1.00 0.00 N ATOM 630 CA LYS A 40 17.766 -0.318 -10.884 1.00 0.00 C ATOM 631 C LYS A 40 16.422 -0.841 -11.397 1.00 0.00 C ATOM 632 O LYS A 40 16.366 -1.571 -12.391 1.00 0.00 O ATOM 633 CB LYS A 40 18.020 -0.826 -9.463 1.00 0.00 C ATOM 634 CG LYS A 40 19.411 -0.483 -8.912 1.00 0.00 C ATOM 635 CD LYS A 40 19.824 -1.436 -7.773 1.00 0.00 C ATOM 636 CE LYS A 40 19.207 -1.157 -6.392 1.00 0.00 C ATOM 637 NZ LYS A 40 17.741 -0.996 -6.418 1.00 0.00 N ATOM 0 H LYS A 40 17.430 1.557 -10.035 1.00 0.00 H new ATOM 0 HA LYS A 40 18.551 -0.685 -11.545 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.265 -0.406 -8.799 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.892 -1.908 -9.448 1.00 0.00 H new ATOM 0 HG2 LYS A 40 20.145 -0.538 -9.716 1.00 0.00 H new ATOM 0 HG3 LYS A 40 19.415 0.544 -8.547 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.561 -2.453 -8.066 1.00 0.00 H new ATOM 0 HD3 LYS A 40 20.909 -1.403 -7.676 1.00 0.00 H new ATOM 0 HE2 LYS A 40 19.462 -1.975 -5.718 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.655 -0.253 -5.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.356 -1.166 -5.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 17.503 -0.030 -6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 17.329 -1.679 -7.085 1.00 0.00 H new ATOM 651 N GLU A 41 15.349 -0.504 -10.674 1.00 0.00 N ATOM 652 CA GLU A 41 14.031 -1.077 -10.861 1.00 0.00 C ATOM 653 C GLU A 41 13.230 -0.334 -11.936 1.00 0.00 C ATOM 654 O GLU A 41 13.474 -0.570 -13.111 1.00 0.00 O ATOM 655 CB GLU A 41 13.294 -1.193 -9.514 1.00 0.00 C ATOM 656 CG GLU A 41 13.875 -2.286 -8.598 1.00 0.00 C ATOM 657 CD GLU A 41 15.098 -1.846 -7.810 1.00 0.00 C ATOM 658 OE1 GLU A 41 15.010 -0.810 -7.118 1.00 0.00 O ATOM 659 OE2 GLU A 41 16.128 -2.552 -7.835 1.00 0.00 O ATOM 0 H GLU A 41 15.384 0.191 -9.928 1.00 0.00 H new ATOM 0 HA GLU A 41 14.147 -2.092 -11.242 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.339 -0.234 -8.998 1.00 0.00 H new ATOM 0 HB3 GLU A 41 12.241 -1.405 -9.700 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.103 -2.609 -7.900 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.139 -3.152 -9.205 1.00 0.00 H new ATOM 666 N LEU A 42 12.300 0.555 -11.557 1.00 0.00 N ATOM 667 CA LEU A 42 11.247 1.087 -12.433 1.00 0.00 C ATOM 668 C LEU A 42 11.561 1.163 -13.927 1.00 0.00 C ATOM 669 O LEU A 42 11.303 0.202 -14.653 1.00 0.00 O ATOM 670 CB LEU A 42 10.660 2.423 -11.946 1.00 0.00 C ATOM 671 CG LEU A 42 10.178 2.421 -10.496 1.00 0.00 C ATOM 672 CD1 LEU A 42 9.396 3.701 -10.194 1.00 0.00 C ATOM 673 CD2 LEU A 42 9.359 1.191 -10.083 1.00 0.00 C ATOM 0 H LEU A 42 12.259 0.933 -10.610 1.00 0.00 H new ATOM 0 HA LEU A 42 10.490 0.308 -12.342 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.416 3.200 -12.062 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.824 2.693 -12.591 1.00 0.00 H new ATOM 0 HG LEU A 42 11.086 2.376 -9.895 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.059 3.685 -9.158 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.039 4.566 -10.354 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.532 3.764 -10.856 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.064 1.284 -9.038 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.468 1.121 -10.707 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.963 0.292 -10.211 1.00 0.00 H new ATOM 685 N THR A 43 12.051 2.302 -14.411 1.00 0.00 N ATOM 686 CA THR A 43 12.130 2.620 -15.822 1.00 0.00 C ATOM 687 C THR A 43 13.347 1.992 -16.504 1.00 0.00 C ATOM 688 O THR A 43 14.060 2.668 -17.242 1.00 0.00 O ATOM 689 CB THR A 43 12.092 4.147 -15.921 1.00 0.00 C ATOM 690 OG1 THR A 43 13.008 4.677 -14.983 1.00 0.00 O ATOM 691 CG2 THR A 43 10.705 4.702 -15.583 1.00 0.00 C ATOM 0 H THR A 43 12.412 3.044 -13.811 1.00 0.00 H new ATOM 0 HA THR A 43 11.290 2.189 -16.366 1.00 0.00 H new ATOM 0 HB THR A 43 12.343 4.428 -16.944 1.00 0.00 H new ATOM 0 HG1 THR A 43 13.525 5.396 -15.402 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.718 5.789 -15.664 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.971 4.295 -16.278 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.437 4.418 -14.565 1.00 0.00 H new ATOM 699 N ILE A 44 13.571 0.695 -16.285 1.00 0.00 N ATOM 700 CA ILE A 44 14.631 -0.077 -16.927 1.00 0.00 C ATOM 701 C ILE A 44 14.469 -1.552 -16.567 1.00 0.00 C ATOM 702 O ILE A 44 14.443 -2.408 -17.448 1.00 0.00 O ATOM 703 CB ILE A 44 16.044 0.470 -16.606 1.00 0.00 C ATOM 704 CG1 ILE A 44 17.129 -0.453 -17.192 1.00 0.00 C ATOM 705 CG2 ILE A 44 16.278 0.740 -15.112 1.00 0.00 C ATOM 706 CD1 ILE A 44 18.527 0.171 -17.130 1.00 0.00 C ATOM 0 H ILE A 44 13.006 0.141 -15.641 1.00 0.00 H new ATOM 0 HA ILE A 44 14.533 0.026 -18.008 1.00 0.00 H new ATOM 0 HB ILE A 44 16.114 1.445 -17.089 1.00 0.00 H new ATOM 0 HG12 ILE A 44 17.132 -1.397 -16.647 1.00 0.00 H new ATOM 0 HG13 ILE A 44 16.884 -0.684 -18.229 1.00 0.00 H new ATOM 0 HG21 ILE A 44 17.289 1.121 -14.965 1.00 0.00 H new ATOM 0 HG22 ILE A 44 15.557 1.477 -14.758 1.00 0.00 H new ATOM 0 HG23 ILE A 44 16.154 -0.186 -14.551 1.00 0.00 H new ATOM 0 HD11 ILE A 44 19.254 -0.521 -17.556 1.00 0.00 H new ATOM 0 HD12 ILE A 44 18.536 1.101 -17.698 1.00 0.00 H new ATOM 0 HD13 ILE A 44 18.788 0.377 -16.092 1.00 0.00 H new ATOM 888 N LEU A 56 16.847 10.377 -18.643 1.00 0.00 N ATOM 889 CA LEU A 56 16.841 11.816 -18.448 1.00 0.00 C ATOM 890 C LEU A 56 15.430 12.290 -18.096 1.00 0.00 C ATOM 891 O LEU A 56 15.265 13.023 -17.125 1.00 0.00 O ATOM 892 CB LEU A 56 17.381 12.511 -19.706 1.00 0.00 C ATOM 893 CG LEU A 56 17.364 14.047 -19.638 1.00 0.00 C ATOM 894 CD1 LEU A 56 18.219 14.585 -18.483 1.00 0.00 C ATOM 895 CD2 LEU A 56 17.888 14.609 -20.963 1.00 0.00 C ATOM 0 HA LEU A 56 17.493 12.079 -17.615 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.404 12.178 -19.880 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.792 12.191 -20.565 1.00 0.00 H new ATOM 0 HG LEU A 56 16.336 14.365 -19.461 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.176 15.674 -18.475 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.837 14.200 -17.538 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.252 14.263 -18.615 1.00 0.00 H new ATOM 0 HD21 LEU A 56 17.880 15.698 -20.925 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.907 14.259 -21.129 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.251 14.270 -21.780 1.00 0.00 H new ATOM 907 N MET A 57 14.420 11.900 -18.882 1.00 0.00 N ATOM 908 CA MET A 57 13.044 12.334 -18.662 1.00 0.00 C ATOM 909 C MET A 57 12.527 11.852 -17.302 1.00 0.00 C ATOM 910 O MET A 57 12.024 12.652 -16.512 1.00 0.00 O ATOM 911 CB MET A 57 12.153 11.850 -19.820 1.00 0.00 C ATOM 912 CG MET A 57 10.671 12.189 -19.612 1.00 0.00 C ATOM 913 SD MET A 57 10.287 13.948 -19.406 1.00 0.00 S ATOM 914 CE MET A 57 8.523 13.838 -19.035 1.00 0.00 C ATOM 0 H MET A 57 14.537 11.279 -19.682 1.00 0.00 H new ATOM 0 HA MET A 57 13.013 13.423 -18.643 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.497 12.302 -20.750 1.00 0.00 H new ATOM 0 HB3 MET A 57 12.262 10.771 -19.930 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.108 11.811 -20.465 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.315 11.653 -18.732 1.00 0.00 H new ATOM 0 HE1 MET A 57 8.121 14.839 -18.878 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.005 13.365 -19.869 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.377 13.243 -18.133 1.00 0.00 H new ATOM 924 N ASP A 58 12.630 10.541 -17.058 1.00 0.00 N ATOM 925 CA ASP A 58 12.143 9.840 -15.874 1.00 0.00 C ATOM 926 C ASP A 58 12.284 10.717 -14.633 1.00 0.00 C ATOM 927 O ASP A 58 11.301 11.139 -14.027 1.00 0.00 O ATOM 928 CB ASP A 58 12.958 8.551 -15.657 1.00 0.00 C ATOM 929 CG ASP A 58 12.759 7.455 -16.688 1.00 0.00 C ATOM 930 OD1 ASP A 58 11.747 7.474 -17.413 1.00 0.00 O ATOM 931 OD2 ASP A 58 13.627 6.551 -16.678 1.00 0.00 O ATOM 0 H ASP A 58 13.081 9.910 -17.720 1.00 0.00 H new ATOM 0 HA ASP A 58 11.091 9.600 -16.031 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.016 8.813 -15.635 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.709 8.148 -14.675 1.00 0.00 H new ATOM 936 N ASP A 59 13.540 11.019 -14.293 1.00 0.00 N ATOM 937 CA ASP A 59 13.959 11.651 -13.051 1.00 0.00 C ATOM 938 C ASP A 59 13.279 12.996 -12.763 1.00 0.00 C ATOM 939 O ASP A 59 13.388 13.508 -11.650 1.00 0.00 O ATOM 940 CB ASP A 59 15.486 11.811 -13.076 1.00 0.00 C ATOM 941 CG ASP A 59 16.064 11.864 -11.678 1.00 0.00 C ATOM 942 OD1 ASP A 59 15.976 10.846 -10.955 1.00 0.00 O ATOM 943 OD2 ASP A 59 16.706 12.854 -11.267 1.00 0.00 O ATOM 0 H ASP A 59 14.326 10.817 -14.910 1.00 0.00 H new ATOM 0 HA ASP A 59 13.645 10.998 -12.236 1.00 0.00 H new ATOM 0 HB2 ASP A 59 15.931 10.979 -13.623 1.00 0.00 H new ATOM 0 HB3 ASP A 59 15.748 12.722 -13.613 1.00 0.00 H new ATOM 948 N LEU A 60 12.603 13.580 -13.754 1.00 0.00 N ATOM 949 CA LEU A 60 11.984 14.891 -13.678 1.00 0.00 C ATOM 950 C LEU A 60 10.537 14.807 -13.197 1.00 0.00 C ATOM 951 O LEU A 60 10.082 15.692 -12.474 1.00 0.00 O ATOM 952 CB LEU A 60 12.055 15.547 -15.059 1.00 0.00 C ATOM 953 CG LEU A 60 13.450 15.416 -15.690 1.00 0.00 C ATOM 954 CD1 LEU A 60 13.425 16.071 -17.075 1.00 0.00 C ATOM 955 CD2 LEU A 60 14.535 16.087 -14.839 1.00 0.00 C ATOM 0 H LEU A 60 12.471 13.132 -14.661 1.00 0.00 H new ATOM 0 HA LEU A 60 12.525 15.494 -12.949 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.316 15.089 -15.716 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.794 16.602 -14.973 1.00 0.00 H new ATOM 0 HG LEU A 60 13.692 14.355 -15.759 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.409 15.986 -17.536 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.687 15.570 -17.701 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.161 17.124 -16.975 1.00 0.00 H new ATOM 0 HD21 LEU A 60 15.504 15.969 -15.325 1.00 0.00 H new ATOM 0 HD22 LEU A 60 14.310 17.148 -14.733 1.00 0.00 H new ATOM 0 HD23 LEU A 60 14.564 15.622 -13.854 1.00 0.00 H new ATOM 967 N ASP A 61 9.801 13.760 -13.599 1.00 0.00 N ATOM 968 CA ASP A 61 8.390 13.613 -13.241 1.00 0.00 C ATOM 969 C ASP A 61 8.235 13.690 -11.720 1.00 0.00 C ATOM 970 O ASP A 61 7.456 14.487 -11.194 1.00 0.00 O ATOM 971 CB ASP A 61 7.834 12.307 -13.817 1.00 0.00 C ATOM 972 CG ASP A 61 6.458 11.993 -13.244 1.00 0.00 C ATOM 973 OD1 ASP A 61 6.425 11.524 -12.086 1.00 0.00 O ATOM 974 OD2 ASP A 61 5.468 12.222 -13.969 1.00 0.00 O ATOM 0 H ASP A 61 10.166 13.001 -14.175 1.00 0.00 H new ATOM 0 HA ASP A 61 7.809 14.428 -13.674 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.770 12.384 -14.902 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.519 11.488 -13.595 1.00 0.00 H new ATOM 979 N ARG A 62 9.110 12.973 -11.016 1.00 0.00 N ATOM 980 CA ARG A 62 9.259 12.967 -9.562 1.00 0.00 C ATOM 981 C ARG A 62 9.735 14.309 -8.957 1.00 0.00 C ATOM 982 O ARG A 62 10.340 14.301 -7.886 1.00 0.00 O ATOM 983 CB ARG A 62 10.179 11.804 -9.158 1.00 0.00 C ATOM 984 CG ARG A 62 11.584 12.004 -9.739 1.00 0.00 C ATOM 985 CD ARG A 62 12.591 10.977 -9.211 1.00 0.00 C ATOM 986 NE ARG A 62 13.963 11.501 -9.309 1.00 0.00 N ATOM 987 CZ ARG A 62 14.461 12.477 -8.535 1.00 0.00 C ATOM 988 NH1 ARG A 62 13.775 12.916 -7.480 1.00 0.00 N ATOM 989 NH2 ARG A 62 15.644 13.040 -8.781 1.00 0.00 N ATOM 0 H ARG A 62 9.772 12.345 -11.472 1.00 0.00 H new ATOM 0 HA ARG A 62 8.264 12.825 -9.140 1.00 0.00 H new ATOM 0 HB2 ARG A 62 10.235 11.737 -8.071 1.00 0.00 H new ATOM 0 HB3 ARG A 62 9.762 10.862 -9.515 1.00 0.00 H new ATOM 0 HG2 ARG A 62 11.537 11.936 -10.826 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.934 13.008 -9.497 1.00 0.00 H new ATOM 0 HD2 ARG A 62 12.362 10.735 -8.173 1.00 0.00 H new ATOM 0 HD3 ARG A 62 12.508 10.051 -9.781 1.00 0.00 H new ATOM 0 HE ARG A 62 14.578 11.094 -10.014 1.00 0.00 H new ATOM 0 HH11 ARG A 62 12.866 12.510 -7.257 1.00 0.00 H new ATOM 0 HH12 ARG A 62 14.159 13.658 -6.895 1.00 0.00 H new ATOM 0 HH21 ARG A 62 16.200 12.731 -9.578 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.993 13.780 -8.172 1.00 0.00 H new ATOM 1003 N ASN A 63 9.524 15.435 -9.650 1.00 0.00 N ATOM 1004 CA ASN A 63 9.932 16.807 -9.352 1.00 0.00 C ATOM 1005 C ASN A 63 10.073 17.194 -7.885 1.00 0.00 C ATOM 1006 O ASN A 63 10.935 18.014 -7.574 1.00 0.00 O ATOM 1007 CB ASN A 63 8.965 17.805 -9.988 1.00 0.00 C ATOM 1008 CG ASN A 63 7.574 17.776 -9.351 1.00 0.00 C ATOM 1009 OD1 ASN A 63 7.224 18.664 -8.581 1.00 0.00 O ATOM 1010 ND2 ASN A 63 6.769 16.757 -9.641 1.00 0.00 N ATOM 0 H ASN A 63 9.007 15.399 -10.528 1.00 0.00 H new ATOM 0 HA ASN A 63 10.937 16.845 -9.772 1.00 0.00 H new ATOM 0 HB2 ASN A 63 9.378 18.810 -9.900 1.00 0.00 H new ATOM 0 HB3 ASN A 63 8.876 17.589 -11.053 1.00 0.00 H new ATOM 0 HD21 ASN A 63 5.841 16.704 -9.220 1.00 0.00 H new ATOM 0 HD22 ASN A 63 7.080 16.029 -10.284 1.00 0.00 H new ATOM 1017 N LYS A 64 9.250 16.661 -6.979 1.00 0.00 N ATOM 1018 CA LYS A 64 9.443 16.876 -5.553 1.00 0.00 C ATOM 1019 C LYS A 64 10.652 16.065 -5.066 1.00 0.00 C ATOM 1020 O LYS A 64 10.561 15.307 -4.109 1.00 0.00 O ATOM 1021 CB LYS A 64 8.157 16.544 -4.782 1.00 0.00 C ATOM 1022 CG LYS A 64 7.018 17.508 -5.133 1.00 0.00 C ATOM 1023 CD LYS A 64 5.667 17.120 -4.511 1.00 0.00 C ATOM 1024 CE LYS A 64 5.676 16.909 -2.984 1.00 0.00 C ATOM 1025 NZ LYS A 64 6.048 15.535 -2.584 1.00 0.00 N ATOM 0 H LYS A 64 8.446 16.079 -7.213 1.00 0.00 H new ATOM 0 HA LYS A 64 9.658 17.928 -5.363 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.851 15.522 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.354 16.588 -3.711 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.287 18.511 -4.800 1.00 0.00 H new ATOM 0 HG3 LYS A 64 6.910 17.550 -6.217 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.941 17.897 -4.749 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.319 16.202 -4.985 1.00 0.00 H new ATOM 0 HE2 LYS A 64 6.374 17.613 -2.531 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.688 17.140 -2.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.733 15.360 -1.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.592 14.852 -3.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 7.081 15.425 -2.640 1.00 0.00 H new ATOM 1039 N ASP A 65 11.825 16.287 -5.665 1.00 0.00 N ATOM 1040 CA ASP A 65 13.093 15.678 -5.297 1.00 0.00 C ATOM 1041 C ASP A 65 13.408 15.920 -3.816 1.00 0.00 C ATOM 1042 O ASP A 65 14.159 15.173 -3.185 1.00 0.00 O ATOM 1043 CB ASP A 65 14.164 16.275 -6.216 1.00 0.00 C ATOM 1044 CG ASP A 65 15.510 15.606 -6.040 1.00 0.00 C ATOM 1045 OD1 ASP A 65 15.660 14.502 -6.607 1.00 0.00 O ATOM 1046 OD2 ASP A 65 16.352 16.185 -5.323 1.00 0.00 O ATOM 0 H ASP A 65 11.914 16.926 -6.455 1.00 0.00 H new ATOM 0 HA ASP A 65 13.057 14.596 -5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.845 16.177 -7.254 1.00 0.00 H new ATOM 0 HB3 ASP A 65 14.261 17.341 -6.012 1.00 0.00 H new ATOM 1051 N GLN A 66 12.828 16.983 -3.257 1.00 0.00 N ATOM 1052 CA GLN A 66 12.859 17.250 -1.826 1.00 0.00 C ATOM 1053 C GLN A 66 12.258 16.106 -0.998 1.00 0.00 C ATOM 1054 O GLN A 66 12.844 15.683 -0.004 1.00 0.00 O ATOM 1055 CB GLN A 66 12.140 18.573 -1.527 1.00 0.00 C ATOM 1056 CG GLN A 66 12.810 19.758 -2.239 1.00 0.00 C ATOM 1057 CD GLN A 66 12.217 21.089 -1.792 1.00 0.00 C ATOM 1058 OE1 GLN A 66 12.909 21.919 -1.214 1.00 0.00 O ATOM 1059 NE2 GLN A 66 10.933 21.310 -2.056 1.00 0.00 N ATOM 0 H GLN A 66 12.320 17.687 -3.793 1.00 0.00 H new ATOM 0 HA GLN A 66 13.905 17.330 -1.531 1.00 0.00 H new ATOM 0 HB2 GLN A 66 11.099 18.501 -1.842 1.00 0.00 H new ATOM 0 HB3 GLN A 66 12.136 18.750 -0.451 1.00 0.00 H new ATOM 0 HG2 GLN A 66 13.880 19.749 -2.034 1.00 0.00 H new ATOM 0 HG3 GLN A 66 12.691 19.650 -3.317 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.382 20.600 -2.539 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.499 22.189 -1.776 1.00 0.00 H new ATOM 1068 N GLU A 67 11.082 15.641 -1.409 1.00 0.00 N ATOM 1069 CA GLU A 67 10.214 14.723 -0.682 1.00 0.00 C ATOM 1070 C GLU A 67 9.349 13.989 -1.712 1.00 0.00 C ATOM 1071 O GLU A 67 8.517 14.621 -2.365 1.00 0.00 O ATOM 1072 CB GLU A 67 9.379 15.540 0.321 1.00 0.00 C ATOM 1073 CG GLU A 67 8.385 14.710 1.149 1.00 0.00 C ATOM 1074 CD GLU A 67 7.144 14.339 0.349 1.00 0.00 C ATOM 1075 OE1 GLU A 67 6.384 15.269 0.000 1.00 0.00 O ATOM 1076 OE2 GLU A 67 7.003 13.142 0.031 1.00 0.00 O ATOM 0 H GLU A 67 10.688 15.911 -2.310 1.00 0.00 H new ATOM 0 HA GLU A 67 10.773 13.979 -0.114 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.056 16.057 1.001 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.827 16.306 -0.224 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.875 13.802 1.499 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.090 15.275 2.034 1.00 0.00 H new ATOM 1083 N VAL A 68 9.560 12.683 -1.885 1.00 0.00 N ATOM 1084 CA VAL A 68 8.876 11.871 -2.882 1.00 0.00 C ATOM 1085 C VAL A 68 8.033 10.829 -2.144 1.00 0.00 C ATOM 1086 O VAL A 68 8.567 10.083 -1.325 1.00 0.00 O ATOM 1087 CB VAL A 68 9.916 11.201 -3.797 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.226 10.506 -4.977 1.00 0.00 C ATOM 1089 CG2 VAL A 68 10.922 12.206 -4.377 1.00 0.00 C ATOM 0 H VAL A 68 10.226 12.153 -1.322 1.00 0.00 H new ATOM 0 HA VAL A 68 8.226 12.482 -3.508 1.00 0.00 H new ATOM 0 HB VAL A 68 10.447 10.482 -3.173 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.977 10.038 -5.613 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.543 9.744 -4.602 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.667 11.241 -5.556 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.633 11.682 -5.015 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.391 12.955 -4.965 1.00 0.00 H new ATOM 0 HG23 VAL A 68 11.457 12.696 -3.563 1.00 0.00 H new ATOM 1099 N ASN A 69 6.736 10.751 -2.435 1.00 0.00 N ATOM 1100 CA ASN A 69 5.795 9.828 -1.821 1.00 0.00 C ATOM 1101 C ASN A 69 5.376 8.790 -2.868 1.00 0.00 C ATOM 1102 O ASN A 69 5.813 8.828 -4.023 1.00 0.00 O ATOM 1103 CB ASN A 69 4.599 10.651 -1.300 1.00 0.00 C ATOM 1104 CG ASN A 69 3.715 9.918 -0.294 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.929 8.752 0.018 1.00 0.00 O ATOM 1106 ND2 ASN A 69 2.688 10.590 0.214 1.00 0.00 N ATOM 0 H ASN A 69 6.299 11.354 -3.132 1.00 0.00 H new ATOM 0 HA ASN A 69 6.235 9.290 -0.981 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.976 11.563 -0.836 1.00 0.00 H new ATOM 0 HB3 ASN A 69 3.986 10.955 -2.149 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.060 10.136 0.877 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.528 11.560 -0.059 1.00 0.00 H new ATOM 1113 N PHE A 70 4.513 7.849 -2.476 1.00 0.00 N ATOM 1114 CA PHE A 70 3.908 6.891 -3.385 1.00 0.00 C ATOM 1115 C PHE A 70 3.251 7.638 -4.542 1.00 0.00 C ATOM 1116 O PHE A 70 3.314 7.186 -5.675 1.00 0.00 O ATOM 1117 CB PHE A 70 2.871 6.031 -2.659 1.00 0.00 C ATOM 1118 CG PHE A 70 2.486 4.764 -3.398 1.00 0.00 C ATOM 1119 CD1 PHE A 70 1.552 4.797 -4.449 1.00 0.00 C ATOM 1120 CD2 PHE A 70 3.079 3.541 -3.038 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.184 3.611 -5.107 1.00 0.00 C ATOM 1122 CE2 PHE A 70 2.714 2.358 -3.701 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.757 2.388 -4.726 1.00 0.00 C ATOM 0 H PHE A 70 4.216 7.736 -1.507 1.00 0.00 H new ATOM 0 HA PHE A 70 4.686 6.231 -3.769 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.262 5.761 -1.678 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.974 6.627 -2.492 1.00 0.00 H new ATOM 0 HD1 PHE A 70 1.116 5.738 -4.752 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.817 3.511 -2.250 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.459 3.641 -5.907 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.172 1.421 -3.420 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.462 1.474 -5.220 1.00 0.00 H new ATOM 1133 N GLN A 71 2.604 8.770 -4.243 1.00 0.00 N ATOM 1134 CA GLN A 71 1.877 9.582 -5.207 1.00 0.00 C ATOM 1135 C GLN A 71 2.748 9.897 -6.429 1.00 0.00 C ATOM 1136 O GLN A 71 2.346 9.622 -7.558 1.00 0.00 O ATOM 1137 CB GLN A 71 1.342 10.837 -4.499 1.00 0.00 C ATOM 1138 CG GLN A 71 0.163 11.506 -5.222 1.00 0.00 C ATOM 1139 CD GLN A 71 0.584 12.517 -6.284 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.572 13.717 -6.035 1.00 0.00 O ATOM 1141 NE2 GLN A 71 0.927 12.065 -7.484 1.00 0.00 N ATOM 0 H GLN A 71 2.575 9.151 -3.297 1.00 0.00 H new ATOM 0 HA GLN A 71 1.021 9.030 -5.595 1.00 0.00 H new ATOM 0 HB2 GLN A 71 1.031 10.568 -3.490 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.152 11.560 -4.401 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.448 10.735 -5.690 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.465 12.007 -4.486 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.930 11.062 -7.669 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.187 12.721 -8.221 1.00 0.00 H new ATOM 1150 N GLU A 72 3.939 10.453 -6.221 1.00 0.00 N ATOM 1151 CA GLU A 72 4.864 10.736 -7.303 1.00 0.00 C ATOM 1152 C GLU A 72 5.314 9.419 -7.941 1.00 0.00 C ATOM 1153 O GLU A 72 5.161 9.221 -9.143 1.00 0.00 O ATOM 1154 CB GLU A 72 6.063 11.532 -6.774 1.00 0.00 C ATOM 1155 CG GLU A 72 5.688 12.916 -6.213 1.00 0.00 C ATOM 1156 CD GLU A 72 5.126 12.887 -4.797 1.00 0.00 C ATOM 1157 OE1 GLU A 72 5.054 11.786 -4.218 1.00 0.00 O ATOM 1158 OE2 GLU A 72 4.812 13.978 -4.280 1.00 0.00 O ATOM 0 H GLU A 72 4.285 10.718 -5.299 1.00 0.00 H new ATOM 0 HA GLU A 72 4.369 11.341 -8.063 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.555 10.954 -5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.787 11.660 -7.579 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.573 13.553 -6.227 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.953 13.376 -6.874 1.00 0.00 H new ATOM 1165 N TYR A 73 5.853 8.511 -7.122 1.00 0.00 N ATOM 1166 CA TYR A 73 6.352 7.199 -7.536 1.00 0.00 C ATOM 1167 C TYR A 73 5.387 6.465 -8.481 1.00 0.00 C ATOM 1168 O TYR A 73 5.821 5.841 -9.449 1.00 0.00 O ATOM 1169 CB TYR A 73 6.631 6.396 -6.258 1.00 0.00 C ATOM 1170 CG TYR A 73 6.649 4.885 -6.374 1.00 0.00 C ATOM 1171 CD1 TYR A 73 5.473 4.149 -6.115 1.00 0.00 C ATOM 1172 CD2 TYR A 73 7.874 4.210 -6.521 1.00 0.00 C ATOM 1173 CE1 TYR A 73 5.552 2.768 -5.879 1.00 0.00 C ATOM 1174 CE2 TYR A 73 7.938 2.819 -6.338 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.790 2.114 -5.958 1.00 0.00 C ATOM 1176 OH TYR A 73 6.898 0.825 -5.547 1.00 0.00 O ATOM 0 H TYR A 73 5.957 8.676 -6.121 1.00 0.00 H new ATOM 0 HA TYR A 73 7.266 7.320 -8.118 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.596 6.715 -5.864 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.878 6.668 -5.518 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.515 4.647 -6.098 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.767 4.762 -6.775 1.00 0.00 H new ATOM 0 HE1 TYR A 73 4.660 2.209 -5.637 1.00 0.00 H new ATOM 0 HE2 TYR A 73 8.870 2.295 -6.490 1.00 0.00 H new ATOM 0 HH TYR A 73 6.145 0.605 -4.959 1.00 0.00 H new ATOM 1186 N ILE A 74 4.083 6.518 -8.207 1.00 0.00 N ATOM 1187 CA ILE A 74 3.082 5.855 -9.025 1.00 0.00 C ATOM 1188 C ILE A 74 2.728 6.723 -10.241 1.00 0.00 C ATOM 1189 O ILE A 74 2.667 6.185 -11.341 1.00 0.00 O ATOM 1190 CB ILE A 74 1.858 5.441 -8.191 1.00 0.00 C ATOM 1191 CG1 ILE A 74 0.945 4.429 -8.900 1.00 0.00 C ATOM 1192 CG2 ILE A 74 1.022 6.667 -7.849 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.567 3.035 -9.005 1.00 0.00 C ATOM 0 H ILE A 74 3.697 7.024 -7.410 1.00 0.00 H new ATOM 0 HA ILE A 74 3.499 4.925 -9.412 1.00 0.00 H new ATOM 0 HB ILE A 74 2.257 4.964 -7.296 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.000 4.360 -8.361 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.715 4.794 -9.901 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.157 6.365 -7.258 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.625 7.370 -7.275 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.684 7.145 -8.768 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.875 2.365 -9.515 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.498 3.093 -9.569 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.772 2.652 -8.005 1.00 0.00 H new ATOM 1205 N THR A 75 2.509 8.039 -10.073 1.00 0.00 N ATOM 1206 CA THR A 75 2.246 8.974 -11.174 1.00 0.00 C ATOM 1207 C THR A 75 3.277 8.775 -12.281 1.00 0.00 C ATOM 1208 O THR A 75 2.953 8.658 -13.459 1.00 0.00 O ATOM 1209 CB THR A 75 2.287 10.418 -10.633 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.100 10.696 -9.918 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.512 11.495 -11.699 1.00 0.00 C ATOM 0 H THR A 75 2.510 8.486 -9.156 1.00 0.00 H new ATOM 0 HA THR A 75 1.258 8.785 -11.594 1.00 0.00 H new ATOM 0 HB THR A 75 3.158 10.462 -9.979 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.377 10.124 -10.250 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.526 12.477 -11.227 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.465 11.319 -12.199 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.706 11.456 -12.431 1.00 0.00 H new ATOM 1219 N PHE A 76 4.528 8.699 -11.854 1.00 0.00 N ATOM 1220 CA PHE A 76 5.710 8.459 -12.647 1.00 0.00 C ATOM 1221 C PHE A 76 5.543 7.240 -13.556 1.00 0.00 C ATOM 1222 O PHE A 76 5.650 7.350 -14.780 1.00 0.00 O ATOM 1223 CB PHE A 76 6.817 8.319 -11.600 1.00 0.00 C ATOM 1224 CG PHE A 76 8.234 8.177 -12.064 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.788 6.895 -12.213 1.00 0.00 C ATOM 1226 CD2 PHE A 76 9.072 9.296 -11.941 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.179 6.752 -12.390 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.458 9.145 -12.041 1.00 0.00 C ATOM 1229 CZ PHE A 76 11.004 7.895 -12.351 1.00 0.00 C ATOM 0 H PHE A 76 4.754 8.813 -10.866 1.00 0.00 H new ATOM 0 HA PHE A 76 5.936 9.257 -13.354 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.769 9.192 -10.949 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.582 7.450 -10.985 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.151 6.023 -12.192 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.646 10.273 -11.769 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.609 5.775 -12.554 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.107 9.993 -11.879 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.060 7.805 -12.561 1.00 0.00 H new ATOM 1239 N LEU A 77 5.218 6.077 -12.980 1.00 0.00 N ATOM 1240 CA LEU A 77 4.866 4.911 -13.782 1.00 0.00 C ATOM 1241 C LEU A 77 3.674 5.244 -14.678 1.00 0.00 C ATOM 1242 O LEU A 77 3.720 5.000 -15.877 1.00 0.00 O ATOM 1243 CB LEU A 77 4.551 3.705 -12.888 1.00 0.00 C ATOM 1244 CG LEU A 77 5.784 3.159 -12.154 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.334 2.106 -11.138 1.00 0.00 C ATOM 1246 CD2 LEU A 77 6.780 2.523 -13.134 1.00 0.00 C ATOM 0 H LEU A 77 5.193 5.923 -11.972 1.00 0.00 H new ATOM 0 HA LEU A 77 5.718 4.646 -14.408 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.797 3.991 -12.155 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.118 2.912 -13.498 1.00 0.00 H new ATOM 0 HG LEU A 77 6.282 3.988 -11.651 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.204 1.713 -10.612 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.651 2.561 -10.421 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.826 1.293 -11.657 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.642 2.146 -12.583 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.297 1.700 -13.660 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.109 3.271 -13.855 1.00 0.00 H new ATOM 1258 N GLY A 78 2.631 5.831 -14.094 1.00 0.00 N ATOM 1259 CA GLY A 78 1.434 6.312 -14.761 1.00 0.00 C ATOM 1260 C GLY A 78 1.722 7.077 -16.054 1.00 0.00 C ATOM 1261 O GLY A 78 0.959 6.961 -17.012 1.00 0.00 O ATOM 0 H GLY A 78 2.602 5.990 -13.087 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.787 5.464 -14.986 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.883 6.960 -14.079 1.00 0.00 H new ATOM 1265 N ALA A 79 2.800 7.864 -16.084 1.00 0.00 N ATOM 1266 CA ALA A 79 3.263 8.528 -17.291 1.00 0.00 C ATOM 1267 C ALA A 79 4.126 7.607 -18.173 1.00 0.00 C ATOM 1268 O ALA A 79 3.792 7.363 -19.331 1.00 0.00 O ATOM 1269 CB ALA A 79 4.015 9.802 -16.896 1.00 0.00 C ATOM 0 H ALA A 79 3.375 8.056 -15.264 1.00 0.00 H new ATOM 0 HA ALA A 79 2.398 8.791 -17.900 1.00 0.00 H new ATOM 0 HB1 ALA A 79 4.368 10.310 -17.794 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.346 10.463 -16.344 1.00 0.00 H new ATOM 0 HB3 ALA A 79 4.867 9.542 -16.268 1.00 0.00 H new ATOM 1275 N LEU A 80 5.254 7.115 -17.653 1.00 0.00 N ATOM 1276 CA LEU A 80 6.288 6.466 -18.465 1.00 0.00 C ATOM 1277 C LEU A 80 5.987 5.012 -18.862 1.00 0.00 C ATOM 1278 O LEU A 80 6.396 4.557 -19.932 1.00 0.00 O ATOM 1279 CB LEU A 80 7.628 6.521 -17.705 1.00 0.00 C ATOM 1280 CG LEU A 80 8.392 7.858 -17.740 1.00 0.00 C ATOM 1281 CD1 LEU A 80 8.963 8.157 -19.132 1.00 0.00 C ATOM 1282 CD2 LEU A 80 7.590 9.062 -17.238 1.00 0.00 C ATOM 0 H LEU A 80 5.476 7.155 -16.658 1.00 0.00 H new ATOM 0 HA LEU A 80 6.326 7.022 -19.402 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.438 6.266 -16.663 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.280 5.747 -18.109 1.00 0.00 H new ATOM 0 HG LEU A 80 9.211 7.715 -17.035 1.00 0.00 H new ATOM 0 HD11 LEU A 80 9.494 9.109 -19.111 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.652 7.364 -19.421 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.149 8.211 -19.855 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.205 9.960 -17.298 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.701 9.190 -17.855 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.292 8.895 -16.203 1.00 0.00 H new ATOM 1294 N ALA A 81 5.316 4.243 -18.008 1.00 0.00 N ATOM 1295 CA ALA A 81 5.240 2.795 -18.162 1.00 0.00 C ATOM 1296 C ALA A 81 4.571 2.257 -19.437 1.00 0.00 C ATOM 1297 O ALA A 81 4.886 1.129 -19.815 1.00 0.00 O ATOM 1298 CB ALA A 81 4.801 2.124 -16.855 1.00 0.00 C ATOM 0 H ALA A 81 4.814 4.603 -17.197 1.00 0.00 H new ATOM 0 HA ALA A 81 6.265 2.480 -18.359 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.753 1.045 -16.999 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.520 2.354 -16.069 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.818 2.496 -16.567 1.00 0.00 H new ATOM 1304 N MET A 82 3.714 3.018 -20.135 1.00 0.00 N ATOM 1305 CA MET A 82 3.179 2.579 -21.435 1.00 0.00 C ATOM 1306 C MET A 82 4.319 2.614 -22.453 1.00 0.00 C ATOM 1307 O MET A 82 4.375 1.787 -23.356 1.00 0.00 O ATOM 1308 CB MET A 82 1.993 3.445 -21.949 1.00 0.00 C ATOM 1309 CG MET A 82 0.613 2.736 -22.090 1.00 0.00 C ATOM 1310 SD MET A 82 0.592 1.177 -23.018 1.00 0.00 S ATOM 1311 CE MET A 82 1.131 1.722 -24.654 1.00 0.00 C ATOM 0 H MET A 82 3.379 3.931 -19.826 1.00 0.00 H new ATOM 0 HA MET A 82 2.781 1.573 -21.305 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.872 4.291 -21.272 1.00 0.00 H new ATOM 0 HB3 MET A 82 2.267 3.852 -22.923 1.00 0.00 H new ATOM 0 HG2 MET A 82 0.226 2.542 -21.090 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.078 3.428 -22.571 1.00 0.00 H new ATOM 0 HE1 MET A 82 1.165 0.867 -25.329 1.00 0.00 H new ATOM 0 HE2 MET A 82 0.430 2.462 -25.040 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.124 2.166 -24.581 1.00 0.00 H new ATOM 1321 N ILE A 83 5.213 3.599 -22.319 1.00 0.00 N ATOM 1322 CA ILE A 83 6.329 3.756 -23.227 1.00 0.00 C ATOM 1323 C ILE A 83 7.301 2.604 -22.989 1.00 0.00 C ATOM 1324 O ILE A 83 7.688 1.927 -23.938 1.00 0.00 O ATOM 1325 CB ILE A 83 6.992 5.139 -23.047 1.00 0.00 C ATOM 1326 CG1 ILE A 83 5.979 6.302 -23.061 1.00 0.00 C ATOM 1327 CG2 ILE A 83 8.078 5.355 -24.111 1.00 0.00 C ATOM 1328 CD1 ILE A 83 5.099 6.362 -24.313 1.00 0.00 C ATOM 0 H ILE A 83 5.175 4.300 -21.579 1.00 0.00 H new ATOM 0 HA ILE A 83 5.989 3.719 -24.262 1.00 0.00 H new ATOM 0 HB ILE A 83 7.450 5.140 -22.058 1.00 0.00 H new ATOM 0 HG12 ILE A 83 5.337 6.218 -22.184 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.523 7.242 -22.969 1.00 0.00 H new ATOM 0 HG21 ILE A 83 8.536 6.334 -23.970 1.00 0.00 H new ATOM 0 HG22 ILE A 83 8.840 4.581 -24.015 1.00 0.00 H new ATOM 0 HG23 ILE A 83 7.630 5.303 -25.104 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.417 7.209 -24.238 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.729 6.480 -25.195 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.524 5.440 -24.398 1.00 0.00 H new ATOM 1340 N TYR A 84 7.718 2.405 -21.730 1.00 0.00 N ATOM 1341 CA TYR A 84 8.792 1.464 -21.435 1.00 0.00 C ATOM 1342 C TYR A 84 8.331 0.030 -21.125 1.00 0.00 C ATOM 1343 O TYR A 84 8.962 -0.901 -21.622 1.00 0.00 O ATOM 1344 CB TYR A 84 9.787 2.044 -20.414 1.00 0.00 C ATOM 1345 CG TYR A 84 9.552 1.671 -18.965 1.00 0.00 C ATOM 1346 CD1 TYR A 84 10.078 0.467 -18.462 1.00 0.00 C ATOM 1347 CD2 TYR A 84 8.820 2.521 -18.120 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.792 0.077 -17.146 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.502 2.111 -16.814 1.00 0.00 C ATOM 1350 CZ TYR A 84 8.957 0.871 -16.341 1.00 0.00 C ATOM 1351 OH TYR A 84 8.703 0.500 -15.057 1.00 0.00 O ATOM 0 H TYR A 84 7.330 2.879 -20.914 1.00 0.00 H new ATOM 0 HA TYR A 84 9.341 1.338 -22.368 1.00 0.00 H new ATOM 0 HB2 TYR A 84 10.790 1.722 -20.692 1.00 0.00 H new ATOM 0 HB3 TYR A 84 9.767 3.131 -20.496 1.00 0.00 H new ATOM 0 HD1 TYR A 84 10.700 -0.155 -19.088 1.00 0.00 H new ATOM 0 HD2 TYR A 84 8.501 3.490 -18.474 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.214 -0.835 -16.750 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.909 2.749 -16.176 1.00 0.00 H new ATOM 0 HH TYR A 84 9.471 0.005 -14.701 1.00 0.00 H new ATOM 1361 N ASN A 85 7.351 -0.181 -20.227 1.00 0.00 N ATOM 1362 CA ASN A 85 7.026 -1.532 -19.762 1.00 0.00 C ATOM 1363 C ASN A 85 5.872 -2.135 -20.564 1.00 0.00 C ATOM 1364 O ASN A 85 6.042 -2.551 -21.705 1.00 0.00 O ATOM 1365 CB ASN A 85 6.774 -1.525 -18.239 1.00 0.00 C ATOM 1366 CG ASN A 85 6.575 -2.933 -17.673 1.00 0.00 C ATOM 1367 OD1 ASN A 85 7.516 -3.718 -17.644 1.00 0.00 O ATOM 1368 ND2 ASN A 85 5.378 -3.282 -17.203 1.00 0.00 N ATOM 0 H ASN A 85 6.781 0.558 -19.817 1.00 0.00 H new ATOM 0 HA ASN A 85 7.880 -2.185 -19.940 1.00 0.00 H new ATOM 0 HB2 ASN A 85 7.617 -1.050 -17.736 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.893 -0.922 -18.022 1.00 0.00 H new ATOM 0 HD21 ASN A 85 5.235 -4.213 -16.812 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.604 -2.618 -17.234 1.00 0.00 H new ATOM 1375 N GLU A 86 4.703 -2.165 -19.924 1.00 0.00 N ATOM 1376 CA GLU A 86 3.384 -2.575 -20.347 1.00 0.00 C ATOM 1377 C GLU A 86 2.523 -2.450 -19.093 1.00 0.00 C ATOM 1378 O GLU A 86 3.024 -1.981 -18.065 1.00 0.00 O ATOM 1379 CB GLU A 86 3.369 -3.984 -20.977 1.00 0.00 C ATOM 1380 CG GLU A 86 2.739 -3.960 -22.380 1.00 0.00 C ATOM 1381 CD GLU A 86 1.266 -3.578 -22.348 1.00 0.00 C ATOM 1382 OE1 GLU A 86 0.575 -4.111 -21.452 1.00 0.00 O ATOM 1383 OE2 GLU A 86 0.865 -2.722 -23.160 1.00 0.00 O ATOM 0 H GLU A 86 4.668 -1.853 -18.953 1.00 0.00 H new ATOM 0 HA GLU A 86 2.997 -1.951 -21.153 1.00 0.00 H new ATOM 0 HB2 GLU A 86 4.387 -4.368 -21.039 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.810 -4.666 -20.336 1.00 0.00 H new ATOM 0 HG2 GLU A 86 3.282 -3.252 -23.007 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.847 -4.942 -22.841 1.00 0.00 H new ATOM 1552 N ALA B 8 -3.118 -10.000 -13.083 1.00 0.00 N ATOM 1553 CA ALA B 8 -3.537 -8.840 -12.316 1.00 0.00 C ATOM 1554 C ALA B 8 -2.908 -7.547 -12.838 1.00 0.00 C ATOM 1555 O ALA B 8 -3.607 -6.557 -13.035 1.00 0.00 O ATOM 1556 CB ALA B 8 -3.201 -9.058 -10.843 1.00 0.00 C ATOM 0 HA ALA B 8 -4.615 -8.727 -12.428 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -3.515 -8.188 -10.266 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.722 -9.943 -10.478 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -2.126 -9.199 -10.732 1.00 0.00 H new ATOM 1562 N ILE B 9 -1.594 -7.538 -13.063 1.00 0.00 N ATOM 1563 CA ILE B 9 -0.907 -6.392 -13.640 1.00 0.00 C ATOM 1564 C ILE B 9 -1.539 -6.090 -15.003 1.00 0.00 C ATOM 1565 O ILE B 9 -2.008 -4.973 -15.218 1.00 0.00 O ATOM 1566 CB ILE B 9 0.624 -6.629 -13.669 1.00 0.00 C ATOM 1567 CG1 ILE B 9 1.284 -6.298 -12.314 1.00 0.00 C ATOM 1568 CG2 ILE B 9 1.315 -5.741 -14.713 1.00 0.00 C ATOM 1569 CD1 ILE B 9 1.053 -7.332 -11.210 1.00 0.00 C ATOM 0 H ILE B 9 -0.981 -8.325 -12.850 1.00 0.00 H new ATOM 0 HA ILE B 9 -1.031 -5.500 -13.026 1.00 0.00 H new ATOM 0 HB ILE B 9 0.747 -7.685 -13.911 1.00 0.00 H new ATOM 0 HG12 ILE B 9 2.357 -6.187 -12.468 1.00 0.00 H new ATOM 0 HG13 ILE B 9 0.910 -5.333 -11.971 1.00 0.00 H new ATOM 0 HG21 ILE B 9 2.387 -5.936 -14.704 1.00 0.00 H new ATOM 0 HG22 ILE B 9 0.914 -5.963 -15.702 1.00 0.00 H new ATOM 0 HG23 ILE B 9 1.134 -4.693 -14.476 1.00 0.00 H new ATOM 0 HD11 ILE B 9 1.556 -7.009 -10.298 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -0.016 -7.429 -11.020 1.00 0.00 H new ATOM 0 HD13 ILE B 9 1.454 -8.296 -11.524 1.00 0.00 H new ATOM 1581 N GLY B 10 -1.616 -7.079 -15.900 1.00 0.00 N ATOM 1582 CA GLY B 10 -2.269 -6.917 -17.197 1.00 0.00 C ATOM 1583 C GLY B 10 -3.651 -6.269 -17.063 1.00 0.00 C ATOM 1584 O GLY B 10 -3.988 -5.327 -17.785 1.00 0.00 O ATOM 0 H GLY B 10 -1.228 -8.010 -15.745 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -1.642 -6.305 -17.845 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -2.369 -7.890 -17.677 1.00 0.00 H new ATOM 1588 N LEU B 11 -4.445 -6.753 -16.106 1.00 0.00 N ATOM 1589 CA LEU B 11 -5.795 -6.282 -15.848 1.00 0.00 C ATOM 1590 C LEU B 11 -5.837 -4.775 -15.584 1.00 0.00 C ATOM 1591 O LEU B 11 -6.848 -4.154 -15.893 1.00 0.00 O ATOM 1592 CB LEU B 11 -6.435 -7.099 -14.713 1.00 0.00 C ATOM 1593 CG LEU B 11 -7.906 -6.760 -14.422 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -8.816 -7.025 -15.628 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -8.385 -7.601 -13.234 1.00 0.00 C ATOM 0 H LEU B 11 -4.154 -7.501 -15.477 1.00 0.00 H new ATOM 0 HA LEU B 11 -6.391 -6.441 -16.747 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -6.364 -8.158 -14.962 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -5.855 -6.946 -13.803 1.00 0.00 H new ATOM 0 HG LEU B 11 -7.964 -5.695 -14.196 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -9.844 -6.770 -15.371 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -8.490 -6.415 -16.471 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -8.761 -8.079 -15.901 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -9.428 -7.367 -13.020 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -8.293 -8.660 -13.477 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -7.776 -7.375 -12.359 1.00 0.00 H new ATOM 1607 N LEU B 12 -4.770 -4.146 -15.072 1.00 0.00 N ATOM 1608 CA LEU B 12 -4.778 -2.692 -14.938 1.00 0.00 C ATOM 1609 C LEU B 12 -4.915 -2.023 -16.312 1.00 0.00 C ATOM 1610 O LEU B 12 -5.711 -1.089 -16.447 1.00 0.00 O ATOM 1611 CB LEU B 12 -3.569 -2.167 -14.144 1.00 0.00 C ATOM 1612 CG LEU B 12 -3.788 -2.128 -12.618 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -4.854 -1.113 -12.185 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -4.089 -3.505 -12.021 1.00 0.00 C ATOM 0 H LEU B 12 -3.918 -4.608 -14.754 1.00 0.00 H new ATOM 0 HA LEU B 12 -5.654 -2.419 -14.350 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -2.705 -2.795 -14.360 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -3.328 -1.162 -14.492 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.833 -1.792 -12.214 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.959 -1.136 -11.100 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.554 -0.113 -12.499 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.808 -1.367 -12.647 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -4.233 -3.411 -10.945 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.994 -3.908 -12.475 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -3.254 -4.177 -12.218 1.00 0.00 H new ATOM 1626 N ILE B 13 -4.197 -2.504 -17.339 1.00 0.00 N ATOM 1627 CA ILE B 13 -4.455 -2.050 -18.705 1.00 0.00 C ATOM 1628 C ILE B 13 -5.822 -2.557 -19.154 1.00 0.00 C ATOM 1629 O ILE B 13 -6.554 -1.808 -19.794 1.00 0.00 O ATOM 1630 CB ILE B 13 -3.311 -2.373 -19.700 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -2.458 -1.095 -19.877 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -3.798 -2.835 -21.084 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -1.290 -1.193 -20.870 1.00 0.00 C ATOM 0 H ILE B 13 -3.450 -3.192 -17.249 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.478 -0.960 -18.702 1.00 0.00 H new ATOM 0 HB ILE B 13 -2.743 -3.203 -19.279 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.114 -0.286 -20.199 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.058 -0.812 -18.903 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.939 -3.041 -21.722 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.395 -3.740 -20.976 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.406 -2.051 -21.536 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -0.766 -0.238 -20.910 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.601 -1.972 -20.545 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -1.674 -1.438 -21.860 1.00 0.00 H new ATOM 1645 N GLY B 14 -6.173 -3.810 -18.856 1.00 0.00 N ATOM 1646 CA GLY B 14 -7.466 -4.387 -19.214 1.00 0.00 C ATOM 1647 C GLY B 14 -8.625 -3.439 -18.884 1.00 0.00 C ATOM 1648 O GLY B 14 -9.367 -3.023 -19.773 1.00 0.00 O ATOM 0 H GLY B 14 -5.562 -4.456 -18.356 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -7.478 -4.618 -20.279 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -7.604 -5.328 -18.682 1.00 0.00 H new ATOM 1652 N ILE B 15 -8.751 -3.075 -17.610 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.733 -2.133 -17.095 1.00 0.00 C ATOM 1654 C ILE B 15 -9.577 -0.780 -17.790 1.00 0.00 C ATOM 1655 O ILE B 15 -10.545 -0.244 -18.326 1.00 0.00 O ATOM 1656 CB ILE B 15 -9.543 -2.011 -15.567 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -9.907 -3.312 -14.824 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -10.286 -0.818 -14.947 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -11.405 -3.631 -14.774 1.00 0.00 C ATOM 0 H ILE B 15 -8.144 -3.446 -16.880 1.00 0.00 H new ATOM 0 HA ILE B 15 -10.743 -2.488 -17.298 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.477 -1.826 -15.436 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -9.389 -4.143 -15.303 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -9.530 -3.247 -13.803 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -10.106 -0.796 -13.872 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -9.924 0.108 -15.394 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -11.355 -0.918 -15.134 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -11.561 -4.564 -14.232 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.932 -2.823 -14.266 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.789 -3.733 -15.789 1.00 0.00 H new ATOM 1671 N PHE B 16 -8.353 -0.241 -17.783 1.00 0.00 N ATOM 1672 CA PHE B 16 -8.040 1.130 -18.150 1.00 0.00 C ATOM 1673 C PHE B 16 -8.868 1.679 -19.313 1.00 0.00 C ATOM 1674 O PHE B 16 -9.807 2.442 -19.104 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.518 1.261 -18.322 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.002 2.505 -18.999 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.545 3.757 -18.680 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -4.917 2.421 -19.887 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.150 4.898 -19.391 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -4.552 3.552 -20.643 1.00 0.00 C ATOM 1681 CZ PHE B 16 -5.190 4.785 -20.409 1.00 0.00 C ATOM 0 H PHE B 16 -7.527 -0.774 -17.510 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.347 1.786 -17.335 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.061 1.200 -17.334 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -6.167 0.399 -18.889 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.270 3.843 -17.884 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -4.367 1.497 -19.989 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.582 5.860 -19.157 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -3.785 3.474 -21.400 1.00 0.00 H new ATOM 0 HZ PHE B 16 -4.941 5.645 -21.013 1.00 0.00 H new ATOM 1691 N HIS B 17 -8.540 1.276 -20.537 1.00 0.00 N ATOM 1692 CA HIS B 17 -9.224 1.807 -21.719 1.00 0.00 C ATOM 1693 C HIS B 17 -10.664 1.284 -21.817 1.00 0.00 C ATOM 1694 O HIS B 17 -11.485 1.861 -22.525 1.00 0.00 O ATOM 1695 CB HIS B 17 -8.421 1.533 -23.005 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.067 0.084 -23.164 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -9.022 -0.908 -23.203 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -6.924 -0.450 -22.638 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -8.516 -1.985 -22.587 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -7.230 -1.747 -22.287 1.00 0.00 N ATOM 0 H HIS B 17 -7.812 0.590 -20.739 1.00 0.00 H new ATOM 0 HA HIS B 17 -9.285 2.889 -21.606 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -9.002 1.859 -23.868 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -7.508 2.128 -22.993 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -5.972 0.045 -22.521 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -9.055 -2.895 -22.368 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -6.585 -2.416 -21.868 1.00 0.00 H new ATOM 1708 N LYS B 18 -10.975 0.158 -21.159 1.00 0.00 N ATOM 1709 CA LYS B 18 -12.313 -0.418 -21.199 1.00 0.00 C ATOM 1710 C LYS B 18 -13.279 0.469 -20.416 1.00 0.00 C ATOM 1711 O LYS B 18 -14.440 0.603 -20.801 1.00 0.00 O ATOM 1712 CB LYS B 18 -12.290 -1.870 -20.698 1.00 0.00 C ATOM 1713 CG LYS B 18 -13.648 -2.596 -20.703 1.00 0.00 C ATOM 1714 CD LYS B 18 -14.262 -2.852 -22.094 1.00 0.00 C ATOM 1715 CE LYS B 18 -15.317 -1.801 -22.484 1.00 0.00 C ATOM 1716 NZ LYS B 18 -16.038 -2.139 -23.726 1.00 0.00 N ATOM 0 H LYS B 18 -10.310 -0.369 -20.592 1.00 0.00 H new ATOM 0 HA LYS B 18 -12.670 -0.455 -22.228 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -11.592 -2.437 -21.314 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -11.897 -1.879 -19.681 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -13.529 -3.554 -20.196 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -14.355 -2.010 -20.116 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -13.468 -2.857 -22.841 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -14.719 -3.841 -22.108 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -16.035 -1.697 -21.671 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -14.830 -0.833 -22.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -16.734 -1.395 -23.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -15.361 -2.212 -24.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -16.528 -3.048 -23.606 1.00 0.00 H new ATOM 1730 N TYR B 19 -12.818 1.110 -19.339 1.00 0.00 N ATOM 1731 CA TYR B 19 -13.652 1.973 -18.509 1.00 0.00 C ATOM 1732 C TYR B 19 -13.851 3.351 -19.166 1.00 0.00 C ATOM 1733 O TYR B 19 -13.653 4.398 -18.555 1.00 0.00 O ATOM 1734 CB TYR B 19 -13.119 1.978 -17.064 1.00 0.00 C ATOM 1735 CG TYR B 19 -13.643 0.816 -16.226 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -13.524 -0.503 -16.706 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.319 1.045 -15.009 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -14.086 -1.569 -15.991 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.827 -0.032 -14.257 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.735 -1.340 -14.770 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.257 -2.416 -14.121 1.00 0.00 O ATOM 0 H TYR B 19 -11.852 1.043 -19.020 1.00 0.00 H new ATOM 0 HA TYR B 19 -14.665 1.578 -18.435 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -12.030 1.940 -17.085 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -13.396 2.917 -16.585 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -12.997 -0.694 -17.629 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.448 2.056 -14.651 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -14.019 -2.573 -16.383 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -15.284 0.144 -13.294 1.00 0.00 H new ATOM 0 HH TYR B 19 -15.989 -2.123 -13.539 1.00 0.00 H new ATOM 1751 N SER B 20 -14.312 3.330 -20.420 1.00 0.00 N ATOM 1752 CA SER B 20 -14.807 4.472 -21.173 1.00 0.00 C ATOM 1753 C SER B 20 -16.177 4.146 -21.789 1.00 0.00 C ATOM 1754 O SER B 20 -16.561 4.706 -22.816 1.00 0.00 O ATOM 1755 CB SER B 20 -13.764 4.929 -22.204 1.00 0.00 C ATOM 1756 OG SER B 20 -12.762 5.703 -21.564 1.00 0.00 O ATOM 0 H SER B 20 -14.349 2.466 -20.961 1.00 0.00 H new ATOM 0 HA SER B 20 -14.962 5.318 -20.503 1.00 0.00 H new ATOM 0 HB2 SER B 20 -13.313 4.062 -22.688 1.00 0.00 H new ATOM 0 HB3 SER B 20 -14.245 5.516 -22.986 1.00 0.00 H new ATOM 0 HG SER B 20 -13.115 6.595 -21.365 1.00 0.00 H new ATOM 1762 N GLY B 21 -16.913 3.217 -21.170 1.00 0.00 N ATOM 1763 CA GLY B 21 -18.316 2.920 -21.417 1.00 0.00 C ATOM 1764 C GLY B 21 -18.560 2.091 -22.672 1.00 0.00 C ATOM 1765 O GLY B 21 -19.211 1.050 -22.624 1.00 0.00 O ATOM 0 H GLY B 21 -16.517 2.622 -20.443 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -18.721 2.387 -20.557 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -18.867 3.857 -21.500 1.00 0.00 H new ATOM 1825 N LYS B 26 -10.551 3.752 -26.424 1.00 0.00 N ATOM 1826 CA LYS B 26 -10.149 5.060 -25.934 1.00 0.00 C ATOM 1827 C LYS B 26 -9.134 4.885 -24.803 1.00 0.00 C ATOM 1828 O LYS B 26 -9.467 4.335 -23.758 1.00 0.00 O ATOM 1829 CB LYS B 26 -11.368 5.871 -25.452 1.00 0.00 C ATOM 1830 CG LYS B 26 -12.590 5.897 -26.386 1.00 0.00 C ATOM 1831 CD LYS B 26 -12.288 6.436 -27.796 1.00 0.00 C ATOM 1832 CE LYS B 26 -13.536 6.396 -28.697 1.00 0.00 C ATOM 1833 NZ LYS B 26 -13.818 5.031 -29.185 1.00 0.00 N ATOM 0 HA LYS B 26 -9.688 5.617 -26.750 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -11.684 5.471 -24.488 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -11.048 6.899 -25.281 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -12.990 4.887 -26.472 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.368 6.511 -25.932 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -11.923 7.461 -27.724 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.492 5.845 -28.249 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -14.397 6.768 -28.142 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.392 7.063 -29.547 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -14.665 5.046 -29.788 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -13.007 4.685 -29.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -13.981 4.399 -28.375 1.00 0.00 H new ATOM 1847 N HIS B 27 -7.888 5.314 -25.022 1.00 0.00 N ATOM 1848 CA HIS B 27 -6.805 5.168 -24.054 1.00 0.00 C ATOM 1849 C HIS B 27 -6.954 6.213 -22.943 1.00 0.00 C ATOM 1850 O HIS B 27 -6.087 7.069 -22.755 1.00 0.00 O ATOM 1851 CB HIS B 27 -5.454 5.228 -24.780 1.00 0.00 C ATOM 1852 CG HIS B 27 -5.285 6.455 -25.640 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -5.196 7.748 -25.167 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -5.331 6.495 -27.007 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -5.162 8.571 -26.232 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -5.238 7.830 -27.359 1.00 0.00 N ATOM 0 H HIS B 27 -7.603 5.776 -25.885 1.00 0.00 H new ATOM 0 HA HIS B 27 -6.854 4.194 -23.566 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -4.653 5.199 -24.042 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -5.346 4.340 -25.403 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -5.162 8.030 -24.187 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -5.422 5.653 -27.677 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -5.086 9.648 -26.192 1.00 0.00 H new ATOM 1864 N THR B 28 -8.077 6.132 -22.239 1.00 0.00 N ATOM 1865 CA THR B 28 -8.580 7.058 -21.250 1.00 0.00 C ATOM 1866 C THR B 28 -9.653 6.290 -20.481 1.00 0.00 C ATOM 1867 O THR B 28 -10.160 5.283 -20.979 1.00 0.00 O ATOM 1868 CB THR B 28 -9.223 8.280 -21.936 1.00 0.00 C ATOM 1869 OG1 THR B 28 -9.969 7.870 -23.069 1.00 0.00 O ATOM 1870 CG2 THR B 28 -8.203 9.328 -22.387 1.00 0.00 C ATOM 0 H THR B 28 -8.711 5.342 -22.363 1.00 0.00 H new ATOM 0 HA THR B 28 -7.782 7.421 -20.603 1.00 0.00 H new ATOM 0 HB THR B 28 -9.867 8.739 -21.186 1.00 0.00 H new ATOM 0 HG1 THR B 28 -10.374 8.654 -23.495 1.00 0.00 H new ATOM 0 HG21 THR B 28 -8.722 10.161 -22.862 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.648 9.692 -21.522 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.511 8.879 -23.099 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.022 6.782 -19.305 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.171 6.325 -18.553 1.00 0.00 C ATOM 1880 C LEU B 29 -12.156 7.488 -18.600 1.00 0.00 C ATOM 1881 O LEU B 29 -11.744 8.631 -18.391 1.00 0.00 O ATOM 1882 CB LEU B 29 -10.794 5.975 -17.111 1.00 0.00 C ATOM 1883 CG LEU B 29 -9.470 5.206 -16.995 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -8.306 6.183 -16.757 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -9.530 4.181 -15.860 1.00 0.00 C ATOM 0 H LEU B 29 -9.511 7.532 -18.839 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.594 5.413 -18.973 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -10.724 6.894 -16.529 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -11.592 5.378 -16.670 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.305 4.674 -17.932 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -7.373 5.625 -16.677 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -8.240 6.881 -17.592 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -8.478 6.736 -15.834 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -8.580 3.650 -15.799 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -9.721 4.693 -14.917 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -10.332 3.469 -16.055 1.00 0.00 H new ATOM 1897 N SER B 30 -13.420 7.238 -18.932 1.00 0.00 N ATOM 1898 CA SER B 30 -14.364 8.335 -19.113 1.00 0.00 C ATOM 1899 C SER B 30 -15.027 8.703 -17.785 1.00 0.00 C ATOM 1900 O SER B 30 -15.130 7.874 -16.881 1.00 0.00 O ATOM 1901 CB SER B 30 -15.377 8.012 -20.212 1.00 0.00 C ATOM 1902 OG SER B 30 -14.702 7.695 -21.419 1.00 0.00 O ATOM 0 H SER B 30 -13.808 6.306 -19.078 1.00 0.00 H new ATOM 0 HA SER B 30 -13.817 9.216 -19.447 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.003 7.174 -19.905 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.039 8.864 -20.369 1.00 0.00 H new ATOM 0 HG SER B 30 -15.359 7.488 -22.116 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.456 9.959 -17.642 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.187 10.359 -16.443 1.00 0.00 C ATOM 1910 C LYS B 31 -17.464 9.522 -16.308 1.00 0.00 C ATOM 1911 O LYS B 31 -18.130 9.235 -17.305 1.00 0.00 O ATOM 1912 CB LYS B 31 -16.485 11.865 -16.399 1.00 0.00 C ATOM 1913 CG LYS B 31 -16.824 12.461 -17.767 1.00 0.00 C ATOM 1914 CD LYS B 31 -17.595 13.776 -17.603 1.00 0.00 C ATOM 1915 CE LYS B 31 -17.667 14.570 -18.916 1.00 0.00 C ATOM 1916 NZ LYS B 31 -16.329 14.971 -19.392 1.00 0.00 N ATOM 0 H LYS B 31 -15.313 10.701 -18.327 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.545 10.163 -15.584 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -17.317 12.043 -15.718 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -15.620 12.386 -15.989 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -15.908 12.637 -18.331 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.420 11.752 -18.342 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.605 13.563 -17.253 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.114 14.385 -16.837 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.157 13.966 -19.679 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -18.281 15.458 -18.770 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -16.422 15.752 -20.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -15.752 15.282 -18.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -15.869 14.162 -19.855 1.00 0.00 H new ATOM 1930 N LYS B 32 -17.778 9.141 -15.068 1.00 0.00 N ATOM 1931 CA LYS B 32 -18.781 8.193 -14.607 1.00 0.00 C ATOM 1932 C LYS B 32 -18.180 6.787 -14.467 1.00 0.00 C ATOM 1933 O LYS B 32 -18.438 6.120 -13.466 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.175 8.353 -15.261 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.023 7.079 -15.387 1.00 0.00 C ATOM 1936 CD LYS B 32 -20.734 6.257 -16.653 1.00 0.00 C ATOM 1937 CE LYS B 32 -20.988 7.038 -17.958 1.00 0.00 C ATOM 1938 NZ LYS B 32 -19.741 7.517 -18.593 1.00 0.00 N ATOM 0 H LYS B 32 -17.274 9.539 -14.276 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.065 8.446 -13.586 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.741 9.084 -14.683 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.038 8.772 -16.258 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -20.850 6.452 -14.512 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -22.078 7.355 -15.378 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -19.696 5.924 -16.633 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -21.356 5.362 -16.646 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -21.525 6.399 -18.659 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -21.633 7.891 -17.746 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -19.942 8.369 -19.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -19.042 7.744 -17.857 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -19.361 6.775 -19.215 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.344 6.325 -15.399 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.666 5.047 -15.235 1.00 0.00 C ATOM 1954 C GLU B 33 -15.661 5.089 -14.073 1.00 0.00 C ATOM 1955 O GLU B 33 -15.540 4.105 -13.343 1.00 0.00 O ATOM 1956 CB GLU B 33 -16.006 4.593 -16.542 1.00 0.00 C ATOM 1957 CG GLU B 33 -17.004 4.178 -17.637 1.00 0.00 C ATOM 1958 CD GLU B 33 -17.700 5.340 -18.322 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -17.384 6.512 -18.034 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -18.647 5.110 -19.101 1.00 0.00 O ATOM 0 H GLU B 33 -17.124 6.815 -16.266 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.421 4.304 -14.980 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.382 5.402 -16.922 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.345 3.753 -16.330 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -16.477 3.591 -18.389 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -17.759 3.527 -17.196 1.00 0.00 H new ATOM 1967 N LEU B 34 -14.964 6.208 -13.845 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.081 6.318 -12.679 1.00 0.00 C ATOM 1969 C LEU B 34 -14.907 6.187 -11.397 1.00 0.00 C ATOM 1970 O LEU B 34 -14.585 5.375 -10.527 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.280 7.627 -12.652 1.00 0.00 C ATOM 1972 CG LEU B 34 -12.184 7.801 -13.704 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -11.199 6.634 -13.724 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.808 8.037 -15.079 1.00 0.00 C ATOM 0 H LEU B 34 -14.992 7.036 -14.440 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.355 5.508 -12.749 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.982 8.454 -12.757 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -12.821 7.721 -11.668 1.00 0.00 H new ATOM 0 HG LEU B 34 -11.601 8.680 -13.431 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -10.443 6.809 -14.489 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -10.717 6.548 -12.750 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -11.733 5.711 -13.947 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.019 8.160 -15.821 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.429 7.183 -15.348 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -13.422 8.937 -15.050 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.003 6.951 -11.307 1.00 0.00 N ATOM 1987 CA LYS B 35 -16.991 6.809 -10.241 1.00 0.00 C ATOM 1988 C LYS B 35 -17.480 5.360 -10.124 1.00 0.00 C ATOM 1989 O LYS B 35 -17.974 4.958 -9.068 1.00 0.00 O ATOM 1990 CB LYS B 35 -18.155 7.785 -10.471 1.00 0.00 C ATOM 1991 CG LYS B 35 -19.285 7.718 -9.422 1.00 0.00 C ATOM 1992 CD LYS B 35 -20.653 7.317 -10.012 1.00 0.00 C ATOM 1993 CE LYS B 35 -20.738 5.935 -10.688 1.00 0.00 C ATOM 1994 NZ LYS B 35 -20.594 4.797 -9.756 1.00 0.00 N ATOM 0 H LYS B 35 -16.226 7.687 -11.977 1.00 0.00 H new ATOM 0 HA LYS B 35 -16.518 7.060 -9.291 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -17.759 8.800 -10.490 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -18.582 7.591 -11.455 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -19.009 7.002 -8.648 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.378 8.690 -8.938 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.392 7.350 -9.211 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -20.942 8.072 -10.743 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.696 5.852 -11.201 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -19.962 5.867 -11.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -20.526 3.912 -10.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -19.733 4.922 -9.186 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -21.422 4.756 -9.128 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.425 4.575 -11.200 1.00 0.00 N ATOM 2009 CA GLU B 36 -17.814 3.180 -11.162 1.00 0.00 C ATOM 2010 C GLU B 36 -16.727 2.313 -10.532 1.00 0.00 C ATOM 2011 O GLU B 36 -16.976 1.693 -9.497 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.331 2.731 -12.538 1.00 0.00 C ATOM 2013 CG GLU B 36 -19.172 1.452 -12.476 1.00 0.00 C ATOM 2014 CD GLU B 36 -20.313 1.515 -11.466 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.860 2.622 -11.252 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.569 0.447 -10.869 1.00 0.00 O ATOM 0 H GLU B 36 -17.110 4.894 -12.116 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.663 3.045 -10.492 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.929 3.531 -12.974 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.483 2.569 -13.203 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -19.585 1.251 -13.465 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -18.523 0.613 -12.225 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.523 2.315 -11.106 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.432 1.480 -10.591 1.00 0.00 C ATOM 2025 C LEU B 37 -14.187 1.713 -9.100 1.00 0.00 C ATOM 2026 O LEU B 37 -13.992 0.759 -8.346 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.143 1.471 -11.433 1.00 0.00 C ATOM 2028 CG LEU B 37 -12.466 2.825 -11.592 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -11.410 3.092 -10.510 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.774 2.919 -12.957 1.00 0.00 C ATOM 0 H LEU B 37 -15.278 2.879 -11.920 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.795 0.458 -10.701 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -12.435 0.779 -10.977 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.377 1.081 -12.423 1.00 0.00 H new ATOM 0 HG LEU B 37 -13.256 3.570 -11.500 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.961 4.071 -10.674 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.882 3.069 -9.528 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.637 2.325 -10.559 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -11.295 3.893 -13.056 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.022 2.134 -13.038 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.513 2.797 -13.749 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.219 2.972 -8.652 1.00 0.00 N ATOM 2043 CA ILE B 38 -14.026 3.254 -7.231 1.00 0.00 C ATOM 2044 C ILE B 38 -15.103 2.589 -6.369 1.00 0.00 C ATOM 2045 O ILE B 38 -14.821 2.184 -5.243 1.00 0.00 O ATOM 2046 CB ILE B 38 -13.917 4.765 -6.965 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -13.507 5.022 -5.502 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.230 5.482 -7.292 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -13.062 6.464 -5.263 1.00 0.00 C ATOM 0 H ILE B 38 -14.373 3.792 -9.238 1.00 0.00 H new ATOM 0 HA ILE B 38 -13.074 2.812 -6.937 1.00 0.00 H new ATOM 0 HB ILE B 38 -13.146 5.170 -7.621 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -14.347 4.791 -4.847 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -12.696 4.346 -5.231 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.121 6.548 -7.094 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -15.475 5.331 -8.343 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -16.030 5.077 -6.672 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -12.784 6.590 -4.217 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -12.204 6.690 -5.896 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -13.880 7.142 -5.506 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.337 2.493 -6.873 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.463 2.081 -6.058 1.00 0.00 C ATOM 2063 C GLN B 39 -17.395 0.590 -5.739 1.00 0.00 C ATOM 2064 O GLN B 39 -17.444 0.225 -4.566 1.00 0.00 O ATOM 2065 CB GLN B 39 -18.787 2.467 -6.736 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.031 1.998 -5.964 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.121 2.577 -4.553 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -20.814 3.563 -4.330 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -19.435 1.974 -3.585 1.00 0.00 N ATOM 0 H GLN B 39 -16.573 2.697 -7.844 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.415 2.610 -5.106 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -18.826 3.550 -6.848 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.810 2.041 -7.739 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -20.924 2.279 -6.522 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -20.023 0.910 -5.903 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -18.866 1.155 -3.798 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -19.479 2.331 -2.631 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.419 -0.265 -6.767 1.00 0.00 N ATOM 2079 CA LYS B 40 -17.449 -1.711 -6.566 1.00 0.00 C ATOM 2080 C LYS B 40 -16.030 -2.281 -6.589 1.00 0.00 C ATOM 2081 O LYS B 40 -15.544 -2.833 -5.608 1.00 0.00 O ATOM 2082 CB LYS B 40 -18.357 -2.415 -7.590 1.00 0.00 C ATOM 2083 CG LYS B 40 -19.622 -1.624 -7.952 1.00 0.00 C ATOM 2084 CD LYS B 40 -20.469 -2.351 -9.009 1.00 0.00 C ATOM 2085 CE LYS B 40 -19.688 -2.721 -10.283 1.00 0.00 C ATOM 2086 NZ LYS B 40 -18.900 -1.587 -10.798 1.00 0.00 N ATOM 0 H LYS B 40 -17.418 0.023 -7.745 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.880 -1.903 -5.583 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.785 -2.602 -8.499 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -18.650 -3.387 -7.193 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -20.220 -1.464 -7.055 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -19.340 -0.640 -8.326 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -20.880 -3.260 -8.569 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -21.314 -1.718 -9.282 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -19.022 -3.557 -10.070 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -20.385 -3.056 -11.051 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -18.390 -1.880 -11.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -19.537 -0.797 -11.026 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -18.216 -1.283 -10.076 1.00 0.00 H new ATOM 2100 N GLU B 41 -15.383 -2.150 -7.744 1.00 0.00 N ATOM 2101 CA GLU B 41 -14.147 -2.802 -8.125 1.00 0.00 C ATOM 2102 C GLU B 41 -13.042 -2.553 -7.096 1.00 0.00 C ATOM 2103 O GLU B 41 -12.493 -3.504 -6.540 1.00 0.00 O ATOM 2104 CB GLU B 41 -13.765 -2.376 -9.554 1.00 0.00 C ATOM 2105 CG GLU B 41 -14.753 -2.841 -10.649 1.00 0.00 C ATOM 2106 CD GLU B 41 -16.017 -2.006 -10.867 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -16.450 -1.250 -9.973 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -16.651 -2.166 -11.933 1.00 0.00 O ATOM 0 H GLU B 41 -15.737 -1.543 -8.484 1.00 0.00 H new ATOM 0 HA GLU B 41 -14.289 -3.883 -8.134 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -13.691 -1.289 -9.588 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -12.775 -2.770 -9.785 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -14.211 -2.883 -11.594 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -15.060 -3.860 -10.413 1.00 0.00 H new ATOM 2115 N LEU B 42 -12.736 -1.288 -6.788 1.00 0.00 N ATOM 2116 CA LEU B 42 -11.712 -0.988 -5.785 1.00 0.00 C ATOM 2117 C LEU B 42 -12.080 -1.499 -4.386 1.00 0.00 C ATOM 2118 O LEU B 42 -11.225 -1.494 -3.503 1.00 0.00 O ATOM 2119 CB LEU B 42 -11.337 0.501 -5.766 1.00 0.00 C ATOM 2120 CG LEU B 42 -10.786 1.043 -7.097 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -10.169 2.423 -6.857 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -9.716 0.149 -7.731 1.00 0.00 C ATOM 0 H LEU B 42 -13.174 -0.470 -7.211 1.00 0.00 H new ATOM 0 HA LEU B 42 -10.823 -1.540 -6.091 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -12.218 1.080 -5.491 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -10.592 0.664 -4.987 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.630 1.082 -7.786 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -9.776 2.814 -7.795 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -10.931 3.100 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -9.359 2.339 -6.132 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -9.376 0.596 -8.665 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -8.873 0.050 -7.048 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -10.137 -0.836 -7.932 1.00 0.00 H new ATOM 2134 N THR B 43 -13.316 -1.963 -4.166 1.00 0.00 N ATOM 2135 CA THR B 43 -13.739 -2.698 -2.982 1.00 0.00 C ATOM 2136 C THR B 43 -13.866 -1.817 -1.740 1.00 0.00 C ATOM 2137 O THR B 43 -14.965 -1.614 -1.233 1.00 0.00 O ATOM 2138 CB THR B 43 -12.866 -3.955 -2.798 1.00 0.00 C ATOM 2139 OG1 THR B 43 -12.875 -4.710 -3.998 1.00 0.00 O ATOM 2140 CG2 THR B 43 -13.409 -4.865 -1.693 1.00 0.00 C ATOM 0 H THR B 43 -14.073 -1.828 -4.837 1.00 0.00 H new ATOM 0 HA THR B 43 -14.759 -3.048 -3.139 1.00 0.00 H new ATOM 0 HB THR B 43 -11.863 -3.618 -2.534 1.00 0.00 H new ATOM 0 HG1 THR B 43 -12.572 -4.147 -4.741 1.00 0.00 H new ATOM 0 HG21 THR B 43 -12.767 -5.740 -1.594 1.00 0.00 H new ATOM 0 HG22 THR B 43 -13.428 -4.320 -0.749 1.00 0.00 H new ATOM 0 HG23 THR B 43 -14.420 -5.184 -1.948 1.00 0.00 H new ATOM 2148 N ILE B 44 -12.733 -1.323 -1.244 1.00 0.00 N ATOM 2149 CA ILE B 44 -12.591 -0.479 -0.060 1.00 0.00 C ATOM 2150 C ILE B 44 -13.529 -0.876 1.091 1.00 0.00 C ATOM 2151 O ILE B 44 -14.132 -0.041 1.761 1.00 0.00 O ATOM 2152 CB ILE B 44 -12.668 1.011 -0.428 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -13.994 1.401 -1.111 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -11.466 1.404 -1.299 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -14.170 2.918 -1.231 1.00 0.00 C ATOM 0 H ILE B 44 -11.834 -1.514 -1.686 1.00 0.00 H new ATOM 0 HA ILE B 44 -11.591 -0.655 0.337 1.00 0.00 H new ATOM 0 HB ILE B 44 -12.635 1.570 0.507 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -14.032 0.955 -2.105 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -14.827 0.986 -0.543 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -11.531 2.462 -1.553 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -10.543 1.219 -0.750 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -11.469 0.810 -2.213 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -15.120 3.137 -1.719 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -14.161 3.365 -0.237 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -13.354 3.333 -1.823 1.00 0.00 H new ATOM 2167 N GLY B 45 -13.600 -2.180 1.338 1.00 0.00 N ATOM 2168 CA GLY B 45 -14.418 -2.773 2.386 1.00 0.00 C ATOM 2169 C GLY B 45 -13.738 -2.561 3.733 1.00 0.00 C ATOM 2170 O GLY B 45 -14.299 -1.956 4.646 1.00 0.00 O ATOM 0 H GLY B 45 -13.076 -2.870 0.800 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -15.409 -2.320 2.390 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -14.555 -3.838 2.198 1.00 0.00 H new ATOM 2373 N ASP B 58 -10.649 10.856 -4.034 1.00 0.00 N ATOM 2374 CA ASP B 58 -10.341 9.803 -5.003 1.00 0.00 C ATOM 2375 C ASP B 58 -11.480 9.494 -5.958 1.00 0.00 C ATOM 2376 O ASP B 58 -11.282 8.803 -6.955 1.00 0.00 O ATOM 2377 CB ASP B 58 -9.780 8.563 -4.298 1.00 0.00 C ATOM 2378 CG ASP B 58 -8.386 8.817 -3.734 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -7.534 9.282 -4.521 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -8.191 8.537 -2.532 1.00 0.00 O ATOM 0 HA ASP B 58 -9.556 10.190 -5.653 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -10.451 8.268 -3.491 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -9.742 7.731 -5.001 1.00 0.00 H new ATOM 2385 N ASP B 59 -12.635 10.119 -5.760 1.00 0.00 N ATOM 2386 CA ASP B 59 -13.719 10.231 -6.723 1.00 0.00 C ATOM 2387 C ASP B 59 -13.254 11.133 -7.881 1.00 0.00 C ATOM 2388 O ASP B 59 -14.027 11.950 -8.351 1.00 0.00 O ATOM 2389 CB ASP B 59 -15.002 10.735 -6.031 1.00 0.00 C ATOM 2390 CG ASP B 59 -16.192 10.894 -6.971 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -16.435 10.002 -7.812 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -16.890 11.929 -6.893 1.00 0.00 O ATOM 0 H ASP B 59 -12.849 10.584 -4.878 1.00 0.00 H new ATOM 0 HA ASP B 59 -13.970 9.256 -7.141 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -15.271 10.040 -5.236 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -14.795 11.695 -5.558 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.955 11.139 -8.240 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.248 12.033 -9.159 1.00 0.00 C ATOM 2399 C LEU B 60 -11.998 12.223 -10.481 1.00 0.00 C ATOM 2400 O LEU B 60 -11.792 13.210 -11.184 1.00 0.00 O ATOM 2401 CB LEU B 60 -9.818 11.507 -9.351 1.00 0.00 C ATOM 2402 CG LEU B 60 -8.877 12.438 -10.136 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -8.812 13.850 -9.538 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -7.469 11.833 -10.121 1.00 0.00 C ATOM 0 H LEU B 60 -11.317 10.445 -7.850 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.198 13.032 -8.725 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -9.382 11.320 -8.370 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -9.867 10.548 -9.866 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.267 12.527 -11.150 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -8.134 14.465 -10.130 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -9.807 14.295 -9.547 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -8.448 13.794 -8.512 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -6.789 12.481 -10.674 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -7.124 11.739 -9.091 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -7.491 10.848 -10.588 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.904 11.290 -10.783 1.00 0.00 N ATOM 2417 CA ASP B 61 -13.980 11.399 -11.762 1.00 0.00 C ATOM 2418 C ASP B 61 -14.549 12.833 -11.764 1.00 0.00 C ATOM 2419 O ASP B 61 -14.875 13.406 -12.806 1.00 0.00 O ATOM 2420 CB ASP B 61 -15.057 10.423 -11.259 1.00 0.00 C ATOM 2421 CG ASP B 61 -16.222 10.214 -12.212 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -17.179 11.016 -12.133 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.210 9.188 -12.923 1.00 0.00 O ATOM 0 H ASP B 61 -12.903 10.382 -10.319 1.00 0.00 H new ATOM 0 HA ASP B 61 -13.643 11.175 -12.774 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -14.590 9.458 -11.062 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -15.445 10.790 -10.309 1.00 0.00 H new ATOM 2428 N ARG B 62 -14.623 13.430 -10.565 1.00 0.00 N ATOM 2429 CA ARG B 62 -15.173 14.751 -10.287 1.00 0.00 C ATOM 2430 C ARG B 62 -14.400 15.890 -10.960 1.00 0.00 C ATOM 2431 O ARG B 62 -14.899 17.012 -10.993 1.00 0.00 O ATOM 2432 CB ARG B 62 -15.306 14.947 -8.767 1.00 0.00 C ATOM 2433 CG ARG B 62 -16.564 15.711 -8.330 1.00 0.00 C ATOM 2434 CD ARG B 62 -17.889 15.063 -8.773 1.00 0.00 C ATOM 2435 NE ARG B 62 -17.839 13.586 -8.732 1.00 0.00 N ATOM 2436 CZ ARG B 62 -17.929 12.741 -9.774 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -18.129 13.172 -11.021 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -17.800 11.430 -9.610 1.00 0.00 N ATOM 0 H ARG B 62 -14.279 12.972 -9.721 1.00 0.00 H new ATOM 0 HA ARG B 62 -16.166 14.795 -10.734 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -15.305 13.969 -8.286 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -14.428 15.481 -8.404 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -16.562 15.798 -7.244 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -16.517 16.723 -8.731 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -18.695 15.414 -8.128 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -18.127 15.387 -9.786 1.00 0.00 H new ATOM 0 HE ARG B 62 -17.724 13.161 -7.812 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -18.219 14.171 -11.207 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -18.192 12.503 -11.788 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -17.629 11.047 -8.680 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -17.872 10.806 -10.414 1.00 0.00 H new ATOM 2452 N ASN B 63 -13.218 15.611 -11.520 1.00 0.00 N ATOM 2453 CA ASN B 63 -12.495 16.529 -12.398 1.00 0.00 C ATOM 2454 C ASN B 63 -13.437 17.015 -13.508 1.00 0.00 C ATOM 2455 O ASN B 63 -13.435 18.193 -13.855 1.00 0.00 O ATOM 2456 CB ASN B 63 -11.258 15.812 -12.957 1.00 0.00 C ATOM 2457 CG ASN B 63 -10.314 16.727 -13.736 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -10.463 17.943 -13.752 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -9.293 16.149 -14.365 1.00 0.00 N ATOM 0 H ASN B 63 -12.732 14.727 -11.372 1.00 0.00 H new ATOM 0 HA ASN B 63 -12.154 17.407 -11.849 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -10.710 15.357 -12.132 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -11.583 15.001 -13.609 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -8.617 16.720 -14.872 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -9.187 15.135 -14.340 1.00 0.00 H new ATOM 2466 N LYS B 64 -14.299 16.112 -13.996 1.00 0.00 N ATOM 2467 CA LYS B 64 -15.435 16.352 -14.878 1.00 0.00 C ATOM 2468 C LYS B 64 -15.163 16.965 -16.264 1.00 0.00 C ATOM 2469 O LYS B 64 -15.616 16.404 -17.263 1.00 0.00 O ATOM 2470 CB LYS B 64 -16.607 17.042 -14.148 1.00 0.00 C ATOM 2471 CG LYS B 64 -16.364 18.496 -13.708 1.00 0.00 C ATOM 2472 CD LYS B 64 -17.692 19.212 -13.438 1.00 0.00 C ATOM 2473 CE LYS B 64 -17.499 20.662 -12.969 1.00 0.00 C ATOM 2474 NZ LYS B 64 -16.750 21.491 -13.938 1.00 0.00 N ATOM 0 H LYS B 64 -14.208 15.123 -13.763 1.00 0.00 H new ATOM 0 HA LYS B 64 -15.728 15.336 -15.143 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -17.479 17.022 -14.802 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -16.857 16.453 -13.266 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -15.748 18.510 -12.809 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -15.810 19.027 -14.482 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -18.295 19.205 -14.346 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -18.250 18.661 -12.681 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -18.475 21.113 -12.792 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -16.971 20.662 -12.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -16.909 22.497 -13.729 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -15.735 21.278 -13.865 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -17.079 21.281 -14.902 1.00 0.00 H new ATOM 2488 N ASP B 65 -14.469 18.101 -16.377 1.00 0.00 N ATOM 2489 CA ASP B 65 -14.403 18.898 -17.604 1.00 0.00 C ATOM 2490 C ASP B 65 -13.443 18.324 -18.658 1.00 0.00 C ATOM 2491 O ASP B 65 -12.828 19.066 -19.420 1.00 0.00 O ATOM 2492 CB ASP B 65 -14.057 20.354 -17.256 1.00 0.00 C ATOM 2493 CG ASP B 65 -14.981 20.938 -16.200 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -16.215 20.979 -16.411 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -14.490 21.280 -15.102 1.00 0.00 O ATOM 0 H ASP B 65 -13.930 18.498 -15.608 1.00 0.00 H new ATOM 0 HA ASP B 65 -15.389 18.861 -18.068 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -13.028 20.404 -16.901 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -14.112 20.962 -18.159 1.00 0.00 H new ATOM 2500 N GLN B 66 -13.318 16.998 -18.709 1.00 0.00 N ATOM 2501 CA GLN B 66 -12.437 16.237 -19.573 1.00 0.00 C ATOM 2502 C GLN B 66 -12.773 14.757 -19.353 1.00 0.00 C ATOM 2503 O GLN B 66 -13.726 14.458 -18.627 1.00 0.00 O ATOM 2504 CB GLN B 66 -10.966 16.566 -19.233 1.00 0.00 C ATOM 2505 CG GLN B 66 -10.654 16.758 -17.736 1.00 0.00 C ATOM 2506 CD GLN B 66 -11.224 15.662 -16.843 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -12.143 15.899 -16.067 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -10.712 14.444 -16.951 1.00 0.00 N ATOM 0 H GLN B 66 -13.871 16.392 -18.103 1.00 0.00 H new ATOM 0 HA GLN B 66 -12.574 16.486 -20.625 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -10.335 15.764 -19.617 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.684 17.475 -19.764 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -9.573 16.797 -17.602 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -11.051 17.720 -17.412 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -9.948 14.268 -17.603 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -11.083 13.683 -16.382 1.00 0.00 H new ATOM 2517 N GLU B 67 -11.994 13.863 -19.964 1.00 0.00 N ATOM 2518 CA GLU B 67 -11.967 12.443 -19.651 1.00 0.00 C ATOM 2519 C GLU B 67 -10.605 12.198 -18.995 1.00 0.00 C ATOM 2520 O GLU B 67 -9.708 13.037 -19.114 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.181 11.587 -20.907 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.440 11.985 -21.695 1.00 0.00 C ATOM 2523 CD GLU B 67 -14.684 12.150 -20.828 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -14.965 11.254 -20.002 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -15.339 13.204 -20.978 1.00 0.00 O ATOM 0 H GLU B 67 -11.348 14.119 -20.711 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.777 12.156 -18.981 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.309 11.677 -21.555 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.256 10.539 -20.618 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.248 12.921 -22.220 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.636 11.228 -22.455 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.459 11.110 -18.246 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.310 10.879 -17.382 1.00 0.00 C ATOM 2534 C VAL B 68 -8.299 9.990 -18.113 1.00 0.00 C ATOM 2535 O VAL B 68 -8.685 9.172 -18.945 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.820 10.248 -16.075 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.720 10.115 -15.027 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -10.949 11.089 -15.453 1.00 0.00 C ATOM 0 H VAL B 68 -11.145 10.355 -18.223 1.00 0.00 H new ATOM 0 HA VAL B 68 -8.796 11.808 -17.135 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.184 9.258 -16.350 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.131 9.664 -14.123 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.921 9.484 -15.416 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.321 11.102 -14.791 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.288 10.617 -14.531 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -10.578 12.090 -15.233 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -11.781 11.156 -16.154 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.005 10.142 -17.832 1.00 0.00 N ATOM 2549 CA ASN B 69 -5.933 9.327 -18.390 1.00 0.00 C ATOM 2550 C ASN B 69 -5.377 8.367 -17.324 1.00 0.00 C ATOM 2551 O ASN B 69 -5.692 8.476 -16.137 1.00 0.00 O ATOM 2552 CB ASN B 69 -4.895 10.263 -19.035 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.477 9.723 -18.984 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.117 8.846 -19.765 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -2.682 10.193 -18.031 1.00 0.00 N ATOM 0 H ASN B 69 -6.666 10.858 -17.190 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.295 8.672 -19.182 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.172 10.437 -20.075 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -4.926 11.229 -18.531 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -1.736 9.825 -17.929 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -3.017 10.922 -17.401 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.590 7.373 -17.767 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.046 6.316 -16.920 1.00 0.00 C ATOM 2564 C PHE B 70 -3.407 6.908 -15.672 1.00 0.00 C ATOM 2565 O PHE B 70 -3.635 6.417 -14.575 1.00 0.00 O ATOM 2566 CB PHE B 70 -2.985 5.500 -17.671 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.603 4.180 -17.005 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -1.892 4.158 -15.790 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -2.796 2.958 -17.681 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.560 2.927 -15.192 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -2.748 1.754 -16.949 1.00 0.00 C ATOM 2572 CZ PHE B 70 -2.147 1.746 -15.678 1.00 0.00 C ATOM 0 H PHE B 70 -4.313 7.286 -18.745 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.874 5.664 -16.640 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.352 5.291 -18.676 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.088 6.109 -17.779 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -1.601 5.084 -15.317 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -2.978 2.944 -18.745 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -0.862 2.891 -14.369 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -3.168 0.848 -17.360 1.00 0.00 H new ATOM 0 HZ PHE B 70 -2.137 0.845 -15.083 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.561 7.925 -15.848 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.794 8.508 -14.763 1.00 0.00 C ATOM 2584 C GLN B 71 -2.727 8.875 -13.609 1.00 0.00 C ATOM 2585 O GLN B 71 -2.546 8.390 -12.496 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.932 9.658 -15.303 1.00 0.00 C ATOM 2587 CG GLN B 71 -0.090 10.382 -14.249 1.00 0.00 C ATOM 2588 CD GLN B 71 -0.885 11.305 -13.326 1.00 0.00 C ATOM 2589 OE1 GLN B 71 -0.608 11.372 -12.133 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -1.884 12.020 -13.833 1.00 0.00 N ATOM 0 H GLN B 71 -2.393 8.364 -16.753 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.089 7.791 -14.342 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.266 9.264 -16.071 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.584 10.385 -15.788 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.426 9.639 -13.641 1.00 0.00 H new ATOM 0 HG3 GLN B 71 0.677 10.968 -14.755 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -2.104 11.955 -14.827 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -2.430 12.633 -13.228 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.745 9.691 -13.873 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.691 10.125 -12.859 1.00 0.00 C ATOM 2601 C GLU B 72 -5.337 8.915 -12.175 1.00 0.00 C ATOM 2602 O GLU B 72 -5.357 8.829 -10.946 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.761 11.010 -13.498 1.00 0.00 C ATOM 2604 CG GLU B 72 -5.215 12.258 -14.201 1.00 0.00 C ATOM 2605 CD GLU B 72 -4.832 11.960 -15.641 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.673 11.529 -15.868 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -5.742 12.088 -16.484 1.00 0.00 O ATOM 0 H GLU B 72 -3.934 10.069 -14.801 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.159 10.701 -12.102 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.321 10.417 -14.221 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.465 11.321 -12.727 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.966 13.048 -14.179 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -4.344 12.630 -13.661 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.850 7.980 -12.983 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.413 6.719 -12.509 1.00 0.00 C ATOM 2616 C TYR B 73 -5.459 6.051 -11.524 1.00 0.00 C ATOM 2617 O TYR B 73 -5.763 5.926 -10.338 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.757 5.828 -13.716 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.667 4.315 -13.559 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.780 3.592 -13.090 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.586 3.612 -14.132 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.864 2.205 -13.307 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.689 2.238 -14.386 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.851 1.545 -14.021 1.00 0.00 C ATOM 2625 OH TYR B 73 -7.021 0.258 -14.424 1.00 0.00 O ATOM 0 H TYR B 73 -5.884 8.083 -13.997 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.340 6.899 -11.964 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.774 6.068 -14.025 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -6.099 6.115 -14.536 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.571 4.104 -12.562 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.674 4.136 -14.376 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.707 1.648 -12.925 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.874 1.714 -14.862 1.00 0.00 H new ATOM 0 HH TYR B 73 -6.428 0.071 -15.181 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.293 5.622 -12.009 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.399 4.813 -11.210 1.00 0.00 C ATOM 2637 C ILE B 74 -2.938 5.606 -9.983 1.00 0.00 C ATOM 2638 O ILE B 74 -2.736 5.034 -8.916 1.00 0.00 O ATOM 2639 CB ILE B 74 -2.245 4.226 -12.042 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.566 3.039 -11.334 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -1.183 5.273 -12.393 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.450 1.788 -11.275 1.00 0.00 C ATOM 0 H ILE B 74 -3.955 5.825 -12.950 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.941 3.941 -10.844 1.00 0.00 H new ATOM 0 HB ILE B 74 -2.705 3.874 -12.965 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.638 2.797 -11.853 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -1.297 3.334 -10.320 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -0.392 4.806 -12.980 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.640 6.075 -12.973 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.760 5.684 -11.476 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.914 0.988 -10.764 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -3.367 2.016 -10.731 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.698 1.470 -12.288 1.00 0.00 H new ATOM 2654 N THR B 75 -2.798 6.929 -10.119 1.00 0.00 N ATOM 2655 CA THR B 75 -2.477 7.801 -9.003 1.00 0.00 C ATOM 2656 C THR B 75 -3.571 7.759 -7.941 1.00 0.00 C ATOM 2657 O THR B 75 -3.242 7.607 -6.768 1.00 0.00 O ATOM 2658 CB THR B 75 -2.150 9.219 -9.485 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.060 9.140 -10.379 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.727 10.127 -8.329 1.00 0.00 C ATOM 0 H THR B 75 -2.906 7.417 -11.008 1.00 0.00 H new ATOM 0 HA THR B 75 -1.573 7.430 -8.521 1.00 0.00 H new ATOM 0 HB THR B 75 -3.043 9.633 -9.952 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.385 8.897 -11.271 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.504 11.123 -8.712 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.536 10.191 -7.601 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.839 9.715 -7.849 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.855 7.854 -8.305 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.907 7.746 -7.297 1.00 0.00 C ATOM 2670 C PHE B 76 -5.924 6.342 -6.684 1.00 0.00 C ATOM 2671 O PHE B 76 -5.954 6.203 -5.460 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.244 8.321 -7.780 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.231 7.397 -8.457 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.919 6.467 -7.658 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.771 7.778 -9.696 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.165 5.962 -8.071 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.064 7.361 -10.057 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.780 6.486 -9.222 1.00 0.00 C ATOM 0 H PHE B 76 -5.181 8.001 -9.260 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.680 8.398 -6.454 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.744 8.764 -6.918 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.023 9.133 -8.473 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.489 6.139 -6.723 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.193 8.391 -10.371 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.647 5.177 -7.508 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.508 7.713 -10.977 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.798 6.217 -9.463 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.814 5.289 -7.504 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.592 3.946 -6.986 1.00 0.00 C ATOM 2690 C LEU B 77 -4.399 3.913 -6.020 1.00 0.00 C ATOM 2691 O LEU B 77 -4.453 3.200 -5.027 1.00 0.00 O ATOM 2692 CB LEU B 77 -5.393 2.929 -8.118 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.710 2.460 -8.756 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -7.305 3.437 -9.768 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -6.482 1.116 -9.458 1.00 0.00 C ATOM 0 H LEU B 77 -5.875 5.347 -8.521 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.489 3.663 -6.434 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.763 3.373 -8.888 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.858 2.063 -7.728 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.425 2.381 -7.937 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.232 3.027 -10.168 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.511 4.388 -9.277 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -6.597 3.594 -10.582 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.414 0.780 -9.912 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -5.723 1.234 -10.232 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -6.146 0.378 -8.730 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.331 4.663 -6.291 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.148 4.751 -5.444 1.00 0.00 C ATOM 2709 C GLY B 78 -2.415 5.483 -4.126 1.00 0.00 C ATOM 2710 O GLY B 78 -1.992 5.040 -3.057 1.00 0.00 O ATOM 0 H GLY B 78 -3.266 5.241 -7.129 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.785 3.746 -5.229 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.356 5.267 -5.987 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.113 6.616 -4.199 1.00 0.00 N ATOM 2715 CA ALA B 79 -3.545 7.368 -3.032 1.00 0.00 C ATOM 2716 C ALA B 79 -4.354 6.452 -2.112 1.00 0.00 C ATOM 2717 O ALA B 79 -4.057 6.346 -0.921 1.00 0.00 O ATOM 2718 CB ALA B 79 -4.327 8.605 -3.478 1.00 0.00 C ATOM 0 H ALA B 79 -3.395 7.039 -5.083 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.686 7.723 -2.462 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -4.650 9.167 -2.602 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -3.689 9.235 -4.098 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -5.200 8.296 -4.053 1.00 0.00 H new ATOM 2724 N LEU B 80 -5.321 5.729 -2.683 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.036 4.691 -1.957 1.00 0.00 C ATOM 2726 C LEU B 80 -5.064 3.615 -1.461 1.00 0.00 C ATOM 2727 O LEU B 80 -5.119 3.252 -0.290 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.147 4.090 -2.829 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.270 5.089 -3.162 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -9.178 4.491 -4.241 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.120 5.439 -1.933 1.00 0.00 C ATOM 0 H LEU B 80 -5.623 5.849 -3.650 1.00 0.00 H new ATOM 0 HA LEU B 80 -6.509 5.138 -1.082 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -6.711 3.722 -3.758 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.576 3.230 -2.316 1.00 0.00 H new ATOM 0 HG LEU B 80 -7.798 6.006 -3.515 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -9.974 5.197 -4.479 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -8.593 4.289 -5.138 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -9.614 3.561 -3.875 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -9.898 6.147 -2.219 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.580 4.533 -1.539 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.486 5.887 -1.168 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.179 3.111 -2.332 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.240 2.026 -2.055 1.00 0.00 C ATOM 2745 C ALA B 81 -2.535 2.219 -0.726 1.00 0.00 C ATOM 2746 O ALA B 81 -2.625 1.346 0.137 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.203 1.852 -3.167 1.00 0.00 C ATOM 0 H ALA B 81 -4.098 3.465 -3.285 1.00 0.00 H new ATOM 0 HA ALA B 81 -3.841 1.118 -2.007 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -1.530 1.033 -2.912 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.710 1.626 -4.105 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -1.630 2.772 -3.277 1.00 0.00 H new ATOM 2753 N MET B 82 -1.852 3.361 -0.575 1.00 0.00 N ATOM 2754 CA MET B 82 -1.156 3.706 0.658 1.00 0.00 C ATOM 2755 C MET B 82 -2.020 3.365 1.873 1.00 0.00 C ATOM 2756 O MET B 82 -1.546 2.736 2.819 1.00 0.00 O ATOM 2757 CB MET B 82 -0.806 5.200 0.677 1.00 0.00 C ATOM 2758 CG MET B 82 0.362 5.565 -0.247 1.00 0.00 C ATOM 2759 SD MET B 82 0.956 7.268 -0.051 1.00 0.00 S ATOM 2760 CE MET B 82 -0.403 8.200 -0.783 1.00 0.00 C ATOM 0 H MET B 82 -1.770 4.067 -1.307 1.00 0.00 H new ATOM 0 HA MET B 82 -0.235 3.125 0.702 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.684 5.775 0.384 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.558 5.494 1.697 1.00 0.00 H new ATOM 0 HG2 MET B 82 1.188 4.879 -0.059 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.053 5.416 -1.282 1.00 0.00 H new ATOM 0 HE1 MET B 82 -0.214 9.268 -0.671 1.00 0.00 H new ATOM 0 HE2 MET B 82 -0.484 7.955 -1.842 1.00 0.00 H new ATOM 0 HE3 MET B 82 -1.334 7.942 -0.279 1.00 0.00 H new ATOM 2770 N ILE B 83 -3.290 3.772 1.820 1.00 0.00 N ATOM 2771 CA ILE B 83 -4.242 3.598 2.895 1.00 0.00 C ATOM 2772 C ILE B 83 -4.749 2.153 2.926 1.00 0.00 C ATOM 2773 O ILE B 83 -4.371 1.387 3.813 1.00 0.00 O ATOM 2774 CB ILE B 83 -5.378 4.637 2.767 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -4.796 6.064 2.761 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -6.364 4.447 3.926 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -5.859 7.151 2.567 1.00 0.00 C ATOM 0 H ILE B 83 -3.684 4.242 1.005 1.00 0.00 H new ATOM 0 HA ILE B 83 -3.756 3.777 3.854 1.00 0.00 H new ATOM 0 HB ILE B 83 -5.908 4.491 1.826 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -4.274 6.240 3.701 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -4.055 6.144 1.965 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -7.169 5.177 3.842 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -6.781 3.441 3.887 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -5.843 4.588 4.873 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -5.382 8.131 2.573 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -6.365 6.999 1.614 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -6.587 7.097 3.377 1.00 0.00 H new ATOM 2789 N TYR B 84 -5.614 1.775 1.977 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.360 0.524 2.054 1.00 0.00 C ATOM 2791 C TYR B 84 -5.469 -0.717 2.000 1.00 0.00 C ATOM 2792 O TYR B 84 -5.866 -1.755 2.522 1.00 0.00 O ATOM 2793 CB TYR B 84 -7.561 0.482 1.080 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.378 -0.200 -0.272 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -6.251 0.083 -1.060 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -8.378 -1.057 -0.783 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -6.076 -0.553 -2.302 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.217 -1.663 -2.043 1.00 0.00 C ATOM 2799 CZ TYR B 84 -7.040 -1.455 -2.775 1.00 0.00 C ATOM 2800 OH TYR B 84 -6.821 -2.115 -3.944 1.00 0.00 O ATOM 0 H TYR B 84 -5.812 2.327 1.142 1.00 0.00 H new ATOM 0 HA TYR B 84 -6.801 0.498 3.050 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -8.386 -0.013 1.592 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -7.873 1.510 0.893 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -5.515 0.792 -0.711 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -9.270 -1.248 -0.204 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -5.196 -0.346 -2.893 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -9.000 -2.288 -2.446 1.00 0.00 H new ATOM 0 HH TYR B 84 -7.581 -2.704 -4.134 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.279 -0.640 1.390 1.00 0.00 N ATOM 2811 CA ASN B 85 -3.418 -1.811 1.307 1.00 0.00 C ATOM 2812 C ASN B 85 -2.887 -2.186 2.681 1.00 0.00 C ATOM 2813 O ASN B 85 -3.019 -3.326 3.120 1.00 0.00 O ATOM 2814 CB ASN B 85 -2.278 -1.609 0.304 1.00 0.00 C ATOM 2815 CG ASN B 85 -1.532 -2.916 0.059 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -1.723 -3.560 -0.965 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -0.668 -3.324 0.985 1.00 0.00 N ATOM 0 H ASN B 85 -3.903 0.204 0.958 1.00 0.00 H new ATOM 0 HA ASN B 85 -4.022 -2.640 0.939 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -2.679 -1.232 -0.637 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -1.586 -0.856 0.680 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -0.147 -4.191 0.850 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -0.526 -2.770 1.830 1.00 0.00 H new ATOM 2824 N GLU B 86 -2.235 -1.226 3.334 1.00 0.00 N ATOM 2825 CA GLU B 86 -1.572 -1.470 4.611 1.00 0.00 C ATOM 2826 C GLU B 86 -1.335 -0.237 5.478 1.00 0.00 C ATOM 2827 O GLU B 86 -0.548 -0.326 6.418 1.00 0.00 O ATOM 2828 CB GLU B 86 -0.279 -2.281 4.390 1.00 0.00 C ATOM 2829 CG GLU B 86 0.790 -1.516 3.588 1.00 0.00 C ATOM 2830 CD GLU B 86 2.070 -2.317 3.363 1.00 0.00 C ATOM 2831 OE1 GLU B 86 2.041 -3.535 3.651 1.00 0.00 O ATOM 2832 OE2 GLU B 86 3.087 -1.693 2.990 1.00 0.00 O ATOM 0 H GLU B 86 -2.152 -0.267 2.996 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.277 -2.057 5.199 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.135 -2.562 5.358 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -0.523 -3.206 3.867 1.00 0.00 H new ATOM 0 HG2 GLU B 86 0.374 -1.232 2.622 1.00 0.00 H new ATOM 0 HG3 GLU B 86 1.036 -0.593 4.113 1.00 0.00 H new