USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=31 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 69 ASN : amide:sc= 0.334 K(o=0.33,f=-6.7!) USER MOD Set 1.2: B 82 MET CE :methyl 173:sc= 0 (180deg=-0.0656) USER MOD Set 2.1: A 71 GLN : amide:sc= 0.4 K(o=4.2,f=3.4) USER MOD Set 2.2: A 75 THR OG1 : rot 172:sc= 1.08 USER MOD Set 2.3: B 71 GLN : amide:sc= 0.787 K(o=4.2,f=2.8) USER MOD Set 2.4: B 75 THR OG1 : rot 63:sc= 1.93 USER MOD Set 3.1: B 19 TYR OH : rot 180:sc= 0.485 USER MOD Set 3.2: B 40 LYS NZ :NH3+ 155:sc= 0.452 (180deg=-0.526) USER MOD Set 4.1: B 20 SER OG : rot -50:sc= 1.19 USER MOD Set 4.2: B 30 SER OG : rot 19:sc= 2.03 USER MOD Set 4.3: B 32 LYS NZ :NH3+ -173:sc= 1.38! (180deg=-0.722!) USER MOD Set 5.1: A 43 THR OG1 : rot -36:sc= 1.69 USER MOD Set 5.2: A 84 TYR OH : rot 120:sc= 1.23 USER MOD Set 6.1: A 26 LYS NZ :NH3+ -170:sc= 2.95 (180deg=1.46) USER MOD Set 6.2: A 28 THR OG1 : rot 180:sc= 0.696 USER MOD Set 6.3: A 30 SER OG : rot -48:sc= 2.25 USER MOD Single : A 17 HIS : no HD1:sc= -1.89 K(o=-1.9,f=-2.8!) USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= 1.29 (180deg=1.23) USER MOD Single : A 19 TYR OH : rot -28:sc= 1.26 USER MOD Single : A 20 SER OG : rot -85:sc= 0.384 USER MOD Single : A 27 HIS : no HD1:sc= -0.044 X(o=-0.044,f=0) USER MOD Single : A 31 LYS NZ :NH3+ -176:sc= 3.31 (180deg=3.18) USER MOD Single : A 32 LYS NZ :NH3+ -161:sc= 1.14 (180deg=0.911) USER MOD Single : A 35 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.21) USER MOD Single : A 39 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.27) USER MOD Single : A 40 LYS NZ :NH3+ 168:sc= 1.02 (180deg=-0.151) USER MOD Single : A 57 MET CE :methyl -170:sc= -0.0139 (180deg=-0.164) USER MOD Single : A 63 ASN : amide:sc= 1.89 K(o=1.9,f=-7.4!) USER MOD Single : A 64 LYS NZ :NH3+ -171:sc= 2.99 (180deg=2.96) USER MOD Single : A 66 GLN : amide:sc= 1.02 K(o=1,f=-0.87) USER MOD Single : A 73 TYR OH : rot -34:sc= 1.02 USER MOD Single : A 82 MET CE :methyl -152:sc= 0 (180deg=-0.224) USER MOD Single : A 85 ASN : amide:sc= -0.742 K(o=-0.74,f=-0.12) USER MOD Single : B 17 HIS : no HD1:sc= -0.219 K(o=-0.22,f=-5.8!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= -0.455 K(o=-0.46,f=-1.1) USER MOD Single : B 28 THR OG1 : rot 180:sc= 0.0837 USER MOD Single : B 31 LYS NZ :NH3+ 155:sc= 2.04 (180deg=-0.457!) USER MOD Single : B 35 LYS NZ :NH3+ -168:sc= 0.65 (180deg=0.468) USER MOD Single : B 39 GLN : amide:sc= 1.19 K(o=1.2,f=0) USER MOD Single : B 43 THR OG1 : rot 71:sc= 1.11 USER MOD Single : B 63 ASN : amide:sc= 0.814 K(o=0.81,f=-0.3) USER MOD Single : B 64 LYS NZ :NH3+ 158:sc= 0.941 (180deg=-1.63!) USER MOD Single : B 66 GLN : amide:sc= 1.04 K(o=1,f=-0.089) USER MOD Single : B 69 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.27) USER MOD Single : B 73 TYR OH : rot 3:sc= 1.29 USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.561 X(o=-0.56,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 0.778 -5.918 -5.680 1.00 0.00 N ATOM 114 CA ILE A 9 0.692 -4.551 -5.167 1.00 0.00 C ATOM 115 C ILE A 9 1.528 -4.449 -3.883 1.00 0.00 C ATOM 116 O ILE A 9 2.332 -3.530 -3.740 1.00 0.00 O ATOM 117 CB ILE A 9 -0.776 -4.124 -4.964 1.00 0.00 C ATOM 118 CG1 ILE A 9 -1.613 -4.197 -6.256 1.00 0.00 C ATOM 119 CG2 ILE A 9 -0.861 -2.716 -4.361 1.00 0.00 C ATOM 120 CD1 ILE A 9 -1.136 -3.280 -7.388 1.00 0.00 C ATOM 0 HA ILE A 9 1.104 -3.853 -5.896 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.204 -4.843 -4.265 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -1.610 -5.226 -6.616 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.646 -3.947 -6.016 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -1.907 -2.440 -4.228 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -0.357 -2.703 -3.395 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.380 -2.004 -5.031 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -1.787 -3.402 -8.254 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -1.167 -2.243 -7.054 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.114 -3.542 -7.663 1.00 0.00 H new ATOM 132 N GLY A 10 1.383 -5.427 -2.985 1.00 0.00 N ATOM 133 CA GLY A 10 2.223 -5.608 -1.812 1.00 0.00 C ATOM 134 C GLY A 10 3.714 -5.531 -2.152 1.00 0.00 C ATOM 135 O GLY A 10 4.443 -4.763 -1.529 1.00 0.00 O ATOM 0 H GLY A 10 0.652 -6.134 -3.063 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.981 -4.845 -1.072 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.005 -6.574 -1.357 1.00 0.00 H new ATOM 139 N LEU A 11 4.184 -6.306 -3.136 1.00 0.00 N ATOM 140 CA LEU A 11 5.577 -6.267 -3.568 1.00 0.00 C ATOM 141 C LEU A 11 5.974 -4.839 -3.935 1.00 0.00 C ATOM 142 O LEU A 11 6.947 -4.323 -3.392 1.00 0.00 O ATOM 143 CB LEU A 11 5.864 -7.215 -4.745 1.00 0.00 C ATOM 144 CG LEU A 11 5.641 -8.711 -4.466 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.992 -9.494 -5.737 1.00 0.00 C ATOM 146 CD2 LEU A 11 6.497 -9.223 -3.302 1.00 0.00 C ATOM 0 H LEU A 11 3.609 -6.973 -3.650 1.00 0.00 H new ATOM 0 HA LEU A 11 6.179 -6.613 -2.728 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.234 -6.923 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.898 -7.073 -5.058 1.00 0.00 H new ATOM 0 HG LEU A 11 4.598 -8.854 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.841 -10.559 -5.562 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.350 -9.166 -6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.035 -9.314 -5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.302 -10.284 -3.146 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.552 -9.078 -3.535 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.247 -8.671 -2.396 1.00 0.00 H new ATOM 158 N LEU A 12 5.221 -4.183 -4.825 1.00 0.00 N ATOM 159 CA LEU A 12 5.509 -2.800 -5.210 1.00 0.00 C ATOM 160 C LEU A 12 5.582 -1.892 -3.977 1.00 0.00 C ATOM 161 O LEU A 12 6.508 -1.085 -3.849 1.00 0.00 O ATOM 162 CB LEU A 12 4.464 -2.286 -6.217 1.00 0.00 C ATOM 163 CG LEU A 12 4.809 -2.532 -7.696 1.00 0.00 C ATOM 164 CD1 LEU A 12 5.976 -1.653 -8.168 1.00 0.00 C ATOM 165 CD2 LEU A 12 5.094 -4.006 -8.006 1.00 0.00 C ATOM 0 H LEU A 12 4.409 -4.588 -5.291 1.00 0.00 H new ATOM 0 HA LEU A 12 6.484 -2.778 -5.697 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.507 -2.761 -5.999 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.330 -1.215 -6.064 1.00 0.00 H new ATOM 0 HG LEU A 12 3.917 -2.249 -8.254 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.186 -1.859 -9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.711 -0.602 -8.051 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.861 -1.872 -7.571 1.00 0.00 H new ATOM 0 HD21 LEU A 12 5.331 -4.116 -9.064 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.939 -4.347 -7.408 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.215 -4.605 -7.767 1.00 0.00 H new ATOM 177 N ILE A 13 4.607 -2.020 -3.075 1.00 0.00 N ATOM 178 CA ILE A 13 4.545 -1.291 -1.814 1.00 0.00 C ATOM 179 C ILE A 13 5.766 -1.582 -0.940 1.00 0.00 C ATOM 180 O ILE A 13 6.239 -0.681 -0.249 1.00 0.00 O ATOM 181 CB ILE A 13 3.207 -1.579 -1.100 1.00 0.00 C ATOM 182 CG1 ILE A 13 2.107 -0.745 -1.780 1.00 0.00 C ATOM 183 CG2 ILE A 13 3.297 -1.280 0.402 1.00 0.00 C ATOM 184 CD1 ILE A 13 0.689 -1.015 -1.272 1.00 0.00 C ATOM 0 H ILE A 13 3.818 -2.652 -3.209 1.00 0.00 H new ATOM 0 HA ILE A 13 4.577 -0.221 -2.020 1.00 0.00 H new ATOM 0 HB ILE A 13 2.965 -2.638 -1.186 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.333 0.312 -1.639 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.136 -0.937 -2.853 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.338 -1.494 0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.069 -1.904 0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.548 -0.230 0.549 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.017 -0.382 -1.809 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.436 -2.062 -1.438 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.636 -0.794 -0.206 1.00 0.00 H new ATOM 196 N GLY A 14 6.281 -2.811 -0.950 1.00 0.00 N ATOM 197 CA GLY A 14 7.486 -3.185 -0.229 1.00 0.00 C ATOM 198 C GLY A 14 8.709 -2.531 -0.868 1.00 0.00 C ATOM 199 O GLY A 14 9.352 -1.667 -0.267 1.00 0.00 O ATOM 0 H GLY A 14 5.862 -3.583 -1.469 1.00 0.00 H new ATOM 0 HA2 GLY A 14 7.404 -2.878 0.814 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.600 -4.269 -0.235 1.00 0.00 H new ATOM 203 N ILE A 15 8.998 -2.951 -2.103 1.00 0.00 N ATOM 204 CA ILE A 15 10.123 -2.532 -2.935 1.00 0.00 C ATOM 205 C ILE A 15 10.305 -1.015 -2.893 1.00 0.00 C ATOM 206 O ILE A 15 11.432 -0.538 -2.777 1.00 0.00 O ATOM 207 CB ILE A 15 9.899 -3.058 -4.370 1.00 0.00 C ATOM 208 CG1 ILE A 15 10.026 -4.592 -4.460 1.00 0.00 C ATOM 209 CG2 ILE A 15 10.814 -2.386 -5.400 1.00 0.00 C ATOM 210 CD1 ILE A 15 11.458 -5.125 -4.324 1.00 0.00 C ATOM 0 H ILE A 15 8.412 -3.638 -2.577 1.00 0.00 H new ATOM 0 HA ILE A 15 11.049 -2.957 -2.549 1.00 0.00 H new ATOM 0 HB ILE A 15 8.872 -2.789 -4.618 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.410 -5.040 -3.680 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.619 -4.921 -5.416 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.611 -2.796 -6.389 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.627 -1.312 -5.407 1.00 0.00 H new ATOM 0 HG23 ILE A 15 11.855 -2.571 -5.137 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.450 -6.212 -4.400 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.078 -4.710 -5.119 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.865 -4.831 -3.356 1.00 0.00 H new ATOM 222 N PHE A 16 9.189 -0.278 -2.944 1.00 0.00 N ATOM 223 CA PHE A 16 9.110 1.173 -2.857 1.00 0.00 C ATOM 224 C PHE A 16 10.242 1.803 -2.037 1.00 0.00 C ATOM 225 O PHE A 16 11.008 2.596 -2.577 1.00 0.00 O ATOM 226 CB PHE A 16 7.693 1.518 -2.371 1.00 0.00 C ATOM 227 CG PHE A 16 7.356 2.914 -1.883 1.00 0.00 C ATOM 228 CD1 PHE A 16 8.133 4.041 -2.214 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.246 3.065 -1.028 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.944 5.245 -1.515 1.00 0.00 C ATOM 231 CE2 PHE A 16 6.022 4.288 -0.374 1.00 0.00 C ATOM 232 CZ PHE A 16 6.917 5.354 -0.561 1.00 0.00 C ATOM 0 H PHE A 16 8.270 -0.708 -3.053 1.00 0.00 H new ATOM 0 HA PHE A 16 9.270 1.621 -3.838 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.010 1.292 -3.190 1.00 0.00 H new ATOM 0 HB3 PHE A 16 7.457 0.830 -1.560 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.870 3.980 -3.001 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.567 2.239 -0.875 1.00 0.00 H new ATOM 0 HE1 PHE A 16 8.589 6.089 -1.711 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.164 4.408 0.271 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.817 6.255 0.026 1.00 0.00 H new ATOM 242 N HIS A 17 10.343 1.487 -0.744 1.00 0.00 N ATOM 243 CA HIS A 17 11.310 2.138 0.147 1.00 0.00 C ATOM 244 C HIS A 17 12.645 1.404 0.268 1.00 0.00 C ATOM 245 O HIS A 17 13.453 1.784 1.109 1.00 0.00 O ATOM 246 CB HIS A 17 10.692 2.517 1.509 1.00 0.00 C ATOM 247 CG HIS A 17 9.451 1.751 1.860 1.00 0.00 C ATOM 248 ND1 HIS A 17 9.406 0.448 2.310 1.00 0.00 N ATOM 249 CD2 HIS A 17 8.232 2.060 1.333 1.00 0.00 C ATOM 250 CE1 HIS A 17 8.200 -0.041 1.995 1.00 0.00 C ATOM 251 NE2 HIS A 17 7.467 0.919 1.409 1.00 0.00 N ATOM 0 H HIS A 17 9.765 0.781 -0.288 1.00 0.00 H new ATOM 0 HA HIS A 17 11.567 3.077 -0.344 1.00 0.00 H new ATOM 0 HB2 HIS A 17 11.436 2.357 2.289 1.00 0.00 H new ATOM 0 HB3 HIS A 17 10.458 3.582 1.505 1.00 0.00 H new ATOM 0 HD2 HIS A 17 7.926 3.016 0.933 1.00 0.00 H new ATOM 0 HE1 HIS A 17 7.868 -1.051 2.183 1.00 0.00 H new ATOM 0 HE2 HIS A 17 6.508 0.820 1.077 1.00 0.00 H new ATOM 259 N LYS A 18 12.921 0.376 -0.542 1.00 0.00 N ATOM 260 CA LYS A 18 14.247 -0.235 -0.513 1.00 0.00 C ATOM 261 C LYS A 18 15.288 0.789 -0.949 1.00 0.00 C ATOM 262 O LYS A 18 16.371 0.868 -0.367 1.00 0.00 O ATOM 263 CB LYS A 18 14.319 -1.476 -1.414 1.00 0.00 C ATOM 264 CG LYS A 18 15.745 -2.061 -1.512 1.00 0.00 C ATOM 265 CD LYS A 18 16.308 -2.620 -0.186 1.00 0.00 C ATOM 266 CE LYS A 18 17.796 -2.281 0.038 1.00 0.00 C ATOM 267 NZ LYS A 18 18.005 -0.981 0.717 1.00 0.00 N ATOM 0 H LYS A 18 12.265 -0.037 -1.205 1.00 0.00 H new ATOM 0 HA LYS A 18 14.451 -0.558 0.508 1.00 0.00 H new ATOM 0 HB2 LYS A 18 13.643 -2.239 -1.028 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.968 -1.215 -2.413 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.745 -2.858 -2.255 1.00 0.00 H new ATOM 0 HG3 LYS A 18 16.417 -1.284 -1.877 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.724 -2.224 0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.184 -3.703 -0.175 1.00 0.00 H new ATOM 0 HE2 LYS A 18 18.256 -3.071 0.631 1.00 0.00 H new ATOM 0 HE3 LYS A 18 18.307 -2.267 -0.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 19.024 -0.788 0.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.549 -0.225 0.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 17.588 -1.016 1.669 1.00 0.00 H new ATOM 281 N TYR A 19 14.978 1.514 -2.021 1.00 0.00 N ATOM 282 CA TYR A 19 15.873 2.475 -2.634 1.00 0.00 C ATOM 283 C TYR A 19 16.284 3.503 -1.583 1.00 0.00 C ATOM 284 O TYR A 19 15.413 4.057 -0.921 1.00 0.00 O ATOM 285 CB TYR A 19 15.174 3.082 -3.847 1.00 0.00 C ATOM 286 CG TYR A 19 14.846 2.030 -4.886 1.00 0.00 C ATOM 287 CD1 TYR A 19 15.852 1.590 -5.760 1.00 0.00 C ATOM 288 CD2 TYR A 19 13.596 1.383 -4.887 1.00 0.00 C ATOM 289 CE1 TYR A 19 15.567 0.629 -6.744 1.00 0.00 C ATOM 290 CE2 TYR A 19 13.325 0.390 -5.841 1.00 0.00 C ATOM 291 CZ TYR A 19 14.292 0.036 -6.794 1.00 0.00 C ATOM 292 OH TYR A 19 14.002 -0.927 -7.711 1.00 0.00 O ATOM 0 H TYR A 19 14.077 1.444 -2.493 1.00 0.00 H new ATOM 0 HA TYR A 19 16.791 2.010 -2.994 1.00 0.00 H new ATOM 0 HB2 TYR A 19 14.257 3.578 -3.529 1.00 0.00 H new ATOM 0 HB3 TYR A 19 15.812 3.846 -4.291 1.00 0.00 H new ATOM 0 HD1 TYR A 19 16.851 1.992 -5.676 1.00 0.00 H new ATOM 0 HD2 TYR A 19 12.847 1.650 -4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 19 16.324 0.346 -7.460 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.365 -0.105 -5.842 1.00 0.00 H new ATOM 0 HH TYR A 19 14.559 -0.799 -8.507 1.00 0.00 H new ATOM 302 N SER A 20 17.595 3.681 -1.383 1.00 0.00 N ATOM 303 CA SER A 20 18.244 4.412 -0.287 1.00 0.00 C ATOM 304 C SER A 20 19.650 3.876 0.013 1.00 0.00 C ATOM 305 O SER A 20 20.369 4.458 0.826 1.00 0.00 O ATOM 306 CB SER A 20 17.467 4.221 1.028 1.00 0.00 C ATOM 307 OG SER A 20 17.319 2.832 1.256 1.00 0.00 O ATOM 0 H SER A 20 18.280 3.290 -2.029 1.00 0.00 H new ATOM 0 HA SER A 20 18.276 5.452 -0.612 1.00 0.00 H new ATOM 0 HB2 SER A 20 18.001 4.687 1.856 1.00 0.00 H new ATOM 0 HB3 SER A 20 16.491 4.702 0.966 1.00 0.00 H new ATOM 0 HG SER A 20 16.536 2.502 0.768 1.00 0.00 H new ATOM 376 N LYS A 26 12.369 3.310 5.732 1.00 0.00 N ATOM 377 CA LYS A 26 11.906 4.690 5.643 1.00 0.00 C ATOM 378 C LYS A 26 10.874 4.818 4.515 1.00 0.00 C ATOM 379 O LYS A 26 11.245 4.782 3.346 1.00 0.00 O ATOM 380 CB LYS A 26 13.133 5.579 5.384 1.00 0.00 C ATOM 381 CG LYS A 26 12.788 7.048 5.107 1.00 0.00 C ATOM 382 CD LYS A 26 14.089 7.840 4.917 1.00 0.00 C ATOM 383 CE LYS A 26 13.815 9.272 4.442 1.00 0.00 C ATOM 384 NZ LYS A 26 13.355 9.319 3.041 1.00 0.00 N ATOM 0 HA LYS A 26 11.420 5.002 6.567 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.795 5.528 6.248 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.686 5.179 4.534 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.166 7.127 4.216 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.213 7.462 5.935 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.639 7.867 5.857 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.723 7.331 4.191 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.062 9.728 5.085 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.723 9.866 4.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.345 10.305 2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.000 8.761 2.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.395 8.923 2.977 1.00 0.00 H new ATOM 398 N HIS A 27 9.587 5.005 4.829 1.00 0.00 N ATOM 399 CA HIS A 27 8.502 4.994 3.838 1.00 0.00 C ATOM 400 C HIS A 27 8.430 6.256 2.959 1.00 0.00 C ATOM 401 O HIS A 27 7.329 6.692 2.628 1.00 0.00 O ATOM 402 CB HIS A 27 7.147 4.736 4.532 1.00 0.00 C ATOM 403 CG HIS A 27 7.111 3.527 5.436 1.00 0.00 C ATOM 404 ND1 HIS A 27 6.434 3.421 6.640 1.00 0.00 N ATOM 405 CD2 HIS A 27 7.853 2.389 5.276 1.00 0.00 C ATOM 406 CE1 HIS A 27 6.808 2.269 7.221 1.00 0.00 C ATOM 407 NE2 HIS A 27 7.657 1.624 6.404 1.00 0.00 N ATOM 0 H HIS A 27 9.266 5.169 5.783 1.00 0.00 H new ATOM 0 HA HIS A 27 8.732 4.177 3.154 1.00 0.00 H new ATOM 0 HB2 HIS A 27 6.883 5.616 5.118 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.380 4.621 3.766 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.473 2.139 4.428 1.00 0.00 H new ATOM 0 HE1 HIS A 27 6.479 1.918 8.188 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.086 0.717 6.589 1.00 0.00 H new ATOM 415 N THR A 28 9.566 6.828 2.547 1.00 0.00 N ATOM 416 CA THR A 28 9.638 7.975 1.647 1.00 0.00 C ATOM 417 C THR A 28 10.975 7.923 0.911 1.00 0.00 C ATOM 418 O THR A 28 11.987 7.641 1.553 1.00 0.00 O ATOM 419 CB THR A 28 9.562 9.303 2.425 1.00 0.00 C ATOM 420 OG1 THR A 28 10.591 9.382 3.400 1.00 0.00 O ATOM 421 CG2 THR A 28 8.212 9.529 3.111 1.00 0.00 C ATOM 0 H THR A 28 10.484 6.494 2.841 1.00 0.00 H new ATOM 0 HA THR A 28 8.797 7.930 0.955 1.00 0.00 H new ATOM 0 HB THR A 28 9.690 10.085 1.677 1.00 0.00 H new ATOM 0 HG1 THR A 28 10.523 10.234 3.879 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.228 10.482 3.640 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.421 9.543 2.361 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.025 8.723 3.821 1.00 0.00 H new ATOM 429 N LEU A 29 11.006 8.241 -0.388 1.00 0.00 N ATOM 430 CA LEU A 29 12.264 8.446 -1.106 1.00 0.00 C ATOM 431 C LEU A 29 12.532 9.952 -1.166 1.00 0.00 C ATOM 432 O LEU A 29 11.951 10.652 -1.991 1.00 0.00 O ATOM 433 CB LEU A 29 12.220 7.817 -2.511 1.00 0.00 C ATOM 434 CG LEU A 29 11.867 6.323 -2.518 1.00 0.00 C ATOM 435 CD1 LEU A 29 11.723 5.846 -3.967 1.00 0.00 C ATOM 436 CD2 LEU A 29 12.950 5.498 -1.820 1.00 0.00 C ATOM 0 H LEU A 29 10.172 8.362 -0.962 1.00 0.00 H new ATOM 0 HA LEU A 29 13.079 7.949 -0.580 1.00 0.00 H new ATOM 0 HB2 LEU A 29 11.490 8.355 -3.115 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.190 7.952 -2.989 1.00 0.00 H new ATOM 0 HG LEU A 29 10.929 6.187 -1.979 1.00 0.00 H new ATOM 0 HD11 LEU A 29 11.472 4.785 -3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 29 10.931 6.411 -4.459 1.00 0.00 H new ATOM 0 HD13 LEU A 29 12.663 6.002 -4.497 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.674 4.444 -1.840 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.900 5.634 -2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 29 13.049 5.828 -0.786 1.00 0.00 H new ATOM 448 N SER A 30 13.399 10.478 -0.301 1.00 0.00 N ATOM 449 CA SER A 30 13.680 11.907 -0.221 1.00 0.00 C ATOM 450 C SER A 30 14.637 12.346 -1.333 1.00 0.00 C ATOM 451 O SER A 30 15.725 12.859 -1.068 1.00 0.00 O ATOM 452 CB SER A 30 14.232 12.245 1.166 1.00 0.00 C ATOM 453 OG SER A 30 13.315 11.838 2.164 1.00 0.00 O ATOM 0 H SER A 30 13.929 9.919 0.368 1.00 0.00 H new ATOM 0 HA SER A 30 12.752 12.460 -0.368 1.00 0.00 H new ATOM 0 HB2 SER A 30 15.190 11.748 1.316 1.00 0.00 H new ATOM 0 HB3 SER A 30 14.414 13.317 1.243 1.00 0.00 H new ATOM 0 HG SER A 30 12.417 12.152 1.930 1.00 0.00 H new ATOM 459 N LYS A 31 14.202 12.161 -2.582 1.00 0.00 N ATOM 460 CA LYS A 31 14.894 12.501 -3.819 1.00 0.00 C ATOM 461 C LYS A 31 16.204 11.727 -4.004 1.00 0.00 C ATOM 462 O LYS A 31 16.302 10.916 -4.919 1.00 0.00 O ATOM 463 CB LYS A 31 15.083 14.018 -3.975 1.00 0.00 C ATOM 464 CG LYS A 31 13.766 14.814 -3.898 1.00 0.00 C ATOM 465 CD LYS A 31 13.667 15.607 -2.585 1.00 0.00 C ATOM 466 CE LYS A 31 12.505 16.611 -2.589 1.00 0.00 C ATOM 467 NZ LYS A 31 11.186 15.962 -2.476 1.00 0.00 N ATOM 0 H LYS A 31 13.291 11.739 -2.764 1.00 0.00 H new ATOM 0 HA LYS A 31 14.242 12.178 -4.631 1.00 0.00 H new ATOM 0 HB2 LYS A 31 15.759 14.374 -3.197 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.564 14.219 -4.932 1.00 0.00 H new ATOM 0 HG2 LYS A 31 13.703 15.498 -4.744 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.921 14.130 -3.977 1.00 0.00 H new ATOM 0 HD2 LYS A 31 13.540 14.913 -1.754 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.603 16.140 -2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 31 12.632 17.310 -1.762 1.00 0.00 H new ATOM 0 HE3 LYS A 31 12.539 17.195 -3.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 10.438 16.680 -2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 11.076 15.265 -3.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 11.113 15.482 -1.556 1.00 0.00 H new ATOM 481 N LYS A 32 17.216 11.956 -3.165 1.00 0.00 N ATOM 482 CA LYS A 32 18.522 11.320 -3.332 1.00 0.00 C ATOM 483 C LYS A 32 18.387 9.790 -3.393 1.00 0.00 C ATOM 484 O LYS A 32 18.930 9.172 -4.304 1.00 0.00 O ATOM 485 CB LYS A 32 19.538 11.826 -2.293 1.00 0.00 C ATOM 486 CG LYS A 32 19.111 11.469 -0.872 1.00 0.00 C ATOM 487 CD LYS A 32 19.990 12.090 0.217 1.00 0.00 C ATOM 488 CE LYS A 32 19.625 11.479 1.580 1.00 0.00 C ATOM 489 NZ LYS A 32 18.164 11.455 1.815 1.00 0.00 N ATOM 0 H LYS A 32 17.154 12.580 -2.360 1.00 0.00 H new ATOM 0 HA LYS A 32 18.934 11.618 -4.296 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.517 11.393 -2.499 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.643 12.907 -2.382 1.00 0.00 H new ATOM 0 HG2 LYS A 32 18.081 11.792 -0.721 1.00 0.00 H new ATOM 0 HG3 LYS A 32 19.125 10.385 -0.761 1.00 0.00 H new ATOM 0 HD2 LYS A 32 21.042 11.911 -0.004 1.00 0.00 H new ATOM 0 HD3 LYS A 32 19.849 13.171 0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 32 20.016 10.463 1.636 1.00 0.00 H new ATOM 0 HE3 LYS A 32 20.108 12.051 2.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 17.978 11.346 2.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 17.744 12.345 1.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 17.742 10.657 1.299 1.00 0.00 H new ATOM 503 N GLU A 33 17.609 9.173 -2.493 1.00 0.00 N ATOM 504 CA GLU A 33 17.290 7.751 -2.587 1.00 0.00 C ATOM 505 C GLU A 33 16.778 7.363 -3.982 1.00 0.00 C ATOM 506 O GLU A 33 17.148 6.317 -4.512 1.00 0.00 O ATOM 507 CB GLU A 33 16.241 7.387 -1.529 1.00 0.00 C ATOM 508 CG GLU A 33 16.660 7.677 -0.079 1.00 0.00 C ATOM 509 CD GLU A 33 16.155 9.015 0.418 1.00 0.00 C ATOM 510 OE1 GLU A 33 16.777 10.031 0.043 1.00 0.00 O ATOM 511 OE2 GLU A 33 15.159 9.034 1.174 1.00 0.00 O ATOM 0 H GLU A 33 17.190 9.643 -1.691 1.00 0.00 H new ATOM 0 HA GLU A 33 18.210 7.194 -2.410 1.00 0.00 H new ATOM 0 HB2 GLU A 33 15.324 7.935 -1.744 1.00 0.00 H new ATOM 0 HB3 GLU A 33 16.007 6.326 -1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 33 16.282 6.887 0.569 1.00 0.00 H new ATOM 0 HG3 GLU A 33 17.747 7.654 -0.008 1.00 0.00 H new ATOM 518 N LEU A 34 15.942 8.203 -4.599 1.00 0.00 N ATOM 519 CA LEU A 34 15.381 7.915 -5.911 1.00 0.00 C ATOM 520 C LEU A 34 16.478 7.857 -6.985 1.00 0.00 C ATOM 521 O LEU A 34 16.303 7.188 -8.004 1.00 0.00 O ATOM 522 CB LEU A 34 14.251 8.911 -6.218 1.00 0.00 C ATOM 523 CG LEU A 34 13.392 8.491 -7.422 1.00 0.00 C ATOM 524 CD1 LEU A 34 11.908 8.735 -7.133 1.00 0.00 C ATOM 525 CD2 LEU A 34 13.796 9.274 -8.674 1.00 0.00 C ATOM 0 H LEU A 34 15.640 9.093 -4.203 1.00 0.00 H new ATOM 0 HA LEU A 34 14.933 6.921 -5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.613 9.010 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.682 9.893 -6.411 1.00 0.00 H new ATOM 0 HG LEU A 34 13.557 7.428 -7.595 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.315 8.432 -7.996 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.606 8.152 -6.263 1.00 0.00 H new ATOM 0 HD13 LEU A 34 11.745 9.794 -6.935 1.00 0.00 H new ATOM 0 HD21 LEU A 34 13.176 8.962 -9.514 1.00 0.00 H new ATOM 0 HD22 LEU A 34 13.657 10.340 -8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 34 14.843 9.078 -8.903 1.00 0.00 H new ATOM 537 N LYS A 35 17.647 8.468 -6.743 1.00 0.00 N ATOM 538 CA LYS A 35 18.807 8.293 -7.609 1.00 0.00 C ATOM 539 C LYS A 35 19.138 6.798 -7.729 1.00 0.00 C ATOM 540 O LYS A 35 19.432 6.324 -8.828 1.00 0.00 O ATOM 541 CB LYS A 35 20.003 9.105 -7.075 1.00 0.00 C ATOM 542 CG LYS A 35 21.052 9.582 -8.099 1.00 0.00 C ATOM 543 CD LYS A 35 21.645 8.495 -9.013 1.00 0.00 C ATOM 544 CE LYS A 35 20.924 8.467 -10.372 1.00 0.00 C ATOM 545 NZ LYS A 35 20.797 7.113 -10.943 1.00 0.00 N ATOM 0 H LYS A 35 17.808 9.089 -5.950 1.00 0.00 H new ATOM 0 HA LYS A 35 18.580 8.670 -8.606 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.611 9.983 -6.561 1.00 0.00 H new ATOM 0 HB3 LYS A 35 20.514 8.499 -6.327 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.596 10.348 -8.727 1.00 0.00 H new ATOM 0 HG3 LYS A 35 21.869 10.059 -7.557 1.00 0.00 H new ATOM 0 HD2 LYS A 35 22.708 8.682 -9.165 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.558 7.521 -8.531 1.00 0.00 H new ATOM 0 HE2 LYS A 35 19.930 8.898 -10.256 1.00 0.00 H new ATOM 0 HE3 LYS A 35 21.466 9.100 -11.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 20.380 7.175 -11.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 21.737 6.673 -11.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 20.184 6.535 -10.333 1.00 0.00 H new ATOM 559 N GLU A 36 19.076 6.045 -6.621 1.00 0.00 N ATOM 560 CA GLU A 36 19.299 4.602 -6.663 1.00 0.00 C ATOM 561 C GLU A 36 18.311 3.960 -7.633 1.00 0.00 C ATOM 562 O GLU A 36 18.652 3.048 -8.388 1.00 0.00 O ATOM 563 CB GLU A 36 19.178 3.964 -5.263 1.00 0.00 C ATOM 564 CG GLU A 36 19.599 2.478 -5.339 1.00 0.00 C ATOM 565 CD GLU A 36 19.303 1.665 -4.088 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.191 2.262 -2.999 1.00 0.00 O ATOM 567 OE2 GLU A 36 19.156 0.434 -4.260 1.00 0.00 O ATOM 0 H GLU A 36 18.874 6.414 -5.692 1.00 0.00 H new ATOM 0 HA GLU A 36 20.317 4.424 -7.011 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.810 4.497 -4.552 1.00 0.00 H new ATOM 0 HB3 GLU A 36 18.153 4.045 -4.901 1.00 0.00 H new ATOM 0 HG2 GLU A 36 19.091 2.014 -6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 36 20.669 2.428 -5.543 1.00 0.00 H new ATOM 574 N LEU A 37 17.070 4.438 -7.568 1.00 0.00 N ATOM 575 CA LEU A 37 15.944 3.864 -8.255 1.00 0.00 C ATOM 576 C LEU A 37 16.190 3.848 -9.748 1.00 0.00 C ATOM 577 O LEU A 37 16.511 2.791 -10.275 1.00 0.00 O ATOM 578 CB LEU A 37 14.642 4.552 -7.813 1.00 0.00 C ATOM 579 CG LEU A 37 13.399 3.703 -8.095 1.00 0.00 C ATOM 580 CD1 LEU A 37 12.288 4.067 -7.106 1.00 0.00 C ATOM 581 CD2 LEU A 37 12.863 3.905 -9.515 1.00 0.00 C ATOM 0 H LEU A 37 16.826 5.260 -7.016 1.00 0.00 H new ATOM 0 HA LEU A 37 15.821 2.817 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.695 4.768 -6.746 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.548 5.508 -8.328 1.00 0.00 H new ATOM 0 HG LEU A 37 13.697 2.660 -7.985 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.406 3.460 -7.311 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.630 3.878 -6.089 1.00 0.00 H new ATOM 0 HD13 LEU A 37 12.036 5.122 -7.214 1.00 0.00 H new ATOM 0 HD21 LEU A 37 11.982 3.281 -9.664 1.00 0.00 H new ATOM 0 HD22 LEU A 37 12.594 4.952 -9.657 1.00 0.00 H new ATOM 0 HD23 LEU A 37 13.631 3.627 -10.237 1.00 0.00 H new ATOM 593 N ILE A 38 16.104 5.006 -10.404 1.00 0.00 N ATOM 594 CA ILE A 38 16.033 5.165 -11.860 1.00 0.00 C ATOM 595 C ILE A 38 17.041 4.342 -12.713 1.00 0.00 C ATOM 596 O ILE A 38 16.865 4.287 -13.926 1.00 0.00 O ATOM 597 CB ILE A 38 16.109 6.658 -12.219 1.00 0.00 C ATOM 598 CG1 ILE A 38 17.495 7.266 -11.937 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.002 7.437 -11.498 1.00 0.00 C ATOM 600 CD1 ILE A 38 17.592 8.716 -12.421 1.00 0.00 C ATOM 0 H ILE A 38 16.081 5.900 -9.914 1.00 0.00 H new ATOM 0 HA ILE A 38 15.070 4.734 -12.133 1.00 0.00 H new ATOM 0 HB ILE A 38 15.953 6.741 -13.295 1.00 0.00 H new ATOM 0 HG12 ILE A 38 17.698 7.226 -10.867 1.00 0.00 H new ATOM 0 HG13 ILE A 38 18.261 6.667 -12.429 1.00 0.00 H new ATOM 0 HG21 ILE A 38 15.069 8.492 -11.762 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.029 7.049 -11.798 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.121 7.324 -10.420 1.00 0.00 H new ATOM 0 HD11 ILE A 38 18.586 9.107 -12.203 1.00 0.00 H new ATOM 0 HD12 ILE A 38 17.416 8.753 -13.496 1.00 0.00 H new ATOM 0 HD13 ILE A 38 16.844 9.321 -11.909 1.00 0.00 H new ATOM 612 N GLN A 39 18.077 3.708 -12.143 1.00 0.00 N ATOM 613 CA GLN A 39 18.939 2.746 -12.838 1.00 0.00 C ATOM 614 C GLN A 39 18.461 1.285 -12.681 1.00 0.00 C ATOM 615 O GLN A 39 18.277 0.576 -13.664 1.00 0.00 O ATOM 616 CB GLN A 39 20.393 2.944 -12.376 1.00 0.00 C ATOM 617 CG GLN A 39 21.407 2.387 -13.387 1.00 0.00 C ATOM 618 CD GLN A 39 21.383 3.147 -14.714 1.00 0.00 C ATOM 619 OE1 GLN A 39 21.015 2.603 -15.754 1.00 0.00 O ATOM 620 NE2 GLN A 39 21.730 4.428 -14.700 1.00 0.00 N ATOM 0 H GLN A 39 18.342 3.854 -11.169 1.00 0.00 H new ATOM 0 HA GLN A 39 18.880 2.943 -13.908 1.00 0.00 H new ATOM 0 HB2 GLN A 39 20.582 4.007 -12.223 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.536 2.453 -11.413 1.00 0.00 H new ATOM 0 HG2 GLN A 39 22.408 2.439 -12.960 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.193 1.334 -13.570 1.00 0.00 H new ATOM 0 HE21 GLN A 39 22.033 4.865 -13.829 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.694 4.976 -15.560 1.00 0.00 H new ATOM 629 N LYS A 40 18.267 0.831 -11.441 1.00 0.00 N ATOM 630 CA LYS A 40 17.759 -0.484 -11.009 1.00 0.00 C ATOM 631 C LYS A 40 16.227 -0.382 -10.880 1.00 0.00 C ATOM 632 O LYS A 40 15.636 -0.869 -9.916 1.00 0.00 O ATOM 633 CB LYS A 40 18.427 -0.842 -9.669 1.00 0.00 C ATOM 634 CG LYS A 40 18.233 -2.318 -9.276 1.00 0.00 C ATOM 635 CD LYS A 40 17.657 -2.543 -7.867 1.00 0.00 C ATOM 636 CE LYS A 40 18.600 -2.190 -6.702 1.00 0.00 C ATOM 637 NZ LYS A 40 18.742 -0.737 -6.490 1.00 0.00 N ATOM 0 H LYS A 40 18.479 1.423 -10.638 1.00 0.00 H new ATOM 0 HA LYS A 40 17.993 -1.271 -11.726 1.00 0.00 H new ATOM 0 HB2 LYS A 40 19.493 -0.625 -9.732 1.00 0.00 H new ATOM 0 HB3 LYS A 40 18.018 -0.206 -8.884 1.00 0.00 H new ATOM 0 HG2 LYS A 40 17.571 -2.788 -10.003 1.00 0.00 H new ATOM 0 HG3 LYS A 40 19.195 -2.827 -9.345 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.747 -1.952 -7.767 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.369 -3.590 -7.774 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.225 -2.649 -5.787 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.583 -2.620 -6.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 19.217 -0.564 -5.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.308 -0.328 -7.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 17.801 -0.294 -6.479 1.00 0.00 H new ATOM 651 N GLU A 41 15.646 0.434 -11.751 1.00 0.00 N ATOM 652 CA GLU A 41 14.403 1.121 -11.565 1.00 0.00 C ATOM 653 C GLU A 41 13.035 0.474 -11.414 1.00 0.00 C ATOM 654 O GLU A 41 12.680 -0.077 -10.376 1.00 0.00 O ATOM 655 CB GLU A 41 14.438 2.176 -12.696 1.00 0.00 C ATOM 656 CG GLU A 41 14.946 1.884 -14.132 1.00 0.00 C ATOM 657 CD GLU A 41 14.274 0.824 -15.000 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.035 0.650 -14.930 1.00 0.00 O ATOM 659 OE2 GLU A 41 15.003 0.299 -15.867 1.00 0.00 O ATOM 0 H GLU A 41 16.068 0.637 -12.657 1.00 0.00 H new ATOM 0 HA GLU A 41 14.415 1.427 -10.519 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.418 2.544 -12.802 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.039 3.005 -12.322 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.903 2.823 -14.684 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.998 1.610 -14.050 1.00 0.00 H new ATOM 666 N LEU A 42 12.246 0.713 -12.441 1.00 0.00 N ATOM 667 CA LEU A 42 10.820 0.559 -12.506 1.00 0.00 C ATOM 668 C LEU A 42 10.465 -0.786 -13.120 1.00 0.00 C ATOM 669 O LEU A 42 9.791 -1.607 -12.497 1.00 0.00 O ATOM 670 CB LEU A 42 10.284 1.795 -13.255 1.00 0.00 C ATOM 671 CG LEU A 42 10.639 3.164 -12.604 1.00 0.00 C ATOM 672 CD1 LEU A 42 10.328 4.272 -13.615 1.00 0.00 C ATOM 673 CD2 LEU A 42 9.805 3.417 -11.346 1.00 0.00 C ATOM 0 H LEU A 42 12.627 1.049 -13.326 1.00 0.00 H new ATOM 0 HA LEU A 42 10.342 0.531 -11.527 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.674 1.782 -14.273 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.199 1.715 -13.328 1.00 0.00 H new ATOM 0 HG LEU A 42 11.693 3.154 -12.327 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.570 5.241 -13.179 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.924 4.121 -14.515 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.269 4.244 -13.872 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.078 4.381 -10.916 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.747 3.422 -11.606 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.996 2.628 -10.618 1.00 0.00 H new ATOM 685 N THR A 43 10.916 -1.008 -14.357 1.00 0.00 N ATOM 686 CA THR A 43 10.764 -2.274 -15.068 1.00 0.00 C ATOM 687 C THR A 43 11.772 -2.298 -16.211 1.00 0.00 C ATOM 688 O THR A 43 12.722 -3.076 -16.205 1.00 0.00 O ATOM 689 CB THR A 43 9.318 -2.513 -15.569 1.00 0.00 C ATOM 690 OG1 THR A 43 8.349 -2.049 -14.653 1.00 0.00 O ATOM 691 CG2 THR A 43 9.074 -4.003 -15.815 1.00 0.00 C ATOM 0 H THR A 43 11.406 -0.297 -14.900 1.00 0.00 H new ATOM 0 HA THR A 43 10.962 -3.094 -14.378 1.00 0.00 H new ATOM 0 HB THR A 43 9.218 -1.951 -16.498 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.667 -2.196 -13.738 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.053 -4.151 -16.166 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.773 -4.367 -16.568 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.222 -4.554 -14.886 1.00 0.00 H new ATOM 699 N ILE A 44 11.542 -1.411 -17.176 1.00 0.00 N ATOM 700 CA ILE A 44 12.432 -1.117 -18.287 1.00 0.00 C ATOM 701 C ILE A 44 12.422 0.377 -18.596 1.00 0.00 C ATOM 702 O ILE A 44 12.386 0.809 -19.746 1.00 0.00 O ATOM 703 CB ILE A 44 12.128 -1.989 -19.514 1.00 0.00 C ATOM 704 CG1 ILE A 44 10.665 -1.875 -19.980 1.00 0.00 C ATOM 705 CG2 ILE A 44 12.522 -3.452 -19.267 1.00 0.00 C ATOM 706 CD1 ILE A 44 10.390 -2.651 -21.270 1.00 0.00 C ATOM 0 H ILE A 44 10.688 -0.853 -17.202 1.00 0.00 H new ATOM 0 HA ILE A 44 13.448 -1.377 -17.992 1.00 0.00 H new ATOM 0 HB ILE A 44 12.742 -1.604 -20.328 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.008 -2.244 -19.192 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.419 -0.824 -20.134 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.295 -4.045 -20.153 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.590 -3.511 -19.055 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.962 -3.841 -18.417 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.343 -2.533 -21.549 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.024 -2.266 -22.069 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.607 -3.707 -21.112 1.00 0.00 H new ATOM 888 N LEU A 56 17.166 10.754 -16.528 1.00 0.00 N ATOM 889 CA LEU A 56 16.612 11.957 -15.940 1.00 0.00 C ATOM 890 C LEU A 56 15.306 12.332 -16.639 1.00 0.00 C ATOM 891 O LEU A 56 14.347 12.666 -15.954 1.00 0.00 O ATOM 892 CB LEU A 56 17.644 13.091 -16.009 1.00 0.00 C ATOM 893 CG LEU A 56 17.161 14.421 -15.406 1.00 0.00 C ATOM 894 CD1 LEU A 56 16.810 14.290 -13.919 1.00 0.00 C ATOM 895 CD2 LEU A 56 18.264 15.471 -15.576 1.00 0.00 C ATOM 0 HA LEU A 56 16.381 11.779 -14.890 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.548 12.776 -15.488 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.917 13.256 -17.051 1.00 0.00 H new ATOM 0 HG LEU A 56 16.254 14.719 -15.932 1.00 0.00 H new ATOM 0 HD11 LEU A 56 16.474 15.255 -13.538 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.015 13.555 -13.796 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.691 13.968 -13.364 1.00 0.00 H new ATOM 0 HD21 LEU A 56 17.933 16.419 -15.152 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.165 15.138 -15.061 1.00 0.00 H new ATOM 0 HD23 LEU A 56 18.480 15.604 -16.636 1.00 0.00 H new ATOM 907 N MET A 57 15.249 12.250 -17.976 1.00 0.00 N ATOM 908 CA MET A 57 14.058 12.588 -18.750 1.00 0.00 C ATOM 909 C MET A 57 12.828 11.834 -18.231 1.00 0.00 C ATOM 910 O MET A 57 11.785 12.436 -17.980 1.00 0.00 O ATOM 911 CB MET A 57 14.300 12.321 -20.242 1.00 0.00 C ATOM 912 CG MET A 57 13.216 12.961 -21.118 1.00 0.00 C ATOM 913 SD MET A 57 13.339 12.622 -22.895 1.00 0.00 S ATOM 914 CE MET A 57 14.958 13.328 -23.277 1.00 0.00 C ATOM 0 H MET A 57 16.036 11.945 -18.549 1.00 0.00 H new ATOM 0 HA MET A 57 13.855 13.652 -18.627 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.276 12.713 -20.528 1.00 0.00 H new ATOM 0 HB3 MET A 57 14.323 11.246 -20.420 1.00 0.00 H new ATOM 0 HG2 MET A 57 12.242 12.618 -20.768 1.00 0.00 H new ATOM 0 HG3 MET A 57 13.246 14.040 -20.970 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.097 13.356 -24.358 1.00 0.00 H new ATOM 0 HE2 MET A 57 15.017 14.340 -22.877 1.00 0.00 H new ATOM 0 HE3 MET A 57 15.738 12.714 -22.827 1.00 0.00 H new ATOM 924 N ASP A 58 12.946 10.519 -18.051 1.00 0.00 N ATOM 925 CA ASP A 58 11.880 9.692 -17.504 1.00 0.00 C ATOM 926 C ASP A 58 11.436 10.184 -16.140 1.00 0.00 C ATOM 927 O ASP A 58 10.247 10.129 -15.825 1.00 0.00 O ATOM 928 CB ASP A 58 12.352 8.229 -17.419 1.00 0.00 C ATOM 929 CG ASP A 58 12.930 7.685 -18.712 1.00 0.00 C ATOM 930 OD1 ASP A 58 14.009 8.174 -19.121 1.00 0.00 O ATOM 931 OD2 ASP A 58 12.375 6.712 -19.271 1.00 0.00 O ATOM 0 H ASP A 58 13.791 9.997 -18.283 1.00 0.00 H new ATOM 0 HA ASP A 58 11.020 9.759 -18.171 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.105 8.147 -16.635 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.510 7.604 -17.119 1.00 0.00 H new ATOM 936 N ASP A 59 12.366 10.692 -15.332 1.00 0.00 N ATOM 937 CA ASP A 59 12.003 11.211 -14.029 1.00 0.00 C ATOM 938 C ASP A 59 11.076 12.428 -14.114 1.00 0.00 C ATOM 939 O ASP A 59 10.439 12.757 -13.114 1.00 0.00 O ATOM 940 CB ASP A 59 13.248 11.498 -13.181 1.00 0.00 C ATOM 941 CG ASP A 59 12.859 11.593 -11.717 1.00 0.00 C ATOM 942 OD1 ASP A 59 12.437 10.538 -11.193 1.00 0.00 O ATOM 943 OD2 ASP A 59 12.880 12.709 -11.162 1.00 0.00 O ATOM 0 H ASP A 59 13.359 10.752 -15.558 1.00 0.00 H new ATOM 0 HA ASP A 59 11.431 10.431 -13.526 1.00 0.00 H new ATOM 0 HB2 ASP A 59 13.985 10.707 -13.321 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.714 12.429 -13.505 1.00 0.00 H new ATOM 948 N LEU A 60 10.954 13.079 -15.280 1.00 0.00 N ATOM 949 CA LEU A 60 10.324 14.390 -15.414 1.00 0.00 C ATOM 950 C LEU A 60 8.813 14.481 -15.282 1.00 0.00 C ATOM 951 O LEU A 60 8.247 15.562 -15.437 1.00 0.00 O ATOM 952 CB LEU A 60 10.891 15.176 -16.589 1.00 0.00 C ATOM 953 CG LEU A 60 12.420 15.203 -16.507 1.00 0.00 C ATOM 954 CD1 LEU A 60 12.936 16.094 -17.643 1.00 0.00 C ATOM 955 CD2 LEU A 60 12.977 15.739 -15.181 1.00 0.00 C ATOM 0 H LEU A 60 11.296 12.701 -16.164 1.00 0.00 H new ATOM 0 HA LEU A 60 10.621 14.890 -14.492 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.576 14.721 -17.528 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.499 16.193 -16.581 1.00 0.00 H new ATOM 0 HG LEU A 60 12.758 14.170 -16.586 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.025 16.132 -17.610 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.617 15.684 -18.601 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.534 17.101 -17.527 1.00 0.00 H new ATOM 0 HD21 LEU A 60 14.066 15.722 -15.211 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.634 16.762 -15.029 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.627 15.113 -14.360 1.00 0.00 H new ATOM 967 N ASP A 61 8.155 13.388 -14.893 1.00 0.00 N ATOM 968 CA ASP A 61 6.845 13.552 -14.277 1.00 0.00 C ATOM 969 C ASP A 61 7.053 14.302 -12.936 1.00 0.00 C ATOM 970 O ASP A 61 6.113 14.903 -12.416 1.00 0.00 O ATOM 971 CB ASP A 61 6.249 12.184 -13.982 1.00 0.00 C ATOM 972 CG ASP A 61 6.958 11.542 -12.810 1.00 0.00 C ATOM 973 OD1 ASP A 61 8.048 10.990 -13.063 1.00 0.00 O ATOM 974 OD2 ASP A 61 6.474 11.687 -11.670 1.00 0.00 O ATOM 0 H ASP A 61 8.488 12.428 -14.987 1.00 0.00 H new ATOM 0 HA ASP A 61 6.177 14.102 -14.939 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.186 12.283 -13.762 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.335 11.546 -14.861 1.00 0.00 H new ATOM 979 N ARG A 62 8.331 14.433 -12.528 1.00 0.00 N ATOM 980 CA ARG A 62 9.045 14.786 -11.289 1.00 0.00 C ATOM 981 C ARG A 62 8.315 15.431 -10.110 1.00 0.00 C ATOM 982 O ARG A 62 8.912 16.122 -9.288 1.00 0.00 O ATOM 983 CB ARG A 62 10.254 15.672 -11.669 1.00 0.00 C ATOM 984 CG ARG A 62 9.943 16.950 -12.482 1.00 0.00 C ATOM 985 CD ARG A 62 8.962 17.947 -11.843 1.00 0.00 C ATOM 986 NE ARG A 62 7.564 17.517 -12.018 1.00 0.00 N ATOM 987 CZ ARG A 62 6.500 17.912 -11.296 1.00 0.00 C ATOM 988 NH1 ARG A 62 6.600 18.857 -10.359 1.00 0.00 N ATOM 989 NH2 ARG A 62 5.325 17.305 -11.488 1.00 0.00 N ATOM 0 H ARG A 62 9.042 14.247 -13.235 1.00 0.00 H new ATOM 0 HA ARG A 62 9.279 13.804 -10.878 1.00 0.00 H new ATOM 0 HB2 ARG A 62 10.763 15.967 -10.751 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.955 15.065 -12.242 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.882 17.470 -12.673 1.00 0.00 H new ATOM 0 HG3 ARG A 62 9.542 16.650 -13.450 1.00 0.00 H new ATOM 0 HD2 ARG A 62 9.183 18.046 -10.780 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.100 18.932 -12.290 1.00 0.00 H new ATOM 0 HE ARG A 62 7.383 16.848 -12.767 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.500 19.300 -10.175 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.776 19.137 -9.827 1.00 0.00 H new ATOM 0 HH21 ARG A 62 5.245 16.554 -12.174 1.00 0.00 H new ATOM 0 HH22 ARG A 62 4.508 17.592 -10.949 1.00 0.00 H new ATOM 1003 N ASN A 63 7.022 15.164 -9.964 1.00 0.00 N ATOM 1004 CA ASN A 63 6.231 15.617 -8.825 1.00 0.00 C ATOM 1005 C ASN A 63 6.833 15.223 -7.464 1.00 0.00 C ATOM 1006 O ASN A 63 6.470 15.791 -6.437 1.00 0.00 O ATOM 1007 CB ASN A 63 4.769 15.218 -9.021 1.00 0.00 C ATOM 1008 CG ASN A 63 3.858 16.339 -8.546 1.00 0.00 C ATOM 1009 OD1 ASN A 63 3.730 17.340 -9.255 1.00 0.00 O ATOM 1010 ND2 ASN A 63 3.249 16.206 -7.375 1.00 0.00 N ATOM 0 H ASN A 63 6.487 14.620 -10.641 1.00 0.00 H new ATOM 0 HA ASN A 63 6.262 16.706 -8.792 1.00 0.00 H new ATOM 0 HB2 ASN A 63 4.579 15.005 -10.073 1.00 0.00 H new ATOM 0 HB3 ASN A 63 4.555 14.304 -8.467 1.00 0.00 H new ATOM 0 HD21 ASN A 63 2.645 16.950 -7.027 1.00 0.00 H new ATOM 0 HD22 ASN A 63 3.385 15.359 -6.823 1.00 0.00 H new ATOM 1017 N LYS A 64 7.838 14.334 -7.495 1.00 0.00 N ATOM 1018 CA LYS A 64 8.786 13.992 -6.437 1.00 0.00 C ATOM 1019 C LYS A 64 9.369 15.237 -5.746 1.00 0.00 C ATOM 1020 O LYS A 64 10.024 15.113 -4.705 1.00 0.00 O ATOM 1021 CB LYS A 64 9.932 13.182 -7.062 1.00 0.00 C ATOM 1022 CG LYS A 64 9.447 11.886 -7.739 1.00 0.00 C ATOM 1023 CD LYS A 64 10.211 11.614 -9.042 1.00 0.00 C ATOM 1024 CE LYS A 64 9.305 10.850 -10.012 1.00 0.00 C ATOM 1025 NZ LYS A 64 9.892 10.786 -11.355 1.00 0.00 N ATOM 0 H LYS A 64 8.019 13.791 -8.339 1.00 0.00 H new ATOM 0 HA LYS A 64 8.256 13.417 -5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.448 13.799 -7.797 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.658 12.933 -6.289 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.578 11.046 -7.057 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.380 11.961 -7.950 1.00 0.00 H new ATOM 0 HD2 LYS A 64 10.533 12.554 -9.491 1.00 0.00 H new ATOM 0 HD3 LYS A 64 11.111 11.035 -8.835 1.00 0.00 H new ATOM 0 HE2 LYS A 64 9.138 9.840 -9.638 1.00 0.00 H new ATOM 0 HE3 LYS A 64 8.331 11.336 -10.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 9.193 10.400 -12.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.169 11.741 -11.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 10.731 10.172 -11.338 1.00 0.00 H new ATOM 1039 N ASP A 65 9.198 16.426 -6.346 1.00 0.00 N ATOM 1040 CA ASP A 65 9.407 17.711 -5.692 1.00 0.00 C ATOM 1041 C ASP A 65 8.811 17.627 -4.280 1.00 0.00 C ATOM 1042 O ASP A 65 9.520 17.849 -3.296 1.00 0.00 O ATOM 1043 CB ASP A 65 8.717 18.832 -6.490 1.00 0.00 C ATOM 1044 CG ASP A 65 9.379 19.142 -7.827 1.00 0.00 C ATOM 1045 OD1 ASP A 65 10.626 19.158 -7.864 1.00 0.00 O ATOM 1046 OD2 ASP A 65 8.617 19.383 -8.792 1.00 0.00 O ATOM 0 H ASP A 65 8.905 16.514 -7.319 1.00 0.00 H new ATOM 0 HA ASP A 65 10.472 17.938 -5.641 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.679 18.551 -6.667 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.703 19.738 -5.885 1.00 0.00 H new ATOM 1051 N GLN A 66 7.537 17.229 -4.164 1.00 0.00 N ATOM 1052 CA GLN A 66 6.968 16.874 -2.867 1.00 0.00 C ATOM 1053 C GLN A 66 7.400 15.443 -2.532 1.00 0.00 C ATOM 1054 O GLN A 66 7.560 14.620 -3.430 1.00 0.00 O ATOM 1055 CB GLN A 66 5.445 17.073 -2.815 1.00 0.00 C ATOM 1056 CG GLN A 66 4.638 16.272 -3.846 1.00 0.00 C ATOM 1057 CD GLN A 66 3.141 16.314 -3.547 1.00 0.00 C ATOM 1058 OE1 GLN A 66 2.668 17.155 -2.786 1.00 0.00 O ATOM 1059 NE2 GLN A 66 2.373 15.405 -4.134 1.00 0.00 N ATOM 0 H GLN A 66 6.890 17.147 -4.948 1.00 0.00 H new ATOM 0 HA GLN A 66 7.352 17.549 -2.102 1.00 0.00 H new ATOM 0 HB2 GLN A 66 5.095 16.805 -1.818 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.230 18.132 -2.955 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.821 16.673 -4.843 1.00 0.00 H new ATOM 0 HG3 GLN A 66 4.979 15.237 -3.851 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.787 14.716 -4.762 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.369 15.395 -3.957 1.00 0.00 H new ATOM 1068 N GLU A 67 7.661 15.162 -1.251 1.00 0.00 N ATOM 1069 CA GLU A 67 8.286 13.918 -0.821 1.00 0.00 C ATOM 1070 C GLU A 67 7.627 12.673 -1.417 1.00 0.00 C ATOM 1071 O GLU A 67 6.402 12.542 -1.450 1.00 0.00 O ATOM 1072 CB GLU A 67 8.351 13.859 0.709 1.00 0.00 C ATOM 1073 CG GLU A 67 9.426 14.814 1.246 1.00 0.00 C ATOM 1074 CD GLU A 67 10.818 14.306 0.896 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.283 13.394 1.611 1.00 0.00 O ATOM 1076 OE2 GLU A 67 11.367 14.788 -0.121 1.00 0.00 O ATOM 0 H GLU A 67 7.442 15.797 -0.484 1.00 0.00 H new ATOM 0 HA GLU A 67 9.304 13.916 -1.211 1.00 0.00 H new ATOM 0 HB2 GLU A 67 7.381 14.123 1.129 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.570 12.840 1.029 1.00 0.00 H new ATOM 0 HG2 GLU A 67 9.280 15.809 0.825 1.00 0.00 H new ATOM 0 HG3 GLU A 67 9.329 14.908 2.328 1.00 0.00 H new ATOM 1083 N VAL A 68 8.470 11.756 -1.896 1.00 0.00 N ATOM 1084 CA VAL A 68 8.041 10.627 -2.697 1.00 0.00 C ATOM 1085 C VAL A 68 7.393 9.569 -1.816 1.00 0.00 C ATOM 1086 O VAL A 68 8.023 8.601 -1.384 1.00 0.00 O ATOM 1087 CB VAL A 68 9.213 10.045 -3.479 1.00 0.00 C ATOM 1088 CG1 VAL A 68 8.756 8.964 -4.471 1.00 0.00 C ATOM 1089 CG2 VAL A 68 9.975 11.127 -4.247 1.00 0.00 C ATOM 0 H VAL A 68 9.476 11.784 -1.733 1.00 0.00 H new ATOM 0 HA VAL A 68 7.299 10.973 -3.416 1.00 0.00 H new ATOM 0 HB VAL A 68 9.875 9.596 -2.739 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.621 8.574 -5.008 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.271 8.153 -3.928 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.052 9.397 -5.182 1.00 0.00 H new ATOM 0 HG21 VAL A 68 10.803 10.672 -4.791 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.302 11.615 -4.952 1.00 0.00 H new ATOM 0 HG23 VAL A 68 10.364 11.865 -3.546 1.00 0.00 H new ATOM 1099 N ASN A 69 6.116 9.797 -1.557 1.00 0.00 N ATOM 1100 CA ASN A 69 5.208 8.821 -0.988 1.00 0.00 C ATOM 1101 C ASN A 69 4.876 7.817 -2.104 1.00 0.00 C ATOM 1102 O ASN A 69 5.154 8.087 -3.279 1.00 0.00 O ATOM 1103 CB ASN A 69 3.967 9.556 -0.460 1.00 0.00 C ATOM 1104 CG ASN A 69 3.149 8.722 0.520 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.314 7.510 0.621 1.00 0.00 O ATOM 1106 ND2 ASN A 69 2.260 9.368 1.267 1.00 0.00 N ATOM 0 H ASN A 69 5.671 10.696 -1.744 1.00 0.00 H new ATOM 0 HA ASN A 69 5.640 8.279 -0.147 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.279 10.478 0.030 1.00 0.00 H new ATOM 0 HB3 ASN A 69 3.335 9.840 -1.301 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.695 8.856 1.944 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.143 10.376 1.163 1.00 0.00 H new ATOM 1113 N PHE A 70 4.273 6.671 -1.768 1.00 0.00 N ATOM 1114 CA PHE A 70 3.920 5.646 -2.748 1.00 0.00 C ATOM 1115 C PHE A 70 3.151 6.278 -3.895 1.00 0.00 C ATOM 1116 O PHE A 70 3.454 6.020 -5.050 1.00 0.00 O ATOM 1117 CB PHE A 70 3.060 4.547 -2.125 1.00 0.00 C ATOM 1118 CG PHE A 70 2.695 3.414 -3.064 1.00 0.00 C ATOM 1119 CD1 PHE A 70 3.671 2.472 -3.436 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.367 3.250 -3.504 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.302 1.323 -4.155 1.00 0.00 C ATOM 1122 CE2 PHE A 70 1.000 2.092 -4.209 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.964 1.125 -4.529 1.00 0.00 C ATOM 0 H PHE A 70 4.018 6.431 -0.810 1.00 0.00 H new ATOM 0 HA PHE A 70 4.846 5.200 -3.110 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.590 4.133 -1.268 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.142 4.995 -1.745 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.705 2.632 -3.169 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.632 4.014 -3.299 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.050 0.590 -4.421 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.028 1.946 -4.506 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.677 0.230 -5.062 1.00 0.00 H new ATOM 1133 N GLN A 71 2.185 7.136 -3.559 1.00 0.00 N ATOM 1134 CA GLN A 71 1.407 7.918 -4.506 1.00 0.00 C ATOM 1135 C GLN A 71 2.270 8.501 -5.633 1.00 0.00 C ATOM 1136 O GLN A 71 1.830 8.487 -6.781 1.00 0.00 O ATOM 1137 CB GLN A 71 0.637 8.998 -3.727 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.304 9.854 -4.590 1.00 0.00 C ATOM 1139 CD GLN A 71 0.361 11.147 -5.060 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.305 12.156 -4.366 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.001 11.121 -6.220 1.00 0.00 N ATOM 0 H GLN A 71 1.919 7.307 -2.589 1.00 0.00 H new ATOM 0 HA GLN A 71 0.694 7.268 -5.012 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.053 8.516 -2.943 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.354 9.654 -3.233 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.625 9.277 -5.457 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.200 10.095 -4.018 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.026 10.262 -6.770 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.469 11.960 -6.563 1.00 0.00 H new ATOM 1150 N GLU A 72 3.460 9.034 -5.334 1.00 0.00 N ATOM 1151 CA GLU A 72 4.251 9.779 -6.310 1.00 0.00 C ATOM 1152 C GLU A 72 5.150 8.847 -7.125 1.00 0.00 C ATOM 1153 O GLU A 72 5.226 8.941 -8.352 1.00 0.00 O ATOM 1154 CB GLU A 72 5.010 10.912 -5.610 1.00 0.00 C ATOM 1155 CG GLU A 72 5.116 12.150 -6.509 1.00 0.00 C ATOM 1156 CD GLU A 72 3.791 12.896 -6.628 1.00 0.00 C ATOM 1157 OE1 GLU A 72 2.930 12.464 -7.426 1.00 0.00 O ATOM 1158 OE2 GLU A 72 3.660 13.938 -5.954 1.00 0.00 O ATOM 0 H GLU A 72 3.896 8.960 -4.415 1.00 0.00 H new ATOM 0 HA GLU A 72 3.587 10.246 -7.037 1.00 0.00 H new ATOM 0 HB2 GLU A 72 4.501 11.176 -4.683 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.009 10.570 -5.339 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.874 12.823 -6.108 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.450 11.848 -7.501 1.00 0.00 H new ATOM 1165 N TYR A 73 5.802 7.907 -6.433 1.00 0.00 N ATOM 1166 CA TYR A 73 6.484 6.777 -7.064 1.00 0.00 C ATOM 1167 C TYR A 73 5.509 6.138 -8.067 1.00 0.00 C ATOM 1168 O TYR A 73 5.869 5.824 -9.203 1.00 0.00 O ATOM 1169 CB TYR A 73 6.915 5.818 -5.938 1.00 0.00 C ATOM 1170 CG TYR A 73 7.141 4.356 -6.286 1.00 0.00 C ATOM 1171 CD1 TYR A 73 6.073 3.449 -6.148 1.00 0.00 C ATOM 1172 CD2 TYR A 73 8.448 3.858 -6.446 1.00 0.00 C ATOM 1173 CE1 TYR A 73 6.314 2.068 -6.087 1.00 0.00 C ATOM 1174 CE2 TYR A 73 8.688 2.473 -6.397 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.626 1.584 -6.166 1.00 0.00 C ATOM 1176 OH TYR A 73 7.882 0.291 -5.824 1.00 0.00 O ATOM 0 H TYR A 73 5.871 7.910 -5.415 1.00 0.00 H new ATOM 0 HA TYR A 73 7.377 7.066 -7.619 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.839 6.204 -5.507 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.157 5.861 -5.156 1.00 0.00 H new ATOM 0 HD1 TYR A 73 5.060 3.819 -6.089 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.269 4.541 -6.607 1.00 0.00 H new ATOM 0 HE1 TYR A 73 5.489 1.379 -5.979 1.00 0.00 H new ATOM 0 HE2 TYR A 73 9.689 2.093 -6.537 1.00 0.00 H new ATOM 0 HH TYR A 73 7.285 0.021 -5.095 1.00 0.00 H new ATOM 1186 N ILE A 74 4.247 6.015 -7.654 1.00 0.00 N ATOM 1187 CA ILE A 74 3.160 5.565 -8.489 1.00 0.00 C ATOM 1188 C ILE A 74 2.873 6.540 -9.640 1.00 0.00 C ATOM 1189 O ILE A 74 2.818 6.069 -10.769 1.00 0.00 O ATOM 1190 CB ILE A 74 1.910 5.216 -7.665 1.00 0.00 C ATOM 1191 CG1 ILE A 74 2.010 3.877 -6.916 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.720 5.157 -8.609 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.997 2.622 -7.801 1.00 0.00 C ATOM 0 H ILE A 74 3.957 6.235 -6.701 1.00 0.00 H new ATOM 0 HA ILE A 74 3.478 4.635 -8.961 1.00 0.00 H new ATOM 0 HB ILE A 74 1.802 5.990 -6.905 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.928 3.877 -6.329 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.181 3.812 -6.211 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.180 4.910 -8.045 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.591 6.125 -9.093 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.894 4.393 -9.367 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.072 1.734 -7.174 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.068 2.587 -8.369 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.842 2.653 -8.489 1.00 0.00 H new ATOM 1205 N THR A 75 2.646 7.844 -9.410 1.00 0.00 N ATOM 1206 CA THR A 75 2.406 8.820 -10.484 1.00 0.00 C ATOM 1207 C THR A 75 3.360 8.561 -11.654 1.00 0.00 C ATOM 1208 O THR A 75 2.962 8.374 -12.806 1.00 0.00 O ATOM 1209 CB THR A 75 2.614 10.251 -9.949 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.823 10.466 -8.806 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.253 11.322 -10.981 1.00 0.00 C ATOM 0 H THR A 75 2.624 8.250 -8.475 1.00 0.00 H new ATOM 0 HA THR A 75 1.379 8.713 -10.833 1.00 0.00 H new ATOM 0 HB THR A 75 3.674 10.337 -9.712 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.054 11.330 -8.406 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.418 12.311 -10.552 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.879 11.201 -11.865 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.205 11.218 -11.261 1.00 0.00 H new ATOM 1219 N PHE A 76 4.639 8.506 -11.300 1.00 0.00 N ATOM 1220 CA PHE A 76 5.748 8.206 -12.181 1.00 0.00 C ATOM 1221 C PHE A 76 5.587 6.846 -12.865 1.00 0.00 C ATOM 1222 O PHE A 76 5.601 6.775 -14.095 1.00 0.00 O ATOM 1223 CB PHE A 76 6.989 8.288 -11.308 1.00 0.00 C ATOM 1224 CG PHE A 76 8.261 7.687 -11.842 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.825 8.147 -13.046 1.00 0.00 C ATOM 1226 CD2 PHE A 76 9.061 6.996 -10.922 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.215 8.095 -13.206 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.457 7.169 -10.976 1.00 0.00 C ATOM 1229 CZ PHE A 76 11.025 7.802 -12.098 1.00 0.00 C ATOM 0 H PHE A 76 4.939 8.679 -10.341 1.00 0.00 H new ATOM 0 HA PHE A 76 5.809 8.912 -13.009 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.179 9.340 -11.094 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.763 7.805 -10.358 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.196 8.534 -13.834 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.615 6.343 -10.186 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.660 8.279 -14.173 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.084 6.821 -10.168 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.074 8.060 -12.106 1.00 0.00 H new ATOM 1239 N LEU A 77 5.418 5.764 -12.094 1.00 0.00 N ATOM 1240 CA LEU A 77 5.184 4.446 -12.679 1.00 0.00 C ATOM 1241 C LEU A 77 4.063 4.509 -13.722 1.00 0.00 C ATOM 1242 O LEU A 77 4.219 4.014 -14.834 1.00 0.00 O ATOM 1243 CB LEU A 77 4.824 3.407 -11.602 1.00 0.00 C ATOM 1244 CG LEU A 77 6.045 2.850 -10.857 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.626 2.236 -9.519 1.00 0.00 C ATOM 1246 CD2 LEU A 77 6.723 1.760 -11.698 1.00 0.00 C ATOM 0 H LEU A 77 5.439 5.778 -11.074 1.00 0.00 H new ATOM 0 HA LEU A 77 6.111 4.137 -13.162 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.145 3.863 -10.881 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.286 2.582 -12.069 1.00 0.00 H new ATOM 0 HG LEU A 77 6.736 3.674 -10.682 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.505 1.847 -9.006 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.153 2.999 -8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.920 1.424 -9.696 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.588 1.371 -11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.017 0.951 -11.882 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.047 2.183 -12.649 1.00 0.00 H new ATOM 1258 N GLY A 78 2.935 5.126 -13.363 1.00 0.00 N ATOM 1259 CA GLY A 78 1.770 5.316 -14.211 1.00 0.00 C ATOM 1260 C GLY A 78 2.134 6.034 -15.507 1.00 0.00 C ATOM 1261 O GLY A 78 1.731 5.602 -16.587 1.00 0.00 O ATOM 0 H GLY A 78 2.809 5.522 -12.431 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.325 4.348 -14.442 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.017 5.892 -13.673 1.00 0.00 H new ATOM 1265 N ALA A 79 2.898 7.126 -15.399 1.00 0.00 N ATOM 1266 CA ALA A 79 3.377 7.868 -16.558 1.00 0.00 C ATOM 1267 C ALA A 79 4.062 6.934 -17.562 1.00 0.00 C ATOM 1268 O ALA A 79 3.719 6.942 -18.743 1.00 0.00 O ATOM 1269 CB ALA A 79 4.292 9.018 -16.124 1.00 0.00 C ATOM 0 H ALA A 79 3.198 7.515 -14.505 1.00 0.00 H new ATOM 0 HA ALA A 79 2.519 8.309 -17.066 1.00 0.00 H new ATOM 0 HB1 ALA A 79 4.639 9.559 -17.004 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.740 9.697 -15.475 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.149 8.617 -15.584 1.00 0.00 H new ATOM 1275 N LEU A 80 5.015 6.115 -17.102 1.00 0.00 N ATOM 1276 CA LEU A 80 5.718 5.192 -17.991 1.00 0.00 C ATOM 1277 C LEU A 80 4.801 4.059 -18.468 1.00 0.00 C ATOM 1278 O LEU A 80 4.794 3.743 -19.656 1.00 0.00 O ATOM 1279 CB LEU A 80 6.976 4.614 -17.328 1.00 0.00 C ATOM 1280 CG LEU A 80 8.175 5.578 -17.296 1.00 0.00 C ATOM 1281 CD1 LEU A 80 8.097 6.571 -16.131 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.462 4.752 -17.184 1.00 0.00 C ATOM 0 H LEU A 80 5.313 6.075 -16.127 1.00 0.00 H new ATOM 0 HA LEU A 80 6.028 5.770 -18.862 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.732 4.322 -16.307 1.00 0.00 H new ATOM 0 HB3 LEU A 80 7.268 3.707 -17.858 1.00 0.00 H new ATOM 0 HG LEU A 80 8.165 6.163 -18.215 1.00 0.00 H new ATOM 0 HD11 LEU A 80 8.966 7.228 -16.154 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.189 7.167 -16.221 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.080 6.025 -15.188 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.323 5.421 -17.160 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.436 4.161 -16.269 1.00 0.00 H new ATOM 0 HD23 LEU A 80 9.543 4.087 -18.044 1.00 0.00 H new ATOM 1294 N ALA A 81 4.070 3.426 -17.544 1.00 0.00 N ATOM 1295 CA ALA A 81 3.231 2.241 -17.734 1.00 0.00 C ATOM 1296 C ALA A 81 2.483 2.239 -19.059 1.00 0.00 C ATOM 1297 O ALA A 81 2.606 1.280 -19.829 1.00 0.00 O ATOM 1298 CB ALA A 81 2.259 2.124 -16.566 1.00 0.00 C ATOM 0 H ALA A 81 4.049 3.752 -16.578 1.00 0.00 H new ATOM 0 HA ALA A 81 3.891 1.374 -17.764 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.631 1.243 -16.702 1.00 0.00 H new ATOM 0 HB2 ALA A 81 2.818 2.031 -15.635 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.631 3.014 -16.525 1.00 0.00 H new ATOM 1304 N MET A 82 1.730 3.318 -19.309 1.00 0.00 N ATOM 1305 CA MET A 82 0.994 3.530 -20.550 1.00 0.00 C ATOM 1306 C MET A 82 1.820 3.078 -21.748 1.00 0.00 C ATOM 1307 O MET A 82 1.319 2.352 -22.604 1.00 0.00 O ATOM 1308 CB MET A 82 0.672 5.018 -20.731 1.00 0.00 C ATOM 1309 CG MET A 82 -0.422 5.507 -19.783 1.00 0.00 C ATOM 1310 SD MET A 82 -0.902 7.240 -20.013 1.00 0.00 S ATOM 1311 CE MET A 82 0.612 8.085 -19.517 1.00 0.00 C ATOM 0 H MET A 82 1.617 4.078 -18.639 1.00 0.00 H new ATOM 0 HA MET A 82 0.074 2.949 -20.491 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.577 5.603 -20.567 1.00 0.00 H new ATOM 0 HB3 MET A 82 0.360 5.195 -21.760 1.00 0.00 H new ATOM 0 HG2 MET A 82 -1.304 4.879 -19.912 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.082 5.371 -18.756 1.00 0.00 H new ATOM 0 HE1 MET A 82 0.366 9.073 -19.127 1.00 0.00 H new ATOM 0 HE2 MET A 82 1.116 7.505 -18.744 1.00 0.00 H new ATOM 0 HE3 MET A 82 1.270 8.189 -20.380 1.00 0.00 H new ATOM 1321 N ILE A 83 3.074 3.529 -21.784 1.00 0.00 N ATOM 1322 CA ILE A 83 4.012 3.304 -22.860 1.00 0.00 C ATOM 1323 C ILE A 83 4.771 1.999 -22.621 1.00 0.00 C ATOM 1324 O ILE A 83 4.542 1.020 -23.329 1.00 0.00 O ATOM 1325 CB ILE A 83 4.951 4.523 -22.986 1.00 0.00 C ATOM 1326 CG1 ILE A 83 4.186 5.858 -23.096 1.00 0.00 C ATOM 1327 CG2 ILE A 83 5.908 4.350 -24.174 1.00 0.00 C ATOM 1328 CD1 ILE A 83 3.166 5.920 -24.238 1.00 0.00 C ATOM 0 H ILE A 83 3.471 4.084 -21.026 1.00 0.00 H new ATOM 0 HA ILE A 83 3.485 3.198 -23.808 1.00 0.00 H new ATOM 0 HB ILE A 83 5.531 4.567 -22.064 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.669 6.043 -22.155 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.907 6.665 -23.227 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.561 5.220 -24.245 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.512 3.454 -24.028 1.00 0.00 H new ATOM 0 HG23 ILE A 83 5.332 4.253 -25.094 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.678 6.895 -24.237 1.00 0.00 H new ATOM 0 HD12 ILE A 83 3.676 5.770 -25.190 1.00 0.00 H new ATOM 0 HD13 ILE A 83 2.418 5.139 -24.100 1.00 0.00 H new ATOM 1340 N TYR A 84 5.668 1.974 -21.627 1.00 0.00 N ATOM 1341 CA TYR A 84 6.644 0.898 -21.487 1.00 0.00 C ATOM 1342 C TYR A 84 6.046 -0.474 -21.171 1.00 0.00 C ATOM 1343 O TYR A 84 6.691 -1.481 -21.453 1.00 0.00 O ATOM 1344 CB TYR A 84 7.841 1.298 -20.592 1.00 0.00 C ATOM 1345 CG TYR A 84 7.766 1.092 -19.083 1.00 0.00 C ATOM 1346 CD1 TYR A 84 6.538 1.151 -18.401 1.00 0.00 C ATOM 1347 CD2 TYR A 84 8.956 0.949 -18.338 1.00 0.00 C ATOM 1348 CE1 TYR A 84 6.494 0.998 -17.004 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.912 0.831 -16.937 1.00 0.00 C ATOM 1350 CZ TYR A 84 7.675 0.813 -16.276 1.00 0.00 C ATOM 1351 OH TYR A 84 7.605 0.571 -14.941 1.00 0.00 O ATOM 0 H TYR A 84 5.734 2.693 -20.907 1.00 0.00 H new ATOM 0 HA TYR A 84 7.058 0.755 -22.485 1.00 0.00 H new ATOM 0 HB2 TYR A 84 8.712 0.750 -20.951 1.00 0.00 H new ATOM 0 HB3 TYR A 84 8.036 2.356 -20.766 1.00 0.00 H new ATOM 0 HD1 TYR A 84 5.624 1.315 -18.953 1.00 0.00 H new ATOM 0 HD2 TYR A 84 9.908 0.930 -18.848 1.00 0.00 H new ATOM 0 HE1 TYR A 84 5.544 1.023 -16.490 1.00 0.00 H new ATOM 0 HE2 TYR A 84 9.829 0.754 -16.371 1.00 0.00 H new ATOM 0 HH TYR A 84 8.009 -0.300 -14.745 1.00 0.00 H new ATOM 1361 N ASN A 85 4.845 -0.538 -20.578 1.00 0.00 N ATOM 1362 CA ASN A 85 4.214 -1.817 -20.278 1.00 0.00 C ATOM 1363 C ASN A 85 3.319 -2.277 -21.419 1.00 0.00 C ATOM 1364 O ASN A 85 3.504 -3.350 -21.985 1.00 0.00 O ATOM 1365 CB ASN A 85 3.437 -1.755 -18.955 1.00 0.00 C ATOM 1366 CG ASN A 85 2.918 -3.134 -18.549 1.00 0.00 C ATOM 1367 OD1 ASN A 85 3.468 -3.764 -17.654 1.00 0.00 O ATOM 1368 ND2 ASN A 85 1.854 -3.621 -19.184 1.00 0.00 N ATOM 0 H ASN A 85 4.300 0.278 -20.301 1.00 0.00 H new ATOM 0 HA ASN A 85 5.008 -2.556 -20.165 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.083 -1.362 -18.170 1.00 0.00 H new ATOM 0 HB3 ASN A 85 2.600 -1.064 -19.055 1.00 0.00 H new ATOM 0 HD21 ASN A 85 1.482 -4.535 -18.928 1.00 0.00 H new ATOM 0 HD22 ASN A 85 1.411 -3.080 -19.926 1.00 0.00 H new ATOM 1375 N GLU A 86 2.300 -1.464 -21.690 1.00 0.00 N ATOM 1376 CA GLU A 86 1.161 -1.831 -22.528 1.00 0.00 C ATOM 1377 C GLU A 86 1.118 -1.139 -23.891 1.00 0.00 C ATOM 1378 O GLU A 86 0.398 -1.595 -24.782 1.00 0.00 O ATOM 1379 CB GLU A 86 -0.120 -1.541 -21.715 1.00 0.00 C ATOM 1380 CG GLU A 86 -1.026 -2.772 -21.567 1.00 0.00 C ATOM 1381 CD GLU A 86 -1.894 -3.010 -22.787 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -2.842 -2.218 -23.026 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -1.699 -4.043 -23.458 1.00 0.00 O ATOM 0 H GLU A 86 2.242 -0.513 -21.326 1.00 0.00 H new ATOM 0 HA GLU A 86 1.253 -2.889 -22.775 1.00 0.00 H new ATOM 0 HB2 GLU A 86 0.158 -1.180 -20.725 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.679 -0.741 -22.201 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.409 -3.653 -21.388 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.663 -2.646 -20.692 1.00 0.00 H new ATOM 1552 N ALA B 8 -3.116 -9.287 -13.417 1.00 0.00 N ATOM 1553 CA ALA B 8 -2.760 -7.983 -12.861 1.00 0.00 C ATOM 1554 C ALA B 8 -2.826 -6.881 -13.921 1.00 0.00 C ATOM 1555 O ALA B 8 -3.454 -5.842 -13.700 1.00 0.00 O ATOM 1556 CB ALA B 8 -1.371 -8.037 -12.215 1.00 0.00 C ATOM 0 HA ALA B 8 -3.492 -7.738 -12.091 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -1.122 -7.058 -11.806 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -1.371 -8.776 -11.414 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -0.631 -8.316 -12.965 1.00 0.00 H new ATOM 1562 N ILE B 9 -2.191 -7.101 -15.078 1.00 0.00 N ATOM 1563 CA ILE B 9 -2.254 -6.149 -16.182 1.00 0.00 C ATOM 1564 C ILE B 9 -3.712 -5.946 -16.605 1.00 0.00 C ATOM 1565 O ILE B 9 -4.158 -4.813 -16.769 1.00 0.00 O ATOM 1566 CB ILE B 9 -1.352 -6.599 -17.349 1.00 0.00 C ATOM 1567 CG1 ILE B 9 0.135 -6.685 -16.952 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -1.514 -5.672 -18.565 1.00 0.00 C ATOM 1569 CD1 ILE B 9 0.705 -5.419 -16.302 1.00 0.00 C ATOM 0 H ILE B 9 -1.629 -7.931 -15.270 1.00 0.00 H new ATOM 0 HA ILE B 9 -1.869 -5.184 -15.853 1.00 0.00 H new ATOM 0 HB ILE B 9 -1.680 -7.603 -17.617 1.00 0.00 H new ATOM 0 HG12 ILE B 9 0.264 -7.519 -16.262 1.00 0.00 H new ATOM 0 HG13 ILE B 9 0.721 -6.914 -17.842 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -0.866 -6.014 -19.372 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -2.551 -5.689 -18.900 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -1.240 -4.655 -18.286 1.00 0.00 H new ATOM 0 HD11 ILE B 9 1.756 -5.576 -16.059 1.00 0.00 H new ATOM 0 HD12 ILE B 9 0.614 -4.582 -16.994 1.00 0.00 H new ATOM 0 HD13 ILE B 9 0.151 -5.197 -15.390 1.00 0.00 H new ATOM 1581 N GLY B 10 -4.467 -7.034 -16.750 1.00 0.00 N ATOM 1582 CA GLY B 10 -5.893 -7.007 -17.024 1.00 0.00 C ATOM 1583 C GLY B 10 -6.622 -6.099 -16.036 1.00 0.00 C ATOM 1584 O GLY B 10 -7.453 -5.278 -16.426 1.00 0.00 O ATOM 0 H GLY B 10 -4.090 -7.979 -16.677 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -6.065 -6.656 -18.041 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -6.298 -8.017 -16.963 1.00 0.00 H new ATOM 1588 N LEU B 11 -6.301 -6.217 -14.749 1.00 0.00 N ATOM 1589 CA LEU B 11 -6.937 -5.407 -13.735 1.00 0.00 C ATOM 1590 C LEU B 11 -6.560 -3.943 -13.908 1.00 0.00 C ATOM 1591 O LEU B 11 -7.434 -3.113 -14.138 1.00 0.00 O ATOM 1592 CB LEU B 11 -6.607 -5.930 -12.326 1.00 0.00 C ATOM 1593 CG LEU B 11 -7.442 -5.233 -11.237 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -8.812 -5.905 -11.095 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -6.720 -5.270 -9.887 1.00 0.00 C ATOM 0 H LEU B 11 -5.602 -6.869 -14.392 1.00 0.00 H new ATOM 0 HA LEU B 11 -8.018 -5.481 -13.855 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -6.787 -7.004 -12.288 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -5.547 -5.777 -12.122 1.00 0.00 H new ATOM 0 HG LEU B 11 -7.578 -4.195 -11.539 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -9.387 -5.398 -10.320 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -9.347 -5.844 -12.043 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -8.677 -6.951 -10.821 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -7.330 -4.771 -9.134 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -6.554 -6.306 -9.591 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -5.761 -4.759 -9.973 1.00 0.00 H new ATOM 1607 N LEU B 12 -5.278 -3.598 -13.784 1.00 0.00 N ATOM 1608 CA LEU B 12 -4.918 -2.188 -13.809 1.00 0.00 C ATOM 1609 C LEU B 12 -5.144 -1.617 -15.205 1.00 0.00 C ATOM 1610 O LEU B 12 -5.843 -0.621 -15.372 1.00 0.00 O ATOM 1611 CB LEU B 12 -3.472 -1.953 -13.361 1.00 0.00 C ATOM 1612 CG LEU B 12 -3.150 -2.498 -11.960 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -1.671 -2.230 -11.654 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -4.017 -1.854 -10.872 1.00 0.00 C ATOM 0 H LEU B 12 -4.501 -4.249 -13.670 1.00 0.00 H new ATOM 0 HA LEU B 12 -5.562 -1.670 -13.098 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -2.800 -2.417 -14.083 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -3.268 -0.882 -13.378 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.363 -3.567 -11.958 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.430 -2.612 -10.662 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -1.049 -2.730 -12.397 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.482 -1.157 -11.685 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.752 -2.272 -9.901 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.848 -0.777 -10.862 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -5.068 -2.054 -11.078 1.00 0.00 H new ATOM 1626 N ILE B 13 -4.514 -2.207 -16.214 1.00 0.00 N ATOM 1627 CA ILE B 13 -4.504 -1.649 -17.551 1.00 0.00 C ATOM 1628 C ILE B 13 -5.668 -2.180 -18.384 1.00 0.00 C ATOM 1629 O ILE B 13 -6.166 -1.438 -19.223 1.00 0.00 O ATOM 1630 CB ILE B 13 -3.130 -1.788 -18.237 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -1.987 -1.781 -17.202 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -2.979 -0.617 -19.224 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -0.589 -1.651 -17.810 1.00 0.00 C ATOM 0 H ILE B 13 -3.999 -3.083 -16.124 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.663 -0.574 -17.463 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.073 -2.740 -18.765 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.147 -0.956 -16.507 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.033 -2.702 -16.620 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.014 -0.687 -19.727 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -3.778 -0.660 -19.964 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -3.038 0.326 -18.681 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.156 -1.654 -17.014 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.405 -2.489 -18.482 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.520 -0.717 -18.367 1.00 0.00 H new ATOM 1645 N GLY B 14 -6.136 -3.421 -18.190 1.00 0.00 N ATOM 1646 CA GLY B 14 -7.227 -3.936 -19.017 1.00 0.00 C ATOM 1647 C GLY B 14 -8.452 -3.062 -18.796 1.00 0.00 C ATOM 1648 O GLY B 14 -8.887 -2.338 -19.696 1.00 0.00 O ATOM 0 H GLY B 14 -5.785 -4.070 -17.486 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -6.941 -3.929 -20.069 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -7.447 -4.971 -18.753 1.00 0.00 H new ATOM 1652 N ILE B 15 -8.931 -3.054 -17.545 1.00 0.00 N ATOM 1653 CA ILE B 15 -10.020 -2.187 -17.103 1.00 0.00 C ATOM 1654 C ILE B 15 -9.864 -0.777 -17.667 1.00 0.00 C ATOM 1655 O ILE B 15 -10.856 -0.209 -18.119 1.00 0.00 O ATOM 1656 CB ILE B 15 -10.188 -2.193 -15.573 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.517 -3.628 -15.110 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -11.302 -1.226 -15.141 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -10.799 -3.752 -13.612 1.00 0.00 C ATOM 0 H ILE B 15 -8.567 -3.657 -16.807 1.00 0.00 H new ATOM 0 HA ILE B 15 -10.946 -2.596 -17.507 1.00 0.00 H new ATOM 0 HB ILE B 15 -9.259 -1.860 -15.110 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -11.385 -3.987 -15.663 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -9.683 -4.281 -15.367 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -11.402 -1.248 -14.056 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -11.051 -0.215 -15.462 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -12.244 -1.529 -15.598 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -11.021 -4.791 -13.368 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -9.924 -3.426 -13.049 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.653 -3.127 -13.350 1.00 0.00 H new ATOM 1671 N PHE B 16 -8.639 -0.238 -17.701 1.00 0.00 N ATOM 1672 CA PHE B 16 -8.406 1.118 -18.164 1.00 0.00 C ATOM 1673 C PHE B 16 -9.074 1.409 -19.505 1.00 0.00 C ATOM 1674 O PHE B 16 -9.897 2.313 -19.597 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.925 1.492 -18.155 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.677 2.895 -18.655 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.034 4.002 -17.869 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.137 3.090 -19.936 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.862 5.303 -18.372 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -5.863 4.388 -20.393 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.246 5.495 -19.620 1.00 0.00 C ATOM 0 H PHE B 16 -7.795 -0.731 -17.410 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.892 1.771 -17.439 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.537 1.398 -17.141 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -6.372 0.786 -18.775 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.440 3.854 -16.879 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -5.932 2.240 -20.570 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.203 6.154 -17.800 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.359 4.535 -21.337 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.067 6.496 -19.985 1.00 0.00 H new ATOM 1691 N HIS B 17 -8.730 0.634 -20.535 1.00 0.00 N ATOM 1692 CA HIS B 17 -9.358 0.778 -21.845 1.00 0.00 C ATOM 1693 C HIS B 17 -10.599 -0.104 -22.001 1.00 0.00 C ATOM 1694 O HIS B 17 -11.299 0.020 -23.003 1.00 0.00 O ATOM 1695 CB HIS B 17 -8.351 0.659 -23.000 1.00 0.00 C ATOM 1696 CG HIS B 17 -7.194 -0.281 -22.778 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -7.231 -1.493 -22.114 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -5.881 0.024 -23.029 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -5.963 -1.878 -21.928 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -5.120 -1.003 -22.498 1.00 0.00 N ATOM 0 H HIS B 17 -8.021 -0.098 -20.485 1.00 0.00 H new ATOM 0 HA HIS B 17 -9.731 1.800 -21.905 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -8.889 0.337 -23.892 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -7.951 1.651 -23.210 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -5.511 0.899 -23.543 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -5.661 -2.767 -21.395 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -4.104 -1.081 -22.533 1.00 0.00 H new ATOM 1708 N LYS B 18 -10.909 -0.996 -21.054 1.00 0.00 N ATOM 1709 CA LYS B 18 -12.209 -1.656 -21.047 1.00 0.00 C ATOM 1710 C LYS B 18 -13.261 -0.560 -20.858 1.00 0.00 C ATOM 1711 O LYS B 18 -14.175 -0.391 -21.667 1.00 0.00 O ATOM 1712 CB LYS B 18 -12.285 -2.715 -19.936 1.00 0.00 C ATOM 1713 CG LYS B 18 -13.339 -3.783 -20.253 1.00 0.00 C ATOM 1714 CD LYS B 18 -13.624 -4.707 -19.057 1.00 0.00 C ATOM 1715 CE LYS B 18 -12.390 -5.405 -18.461 1.00 0.00 C ATOM 1716 NZ LYS B 18 -11.590 -6.133 -19.464 1.00 0.00 N ATOM 0 H LYS B 18 -10.285 -1.271 -20.295 1.00 0.00 H new ATOM 0 HA LYS B 18 -12.381 -2.189 -21.982 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -11.310 -3.188 -19.815 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -12.526 -2.234 -18.988 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -14.264 -3.295 -20.559 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -13.000 -4.383 -21.098 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -14.105 -4.122 -18.273 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -14.338 -5.469 -19.369 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -11.760 -4.661 -17.975 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.714 -6.103 -17.689 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -10.774 -6.580 -18.999 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -12.178 -6.865 -19.912 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -11.253 -5.468 -20.189 1.00 0.00 H new ATOM 1730 N TYR B 19 -13.089 0.210 -19.788 1.00 0.00 N ATOM 1731 CA TYR B 19 -13.919 1.347 -19.461 1.00 0.00 C ATOM 1732 C TYR B 19 -13.728 2.409 -20.558 1.00 0.00 C ATOM 1733 O TYR B 19 -12.623 2.641 -21.041 1.00 0.00 O ATOM 1734 CB TYR B 19 -13.588 1.792 -18.019 1.00 0.00 C ATOM 1735 CG TYR B 19 -14.094 0.905 -16.872 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -14.671 -0.355 -17.138 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.051 1.362 -15.530 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -15.221 -1.120 -16.101 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.593 0.587 -14.489 1.00 0.00 C ATOM 1740 CZ TYR B 19 -15.200 -0.640 -14.785 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.749 -1.388 -13.799 1.00 0.00 O ATOM 0 H TYR B 19 -12.345 0.049 -19.110 1.00 0.00 H new ATOM 0 HA TYR B 19 -14.986 1.123 -19.454 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -12.504 1.871 -17.931 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -13.993 2.794 -17.874 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.689 -0.733 -18.150 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -13.597 2.316 -15.305 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -15.662 -2.082 -16.317 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -14.541 0.936 -13.468 1.00 0.00 H new ATOM 0 HH TYR B 19 -15.655 -0.920 -12.943 1.00 0.00 H new ATOM 1751 N SER B 20 -14.841 2.960 -21.048 1.00 0.00 N ATOM 1752 CA SER B 20 -14.936 3.816 -22.226 1.00 0.00 C ATOM 1753 C SER B 20 -14.312 3.258 -23.514 1.00 0.00 C ATOM 1754 O SER B 20 -14.070 4.062 -24.416 1.00 0.00 O ATOM 1755 CB SER B 20 -14.341 5.208 -21.969 1.00 0.00 C ATOM 1756 OG SER B 20 -14.976 6.136 -22.838 1.00 0.00 O ATOM 0 H SER B 20 -15.748 2.811 -20.607 1.00 0.00 H new ATOM 0 HA SER B 20 -16.011 3.870 -22.396 1.00 0.00 H new ATOM 0 HB2 SER B 20 -14.491 5.498 -20.929 1.00 0.00 H new ATOM 0 HB3 SER B 20 -13.265 5.199 -22.145 1.00 0.00 H new ATOM 0 HG SER B 20 -14.956 5.792 -23.755 1.00 0.00 H new ATOM 1762 N GLY B 21 -14.029 1.954 -23.640 1.00 0.00 N ATOM 1763 CA GLY B 21 -13.232 1.533 -24.795 1.00 0.00 C ATOM 1764 C GLY B 21 -13.363 0.081 -25.247 1.00 0.00 C ATOM 1765 O GLY B 21 -12.996 -0.220 -26.380 1.00 0.00 O ATOM 0 H GLY B 21 -14.319 1.215 -23.000 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -13.495 2.173 -25.637 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -12.183 1.722 -24.567 1.00 0.00 H new ATOM 1825 N LYS B 26 -6.702 2.842 -27.805 1.00 0.00 N ATOM 1826 CA LYS B 26 -6.288 3.810 -26.799 1.00 0.00 C ATOM 1827 C LYS B 26 -7.517 4.595 -26.331 1.00 0.00 C ATOM 1828 O LYS B 26 -8.052 5.408 -27.083 1.00 0.00 O ATOM 1829 CB LYS B 26 -5.240 4.770 -27.391 1.00 0.00 C ATOM 1830 CG LYS B 26 -3.869 4.131 -27.667 1.00 0.00 C ATOM 1831 CD LYS B 26 -3.768 3.442 -29.040 1.00 0.00 C ATOM 1832 CE LYS B 26 -2.345 2.920 -29.305 1.00 0.00 C ATOM 1833 NZ LYS B 26 -2.035 1.741 -28.477 1.00 0.00 N ATOM 0 HA LYS B 26 -5.841 3.291 -25.951 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -5.629 5.181 -28.323 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -5.105 5.607 -26.705 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -3.100 4.901 -27.600 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -3.656 3.399 -26.888 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -4.475 2.614 -29.086 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -4.050 4.146 -29.823 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -2.242 2.662 -30.359 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -1.623 3.710 -29.098 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -1.068 1.417 -28.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -2.109 1.994 -27.471 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -2.709 0.979 -28.692 1.00 0.00 H new ATOM 1847 N HIS B 27 -7.974 4.369 -25.093 1.00 0.00 N ATOM 1848 CA HIS B 27 -9.138 5.046 -24.533 1.00 0.00 C ATOM 1849 C HIS B 27 -8.879 5.410 -23.073 1.00 0.00 C ATOM 1850 O HIS B 27 -8.500 4.545 -22.289 1.00 0.00 O ATOM 1851 CB HIS B 27 -10.381 4.157 -24.680 1.00 0.00 C ATOM 1852 CG HIS B 27 -10.707 3.855 -26.124 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -10.787 4.805 -27.128 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -10.674 2.620 -26.715 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -10.812 4.160 -28.305 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -10.770 2.837 -28.074 1.00 0.00 N ATOM 0 H HIS B 27 -7.539 3.705 -24.452 1.00 0.00 H new ATOM 0 HA HIS B 27 -9.320 5.971 -25.081 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -10.221 3.222 -24.144 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -11.234 4.650 -24.213 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -10.590 1.666 -26.216 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -10.858 4.627 -29.277 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -10.804 2.110 -28.789 1.00 0.00 H new ATOM 1864 N THR B 28 -9.072 6.688 -22.740 1.00 0.00 N ATOM 1865 CA THR B 28 -9.091 7.234 -21.392 1.00 0.00 C ATOM 1866 C THR B 28 -10.491 7.045 -20.799 1.00 0.00 C ATOM 1867 O THR B 28 -11.409 6.657 -21.522 1.00 0.00 O ATOM 1868 CB THR B 28 -8.738 8.724 -21.516 1.00 0.00 C ATOM 1869 OG1 THR B 28 -9.524 9.293 -22.548 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.272 8.911 -21.918 1.00 0.00 C ATOM 0 H THR B 28 -9.227 7.406 -23.448 1.00 0.00 H new ATOM 0 HA THR B 28 -8.380 6.735 -20.734 1.00 0.00 H new ATOM 0 HB THR B 28 -8.921 9.197 -20.551 1.00 0.00 H new ATOM 0 HG1 THR B 28 -9.309 10.245 -22.636 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.050 9.975 -21.998 1.00 0.00 H new ATOM 0 HG22 THR B 28 -6.627 8.462 -21.163 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.094 8.429 -22.880 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.679 7.350 -19.510 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.985 7.282 -18.869 1.00 0.00 C ATOM 1880 C LEU B 29 -12.565 8.687 -18.704 1.00 0.00 C ATOM 1881 O LEU B 29 -11.826 9.660 -18.532 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.897 6.610 -17.495 1.00 0.00 C ATOM 1883 CG LEU B 29 -11.549 5.115 -17.524 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.049 4.885 -17.701 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -11.965 4.495 -16.188 1.00 0.00 C ATOM 0 H LEU B 29 -9.928 7.650 -18.888 1.00 0.00 H new ATOM 0 HA LEU B 29 -12.636 6.685 -19.508 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -11.147 7.131 -16.900 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.852 6.735 -16.984 1.00 0.00 H new ATOM 0 HG LEU B 29 -12.073 4.662 -18.365 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.844 3.814 -17.716 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.721 5.331 -18.640 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -9.510 5.345 -16.873 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -11.725 3.432 -16.190 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.429 4.986 -15.376 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -13.038 4.625 -16.045 1.00 0.00 H new ATOM 1897 N SER B 30 -13.897 8.757 -18.728 1.00 0.00 N ATOM 1898 CA SER B 30 -14.709 9.913 -18.393 1.00 0.00 C ATOM 1899 C SER B 30 -15.633 9.535 -17.230 1.00 0.00 C ATOM 1900 O SER B 30 -15.717 8.370 -16.827 1.00 0.00 O ATOM 1901 CB SER B 30 -15.476 10.401 -19.639 1.00 0.00 C ATOM 1902 OG SER B 30 -16.151 9.339 -20.285 1.00 0.00 O ATOM 0 H SER B 30 -14.466 7.955 -18.999 1.00 0.00 H new ATOM 0 HA SER B 30 -14.087 10.748 -18.071 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.196 11.166 -19.347 1.00 0.00 H new ATOM 0 HB3 SER B 30 -14.780 10.867 -20.336 1.00 0.00 H new ATOM 0 HG SER B 30 -16.240 8.584 -19.667 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.331 10.522 -16.670 1.00 0.00 N ATOM 1909 CA LYS B 31 -17.099 10.354 -15.446 1.00 0.00 C ATOM 1910 C LYS B 31 -18.070 9.162 -15.510 1.00 0.00 C ATOM 1911 O LYS B 31 -18.368 8.531 -14.496 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.798 11.670 -15.079 1.00 0.00 C ATOM 1913 CG LYS B 31 -18.007 11.762 -13.560 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.507 13.161 -13.183 1.00 0.00 C ATOM 1915 CE LYS B 31 -18.482 13.408 -11.667 1.00 0.00 C ATOM 1916 NZ LYS B 31 -17.109 13.403 -11.124 1.00 0.00 N ATOM 0 H LYS B 31 -16.377 11.464 -17.058 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.403 10.107 -14.644 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -17.200 12.514 -15.422 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -18.759 11.733 -15.589 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -18.728 11.010 -13.238 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.072 11.550 -13.042 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -17.890 13.910 -13.680 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -19.524 13.291 -13.552 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.954 14.366 -11.449 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.072 12.641 -11.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -17.079 13.965 -10.250 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -16.821 12.425 -10.917 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -16.458 13.815 -11.823 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.567 8.842 -16.708 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.573 7.814 -16.922 1.00 0.00 C ATOM 1932 C LYS B 32 -19.115 6.395 -16.571 1.00 0.00 C ATOM 1933 O LYS B 32 -19.952 5.583 -16.166 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.099 7.906 -18.367 1.00 0.00 C ATOM 1935 CG LYS B 32 -19.056 7.426 -19.393 1.00 0.00 C ATOM 1936 CD LYS B 32 -19.404 7.844 -20.831 1.00 0.00 C ATOM 1937 CE LYS B 32 -18.545 7.124 -21.889 1.00 0.00 C ATOM 1938 NZ LYS B 32 -17.098 7.200 -21.601 1.00 0.00 N ATOM 0 H LYS B 32 -18.272 9.303 -17.569 1.00 0.00 H new ATOM 0 HA LYS B 32 -20.383 8.013 -16.221 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.004 7.306 -18.462 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.376 8.937 -18.587 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -18.079 7.830 -19.128 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -18.976 6.340 -19.344 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -20.457 7.634 -21.021 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -19.271 8.921 -20.933 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -18.845 6.078 -21.943 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -18.739 7.563 -22.868 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -16.564 6.805 -22.401 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -16.824 8.193 -21.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -16.886 6.656 -20.741 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.829 6.070 -16.726 1.00 0.00 N ATOM 1953 CA GLU B 33 -17.300 4.798 -16.234 1.00 0.00 C ATOM 1954 C GLU B 33 -16.781 4.964 -14.811 1.00 0.00 C ATOM 1955 O GLU B 33 -16.897 4.029 -14.022 1.00 0.00 O ATOM 1956 CB GLU B 33 -16.250 4.165 -17.152 1.00 0.00 C ATOM 1957 CG GLU B 33 -15.366 5.193 -17.855 1.00 0.00 C ATOM 1958 CD GLU B 33 -16.043 5.790 -19.061 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.796 5.115 -19.792 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -15.771 6.967 -19.344 1.00 0.00 O ATOM 0 H GLU B 33 -17.140 6.666 -17.185 1.00 0.00 H new ATOM 0 HA GLU B 33 -18.130 4.092 -16.232 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.621 3.495 -16.566 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -16.753 3.555 -17.902 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -15.107 5.987 -17.155 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -14.433 4.720 -18.160 1.00 0.00 H new ATOM 1967 N LEU B 34 -16.263 6.144 -14.453 1.00 0.00 N ATOM 1968 CA LEU B 34 -15.929 6.423 -13.060 1.00 0.00 C ATOM 1969 C LEU B 34 -17.125 6.116 -12.164 1.00 0.00 C ATOM 1970 O LEU B 34 -16.949 5.472 -11.137 1.00 0.00 O ATOM 1971 CB LEU B 34 -15.431 7.858 -12.863 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.915 8.033 -13.051 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -13.165 7.567 -11.799 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -13.380 7.326 -14.302 1.00 0.00 C ATOM 0 H LEU B 34 -16.070 6.908 -15.100 1.00 0.00 H new ATOM 0 HA LEU B 34 -15.104 5.770 -12.774 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -15.950 8.510 -13.566 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -15.702 8.190 -11.861 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.736 9.098 -13.201 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -12.093 7.697 -11.948 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -13.487 8.158 -10.941 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -13.381 6.514 -11.616 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.305 7.487 -14.379 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.583 6.257 -14.231 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -13.872 7.731 -15.187 1.00 0.00 H new ATOM 1986 N LYS B 35 -18.344 6.475 -12.583 1.00 0.00 N ATOM 1987 CA LYS B 35 -19.576 6.057 -11.922 1.00 0.00 C ATOM 1988 C LYS B 35 -19.543 4.586 -11.481 1.00 0.00 C ATOM 1989 O LYS B 35 -20.018 4.255 -10.396 1.00 0.00 O ATOM 1990 CB LYS B 35 -20.720 6.304 -12.917 1.00 0.00 C ATOM 1991 CG LYS B 35 -22.101 5.733 -12.548 1.00 0.00 C ATOM 1992 CD LYS B 35 -22.937 5.479 -13.815 1.00 0.00 C ATOM 1993 CE LYS B 35 -22.763 4.072 -14.424 1.00 0.00 C ATOM 1994 NZ LYS B 35 -21.373 3.748 -14.817 1.00 0.00 N ATOM 0 H LYS B 35 -18.499 7.069 -13.398 1.00 0.00 H new ATOM 0 HA LYS B 35 -19.712 6.632 -11.006 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -20.824 7.380 -13.054 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -20.427 5.887 -13.881 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -21.980 4.803 -11.993 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -22.625 6.429 -11.893 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -23.990 5.631 -13.577 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -22.670 6.222 -14.566 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -23.107 3.331 -13.702 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -23.406 3.986 -15.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -21.368 2.884 -15.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -20.975 4.536 -15.368 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -20.797 3.597 -13.964 1.00 0.00 H new ATOM 2008 N GLU B 36 -19.051 3.690 -12.342 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.910 2.282 -12.006 1.00 0.00 C ATOM 2010 C GLU B 36 -17.683 2.067 -11.124 1.00 0.00 C ATOM 2011 O GLU B 36 -17.776 1.482 -10.045 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.860 1.445 -13.289 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.740 -0.043 -12.953 1.00 0.00 C ATOM 2014 CD GLU B 36 -18.900 -0.941 -14.171 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -19.312 -0.416 -15.228 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -18.613 -2.147 -13.994 1.00 0.00 O ATOM 0 H GLU B 36 -18.742 3.925 -13.285 1.00 0.00 H new ATOM 0 HA GLU B 36 -19.776 1.953 -11.432 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.760 1.619 -13.879 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -18.013 1.755 -13.900 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -17.768 -0.230 -12.496 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -19.496 -0.305 -12.213 1.00 0.00 H new ATOM 2023 N LEU B 37 -16.540 2.556 -11.604 1.00 0.00 N ATOM 2024 CA LEU B 37 -15.221 2.390 -11.001 1.00 0.00 C ATOM 2025 C LEU B 37 -15.300 2.657 -9.490 1.00 0.00 C ATOM 2026 O LEU B 37 -14.845 1.856 -8.670 1.00 0.00 O ATOM 2027 CB LEU B 37 -14.221 3.333 -11.692 1.00 0.00 C ATOM 2028 CG LEU B 37 -12.753 2.876 -11.620 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -11.915 3.727 -12.576 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -12.147 3.005 -10.219 1.00 0.00 C ATOM 0 H LEU B 37 -16.509 3.104 -12.464 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.874 1.366 -11.139 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -14.504 3.437 -12.739 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -14.302 4.322 -11.240 1.00 0.00 H new ATOM 0 HG LEU B 37 -12.741 1.821 -11.893 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.874 3.408 -12.529 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.287 3.605 -13.593 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.986 4.776 -12.287 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -11.111 2.666 -10.238 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -12.182 4.047 -9.902 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.716 2.393 -9.519 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.911 3.792 -9.130 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.973 4.264 -7.757 1.00 0.00 C ATOM 2044 C ILE B 38 -16.913 3.437 -6.880 1.00 0.00 C ATOM 2045 O ILE B 38 -16.828 3.519 -5.658 1.00 0.00 O ATOM 2046 CB ILE B 38 -16.317 5.762 -7.693 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -17.787 6.030 -8.074 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.298 6.599 -8.485 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -18.104 7.512 -8.289 1.00 0.00 C ATOM 0 H ILE B 38 -16.378 4.408 -9.795 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.974 4.128 -7.343 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.230 6.092 -6.658 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -18.023 5.481 -8.985 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -18.434 5.639 -7.289 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.566 7.654 -8.422 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -14.303 6.452 -8.066 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -15.302 6.285 -9.529 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -19.155 7.624 -8.554 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -17.900 8.065 -7.372 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -17.483 7.904 -9.094 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.811 2.648 -7.473 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.627 1.708 -6.724 1.00 0.00 C ATOM 2063 C GLN B 39 -17.863 0.391 -6.612 1.00 0.00 C ATOM 2064 O GLN B 39 -17.588 -0.083 -5.510 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.984 1.529 -7.415 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.836 2.795 -7.275 1.00 0.00 C ATOM 2067 CD GLN B 39 -22.176 2.629 -7.978 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -23.150 2.184 -7.382 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -22.241 2.976 -9.259 1.00 0.00 N ATOM 0 H GLN B 39 -17.988 2.647 -8.478 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.826 2.082 -5.720 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.833 1.302 -8.470 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.511 0.680 -6.978 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -20.999 3.013 -6.220 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -20.302 3.646 -7.698 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -21.415 3.344 -9.730 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -23.117 2.875 -9.771 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.530 -0.195 -7.761 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.947 -1.521 -7.854 1.00 0.00 C ATOM 2080 C LYS B 40 -15.434 -1.493 -7.610 1.00 0.00 C ATOM 2081 O LYS B 40 -14.984 -1.793 -6.506 1.00 0.00 O ATOM 2082 CB LYS B 40 -17.286 -2.118 -9.226 1.00 0.00 C ATOM 2083 CG LYS B 40 -18.678 -2.757 -9.275 1.00 0.00 C ATOM 2084 CD LYS B 40 -19.069 -3.230 -10.688 1.00 0.00 C ATOM 2085 CE LYS B 40 -17.967 -4.018 -11.417 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.023 -3.137 -12.137 1.00 0.00 N ATOM 0 H LYS B 40 -17.663 0.252 -8.668 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.371 -2.152 -7.073 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.225 -1.335 -9.982 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -16.539 -2.868 -9.484 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -18.707 -3.606 -8.592 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -19.416 -2.037 -8.921 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -19.960 -3.854 -10.616 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -19.336 -2.361 -11.289 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -17.417 -4.621 -10.694 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.426 -4.709 -12.124 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -16.109 -3.621 -12.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -17.407 -2.911 -13.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.888 -2.258 -11.597 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.649 -1.175 -8.642 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.202 -1.348 -8.672 1.00 0.00 C ATOM 2102 C GLU B 41 -12.459 -0.746 -7.480 1.00 0.00 C ATOM 2103 O GLU B 41 -11.472 -1.329 -7.031 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.651 -0.832 -10.006 1.00 0.00 C ATOM 2105 CG GLU B 41 -12.832 -1.851 -11.141 1.00 0.00 C ATOM 2106 CD GLU B 41 -14.272 -2.266 -11.394 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -15.174 -1.399 -11.289 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -14.513 -3.442 -11.744 1.00 0.00 O ATOM 0 H GLU B 41 -15.019 -0.778 -9.506 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.017 -2.419 -8.584 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -13.155 0.097 -10.270 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.592 -0.599 -9.894 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.422 -1.429 -12.059 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -12.246 -2.741 -10.910 1.00 0.00 H new ATOM 2115 N LEU B 42 -12.906 0.385 -6.926 1.00 0.00 N ATOM 2116 CA LEU B 42 -12.248 0.933 -5.737 1.00 0.00 C ATOM 2117 C LEU B 42 -12.351 0.027 -4.492 1.00 0.00 C ATOM 2118 O LEU B 42 -11.719 0.314 -3.475 1.00 0.00 O ATOM 2119 CB LEU B 42 -12.700 2.371 -5.471 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.329 3.359 -6.592 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.621 4.778 -6.094 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -10.866 3.272 -7.036 1.00 0.00 C ATOM 0 H LEU B 42 -13.699 0.926 -7.270 1.00 0.00 H new ATOM 0 HA LEU B 42 -11.181 0.961 -5.959 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -13.781 2.382 -5.334 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -12.256 2.714 -4.536 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.928 3.099 -7.465 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -12.365 5.497 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -13.680 4.868 -5.851 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.026 4.981 -5.204 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.682 3.998 -7.828 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -10.215 3.487 -6.188 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -10.658 2.269 -7.408 1.00 0.00 H new ATOM 2134 N THR B 43 -13.103 -1.076 -4.563 1.00 0.00 N ATOM 2135 CA THR B 43 -13.122 -2.168 -3.598 1.00 0.00 C ATOM 2136 C THR B 43 -13.193 -1.696 -2.139 1.00 0.00 C ATOM 2137 O THR B 43 -14.238 -1.238 -1.683 1.00 0.00 O ATOM 2138 CB THR B 43 -11.961 -3.133 -3.911 1.00 0.00 C ATOM 2139 OG1 THR B 43 -11.929 -3.421 -5.294 1.00 0.00 O ATOM 2140 CG2 THR B 43 -12.137 -4.484 -3.208 1.00 0.00 C ATOM 0 H THR B 43 -13.747 -1.235 -5.338 1.00 0.00 H new ATOM 0 HA THR B 43 -14.052 -2.725 -3.708 1.00 0.00 H new ATOM 0 HB THR B 43 -11.051 -2.639 -3.570 1.00 0.00 H new ATOM 0 HG1 THR B 43 -11.636 -2.626 -5.787 1.00 0.00 H new ATOM 0 HG21 THR B 43 -11.298 -5.135 -3.455 1.00 0.00 H new ATOM 0 HG22 THR B 43 -12.173 -4.331 -2.129 1.00 0.00 H new ATOM 0 HG23 THR B 43 -13.066 -4.948 -3.539 1.00 0.00 H new ATOM 2148 N ILE B 44 -12.101 -1.825 -1.380 1.00 0.00 N ATOM 2149 CA ILE B 44 -12.087 -1.517 0.042 1.00 0.00 C ATOM 2150 C ILE B 44 -12.181 -0.007 0.285 1.00 0.00 C ATOM 2151 O ILE B 44 -12.576 0.415 1.370 1.00 0.00 O ATOM 2152 CB ILE B 44 -10.893 -2.200 0.741 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -10.818 -3.718 0.484 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -10.879 -1.929 2.253 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -12.072 -4.497 0.898 1.00 0.00 C ATOM 0 H ILE B 44 -11.203 -2.147 -1.741 1.00 0.00 H new ATOM 0 HA ILE B 44 -12.979 -1.937 0.506 1.00 0.00 H new ATOM 0 HB ILE B 44 -10.009 -1.748 0.291 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -10.636 -3.885 -0.578 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -9.961 -4.123 1.022 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -10.022 -2.429 2.704 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -10.808 -0.856 2.430 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -11.798 -2.310 2.699 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -11.931 -5.556 0.681 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -12.246 -4.365 1.966 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -12.932 -4.124 0.342 1.00 0.00 H new ATOM 2167 N GLY B 45 -11.884 0.818 -0.721 1.00 0.00 N ATOM 2168 CA GLY B 45 -12.151 2.243 -0.650 1.00 0.00 C ATOM 2169 C GLY B 45 -13.657 2.477 -0.688 1.00 0.00 C ATOM 2170 O GLY B 45 -14.214 3.158 0.173 1.00 0.00 O ATOM 0 H GLY B 45 -11.456 0.515 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -11.730 2.658 0.266 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -11.671 2.756 -1.483 1.00 0.00 H new ATOM 2373 N ASP B 58 -12.054 10.486 -4.852 1.00 0.00 N ATOM 2374 CA ASP B 58 -12.594 9.771 -6.017 1.00 0.00 C ATOM 2375 C ASP B 58 -13.032 10.675 -7.148 1.00 0.00 C ATOM 2376 O ASP B 58 -12.629 10.493 -8.294 1.00 0.00 O ATOM 2377 CB ASP B 58 -13.616 8.686 -5.609 1.00 0.00 C ATOM 2378 CG ASP B 58 -15.071 9.125 -5.514 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -15.343 10.333 -5.367 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -15.964 8.253 -5.466 1.00 0.00 O ATOM 0 HA ASP B 58 -11.760 9.225 -6.459 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -13.552 7.869 -6.328 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -13.317 8.283 -4.641 1.00 0.00 H new ATOM 2385 N ASP B 59 -13.750 11.732 -6.824 1.00 0.00 N ATOM 2386 CA ASP B 59 -14.129 12.709 -7.812 1.00 0.00 C ATOM 2387 C ASP B 59 -12.920 13.565 -8.233 1.00 0.00 C ATOM 2388 O ASP B 59 -13.106 14.629 -8.799 1.00 0.00 O ATOM 2389 CB ASP B 59 -15.386 13.441 -7.286 1.00 0.00 C ATOM 2390 CG ASP B 59 -15.744 14.767 -7.941 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -16.384 14.733 -9.012 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -15.424 15.801 -7.309 1.00 0.00 O ATOM 0 H ASP B 59 -14.081 11.932 -5.880 1.00 0.00 H new ATOM 0 HA ASP B 59 -14.426 12.266 -8.763 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -16.238 12.770 -7.395 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -15.253 13.617 -6.219 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.661 13.131 -8.035 1.00 0.00 N ATOM 2398 CA LEU B 60 -10.504 13.764 -8.676 1.00 0.00 C ATOM 2399 C LEU B 60 -10.708 13.813 -10.195 1.00 0.00 C ATOM 2400 O LEU B 60 -10.171 14.708 -10.842 1.00 0.00 O ATOM 2401 CB LEU B 60 -9.187 13.043 -8.346 1.00 0.00 C ATOM 2402 CG LEU B 60 -8.523 13.567 -7.060 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -7.454 12.571 -6.593 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -7.853 14.929 -7.283 1.00 0.00 C ATOM 0 H LEU B 60 -11.424 12.342 -7.434 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.428 14.777 -8.281 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -9.380 11.975 -8.240 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -8.495 13.161 -9.180 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.304 13.680 -6.308 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -6.984 12.942 -5.682 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -7.919 11.605 -6.394 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.699 12.457 -7.371 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -7.395 15.266 -6.353 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -7.086 14.836 -8.052 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.601 15.654 -7.603 1.00 0.00 H new ATOM 2416 N ASP B 61 -11.533 12.910 -10.750 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.014 12.986 -12.132 1.00 0.00 C ATOM 2418 C ASP B 61 -12.490 14.390 -12.511 1.00 0.00 C ATOM 2419 O ASP B 61 -12.417 14.797 -13.674 1.00 0.00 O ATOM 2420 CB ASP B 61 -13.108 11.935 -12.372 1.00 0.00 C ATOM 2421 CG ASP B 61 -14.527 12.358 -12.017 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.038 13.335 -12.606 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -15.167 11.689 -11.176 1.00 0.00 O ATOM 0 H ASP B 61 -11.887 12.099 -10.243 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.171 12.766 -12.786 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.087 11.651 -13.424 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -12.861 11.043 -11.796 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.900 15.144 -11.486 1.00 0.00 N ATOM 2429 CA ARG B 62 -13.178 16.585 -11.586 1.00 0.00 C ATOM 2430 C ARG B 62 -12.131 17.374 -12.396 1.00 0.00 C ATOM 2431 O ARG B 62 -12.427 18.491 -12.814 1.00 0.00 O ATOM 2432 CB ARG B 62 -13.396 17.248 -10.216 1.00 0.00 C ATOM 2433 CG ARG B 62 -12.088 17.467 -9.433 1.00 0.00 C ATOM 2434 CD ARG B 62 -12.352 18.016 -8.025 1.00 0.00 C ATOM 2435 NE ARG B 62 -13.087 17.045 -7.199 1.00 0.00 N ATOM 2436 CZ ARG B 62 -12.602 16.210 -6.268 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -11.297 16.162 -5.990 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -13.466 15.421 -5.633 1.00 0.00 N ATOM 0 H ARG B 62 -13.051 14.768 -10.550 1.00 0.00 H new ATOM 0 HA ARG B 62 -14.113 16.632 -12.144 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -13.891 18.208 -10.359 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -14.068 16.628 -9.622 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -11.546 16.524 -9.360 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -11.449 18.160 -9.980 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -11.405 18.261 -7.545 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -12.923 18.942 -8.095 1.00 0.00 H new ATOM 0 HE ARG B 62 -14.094 17.001 -7.354 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -10.646 16.768 -6.490 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -10.951 15.519 -5.278 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.459 15.465 -5.861 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -13.135 14.773 -4.919 1.00 0.00 H new ATOM 2452 N ASN B 63 -10.920 16.825 -12.589 1.00 0.00 N ATOM 2453 CA ASN B 63 -9.883 17.282 -13.517 1.00 0.00 C ATOM 2454 C ASN B 63 -10.460 17.966 -14.763 1.00 0.00 C ATOM 2455 O ASN B 63 -9.901 18.960 -15.218 1.00 0.00 O ATOM 2456 CB ASN B 63 -9.071 16.086 -14.033 1.00 0.00 C ATOM 2457 CG ASN B 63 -8.241 15.340 -12.998 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -7.650 15.940 -12.105 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -8.168 14.019 -13.135 1.00 0.00 N ATOM 0 H ASN B 63 -10.625 16.000 -12.067 1.00 0.00 H new ATOM 0 HA ASN B 63 -9.275 17.989 -12.953 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -9.759 15.378 -14.495 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -8.403 16.439 -14.818 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -7.606 13.469 -12.485 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -8.674 13.556 -13.890 1.00 0.00 H new ATOM 2466 N LYS B 64 -11.546 17.416 -15.322 1.00 0.00 N ATOM 2467 CA LYS B 64 -12.359 17.950 -16.417 1.00 0.00 C ATOM 2468 C LYS B 64 -11.657 18.066 -17.778 1.00 0.00 C ATOM 2469 O LYS B 64 -12.146 17.497 -18.750 1.00 0.00 O ATOM 2470 CB LYS B 64 -13.162 19.215 -16.046 1.00 0.00 C ATOM 2471 CG LYS B 64 -12.370 20.454 -15.587 1.00 0.00 C ATOM 2472 CD LYS B 64 -13.149 21.756 -15.831 1.00 0.00 C ATOM 2473 CE LYS B 64 -12.889 22.290 -17.251 1.00 0.00 C ATOM 2474 NZ LYS B 64 -11.550 22.907 -17.381 1.00 0.00 N ATOM 0 H LYS B 64 -11.904 16.519 -14.994 1.00 0.00 H new ATOM 0 HA LYS B 64 -13.093 17.159 -16.569 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -13.759 19.500 -16.912 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -13.860 18.949 -15.252 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -12.138 20.364 -14.526 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -11.420 20.495 -16.119 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -14.216 21.578 -15.694 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -12.854 22.505 -15.096 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -12.982 21.473 -17.967 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -13.652 23.025 -17.506 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -11.266 22.912 -18.381 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -11.582 23.884 -17.025 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -10.860 22.359 -16.828 1.00 0.00 H new ATOM 2488 N ASP B 65 -10.563 18.828 -17.888 1.00 0.00 N ATOM 2489 CA ASP B 65 -9.914 19.096 -19.174 1.00 0.00 C ATOM 2490 C ASP B 65 -9.478 17.772 -19.803 1.00 0.00 C ATOM 2491 O ASP B 65 -9.624 17.557 -21.005 1.00 0.00 O ATOM 2492 CB ASP B 65 -8.772 20.101 -18.994 1.00 0.00 C ATOM 2493 CG ASP B 65 -9.328 21.411 -18.464 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -9.927 22.180 -19.249 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -9.333 21.597 -17.228 1.00 0.00 O ATOM 0 H ASP B 65 -10.106 19.273 -17.092 1.00 0.00 H new ATOM 0 HA ASP B 65 -10.613 19.563 -19.868 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -8.029 19.703 -18.303 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -8.266 20.267 -19.945 1.00 0.00 H new ATOM 2500 N GLN B 66 -8.962 16.886 -18.954 1.00 0.00 N ATOM 2501 CA GLN B 66 -8.784 15.475 -19.220 1.00 0.00 C ATOM 2502 C GLN B 66 -9.434 14.840 -17.997 1.00 0.00 C ATOM 2503 O GLN B 66 -9.074 15.211 -16.883 1.00 0.00 O ATOM 2504 CB GLN B 66 -7.305 15.094 -19.401 1.00 0.00 C ATOM 2505 CG GLN B 66 -6.375 15.502 -18.247 1.00 0.00 C ATOM 2506 CD GLN B 66 -4.945 15.056 -18.524 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -4.177 15.774 -19.156 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -4.568 13.869 -18.061 1.00 0.00 N ATOM 0 H GLN B 66 -8.645 17.152 -18.022 1.00 0.00 H new ATOM 0 HA GLN B 66 -9.228 15.140 -20.157 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -7.239 14.014 -19.535 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -6.939 15.552 -20.320 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -6.405 16.584 -18.115 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -6.726 15.057 -17.316 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -5.227 13.293 -17.538 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -3.619 13.534 -18.228 1.00 0.00 H new ATOM 2517 N GLU B 67 -10.454 13.998 -18.170 1.00 0.00 N ATOM 2518 CA GLU B 67 -11.204 13.490 -17.031 1.00 0.00 C ATOM 2519 C GLU B 67 -10.326 12.528 -16.228 1.00 0.00 C ATOM 2520 O GLU B 67 -9.807 12.914 -15.179 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.525 12.880 -17.506 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.464 13.974 -18.033 1.00 0.00 C ATOM 2523 CD GLU B 67 -14.773 13.382 -18.524 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -15.541 12.894 -17.665 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -14.967 13.354 -19.757 1.00 0.00 O ATOM 0 H GLU B 67 -10.773 13.659 -19.078 1.00 0.00 H new ATOM 0 HA GLU B 67 -11.474 14.300 -16.353 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -12.333 12.148 -18.291 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.003 12.347 -16.684 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.663 14.698 -17.243 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -12.978 14.514 -18.846 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.121 11.295 -16.713 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.155 10.399 -16.088 1.00 0.00 C ATOM 2534 C VAL B 68 -8.362 9.611 -17.134 1.00 0.00 C ATOM 2535 O VAL B 68 -8.860 8.658 -17.740 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.815 9.457 -15.063 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.777 9.057 -14.014 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.009 10.059 -14.322 1.00 0.00 C ATOM 0 H VAL B 68 -10.605 10.906 -17.522 1.00 0.00 H new ATOM 0 HA VAL B 68 -8.452 11.027 -15.540 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.187 8.610 -15.639 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.236 8.390 -13.284 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.946 8.546 -14.501 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.408 9.949 -13.508 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.410 9.326 -13.622 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -10.688 10.946 -13.775 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -11.781 10.335 -15.040 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.107 10.007 -17.337 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.118 9.242 -18.079 1.00 0.00 C ATOM 2550 C ASN B 69 -5.386 8.311 -17.093 1.00 0.00 C ATOM 2551 O ASN B 69 -5.587 8.391 -15.877 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.219 10.198 -18.881 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.837 9.626 -19.147 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.667 8.833 -20.067 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -2.868 9.954 -18.301 1.00 0.00 N ATOM 0 H ASN B 69 -6.745 10.891 -16.980 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.571 8.593 -18.829 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.700 10.430 -19.831 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.119 11.137 -18.337 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -1.941 9.542 -18.403 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -3.051 10.618 -17.549 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.607 7.357 -17.620 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.031 6.268 -16.842 1.00 0.00 C ATOM 2564 C PHE B 70 -3.218 6.781 -15.662 1.00 0.00 C ATOM 2565 O PHE B 70 -3.289 6.198 -14.587 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.157 5.368 -17.718 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.720 4.081 -17.041 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -3.658 3.059 -16.825 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -1.415 3.936 -16.537 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -3.291 1.876 -16.164 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -1.045 2.746 -15.885 1.00 0.00 C ATOM 2572 CZ PHE B 70 -1.975 1.712 -15.710 1.00 0.00 C ATOM 0 H PHE B 70 -4.360 7.325 -18.609 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.866 5.685 -16.453 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.705 5.120 -18.627 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.271 5.925 -18.022 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -4.673 3.184 -17.171 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.699 4.736 -16.650 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -4.020 1.095 -16.006 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.037 2.628 -15.516 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.679 0.792 -15.227 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.438 7.849 -15.853 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.640 8.412 -14.776 1.00 0.00 C ATOM 2584 C GLN B 71 -2.550 8.782 -13.607 1.00 0.00 C ATOM 2585 O GLN B 71 -2.370 8.256 -12.511 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.787 9.583 -15.286 1.00 0.00 C ATOM 2587 CG GLN B 71 0.030 10.263 -14.173 1.00 0.00 C ATOM 2588 CD GLN B 71 -0.684 11.487 -13.596 1.00 0.00 C ATOM 2589 OE1 GLN B 71 -0.786 12.510 -14.262 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -1.171 11.421 -12.360 1.00 0.00 N ATOM 0 H GLN B 71 -2.347 8.336 -16.745 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.932 7.670 -14.407 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.108 9.221 -16.058 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.437 10.322 -15.754 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.220 9.546 -13.375 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.000 10.564 -14.569 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -1.077 10.561 -11.820 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -1.639 12.231 -11.952 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.529 9.660 -13.826 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.433 10.116 -12.779 1.00 0.00 C ATOM 2601 C GLU B 72 -5.141 8.928 -12.130 1.00 0.00 C ATOM 2602 O GLU B 72 -5.108 8.776 -10.907 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.450 11.125 -13.331 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.803 12.210 -14.201 1.00 0.00 C ATOM 2605 CD GLU B 72 -4.819 11.815 -15.668 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.877 11.107 -16.095 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -5.804 12.184 -16.346 1.00 0.00 O ATOM 0 H GLU B 72 -3.715 10.074 -14.739 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.843 10.623 -12.015 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.199 10.594 -13.919 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.973 11.597 -12.500 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.335 13.152 -14.069 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.776 12.376 -13.877 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.753 8.085 -12.966 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.411 6.839 -12.585 1.00 0.00 C ATOM 2616 C TYR B 73 -5.530 6.069 -11.597 1.00 0.00 C ATOM 2617 O TYR B 73 -5.913 5.815 -10.454 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.682 6.061 -13.884 1.00 0.00 C ATOM 2619 CG TYR B 73 -7.113 4.613 -13.787 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -6.132 3.606 -13.842 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -8.462 4.277 -14.006 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -6.487 2.277 -14.111 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -8.809 2.960 -14.351 1.00 0.00 C ATOM 2624 CZ TYR B 73 -7.821 1.967 -14.419 1.00 0.00 C ATOM 2625 OH TYR B 73 -8.122 0.771 -14.983 1.00 0.00 O ATOM 0 H TYR B 73 -5.804 8.263 -13.969 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.357 7.012 -12.072 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.452 6.599 -14.437 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.774 6.096 -14.486 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -5.095 3.859 -13.675 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -9.230 5.031 -13.909 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -5.740 1.498 -14.082 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -9.838 2.712 -14.564 1.00 0.00 H new ATOM 0 HH TYR B 73 -7.307 0.232 -15.062 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.316 5.733 -12.033 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.339 5.028 -11.227 1.00 0.00 C ATOM 2637 C ILE B 74 -2.997 5.809 -9.962 1.00 0.00 C ATOM 2638 O ILE B 74 -2.847 5.205 -8.907 1.00 0.00 O ATOM 2639 CB ILE B 74 -2.087 4.706 -12.067 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -2.227 3.428 -12.910 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.839 4.599 -11.200 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.680 2.178 -12.144 1.00 0.00 C ATOM 0 H ILE B 74 -3.985 5.950 -12.973 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.773 4.082 -10.902 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.985 5.547 -12.753 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.939 3.619 -13.712 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -1.267 3.217 -13.380 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.022 4.371 -11.828 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.672 5.545 -10.684 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.973 3.804 -10.466 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.746 1.334 -12.831 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.958 1.951 -11.359 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -3.657 2.360 -11.697 1.00 0.00 H new ATOM 2654 N THR B 75 -2.832 7.126 -10.046 1.00 0.00 N ATOM 2655 CA THR B 75 -2.428 7.926 -8.899 1.00 0.00 C ATOM 2656 C THR B 75 -3.488 7.805 -7.801 1.00 0.00 C ATOM 2657 O THR B 75 -3.174 7.515 -6.643 1.00 0.00 O ATOM 2658 CB THR B 75 -2.170 9.377 -9.337 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.229 9.394 -10.394 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.585 10.207 -8.196 1.00 0.00 C ATOM 0 H THR B 75 -2.973 7.662 -10.902 1.00 0.00 H new ATOM 0 HA THR B 75 -1.490 7.558 -8.483 1.00 0.00 H new ATOM 0 HB THR B 75 -3.126 9.799 -9.647 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.599 8.922 -11.169 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.414 11.228 -8.539 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.283 10.217 -7.359 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.640 9.769 -7.875 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.759 7.996 -8.163 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.841 7.930 -7.193 1.00 0.00 C ATOM 2670 C PHE B 76 -6.091 6.498 -6.707 1.00 0.00 C ATOM 2671 O PHE B 76 -6.311 6.287 -5.513 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.036 8.763 -7.646 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.025 8.138 -8.595 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -9.033 7.357 -8.015 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.285 8.806 -9.803 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.367 7.508 -8.444 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.619 9.012 -10.205 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.667 8.439 -9.461 1.00 0.00 C ATOM 0 H PHE B 76 -5.058 8.196 -9.118 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.550 8.422 -6.265 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.581 9.074 -6.755 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.651 9.668 -8.116 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.789 6.643 -7.243 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.470 9.158 -10.418 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -11.153 6.916 -7.998 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.837 9.607 -11.080 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.692 8.709 -9.667 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.976 5.500 -7.589 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.953 4.105 -7.153 1.00 0.00 C ATOM 2690 C LEU B 77 -4.833 3.904 -6.124 1.00 0.00 C ATOM 2691 O LEU B 77 -5.060 3.326 -5.066 1.00 0.00 O ATOM 2692 CB LEU B 77 -5.756 3.163 -8.352 1.00 0.00 C ATOM 2693 CG LEU B 77 -7.028 2.985 -9.195 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -6.665 2.443 -10.581 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.990 1.995 -8.529 1.00 0.00 C ATOM 0 H LEU B 77 -5.898 5.632 -8.597 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.910 3.866 -6.690 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.959 3.553 -8.985 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.428 2.188 -7.991 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.510 3.959 -9.281 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -7.572 2.320 -11.172 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.997 3.144 -11.082 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -6.167 1.479 -10.476 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.883 1.886 -9.144 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -7.501 1.027 -8.424 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.272 2.368 -7.544 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.630 4.394 -6.423 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.445 4.327 -5.579 1.00 0.00 C ATOM 2709 C GLY B 78 -2.697 4.916 -4.192 1.00 0.00 C ATOM 2710 O GLY B 78 -2.329 4.315 -3.181 1.00 0.00 O ATOM 0 H GLY B 78 -3.450 4.872 -7.306 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -2.128 3.289 -5.480 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.627 4.865 -6.058 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.335 6.090 -4.144 1.00 0.00 N ATOM 2715 CA ALA B 79 -3.737 6.708 -2.887 1.00 0.00 C ATOM 2716 C ALA B 79 -4.533 5.718 -2.030 1.00 0.00 C ATOM 2717 O ALA B 79 -4.196 5.486 -0.870 1.00 0.00 O ATOM 2718 CB ALA B 79 -4.527 7.993 -3.152 1.00 0.00 C ATOM 0 H ALA B 79 -3.584 6.631 -4.972 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.843 6.980 -2.326 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -4.820 8.442 -2.203 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -3.905 8.694 -3.709 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -5.419 7.758 -3.733 1.00 0.00 H new ATOM 2724 N LEU B 80 -5.571 5.098 -2.599 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.311 4.067 -1.875 1.00 0.00 C ATOM 2726 C LEU B 80 -5.433 2.854 -1.567 1.00 0.00 C ATOM 2727 O LEU B 80 -5.541 2.291 -0.481 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.565 3.639 -2.644 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.740 4.606 -2.447 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -9.842 4.213 -3.433 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.304 4.551 -1.019 1.00 0.00 C ATOM 0 H LEU B 80 -5.911 5.289 -3.541 1.00 0.00 H new ATOM 0 HA LEU B 80 -6.623 4.504 -0.927 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.329 3.572 -3.706 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.862 2.642 -2.320 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.386 5.622 -2.620 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -10.692 4.885 -3.315 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.461 4.285 -4.452 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.159 3.189 -3.235 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.133 5.252 -0.928 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.657 3.542 -0.806 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.522 4.820 -0.308 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.580 2.445 -2.511 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.716 1.285 -2.370 1.00 0.00 C ATOM 2745 C ALA B 81 -2.922 1.349 -1.072 1.00 0.00 C ATOM 2746 O ALA B 81 -2.891 0.372 -0.332 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.804 1.114 -3.586 1.00 0.00 C ATOM 0 H ALA B 81 -4.474 2.923 -3.406 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.351 0.400 -2.322 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.172 0.237 -3.446 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.412 0.984 -4.481 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.177 1.999 -3.698 1.00 0.00 H new ATOM 2753 N MET B 82 -2.319 2.504 -0.779 1.00 0.00 N ATOM 2754 CA MET B 82 -1.660 2.732 0.503 1.00 0.00 C ATOM 2755 C MET B 82 -2.607 2.359 1.651 1.00 0.00 C ATOM 2756 O MET B 82 -2.350 1.426 2.415 1.00 0.00 O ATOM 2757 CB MET B 82 -1.252 4.210 0.610 1.00 0.00 C ATOM 2758 CG MET B 82 -0.171 4.605 -0.400 1.00 0.00 C ATOM 2759 SD MET B 82 -0.240 6.320 -0.979 1.00 0.00 S ATOM 2760 CE MET B 82 -0.181 7.194 0.597 1.00 0.00 C ATOM 0 H MET B 82 -2.275 3.298 -1.418 1.00 0.00 H new ATOM 0 HA MET B 82 -0.769 2.108 0.570 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.131 4.836 0.457 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.890 4.410 1.619 1.00 0.00 H new ATOM 0 HG2 MET B 82 0.806 4.431 0.052 1.00 0.00 H new ATOM 0 HG3 MET B 82 -0.245 3.944 -1.264 1.00 0.00 H new ATOM 0 HE1 MET B 82 -0.090 8.265 0.416 1.00 0.00 H new ATOM 0 HE2 MET B 82 -1.095 6.997 1.157 1.00 0.00 H new ATOM 0 HE3 MET B 82 0.678 6.849 1.173 1.00 0.00 H new ATOM 2770 N ILE B 83 -3.699 3.117 1.772 1.00 0.00 N ATOM 2771 CA ILE B 83 -4.605 3.061 2.909 1.00 0.00 C ATOM 2772 C ILE B 83 -5.163 1.648 3.088 1.00 0.00 C ATOM 2773 O ILE B 83 -5.074 1.095 4.183 1.00 0.00 O ATOM 2774 CB ILE B 83 -5.696 4.147 2.771 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -5.217 5.505 3.320 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -6.983 3.792 3.533 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -3.948 6.053 2.660 1.00 0.00 C ATOM 0 H ILE B 83 -3.979 3.798 1.066 1.00 0.00 H new ATOM 0 HA ILE B 83 -4.060 3.283 3.826 1.00 0.00 H new ATOM 0 HB ILE B 83 -5.900 4.207 1.702 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -6.018 6.234 3.196 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -5.039 5.406 4.391 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -7.715 4.589 3.402 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -7.390 2.858 3.145 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -6.758 3.677 4.593 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -3.688 7.011 3.111 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -3.129 5.349 2.806 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -4.123 6.190 1.593 1.00 0.00 H new ATOM 2789 N TYR B 84 -5.756 1.063 2.042 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.468 -0.200 2.192 1.00 0.00 C ATOM 2791 C TYR B 84 -5.547 -1.423 2.280 1.00 0.00 C ATOM 2792 O TYR B 84 -6.042 -2.526 2.494 1.00 0.00 O ATOM 2793 CB TYR B 84 -7.630 -0.335 1.189 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.389 -0.423 -0.317 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -6.204 -0.962 -0.856 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -8.481 -0.185 -1.181 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -6.154 -1.344 -2.209 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.377 -0.428 -2.560 1.00 0.00 C ATOM 2799 CZ TYR B 84 -7.218 -1.030 -3.071 1.00 0.00 C ATOM 2800 OH TYR B 84 -7.139 -1.324 -4.399 1.00 0.00 O ATOM 0 H TYR B 84 -5.755 1.442 1.095 1.00 0.00 H new ATOM 0 HA TYR B 84 -6.940 -0.174 3.174 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -8.188 -1.228 1.471 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -8.289 0.518 1.353 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -5.333 -1.082 -0.229 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -9.409 0.189 -0.775 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -5.296 -1.880 -2.586 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -9.184 -0.153 -3.223 1.00 0.00 H new ATOM 0 HH TYR B 84 -7.963 -1.039 -4.847 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.232 -1.243 2.097 1.00 0.00 N ATOM 2811 CA ASN B 85 -3.261 -2.324 2.199 1.00 0.00 C ATOM 2812 C ASN B 85 -2.758 -2.407 3.643 1.00 0.00 C ATOM 2813 O ASN B 85 -3.456 -2.937 4.504 1.00 0.00 O ATOM 2814 CB ASN B 85 -2.189 -2.125 1.121 1.00 0.00 C ATOM 2815 CG ASN B 85 -1.263 -3.321 0.959 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -1.700 -4.424 0.655 1.00 0.00 O ATOM 2817 ND2 ASN B 85 0.034 -3.104 1.118 1.00 0.00 N ATOM 0 H ASN B 85 -3.817 -0.338 1.874 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.694 -3.304 1.996 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -2.677 -1.921 0.168 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -1.594 -1.246 1.369 1.00 0.00 H new ATOM 0 HD21 ASN B 85 0.699 -3.867 0.987 1.00 0.00 H new ATOM 0 HD22 ASN B 85 0.368 -2.174 1.371 1.00 0.00 H new ATOM 2824 N GLU B 86 -1.579 -1.859 3.932 1.00 0.00 N ATOM 2825 CA GLU B 86 -0.999 -1.760 5.267 1.00 0.00 C ATOM 2826 C GLU B 86 -0.530 -0.340 5.574 1.00 0.00 C ATOM 2827 O GLU B 86 0.359 -0.141 6.407 1.00 0.00 O ATOM 2828 CB GLU B 86 0.088 -2.833 5.472 1.00 0.00 C ATOM 2829 CG GLU B 86 0.879 -3.206 4.210 1.00 0.00 C ATOM 2830 CD GLU B 86 1.507 -2.019 3.491 1.00 0.00 C ATOM 2831 OE1 GLU B 86 0.748 -1.206 2.909 1.00 0.00 O ATOM 2832 OE2 GLU B 86 2.749 -1.933 3.530 1.00 0.00 O ATOM 0 H GLU B 86 -0.979 -1.456 3.212 1.00 0.00 H new ATOM 0 HA GLU B 86 -1.777 -1.970 6.001 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.788 -2.480 6.230 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -0.382 -3.734 5.867 1.00 0.00 H new ATOM 0 HG2 GLU B 86 1.666 -3.909 4.483 1.00 0.00 H new ATOM 0 HG3 GLU B 86 0.215 -3.725 3.519 1.00 0.00 H new