USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 75 THR OG1 : rot 72:sc= 2.17 USER MOD Set 1.2: B 64 LYS NZ :NH3+ -170:sc= 3.32 (180deg=2.07) USER MOD Set 1.3: B 71 GLN : amide:sc= 2.8 K(o=9.5,f=-8.6!) USER MOD Set 1.4: B 75 THR OG1 : rot -54:sc= 1.16 USER MOD Set 2.1: B 19 TYR OH : rot -157:sc= 0.764 USER MOD Set 2.2: B 40 LYS NZ :NH3+ 166:sc= 1.78 (180deg=1.19) USER MOD Set 3.1: B 27 HIS : no HD1:sc= -0.273 K(o=-0.19,f=0.51) USER MOD Set 3.2: B 28 THR OG1 : rot 180:sc= 0.0822 USER MOD Set 3.3: B 69 ASN : amide:sc= 0.00436 K(o=-0.19,f=0.64) USER MOD Set 4.1: A 64 LYS NZ :NH3+ -176:sc= 1.83 (180deg=1.62) USER MOD Set 4.2: A 71 GLN : amide:sc= -0.516 K(o=1.3,f=-12!) USER MOD Set 5.1: A 30 SER OG : rot 50:sc= 1.26 USER MOD Set 5.2: A 32 LYS NZ :NH3+ 169:sc= 0.731 (180deg=0.511) USER MOD Set 6.1: A 27 HIS : no HD1:sc= -0.283 X(o=-0.49,f=-0.31) USER MOD Set 6.2: A 28 THR OG1 : rot 180:sc= -0.21 USER MOD Set 7.1: A 18 LYS NZ :NH3+ -134:sc= 2.33 (180deg=-0.732) USER MOD Set 7.2: A 19 TYR OH : rot -176:sc= 2 USER MOD Set 7.3: A 40 LYS NZ :NH3+ -151:sc= 3.56 (180deg=1.4) USER MOD Set 8.1: A 17 HIS : no HD1:sc= -2.7 K(o=-1.7,f=-11!) USER MOD Set 8.2: A 20 SER OG : rot 140:sc= 1 USER MOD Single : A 26 LYS NZ :NH3+ 148:sc= 1.21 (180deg=1.04) USER MOD Single : A 31 LYS NZ :NH3+ 177:sc= 0.755 (180deg=0.706) USER MOD Single : A 35 LYS NZ :NH3+ -133:sc= 1.64 (180deg=-5.08!) USER MOD Single : A 39 GLN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 43 THR OG1 : rot 53:sc= 0.259 USER MOD Single : A 57 MET CE :methyl 177:sc= 0 (180deg=-0.0152) USER MOD Single : A 63 ASN : amide:sc= 0.913 K(o=0.91,f=-0.48) USER MOD Single : A 66 GLN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.883 K(o=0.88,f=-8.1!) USER MOD Single : A 73 TYR OH : rot 141:sc= 1.26 USER MOD Single : A 82 MET CE :methyl -172:sc= -0.0128 (180deg=-0.145) USER MOD Single : A 84 TYR OH : rot 117:sc= 1.23 USER MOD Single : A 85 ASN : amide:sc= 0.622 K(o=0.62,f=-0.41) USER MOD Single : B 17 HIS : no HD1:sc= -2.74 K(o=-2.7,f=-4.9!) USER MOD Single : B 18 LYS NZ :NH3+ -153:sc= 1.24 (180deg=1.1) USER MOD Single : B 20 SER OG : rot -84:sc= 0.851 USER MOD Single : B 26 LYS NZ :NH3+ -116:sc= 0.899 (180deg=-0.512) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ -143:sc= 1.43! (180deg=-3.43!) USER MOD Single : B 32 LYS NZ :NH3+ 177:sc= 2.3 (180deg=2.17) USER MOD Single : B 35 LYS NZ :NH3+ 164:sc= 1.7 (180deg=-0.08!) USER MOD Single : B 39 GLN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : B 43 THR OG1 : rot 180:sc= -0.307 USER MOD Single : B 63 ASN : amide:sc= 0.793 K(o=0.79,f=-0.98) USER MOD Single : B 66 GLN : amide:sc= 0.609 K(o=0.61,f=-0.14) USER MOD Single : B 73 TYR OH : rot 130:sc= 1.16 USER MOD Single : B 82 MET CE :methyl 173:sc= 0 (180deg=-0.0738) USER MOD Single : B 84 TYR OH : rot 171:sc= 1.23 USER MOD Single : B 85 ASN : amide:sc= 0.897 K(o=0.9,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 1.910 -8.528 -2.204 1.00 0.00 N ATOM 114 CA ILE A 9 1.373 -7.176 -2.103 1.00 0.00 C ATOM 115 C ILE A 9 2.350 -6.334 -1.286 1.00 0.00 C ATOM 116 O ILE A 9 2.783 -5.280 -1.745 1.00 0.00 O ATOM 117 CB ILE A 9 -0.042 -7.239 -1.491 1.00 0.00 C ATOM 118 CG1 ILE A 9 -1.038 -8.000 -2.390 1.00 0.00 C ATOM 119 CG2 ILE A 9 -0.599 -5.854 -1.149 1.00 0.00 C ATOM 120 CD1 ILE A 9 -1.403 -7.286 -3.697 1.00 0.00 C ATOM 0 HA ILE A 9 1.270 -6.704 -3.080 1.00 0.00 H new ATOM 0 HB ILE A 9 0.072 -7.795 -0.560 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.615 -8.975 -2.631 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -1.952 -8.180 -1.824 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -1.596 -5.958 -0.722 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.056 -5.367 -0.427 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.653 -5.250 -2.055 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -2.107 -7.897 -4.261 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -1.859 -6.322 -3.470 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.502 -7.130 -4.290 1.00 0.00 H new ATOM 132 N GLY A 10 2.750 -6.822 -0.110 1.00 0.00 N ATOM 133 CA GLY A 10 3.762 -6.188 0.716 1.00 0.00 C ATOM 134 C GLY A 10 4.944 -5.675 -0.102 1.00 0.00 C ATOM 135 O GLY A 10 5.298 -4.503 0.006 1.00 0.00 O ATOM 0 H GLY A 10 2.372 -7.679 0.294 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.314 -5.358 1.262 1.00 0.00 H new ATOM 0 HA3 GLY A 10 4.120 -6.901 1.459 1.00 0.00 H new ATOM 139 N LEU A 11 5.538 -6.526 -0.942 1.00 0.00 N ATOM 140 CA LEU A 11 6.696 -6.170 -1.750 1.00 0.00 C ATOM 141 C LEU A 11 6.464 -4.934 -2.624 1.00 0.00 C ATOM 142 O LEU A 11 7.429 -4.227 -2.896 1.00 0.00 O ATOM 143 CB LEU A 11 7.185 -7.358 -2.593 1.00 0.00 C ATOM 144 CG LEU A 11 7.829 -8.486 -1.766 1.00 0.00 C ATOM 145 CD1 LEU A 11 8.035 -9.711 -2.665 1.00 0.00 C ATOM 146 CD2 LEU A 11 9.185 -8.073 -1.178 1.00 0.00 C ATOM 0 H LEU A 11 5.223 -7.487 -1.078 1.00 0.00 H new ATOM 0 HA LEU A 11 7.483 -5.906 -1.043 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.343 -7.766 -3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.909 -6.998 -3.325 1.00 0.00 H new ATOM 0 HG LEU A 11 7.158 -8.713 -0.938 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.491 -10.514 -2.086 1.00 0.00 H new ATOM 0 HD12 LEU A 11 7.072 -10.044 -3.052 1.00 0.00 H new ATOM 0 HD13 LEU A 11 8.689 -9.447 -3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.600 -8.901 -0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 11 9.869 -7.814 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 11 9.051 -7.210 -0.526 1.00 0.00 H new ATOM 158 N LEU A 12 5.232 -4.609 -3.034 1.00 0.00 N ATOM 159 CA LEU A 12 5.013 -3.362 -3.765 1.00 0.00 C ATOM 160 C LEU A 12 5.441 -2.162 -2.911 1.00 0.00 C ATOM 161 O LEU A 12 6.047 -1.225 -3.436 1.00 0.00 O ATOM 162 CB LEU A 12 3.563 -3.218 -4.260 1.00 0.00 C ATOM 163 CG LEU A 12 3.259 -3.904 -5.604 1.00 0.00 C ATOM 164 CD1 LEU A 12 3.962 -3.225 -6.786 1.00 0.00 C ATOM 165 CD2 LEU A 12 3.577 -5.403 -5.579 1.00 0.00 C ATOM 0 H LEU A 12 4.397 -5.174 -2.877 1.00 0.00 H new ATOM 0 HA LEU A 12 5.637 -3.390 -4.658 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.895 -3.627 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.331 -2.157 -4.351 1.00 0.00 H new ATOM 0 HG LEU A 12 2.185 -3.792 -5.752 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.712 -3.750 -7.708 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.633 -2.188 -6.858 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.041 -3.254 -6.633 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.345 -5.840 -6.550 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.635 -5.547 -5.359 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.977 -5.889 -4.810 1.00 0.00 H new ATOM 177 N ILE A 13 5.157 -2.185 -1.602 1.00 0.00 N ATOM 178 CA ILE A 13 5.649 -1.175 -0.670 1.00 0.00 C ATOM 179 C ILE A 13 7.087 -1.511 -0.232 1.00 0.00 C ATOM 180 O ILE A 13 7.877 -0.609 0.032 1.00 0.00 O ATOM 181 CB ILE A 13 4.658 -0.954 0.496 1.00 0.00 C ATOM 182 CG1 ILE A 13 3.671 0.187 0.156 1.00 0.00 C ATOM 183 CG2 ILE A 13 5.340 -0.720 1.858 1.00 0.00 C ATOM 184 CD1 ILE A 13 2.760 0.663 1.301 1.00 0.00 C ATOM 0 H ILE A 13 4.581 -2.904 -1.165 1.00 0.00 H new ATOM 0 HA ILE A 13 5.705 -0.210 -1.173 1.00 0.00 H new ATOM 0 HB ILE A 13 4.103 -1.885 0.608 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.246 1.041 -0.202 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.040 -0.141 -0.670 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.580 -0.573 2.625 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.950 -1.586 2.113 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.973 0.165 1.801 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.114 1.464 0.943 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.148 -0.169 1.649 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.372 1.032 2.124 1.00 0.00 H new ATOM 196 N GLY A 14 7.454 -2.792 -0.160 1.00 0.00 N ATOM 197 CA GLY A 14 8.799 -3.224 0.192 1.00 0.00 C ATOM 198 C GLY A 14 9.848 -2.603 -0.732 1.00 0.00 C ATOM 199 O GLY A 14 10.776 -1.947 -0.262 1.00 0.00 O ATOM 0 H GLY A 14 6.815 -3.564 -0.348 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.013 -2.947 1.224 1.00 0.00 H new ATOM 0 HA3 GLY A 14 8.860 -4.311 0.134 1.00 0.00 H new ATOM 203 N ILE A 15 9.685 -2.800 -2.046 1.00 0.00 N ATOM 204 CA ILE A 15 10.541 -2.219 -3.072 1.00 0.00 C ATOM 205 C ILE A 15 10.622 -0.712 -2.832 1.00 0.00 C ATOM 206 O ILE A 15 11.676 -0.231 -2.432 1.00 0.00 O ATOM 207 CB ILE A 15 10.019 -2.596 -4.476 1.00 0.00 C ATOM 208 CG1 ILE A 15 10.152 -4.106 -4.761 1.00 0.00 C ATOM 209 CG2 ILE A 15 10.700 -1.790 -5.591 1.00 0.00 C ATOM 210 CD1 ILE A 15 11.589 -4.638 -4.837 1.00 0.00 C ATOM 0 H ILE A 15 8.938 -3.380 -2.427 1.00 0.00 H new ATOM 0 HA ILE A 15 11.554 -2.618 -3.017 1.00 0.00 H new ATOM 0 HB ILE A 15 8.960 -2.340 -4.473 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.621 -4.653 -3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.651 -4.326 -5.704 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.297 -2.093 -6.557 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.513 -0.727 -5.438 1.00 0.00 H new ATOM 0 HG23 ILE A 15 11.774 -1.976 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.570 -5.709 -5.041 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.125 -4.126 -5.636 1.00 0.00 H new ATOM 0 HD13 ILE A 15 12.094 -4.458 -3.888 1.00 0.00 H new ATOM 222 N PHE A 16 9.497 -0.004 -2.987 1.00 0.00 N ATOM 223 CA PHE A 16 9.301 1.399 -2.613 1.00 0.00 C ATOM 224 C PHE A 16 10.197 1.794 -1.433 1.00 0.00 C ATOM 225 O PHE A 16 11.120 2.589 -1.601 1.00 0.00 O ATOM 226 CB PHE A 16 7.792 1.592 -2.377 1.00 0.00 C ATOM 227 CG PHE A 16 7.326 2.702 -1.458 1.00 0.00 C ATOM 228 CD1 PHE A 16 7.364 4.030 -1.911 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.645 2.401 -0.261 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.888 5.065 -1.093 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.973 3.414 0.439 1.00 0.00 C ATOM 232 CZ PHE A 16 6.143 4.759 0.060 1.00 0.00 C ATOM 0 H PHE A 16 8.658 -0.415 -3.397 1.00 0.00 H new ATOM 0 HA PHE A 16 9.612 2.081 -3.405 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.325 1.753 -3.349 1.00 0.00 H new ATOM 0 HB3 PHE A 16 7.398 0.654 -1.985 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.760 4.255 -2.890 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.641 1.390 0.117 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.093 6.094 -1.348 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.327 3.163 1.267 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.705 5.550 0.650 1.00 0.00 H new ATOM 242 N HIS A 17 9.985 1.218 -0.250 1.00 0.00 N ATOM 243 CA HIS A 17 10.732 1.614 0.927 1.00 0.00 C ATOM 244 C HIS A 17 12.172 1.098 1.047 1.00 0.00 C ATOM 245 O HIS A 17 12.901 1.623 1.885 1.00 0.00 O ATOM 246 CB HIS A 17 9.842 1.521 2.177 1.00 0.00 C ATOM 247 CG HIS A 17 9.089 2.800 2.435 1.00 0.00 C ATOM 248 ND1 HIS A 17 9.439 4.043 1.955 1.00 0.00 N ATOM 249 CD2 HIS A 17 7.859 2.908 3.017 1.00 0.00 C ATOM 250 CE1 HIS A 17 8.441 4.884 2.213 1.00 0.00 C ATOM 251 NE2 HIS A 17 7.491 4.240 2.912 1.00 0.00 N ATOM 0 H HIS A 17 9.302 0.478 -0.089 1.00 0.00 H new ATOM 0 HA HIS A 17 10.977 2.669 0.802 1.00 0.00 H new ATOM 0 HB2 HIS A 17 9.133 0.702 2.056 1.00 0.00 H new ATOM 0 HB3 HIS A 17 10.459 1.283 3.044 1.00 0.00 H new ATOM 0 HD2 HIS A 17 7.286 2.113 3.470 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.401 5.920 1.909 1.00 0.00 H new ATOM 0 HE2 HIS A 17 6.645 4.659 3.299 1.00 0.00 H new ATOM 259 N LYS A 18 12.657 0.190 0.192 1.00 0.00 N ATOM 260 CA LYS A 18 14.101 -0.076 0.134 1.00 0.00 C ATOM 261 C LYS A 18 14.817 1.249 -0.161 1.00 0.00 C ATOM 262 O LYS A 18 15.810 1.606 0.475 1.00 0.00 O ATOM 263 CB LYS A 18 14.418 -1.145 -0.930 1.00 0.00 C ATOM 264 CG LYS A 18 15.920 -1.369 -1.211 1.00 0.00 C ATOM 265 CD LYS A 18 16.317 -0.802 -2.588 1.00 0.00 C ATOM 266 CE LYS A 18 17.760 -1.139 -3.004 1.00 0.00 C ATOM 267 NZ LYS A 18 18.096 -0.656 -4.367 1.00 0.00 N ATOM 0 H LYS A 18 12.090 -0.360 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 18 14.452 -0.472 1.087 1.00 0.00 H new ATOM 0 HB2 LYS A 18 13.979 -2.091 -0.613 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.929 -0.863 -1.862 1.00 0.00 H new ATOM 0 HG2 LYS A 18 16.514 -0.891 -0.432 1.00 0.00 H new ATOM 0 HG3 LYS A 18 16.145 -2.435 -1.174 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.631 -1.189 -3.342 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.196 0.281 -2.573 1.00 0.00 H new ATOM 0 HE2 LYS A 18 18.452 -0.698 -2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.902 -2.219 -2.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.581 -1.411 -4.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.223 -0.392 -4.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.719 0.173 -4.297 1.00 0.00 H new ATOM 281 N TYR A 19 14.257 2.022 -1.092 1.00 0.00 N ATOM 282 CA TYR A 19 14.818 3.288 -1.541 1.00 0.00 C ATOM 283 C TYR A 19 14.659 4.412 -0.507 1.00 0.00 C ATOM 284 O TYR A 19 15.048 5.549 -0.769 1.00 0.00 O ATOM 285 CB TYR A 19 14.209 3.625 -2.906 1.00 0.00 C ATOM 286 CG TYR A 19 14.521 2.569 -3.949 1.00 0.00 C ATOM 287 CD1 TYR A 19 15.721 2.613 -4.671 1.00 0.00 C ATOM 288 CD2 TYR A 19 13.689 1.447 -4.083 1.00 0.00 C ATOM 289 CE1 TYR A 19 16.042 1.584 -5.558 1.00 0.00 C ATOM 290 CE2 TYR A 19 14.129 0.320 -4.796 1.00 0.00 C ATOM 291 CZ TYR A 19 15.308 0.397 -5.553 1.00 0.00 C ATOM 292 OH TYR A 19 15.911 -0.725 -6.038 1.00 0.00 O ATOM 0 H TYR A 19 13.385 1.778 -1.561 1.00 0.00 H new ATOM 0 HA TYR A 19 15.898 3.188 -1.652 1.00 0.00 H new ATOM 0 HB2 TYR A 19 13.128 3.725 -2.805 1.00 0.00 H new ATOM 0 HB3 TYR A 19 14.589 4.590 -3.243 1.00 0.00 H new ATOM 0 HD1 TYR A 19 16.398 3.444 -4.541 1.00 0.00 H new ATOM 0 HD2 TYR A 19 12.706 1.450 -3.636 1.00 0.00 H new ATOM 0 HE1 TYR A 19 16.861 1.707 -6.251 1.00 0.00 H new ATOM 0 HE2 TYR A 19 13.564 -0.600 -4.762 1.00 0.00 H new ATOM 0 HH TYR A 19 15.271 -1.467 -6.036 1.00 0.00 H new ATOM 302 N SER A 20 14.120 4.114 0.681 1.00 0.00 N ATOM 303 CA SER A 20 14.148 5.040 1.803 1.00 0.00 C ATOM 304 C SER A 20 15.429 4.894 2.623 1.00 0.00 C ATOM 305 O SER A 20 15.645 5.697 3.531 1.00 0.00 O ATOM 306 CB SER A 20 12.952 4.788 2.715 1.00 0.00 C ATOM 307 OG SER A 20 11.761 5.226 2.100 1.00 0.00 O ATOM 0 H SER A 20 13.657 3.228 0.884 1.00 0.00 H new ATOM 0 HA SER A 20 14.109 6.050 1.394 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.880 3.725 2.945 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.093 5.310 3.662 1.00 0.00 H new ATOM 0 HG SER A 20 11.046 4.579 2.275 1.00 0.00 H new ATOM 376 N LYS A 26 11.833 8.493 5.517 1.00 0.00 N ATOM 377 CA LYS A 26 11.552 7.073 5.651 1.00 0.00 C ATOM 378 C LYS A 26 10.051 6.734 5.571 1.00 0.00 C ATOM 379 O LYS A 26 9.719 5.626 5.146 1.00 0.00 O ATOM 380 CB LYS A 26 12.239 6.475 6.895 1.00 0.00 C ATOM 381 CG LYS A 26 13.755 6.254 6.710 1.00 0.00 C ATOM 382 CD LYS A 26 14.634 7.402 7.232 1.00 0.00 C ATOM 383 CE LYS A 26 16.085 7.297 6.727 1.00 0.00 C ATOM 384 NZ LYS A 26 16.209 7.604 5.285 1.00 0.00 N ATOM 0 HA LYS A 26 11.993 6.588 4.780 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.077 7.138 7.745 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.768 5.523 7.139 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.040 5.334 7.220 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.962 6.108 5.650 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.209 8.355 6.917 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.629 7.395 8.322 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.714 7.982 7.296 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.459 6.290 6.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.133 8.044 5.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.129 6.725 4.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 15.452 8.259 5.003 1.00 0.00 H new ATOM 398 N HIS A 27 9.128 7.643 5.924 1.00 0.00 N ATOM 399 CA HIS A 27 7.712 7.406 5.617 1.00 0.00 C ATOM 400 C HIS A 27 7.522 7.575 4.109 1.00 0.00 C ATOM 401 O HIS A 27 6.740 6.854 3.487 1.00 0.00 O ATOM 402 CB HIS A 27 6.759 8.282 6.450 1.00 0.00 C ATOM 403 CG HIS A 27 6.987 9.772 6.380 1.00 0.00 C ATOM 404 ND1 HIS A 27 6.682 10.602 5.314 1.00 0.00 N ATOM 405 CD2 HIS A 27 7.743 10.486 7.268 1.00 0.00 C ATOM 406 CE1 HIS A 27 7.260 11.794 5.549 1.00 0.00 C ATOM 407 NE2 HIS A 27 7.930 11.735 6.714 1.00 0.00 N ATOM 0 H HIS A 27 9.328 8.520 6.406 1.00 0.00 H new ATOM 0 HA HIS A 27 7.444 6.389 5.902 1.00 0.00 H new ATOM 0 HB2 HIS A 27 5.738 8.077 6.129 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.834 7.973 7.493 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.120 10.139 8.219 1.00 0.00 H new ATOM 0 HE1 HIS A 27 7.196 12.659 4.906 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.484 12.489 7.120 1.00 0.00 H new ATOM 415 N THR A 28 8.275 8.517 3.540 1.00 0.00 N ATOM 416 CA THR A 28 8.494 8.737 2.115 1.00 0.00 C ATOM 417 C THR A 28 9.877 8.144 1.769 1.00 0.00 C ATOM 418 O THR A 28 10.583 7.673 2.663 1.00 0.00 O ATOM 419 CB THR A 28 8.393 10.253 1.833 1.00 0.00 C ATOM 420 OG1 THR A 28 8.541 11.021 3.010 1.00 0.00 O ATOM 421 CG2 THR A 28 7.002 10.625 1.324 1.00 0.00 C ATOM 0 H THR A 28 8.784 9.195 4.107 1.00 0.00 H new ATOM 0 HA THR A 28 7.748 8.248 1.489 1.00 0.00 H new ATOM 0 HB THR A 28 9.180 10.459 1.108 1.00 0.00 H new ATOM 0 HG1 THR A 28 8.472 11.973 2.790 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.959 11.697 1.134 1.00 0.00 H new ATOM 0 HG22 THR A 28 6.796 10.084 0.400 1.00 0.00 H new ATOM 0 HG23 THR A 28 6.257 10.359 2.074 1.00 0.00 H new ATOM 429 N LEU A 29 10.256 8.081 0.488 1.00 0.00 N ATOM 430 CA LEU A 29 11.599 7.672 0.055 1.00 0.00 C ATOM 431 C LEU A 29 12.320 8.869 -0.554 1.00 0.00 C ATOM 432 O LEU A 29 11.738 9.948 -0.564 1.00 0.00 O ATOM 433 CB LEU A 29 11.523 6.434 -0.851 1.00 0.00 C ATOM 434 CG LEU A 29 10.886 6.662 -2.229 1.00 0.00 C ATOM 435 CD1 LEU A 29 11.871 7.258 -3.236 1.00 0.00 C ATOM 436 CD2 LEU A 29 10.401 5.332 -2.806 1.00 0.00 C ATOM 0 H LEU A 29 9.634 8.315 -0.286 1.00 0.00 H new ATOM 0 HA LEU A 29 12.201 7.356 0.907 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.532 6.049 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.958 5.660 -0.332 1.00 0.00 H new ATOM 0 HG LEU A 29 10.063 7.360 -2.076 1.00 0.00 H new ATOM 0 HD11 LEU A 29 11.371 7.400 -4.194 1.00 0.00 H new ATOM 0 HD12 LEU A 29 12.230 8.219 -2.869 1.00 0.00 H new ATOM 0 HD13 LEU A 29 12.715 6.580 -3.364 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.950 5.502 -3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 29 11.246 4.651 -2.909 1.00 0.00 H new ATOM 0 HD23 LEU A 29 9.661 4.893 -2.137 1.00 0.00 H new ATOM 448 N SER A 30 13.570 8.713 -1.021 1.00 0.00 N ATOM 449 CA SER A 30 14.339 9.829 -1.573 1.00 0.00 C ATOM 450 C SER A 30 14.528 9.733 -3.087 1.00 0.00 C ATOM 451 O SER A 30 14.690 8.651 -3.653 1.00 0.00 O ATOM 452 CB SER A 30 15.668 9.998 -0.833 1.00 0.00 C ATOM 453 OG SER A 30 16.373 11.128 -1.329 1.00 0.00 O ATOM 0 H SER A 30 14.066 7.822 -1.025 1.00 0.00 H new ATOM 0 HA SER A 30 13.750 10.732 -1.409 1.00 0.00 H new ATOM 0 HB2 SER A 30 15.484 10.117 0.235 1.00 0.00 H new ATOM 0 HB3 SER A 30 16.275 9.101 -0.954 1.00 0.00 H new ATOM 0 HG SER A 30 15.774 11.903 -1.351 1.00 0.00 H new ATOM 459 N LYS A 31 14.516 10.902 -3.735 1.00 0.00 N ATOM 460 CA LYS A 31 14.592 11.048 -5.182 1.00 0.00 C ATOM 461 C LYS A 31 15.837 10.381 -5.777 1.00 0.00 C ATOM 462 O LYS A 31 15.784 9.839 -6.877 1.00 0.00 O ATOM 463 CB LYS A 31 14.513 12.539 -5.546 1.00 0.00 C ATOM 464 CG LYS A 31 15.733 13.338 -5.063 1.00 0.00 C ATOM 465 CD LYS A 31 15.450 14.847 -5.098 1.00 0.00 C ATOM 466 CE LYS A 31 16.297 15.599 -4.064 1.00 0.00 C ATOM 467 NZ LYS A 31 15.813 15.336 -2.692 1.00 0.00 N ATOM 0 H LYS A 31 14.451 11.796 -3.248 1.00 0.00 H new ATOM 0 HA LYS A 31 13.743 10.527 -5.624 1.00 0.00 H new ATOM 0 HB2 LYS A 31 14.424 12.639 -6.628 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.610 12.967 -5.111 1.00 0.00 H new ATOM 0 HG2 LYS A 31 15.992 13.036 -4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 31 16.594 13.111 -5.692 1.00 0.00 H new ATOM 0 HD2 LYS A 31 15.660 15.235 -6.095 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.392 15.025 -4.903 1.00 0.00 H new ATOM 0 HE2 LYS A 31 17.340 15.293 -4.151 1.00 0.00 H new ATOM 0 HE3 LYS A 31 16.261 16.669 -4.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 16.433 15.815 -2.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 14.843 15.696 -2.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.823 14.312 -2.511 1.00 0.00 H new ATOM 481 N LYS A 32 16.979 10.446 -5.084 1.00 0.00 N ATOM 482 CA LYS A 32 18.217 9.887 -5.618 1.00 0.00 C ATOM 483 C LYS A 32 18.024 8.381 -5.792 1.00 0.00 C ATOM 484 O LYS A 32 18.188 7.831 -6.878 1.00 0.00 O ATOM 485 CB LYS A 32 19.403 10.180 -4.683 1.00 0.00 C ATOM 486 CG LYS A 32 19.598 11.656 -4.319 1.00 0.00 C ATOM 487 CD LYS A 32 20.427 11.810 -3.028 1.00 0.00 C ATOM 488 CE LYS A 32 19.589 11.812 -1.732 1.00 0.00 C ATOM 489 NZ LYS A 32 19.253 10.474 -1.198 1.00 0.00 N ATOM 0 H LYS A 32 17.068 10.876 -4.163 1.00 0.00 H new ATOM 0 HA LYS A 32 18.445 10.348 -6.579 1.00 0.00 H new ATOM 0 HB2 LYS A 32 19.269 9.610 -3.763 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.315 9.815 -5.154 1.00 0.00 H new ATOM 0 HG2 LYS A 32 20.098 12.172 -5.139 1.00 0.00 H new ATOM 0 HG3 LYS A 32 18.626 12.132 -4.189 1.00 0.00 H new ATOM 0 HD2 LYS A 32 21.152 10.998 -2.977 1.00 0.00 H new ATOM 0 HD3 LYS A 32 20.993 12.740 -3.082 1.00 0.00 H new ATOM 0 HE2 LYS A 32 20.134 12.365 -0.967 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.662 12.355 -1.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 18.857 10.571 -0.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 18.553 10.018 -1.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 20.113 9.890 -1.159 1.00 0.00 H new ATOM 503 N GLU A 33 17.624 7.728 -4.707 1.00 0.00 N ATOM 504 CA GLU A 33 17.375 6.307 -4.653 1.00 0.00 C ATOM 505 C GLU A 33 16.260 5.955 -5.647 1.00 0.00 C ATOM 506 O GLU A 33 16.386 4.992 -6.399 1.00 0.00 O ATOM 507 CB GLU A 33 17.088 5.928 -3.191 1.00 0.00 C ATOM 508 CG GLU A 33 18.349 5.992 -2.309 1.00 0.00 C ATOM 509 CD GLU A 33 18.940 7.385 -2.209 1.00 0.00 C ATOM 510 OE1 GLU A 33 18.140 8.344 -2.135 1.00 0.00 O ATOM 511 OE2 GLU A 33 20.182 7.512 -2.258 1.00 0.00 O ATOM 0 H GLU A 33 17.461 8.196 -3.815 1.00 0.00 H new ATOM 0 HA GLU A 33 18.237 5.716 -4.962 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.331 6.599 -2.786 1.00 0.00 H new ATOM 0 HB3 GLU A 33 16.673 4.921 -3.154 1.00 0.00 H new ATOM 0 HG2 GLU A 33 18.103 5.636 -1.308 1.00 0.00 H new ATOM 0 HG3 GLU A 33 19.101 5.314 -2.712 1.00 0.00 H new ATOM 518 N LEU A 34 15.203 6.763 -5.743 1.00 0.00 N ATOM 519 CA LEU A 34 14.192 6.581 -6.786 1.00 0.00 C ATOM 520 C LEU A 34 14.821 6.466 -8.183 1.00 0.00 C ATOM 521 O LEU A 34 14.385 5.658 -9.005 1.00 0.00 O ATOM 522 CB LEU A 34 13.185 7.729 -6.743 1.00 0.00 C ATOM 523 CG LEU A 34 11.945 7.515 -7.623 1.00 0.00 C ATOM 524 CD1 LEU A 34 11.146 6.251 -7.285 1.00 0.00 C ATOM 525 CD2 LEU A 34 11.055 8.736 -7.422 1.00 0.00 C ATOM 0 H LEU A 34 15.025 7.546 -5.114 1.00 0.00 H new ATOM 0 HA LEU A 34 13.675 5.642 -6.588 1.00 0.00 H new ATOM 0 HB2 LEU A 34 12.863 7.876 -5.712 1.00 0.00 H new ATOM 0 HB3 LEU A 34 13.684 8.646 -7.055 1.00 0.00 H new ATOM 0 HG LEU A 34 12.276 7.386 -8.653 1.00 0.00 H new ATOM 0 HD11 LEU A 34 10.287 6.174 -7.952 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.782 5.374 -7.410 1.00 0.00 H new ATOM 0 HD13 LEU A 34 10.800 6.304 -6.253 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.155 8.634 -8.028 1.00 0.00 H new ATOM 0 HD22 LEU A 34 10.777 8.815 -6.371 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.595 9.634 -7.723 1.00 0.00 H new ATOM 537 N LYS A 35 15.866 7.252 -8.462 1.00 0.00 N ATOM 538 CA LYS A 35 16.542 7.192 -9.752 1.00 0.00 C ATOM 539 C LYS A 35 17.382 5.905 -9.896 1.00 0.00 C ATOM 540 O LYS A 35 17.709 5.515 -11.017 1.00 0.00 O ATOM 541 CB LYS A 35 17.280 8.513 -10.018 1.00 0.00 C ATOM 542 CG LYS A 35 16.249 9.660 -10.087 1.00 0.00 C ATOM 543 CD LYS A 35 16.898 11.050 -10.030 1.00 0.00 C ATOM 544 CE LYS A 35 15.940 12.120 -9.475 1.00 0.00 C ATOM 545 NZ LYS A 35 14.632 12.123 -10.156 1.00 0.00 N ATOM 0 H LYS A 35 16.257 7.933 -7.811 1.00 0.00 H new ATOM 0 HA LYS A 35 15.812 7.105 -10.557 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.005 8.705 -9.227 1.00 0.00 H new ATOM 0 HB3 LYS A 35 17.837 8.451 -10.953 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.674 9.570 -11.009 1.00 0.00 H new ATOM 0 HG3 LYS A 35 15.545 9.559 -9.261 1.00 0.00 H new ATOM 0 HD2 LYS A 35 17.791 11.006 -9.406 1.00 0.00 H new ATOM 0 HD3 LYS A 35 17.222 11.339 -11.030 1.00 0.00 H new ATOM 0 HE2 LYS A 35 15.789 11.949 -8.409 1.00 0.00 H new ATOM 0 HE3 LYS A 35 16.401 13.102 -9.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 14.372 13.099 -10.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 14.690 11.550 -11.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 13.910 11.722 -9.523 1.00 0.00 H new ATOM 559 N GLU A 36 17.696 5.204 -8.797 1.00 0.00 N ATOM 560 CA GLU A 36 18.241 3.845 -8.836 1.00 0.00 C ATOM 561 C GLU A 36 17.097 2.865 -9.125 1.00 0.00 C ATOM 562 O GLU A 36 17.241 1.914 -9.894 1.00 0.00 O ATOM 563 CB GLU A 36 18.982 3.505 -7.524 1.00 0.00 C ATOM 564 CG GLU A 36 19.715 2.147 -7.562 1.00 0.00 C ATOM 565 CD GLU A 36 19.209 1.143 -6.530 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.315 1.411 -5.314 1.00 0.00 O ATOM 567 OE2 GLU A 36 18.629 0.112 -6.940 1.00 0.00 O ATOM 0 H GLU A 36 17.577 5.569 -7.852 1.00 0.00 H new ATOM 0 HA GLU A 36 18.981 3.765 -9.633 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.705 4.293 -7.310 1.00 0.00 H new ATOM 0 HB3 GLU A 36 18.265 3.499 -6.703 1.00 0.00 H new ATOM 0 HG2 GLU A 36 19.609 1.715 -8.557 1.00 0.00 H new ATOM 0 HG3 GLU A 36 20.780 2.315 -7.400 1.00 0.00 H new ATOM 574 N LEU A 37 15.949 3.105 -8.494 1.00 0.00 N ATOM 575 CA LEU A 37 14.733 2.309 -8.629 1.00 0.00 C ATOM 576 C LEU A 37 14.338 2.201 -10.105 1.00 0.00 C ATOM 577 O LEU A 37 14.350 1.106 -10.668 1.00 0.00 O ATOM 578 CB LEU A 37 13.615 2.923 -7.763 1.00 0.00 C ATOM 579 CG LEU A 37 12.529 1.942 -7.302 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.655 2.614 -6.233 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.623 1.473 -8.434 1.00 0.00 C ATOM 0 H LEU A 37 15.837 3.889 -7.851 1.00 0.00 H new ATOM 0 HA LEU A 37 14.907 1.295 -8.270 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.069 3.377 -6.882 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.140 3.726 -8.327 1.00 0.00 H new ATOM 0 HG LEU A 37 13.047 1.068 -6.907 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.883 1.918 -5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.274 2.897 -5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.187 3.504 -6.653 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.877 0.782 -8.041 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.122 2.333 -8.879 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.221 0.969 -9.193 1.00 0.00 H new ATOM 593 N ILE A 38 14.005 3.342 -10.728 1.00 0.00 N ATOM 594 CA ILE A 38 13.424 3.411 -12.071 1.00 0.00 C ATOM 595 C ILE A 38 14.124 2.485 -13.068 1.00 0.00 C ATOM 596 O ILE A 38 13.469 1.807 -13.859 1.00 0.00 O ATOM 597 CB ILE A 38 13.363 4.867 -12.580 1.00 0.00 C ATOM 598 CG1 ILE A 38 12.599 4.933 -13.916 1.00 0.00 C ATOM 599 CG2 ILE A 38 14.757 5.489 -12.729 1.00 0.00 C ATOM 600 CD1 ILE A 38 12.509 6.341 -14.509 1.00 0.00 C ATOM 0 H ILE A 38 14.136 4.259 -10.301 1.00 0.00 H new ATOM 0 HA ILE A 38 12.400 3.045 -11.990 1.00 0.00 H new ATOM 0 HB ILE A 38 12.829 5.451 -11.831 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.088 4.277 -14.636 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.591 4.547 -13.766 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.662 6.513 -13.090 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.260 5.490 -11.762 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.341 4.906 -13.441 1.00 0.00 H new ATOM 0 HD11 ILE A 38 11.957 6.306 -15.448 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.993 6.998 -13.809 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.513 6.723 -14.692 1.00 0.00 H new ATOM 612 N GLN A 39 15.458 2.479 -13.033 1.00 0.00 N ATOM 613 CA GLN A 39 16.281 1.753 -13.980 1.00 0.00 C ATOM 614 C GLN A 39 15.914 0.267 -14.035 1.00 0.00 C ATOM 615 O GLN A 39 15.787 -0.277 -15.130 1.00 0.00 O ATOM 616 CB GLN A 39 17.760 1.959 -13.629 1.00 0.00 C ATOM 617 CG GLN A 39 18.205 3.403 -13.893 1.00 0.00 C ATOM 618 CD GLN A 39 19.655 3.615 -13.466 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.573 3.137 -14.121 1.00 0.00 O ATOM 620 NE2 GLN A 39 19.878 4.329 -12.369 1.00 0.00 N ATOM 0 H GLN A 39 15.997 2.988 -12.333 1.00 0.00 H new ATOM 0 HA GLN A 39 16.096 2.148 -14.979 1.00 0.00 H new ATOM 0 HB2 GLN A 39 17.924 1.713 -12.580 1.00 0.00 H new ATOM 0 HB3 GLN A 39 18.373 1.275 -14.216 1.00 0.00 H new ATOM 0 HG2 GLN A 39 18.097 3.633 -14.953 1.00 0.00 H new ATOM 0 HG3 GLN A 39 17.558 4.092 -13.350 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.094 4.715 -11.843 1.00 0.00 H new ATOM 0 HE22 GLN A 39 20.834 4.492 -12.052 1.00 0.00 H new ATOM 629 N LYS A 40 15.806 -0.396 -12.876 1.00 0.00 N ATOM 630 CA LYS A 40 15.534 -1.830 -12.834 1.00 0.00 C ATOM 631 C LYS A 40 14.036 -2.121 -12.716 1.00 0.00 C ATOM 632 O LYS A 40 13.368 -2.334 -13.727 1.00 0.00 O ATOM 633 CB LYS A 40 16.378 -2.563 -11.778 1.00 0.00 C ATOM 634 CG LYS A 40 17.885 -2.332 -11.922 1.00 0.00 C ATOM 635 CD LYS A 40 18.408 -1.148 -11.094 1.00 0.00 C ATOM 636 CE LYS A 40 18.292 -1.348 -9.571 1.00 0.00 C ATOM 637 NZ LYS A 40 17.157 -0.628 -8.952 1.00 0.00 N ATOM 0 H LYS A 40 15.903 0.041 -11.959 1.00 0.00 H new ATOM 0 HA LYS A 40 15.852 -2.241 -13.792 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.063 -2.239 -10.786 1.00 0.00 H new ATOM 0 HB3 LYS A 40 16.176 -3.632 -11.843 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.413 -3.237 -11.621 1.00 0.00 H new ATOM 0 HG3 LYS A 40 18.119 -2.161 -12.973 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.453 -0.974 -11.349 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.858 -0.250 -11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.190 -2.413 -9.362 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.218 -1.018 -9.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.393 -0.389 -7.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 16.968 0.245 -9.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 16.312 -1.233 -8.968 1.00 0.00 H new ATOM 651 N GLU A 41 13.512 -2.152 -11.485 1.00 0.00 N ATOM 652 CA GLU A 41 12.181 -2.669 -11.197 1.00 0.00 C ATOM 653 C GLU A 41 11.092 -2.086 -12.095 1.00 0.00 C ATOM 654 O GLU A 41 10.253 -2.821 -12.617 1.00 0.00 O ATOM 655 CB GLU A 41 11.849 -2.470 -9.714 1.00 0.00 C ATOM 656 CG GLU A 41 12.869 -3.174 -8.807 1.00 0.00 C ATOM 657 CD GLU A 41 13.917 -2.233 -8.237 1.00 0.00 C ATOM 658 OE1 GLU A 41 14.676 -1.629 -9.031 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.973 -2.133 -6.995 1.00 0.00 O ATOM 0 H GLU A 41 14.008 -1.815 -10.660 1.00 0.00 H new ATOM 0 HA GLU A 41 12.201 -3.736 -11.421 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.831 -1.405 -9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.851 -2.857 -9.509 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.341 -3.659 -7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.367 -3.961 -9.374 1.00 0.00 H new ATOM 666 N LEU A 42 11.098 -0.767 -12.308 1.00 0.00 N ATOM 667 CA LEU A 42 10.028 -0.145 -13.075 1.00 0.00 C ATOM 668 C LEU A 42 10.063 -0.515 -14.559 1.00 0.00 C ATOM 669 O LEU A 42 9.175 -0.091 -15.290 1.00 0.00 O ATOM 670 CB LEU A 42 9.963 1.371 -12.862 1.00 0.00 C ATOM 671 CG LEU A 42 9.924 1.777 -11.380 1.00 0.00 C ATOM 672 CD1 LEU A 42 9.521 3.251 -11.282 1.00 0.00 C ATOM 673 CD2 LEU A 42 8.960 0.938 -10.530 1.00 0.00 C ATOM 0 H LEU A 42 11.815 -0.127 -11.967 1.00 0.00 H new ATOM 0 HA LEU A 42 9.101 -0.560 -12.681 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.828 1.835 -13.336 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.078 1.763 -13.362 1.00 0.00 H new ATOM 0 HG LEU A 42 10.923 1.602 -10.980 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.490 3.551 -10.235 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.250 3.863 -11.813 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.536 3.389 -11.728 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.989 1.285 -9.497 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.947 1.042 -10.919 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.258 -0.110 -10.569 1.00 0.00 H new ATOM 685 N THR A 43 11.038 -1.310 -15.017 1.00 0.00 N ATOM 686 CA THR A 43 11.017 -1.921 -16.343 1.00 0.00 C ATOM 687 C THR A 43 11.057 -0.855 -17.451 1.00 0.00 C ATOM 688 O THR A 43 10.538 -1.042 -18.549 1.00 0.00 O ATOM 689 CB THR A 43 9.815 -2.889 -16.422 1.00 0.00 C ATOM 690 OG1 THR A 43 9.787 -3.710 -15.265 1.00 0.00 O ATOM 691 CG2 THR A 43 9.877 -3.850 -17.611 1.00 0.00 C ATOM 0 H THR A 43 11.867 -1.546 -14.471 1.00 0.00 H new ATOM 0 HA THR A 43 11.917 -2.513 -16.510 1.00 0.00 H new ATOM 0 HB THR A 43 8.937 -2.251 -16.520 1.00 0.00 H new ATOM 0 HG1 THR A 43 9.822 -3.147 -14.464 1.00 0.00 H new ATOM 0 HG21 THR A 43 9.001 -4.498 -17.601 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.895 -3.279 -18.539 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.779 -4.458 -17.541 1.00 0.00 H new ATOM 699 N ILE A 44 11.727 0.271 -17.181 1.00 0.00 N ATOM 700 CA ILE A 44 11.817 1.373 -18.131 1.00 0.00 C ATOM 701 C ILE A 44 12.492 0.922 -19.432 1.00 0.00 C ATOM 702 O ILE A 44 12.104 1.343 -20.521 1.00 0.00 O ATOM 703 CB ILE A 44 12.509 2.580 -17.464 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.425 3.863 -18.307 1.00 0.00 C ATOM 705 CG2 ILE A 44 13.981 2.302 -17.126 1.00 0.00 C ATOM 706 CD1 ILE A 44 10.981 4.304 -18.547 1.00 0.00 C ATOM 0 H ILE A 44 12.217 0.438 -16.302 1.00 0.00 H new ATOM 0 HA ILE A 44 10.816 1.697 -18.416 1.00 0.00 H new ATOM 0 HB ILE A 44 11.955 2.737 -16.539 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.968 4.663 -17.803 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.917 3.698 -19.266 1.00 0.00 H new ATOM 0 HG21 ILE A 44 14.420 3.184 -16.659 1.00 0.00 H new ATOM 0 HG22 ILE A 44 14.043 1.458 -16.439 1.00 0.00 H new ATOM 0 HG23 ILE A 44 14.526 2.067 -18.040 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.973 5.214 -19.147 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.443 3.517 -19.075 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.495 4.496 -17.590 1.00 0.00 H new ATOM 888 N LEU A 56 15.960 12.086 -18.745 1.00 0.00 N ATOM 889 CA LEU A 56 15.631 13.371 -18.138 1.00 0.00 C ATOM 890 C LEU A 56 14.105 13.548 -18.137 1.00 0.00 C ATOM 891 O LEU A 56 13.505 13.851 -17.105 1.00 0.00 O ATOM 892 CB LEU A 56 16.364 14.503 -18.881 1.00 0.00 C ATOM 893 CG LEU A 56 16.716 15.711 -17.996 1.00 0.00 C ATOM 894 CD1 LEU A 56 17.499 16.726 -18.839 1.00 0.00 C ATOM 895 CD2 LEU A 56 15.482 16.397 -17.400 1.00 0.00 C ATOM 0 HA LEU A 56 15.968 13.406 -17.102 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.281 14.104 -19.314 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.742 14.842 -19.709 1.00 0.00 H new ATOM 0 HG LEU A 56 17.311 15.343 -17.160 1.00 0.00 H new ATOM 0 HD11 LEU A 56 17.756 17.589 -18.224 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.412 16.262 -19.212 1.00 0.00 H new ATOM 0 HD13 LEU A 56 16.886 17.050 -19.681 1.00 0.00 H new ATOM 0 HD21 LEU A 56 15.796 17.241 -16.786 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.839 16.753 -18.205 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.932 15.685 -16.784 1.00 0.00 H new ATOM 907 N MET A 57 13.448 13.316 -19.279 1.00 0.00 N ATOM 908 CA MET A 57 11.993 13.378 -19.362 1.00 0.00 C ATOM 909 C MET A 57 11.324 12.403 -18.380 1.00 0.00 C ATOM 910 O MET A 57 10.359 12.791 -17.721 1.00 0.00 O ATOM 911 CB MET A 57 11.515 13.195 -20.811 1.00 0.00 C ATOM 912 CG MET A 57 10.003 13.425 -20.964 1.00 0.00 C ATOM 913 SD MET A 57 9.336 15.004 -20.368 1.00 0.00 S ATOM 914 CE MET A 57 10.270 16.175 -21.378 1.00 0.00 C ATOM 0 H MET A 57 13.907 13.083 -20.159 1.00 0.00 H new ATOM 0 HA MET A 57 11.678 14.375 -19.053 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.052 13.888 -21.458 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.762 12.188 -21.148 1.00 0.00 H new ATOM 0 HG2 MET A 57 9.753 13.331 -22.021 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.485 12.621 -20.441 1.00 0.00 H new ATOM 0 HE1 MET A 57 9.933 17.189 -21.165 1.00 0.00 H new ATOM 0 HE2 MET A 57 11.332 16.089 -21.146 1.00 0.00 H new ATOM 0 HE3 MET A 57 10.110 15.954 -22.433 1.00 0.00 H new ATOM 924 N ASP A 58 11.856 11.184 -18.225 1.00 0.00 N ATOM 925 CA ASP A 58 11.374 10.188 -17.266 1.00 0.00 C ATOM 926 C ASP A 58 11.655 10.540 -15.823 1.00 0.00 C ATOM 927 O ASP A 58 11.177 9.828 -14.944 1.00 0.00 O ATOM 928 CB ASP A 58 11.967 8.792 -17.515 1.00 0.00 C ATOM 929 CG ASP A 58 11.764 8.173 -18.881 1.00 0.00 C ATOM 930 OD1 ASP A 58 10.635 8.135 -19.417 1.00 0.00 O ATOM 931 OD2 ASP A 58 12.745 7.587 -19.381 1.00 0.00 O ATOM 0 H ASP A 58 12.650 10.858 -18.776 1.00 0.00 H new ATOM 0 HA ASP A 58 10.297 10.182 -17.431 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.039 8.845 -17.327 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.547 8.112 -16.773 1.00 0.00 H new ATOM 936 N ASP A 59 12.296 11.668 -15.540 1.00 0.00 N ATOM 937 CA ASP A 59 12.379 12.199 -14.189 1.00 0.00 C ATOM 938 C ASP A 59 10.998 12.698 -13.697 1.00 0.00 C ATOM 939 O ASP A 59 10.913 13.702 -12.999 1.00 0.00 O ATOM 940 CB ASP A 59 13.508 13.242 -14.116 1.00 0.00 C ATOM 941 CG ASP A 59 14.249 13.134 -12.804 1.00 0.00 C ATOM 942 OD1 ASP A 59 15.032 12.167 -12.671 1.00 0.00 O ATOM 943 OD2 ASP A 59 14.024 13.960 -11.891 1.00 0.00 O ATOM 0 H ASP A 59 12.771 12.237 -16.240 1.00 0.00 H new ATOM 0 HA ASP A 59 12.647 11.409 -13.487 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.201 13.094 -14.944 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.092 14.244 -14.223 1.00 0.00 H new ATOM 948 N LEU A 60 9.884 12.132 -14.193 1.00 0.00 N ATOM 949 CA LEU A 60 8.507 12.532 -13.915 1.00 0.00 C ATOM 950 C LEU A 60 8.200 12.518 -12.418 1.00 0.00 C ATOM 951 O LEU A 60 7.313 13.245 -11.976 1.00 0.00 O ATOM 952 CB LEU A 60 7.521 11.595 -14.636 1.00 0.00 C ATOM 953 CG LEU A 60 7.582 11.628 -16.170 1.00 0.00 C ATOM 954 CD1 LEU A 60 6.736 10.481 -16.734 1.00 0.00 C ATOM 955 CD2 LEU A 60 7.072 12.952 -16.745 1.00 0.00 C ATOM 0 H LEU A 60 9.931 11.340 -14.834 1.00 0.00 H new ATOM 0 HA LEU A 60 8.391 13.552 -14.282 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.708 10.574 -14.304 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.509 11.851 -14.324 1.00 0.00 H new ATOM 0 HG LEU A 60 8.628 11.521 -16.459 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.776 10.501 -17.823 1.00 0.00 H new ATOM 0 HD12 LEU A 60 7.127 9.529 -16.373 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.703 10.596 -16.407 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.136 12.925 -17.833 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.035 13.103 -16.446 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.682 13.772 -16.366 1.00 0.00 H new ATOM 967 N ASP A 61 8.942 11.736 -11.629 1.00 0.00 N ATOM 968 CA ASP A 61 8.911 11.788 -10.174 1.00 0.00 C ATOM 969 C ASP A 61 9.137 13.201 -9.660 1.00 0.00 C ATOM 970 O ASP A 61 8.713 13.542 -8.554 1.00 0.00 O ATOM 971 CB ASP A 61 10.006 10.902 -9.601 1.00 0.00 C ATOM 972 CG ASP A 61 11.401 11.247 -10.097 1.00 0.00 C ATOM 973 OD1 ASP A 61 11.593 11.165 -11.325 1.00 0.00 O ATOM 974 OD2 ASP A 61 12.267 11.574 -9.255 1.00 0.00 O ATOM 0 H ASP A 61 9.591 11.039 -11.995 1.00 0.00 H new ATOM 0 HA ASP A 61 7.926 11.444 -9.859 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.989 10.977 -8.514 1.00 0.00 H new ATOM 0 HB3 ASP A 61 9.788 9.864 -9.852 1.00 0.00 H new ATOM 979 N ARG A 62 9.774 14.034 -10.485 1.00 0.00 N ATOM 980 CA ARG A 62 9.895 15.457 -10.168 1.00 0.00 C ATOM 981 C ARG A 62 8.540 16.133 -9.868 1.00 0.00 C ATOM 982 O ARG A 62 8.539 17.216 -9.287 1.00 0.00 O ATOM 983 CB ARG A 62 10.693 16.227 -11.233 1.00 0.00 C ATOM 984 CG ARG A 62 9.829 16.689 -12.416 1.00 0.00 C ATOM 985 CD ARG A 62 10.689 17.322 -13.519 1.00 0.00 C ATOM 986 NE ARG A 62 11.284 16.303 -14.398 1.00 0.00 N ATOM 987 CZ ARG A 62 10.615 15.647 -15.361 1.00 0.00 C ATOM 988 NH1 ARG A 62 9.318 15.900 -15.556 1.00 0.00 N ATOM 989 NH2 ARG A 62 11.220 14.747 -16.135 1.00 0.00 N ATOM 0 H ARG A 62 10.208 13.753 -11.364 1.00 0.00 H new ATOM 0 HA ARG A 62 10.467 15.501 -9.241 1.00 0.00 H new ATOM 0 HB2 ARG A 62 11.160 17.097 -10.770 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.498 15.593 -11.604 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.280 15.839 -12.822 1.00 0.00 H new ATOM 0 HG3 ARG A 62 9.089 17.410 -12.069 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.077 18.002 -14.112 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.481 17.919 -13.066 1.00 0.00 H new ATOM 0 HE ARG A 62 12.271 16.080 -14.268 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.840 16.589 -14.975 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.806 15.405 -16.286 1.00 0.00 H new ATOM 0 HH21 ARG A 62 12.211 14.544 -16.002 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.692 14.261 -16.860 1.00 0.00 H new ATOM 1003 N ASN A 63 7.417 15.517 -10.277 1.00 0.00 N ATOM 1004 CA ASN A 63 6.041 16.018 -10.227 1.00 0.00 C ATOM 1005 C ASN A 63 5.783 17.019 -9.097 1.00 0.00 C ATOM 1006 O ASN A 63 5.465 18.173 -9.378 1.00 0.00 O ATOM 1007 CB ASN A 63 5.081 14.824 -10.115 1.00 0.00 C ATOM 1008 CG ASN A 63 3.618 15.252 -10.022 1.00 0.00 C ATOM 1009 OD1 ASN A 63 3.214 16.256 -10.599 1.00 0.00 O ATOM 1010 ND2 ASN A 63 2.804 14.490 -9.304 1.00 0.00 N ATOM 0 H ASN A 63 7.456 14.582 -10.683 1.00 0.00 H new ATOM 0 HA ASN A 63 5.868 16.571 -11.150 1.00 0.00 H new ATOM 0 HB2 ASN A 63 5.211 14.175 -10.981 1.00 0.00 H new ATOM 0 HB3 ASN A 63 5.340 14.236 -9.235 1.00 0.00 H new ATOM 0 HD21 ASN A 63 1.817 14.734 -9.222 1.00 0.00 H new ATOM 0 HD22 ASN A 63 3.165 13.660 -8.834 1.00 0.00 H new ATOM 1017 N LYS A 64 5.921 16.599 -7.833 1.00 0.00 N ATOM 1018 CA LYS A 64 5.912 17.550 -6.727 1.00 0.00 C ATOM 1019 C LYS A 64 6.746 17.071 -5.537 1.00 0.00 C ATOM 1020 O LYS A 64 7.633 17.786 -5.072 1.00 0.00 O ATOM 1021 CB LYS A 64 4.485 18.030 -6.369 1.00 0.00 C ATOM 1022 CG LYS A 64 3.644 17.268 -5.326 1.00 0.00 C ATOM 1023 CD LYS A 64 3.066 15.916 -5.775 1.00 0.00 C ATOM 1024 CE LYS A 64 2.016 15.439 -4.748 1.00 0.00 C ATOM 1025 NZ LYS A 64 1.927 13.968 -4.689 1.00 0.00 N ATOM 0 H LYS A 64 6.038 15.624 -7.559 1.00 0.00 H new ATOM 0 HA LYS A 64 6.422 18.450 -7.072 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.569 19.061 -6.024 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.910 18.049 -7.295 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.262 17.100 -4.444 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.817 17.909 -5.019 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.609 16.013 -6.760 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.864 15.179 -5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.272 15.826 -3.762 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.041 15.851 -5.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 1.164 13.692 -4.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.724 13.594 -5.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.830 13.579 -4.349 1.00 0.00 H new ATOM 1039 N ASP A 65 6.472 15.859 -5.051 1.00 0.00 N ATOM 1040 CA ASP A 65 7.021 15.381 -3.791 1.00 0.00 C ATOM 1041 C ASP A 65 8.527 15.156 -3.892 1.00 0.00 C ATOM 1042 O ASP A 65 9.254 15.532 -2.976 1.00 0.00 O ATOM 1043 CB ASP A 65 6.291 14.112 -3.326 1.00 0.00 C ATOM 1044 CG ASP A 65 4.830 14.365 -2.972 1.00 0.00 C ATOM 1045 OD1 ASP A 65 4.511 15.478 -2.507 1.00 0.00 O ATOM 1046 OD2 ASP A 65 4.013 13.451 -3.216 1.00 0.00 O ATOM 0 H ASP A 65 5.865 15.187 -5.521 1.00 0.00 H new ATOM 0 HA ASP A 65 6.860 16.153 -3.038 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.344 13.359 -4.113 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.805 13.701 -2.457 1.00 0.00 H new ATOM 1051 N GLN A 66 8.985 14.542 -4.992 1.00 0.00 N ATOM 1052 CA GLN A 66 10.380 14.208 -5.280 1.00 0.00 C ATOM 1053 C GLN A 66 10.858 13.087 -4.358 1.00 0.00 C ATOM 1054 O GLN A 66 11.165 11.979 -4.797 1.00 0.00 O ATOM 1055 CB GLN A 66 11.263 15.461 -5.256 1.00 0.00 C ATOM 1056 CG GLN A 66 10.810 16.510 -6.283 1.00 0.00 C ATOM 1057 CD GLN A 66 11.233 17.910 -5.857 1.00 0.00 C ATOM 1058 OE1 GLN A 66 12.379 18.303 -6.053 1.00 0.00 O ATOM 1059 NE2 GLN A 66 10.322 18.672 -5.260 1.00 0.00 N ATOM 0 H GLN A 66 8.357 14.251 -5.741 1.00 0.00 H new ATOM 0 HA GLN A 66 10.461 13.820 -6.295 1.00 0.00 H new ATOM 0 HB2 GLN A 66 11.242 15.899 -4.258 1.00 0.00 H new ATOM 0 HB3 GLN A 66 12.296 15.179 -5.459 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.238 16.278 -7.258 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.726 16.472 -6.393 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.378 18.316 -5.112 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.567 19.612 -4.950 1.00 0.00 H new ATOM 1068 N GLU A 67 10.876 13.364 -3.061 1.00 0.00 N ATOM 1069 CA GLU A 67 11.009 12.370 -2.012 1.00 0.00 C ATOM 1070 C GLU A 67 9.654 11.644 -1.971 1.00 0.00 C ATOM 1071 O GLU A 67 8.840 11.860 -1.074 1.00 0.00 O ATOM 1072 CB GLU A 67 11.342 13.075 -0.681 1.00 0.00 C ATOM 1073 CG GLU A 67 12.844 13.263 -0.406 1.00 0.00 C ATOM 1074 CD GLU A 67 13.654 13.741 -1.599 1.00 0.00 C ATOM 1075 OE1 GLU A 67 13.393 14.860 -2.090 1.00 0.00 O ATOM 1076 OE2 GLU A 67 14.649 13.063 -1.965 1.00 0.00 O ATOM 0 H GLU A 67 10.796 14.316 -2.702 1.00 0.00 H new ATOM 0 HA GLU A 67 11.814 11.657 -2.189 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.861 14.053 -0.674 1.00 0.00 H new ATOM 0 HB3 GLU A 67 10.907 12.500 0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 67 12.964 13.979 0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.257 12.316 -0.060 1.00 0.00 H new ATOM 1083 N VAL A 68 9.379 10.836 -3.001 1.00 0.00 N ATOM 1084 CA VAL A 68 8.051 10.293 -3.250 1.00 0.00 C ATOM 1085 C VAL A 68 7.488 9.429 -2.117 1.00 0.00 C ATOM 1086 O VAL A 68 8.204 8.814 -1.324 1.00 0.00 O ATOM 1087 CB VAL A 68 7.982 9.539 -4.592 1.00 0.00 C ATOM 1088 CG1 VAL A 68 8.280 10.447 -5.792 1.00 0.00 C ATOM 1089 CG2 VAL A 68 8.867 8.298 -4.607 1.00 0.00 C ATOM 0 H VAL A 68 10.078 10.543 -3.684 1.00 0.00 H new ATOM 0 HA VAL A 68 7.406 11.171 -3.301 1.00 0.00 H new ATOM 0 HB VAL A 68 6.950 9.203 -4.691 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.218 9.866 -6.712 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.552 11.257 -5.825 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.282 10.864 -5.693 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.783 7.803 -5.574 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.904 8.588 -4.437 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.548 7.614 -3.820 1.00 0.00 H new ATOM 1099 N ASN A 69 6.157 9.382 -2.096 1.00 0.00 N ATOM 1100 CA ASN A 69 5.307 8.491 -1.316 1.00 0.00 C ATOM 1101 C ASN A 69 4.783 7.424 -2.279 1.00 0.00 C ATOM 1102 O ASN A 69 5.072 7.473 -3.476 1.00 0.00 O ATOM 1103 CB ASN A 69 4.146 9.286 -0.695 1.00 0.00 C ATOM 1104 CG ASN A 69 3.538 10.226 -1.727 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.121 9.783 -2.792 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.591 11.523 -1.457 1.00 0.00 N ATOM 0 H ASN A 69 5.604 10.018 -2.671 1.00 0.00 H new ATOM 0 HA ASN A 69 5.860 8.028 -0.498 1.00 0.00 H new ATOM 0 HB2 ASN A 69 3.384 8.600 -0.324 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.504 9.858 0.161 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.276 12.202 -2.151 1.00 0.00 H new ATOM 0 HD22 ASN A 69 3.946 11.842 -0.556 1.00 0.00 H new ATOM 1113 N PHE A 70 4.025 6.451 -1.765 1.00 0.00 N ATOM 1114 CA PHE A 70 3.556 5.342 -2.581 1.00 0.00 C ATOM 1115 C PHE A 70 2.751 5.866 -3.766 1.00 0.00 C ATOM 1116 O PHE A 70 2.996 5.467 -4.899 1.00 0.00 O ATOM 1117 CB PHE A 70 2.724 4.366 -1.751 1.00 0.00 C ATOM 1118 CG PHE A 70 2.391 3.080 -2.477 1.00 0.00 C ATOM 1119 CD1 PHE A 70 3.399 2.122 -2.690 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.091 2.850 -2.967 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.092 0.910 -3.330 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.794 1.647 -3.633 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.791 0.671 -3.800 1.00 0.00 C ATOM 0 H PHE A 70 3.727 6.414 -0.790 1.00 0.00 H new ATOM 0 HA PHE A 70 4.424 4.802 -2.960 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.266 4.127 -0.836 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.797 4.855 -1.453 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.409 2.318 -2.361 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.323 3.597 -2.832 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.858 0.160 -3.461 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.201 1.474 -4.016 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.556 -0.263 -4.290 1.00 0.00 H new ATOM 1133 N GLN A 71 1.798 6.770 -3.516 1.00 0.00 N ATOM 1134 CA GLN A 71 0.999 7.323 -4.598 1.00 0.00 C ATOM 1135 C GLN A 71 1.846 7.940 -5.712 1.00 0.00 C ATOM 1136 O GLN A 71 1.541 7.697 -6.875 1.00 0.00 O ATOM 1137 CB GLN A 71 -0.193 8.170 -4.118 1.00 0.00 C ATOM 1138 CG GLN A 71 0.031 9.516 -3.407 1.00 0.00 C ATOM 1139 CD GLN A 71 0.446 10.710 -4.276 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.762 11.776 -3.747 1.00 0.00 O ATOM 1141 NE2 GLN A 71 0.422 10.587 -5.600 1.00 0.00 N ATOM 0 H GLN A 71 1.569 7.125 -2.588 1.00 0.00 H new ATOM 0 HA GLN A 71 0.513 6.476 -5.082 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.816 8.369 -4.990 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -0.778 7.545 -3.443 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.890 9.781 -2.888 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.796 9.371 -2.645 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.158 9.698 -6.025 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.667 11.382 -6.191 1.00 0.00 H new ATOM 1150 N GLU A 72 2.898 8.703 -5.405 1.00 0.00 N ATOM 1151 CA GLU A 72 3.751 9.246 -6.458 1.00 0.00 C ATOM 1152 C GLU A 72 4.584 8.152 -7.123 1.00 0.00 C ATOM 1153 O GLU A 72 4.635 8.101 -8.348 1.00 0.00 O ATOM 1154 CB GLU A 72 4.636 10.385 -5.952 1.00 0.00 C ATOM 1155 CG GLU A 72 3.852 11.674 -5.723 1.00 0.00 C ATOM 1156 CD GLU A 72 3.137 12.178 -6.964 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.807 12.354 -8.002 1.00 0.00 O ATOM 1158 OE2 GLU A 72 1.925 12.458 -6.828 1.00 0.00 O ATOM 0 H GLU A 72 3.174 8.953 -4.455 1.00 0.00 H new ATOM 0 HA GLU A 72 3.089 9.667 -7.215 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.114 10.083 -5.020 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.432 10.571 -6.673 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.119 11.508 -4.933 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.534 12.446 -5.368 1.00 0.00 H new ATOM 1165 N TYR A 73 5.212 7.265 -6.342 1.00 0.00 N ATOM 1166 CA TYR A 73 5.905 6.085 -6.865 1.00 0.00 C ATOM 1167 C TYR A 73 5.025 5.375 -7.900 1.00 0.00 C ATOM 1168 O TYR A 73 5.470 5.064 -9.006 1.00 0.00 O ATOM 1169 CB TYR A 73 6.283 5.168 -5.690 1.00 0.00 C ATOM 1170 CG TYR A 73 6.511 3.696 -6.003 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.799 3.230 -6.315 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.471 2.767 -5.794 1.00 0.00 C ATOM 1173 CE1 TYR A 73 8.063 1.849 -6.319 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.746 1.390 -5.748 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.056 0.938 -5.968 1.00 0.00 C ATOM 1176 OH TYR A 73 7.392 -0.335 -5.630 1.00 0.00 O ATOM 0 H TYR A 73 5.253 7.347 -5.326 1.00 0.00 H new ATOM 0 HA TYR A 73 6.823 6.376 -7.376 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.191 5.561 -5.233 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.494 5.236 -4.941 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.585 3.932 -6.551 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.457 3.116 -5.669 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.044 1.489 -6.593 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.954 0.684 -5.545 1.00 0.00 H new ATOM 0 HH TYR A 73 6.826 -0.637 -4.890 1.00 0.00 H new ATOM 1186 N ILE A 74 3.757 5.153 -7.552 1.00 0.00 N ATOM 1187 CA ILE A 74 2.800 4.546 -8.450 1.00 0.00 C ATOM 1188 C ILE A 74 2.502 5.459 -9.645 1.00 0.00 C ATOM 1189 O ILE A 74 2.582 4.998 -10.777 1.00 0.00 O ATOM 1190 CB ILE A 74 1.508 4.162 -7.707 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.656 2.957 -6.762 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.426 3.857 -8.743 1.00 0.00 C ATOM 1193 CD1 ILE A 74 2.258 1.721 -7.440 1.00 0.00 C ATOM 0 H ILE A 74 3.374 5.392 -6.637 1.00 0.00 H new ATOM 0 HA ILE A 74 3.245 3.630 -8.838 1.00 0.00 H new ATOM 0 HB ILE A 74 1.244 5.010 -7.075 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.285 3.242 -5.918 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.677 2.700 -6.358 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.498 3.583 -8.234 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.253 4.740 -9.359 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.751 3.031 -9.376 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.334 0.910 -6.716 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.618 1.411 -8.266 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.251 1.962 -7.820 1.00 0.00 H new ATOM 1205 N THR A 75 2.112 6.719 -9.415 1.00 0.00 N ATOM 1206 CA THR A 75 1.782 7.674 -10.477 1.00 0.00 C ATOM 1207 C THR A 75 2.866 7.643 -11.544 1.00 0.00 C ATOM 1208 O THR A 75 2.598 7.532 -12.737 1.00 0.00 O ATOM 1209 CB THR A 75 1.638 9.090 -9.895 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.553 9.103 -8.996 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.372 10.141 -10.975 1.00 0.00 C ATOM 0 H THR A 75 2.016 7.107 -8.476 1.00 0.00 H new ATOM 0 HA THR A 75 0.831 7.393 -10.930 1.00 0.00 H new ATOM 0 HB THR A 75 2.578 9.339 -9.402 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.797 8.616 -8.181 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.278 11.123 -10.512 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.200 10.152 -11.684 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.448 9.898 -11.500 1.00 0.00 H new ATOM 1219 N PHE A 76 4.103 7.719 -11.070 1.00 0.00 N ATOM 1220 CA PHE A 76 5.315 7.618 -11.841 1.00 0.00 C ATOM 1221 C PHE A 76 5.379 6.295 -12.598 1.00 0.00 C ATOM 1222 O PHE A 76 5.395 6.310 -13.828 1.00 0.00 O ATOM 1223 CB PHE A 76 6.460 7.804 -10.843 1.00 0.00 C ATOM 1224 CG PHE A 76 7.849 7.523 -11.346 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.481 8.493 -12.134 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.598 6.490 -10.757 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.881 8.520 -12.222 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.005 6.534 -10.820 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.643 7.584 -11.509 1.00 0.00 C ATOM 0 H PHE A 76 4.287 7.861 -10.077 1.00 0.00 H new ATOM 0 HA PHE A 76 5.373 8.379 -12.620 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.431 8.831 -10.480 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.272 7.158 -9.986 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.891 9.219 -12.673 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.100 5.670 -10.261 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.370 9.260 -12.838 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.593 5.765 -10.341 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.720 7.668 -11.488 1.00 0.00 H new ATOM 1239 N LEU A 77 5.403 5.153 -11.899 1.00 0.00 N ATOM 1240 CA LEU A 77 5.552 3.871 -12.582 1.00 0.00 C ATOM 1241 C LEU A 77 4.467 3.688 -13.641 1.00 0.00 C ATOM 1242 O LEU A 77 4.748 3.261 -14.758 1.00 0.00 O ATOM 1243 CB LEU A 77 5.693 2.700 -11.592 1.00 0.00 C ATOM 1244 CG LEU A 77 4.435 1.929 -11.152 1.00 0.00 C ATOM 1245 CD1 LEU A 77 3.976 0.878 -12.176 1.00 0.00 C ATOM 1246 CD2 LEU A 77 4.785 1.173 -9.863 1.00 0.00 C ATOM 0 H LEU A 77 5.323 5.094 -10.884 1.00 0.00 H new ATOM 0 HA LEU A 77 6.495 3.874 -13.128 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.381 1.979 -12.033 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.171 3.088 -10.692 1.00 0.00 H new ATOM 0 HG LEU A 77 3.632 2.656 -11.032 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.085 0.372 -11.804 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.746 1.368 -13.122 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.771 0.148 -12.329 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.914 0.614 -9.521 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.606 0.483 -10.057 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.084 1.885 -9.093 1.00 0.00 H new ATOM 1258 N GLY A 78 3.228 4.051 -13.308 1.00 0.00 N ATOM 1259 CA GLY A 78 2.114 4.022 -14.233 1.00 0.00 C ATOM 1260 C GLY A 78 2.314 4.966 -15.419 1.00 0.00 C ATOM 1261 O GLY A 78 2.102 4.555 -16.559 1.00 0.00 O ATOM 0 H GLY A 78 2.975 4.376 -12.375 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.978 3.005 -14.601 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.200 4.295 -13.705 1.00 0.00 H new ATOM 1265 N ALA A 79 2.713 6.223 -15.185 1.00 0.00 N ATOM 1266 CA ALA A 79 2.990 7.151 -16.274 1.00 0.00 C ATOM 1267 C ALA A 79 4.036 6.563 -17.225 1.00 0.00 C ATOM 1268 O ALA A 79 3.850 6.569 -18.440 1.00 0.00 O ATOM 1269 CB ALA A 79 3.441 8.503 -15.715 1.00 0.00 C ATOM 0 H ALA A 79 2.849 6.614 -14.253 1.00 0.00 H new ATOM 0 HA ALA A 79 2.075 7.311 -16.845 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.645 9.187 -16.538 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.654 8.917 -15.085 1.00 0.00 H new ATOM 0 HB3 ALA A 79 4.346 8.368 -15.123 1.00 0.00 H new ATOM 1275 N LEU A 80 5.124 6.025 -16.670 1.00 0.00 N ATOM 1276 CA LEU A 80 6.162 5.374 -17.454 1.00 0.00 C ATOM 1277 C LEU A 80 5.589 4.169 -18.211 1.00 0.00 C ATOM 1278 O LEU A 80 5.831 4.015 -19.409 1.00 0.00 O ATOM 1279 CB LEU A 80 7.334 4.979 -16.546 1.00 0.00 C ATOM 1280 CG LEU A 80 8.009 6.178 -15.852 1.00 0.00 C ATOM 1281 CD1 LEU A 80 8.982 5.656 -14.791 1.00 0.00 C ATOM 1282 CD2 LEU A 80 8.763 7.083 -16.833 1.00 0.00 C ATOM 0 H LEU A 80 5.305 6.031 -15.666 1.00 0.00 H new ATOM 0 HA LEU A 80 6.541 6.072 -18.201 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.976 4.285 -15.786 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.078 4.447 -17.138 1.00 0.00 H new ATOM 0 HG LEU A 80 7.222 6.781 -15.398 1.00 0.00 H new ATOM 0 HD11 LEU A 80 9.465 6.498 -14.294 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.436 5.065 -14.056 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.739 5.033 -15.267 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.218 7.910 -16.289 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.541 6.507 -17.335 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.067 7.476 -17.574 1.00 0.00 H new ATOM 1294 N ALA A 81 4.804 3.324 -17.536 1.00 0.00 N ATOM 1295 CA ALA A 81 4.145 2.175 -18.143 1.00 0.00 C ATOM 1296 C ALA A 81 3.279 2.598 -19.328 1.00 0.00 C ATOM 1297 O ALA A 81 3.310 1.945 -20.366 1.00 0.00 O ATOM 1298 CB ALA A 81 3.335 1.399 -17.100 1.00 0.00 C ATOM 0 H ALA A 81 4.609 3.424 -16.540 1.00 0.00 H new ATOM 0 HA ALA A 81 4.915 1.506 -18.528 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.852 0.546 -17.576 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.000 1.046 -16.312 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.576 2.052 -16.669 1.00 0.00 H new ATOM 1304 N MET A 82 2.555 3.715 -19.211 1.00 0.00 N ATOM 1305 CA MET A 82 1.798 4.279 -20.326 1.00 0.00 C ATOM 1306 C MET A 82 2.671 4.485 -21.572 1.00 0.00 C ATOM 1307 O MET A 82 2.145 4.492 -22.686 1.00 0.00 O ATOM 1308 CB MET A 82 1.102 5.589 -19.914 1.00 0.00 C ATOM 1309 CG MET A 82 -0.429 5.488 -19.995 1.00 0.00 C ATOM 1310 SD MET A 82 -1.325 7.067 -20.005 1.00 0.00 S ATOM 1311 CE MET A 82 -0.497 7.969 -18.677 1.00 0.00 C ATOM 0 H MET A 82 2.479 4.249 -18.345 1.00 0.00 H new ATOM 0 HA MET A 82 1.029 3.553 -20.592 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.393 5.848 -18.896 1.00 0.00 H new ATOM 0 HB3 MET A 82 1.445 6.398 -20.559 1.00 0.00 H new ATOM 0 HG2 MET A 82 -0.691 4.938 -20.899 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.781 4.898 -19.149 1.00 0.00 H new ATOM 0 HE1 MET A 82 -1.034 8.896 -18.477 1.00 0.00 H new ATOM 0 HE2 MET A 82 -0.482 7.356 -17.776 1.00 0.00 H new ATOM 0 HE3 MET A 82 0.525 8.200 -18.976 1.00 0.00 H new ATOM 1321 N ILE A 83 3.983 4.682 -21.403 1.00 0.00 N ATOM 1322 CA ILE A 83 4.928 4.760 -22.504 1.00 0.00 C ATOM 1323 C ILE A 83 5.446 3.351 -22.824 1.00 0.00 C ATOM 1324 O ILE A 83 5.147 2.816 -23.888 1.00 0.00 O ATOM 1325 CB ILE A 83 6.066 5.759 -22.196 1.00 0.00 C ATOM 1326 CG1 ILE A 83 5.502 7.117 -21.739 1.00 0.00 C ATOM 1327 CG2 ILE A 83 6.939 5.935 -23.449 1.00 0.00 C ATOM 1328 CD1 ILE A 83 6.593 8.119 -21.344 1.00 0.00 C ATOM 0 H ILE A 83 4.415 4.792 -20.486 1.00 0.00 H new ATOM 0 HA ILE A 83 4.426 5.145 -23.391 1.00 0.00 H new ATOM 0 HB ILE A 83 6.673 5.362 -21.382 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.900 7.542 -22.542 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.836 6.960 -20.890 1.00 0.00 H new ATOM 0 HG21 ILE A 83 7.743 6.639 -23.236 1.00 0.00 H new ATOM 0 HG22 ILE A 83 7.365 4.973 -23.734 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.329 6.318 -24.267 1.00 0.00 H new ATOM 0 HD11 ILE A 83 6.131 9.056 -21.032 1.00 0.00 H new ATOM 0 HD12 ILE A 83 7.180 7.712 -20.521 1.00 0.00 H new ATOM 0 HD13 ILE A 83 7.245 8.303 -22.198 1.00 0.00 H new ATOM 1340 N TYR A 84 6.239 2.752 -21.927 1.00 0.00 N ATOM 1341 CA TYR A 84 6.964 1.525 -22.257 1.00 0.00 C ATOM 1342 C TYR A 84 6.035 0.331 -22.484 1.00 0.00 C ATOM 1343 O TYR A 84 6.295 -0.500 -23.348 1.00 0.00 O ATOM 1344 CB TYR A 84 8.073 1.222 -21.235 1.00 0.00 C ATOM 1345 CG TYR A 84 7.637 0.774 -19.851 1.00 0.00 C ATOM 1346 CD1 TYR A 84 7.237 -0.559 -19.628 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.785 1.642 -18.753 1.00 0.00 C ATOM 1348 CE1 TYR A 84 6.836 -0.972 -18.348 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.448 1.207 -17.461 1.00 0.00 C ATOM 1350 CZ TYR A 84 6.940 -0.088 -17.265 1.00 0.00 C ATOM 1351 OH TYR A 84 6.656 -0.528 -16.010 1.00 0.00 O ATOM 0 H TYR A 84 6.392 3.094 -20.978 1.00 0.00 H new ATOM 0 HA TYR A 84 7.456 1.704 -23.213 1.00 0.00 H new ATOM 0 HB2 TYR A 84 8.716 0.448 -21.654 1.00 0.00 H new ATOM 0 HB3 TYR A 84 8.684 2.118 -21.123 1.00 0.00 H new ATOM 0 HD1 TYR A 84 7.239 -1.265 -20.445 1.00 0.00 H new ATOM 0 HD2 TYR A 84 8.158 2.644 -18.904 1.00 0.00 H new ATOM 0 HE1 TYR A 84 6.448 -1.969 -18.198 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.579 1.868 -16.617 1.00 0.00 H new ATOM 0 HH TYR A 84 7.460 -0.468 -15.453 1.00 0.00 H new ATOM 1361 N ASN A 85 4.966 0.231 -21.694 1.00 0.00 N ATOM 1362 CA ASN A 85 4.015 -0.873 -21.714 1.00 0.00 C ATOM 1363 C ASN A 85 2.844 -0.593 -22.664 1.00 0.00 C ATOM 1364 O ASN A 85 1.749 -1.104 -22.432 1.00 0.00 O ATOM 1365 CB ASN A 85 3.543 -1.188 -20.282 1.00 0.00 C ATOM 1366 CG ASN A 85 3.216 -2.668 -20.087 1.00 0.00 C ATOM 1367 OD1 ASN A 85 3.905 -3.361 -19.348 1.00 0.00 O ATOM 1368 ND2 ASN A 85 2.166 -3.170 -20.729 1.00 0.00 N ATOM 0 H ASN A 85 4.733 0.942 -21.000 1.00 0.00 H new ATOM 0 HA ASN A 85 4.517 -1.758 -22.104 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.318 -0.894 -19.574 1.00 0.00 H new ATOM 0 HB3 ASN A 85 2.660 -0.591 -20.054 1.00 0.00 H new ATOM 0 HD21 ASN A 85 1.918 -4.153 -20.612 1.00 0.00 H new ATOM 0 HD22 ASN A 85 1.608 -2.573 -21.339 1.00 0.00 H new ATOM 1375 N GLU A 86 3.025 0.283 -23.664 1.00 0.00 N ATOM 1376 CA GLU A 86 1.968 0.680 -24.572 1.00 0.00 C ATOM 1377 C GLU A 86 1.170 -0.528 -25.078 1.00 0.00 C ATOM 1378 O GLU A 86 1.708 -1.585 -25.402 1.00 0.00 O ATOM 1379 CB GLU A 86 2.505 1.551 -25.718 1.00 0.00 C ATOM 1380 CG GLU A 86 1.426 2.004 -26.724 1.00 0.00 C ATOM 1381 CD GLU A 86 0.314 2.858 -26.127 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -0.491 2.338 -25.325 1.00 0.00 O ATOM 1383 OE2 GLU A 86 0.251 4.056 -26.475 1.00 0.00 O ATOM 0 H GLU A 86 3.920 0.732 -23.856 1.00 0.00 H new ATOM 0 HA GLU A 86 1.269 1.299 -24.010 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.985 2.433 -25.295 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.275 0.995 -26.253 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.908 2.567 -27.523 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.981 1.120 -27.180 1.00 0.00 H new ATOM 1552 N ALA B 8 -0.253 -8.145 -14.237 1.00 0.00 N ATOM 1553 CA ALA B 8 -0.758 -7.144 -13.303 1.00 0.00 C ATOM 1554 C ALA B 8 -1.110 -5.847 -14.039 1.00 0.00 C ATOM 1555 O ALA B 8 -2.220 -5.325 -13.919 1.00 0.00 O ATOM 1556 CB ALA B 8 0.274 -6.902 -12.198 1.00 0.00 C ATOM 0 HA ALA B 8 -1.674 -7.513 -12.841 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -0.106 -6.154 -11.502 1.00 0.00 H new ATOM 0 HB2 ALA B 8 0.460 -7.834 -11.663 1.00 0.00 H new ATOM 0 HB3 ALA B 8 1.204 -6.546 -12.641 1.00 0.00 H new ATOM 1562 N ILE B 9 -0.163 -5.342 -14.829 1.00 0.00 N ATOM 1563 CA ILE B 9 -0.367 -4.176 -15.672 1.00 0.00 C ATOM 1564 C ILE B 9 -1.560 -4.434 -16.599 1.00 0.00 C ATOM 1565 O ILE B 9 -2.452 -3.599 -16.685 1.00 0.00 O ATOM 1566 CB ILE B 9 0.936 -3.811 -16.409 1.00 0.00 C ATOM 1567 CG1 ILE B 9 1.994 -3.336 -15.393 1.00 0.00 C ATOM 1568 CG2 ILE B 9 0.665 -2.706 -17.438 1.00 0.00 C ATOM 1569 CD1 ILE B 9 3.404 -3.256 -15.989 1.00 0.00 C ATOM 0 H ILE B 9 0.774 -5.738 -14.899 1.00 0.00 H new ATOM 0 HA ILE B 9 -0.615 -3.300 -15.072 1.00 0.00 H new ATOM 0 HB ILE B 9 1.310 -4.693 -16.929 1.00 0.00 H new ATOM 0 HG12 ILE B 9 1.710 -2.355 -15.013 1.00 0.00 H new ATOM 0 HG13 ILE B 9 2.004 -4.017 -14.542 1.00 0.00 H new ATOM 0 HG21 ILE B 9 1.591 -2.454 -17.954 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -0.070 -3.056 -18.162 1.00 0.00 H new ATOM 0 HG23 ILE B 9 0.281 -1.822 -16.930 1.00 0.00 H new ATOM 0 HD11 ILE B 9 4.103 -2.916 -15.225 1.00 0.00 H new ATOM 0 HD12 ILE B 9 3.705 -4.242 -16.344 1.00 0.00 H new ATOM 0 HD13 ILE B 9 3.407 -2.554 -16.823 1.00 0.00 H new ATOM 1581 N GLY B 10 -1.612 -5.599 -17.248 1.00 0.00 N ATOM 1582 CA GLY B 10 -2.741 -6.036 -18.056 1.00 0.00 C ATOM 1583 C GLY B 10 -4.074 -5.859 -17.327 1.00 0.00 C ATOM 1584 O GLY B 10 -4.996 -5.241 -17.855 1.00 0.00 O ATOM 0 H GLY B 10 -0.850 -6.277 -17.223 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.760 -5.470 -18.987 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -2.611 -7.085 -18.323 1.00 0.00 H new ATOM 1588 N LEU B 11 -4.184 -6.379 -16.102 1.00 0.00 N ATOM 1589 CA LEU B 11 -5.389 -6.243 -15.296 1.00 0.00 C ATOM 1590 C LEU B 11 -5.716 -4.763 -15.092 1.00 0.00 C ATOM 1591 O LEU B 11 -6.845 -4.337 -15.337 1.00 0.00 O ATOM 1592 CB LEU B 11 -5.220 -6.994 -13.967 1.00 0.00 C ATOM 1593 CG LEU B 11 -6.426 -6.866 -13.020 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -7.714 -7.419 -13.642 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -6.125 -7.625 -11.723 1.00 0.00 C ATOM 0 H LEU B 11 -3.438 -6.905 -15.646 1.00 0.00 H new ATOM 0 HA LEU B 11 -6.235 -6.693 -15.816 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -5.046 -8.049 -14.177 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -4.331 -6.619 -13.460 1.00 0.00 H new ATOM 0 HG LEU B 11 -6.584 -5.806 -12.823 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -8.537 -7.306 -12.936 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -7.942 -6.870 -14.555 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -7.580 -8.475 -13.878 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -6.975 -7.539 -11.046 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -5.946 -8.676 -11.950 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -5.240 -7.200 -11.250 1.00 0.00 H new ATOM 1607 N LEU B 12 -4.731 -3.966 -14.671 1.00 0.00 N ATOM 1608 CA LEU B 12 -4.925 -2.534 -14.473 1.00 0.00 C ATOM 1609 C LEU B 12 -5.400 -1.848 -15.762 1.00 0.00 C ATOM 1610 O LEU B 12 -6.285 -0.991 -15.703 1.00 0.00 O ATOM 1611 CB LEU B 12 -3.645 -1.883 -13.934 1.00 0.00 C ATOM 1612 CG LEU B 12 -3.280 -2.345 -12.513 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -1.831 -1.946 -12.207 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -4.206 -1.716 -11.463 1.00 0.00 C ATOM 0 H LEU B 12 -3.788 -4.293 -14.461 1.00 0.00 H new ATOM 0 HA LEU B 12 -5.710 -2.402 -13.729 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -2.818 -2.112 -14.607 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -3.768 -0.800 -13.936 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.396 -3.428 -12.468 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.569 -2.272 -11.200 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -1.163 -2.419 -12.927 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.730 -0.863 -12.276 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.920 -2.064 -10.470 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.120 -0.630 -11.506 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -5.237 -2.006 -11.666 1.00 0.00 H new ATOM 1626 N ILE B 13 -4.825 -2.211 -16.914 1.00 0.00 N ATOM 1627 CA ILE B 13 -5.246 -1.736 -18.228 1.00 0.00 C ATOM 1628 C ILE B 13 -6.697 -2.145 -18.479 1.00 0.00 C ATOM 1629 O ILE B 13 -7.475 -1.338 -18.979 1.00 0.00 O ATOM 1630 CB ILE B 13 -4.312 -2.239 -19.349 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -2.928 -1.580 -19.223 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -4.908 -1.924 -20.733 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -1.868 -2.266 -20.095 1.00 0.00 C ATOM 0 H ILE B 13 -4.037 -2.858 -16.955 1.00 0.00 H new ATOM 0 HA ILE B 13 -5.180 -0.648 -18.240 1.00 0.00 H new ATOM 0 HB ILE B 13 -4.208 -3.319 -19.247 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.002 -0.530 -19.506 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.610 -1.608 -18.181 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.235 -2.286 -21.510 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.876 -2.416 -20.833 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.036 -0.847 -20.837 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -0.910 -1.761 -19.968 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -1.771 -3.310 -19.796 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -2.169 -2.215 -21.141 1.00 0.00 H new ATOM 1645 N GLY B 14 -7.065 -3.382 -18.145 1.00 0.00 N ATOM 1646 CA GLY B 14 -8.429 -3.866 -18.269 1.00 0.00 C ATOM 1647 C GLY B 14 -9.389 -2.994 -17.461 1.00 0.00 C ATOM 1648 O GLY B 14 -10.314 -2.403 -18.015 1.00 0.00 O ATOM 0 H GLY B 14 -6.415 -4.078 -17.778 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -8.726 -3.866 -19.318 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -8.487 -4.897 -17.921 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.163 -2.902 -16.148 1.00 0.00 N ATOM 1653 CA ILE B 15 -10.004 -2.117 -15.250 1.00 0.00 C ATOM 1654 C ILE B 15 -10.114 -0.673 -15.758 1.00 0.00 C ATOM 1655 O ILE B 15 -11.217 -0.137 -15.852 1.00 0.00 O ATOM 1656 CB ILE B 15 -9.465 -2.209 -13.809 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -9.516 -3.642 -13.239 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -10.201 -1.241 -12.872 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -10.927 -4.197 -13.007 1.00 0.00 C ATOM 0 H ILE B 15 -8.389 -3.372 -15.680 1.00 0.00 H new ATOM 0 HA ILE B 15 -11.015 -2.523 -15.237 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.416 -1.919 -13.864 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.988 -4.308 -13.922 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -8.975 -3.660 -12.293 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.796 -1.332 -11.864 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -10.067 -0.219 -13.226 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -11.263 -1.484 -12.859 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -10.859 -5.208 -12.606 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.456 -3.560 -12.298 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.470 -4.218 -13.952 1.00 0.00 H new ATOM 1671 N PHE B 16 -8.977 -0.072 -16.120 1.00 0.00 N ATOM 1672 CA PHE B 16 -8.899 1.221 -16.789 1.00 0.00 C ATOM 1673 C PHE B 16 -9.811 1.258 -18.019 1.00 0.00 C ATOM 1674 O PHE B 16 -10.859 1.896 -17.991 1.00 0.00 O ATOM 1675 CB PHE B 16 -7.424 1.499 -17.114 1.00 0.00 C ATOM 1676 CG PHE B 16 -7.121 2.679 -18.008 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.502 3.976 -17.623 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.290 2.501 -19.129 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -7.152 5.077 -18.422 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -5.821 3.617 -19.839 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.312 4.900 -19.535 1.00 0.00 C ATOM 0 H PHE B 16 -8.061 -0.487 -15.949 1.00 0.00 H new ATOM 0 HA PHE B 16 -9.263 2.017 -16.140 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.893 1.644 -16.173 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -7.008 0.606 -17.581 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -8.064 4.126 -16.713 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -6.013 1.506 -19.443 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.529 6.060 -18.181 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.084 3.491 -20.618 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.045 5.744 -20.153 1.00 0.00 H new ATOM 1691 N HIS B 17 -9.420 0.600 -19.112 1.00 0.00 N ATOM 1692 CA HIS B 17 -10.072 0.750 -20.401 1.00 0.00 C ATOM 1693 C HIS B 17 -11.310 -0.108 -20.652 1.00 0.00 C ATOM 1694 O HIS B 17 -11.799 -0.118 -21.780 1.00 0.00 O ATOM 1695 CB HIS B 17 -9.027 0.709 -21.523 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.567 2.070 -21.952 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -9.211 3.274 -21.736 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -7.312 2.330 -22.406 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -8.334 4.251 -22.015 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -7.189 3.701 -22.470 1.00 0.00 N ATOM 0 H HIS B 17 -8.637 -0.054 -19.121 1.00 0.00 H new ATOM 0 HA HIS B 17 -10.529 1.740 -20.389 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -8.166 0.131 -21.188 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -9.447 0.187 -22.383 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -6.557 1.603 -22.666 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -8.516 5.309 -21.895 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -6.372 4.212 -22.804 1.00 0.00 H new ATOM 1708 N LYS B 18 -11.857 -0.783 -19.637 1.00 0.00 N ATOM 1709 CA LYS B 18 -13.208 -1.319 -19.765 1.00 0.00 C ATOM 1710 C LYS B 18 -14.116 -0.121 -20.070 1.00 0.00 C ATOM 1711 O LYS B 18 -14.921 -0.123 -21.002 1.00 0.00 O ATOM 1712 CB LYS B 18 -13.628 -2.047 -18.479 1.00 0.00 C ATOM 1713 CG LYS B 18 -14.972 -2.760 -18.691 1.00 0.00 C ATOM 1714 CD LYS B 18 -15.394 -3.594 -17.474 1.00 0.00 C ATOM 1715 CE LYS B 18 -15.845 -2.706 -16.307 1.00 0.00 C ATOM 1716 NZ LYS B 18 -16.353 -3.502 -15.171 1.00 0.00 N ATOM 0 H LYS B 18 -11.399 -0.966 -18.744 1.00 0.00 H new ATOM 0 HA LYS B 18 -13.275 -2.060 -20.562 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -12.864 -2.771 -18.196 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -13.711 -1.334 -17.659 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -15.743 -2.019 -18.905 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -14.902 -3.408 -19.565 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -16.206 -4.265 -17.756 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -14.560 -4.219 -17.155 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -15.008 -2.092 -15.974 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -16.624 -2.025 -16.650 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -17.038 -2.937 -14.630 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -16.818 -4.361 -15.529 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -15.561 -3.770 -14.553 1.00 0.00 H new ATOM 1730 N TYR B 19 -13.910 0.934 -19.286 1.00 0.00 N ATOM 1731 CA TYR B 19 -14.479 2.243 -19.506 1.00 0.00 C ATOM 1732 C TYR B 19 -13.994 2.803 -20.840 1.00 0.00 C ATOM 1733 O TYR B 19 -12.804 2.767 -21.164 1.00 0.00 O ATOM 1734 CB TYR B 19 -14.114 3.098 -18.302 1.00 0.00 C ATOM 1735 CG TYR B 19 -14.992 2.754 -17.122 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -16.333 3.171 -17.122 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.583 1.758 -16.219 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -17.212 2.734 -16.125 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -15.473 1.299 -15.237 1.00 0.00 C ATOM 1740 CZ TYR B 19 -16.754 1.865 -15.133 1.00 0.00 C ATOM 1741 OH TYR B 19 -17.552 1.609 -14.068 1.00 0.00 O ATOM 0 H TYR B 19 -13.321 0.890 -18.454 1.00 0.00 H new ATOM 0 HA TYR B 19 -15.566 2.217 -19.585 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -13.067 2.941 -18.042 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -14.226 4.153 -18.551 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -16.688 3.834 -17.897 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -13.586 1.347 -16.281 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -18.239 3.067 -16.123 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -15.174 0.511 -14.562 1.00 0.00 H new ATOM 0 HH TYR B 19 -17.003 1.317 -13.311 1.00 0.00 H new ATOM 1751 N SER B 20 -14.954 3.293 -21.623 1.00 0.00 N ATOM 1752 CA SER B 20 -14.774 3.610 -23.030 1.00 0.00 C ATOM 1753 C SER B 20 -15.957 4.386 -23.641 1.00 0.00 C ATOM 1754 O SER B 20 -15.820 4.921 -24.745 1.00 0.00 O ATOM 1755 CB SER B 20 -14.536 2.284 -23.771 1.00 0.00 C ATOM 1756 OG SER B 20 -15.501 1.311 -23.407 1.00 0.00 O ATOM 0 H SER B 20 -15.897 3.483 -21.285 1.00 0.00 H new ATOM 0 HA SER B 20 -13.920 4.279 -23.134 1.00 0.00 H new ATOM 0 HB2 SER B 20 -14.575 2.454 -24.847 1.00 0.00 H new ATOM 0 HB3 SER B 20 -13.537 1.912 -23.543 1.00 0.00 H new ATOM 0 HG SER B 20 -15.224 0.870 -22.577 1.00 0.00 H new ATOM 1762 N GLY B 21 -17.106 4.445 -22.955 1.00 0.00 N ATOM 1763 CA GLY B 21 -18.282 5.252 -23.254 1.00 0.00 C ATOM 1764 C GLY B 21 -19.117 4.638 -24.367 1.00 0.00 C ATOM 1765 O GLY B 21 -20.272 4.263 -24.182 1.00 0.00 O ATOM 0 H GLY B 21 -17.241 3.885 -22.114 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -18.891 5.354 -22.356 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -17.971 6.256 -23.544 1.00 0.00 H new ATOM 1825 N LYS B 26 -10.671 6.399 -26.183 1.00 0.00 N ATOM 1826 CA LYS B 26 -10.032 5.093 -26.115 1.00 0.00 C ATOM 1827 C LYS B 26 -8.617 5.180 -25.528 1.00 0.00 C ATOM 1828 O LYS B 26 -8.106 4.169 -25.058 1.00 0.00 O ATOM 1829 CB LYS B 26 -10.004 4.449 -27.513 1.00 0.00 C ATOM 1830 CG LYS B 26 -11.402 4.256 -28.122 1.00 0.00 C ATOM 1831 CD LYS B 26 -12.184 3.143 -27.403 1.00 0.00 C ATOM 1832 CE LYS B 26 -13.698 3.275 -27.593 1.00 0.00 C ATOM 1833 NZ LYS B 26 -14.236 4.496 -26.958 1.00 0.00 N ATOM 0 HA LYS B 26 -10.619 4.466 -25.445 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -9.408 5.071 -28.180 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -9.506 3.481 -27.450 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -11.959 5.191 -28.060 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.308 4.010 -29.180 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -11.857 2.173 -27.778 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.951 3.169 -26.339 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -13.929 3.290 -28.658 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -14.193 2.400 -27.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -14.890 4.231 -26.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -13.453 5.056 -26.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -14.744 5.062 -27.668 1.00 0.00 H new ATOM 1847 N HIS B 27 -7.986 6.361 -25.528 1.00 0.00 N ATOM 1848 CA HIS B 27 -6.747 6.612 -24.800 1.00 0.00 C ATOM 1849 C HIS B 27 -7.094 7.178 -23.417 1.00 0.00 C ATOM 1850 O HIS B 27 -6.413 6.870 -22.438 1.00 0.00 O ATOM 1851 CB HIS B 27 -5.774 7.498 -25.608 1.00 0.00 C ATOM 1852 CG HIS B 27 -6.390 8.696 -26.283 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -7.053 8.675 -27.497 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -6.652 9.888 -25.677 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -7.758 9.818 -27.595 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -7.561 10.549 -26.480 1.00 0.00 N ATOM 0 H HIS B 27 -8.329 7.174 -26.040 1.00 0.00 H new ATOM 0 HA HIS B 27 -6.207 5.677 -24.653 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -4.987 7.846 -24.939 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -5.296 6.881 -26.369 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -6.231 10.246 -24.749 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -8.380 10.103 -28.431 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -8.008 11.440 -26.265 1.00 0.00 H new ATOM 1864 N THR B 28 -8.169 7.964 -23.314 1.00 0.00 N ATOM 1865 CA THR B 28 -8.719 8.503 -22.068 1.00 0.00 C ATOM 1866 C THR B 28 -10.002 7.757 -21.704 1.00 0.00 C ATOM 1867 O THR B 28 -10.516 6.978 -22.506 1.00 0.00 O ATOM 1868 CB THR B 28 -9.037 10.002 -22.260 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.150 10.592 -23.184 1.00 0.00 O ATOM 1870 CG2 THR B 28 -8.957 10.830 -20.983 1.00 0.00 C ATOM 0 H THR B 28 -8.703 8.255 -24.133 1.00 0.00 H new ATOM 0 HA THR B 28 -7.990 8.379 -21.267 1.00 0.00 H new ATOM 0 HB THR B 28 -10.067 10.012 -22.616 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.372 11.541 -23.290 1.00 0.00 H new ATOM 0 HG21 THR B 28 -9.195 11.870 -21.208 1.00 0.00 H new ATOM 0 HG22 THR B 28 -9.670 10.444 -20.254 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.949 10.769 -20.572 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.509 7.989 -20.491 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.837 7.564 -20.076 1.00 0.00 C ATOM 1880 C LEU B 29 -12.780 8.756 -20.219 1.00 0.00 C ATOM 1881 O LEU B 29 -12.436 9.865 -19.809 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.804 7.092 -18.620 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.745 6.013 -18.349 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.914 5.523 -16.911 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.839 4.839 -19.324 1.00 0.00 C ATOM 0 H LEU B 29 -9.996 8.485 -19.762 1.00 0.00 H new ATOM 0 HA LEU B 29 -12.180 6.736 -20.696 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -11.613 7.948 -17.973 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.786 6.702 -18.351 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.759 6.455 -18.494 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -10.170 4.755 -16.698 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -10.780 6.358 -16.224 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.913 5.106 -16.784 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.068 4.106 -19.087 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.821 4.373 -19.239 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -10.696 5.200 -20.343 1.00 0.00 H new ATOM 1897 N SER B 30 -13.962 8.551 -20.803 1.00 0.00 N ATOM 1898 CA SER B 30 -14.911 9.618 -21.096 1.00 0.00 C ATOM 1899 C SER B 30 -15.647 10.095 -19.832 1.00 0.00 C ATOM 1900 O SER B 30 -16.855 9.909 -19.699 1.00 0.00 O ATOM 1901 CB SER B 30 -15.855 9.137 -22.205 1.00 0.00 C ATOM 1902 OG SER B 30 -15.094 8.528 -23.239 1.00 0.00 O ATOM 0 H SER B 30 -14.288 7.627 -21.088 1.00 0.00 H new ATOM 0 HA SER B 30 -14.380 10.500 -21.455 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.576 8.426 -21.802 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.424 9.977 -22.603 1.00 0.00 H new ATOM 0 HG SER B 30 -15.695 8.218 -23.948 1.00 0.00 H new ATOM 1908 N LYS B 31 -14.896 10.726 -18.922 1.00 0.00 N ATOM 1909 CA LYS B 31 -15.313 11.393 -17.690 1.00 0.00 C ATOM 1910 C LYS B 31 -16.360 10.641 -16.860 1.00 0.00 C ATOM 1911 O LYS B 31 -16.003 10.041 -15.847 1.00 0.00 O ATOM 1912 CB LYS B 31 -15.726 12.846 -17.961 1.00 0.00 C ATOM 1913 CG LYS B 31 -14.602 13.663 -18.617 1.00 0.00 C ATOM 1914 CD LYS B 31 -14.919 15.154 -18.441 1.00 0.00 C ATOM 1915 CE LYS B 31 -14.029 16.086 -19.273 1.00 0.00 C ATOM 1916 NZ LYS B 31 -12.586 15.854 -19.077 1.00 0.00 N ATOM 0 H LYS B 31 -13.885 10.786 -19.045 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.427 11.393 -17.055 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -16.604 12.857 -18.607 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -16.015 13.319 -17.023 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -13.642 13.423 -18.159 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -14.521 13.415 -19.675 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -15.961 15.327 -18.711 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -14.815 15.415 -17.388 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -14.269 15.958 -20.328 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -14.260 17.120 -19.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -12.082 16.764 -19.098 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -12.430 15.393 -18.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -12.227 15.241 -19.837 1.00 0.00 H new ATOM 1930 N LYS B 32 -17.638 10.683 -17.253 1.00 0.00 N ATOM 1931 CA LYS B 32 -18.726 9.941 -16.614 1.00 0.00 C ATOM 1932 C LYS B 32 -18.267 8.516 -16.327 1.00 0.00 C ATOM 1933 O LYS B 32 -18.419 8.005 -15.218 1.00 0.00 O ATOM 1934 CB LYS B 32 -19.968 9.970 -17.525 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.057 8.948 -17.138 1.00 0.00 C ATOM 1936 CD LYS B 32 -20.925 7.603 -17.888 1.00 0.00 C ATOM 1937 CE LYS B 32 -21.023 6.402 -16.933 1.00 0.00 C ATOM 1938 NZ LYS B 32 -20.850 5.111 -17.628 1.00 0.00 N ATOM 0 H LYS B 32 -17.950 11.248 -18.043 1.00 0.00 H new ATOM 0 HA LYS B 32 -18.995 10.404 -15.665 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.399 10.971 -17.501 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -19.656 9.781 -18.552 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -21.008 8.764 -16.065 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -22.038 9.377 -17.344 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -21.707 7.531 -18.644 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -19.970 7.572 -18.413 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -20.265 6.497 -16.156 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -21.993 6.416 -16.435 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -20.874 4.337 -16.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -21.618 4.982 -18.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -19.936 5.103 -18.124 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.663 7.908 -17.345 1.00 0.00 N ATOM 1953 CA GLU B 33 -17.025 6.614 -17.278 1.00 0.00 C ATOM 1954 C GLU B 33 -16.183 6.473 -16.002 1.00 0.00 C ATOM 1955 O GLU B 33 -16.414 5.609 -15.159 1.00 0.00 O ATOM 1956 CB GLU B 33 -16.157 6.507 -18.538 1.00 0.00 C ATOM 1957 CG GLU B 33 -16.971 6.383 -19.833 1.00 0.00 C ATOM 1958 CD GLU B 33 -17.773 5.094 -19.874 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -17.200 4.084 -20.342 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -18.934 5.136 -19.413 1.00 0.00 O ATOM 0 H GLU B 33 -17.607 8.328 -18.273 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.761 5.811 -17.238 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.516 7.386 -18.604 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.502 5.641 -18.446 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -17.646 7.234 -19.921 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -16.298 6.420 -20.690 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.209 7.363 -15.846 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.294 7.357 -14.722 1.00 0.00 C ATOM 1969 C LEU B 34 -15.063 7.583 -13.415 1.00 0.00 C ATOM 1970 O LEU B 34 -14.869 6.856 -12.440 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.211 8.396 -15.026 1.00 0.00 C ATOM 1972 CG LEU B 34 -12.090 8.575 -13.999 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -12.444 9.630 -12.952 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -11.599 7.273 -13.359 1.00 0.00 C ATOM 0 H LEU B 34 -15.035 8.118 -16.509 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.801 6.395 -14.581 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -12.753 8.134 -15.980 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -13.700 9.361 -15.161 1.00 0.00 H new ATOM 0 HG LEU B 34 -11.238 8.941 -14.571 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -11.623 9.727 -12.242 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.614 10.588 -13.444 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -13.348 9.328 -12.423 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -10.806 7.495 -12.645 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.426 6.787 -12.842 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.215 6.609 -14.134 1.00 0.00 H new ATOM 1986 N LYS B 35 -15.993 8.544 -13.402 1.00 0.00 N ATOM 1987 CA LYS B 35 -16.814 8.800 -12.223 1.00 0.00 C ATOM 1988 C LYS B 35 -17.680 7.582 -11.847 1.00 0.00 C ATOM 1989 O LYS B 35 -18.128 7.493 -10.705 1.00 0.00 O ATOM 1990 CB LYS B 35 -17.635 10.094 -12.372 1.00 0.00 C ATOM 1991 CG LYS B 35 -16.831 11.381 -12.088 1.00 0.00 C ATOM 1992 CD LYS B 35 -15.827 11.705 -13.200 1.00 0.00 C ATOM 1993 CE LYS B 35 -15.090 13.041 -13.032 1.00 0.00 C ATOM 1994 NZ LYS B 35 -14.320 13.134 -11.778 1.00 0.00 N ATOM 0 H LYS B 35 -16.193 9.154 -14.195 1.00 0.00 H new ATOM 0 HA LYS B 35 -16.137 8.959 -11.383 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -18.036 10.144 -13.384 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -18.487 10.052 -11.693 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -17.520 12.217 -11.971 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -16.299 11.272 -11.143 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -15.090 10.903 -13.250 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -16.353 11.714 -14.154 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -14.414 13.183 -13.875 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -15.816 13.854 -13.065 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -13.643 13.921 -11.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -14.970 13.302 -10.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -13.803 12.245 -11.621 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.914 6.633 -12.762 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.523 5.348 -12.427 1.00 0.00 C ATOM 2010 C GLU B 36 -17.468 4.373 -11.885 1.00 0.00 C ATOM 2011 O GLU B 36 -17.664 3.746 -10.841 1.00 0.00 O ATOM 2012 CB GLU B 36 -19.269 4.797 -13.648 1.00 0.00 C ATOM 2013 CG GLU B 36 -20.091 3.548 -13.302 1.00 0.00 C ATOM 2014 CD GLU B 36 -20.618 2.836 -14.536 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.893 3.534 -15.536 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.709 1.590 -14.461 1.00 0.00 O ATOM 0 H GLU B 36 -17.686 6.737 -13.751 1.00 0.00 H new ATOM 0 HA GLU B 36 -19.254 5.484 -11.630 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.929 5.567 -14.048 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -18.552 4.554 -14.432 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -19.473 2.859 -12.725 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -20.929 3.834 -12.666 1.00 0.00 H new ATOM 2023 N LEU B 37 -16.344 4.273 -12.595 1.00 0.00 N ATOM 2024 CA LEU B 37 -15.200 3.413 -12.286 1.00 0.00 C ATOM 2025 C LEU B 37 -14.859 3.499 -10.796 1.00 0.00 C ATOM 2026 O LEU B 37 -14.763 2.483 -10.103 1.00 0.00 O ATOM 2027 CB LEU B 37 -14.012 3.814 -13.184 1.00 0.00 C ATOM 2028 CG LEU B 37 -12.931 2.736 -13.377 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -11.950 3.182 -14.467 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -12.125 2.436 -12.118 1.00 0.00 C ATOM 0 H LEU B 37 -16.199 4.818 -13.445 1.00 0.00 H new ATOM 0 HA LEU B 37 -15.444 2.371 -12.493 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -14.399 4.095 -14.164 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.543 4.702 -12.760 1.00 0.00 H new ATOM 0 HG LEU B 37 -13.465 1.826 -13.652 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -11.185 2.418 -14.603 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.488 3.327 -15.404 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.478 4.119 -14.171 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -11.384 1.667 -12.335 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.620 3.343 -11.785 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.794 2.084 -11.333 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.709 4.729 -10.298 1.00 0.00 N ATOM 2043 CA ILE B 38 -14.384 4.962 -8.895 1.00 0.00 C ATOM 2044 C ILE B 38 -15.396 4.324 -7.945 1.00 0.00 C ATOM 2045 O ILE B 38 -15.020 3.803 -6.897 1.00 0.00 O ATOM 2046 CB ILE B 38 -14.173 6.458 -8.609 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -15.441 7.302 -8.802 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -13.027 6.964 -9.485 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -15.217 8.801 -8.573 1.00 0.00 C ATOM 0 H ILE B 38 -14.809 5.580 -10.851 1.00 0.00 H new ATOM 0 HA ILE B 38 -13.436 4.461 -8.700 1.00 0.00 H new ATOM 0 HB ILE B 38 -13.919 6.568 -7.555 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -15.819 7.149 -9.813 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -16.211 6.949 -8.116 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -12.864 8.025 -9.294 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -12.118 6.410 -9.251 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -13.280 6.819 -10.535 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -16.154 9.336 -8.726 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -14.868 8.965 -7.554 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.470 9.169 -9.276 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.681 4.354 -8.298 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.721 3.857 -7.422 1.00 0.00 C ATOM 2063 C GLN B 39 -17.654 2.335 -7.364 1.00 0.00 C ATOM 2064 O GLN B 39 -17.522 1.766 -6.283 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.096 4.361 -7.883 1.00 0.00 C ATOM 2066 CG GLN B 39 -19.144 5.891 -7.823 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.506 6.433 -8.237 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -21.477 6.313 -7.499 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.590 7.050 -9.411 1.00 0.00 N ATOM 0 H GLN B 39 -17.019 4.720 -9.188 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.566 4.237 -6.412 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.293 4.023 -8.900 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -19.877 3.940 -7.250 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -18.914 6.222 -6.810 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -18.375 6.304 -8.476 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -19.764 7.134 -10.003 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -21.481 7.440 -9.720 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.771 1.672 -8.517 1.00 0.00 N ATOM 2079 CA LYS B 40 -17.900 0.218 -8.540 1.00 0.00 C ATOM 2080 C LYS B 40 -16.523 -0.448 -8.631 1.00 0.00 C ATOM 2081 O LYS B 40 -16.057 -1.053 -7.668 1.00 0.00 O ATOM 2082 CB LYS B 40 -18.898 -0.270 -9.613 1.00 0.00 C ATOM 2083 CG LYS B 40 -19.753 0.842 -10.247 1.00 0.00 C ATOM 2084 CD LYS B 40 -20.890 0.290 -11.125 1.00 0.00 C ATOM 2085 CE LYS B 40 -20.429 -0.732 -12.173 1.00 0.00 C ATOM 2086 NZ LYS B 40 -19.374 -0.191 -13.047 1.00 0.00 N ATOM 0 H LYS B 40 -17.779 2.115 -9.436 1.00 0.00 H new ATOM 0 HA LYS B 40 -18.337 -0.097 -7.593 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -18.343 -0.778 -10.402 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -19.562 -1.009 -9.164 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -20.178 1.463 -9.458 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -19.114 1.487 -10.850 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -21.638 -0.175 -10.483 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -21.379 1.121 -11.633 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -20.060 -1.625 -11.670 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -21.281 -1.038 -12.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -18.928 -0.968 -13.575 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -19.791 0.487 -13.716 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -18.657 0.291 -12.468 1.00 0.00 H new ATOM 2100 N GLU B 41 -15.870 -0.347 -9.790 1.00 0.00 N ATOM 2101 CA GLU B 41 -14.673 -1.099 -10.122 1.00 0.00 C ATOM 2102 C GLU B 41 -13.511 -0.856 -9.156 1.00 0.00 C ATOM 2103 O GLU B 41 -12.796 -1.805 -8.842 1.00 0.00 O ATOM 2104 CB GLU B 41 -14.268 -0.840 -11.579 1.00 0.00 C ATOM 2105 CG GLU B 41 -15.139 -1.612 -12.586 1.00 0.00 C ATOM 2106 CD GLU B 41 -16.556 -1.084 -12.740 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -16.879 0.001 -12.207 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -17.338 -1.742 -13.464 1.00 0.00 O ATOM 0 H GLU B 41 -16.172 0.277 -10.538 1.00 0.00 H new ATOM 0 HA GLU B 41 -14.921 -2.154 -10.010 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -14.340 0.228 -11.787 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -13.224 -1.122 -11.717 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -14.650 -1.589 -13.560 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -15.187 -2.656 -12.278 1.00 0.00 H new ATOM 2115 N LEU B 42 -13.305 0.369 -8.656 1.00 0.00 N ATOM 2116 CA LEU B 42 -12.254 0.572 -7.653 1.00 0.00 C ATOM 2117 C LEU B 42 -12.585 -0.051 -6.294 1.00 0.00 C ATOM 2118 O LEU B 42 -11.740 -0.013 -5.399 1.00 0.00 O ATOM 2119 CB LEU B 42 -11.844 2.042 -7.498 1.00 0.00 C ATOM 2120 CG LEU B 42 -11.261 2.671 -8.770 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -10.549 3.976 -8.399 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -10.273 1.768 -9.515 1.00 0.00 C ATOM 0 H LEU B 42 -13.829 1.204 -8.917 1.00 0.00 H new ATOM 0 HA LEU B 42 -11.391 0.036 -8.048 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -12.715 2.619 -7.187 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -11.108 2.120 -6.698 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.101 2.841 -9.443 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -10.131 4.431 -9.297 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -11.262 4.663 -7.943 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -9.746 3.764 -7.692 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -9.906 2.284 -10.402 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -9.434 1.529 -8.861 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -10.775 0.847 -9.813 1.00 0.00 H new ATOM 2134 N THR B 43 -13.754 -0.679 -6.134 1.00 0.00 N ATOM 2135 CA THR B 43 -14.152 -1.500 -4.992 1.00 0.00 C ATOM 2136 C THR B 43 -14.884 -0.678 -3.926 1.00 0.00 C ATOM 2137 O THR B 43 -15.310 -1.245 -2.927 1.00 0.00 O ATOM 2138 CB THR B 43 -12.987 -2.326 -4.388 1.00 0.00 C ATOM 2139 OG1 THR B 43 -12.072 -2.748 -5.378 1.00 0.00 O ATOM 2140 CG2 THR B 43 -13.458 -3.606 -3.690 1.00 0.00 C ATOM 0 H THR B 43 -14.488 -0.623 -6.840 1.00 0.00 H new ATOM 0 HA THR B 43 -14.858 -2.231 -5.385 1.00 0.00 H new ATOM 0 HB THR B 43 -12.523 -1.647 -3.672 1.00 0.00 H new ATOM 0 HG1 THR B 43 -11.352 -3.264 -4.959 1.00 0.00 H new ATOM 0 HG21 THR B 43 -12.596 -4.140 -3.288 1.00 0.00 H new ATOM 0 HG22 THR B 43 -14.137 -3.348 -2.877 1.00 0.00 H new ATOM 0 HG23 THR B 43 -13.977 -4.242 -4.407 1.00 0.00 H new ATOM 2148 N ILE B 44 -15.041 0.640 -4.100 1.00 0.00 N ATOM 2149 CA ILE B 44 -15.594 1.499 -3.054 1.00 0.00 C ATOM 2150 C ILE B 44 -17.003 1.028 -2.668 1.00 0.00 C ATOM 2151 O ILE B 44 -17.259 0.708 -1.507 1.00 0.00 O ATOM 2152 CB ILE B 44 -15.536 2.982 -3.480 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -14.074 3.387 -3.764 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -16.135 3.872 -2.382 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -13.887 4.884 -4.040 1.00 0.00 C ATOM 0 H ILE B 44 -14.791 1.132 -4.958 1.00 0.00 H new ATOM 0 HA ILE B 44 -14.984 1.419 -2.155 1.00 0.00 H new ATOM 0 HB ILE B 44 -16.121 3.115 -4.390 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -13.457 3.105 -2.911 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -13.710 2.821 -4.622 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -16.089 4.915 -2.694 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -17.174 3.590 -2.212 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -15.568 3.743 -1.460 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -12.834 5.090 -4.230 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -14.476 5.170 -4.912 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -14.218 5.458 -3.174 1.00 0.00 H new ATOM 2167 N GLY B 45 -17.906 0.945 -3.646 1.00 0.00 N ATOM 2168 CA GLY B 45 -19.251 0.427 -3.456 1.00 0.00 C ATOM 2169 C GLY B 45 -19.204 -1.003 -2.924 1.00 0.00 C ATOM 2170 O GLY B 45 -19.803 -1.315 -1.896 1.00 0.00 O ATOM 0 H GLY B 45 -17.716 1.241 -4.603 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -19.797 1.063 -2.759 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -19.793 0.452 -4.401 1.00 0.00 H new ATOM 2373 N ASP B 58 -12.332 10.768 -4.242 1.00 0.00 N ATOM 2374 CA ASP B 58 -11.754 10.166 -5.445 1.00 0.00 C ATOM 2375 C ASP B 58 -12.056 10.901 -6.747 1.00 0.00 C ATOM 2376 O ASP B 58 -11.321 10.766 -7.719 1.00 0.00 O ATOM 2377 CB ASP B 58 -12.082 8.667 -5.484 1.00 0.00 C ATOM 2378 CG ASP B 58 -10.928 7.852 -6.042 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -9.822 7.994 -5.477 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -11.180 7.059 -6.972 1.00 0.00 O ATOM 0 HA ASP B 58 -10.673 10.278 -5.368 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -12.319 8.320 -4.478 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -12.970 8.505 -6.095 1.00 0.00 H new ATOM 2385 N ASP B 59 -13.055 11.787 -6.747 1.00 0.00 N ATOM 2386 CA ASP B 59 -13.239 12.746 -7.834 1.00 0.00 C ATOM 2387 C ASP B 59 -12.038 13.732 -7.929 1.00 0.00 C ATOM 2388 O ASP B 59 -11.994 14.591 -8.808 1.00 0.00 O ATOM 2389 CB ASP B 59 -14.619 13.406 -7.648 1.00 0.00 C ATOM 2390 CG ASP B 59 -14.892 14.581 -8.579 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -15.327 14.315 -9.719 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.692 15.727 -8.116 1.00 0.00 O ATOM 0 H ASP B 59 -13.749 11.858 -6.003 1.00 0.00 H new ATOM 0 HA ASP B 59 -13.241 12.255 -8.807 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -15.391 12.652 -7.800 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -14.707 13.748 -6.617 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.016 13.593 -7.066 1.00 0.00 N ATOM 2398 CA LEU B 60 -9.716 14.258 -7.106 1.00 0.00 C ATOM 2399 C LEU B 60 -9.021 14.208 -8.461 1.00 0.00 C ATOM 2400 O LEU B 60 -8.085 14.977 -8.648 1.00 0.00 O ATOM 2401 CB LEU B 60 -8.773 13.797 -5.977 1.00 0.00 C ATOM 2402 CG LEU B 60 -8.268 12.344 -6.084 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -6.943 12.255 -6.856 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -8.011 11.772 -4.684 1.00 0.00 C ATOM 0 H LEU B 60 -11.090 12.965 -6.266 1.00 0.00 H new ATOM 0 HA LEU B 60 -9.953 15.308 -6.933 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -7.910 14.462 -5.954 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -9.291 13.914 -5.025 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.040 11.782 -6.611 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -6.622 11.215 -6.909 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -7.083 12.643 -7.865 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.183 12.844 -6.343 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -7.655 10.745 -4.770 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -7.259 12.376 -4.177 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.937 11.788 -4.109 1.00 0.00 H new ATOM 2416 N ASP B 61 -9.473 13.385 -9.421 1.00 0.00 N ATOM 2417 CA ASP B 61 -9.043 13.527 -10.817 1.00 0.00 C ATOM 2418 C ASP B 61 -9.135 14.989 -11.250 1.00 0.00 C ATOM 2419 O ASP B 61 -8.387 15.444 -12.117 1.00 0.00 O ATOM 2420 CB ASP B 61 -9.919 12.719 -11.781 1.00 0.00 C ATOM 2421 CG ASP B 61 -11.408 12.961 -11.627 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -11.907 14.017 -12.079 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -12.101 12.064 -11.101 1.00 0.00 O ATOM 0 H ASP B 61 -10.130 12.622 -9.256 1.00 0.00 H new ATOM 0 HA ASP B 61 -8.018 13.158 -10.860 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -9.628 12.958 -12.804 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -9.718 11.658 -11.632 1.00 0.00 H new ATOM 2428 N ARG B 62 -10.043 15.734 -10.607 1.00 0.00 N ATOM 2429 CA ARG B 62 -10.183 17.171 -10.841 1.00 0.00 C ATOM 2430 C ARG B 62 -8.877 17.969 -10.648 1.00 0.00 C ATOM 2431 O ARG B 62 -8.837 19.139 -11.017 1.00 0.00 O ATOM 2432 CB ARG B 62 -11.327 17.752 -10.000 1.00 0.00 C ATOM 2433 CG ARG B 62 -10.864 18.215 -8.611 1.00 0.00 C ATOM 2434 CD ARG B 62 -12.069 18.623 -7.765 1.00 0.00 C ATOM 2435 NE ARG B 62 -12.809 17.441 -7.307 1.00 0.00 N ATOM 2436 CZ ARG B 62 -12.566 16.755 -6.185 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -11.501 17.010 -5.420 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -13.426 15.809 -5.850 1.00 0.00 N ATOM 0 H ARG B 62 -10.694 15.359 -9.917 1.00 0.00 H new ATOM 0 HA ARG B 62 -10.432 17.281 -11.896 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -11.771 18.595 -10.530 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -12.108 17.000 -9.886 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -10.317 17.413 -8.116 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -10.177 19.056 -8.709 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -11.735 19.204 -6.905 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -12.728 19.266 -8.349 1.00 0.00 H new ATOM 0 HE ARG B 62 -13.575 17.114 -7.896 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -10.846 17.745 -5.686 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -11.343 16.469 -4.570 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.238 15.626 -6.440 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -13.278 15.262 -5.002 1.00 0.00 H new ATOM 2452 N ASN B 63 -7.844 17.358 -10.048 1.00 0.00 N ATOM 2453 CA ASN B 63 -6.519 17.894 -9.740 1.00 0.00 C ATOM 2454 C ASN B 63 -6.057 18.977 -10.707 1.00 0.00 C ATOM 2455 O ASN B 63 -5.559 20.013 -10.271 1.00 0.00 O ATOM 2456 CB ASN B 63 -5.480 16.753 -9.771 1.00 0.00 C ATOM 2457 CG ASN B 63 -5.342 15.981 -8.460 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -5.415 16.555 -7.376 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -5.094 14.678 -8.538 1.00 0.00 N ATOM 0 H ASN B 63 -7.928 16.389 -9.740 1.00 0.00 H new ATOM 0 HA ASN B 63 -6.599 18.345 -8.751 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -5.751 16.054 -10.562 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -4.509 17.171 -10.035 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -4.960 14.133 -7.687 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -5.038 14.223 -9.449 1.00 0.00 H new ATOM 2466 N LYS B 64 -6.155 18.711 -12.011 1.00 0.00 N ATOM 2467 CA LYS B 64 -5.641 19.612 -13.032 1.00 0.00 C ATOM 2468 C LYS B 64 -6.457 19.504 -14.323 1.00 0.00 C ATOM 2469 O LYS B 64 -6.906 20.519 -14.850 1.00 0.00 O ATOM 2470 CB LYS B 64 -4.131 19.363 -13.222 1.00 0.00 C ATOM 2471 CG LYS B 64 -3.809 17.949 -13.728 1.00 0.00 C ATOM 2472 CD LYS B 64 -2.358 17.532 -13.472 1.00 0.00 C ATOM 2473 CE LYS B 64 -1.994 16.259 -14.257 1.00 0.00 C ATOM 2474 NZ LYS B 64 -2.962 15.157 -14.075 1.00 0.00 N ATOM 0 H LYS B 64 -6.592 17.868 -12.383 1.00 0.00 H new ATOM 0 HA LYS B 64 -5.754 20.647 -12.710 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -3.735 20.093 -13.928 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -3.620 19.527 -12.273 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -4.476 17.236 -13.243 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -4.011 17.898 -14.798 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -1.688 18.343 -13.759 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -2.210 17.359 -12.406 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.928 16.502 -15.317 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -1.006 15.920 -13.945 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -2.576 14.284 -14.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -3.137 15.013 -13.060 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -3.856 15.398 -14.549 1.00 0.00 H new ATOM 2488 N ASP B 65 -6.631 18.281 -14.834 1.00 0.00 N ATOM 2489 CA ASP B 65 -7.172 18.012 -16.158 1.00 0.00 C ATOM 2490 C ASP B 65 -8.520 17.287 -16.116 1.00 0.00 C ATOM 2491 O ASP B 65 -9.451 17.661 -16.825 1.00 0.00 O ATOM 2492 CB ASP B 65 -6.146 17.147 -16.913 1.00 0.00 C ATOM 2493 CG ASP B 65 -5.901 15.816 -16.214 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -5.303 15.861 -15.115 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -6.395 14.791 -16.721 1.00 0.00 O ATOM 0 H ASP B 65 -6.391 17.433 -14.320 1.00 0.00 H new ATOM 0 HA ASP B 65 -7.349 18.964 -16.658 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -6.501 16.964 -17.927 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -5.205 17.691 -16.998 1.00 0.00 H new ATOM 2500 N GLN B 66 -8.623 16.237 -15.296 1.00 0.00 N ATOM 2501 CA GLN B 66 -9.694 15.253 -15.365 1.00 0.00 C ATOM 2502 C GLN B 66 -10.009 14.820 -16.805 1.00 0.00 C ATOM 2503 O GLN B 66 -11.172 14.636 -17.180 1.00 0.00 O ATOM 2504 CB GLN B 66 -10.909 15.581 -14.492 1.00 0.00 C ATOM 2505 CG GLN B 66 -11.634 16.897 -14.782 1.00 0.00 C ATOM 2506 CD GLN B 66 -12.890 17.076 -13.926 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -13.726 17.917 -14.239 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -13.070 16.306 -12.853 1.00 0.00 N ATOM 0 H GLN B 66 -7.949 16.048 -14.554 1.00 0.00 H new ATOM 0 HA GLN B 66 -9.305 14.352 -14.891 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -11.628 14.768 -14.592 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.585 15.594 -13.451 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -10.954 17.730 -14.602 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -11.909 16.932 -15.836 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -12.368 15.610 -12.602 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.909 16.413 -12.283 1.00 0.00 H new ATOM 2517 N GLU B 67 -8.947 14.627 -17.592 1.00 0.00 N ATOM 2518 CA GLU B 67 -8.935 13.944 -18.873 1.00 0.00 C ATOM 2519 C GLU B 67 -8.228 12.644 -18.516 1.00 0.00 C ATOM 2520 O GLU B 67 -7.079 12.401 -18.876 1.00 0.00 O ATOM 2521 CB GLU B 67 -8.169 14.745 -19.942 1.00 0.00 C ATOM 2522 CG GLU B 67 -8.693 16.168 -20.189 1.00 0.00 C ATOM 2523 CD GLU B 67 -10.179 16.244 -20.489 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -10.798 15.212 -20.841 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -10.780 17.304 -20.208 1.00 0.00 O ATOM 0 H GLU B 67 -8.022 14.966 -17.329 1.00 0.00 H new ATOM 0 HA GLU B 67 -9.923 13.802 -19.311 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -7.122 14.806 -19.647 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -8.204 14.193 -20.881 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -8.480 16.778 -19.311 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -8.143 16.605 -21.022 1.00 0.00 H new ATOM 2532 N VAL B 68 -8.925 11.819 -17.734 1.00 0.00 N ATOM 2533 CA VAL B 68 -8.305 10.697 -17.067 1.00 0.00 C ATOM 2534 C VAL B 68 -7.831 9.618 -18.032 1.00 0.00 C ATOM 2535 O VAL B 68 -8.595 8.783 -18.522 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.204 10.142 -15.964 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.485 9.019 -15.202 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -9.594 11.265 -14.990 1.00 0.00 C ATOM 0 H VAL B 68 -9.924 11.916 -17.553 1.00 0.00 H new ATOM 0 HA VAL B 68 -7.401 11.075 -16.590 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.105 9.735 -16.422 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.139 8.634 -14.419 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.233 8.214 -15.893 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -7.573 9.411 -14.752 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -10.235 10.861 -14.207 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -8.694 11.686 -14.541 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -10.130 12.046 -15.530 1.00 0.00 H new ATOM 2548 N ASN B 69 -6.529 9.672 -18.281 1.00 0.00 N ATOM 2549 CA ASN B 69 -5.749 8.616 -18.895 1.00 0.00 C ATOM 2550 C ASN B 69 -5.295 7.736 -17.722 1.00 0.00 C ATOM 2551 O ASN B 69 -5.853 7.821 -16.628 1.00 0.00 O ATOM 2552 CB ASN B 69 -4.581 9.205 -19.707 1.00 0.00 C ATOM 2553 CG ASN B 69 -5.065 10.122 -20.831 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -4.767 11.308 -20.844 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -5.813 9.575 -21.784 1.00 0.00 N ATOM 0 H ASN B 69 -5.967 10.491 -18.049 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.314 8.027 -19.618 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -3.923 9.764 -19.042 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -3.990 8.394 -20.131 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -6.156 10.148 -22.555 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -6.044 8.582 -21.744 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.281 6.889 -17.903 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.871 5.987 -16.830 1.00 0.00 C ATOM 2564 C PHE B 70 -3.348 6.761 -15.615 1.00 0.00 C ATOM 2565 O PHE B 70 -3.390 6.258 -14.499 1.00 0.00 O ATOM 2566 CB PHE B 70 -2.808 5.023 -17.353 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.612 3.758 -16.542 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -3.521 2.696 -16.686 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -1.446 3.578 -15.773 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -3.234 1.438 -16.131 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -1.177 2.329 -15.187 1.00 0.00 C ATOM 2572 CZ PHE B 70 -2.055 1.251 -15.390 1.00 0.00 C ATOM 0 H PHE B 70 -3.739 6.810 -18.764 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.743 5.421 -16.502 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.069 4.742 -18.373 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -1.856 5.552 -17.402 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -4.444 2.848 -17.226 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.759 4.399 -15.634 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.919 0.615 -16.274 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.294 2.198 -14.580 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.824 0.280 -14.977 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.825 7.974 -15.833 1.00 0.00 N ATOM 2583 CA GLN B 71 -2.151 8.743 -14.799 1.00 0.00 C ATOM 2584 C GLN B 71 -3.071 9.051 -13.611 1.00 0.00 C ATOM 2585 O GLN B 71 -2.871 8.477 -12.548 1.00 0.00 O ATOM 2586 CB GLN B 71 -1.479 9.971 -15.428 1.00 0.00 C ATOM 2587 CG GLN B 71 -0.586 10.725 -14.434 1.00 0.00 C ATOM 2588 CD GLN B 71 -1.342 11.863 -13.756 1.00 0.00 C ATOM 2589 OE1 GLN B 71 -1.612 12.879 -14.396 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -1.713 11.718 -12.491 1.00 0.00 N ATOM 0 H GLN B 71 -2.862 8.445 -16.737 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.355 8.142 -14.358 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.880 9.656 -16.283 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.246 10.646 -15.808 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -0.215 10.032 -13.679 1.00 0.00 H new ATOM 0 HG3 GLN B 71 0.284 11.124 -14.955 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -1.476 10.865 -11.984 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -2.236 12.459 -12.025 1.00 0.00 H new ATOM 2599 N GLU B 72 -4.066 9.938 -13.742 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.889 10.302 -12.586 1.00 0.00 C ATOM 2601 C GLU B 72 -5.552 9.066 -11.965 1.00 0.00 C ATOM 2602 O GLU B 72 -5.549 8.906 -10.747 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.916 11.382 -12.950 1.00 0.00 C ATOM 2604 CG GLU B 72 -5.254 12.749 -13.179 1.00 0.00 C ATOM 2605 CD GLU B 72 -4.634 13.320 -11.908 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -5.333 13.366 -10.876 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -3.450 13.720 -11.990 1.00 0.00 O ATOM 0 H GLU B 72 -4.315 10.405 -14.614 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.231 10.729 -11.829 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.453 11.083 -13.850 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.654 11.465 -12.152 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.483 12.652 -13.943 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.997 13.449 -13.563 1.00 0.00 H new ATOM 2614 N TYR B 73 -6.051 8.163 -12.817 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.540 6.853 -12.415 1.00 0.00 C ATOM 2616 C TYR B 73 -5.565 6.201 -11.426 1.00 0.00 C ATOM 2617 O TYR B 73 -5.889 5.962 -10.262 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.750 6.007 -13.683 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.859 4.507 -13.486 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -8.094 3.927 -13.145 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.752 3.676 -13.752 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -8.226 2.529 -13.110 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.882 2.281 -13.700 1.00 0.00 C ATOM 2624 CZ TYR B 73 -7.124 1.709 -13.395 1.00 0.00 C ATOM 2625 OH TYR B 73 -7.294 0.370 -13.543 1.00 0.00 O ATOM 0 H TYR B 73 -6.125 8.332 -13.820 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.494 6.938 -11.894 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.658 6.353 -14.177 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.922 6.202 -14.364 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.940 4.556 -12.910 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.797 4.117 -13.998 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -9.179 2.084 -12.863 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -5.028 1.650 -13.894 1.00 0.00 H new ATOM 0 HH TYR B 73 -6.864 0.075 -14.373 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.349 5.908 -11.884 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.404 5.162 -11.076 1.00 0.00 C ATOM 2637 C ILE B 74 -2.948 5.990 -9.867 1.00 0.00 C ATOM 2638 O ILE B 74 -2.695 5.424 -8.805 1.00 0.00 O ATOM 2639 CB ILE B 74 -2.282 4.572 -11.949 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.738 3.261 -11.362 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -1.135 5.560 -12.151 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.665 2.068 -11.611 1.00 0.00 C ATOM 0 H ILE B 74 -4.003 6.177 -12.805 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.891 4.290 -10.638 1.00 0.00 H new ATOM 0 HB ILE B 74 -2.729 4.362 -12.921 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.760 3.052 -11.796 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -1.591 3.383 -10.289 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -0.366 5.102 -12.773 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.511 6.458 -12.641 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.709 5.826 -11.184 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.228 1.170 -11.174 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -3.635 2.259 -11.153 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.792 1.924 -12.684 1.00 0.00 H new ATOM 2654 N THR B 75 -2.899 7.323 -9.993 1.00 0.00 N ATOM 2655 CA THR B 75 -2.689 8.221 -8.867 1.00 0.00 C ATOM 2656 C THR B 75 -3.718 7.951 -7.766 1.00 0.00 C ATOM 2657 O THR B 75 -3.317 7.709 -6.625 1.00 0.00 O ATOM 2658 CB THR B 75 -2.686 9.692 -9.327 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.721 9.868 -10.345 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.355 10.657 -8.185 1.00 0.00 C ATOM 0 H THR B 75 -3.005 7.804 -10.886 1.00 0.00 H new ATOM 0 HA THR B 75 -1.705 8.026 -8.441 1.00 0.00 H new ATOM 0 HB THR B 75 -3.689 9.915 -9.690 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.852 9.539 -10.033 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.365 11.681 -8.559 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.097 10.552 -7.394 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.367 10.426 -7.788 1.00 0.00 H new ATOM 2668 N PHE B 76 -5.027 7.966 -8.067 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.992 7.682 -7.009 1.00 0.00 C ATOM 2670 C PHE B 76 -5.826 6.271 -6.463 1.00 0.00 C ATOM 2671 O PHE B 76 -5.799 6.119 -5.245 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.460 7.943 -7.334 1.00 0.00 C ATOM 2673 CG PHE B 76 -7.864 8.132 -8.769 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.109 9.454 -9.167 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.571 7.087 -9.384 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.307 9.751 -9.827 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.689 7.380 -10.182 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.126 8.712 -10.287 1.00 0.00 C ATOM 0 H PHE B 76 -5.421 8.162 -8.987 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.740 8.420 -6.248 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -8.039 7.110 -6.936 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.765 8.834 -6.786 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.385 10.230 -8.968 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.257 6.063 -9.244 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -9.599 10.779 -9.981 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.207 6.592 -10.708 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.090 8.933 -10.721 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.703 5.249 -7.326 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.445 3.902 -6.829 1.00 0.00 C ATOM 2690 C LEU B 77 -4.301 3.932 -5.811 1.00 0.00 C ATOM 2691 O LEU B 77 -4.469 3.469 -4.688 1.00 0.00 O ATOM 2692 CB LEU B 77 -5.129 2.898 -7.949 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.380 2.322 -8.633 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -6.865 3.183 -9.796 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -6.091 0.909 -9.155 1.00 0.00 C ATOM 0 H LEU B 77 -5.776 5.331 -8.340 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.362 3.559 -6.350 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.508 3.388 -8.699 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.542 2.078 -7.535 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.166 2.302 -7.878 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -7.750 2.728 -10.241 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.113 4.180 -9.432 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -6.078 3.257 -10.547 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -6.983 0.510 -9.638 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -5.275 0.947 -9.876 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -5.810 0.264 -8.323 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.158 4.512 -6.182 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.011 4.675 -5.303 1.00 0.00 C ATOM 2709 C GLY B 78 -2.371 5.376 -3.990 1.00 0.00 C ATOM 2710 O GLY B 78 -1.986 4.914 -2.916 1.00 0.00 O ATOM 0 H GLY B 78 -3.006 4.886 -7.119 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.584 3.696 -5.083 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.242 5.250 -5.818 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.088 6.502 -4.073 1.00 0.00 N ATOM 2715 CA ALA B 79 -3.493 7.286 -2.910 1.00 0.00 C ATOM 2716 C ALA B 79 -4.333 6.448 -1.949 1.00 0.00 C ATOM 2717 O ALA B 79 -4.015 6.351 -0.765 1.00 0.00 O ATOM 2718 CB ALA B 79 -4.242 8.544 -3.361 1.00 0.00 C ATOM 0 H ALA B 79 -3.404 6.895 -4.959 1.00 0.00 H new ATOM 0 HA ALA B 79 -2.599 7.597 -2.368 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -4.540 9.123 -2.487 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -3.590 9.149 -3.992 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -5.129 8.257 -3.926 1.00 0.00 H new ATOM 2724 N LEU B 80 -5.402 5.835 -2.457 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.259 4.978 -1.656 1.00 0.00 C ATOM 2726 C LEU B 80 -5.454 3.801 -1.102 1.00 0.00 C ATOM 2727 O LEU B 80 -5.618 3.436 0.061 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.437 4.464 -2.497 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.375 5.544 -3.064 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -9.421 4.856 -3.949 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.084 6.331 -1.956 1.00 0.00 C ATOM 0 H LEU B 80 -5.693 5.921 -3.431 1.00 0.00 H new ATOM 0 HA LEU B 80 -6.654 5.559 -0.823 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.039 3.882 -3.328 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -8.027 3.782 -1.884 1.00 0.00 H new ATOM 0 HG LEU B 80 -7.779 6.254 -3.637 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -10.097 5.604 -4.362 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -8.921 4.331 -4.763 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -9.990 4.143 -3.353 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -9.735 7.082 -2.403 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.680 5.649 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.342 6.822 -1.327 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.610 3.192 -1.941 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.931 1.934 -1.673 1.00 0.00 C ATOM 2745 C ALA B 81 -3.276 1.874 -0.295 1.00 0.00 C ATOM 2746 O ALA B 81 -3.560 0.942 0.453 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.932 1.602 -2.780 1.00 0.00 C ATOM 0 H ALA B 81 -4.377 3.580 -2.855 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.707 1.168 -1.665 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.439 0.657 -2.554 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.457 1.519 -3.731 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.186 2.394 -2.846 1.00 0.00 H new ATOM 2753 N MET B 82 -2.427 2.849 0.055 1.00 0.00 N ATOM 2754 CA MET B 82 -1.771 2.866 1.367 1.00 0.00 C ATOM 2755 C MET B 82 -2.777 2.653 2.507 1.00 0.00 C ATOM 2756 O MET B 82 -2.430 2.057 3.523 1.00 0.00 O ATOM 2757 CB MET B 82 -1.004 4.179 1.594 1.00 0.00 C ATOM 2758 CG MET B 82 0.323 4.266 0.827 1.00 0.00 C ATOM 2759 SD MET B 82 1.187 5.855 0.995 1.00 0.00 S ATOM 2760 CE MET B 82 1.667 5.802 2.736 1.00 0.00 C ATOM 0 H MET B 82 -2.180 3.632 -0.550 1.00 0.00 H new ATOM 0 HA MET B 82 -1.061 2.039 1.372 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.638 5.015 1.298 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.804 4.292 2.660 1.00 0.00 H new ATOM 0 HG2 MET B 82 0.982 3.470 1.174 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.130 4.082 -0.230 1.00 0.00 H new ATOM 0 HE1 MET B 82 2.313 6.650 2.961 1.00 0.00 H new ATOM 0 HE2 MET B 82 0.775 5.849 3.361 1.00 0.00 H new ATOM 0 HE3 MET B 82 2.203 4.874 2.938 1.00 0.00 H new ATOM 2770 N ILE B 83 -4.008 3.151 2.345 1.00 0.00 N ATOM 2771 CA ILE B 83 -5.073 2.986 3.316 1.00 0.00 C ATOM 2772 C ILE B 83 -5.871 1.714 3.005 1.00 0.00 C ATOM 2773 O ILE B 83 -5.771 0.718 3.717 1.00 0.00 O ATOM 2774 CB ILE B 83 -5.953 4.254 3.348 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -5.132 5.548 3.525 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -7.026 4.141 4.441 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -4.241 5.572 4.772 1.00 0.00 C ATOM 0 H ILE B 83 -4.287 3.685 1.522 1.00 0.00 H new ATOM 0 HA ILE B 83 -4.655 2.862 4.315 1.00 0.00 H new ATOM 0 HB ILE B 83 -6.440 4.322 2.375 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -4.506 5.689 2.644 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -5.817 6.395 3.568 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -7.636 5.045 4.447 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -7.660 3.277 4.241 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -6.545 4.021 5.412 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -3.701 6.518 4.815 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -4.860 5.466 5.663 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -3.528 4.749 4.725 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.693 1.731 1.952 1.00 0.00 N ATOM 2790 CA TYR B 84 -7.668 0.665 1.746 1.00 0.00 C ATOM 2791 C TYR B 84 -7.051 -0.642 1.241 1.00 0.00 C ATOM 2792 O TYR B 84 -7.651 -1.698 1.418 1.00 0.00 O ATOM 2793 CB TYR B 84 -8.903 1.155 0.965 1.00 0.00 C ATOM 2794 CG TYR B 84 -8.941 1.037 -0.551 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -7.779 1.146 -1.338 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -10.192 0.907 -1.185 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -7.862 1.065 -2.740 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -10.278 0.854 -2.585 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.112 0.912 -3.364 1.00 0.00 C ATOM 2800 OH TYR B 84 -9.192 0.826 -4.720 1.00 0.00 O ATOM 0 H TYR B 84 -6.701 2.461 1.240 1.00 0.00 H new ATOM 0 HA TYR B 84 -8.049 0.390 2.729 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -9.767 0.616 1.354 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -9.046 2.207 1.212 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -6.820 1.292 -0.864 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -11.091 0.848 -0.590 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -6.964 1.120 -3.338 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -11.243 0.768 -3.063 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.103 0.575 -4.979 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.864 -0.584 0.623 1.00 0.00 N ATOM 2811 CA ASN B 85 -5.070 -1.758 0.284 1.00 0.00 C ATOM 2812 C ASN B 85 -4.058 -2.051 1.397 1.00 0.00 C ATOM 2813 O ASN B 85 -3.019 -2.664 1.129 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.443 -1.601 -1.113 1.00 0.00 C ATOM 2815 CG ASN B 85 -4.166 -2.932 -1.812 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -4.812 -3.262 -2.801 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -3.194 -3.699 -1.339 1.00 0.00 N ATOM 0 H ASN B 85 -5.428 0.295 0.343 1.00 0.00 H new ATOM 0 HA ASN B 85 -5.711 -2.637 0.221 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.109 -1.005 -1.736 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -3.509 -1.046 -1.023 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -2.971 -4.582 -1.799 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -2.669 -3.406 -0.515 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.296 -1.589 2.638 1.00 0.00 N ATOM 2825 CA GLU B 86 -3.458 -2.014 3.736 1.00 0.00 C ATOM 2826 C GLU B 86 -3.477 -3.548 3.749 1.00 0.00 C ATOM 2827 O GLU B 86 -4.517 -4.203 3.733 1.00 0.00 O ATOM 2828 CB GLU B 86 -3.767 -1.313 5.067 1.00 0.00 C ATOM 2829 CG GLU B 86 -2.706 -1.601 6.148 1.00 0.00 C ATOM 2830 CD GLU B 86 -1.272 -1.396 5.665 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -0.782 -2.305 4.964 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -0.654 -0.355 5.970 1.00 0.00 O ATOM 0 H GLU B 86 -5.043 -0.940 2.886 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.428 -1.690 3.586 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -3.829 -0.237 4.901 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -4.744 -1.637 5.426 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -2.888 -0.954 7.006 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -2.821 -2.628 6.494 1.00 0.00 H new