USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1093 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 Single : A 8 GLN :FLIP amide:sc= 0 F(o=-0.79,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.00729 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-18!) USER MOD Single : A 20 LYS NZ :NH3+ -159:sc= -0.297 (180deg=-1.59!) USER MOD Single : A 23 LYS NZ :NH3+ -124:sc= -0.0701 (180deg=-1.94!) USER MOD Single : A 30 SER OG : rot 35:sc= 0.705 USER MOD Single : A 33 HIS : no HD1:sc= -2.77 K(o=-2.8,f=-7.1!) USER MOD Single : A 36 ASN : amide:sc= -3.12! C(o=-3.1!,f=-2.7!) USER MOD Single : A 37 THR OG1 : rot 122:sc= -0.376 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0168 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -1.83! C(o=-1.8!,f=-1.8!) USER MOD Single : A 59 GLN : amide:sc= -0.033 X(o=-0.033,f=-0.29) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0443) USER MOD Single : A 71 ASN : amide:sc= -1.12 K(o=-1.1,f=-2.1!) USER MOD Single : B 8 GLN :FLIP amide:sc= 0 F(o=-0.85,f=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0.00888 USER MOD Single : B 13 TYR OH : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 HIS : no HD1:sc= -4.08! C(o=-4.1!,f=-17!) USER MOD Single : B 20 LYS NZ :NH3+ -158:sc= -0.293 (180deg=-1.55!) USER MOD Single : B 23 LYS NZ :NH3+ -124:sc= -0.0732 (180deg=-1.92!) USER MOD Single : B 30 SER OG : rot 40:sc= 0.703 USER MOD Single : B 33 HIS : no HD1:sc= -2.68 K(o=-2.7,f=-6.9!) USER MOD Single : B 36 ASN :FLIP amide:sc= -2.62! C(o=-3.2!,f=-2.6!) USER MOD Single : B 37 THR OG1 : rot 121:sc= -0.495 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= -1.76! C(o=-1.8!,f=-1.3!) USER MOD Single : B 59 GLN : amide:sc= -0.0358 X(o=-0.036,f=-0.3) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0358) USER MOD Single : B 71 ASN : amide:sc= -1.2 K(o=-1.2,f=-2.4!) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 93 N CYS A 7 14.585 1.411 1.780 1.00 0.00 N ATOM 94 CA CYS A 7 13.236 0.779 1.877 1.00 0.00 C ATOM 95 C CYS A 7 12.648 0.559 0.477 1.00 0.00 C ATOM 96 O CYS A 7 12.976 1.269 -0.452 1.00 0.00 O ATOM 97 CB CYS A 7 12.312 1.699 2.675 1.00 0.00 C ATOM 98 SG CYS A 7 12.533 1.743 4.470 1.00 0.00 S ATOM 0 HA CYS A 7 13.328 -0.186 2.375 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.436 2.713 2.295 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.283 1.405 2.469 1.00 0.00 H new ATOM 103 N GLN A 8 11.789 -0.424 0.354 1.00 0.00 N ATOM 104 CA GLN A 8 11.174 -0.686 -0.984 1.00 0.00 C ATOM 105 C GLN A 8 10.327 0.515 -1.419 1.00 0.00 C ATOM 106 O GLN A 8 10.170 0.771 -2.596 1.00 0.00 O ATOM 107 CB GLN A 8 10.285 -1.928 -0.900 1.00 0.00 C ATOM 108 CG GLN A 8 11.153 -3.184 -1.000 1.00 0.00 C ATOM 109 CD GLN A 8 11.152 -3.685 -2.446 1.00 0.00 C ATOM 110 OE1 GLN A 8 11.251 -2.819 -3.418 1.00 0.00 O flip ATOM 111 NE2 GLN A 8 11.061 -4.870 -2.705 1.00 0.00 N flip ATOM 0 H GLN A 8 11.492 -1.045 1.106 1.00 0.00 H new ATOM 0 HA GLN A 8 11.967 -0.847 -1.714 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.731 -1.929 0.039 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.549 -1.917 -1.704 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.171 -2.963 -0.680 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.771 -3.958 -0.334 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.983 -5.552 -1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 8 11.062 -5.181 -3.676 1.00 0.00 H new ATOM 120 N CYS A 9 9.804 1.226 -0.459 1.00 0.00 N ATOM 121 CA CYS A 9 8.968 2.414 -0.802 1.00 0.00 C ATOM 122 C CYS A 9 9.813 3.689 -0.769 1.00 0.00 C ATOM 123 O CYS A 9 10.456 3.987 0.219 1.00 0.00 O ATOM 124 CB CYS A 9 7.830 2.534 0.208 1.00 0.00 C ATOM 125 SG CYS A 9 6.387 1.474 -0.038 1.00 0.00 S ATOM 0 H CYS A 9 9.916 1.040 0.538 1.00 0.00 H new ATOM 0 HA CYS A 9 8.564 2.286 -1.806 1.00 0.00 H new ATOM 0 HB2 CYS A 9 8.235 2.327 1.199 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.491 3.570 0.212 1.00 0.00 H new ATOM 130 N ILE A 10 9.794 4.414 -1.857 1.00 0.00 N ATOM 131 CA ILE A 10 10.585 5.680 -1.913 1.00 0.00 C ATOM 132 C ILE A 10 9.667 6.878 -1.645 1.00 0.00 C ATOM 133 O ILE A 10 9.806 7.558 -0.647 1.00 0.00 O ATOM 134 CB ILE A 10 11.215 5.817 -3.300 1.00 0.00 C ATOM 135 CG1 ILE A 10 12.450 4.914 -3.385 1.00 0.00 C ATOM 136 CG2 ILE A 10 11.636 7.270 -3.521 1.00 0.00 C ATOM 137 CD1 ILE A 10 12.028 3.458 -3.175 1.00 0.00 C ATOM 0 H ILE A 10 9.270 4.188 -2.702 1.00 0.00 H new ATOM 0 HA ILE A 10 11.367 5.654 -1.155 1.00 0.00 H new ATOM 0 HB ILE A 10 10.493 5.524 -4.062 1.00 0.00 H new ATOM 0 HG12 ILE A 10 12.932 5.028 -4.356 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.180 5.205 -2.630 1.00 0.00 H new ATOM 0 HG21 ILE A 10 12.086 7.372 -4.509 1.00 0.00 H new ATOM 0 HG22 ILE A 10 10.761 7.917 -3.452 1.00 0.00 H new ATOM 0 HG23 ILE A 10 12.362 7.558 -2.760 1.00 0.00 H new ATOM 0 HD11 ILE A 10 12.905 2.813 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 10 11.565 3.351 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE A 10 11.313 3.171 -3.946 1.00 0.00 H new ATOM 149 N LYS A 11 8.746 7.106 -2.550 1.00 0.00 N ATOM 150 CA LYS A 11 7.796 8.250 -2.377 1.00 0.00 C ATOM 151 C LYS A 11 6.388 7.720 -2.086 1.00 0.00 C ATOM 152 O LYS A 11 6.042 6.625 -2.483 1.00 0.00 O ATOM 153 CB LYS A 11 7.772 9.077 -3.662 1.00 0.00 C ATOM 154 CG LYS A 11 7.536 10.546 -3.307 1.00 0.00 C ATOM 155 CD LYS A 11 7.236 11.330 -4.586 1.00 0.00 C ATOM 156 CE LYS A 11 5.723 11.365 -4.810 1.00 0.00 C ATOM 157 NZ LYS A 11 5.414 11.653 -6.239 1.00 0.00 N ATOM 0 H LYS A 11 8.611 6.553 -3.396 1.00 0.00 H new ATOM 0 HA LYS A 11 8.123 8.870 -1.542 1.00 0.00 H new ATOM 0 HB2 LYS A 11 8.715 8.966 -4.198 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.984 8.719 -4.325 1.00 0.00 H new ATOM 0 HG2 LYS A 11 6.704 10.635 -2.608 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.415 10.958 -2.811 1.00 0.00 H new ATOM 0 HD2 LYS A 11 7.628 12.344 -4.506 1.00 0.00 H new ATOM 0 HD3 LYS A 11 7.731 10.864 -5.438 1.00 0.00 H new ATOM 0 HE2 LYS A 11 5.285 10.409 -4.522 1.00 0.00 H new ATOM 0 HE3 LYS A 11 5.273 12.127 -4.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 4.383 11.673 -6.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 5.816 12.575 -6.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 5.827 10.911 -6.840 1.00 0.00 H new ATOM 171 N THR A 12 5.605 8.514 -1.398 1.00 0.00 N ATOM 172 CA THR A 12 4.214 8.073 -1.065 1.00 0.00 C ATOM 173 C THR A 12 3.196 8.783 -1.965 1.00 0.00 C ATOM 174 O THR A 12 3.547 9.647 -2.746 1.00 0.00 O ATOM 175 CB THR A 12 3.920 8.412 0.398 1.00 0.00 C ATOM 176 OG1 THR A 12 4.237 9.796 0.521 1.00 0.00 O ATOM 177 CG2 THR A 12 4.877 7.692 1.343 1.00 0.00 C ATOM 0 H THR A 12 5.865 9.439 -1.055 1.00 0.00 H new ATOM 0 HA THR A 12 4.134 6.998 -1.226 1.00 0.00 H new ATOM 0 HB THR A 12 2.894 8.139 0.644 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.070 10.089 1.441 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.639 7.956 2.373 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.776 6.615 1.212 1.00 0.00 H new ATOM 0 HG23 THR A 12 5.901 7.990 1.120 1.00 0.00 H new ATOM 185 N TYR A 13 1.955 8.399 -1.833 1.00 0.00 N ATOM 186 CA TYR A 13 0.890 9.034 -2.668 1.00 0.00 C ATOM 187 C TYR A 13 0.154 10.113 -1.860 1.00 0.00 C ATOM 188 O TYR A 13 -0.338 9.853 -0.779 1.00 0.00 O ATOM 189 CB TYR A 13 -0.098 7.951 -3.102 1.00 0.00 C ATOM 190 CG TYR A 13 -0.717 8.329 -4.451 1.00 0.00 C ATOM 191 CD1 TYR A 13 0.071 8.436 -5.579 1.00 0.00 C ATOM 192 CD2 TYR A 13 -2.071 8.565 -4.559 1.00 0.00 C ATOM 193 CE1 TYR A 13 -0.486 8.777 -6.794 1.00 0.00 C ATOM 194 CE2 TYR A 13 -2.630 8.904 -5.774 1.00 0.00 C ATOM 195 CZ TYR A 13 -1.842 9.013 -6.900 1.00 0.00 C ATOM 196 OH TYR A 13 -2.400 9.354 -8.115 1.00 0.00 O ATOM 0 H TYR A 13 1.632 7.678 -1.188 1.00 0.00 H new ATOM 0 HA TYR A 13 1.341 9.504 -3.542 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.411 6.991 -3.181 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.880 7.836 -2.351 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.133 8.251 -5.510 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.700 8.484 -3.685 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.143 8.860 -7.668 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.692 9.085 -5.843 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.365 9.483 -8.007 1.00 0.00 H new ATOM 206 N SER A 14 0.093 11.304 -2.410 1.00 0.00 N ATOM 207 CA SER A 14 -0.601 12.422 -1.690 1.00 0.00 C ATOM 208 C SER A 14 -1.953 12.732 -2.348 1.00 0.00 C ATOM 209 O SER A 14 -2.438 13.844 -2.273 1.00 0.00 O ATOM 210 CB SER A 14 0.281 13.668 -1.742 1.00 0.00 C ATOM 211 OG SER A 14 0.389 13.958 -3.128 1.00 0.00 O ATOM 0 H SER A 14 0.489 11.549 -3.317 1.00 0.00 H new ATOM 0 HA SER A 14 -0.776 12.123 -0.656 1.00 0.00 H new ATOM 0 HB2 SER A 14 -0.168 14.497 -1.195 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.258 13.484 -1.296 1.00 0.00 H new ATOM 0 HG SER A 14 0.945 14.755 -3.253 1.00 0.00 H new ATOM 217 N LYS A 15 -2.526 11.739 -2.978 1.00 0.00 N ATOM 218 CA LYS A 15 -3.850 11.943 -3.649 1.00 0.00 C ATOM 219 C LYS A 15 -4.811 10.781 -3.267 1.00 0.00 C ATOM 220 O LYS A 15 -4.693 9.704 -3.805 1.00 0.00 O ATOM 221 CB LYS A 15 -3.631 11.930 -5.163 1.00 0.00 C ATOM 222 CG LYS A 15 -3.725 13.364 -5.696 1.00 0.00 C ATOM 223 CD LYS A 15 -5.180 13.847 -5.613 1.00 0.00 C ATOM 224 CE LYS A 15 -5.714 14.078 -7.028 1.00 0.00 C ATOM 225 NZ LYS A 15 -7.107 14.608 -6.978 1.00 0.00 N ATOM 0 H LYS A 15 -2.138 10.799 -3.058 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.285 12.891 -3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.655 11.505 -5.398 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.378 11.300 -5.646 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -3.079 14.022 -5.115 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -3.376 13.403 -6.728 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.792 13.108 -5.096 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.237 14.769 -5.035 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.070 14.781 -7.557 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -5.694 13.143 -7.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -7.456 14.760 -7.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -7.721 13.924 -6.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.117 15.510 -6.461 1.00 0.00 H new ATOM 239 N PRO A 16 -5.758 11.016 -2.350 1.00 0.00 N ATOM 240 CA PRO A 16 -6.677 9.948 -1.918 1.00 0.00 C ATOM 241 C PRO A 16 -7.451 9.345 -3.097 1.00 0.00 C ATOM 242 O PRO A 16 -7.860 10.045 -4.002 1.00 0.00 O ATOM 243 CB PRO A 16 -7.634 10.613 -0.923 1.00 0.00 C ATOM 244 CG PRO A 16 -7.135 12.071 -0.703 1.00 0.00 C ATOM 245 CD PRO A 16 -5.995 12.323 -1.705 1.00 0.00 C ATOM 0 HA PRO A 16 -6.129 9.118 -1.471 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.653 10.610 -1.310 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.649 10.066 0.020 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.947 12.782 -0.858 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.784 12.206 0.320 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -6.274 13.080 -2.438 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -5.098 12.683 -1.200 1.00 0.00 H new ATOM 253 N PHE A 17 -7.635 8.046 -3.053 1.00 0.00 N ATOM 254 CA PHE A 17 -8.380 7.374 -4.153 1.00 0.00 C ATOM 255 C PHE A 17 -9.147 6.150 -3.617 1.00 0.00 C ATOM 256 O PHE A 17 -8.739 5.513 -2.666 1.00 0.00 O ATOM 257 CB PHE A 17 -7.408 6.966 -5.278 1.00 0.00 C ATOM 258 CG PHE A 17 -6.291 6.045 -4.754 1.00 0.00 C ATOM 259 CD1 PHE A 17 -5.361 6.500 -3.827 1.00 0.00 C ATOM 260 CD2 PHE A 17 -6.193 4.740 -5.208 1.00 0.00 C ATOM 261 CE1 PHE A 17 -4.365 5.665 -3.368 1.00 0.00 C ATOM 262 CE2 PHE A 17 -5.191 3.913 -4.748 1.00 0.00 C ATOM 263 CZ PHE A 17 -4.280 4.374 -3.829 1.00 0.00 C ATOM 0 H PHE A 17 -7.303 7.432 -2.309 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.108 8.073 -4.564 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -7.959 6.457 -6.069 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -6.967 7.859 -5.720 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.419 7.515 -3.464 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.907 4.368 -5.928 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.650 6.027 -2.644 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.122 2.898 -5.112 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.498 3.722 -3.469 1.00 0.00 H new ATOM 273 N HIS A 18 -10.246 5.864 -4.259 1.00 0.00 N ATOM 274 CA HIS A 18 -11.124 4.721 -3.829 1.00 0.00 C ATOM 275 C HIS A 18 -10.470 3.345 -4.155 1.00 0.00 C ATOM 276 O HIS A 18 -9.825 3.208 -5.176 1.00 0.00 O ATOM 277 CB HIS A 18 -12.414 4.849 -4.637 1.00 0.00 C ATOM 278 CG HIS A 18 -13.468 3.912 -4.088 1.00 0.00 C ATOM 279 ND1 HIS A 18 -13.446 2.598 -4.208 1.00 0.00 N ATOM 280 CD2 HIS A 18 -14.610 4.220 -3.374 1.00 0.00 C ATOM 281 CE1 HIS A 18 -14.492 2.119 -3.618 1.00 0.00 C ATOM 282 NE2 HIS A 18 -15.178 3.081 -3.126 1.00 0.00 N ATOM 0 H HIS A 18 -10.583 6.376 -5.074 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.291 4.762 -2.753 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -12.775 5.877 -4.599 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.221 4.617 -5.684 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -14.956 5.201 -3.084 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -14.747 1.072 -3.551 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -16.051 2.967 -2.610 1.00 0.00 H new ATOM 290 N PRO A 19 -10.648 2.334 -3.278 1.00 0.00 N ATOM 291 CA PRO A 19 -10.094 0.999 -3.549 1.00 0.00 C ATOM 292 C PRO A 19 -10.632 0.473 -4.887 1.00 0.00 C ATOM 293 O PRO A 19 -10.228 -0.567 -5.368 1.00 0.00 O ATOM 294 CB PRO A 19 -10.568 0.112 -2.393 1.00 0.00 C ATOM 295 CG PRO A 19 -11.387 1.013 -1.423 1.00 0.00 C ATOM 296 CD PRO A 19 -11.353 2.446 -1.979 1.00 0.00 C ATOM 0 HA PRO A 19 -9.006 1.013 -3.619 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -11.181 -0.709 -2.765 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -9.718 -0.334 -1.877 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -12.414 0.657 -1.345 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -10.962 0.981 -0.420 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.360 2.843 -2.109 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -10.829 3.120 -1.302 1.00 0.00 H new ATOM 304 N LYS A 20 -11.548 1.212 -5.438 1.00 0.00 N ATOM 305 CA LYS A 20 -12.146 0.832 -6.752 1.00 0.00 C ATOM 306 C LYS A 20 -11.035 0.552 -7.777 1.00 0.00 C ATOM 307 O LYS A 20 -11.253 -0.127 -8.762 1.00 0.00 O ATOM 308 CB LYS A 20 -13.003 2.015 -7.204 1.00 0.00 C ATOM 309 CG LYS A 20 -13.637 1.782 -8.574 1.00 0.00 C ATOM 310 CD LYS A 20 -14.221 3.120 -9.038 1.00 0.00 C ATOM 311 CE LYS A 20 -15.508 2.887 -9.815 1.00 0.00 C ATOM 312 NZ LYS A 20 -15.433 1.619 -10.595 1.00 0.00 N ATOM 0 H LYS A 20 -11.915 2.073 -5.033 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.748 -0.073 -6.664 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -13.788 2.194 -6.469 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.388 2.914 -7.239 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.894 1.420 -9.285 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.417 1.023 -8.513 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.418 3.758 -8.177 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.499 3.643 -9.664 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.352 2.846 -9.126 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.688 3.724 -10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.128 1.645 -11.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.478 1.511 -10.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.641 0.814 -9.970 1.00 0.00 H new ATOM 326 N PHE A 21 -9.865 1.071 -7.508 1.00 0.00 N ATOM 327 CA PHE A 21 -8.724 0.880 -8.462 1.00 0.00 C ATOM 328 C PHE A 21 -7.666 -0.064 -7.877 1.00 0.00 C ATOM 329 O PHE A 21 -6.689 -0.381 -8.528 1.00 0.00 O ATOM 330 CB PHE A 21 -8.109 2.248 -8.729 1.00 0.00 C ATOM 331 CG PHE A 21 -9.237 3.205 -9.123 1.00 0.00 C ATOM 332 CD1 PHE A 21 -9.827 3.111 -10.372 1.00 0.00 C ATOM 333 CD2 PHE A 21 -9.688 4.172 -8.238 1.00 0.00 C ATOM 334 CE1 PHE A 21 -10.850 3.965 -10.728 1.00 0.00 C ATOM 335 CE2 PHE A 21 -10.714 5.025 -8.599 1.00 0.00 C ATOM 336 CZ PHE A 21 -11.295 4.918 -9.842 1.00 0.00 C ATOM 0 H PHE A 21 -9.648 1.617 -6.674 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.089 0.431 -9.386 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -7.592 2.613 -7.842 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -7.368 2.184 -9.526 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -9.484 2.364 -11.072 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -9.235 4.259 -7.261 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -11.303 3.885 -11.705 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.060 5.776 -7.905 1.00 0.00 H new ATOM 0 HZ PHE A 21 -12.100 5.582 -10.121 1.00 0.00 H new ATOM 346 N ILE A 22 -7.888 -0.495 -6.669 1.00 0.00 N ATOM 347 CA ILE A 22 -6.912 -1.417 -6.017 1.00 0.00 C ATOM 348 C ILE A 22 -7.427 -2.855 -6.049 1.00 0.00 C ATOM 349 O ILE A 22 -8.564 -3.114 -5.708 1.00 0.00 O ATOM 350 CB ILE A 22 -6.714 -0.961 -4.584 1.00 0.00 C ATOM 351 CG1 ILE A 22 -5.845 0.300 -4.617 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.000 -2.054 -3.782 1.00 0.00 C ATOM 353 CD1 ILE A 22 -6.237 1.247 -3.485 1.00 0.00 C ATOM 0 H ILE A 22 -8.701 -0.251 -6.103 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.964 -1.392 -6.554 1.00 0.00 H new ATOM 0 HB ILE A 22 -7.675 -0.758 -4.112 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.794 0.027 -4.524 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.960 0.803 -5.577 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -5.861 -1.719 -2.754 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.602 -2.963 -3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -5.028 -2.259 -4.231 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.610 2.138 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.283 1.534 -3.596 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.098 0.746 -2.527 1.00 0.00 H new ATOM 365 N LYS A 23 -6.570 -3.759 -6.464 1.00 0.00 N ATOM 366 CA LYS A 23 -6.977 -5.188 -6.535 1.00 0.00 C ATOM 367 C LYS A 23 -5.996 -6.060 -5.750 1.00 0.00 C ATOM 368 O LYS A 23 -6.307 -7.189 -5.418 1.00 0.00 O ATOM 369 CB LYS A 23 -6.998 -5.640 -7.999 1.00 0.00 C ATOM 370 CG LYS A 23 -8.253 -5.096 -8.692 1.00 0.00 C ATOM 371 CD LYS A 23 -8.384 -5.753 -10.068 1.00 0.00 C ATOM 372 CE LYS A 23 -9.625 -5.200 -10.775 1.00 0.00 C ATOM 373 NZ LYS A 23 -9.508 -5.380 -12.251 1.00 0.00 N ATOM 0 H LYS A 23 -5.612 -3.564 -6.754 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.971 -5.293 -6.100 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.105 -5.284 -8.512 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -6.984 -6.729 -8.053 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.137 -5.305 -8.089 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.187 -4.013 -8.796 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -7.493 -5.556 -10.664 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.463 -6.835 -9.961 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.516 -5.710 -10.410 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.744 -4.142 -10.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -9.613 -4.459 -12.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -8.576 -5.782 -12.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.254 -6.025 -12.582 1.00 0.00 H new ATOM 387 N GLU A 24 -4.830 -5.528 -5.473 1.00 0.00 N ATOM 388 CA GLU A 24 -3.824 -6.336 -4.703 1.00 0.00 C ATOM 389 C GLU A 24 -3.148 -5.473 -3.632 1.00 0.00 C ATOM 390 O GLU A 24 -2.600 -4.430 -3.927 1.00 0.00 O ATOM 391 CB GLU A 24 -2.766 -6.871 -5.666 1.00 0.00 C ATOM 392 CG GLU A 24 -1.746 -7.707 -4.885 1.00 0.00 C ATOM 393 CD GLU A 24 -0.467 -6.889 -4.688 1.00 0.00 C ATOM 394 OE1 GLU A 24 -0.599 -5.795 -4.164 1.00 0.00 O ATOM 395 OE2 GLU A 24 0.569 -7.405 -5.073 1.00 0.00 O ATOM 0 H GLU A 24 -4.532 -4.589 -5.739 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.336 -7.164 -4.213 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.236 -7.479 -6.439 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -2.266 -6.044 -6.171 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -2.159 -7.996 -3.919 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -1.523 -8.627 -5.425 1.00 0.00 H new ATOM 402 N LEU A 25 -3.202 -5.936 -2.408 1.00 0.00 N ATOM 403 CA LEU A 25 -2.569 -5.168 -1.296 1.00 0.00 C ATOM 404 C LEU A 25 -1.235 -5.808 -0.904 1.00 0.00 C ATOM 405 O LEU A 25 -1.025 -6.987 -1.106 1.00 0.00 O ATOM 406 CB LEU A 25 -3.506 -5.171 -0.091 1.00 0.00 C ATOM 407 CG LEU A 25 -3.175 -3.979 0.810 1.00 0.00 C ATOM 408 CD1 LEU A 25 -3.971 -2.759 0.345 1.00 0.00 C ATOM 409 CD2 LEU A 25 -3.563 -4.315 2.251 1.00 0.00 C ATOM 0 H LEU A 25 -3.655 -6.808 -2.133 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.387 -4.145 -1.625 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.543 -5.114 -0.422 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.399 -6.102 0.465 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.108 -3.763 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.738 -1.907 0.984 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.706 -2.523 -0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.037 -2.976 0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.329 -3.469 2.897 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.631 -4.525 2.301 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.005 -5.190 2.583 1.00 0.00 H new ATOM 421 N ARG A 26 -0.361 -5.014 -0.346 1.00 0.00 N ATOM 422 CA ARG A 26 0.966 -5.557 0.063 1.00 0.00 C ATOM 423 C ARG A 26 1.493 -4.798 1.286 1.00 0.00 C ATOM 424 O ARG A 26 1.485 -3.584 1.312 1.00 0.00 O ATOM 425 CB ARG A 26 1.942 -5.400 -1.092 1.00 0.00 C ATOM 426 CG ARG A 26 2.049 -6.730 -1.843 1.00 0.00 C ATOM 427 CD ARG A 26 2.976 -6.566 -3.052 1.00 0.00 C ATOM 428 NE ARG A 26 4.335 -7.061 -2.695 1.00 0.00 N ATOM 429 CZ ARG A 26 5.361 -6.680 -3.406 1.00 0.00 C ATOM 430 NH1 ARG A 26 5.150 -6.047 -4.527 1.00 0.00 N ATOM 431 NH2 ARG A 26 6.564 -6.944 -2.972 1.00 0.00 N ATOM 0 H ARG A 26 -0.506 -4.022 -0.157 1.00 0.00 H new ATOM 0 HA ARG A 26 0.861 -6.611 0.322 1.00 0.00 H new ATOM 0 HB2 ARG A 26 1.603 -4.614 -1.766 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.921 -5.099 -0.719 1.00 0.00 H new ATOM 0 HG2 ARG A 26 2.434 -7.504 -1.179 1.00 0.00 H new ATOM 0 HG3 ARG A 26 1.061 -7.054 -2.171 1.00 0.00 H new ATOM 0 HD2 ARG A 26 2.585 -7.122 -3.904 1.00 0.00 H new ATOM 0 HD3 ARG A 26 3.024 -5.519 -3.350 1.00 0.00 H new ATOM 0 HE ARG A 26 4.462 -7.691 -1.903 1.00 0.00 H new ATOM 0 HH11 ARG A 26 4.196 -5.858 -4.834 1.00 0.00 H new ATOM 0 HH12 ARG A 26 5.939 -5.741 -5.096 1.00 0.00 H new ATOM 0 HH21 ARG A 26 6.690 -7.441 -2.090 1.00 0.00 H new ATOM 0 HH22 ARG A 26 7.377 -6.654 -3.515 1.00 0.00 H new ATOM 445 N VAL A 27 1.941 -5.536 2.272 1.00 0.00 N ATOM 446 CA VAL A 27 2.476 -4.880 3.508 1.00 0.00 C ATOM 447 C VAL A 27 3.824 -5.497 3.890 1.00 0.00 C ATOM 448 O VAL A 27 3.888 -6.632 4.322 1.00 0.00 O ATOM 449 CB VAL A 27 1.481 -5.078 4.651 1.00 0.00 C ATOM 450 CG1 VAL A 27 1.920 -4.236 5.851 1.00 0.00 C ATOM 451 CG2 VAL A 27 0.094 -4.623 4.196 1.00 0.00 C ATOM 0 H VAL A 27 1.960 -6.556 2.276 1.00 0.00 H new ATOM 0 HA VAL A 27 2.616 -3.816 3.319 1.00 0.00 H new ATOM 0 HB VAL A 27 1.448 -6.131 4.932 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.214 -4.373 6.670 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.913 -4.550 6.172 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.946 -3.184 5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.619 -4.762 5.008 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.129 -3.569 3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.218 -5.213 3.334 1.00 0.00 H new ATOM 461 N ILE A 28 4.870 -4.731 3.726 1.00 0.00 N ATOM 462 CA ILE A 28 6.232 -5.246 4.068 1.00 0.00 C ATOM 463 C ILE A 28 6.722 -4.613 5.375 1.00 0.00 C ATOM 464 O ILE A 28 6.805 -3.405 5.492 1.00 0.00 O ATOM 465 CB ILE A 28 7.192 -4.895 2.927 1.00 0.00 C ATOM 466 CG1 ILE A 28 6.848 -5.760 1.704 1.00 0.00 C ATOM 467 CG2 ILE A 28 8.631 -5.182 3.365 1.00 0.00 C ATOM 468 CD1 ILE A 28 7.635 -5.271 0.480 1.00 0.00 C ATOM 0 H ILE A 28 4.843 -3.775 3.372 1.00 0.00 H new ATOM 0 HA ILE A 28 6.193 -6.327 4.200 1.00 0.00 H new ATOM 0 HB ILE A 28 7.096 -3.839 2.674 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.087 -6.804 1.907 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.778 -5.711 1.502 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.315 -4.933 2.554 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.872 -4.579 4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.732 -6.239 3.613 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.386 -5.889 -0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 28 7.375 -4.233 0.271 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.704 -5.343 0.682 1.00 0.00 H new ATOM 480 N GLU A 29 7.037 -5.444 6.331 1.00 0.00 N ATOM 481 CA GLU A 29 7.518 -4.915 7.642 1.00 0.00 C ATOM 482 C GLU A 29 9.027 -4.642 7.585 1.00 0.00 C ATOM 483 O GLU A 29 9.702 -5.084 6.677 1.00 0.00 O ATOM 484 CB GLU A 29 7.224 -5.948 8.729 1.00 0.00 C ATOM 485 CG GLU A 29 7.802 -5.462 10.060 1.00 0.00 C ATOM 486 CD GLU A 29 7.129 -6.214 11.210 1.00 0.00 C ATOM 487 OE1 GLU A 29 6.771 -7.356 10.972 1.00 0.00 O ATOM 488 OE2 GLU A 29 7.013 -5.606 12.260 1.00 0.00 O ATOM 0 H GLU A 29 6.983 -6.460 6.263 1.00 0.00 H new ATOM 0 HA GLU A 29 7.004 -3.980 7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.149 -6.100 8.821 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.660 -6.910 8.460 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.879 -5.627 10.084 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.642 -4.389 10.169 1.00 0.00 H new ATOM 495 N SER A 30 9.514 -3.905 8.558 1.00 0.00 N ATOM 496 CA SER A 30 10.979 -3.590 8.601 1.00 0.00 C ATOM 497 C SER A 30 11.804 -4.799 8.146 1.00 0.00 C ATOM 498 O SER A 30 11.742 -5.854 8.746 1.00 0.00 O ATOM 499 CB SER A 30 11.366 -3.226 10.032 1.00 0.00 C ATOM 500 OG SER A 30 10.871 -4.305 10.811 1.00 0.00 O ATOM 0 H SER A 30 8.963 -3.510 9.320 1.00 0.00 H new ATOM 0 HA SER A 30 11.182 -2.756 7.930 1.00 0.00 H new ATOM 0 HB2 SER A 30 12.446 -3.120 10.138 1.00 0.00 H new ATOM 0 HB3 SER A 30 10.922 -2.278 10.336 1.00 0.00 H new ATOM 0 HG SER A 30 10.948 -5.139 10.302 1.00 0.00 H new ATOM 506 N GLY A 31 12.557 -4.608 7.093 1.00 0.00 N ATOM 507 CA GLY A 31 13.398 -5.724 6.561 1.00 0.00 C ATOM 508 C GLY A 31 14.877 -5.316 6.557 1.00 0.00 C ATOM 509 O GLY A 31 15.239 -4.274 7.069 1.00 0.00 O ATOM 0 H GLY A 31 12.626 -3.730 6.579 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.261 -6.616 7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 31 13.080 -5.979 5.550 1.00 0.00 H new ATOM 513 N PRO A 32 15.705 -6.154 5.970 1.00 0.00 N ATOM 514 CA PRO A 32 17.148 -5.893 5.899 1.00 0.00 C ATOM 515 C PRO A 32 17.412 -4.640 5.061 1.00 0.00 C ATOM 516 O PRO A 32 18.537 -4.202 4.925 1.00 0.00 O ATOM 517 CB PRO A 32 17.749 -7.132 5.223 1.00 0.00 C ATOM 518 CG PRO A 32 16.570 -8.105 4.906 1.00 0.00 C ATOM 519 CD PRO A 32 15.268 -7.405 5.333 1.00 0.00 C ATOM 0 HA PRO A 32 17.586 -5.719 6.882 1.00 0.00 H new ATOM 0 HB2 PRO A 32 18.275 -6.854 4.309 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.478 -7.611 5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 32 16.546 -8.345 3.843 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.694 -9.046 5.443 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.625 -7.208 4.475 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.696 -8.022 6.025 1.00 0.00 H new ATOM 527 N HIS A 33 16.354 -4.100 4.523 1.00 0.00 N ATOM 528 CA HIS A 33 16.479 -2.871 3.685 1.00 0.00 C ATOM 529 C HIS A 33 15.655 -1.741 4.303 1.00 0.00 C ATOM 530 O HIS A 33 15.928 -0.577 4.085 1.00 0.00 O ATOM 531 CB HIS A 33 15.930 -3.175 2.297 1.00 0.00 C ATOM 532 CG HIS A 33 14.414 -3.336 2.402 1.00 0.00 C ATOM 533 ND1 HIS A 33 13.811 -4.125 3.230 1.00 0.00 N ATOM 534 CD2 HIS A 33 13.393 -2.688 1.702 1.00 0.00 C ATOM 535 CE1 HIS A 33 12.542 -4.028 3.113 1.00 0.00 C ATOM 536 NE2 HIS A 33 12.257 -3.156 2.188 1.00 0.00 N ATOM 0 H HIS A 33 15.404 -4.457 4.627 1.00 0.00 H new ATOM 0 HA HIS A 33 17.525 -2.569 3.627 1.00 0.00 H new ATOM 0 HB2 HIS A 33 16.179 -2.369 1.606 1.00 0.00 H new ATOM 0 HB3 HIS A 33 16.381 -4.085 1.902 1.00 0.00 H new ATOM 0 HD2 HIS A 33 13.509 -1.952 0.920 1.00 0.00 H new ATOM 0 HE1 HIS A 33 11.818 -4.583 3.691 1.00 0.00 H new ATOM 0 HE2 HIS A 33 11.320 -2.882 1.891 1.00 0.00 H new ATOM 544 N CYS A 34 14.658 -2.121 5.066 1.00 0.00 N ATOM 545 CA CYS A 34 13.777 -1.099 5.710 1.00 0.00 C ATOM 546 C CYS A 34 13.705 -1.338 7.221 1.00 0.00 C ATOM 547 O CYS A 34 13.532 -2.455 7.667 1.00 0.00 O ATOM 548 CB CYS A 34 12.375 -1.210 5.113 1.00 0.00 C ATOM 549 SG CYS A 34 11.332 0.270 5.153 1.00 0.00 S ATOM 0 H CYS A 34 14.418 -3.091 5.269 1.00 0.00 H new ATOM 0 HA CYS A 34 14.186 -0.105 5.530 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.475 -1.523 4.074 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.848 -2.008 5.637 1.00 0.00 H new ATOM 554 N ALA A 35 13.836 -0.279 7.973 1.00 0.00 N ATOM 555 CA ALA A 35 13.776 -0.416 9.455 1.00 0.00 C ATOM 556 C ALA A 35 12.388 -0.014 9.966 1.00 0.00 C ATOM 557 O ALA A 35 12.238 0.398 11.099 1.00 0.00 O ATOM 558 CB ALA A 35 14.832 0.492 10.083 1.00 0.00 C ATOM 0 H ALA A 35 13.981 0.670 7.627 1.00 0.00 H new ATOM 0 HA ALA A 35 13.966 -1.454 9.729 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.794 0.397 11.168 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.820 0.201 9.727 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.636 1.527 9.802 1.00 0.00 H new ATOM 564 N ASN A 36 11.403 -0.141 9.118 1.00 0.00 N ATOM 565 CA ASN A 36 10.021 0.235 9.542 1.00 0.00 C ATOM 566 C ASN A 36 8.976 -0.531 8.723 1.00 0.00 C ATOM 567 O ASN A 36 9.272 -1.524 8.101 1.00 0.00 O ATOM 568 CB ASN A 36 9.831 1.737 9.332 1.00 0.00 C ATOM 569 CG ASN A 36 10.844 2.499 10.187 1.00 0.00 C ATOM 570 OD1 ASN A 36 10.607 2.787 11.344 1.00 0.00 O ATOM 571 ND2 ASN A 36 11.986 2.846 9.659 1.00 0.00 N ATOM 0 H ASN A 36 11.492 -0.484 8.162 1.00 0.00 H new ATOM 0 HA ASN A 36 9.890 -0.019 10.594 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.964 1.988 8.280 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.816 2.028 9.604 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.672 3.355 10.216 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.193 2.608 8.689 1.00 0.00 H new ATOM 578 N THR A 37 7.772 -0.044 8.755 1.00 0.00 N ATOM 579 CA THR A 37 6.675 -0.716 7.992 1.00 0.00 C ATOM 580 C THR A 37 6.287 0.114 6.764 1.00 0.00 C ATOM 581 O THR A 37 6.207 1.325 6.830 1.00 0.00 O ATOM 582 CB THR A 37 5.465 -0.879 8.907 1.00 0.00 C ATOM 583 OG1 THR A 37 5.541 -2.226 9.362 1.00 0.00 O ATOM 584 CG2 THR A 37 4.146 -0.784 8.141 1.00 0.00 C ATOM 0 H THR A 37 7.494 0.789 9.274 1.00 0.00 H new ATOM 0 HA THR A 37 7.020 -1.692 7.652 1.00 0.00 H new ATOM 0 HB THR A 37 5.481 -0.110 9.680 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.587 -2.239 10.341 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.313 -0.906 8.834 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.076 0.190 7.657 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.107 -1.568 7.385 1.00 0.00 H new ATOM 592 N GLU A 38 6.056 -0.565 5.668 1.00 0.00 N ATOM 593 CA GLU A 38 5.665 0.150 4.416 1.00 0.00 C ATOM 594 C GLU A 38 4.457 -0.543 3.779 1.00 0.00 C ATOM 595 O GLU A 38 4.493 -1.724 3.498 1.00 0.00 O ATOM 596 CB GLU A 38 6.841 0.127 3.439 1.00 0.00 C ATOM 597 CG GLU A 38 8.087 0.673 4.139 1.00 0.00 C ATOM 598 CD GLU A 38 7.844 2.128 4.544 1.00 0.00 C ATOM 599 OE1 GLU A 38 7.506 2.889 3.652 1.00 0.00 O ATOM 600 OE2 GLU A 38 8.009 2.397 5.723 1.00 0.00 O ATOM 0 H GLU A 38 6.121 -1.580 5.587 1.00 0.00 H new ATOM 0 HA GLU A 38 5.401 1.181 4.652 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.021 -0.890 3.092 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.610 0.728 2.559 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.316 0.072 5.019 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.949 0.608 3.475 1.00 0.00 H new ATOM 607 N ILE A 39 3.411 0.207 3.565 1.00 0.00 N ATOM 608 CA ILE A 39 2.191 -0.400 2.958 1.00 0.00 C ATOM 609 C ILE A 39 2.184 -0.196 1.439 1.00 0.00 C ATOM 610 O ILE A 39 1.790 0.844 0.951 1.00 0.00 O ATOM 611 CB ILE A 39 0.951 0.259 3.564 1.00 0.00 C ATOM 612 CG1 ILE A 39 0.942 0.013 5.075 1.00 0.00 C ATOM 613 CG2 ILE A 39 -0.304 -0.356 2.942 1.00 0.00 C ATOM 614 CD1 ILE A 39 -0.158 0.862 5.719 1.00 0.00 C ATOM 0 H ILE A 39 3.347 1.202 3.781 1.00 0.00 H new ATOM 0 HA ILE A 39 2.188 -1.470 3.165 1.00 0.00 H new ATOM 0 HB ILE A 39 0.968 1.331 3.365 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.770 -1.043 5.282 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.912 0.268 5.502 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.190 0.112 3.372 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.294 -0.192 1.864 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.324 -1.427 3.146 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.168 0.690 6.795 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.034 1.917 5.522 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.125 0.585 5.299 1.00 0.00 H new ATOM 626 N ILE A 40 2.622 -1.197 0.726 1.00 0.00 N ATOM 627 CA ILE A 40 2.636 -1.083 -0.762 1.00 0.00 C ATOM 628 C ILE A 40 1.305 -1.587 -1.326 1.00 0.00 C ATOM 629 O ILE A 40 0.560 -2.264 -0.646 1.00 0.00 O ATOM 630 CB ILE A 40 3.784 -1.923 -1.320 1.00 0.00 C ATOM 631 CG1 ILE A 40 5.111 -1.338 -0.839 1.00 0.00 C ATOM 632 CG2 ILE A 40 3.739 -1.890 -2.848 1.00 0.00 C ATOM 633 CD1 ILE A 40 6.104 -2.474 -0.598 1.00 0.00 C ATOM 0 H ILE A 40 2.967 -2.080 1.103 1.00 0.00 H new ATOM 0 HA ILE A 40 2.775 -0.041 -1.049 1.00 0.00 H new ATOM 0 HB ILE A 40 3.689 -2.953 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.507 -0.645 -1.581 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.960 -0.770 0.079 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.557 -2.488 -3.249 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.788 -2.297 -3.193 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.839 -0.861 -3.193 1.00 0.00 H new ATOM 0 HD11 ILE A 40 7.053 -2.061 -0.255 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.707 -3.150 0.159 1.00 0.00 H new ATOM 0 HD13 ILE A 40 6.262 -3.022 -1.527 1.00 0.00 H new ATOM 645 N VAL A 41 1.032 -1.252 -2.555 1.00 0.00 N ATOM 646 CA VAL A 41 -0.254 -1.706 -3.157 1.00 0.00 C ATOM 647 C VAL A 41 -0.141 -1.775 -4.686 1.00 0.00 C ATOM 648 O VAL A 41 0.753 -1.192 -5.267 1.00 0.00 O ATOM 649 CB VAL A 41 -1.352 -0.719 -2.759 1.00 0.00 C ATOM 650 CG1 VAL A 41 -1.079 0.639 -3.420 1.00 0.00 C ATOM 651 CG2 VAL A 41 -2.708 -1.251 -3.221 1.00 0.00 C ATOM 0 H VAL A 41 1.632 -0.693 -3.162 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.495 -2.704 -2.791 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.361 -0.600 -1.676 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.860 1.345 -3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.112 1.017 -3.089 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.071 0.521 -4.504 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.491 -0.547 -2.937 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.702 -1.370 -4.304 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.900 -2.216 -2.751 1.00 0.00 H new ATOM 661 N LYS A 42 -1.057 -2.491 -5.301 1.00 0.00 N ATOM 662 CA LYS A 42 -1.026 -2.613 -6.795 1.00 0.00 C ATOM 663 C LYS A 42 -2.406 -2.301 -7.387 1.00 0.00 C ATOM 664 O LYS A 42 -3.415 -2.864 -6.974 1.00 0.00 O ATOM 665 CB LYS A 42 -0.625 -4.039 -7.182 1.00 0.00 C ATOM 666 CG LYS A 42 0.591 -3.997 -8.118 1.00 0.00 C ATOM 667 CD LYS A 42 0.799 -5.384 -8.732 1.00 0.00 C ATOM 668 CE LYS A 42 0.959 -6.415 -7.614 1.00 0.00 C ATOM 669 NZ LYS A 42 1.673 -7.622 -8.117 1.00 0.00 N ATOM 0 H LYS A 42 -1.816 -2.991 -4.838 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.301 -1.901 -7.189 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.389 -4.616 -6.288 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.458 -4.541 -7.674 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.435 -3.258 -8.904 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.480 -3.693 -7.566 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.050 -5.645 -9.364 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.683 -5.383 -9.370 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.513 -5.977 -6.784 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.021 -6.698 -7.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.774 -8.312 -7.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 1.129 -8.048 -8.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.615 -7.349 -8.462 1.00 0.00 H new ATOM 683 N LEU A 43 -2.416 -1.414 -8.351 1.00 0.00 N ATOM 684 CA LEU A 43 -3.704 -1.038 -8.999 1.00 0.00 C ATOM 685 C LEU A 43 -3.903 -1.838 -10.290 1.00 0.00 C ATOM 686 O LEU A 43 -2.974 -2.031 -11.055 1.00 0.00 O ATOM 687 CB LEU A 43 -3.686 0.456 -9.320 1.00 0.00 C ATOM 688 CG LEU A 43 -3.986 1.247 -8.045 1.00 0.00 C ATOM 689 CD1 LEU A 43 -2.923 0.930 -6.992 1.00 0.00 C ATOM 690 CD2 LEU A 43 -3.951 2.743 -8.362 1.00 0.00 C ATOM 0 H LEU A 43 -1.590 -0.937 -8.714 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.526 -1.262 -8.319 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.713 0.743 -9.720 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.426 0.685 -10.087 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.971 0.974 -7.666 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.133 1.492 -6.082 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.937 -0.137 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.940 1.209 -7.372 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.164 3.312 -7.457 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.963 3.013 -8.736 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.701 2.972 -9.119 1.00 0.00 H new ATOM 702 N SER A 44 -5.118 -2.277 -10.501 1.00 0.00 N ATOM 703 CA SER A 44 -5.424 -3.079 -11.727 1.00 0.00 C ATOM 704 C SER A 44 -4.845 -2.413 -12.978 1.00 0.00 C ATOM 705 O SER A 44 -4.596 -3.068 -13.970 1.00 0.00 O ATOM 706 CB SER A 44 -6.938 -3.193 -11.877 1.00 0.00 C ATOM 707 OG SER A 44 -7.306 -2.018 -12.582 1.00 0.00 O ATOM 0 H SER A 44 -5.911 -2.116 -9.879 1.00 0.00 H new ATOM 0 HA SER A 44 -4.973 -4.066 -11.621 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.217 -4.092 -12.427 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.432 -3.247 -10.907 1.00 0.00 H new ATOM 0 HG SER A 44 -8.276 -2.012 -12.724 1.00 0.00 H new ATOM 713 N ASP A 45 -4.642 -1.129 -12.910 1.00 0.00 N ATOM 714 CA ASP A 45 -4.088 -0.421 -14.099 1.00 0.00 C ATOM 715 C ASP A 45 -2.726 -1.014 -14.470 1.00 0.00 C ATOM 716 O ASP A 45 -2.157 -0.683 -15.490 1.00 0.00 O ATOM 717 CB ASP A 45 -3.929 1.061 -13.770 1.00 0.00 C ATOM 718 CG ASP A 45 -3.278 1.207 -12.393 1.00 0.00 C ATOM 719 OD1 ASP A 45 -2.506 0.324 -12.063 1.00 0.00 O ATOM 720 OD2 ASP A 45 -3.592 2.195 -11.749 1.00 0.00 O ATOM 0 H ASP A 45 -4.832 -0.544 -12.096 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.768 -0.540 -14.942 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.317 1.550 -14.528 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -4.901 1.554 -13.779 1.00 0.00 H new ATOM 725 N GLY A 46 -2.235 -1.882 -13.629 1.00 0.00 N ATOM 726 CA GLY A 46 -0.916 -2.509 -13.909 1.00 0.00 C ATOM 727 C GLY A 46 0.203 -1.659 -13.316 1.00 0.00 C ATOM 728 O GLY A 46 1.332 -1.724 -13.760 1.00 0.00 O ATOM 0 H GLY A 46 -2.688 -2.182 -12.766 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.884 -3.513 -13.486 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -0.774 -2.612 -14.985 1.00 0.00 H new ATOM 732 N ARG A 47 -0.139 -0.878 -12.318 1.00 0.00 N ATOM 733 CA ARG A 47 0.890 0.006 -11.681 1.00 0.00 C ATOM 734 C ARG A 47 1.034 -0.320 -10.192 1.00 0.00 C ATOM 735 O ARG A 47 0.235 -1.043 -9.631 1.00 0.00 O ATOM 736 CB ARG A 47 0.455 1.460 -11.838 1.00 0.00 C ATOM 737 CG ARG A 47 0.297 1.780 -13.329 1.00 0.00 C ATOM 738 CD ARG A 47 -0.484 3.086 -13.488 1.00 0.00 C ATOM 739 NE ARG A 47 0.357 4.216 -13.000 1.00 0.00 N ATOM 740 CZ ARG A 47 1.389 4.595 -13.703 1.00 0.00 C ATOM 741 NH1 ARG A 47 1.614 4.019 -14.852 1.00 0.00 N ATOM 742 NH2 ARG A 47 2.163 5.535 -13.233 1.00 0.00 N ATOM 0 H ARG A 47 -1.076 -0.814 -11.920 1.00 0.00 H new ATOM 0 HA ARG A 47 1.851 -0.158 -12.168 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.487 1.629 -11.316 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.193 2.124 -11.387 1.00 0.00 H new ATOM 0 HG2 ARG A 47 1.276 1.870 -13.799 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.225 0.967 -13.833 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -0.752 3.240 -14.533 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -1.416 3.039 -12.924 1.00 0.00 H new ATOM 0 HE ARG A 47 0.128 4.688 -12.125 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.988 3.286 -15.186 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.416 4.302 -15.416 1.00 0.00 H new ATOM 0 HH21 ARG A 47 1.957 5.961 -12.329 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.974 5.843 -13.769 1.00 0.00 H new ATOM 756 N GLU A 48 2.057 0.226 -9.588 1.00 0.00 N ATOM 757 CA GLU A 48 2.283 -0.026 -8.134 1.00 0.00 C ATOM 758 C GLU A 48 2.679 1.276 -7.432 1.00 0.00 C ATOM 759 O GLU A 48 3.481 2.036 -7.939 1.00 0.00 O ATOM 760 CB GLU A 48 3.397 -1.060 -7.968 1.00 0.00 C ATOM 761 CG GLU A 48 4.645 -0.582 -8.713 1.00 0.00 C ATOM 762 CD GLU A 48 5.700 -1.690 -8.691 1.00 0.00 C ATOM 763 OE1 GLU A 48 5.418 -2.717 -9.288 1.00 0.00 O ATOM 764 OE2 GLU A 48 6.728 -1.447 -8.082 1.00 0.00 O ATOM 0 H GLU A 48 2.743 0.833 -10.036 1.00 0.00 H new ATOM 0 HA GLU A 48 1.364 -0.403 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.622 -1.202 -6.911 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.074 -2.025 -8.358 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.393 -0.324 -9.742 1.00 0.00 H new ATOM 0 HG3 GLU A 48 5.039 0.321 -8.246 1.00 0.00 H new ATOM 771 N LEU A 49 2.102 1.503 -6.280 1.00 0.00 N ATOM 772 CA LEU A 49 2.423 2.754 -5.522 1.00 0.00 C ATOM 773 C LEU A 49 2.677 2.429 -4.047 1.00 0.00 C ATOM 774 O LEU A 49 2.700 1.278 -3.657 1.00 0.00 O ATOM 775 CB LEU A 49 1.244 3.719 -5.635 1.00 0.00 C ATOM 776 CG LEU A 49 0.982 4.024 -7.112 1.00 0.00 C ATOM 777 CD1 LEU A 49 -0.239 3.232 -7.583 1.00 0.00 C ATOM 778 CD2 LEU A 49 0.706 5.520 -7.276 1.00 0.00 C ATOM 0 H LEU A 49 1.427 0.883 -5.832 1.00 0.00 H new ATOM 0 HA LEU A 49 3.320 3.209 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.356 3.282 -5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.460 4.640 -5.094 1.00 0.00 H new ATOM 0 HG LEU A 49 1.852 3.743 -7.705 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.429 3.447 -8.635 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.051 2.166 -7.459 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.109 3.518 -6.992 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.519 5.742 -8.327 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.168 5.796 -6.685 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.570 6.089 -6.933 1.00 0.00 H new ATOM 790 N CYS A 50 2.864 3.458 -3.259 1.00 0.00 N ATOM 791 CA CYS A 50 3.119 3.241 -1.803 1.00 0.00 C ATOM 792 C CYS A 50 2.324 4.250 -0.968 1.00 0.00 C ATOM 793 O CYS A 50 2.369 5.440 -1.222 1.00 0.00 O ATOM 794 CB CYS A 50 4.611 3.417 -1.526 1.00 0.00 C ATOM 795 SG CYS A 50 5.691 2.005 -1.859 1.00 0.00 S ATOM 0 H CYS A 50 2.851 4.433 -3.559 1.00 0.00 H new ATOM 0 HA CYS A 50 2.804 2.234 -1.531 1.00 0.00 H new ATOM 0 HB2 CYS A 50 4.966 4.260 -2.118 1.00 0.00 H new ATOM 0 HB3 CYS A 50 4.729 3.692 -0.478 1.00 0.00 H new ATOM 800 N LEU A 51 1.612 3.747 0.010 1.00 0.00 N ATOM 801 CA LEU A 51 0.798 4.651 0.882 1.00 0.00 C ATOM 802 C LEU A 51 1.364 4.659 2.305 1.00 0.00 C ATOM 803 O LEU A 51 1.872 3.659 2.774 1.00 0.00 O ATOM 804 CB LEU A 51 -0.645 4.143 0.921 1.00 0.00 C ATOM 805 CG LEU A 51 -1.106 3.799 -0.500 1.00 0.00 C ATOM 806 CD1 LEU A 51 -2.559 3.321 -0.451 1.00 0.00 C ATOM 807 CD2 LEU A 51 -1.020 5.049 -1.378 1.00 0.00 C ATOM 0 H LEU A 51 1.559 2.755 0.242 1.00 0.00 H new ATOM 0 HA LEU A 51 0.830 5.663 0.478 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.714 3.263 1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.297 4.902 1.352 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.470 3.016 -0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.895 3.074 -1.458 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.630 2.437 0.182 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.188 4.111 -0.042 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.347 4.807 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.661 5.828 -0.966 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.010 5.404 -1.406 1.00 0.00 H new ATOM 819 N ASP A 52 1.262 5.792 2.958 1.00 0.00 N ATOM 820 CA ASP A 52 1.785 5.896 4.357 1.00 0.00 C ATOM 821 C ASP A 52 0.601 6.129 5.344 1.00 0.00 C ATOM 822 O ASP A 52 -0.266 6.934 5.065 1.00 0.00 O ATOM 823 CB ASP A 52 2.737 7.088 4.435 1.00 0.00 C ATOM 824 CG ASP A 52 3.616 6.956 5.679 1.00 0.00 C ATOM 825 OD1 ASP A 52 3.074 7.172 6.751 1.00 0.00 O ATOM 826 OD2 ASP A 52 4.781 6.645 5.489 1.00 0.00 O ATOM 0 H ASP A 52 0.842 6.644 2.586 1.00 0.00 H new ATOM 0 HA ASP A 52 2.304 4.976 4.625 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.358 7.130 3.540 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.170 8.018 4.474 1.00 0.00 H new ATOM 831 N PRO A 53 0.575 5.426 6.484 1.00 0.00 N ATOM 832 CA PRO A 53 -0.512 5.612 7.459 1.00 0.00 C ATOM 833 C PRO A 53 -0.540 7.060 7.962 1.00 0.00 C ATOM 834 O PRO A 53 -1.442 7.457 8.673 1.00 0.00 O ATOM 835 CB PRO A 53 -0.192 4.658 8.616 1.00 0.00 C ATOM 836 CG PRO A 53 1.166 3.968 8.289 1.00 0.00 C ATOM 837 CD PRO A 53 1.588 4.426 6.882 1.00 0.00 C ATOM 0 HA PRO A 53 -1.487 5.406 7.018 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -0.128 5.204 9.557 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -0.982 3.916 8.731 1.00 0.00 H new ATOM 0 HG2 PRO A 53 1.922 4.242 9.025 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.064 2.883 8.325 1.00 0.00 H new ATOM 0 HD2 PRO A 53 2.588 4.860 6.892 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.611 3.588 6.185 1.00 0.00 H new ATOM 845 N LYS A 54 0.453 7.813 7.581 1.00 0.00 N ATOM 846 CA LYS A 54 0.516 9.229 8.030 1.00 0.00 C ATOM 847 C LYS A 54 -0.762 9.980 7.642 1.00 0.00 C ATOM 848 O LYS A 54 -1.088 10.990 8.235 1.00 0.00 O ATOM 849 CB LYS A 54 1.720 9.907 7.374 1.00 0.00 C ATOM 850 CG LYS A 54 1.875 11.317 7.947 1.00 0.00 C ATOM 851 CD LYS A 54 3.186 11.922 7.441 1.00 0.00 C ATOM 852 CE LYS A 54 4.167 12.043 8.609 1.00 0.00 C ATOM 853 NZ LYS A 54 5.479 12.568 8.136 1.00 0.00 N ATOM 0 H LYS A 54 1.220 7.510 6.981 1.00 0.00 H new ATOM 0 HA LYS A 54 0.614 9.250 9.115 1.00 0.00 H new ATOM 0 HB2 LYS A 54 2.624 9.326 7.556 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.583 9.953 6.294 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.033 11.940 7.646 1.00 0.00 H new ATOM 0 HG3 LYS A 54 1.873 11.282 9.036 1.00 0.00 H new ATOM 0 HD2 LYS A 54 3.611 11.295 6.657 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.002 12.902 7.001 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.756 12.707 9.370 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.306 11.069 9.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 6.133 12.644 8.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 5.877 11.920 7.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 5.344 13.507 7.710 1.00 0.00 H new ATOM 867 N GLU A 55 -1.462 9.469 6.656 1.00 0.00 N ATOM 868 CA GLU A 55 -2.720 10.153 6.214 1.00 0.00 C ATOM 869 C GLU A 55 -3.948 9.352 6.656 1.00 0.00 C ATOM 870 O GLU A 55 -3.976 8.142 6.558 1.00 0.00 O ATOM 871 CB GLU A 55 -2.714 10.283 4.696 1.00 0.00 C ATOM 872 CG GLU A 55 -1.387 10.900 4.248 1.00 0.00 C ATOM 873 CD GLU A 55 -1.668 12.131 3.384 1.00 0.00 C ATOM 874 OE1 GLU A 55 -1.943 13.159 3.981 1.00 0.00 O ATOM 875 OE2 GLU A 55 -1.592 11.974 2.177 1.00 0.00 O ATOM 0 H GLU A 55 -1.221 8.620 6.144 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.766 11.142 6.670 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.848 9.304 4.235 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.547 10.906 4.369 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.791 11.180 5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.806 10.171 3.684 1.00 0.00 H new ATOM 882 N ASN A 56 -4.944 10.050 7.124 1.00 0.00 N ATOM 883 CA ASN A 56 -6.176 9.351 7.590 1.00 0.00 C ATOM 884 C ASN A 56 -6.905 8.680 6.420 1.00 0.00 C ATOM 885 O ASN A 56 -7.418 7.588 6.560 1.00 0.00 O ATOM 886 CB ASN A 56 -7.107 10.367 8.252 1.00 0.00 C ATOM 887 CG ASN A 56 -8.195 9.624 9.029 1.00 0.00 C ATOM 888 OD1 ASN A 56 -8.218 8.410 9.081 1.00 0.00 O ATOM 889 ND2 ASN A 56 -9.116 10.313 9.646 1.00 0.00 N ATOM 0 H ASN A 56 -4.960 11.067 7.204 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.889 8.579 8.304 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -6.541 11.013 8.923 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.558 11.010 7.497 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.849 9.832 10.168 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.103 11.332 9.607 1.00 0.00 H new ATOM 896 N TRP A 57 -6.940 9.335 5.287 1.00 0.00 N ATOM 897 CA TRP A 57 -7.653 8.717 4.131 1.00 0.00 C ATOM 898 C TRP A 57 -6.978 7.409 3.727 1.00 0.00 C ATOM 899 O TRP A 57 -7.594 6.560 3.119 1.00 0.00 O ATOM 900 CB TRP A 57 -7.686 9.684 2.937 1.00 0.00 C ATOM 901 CG TRP A 57 -6.265 10.070 2.502 1.00 0.00 C ATOM 902 CD1 TRP A 57 -5.644 11.182 2.883 1.00 0.00 C ATOM 903 CD2 TRP A 57 -5.514 9.382 1.654 1.00 0.00 C ATOM 904 NE1 TRP A 57 -4.477 11.142 2.220 1.00 0.00 N ATOM 905 CE2 TRP A 57 -4.315 10.037 1.421 1.00 0.00 C ATOM 906 CE3 TRP A 57 -5.764 8.175 1.021 1.00 0.00 C ATOM 907 CZ2 TRP A 57 -3.377 9.493 0.566 1.00 0.00 C ATOM 908 CZ3 TRP A 57 -4.821 7.632 0.168 1.00 0.00 C ATOM 909 CH2 TRP A 57 -3.630 8.291 -0.058 1.00 0.00 C ATOM 0 H TRP A 57 -6.517 10.247 5.115 1.00 0.00 H new ATOM 0 HA TRP A 57 -8.678 8.504 4.435 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -8.212 9.220 2.103 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -8.244 10.581 3.206 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -5.996 11.941 3.566 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -3.769 11.872 2.303 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -6.696 7.658 1.194 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -2.446 10.009 0.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -5.017 6.690 -0.322 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -2.895 7.864 -0.725 1.00 0.00 H new ATOM 920 N VAL A 58 -5.731 7.263 4.069 1.00 0.00 N ATOM 921 CA VAL A 58 -5.031 6.001 3.700 1.00 0.00 C ATOM 922 C VAL A 58 -5.527 4.869 4.590 1.00 0.00 C ATOM 923 O VAL A 58 -5.677 3.745 4.153 1.00 0.00 O ATOM 924 CB VAL A 58 -3.523 6.183 3.889 1.00 0.00 C ATOM 925 CG1 VAL A 58 -2.865 4.818 4.095 1.00 0.00 C ATOM 926 CG2 VAL A 58 -2.935 6.844 2.646 1.00 0.00 C ATOM 0 H VAL A 58 -5.173 7.948 4.579 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.238 5.758 2.658 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.339 6.811 4.761 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.791 4.948 4.229 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.286 4.341 4.980 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.048 4.191 3.223 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.861 6.975 2.777 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.120 6.213 1.776 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.403 7.817 2.495 1.00 0.00 H new ATOM 936 N GLN A 59 -5.771 5.192 5.823 1.00 0.00 N ATOM 937 CA GLN A 59 -6.270 4.159 6.761 1.00 0.00 C ATOM 938 C GLN A 59 -7.715 3.798 6.412 1.00 0.00 C ATOM 939 O GLN A 59 -8.190 2.739 6.752 1.00 0.00 O ATOM 940 CB GLN A 59 -6.215 4.714 8.184 1.00 0.00 C ATOM 941 CG GLN A 59 -6.231 3.553 9.179 1.00 0.00 C ATOM 942 CD GLN A 59 -4.802 3.054 9.398 1.00 0.00 C ATOM 943 OE1 GLN A 59 -3.904 3.818 9.693 1.00 0.00 O ATOM 944 NE2 GLN A 59 -4.550 1.782 9.265 1.00 0.00 N ATOM 0 H GLN A 59 -5.647 6.123 6.221 1.00 0.00 H new ATOM 0 HA GLN A 59 -5.650 3.266 6.685 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.314 5.312 8.319 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.064 5.373 8.363 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.664 3.876 10.125 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.857 2.744 8.802 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.300 1.137 9.018 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.603 1.432 9.408 1.00 0.00 H new ATOM 953 N ARG A 60 -8.378 4.687 5.722 1.00 0.00 N ATOM 954 CA ARG A 60 -9.802 4.421 5.361 1.00 0.00 C ATOM 955 C ARG A 60 -9.914 3.668 4.026 1.00 0.00 C ATOM 956 O ARG A 60 -10.522 2.618 3.964 1.00 0.00 O ATOM 957 CB ARG A 60 -10.545 5.750 5.262 1.00 0.00 C ATOM 958 CG ARG A 60 -11.588 5.824 6.380 1.00 0.00 C ATOM 959 CD ARG A 60 -12.351 7.145 6.270 1.00 0.00 C ATOM 960 NE ARG A 60 -12.880 7.512 7.614 1.00 0.00 N ATOM 961 CZ ARG A 60 -12.517 8.641 8.159 1.00 0.00 C ATOM 962 NH1 ARG A 60 -11.246 8.873 8.339 1.00 0.00 N ATOM 963 NH2 ARG A 60 -13.437 9.499 8.506 1.00 0.00 N ATOM 0 H ARG A 60 -8.001 5.577 5.395 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.243 3.794 6.136 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.844 6.580 5.346 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.029 5.839 4.289 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -12.279 4.984 6.305 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -11.102 5.751 7.353 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -11.693 7.930 5.897 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -13.169 7.049 5.556 1.00 0.00 H new ATOM 0 HE ARG A 60 -13.520 6.887 8.104 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.556 8.178 8.055 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.943 9.750 8.763 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -14.421 9.282 8.350 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.172 10.386 8.933 1.00 0.00 H new ATOM 977 N VAL A 61 -9.333 4.207 2.982 1.00 0.00 N ATOM 978 CA VAL A 61 -9.437 3.513 1.671 1.00 0.00 C ATOM 979 C VAL A 61 -8.807 2.121 1.776 1.00 0.00 C ATOM 980 O VAL A 61 -9.227 1.193 1.115 1.00 0.00 O ATOM 981 CB VAL A 61 -8.724 4.345 0.606 1.00 0.00 C ATOM 982 CG1 VAL A 61 -9.328 5.752 0.585 1.00 0.00 C ATOM 983 CG2 VAL A 61 -7.235 4.427 0.950 1.00 0.00 C ATOM 0 H VAL A 61 -8.803 5.079 2.983 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.484 3.400 1.391 1.00 0.00 H new ATOM 0 HB VAL A 61 -8.845 3.883 -0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -8.825 6.353 -0.173 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.391 5.688 0.351 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.199 6.218 1.562 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -6.719 5.019 0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.112 4.897 1.926 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.812 3.423 0.975 1.00 0.00 H new ATOM 993 N VAL A 62 -7.816 2.002 2.613 1.00 0.00 N ATOM 994 CA VAL A 62 -7.172 0.671 2.783 1.00 0.00 C ATOM 995 C VAL A 62 -8.095 -0.237 3.601 1.00 0.00 C ATOM 996 O VAL A 62 -8.313 -1.381 3.252 1.00 0.00 O ATOM 997 CB VAL A 62 -5.838 0.841 3.504 1.00 0.00 C ATOM 998 CG1 VAL A 62 -5.278 -0.539 3.856 1.00 0.00 C ATOM 999 CG2 VAL A 62 -4.855 1.560 2.577 1.00 0.00 C ATOM 0 H VAL A 62 -7.428 2.756 3.179 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.996 0.219 1.807 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.982 1.424 4.414 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.325 -0.424 4.372 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.981 -1.062 4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.129 -1.115 2.943 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.899 1.685 3.086 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.710 0.970 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.255 2.539 2.311 1.00 0.00 H new ATOM 1009 N GLU A 63 -8.622 0.291 4.680 1.00 0.00 N ATOM 1010 CA GLU A 63 -9.548 -0.533 5.510 1.00 0.00 C ATOM 1011 C GLU A 63 -10.701 -1.021 4.638 1.00 0.00 C ATOM 1012 O GLU A 63 -11.147 -2.145 4.761 1.00 0.00 O ATOM 1013 CB GLU A 63 -10.102 0.318 6.653 1.00 0.00 C ATOM 1014 CG GLU A 63 -10.934 -0.570 7.583 1.00 0.00 C ATOM 1015 CD GLU A 63 -10.257 -0.639 8.953 1.00 0.00 C ATOM 1016 OE1 GLU A 63 -10.537 0.251 9.740 1.00 0.00 O ATOM 1017 OE2 GLU A 63 -9.499 -1.576 9.135 1.00 0.00 O ATOM 0 H GLU A 63 -8.454 1.240 5.015 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.010 -1.387 5.922 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.285 0.781 7.207 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -10.716 1.126 6.256 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.942 -0.168 7.682 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.029 -1.570 7.161 1.00 0.00 H new ATOM 1024 N LYS A 64 -11.161 -0.160 3.772 1.00 0.00 N ATOM 1025 CA LYS A 64 -12.282 -0.553 2.875 1.00 0.00 C ATOM 1026 C LYS A 64 -11.874 -1.773 2.046 1.00 0.00 C ATOM 1027 O LYS A 64 -12.629 -2.715 1.914 1.00 0.00 O ATOM 1028 CB LYS A 64 -12.611 0.616 1.948 1.00 0.00 C ATOM 1029 CG LYS A 64 -13.650 1.520 2.616 1.00 0.00 C ATOM 1030 CD LYS A 64 -15.053 1.023 2.263 1.00 0.00 C ATOM 1031 CE LYS A 64 -16.084 1.835 3.049 1.00 0.00 C ATOM 1032 NZ LYS A 64 -17.170 2.313 2.145 1.00 0.00 N ATOM 0 H LYS A 64 -10.812 0.790 3.648 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.159 -0.806 3.470 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.707 1.184 1.727 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.994 0.244 0.998 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -13.511 1.516 3.697 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.522 2.550 2.282 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.230 1.126 1.192 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.148 -0.036 2.501 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.508 1.223 3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -15.598 2.686 3.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -17.862 2.862 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.763 2.914 1.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -17.644 1.496 1.710 1.00 0.00 H new ATOM 1046 N PHE A 65 -10.685 -1.731 1.502 1.00 0.00 N ATOM 1047 CA PHE A 65 -10.221 -2.892 0.689 1.00 0.00 C ATOM 1048 C PHE A 65 -10.382 -4.187 1.485 1.00 0.00 C ATOM 1049 O PHE A 65 -10.907 -5.162 0.988 1.00 0.00 O ATOM 1050 CB PHE A 65 -8.757 -2.707 0.329 1.00 0.00 C ATOM 1051 CG PHE A 65 -8.279 -3.938 -0.451 1.00 0.00 C ATOM 1052 CD1 PHE A 65 -8.721 -4.164 -1.744 1.00 0.00 C ATOM 1053 CD2 PHE A 65 -7.403 -4.839 0.127 1.00 0.00 C ATOM 1054 CE1 PHE A 65 -8.292 -5.275 -2.445 1.00 0.00 C ATOM 1055 CE2 PHE A 65 -6.977 -5.949 -0.577 1.00 0.00 C ATOM 1056 CZ PHE A 65 -7.420 -6.166 -1.860 1.00 0.00 C ATOM 0 H PHE A 65 -10.026 -0.957 1.584 1.00 0.00 H new ATOM 0 HA PHE A 65 -10.821 -2.950 -0.219 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.627 -1.806 -0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.160 -2.577 1.232 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.405 -3.468 -2.207 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -7.050 -4.674 1.134 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.641 -5.445 -3.453 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.294 -6.648 -0.118 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.085 -7.034 -2.408 1.00 0.00 H new ATOM 1066 N LEU A 66 -9.922 -4.169 2.706 1.00 0.00 N ATOM 1067 CA LEU A 66 -10.039 -5.392 3.552 1.00 0.00 C ATOM 1068 C LEU A 66 -11.515 -5.699 3.830 1.00 0.00 C ATOM 1069 O LEU A 66 -11.902 -6.843 3.950 1.00 0.00 O ATOM 1070 CB LEU A 66 -9.309 -5.156 4.875 1.00 0.00 C ATOM 1071 CG LEU A 66 -8.369 -6.333 5.150 1.00 0.00 C ATOM 1072 CD1 LEU A 66 -7.639 -6.093 6.473 1.00 0.00 C ATOM 1073 CD2 LEU A 66 -9.186 -7.625 5.253 1.00 0.00 C ATOM 0 H LEU A 66 -9.474 -3.369 3.152 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.594 -6.238 3.028 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.743 -4.226 4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.028 -5.052 5.687 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.646 -6.422 4.339 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.968 -6.928 6.675 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.062 -5.171 6.408 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -8.367 -6.009 7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.518 -8.463 5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.905 -7.537 6.067 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.717 -7.795 4.316 1.00 0.00 H new ATOM 1085 N LYS A 67 -12.306 -4.666 3.928 1.00 0.00 N ATOM 1086 CA LYS A 67 -13.758 -4.876 4.198 1.00 0.00 C ATOM 1087 C LYS A 67 -14.440 -5.500 2.975 1.00 0.00 C ATOM 1088 O LYS A 67 -15.299 -6.348 3.106 1.00 0.00 O ATOM 1089 CB LYS A 67 -14.407 -3.530 4.512 1.00 0.00 C ATOM 1090 CG LYS A 67 -15.663 -3.762 5.354 1.00 0.00 C ATOM 1091 CD LYS A 67 -16.469 -2.463 5.420 1.00 0.00 C ATOM 1092 CE LYS A 67 -17.562 -2.604 6.481 1.00 0.00 C ATOM 1093 NZ LYS A 67 -16.991 -2.420 7.845 1.00 0.00 N ATOM 0 H LYS A 67 -12.014 -3.693 3.834 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.872 -5.551 5.046 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.706 -2.892 5.050 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -14.664 -3.012 3.588 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -16.267 -4.557 4.917 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -15.388 -4.085 6.358 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -15.814 -1.626 5.664 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.914 -2.247 4.449 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -18.345 -1.866 6.305 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -18.027 -3.587 6.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -17.763 -2.349 8.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -16.387 -3.233 8.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -16.424 -1.549 7.869 1.00 0.00 H new ATOM 1107 N ARG A 68 -14.040 -5.065 1.810 1.00 0.00 N ATOM 1108 CA ARG A 68 -14.655 -5.622 0.571 1.00 0.00 C ATOM 1109 C ARG A 68 -14.020 -6.974 0.229 1.00 0.00 C ATOM 1110 O ARG A 68 -14.678 -7.862 -0.278 1.00 0.00 O ATOM 1111 CB ARG A 68 -14.427 -4.646 -0.582 1.00 0.00 C ATOM 1112 CG ARG A 68 -15.505 -4.865 -1.645 1.00 0.00 C ATOM 1113 CD ARG A 68 -15.209 -3.970 -2.851 1.00 0.00 C ATOM 1114 NE ARG A 68 -15.007 -4.828 -4.052 1.00 0.00 N ATOM 1115 CZ ARG A 68 -15.764 -4.652 -5.100 1.00 0.00 C ATOM 1116 NH1 ARG A 68 -17.060 -4.657 -4.949 1.00 0.00 N ATOM 1117 NH2 ARG A 68 -15.200 -4.477 -6.263 1.00 0.00 N ATOM 0 H ARG A 68 -13.322 -4.356 1.663 1.00 0.00 H new ATOM 0 HA ARG A 68 -15.724 -5.764 0.732 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -14.461 -3.619 -0.218 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -13.438 -4.798 -1.013 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -15.526 -5.911 -1.949 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -16.488 -4.632 -1.237 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -16.034 -3.277 -3.017 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -14.320 -3.368 -2.664 1.00 0.00 H new ATOM 0 HE ARG A 68 -14.283 -5.547 -4.055 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -17.465 -4.797 -4.023 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -17.668 -4.521 -5.757 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.183 -4.479 -6.342 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -15.776 -4.338 -7.093 1.00 0.00 H new ATOM 1131 N ALA A 69 -12.754 -7.099 0.513 1.00 0.00 N ATOM 1132 CA ALA A 69 -12.058 -8.384 0.213 1.00 0.00 C ATOM 1133 C ALA A 69 -12.446 -9.445 1.249 1.00 0.00 C ATOM 1134 O ALA A 69 -12.441 -10.625 0.965 1.00 0.00 O ATOM 1135 CB ALA A 69 -10.547 -8.155 0.255 1.00 0.00 C ATOM 0 H ALA A 69 -12.174 -6.375 0.936 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.352 -8.733 -0.777 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.031 -9.090 0.037 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.272 -7.407 -0.488 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.259 -7.805 1.246 1.00 0.00 H new ATOM 1141 N GLU A 70 -12.776 -8.998 2.430 1.00 0.00 N ATOM 1142 CA GLU A 70 -13.170 -9.964 3.496 1.00 0.00 C ATOM 1143 C GLU A 70 -14.642 -10.357 3.335 1.00 0.00 C ATOM 1144 O GLU A 70 -15.030 -11.463 3.653 1.00 0.00 O ATOM 1145 CB GLU A 70 -12.963 -9.313 4.862 1.00 0.00 C ATOM 1146 CG GLU A 70 -13.500 -10.246 5.949 1.00 0.00 C ATOM 1147 CD GLU A 70 -12.989 -9.780 7.314 1.00 0.00 C ATOM 1148 OE1 GLU A 70 -11.901 -10.210 7.661 1.00 0.00 O ATOM 1149 OE2 GLU A 70 -13.715 -9.020 7.933 1.00 0.00 O ATOM 0 H GLU A 70 -12.790 -8.015 2.702 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.555 -10.860 3.414 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.904 -9.114 5.027 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.478 -8.353 4.903 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.590 -10.247 5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.178 -11.270 5.757 1.00 0.00 H new ATOM 1156 N ASN A 71 -15.429 -9.440 2.842 1.00 0.00 N ATOM 1157 CA ASN A 71 -16.879 -9.743 2.653 1.00 0.00 C ATOM 1158 C ASN A 71 -17.074 -10.672 1.451 1.00 0.00 C ATOM 1159 O ASN A 71 -17.955 -11.509 1.445 1.00 0.00 O ATOM 1160 CB ASN A 71 -17.635 -8.437 2.415 1.00 0.00 C ATOM 1161 CG ASN A 71 -19.140 -8.699 2.514 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -19.617 -9.772 2.202 1.00 0.00 O ATOM 1163 ND2 ASN A 71 -19.922 -7.746 2.943 1.00 0.00 N ATOM 0 H ASN A 71 -15.136 -8.503 2.564 1.00 0.00 H new ATOM 0 HA ASN A 71 -17.262 -10.238 3.546 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -17.335 -7.690 3.150 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -17.388 -8.034 1.433 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -20.927 -7.904 3.015 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -19.528 -6.843 3.207 1.00 0.00 H new ATOM 1275 N CYS B 7 -7.585 -19.568 -9.127 1.00 0.00 N ATOM 1276 CA CYS B 7 -7.114 -18.592 -8.099 1.00 0.00 C ATOM 1277 C CYS B 7 -5.601 -18.735 -7.883 1.00 0.00 C ATOM 1278 O CYS B 7 -5.042 -19.793 -8.088 1.00 0.00 O ATOM 1279 CB CYS B 7 -7.843 -18.865 -6.785 1.00 0.00 C ATOM 1280 SG CYS B 7 -9.564 -18.319 -6.661 1.00 0.00 S ATOM 0 HA CYS B 7 -7.325 -17.579 -8.442 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -7.816 -19.939 -6.601 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -7.280 -18.390 -5.982 1.00 0.00 H new ATOM 1285 N GLN B 8 -4.968 -17.665 -7.470 1.00 0.00 N ATOM 1286 CA GLN B 8 -3.494 -17.741 -7.230 1.00 0.00 C ATOM 1287 C GLN B 8 -3.195 -18.729 -6.099 1.00 0.00 C ATOM 1288 O GLN B 8 -2.143 -19.337 -6.065 1.00 0.00 O ATOM 1289 CB GLN B 8 -2.970 -16.356 -6.845 1.00 0.00 C ATOM 1290 CG GLN B 8 -2.771 -15.517 -8.111 1.00 0.00 C ATOM 1291 CD GLN B 8 -1.303 -15.592 -8.540 1.00 0.00 C ATOM 1292 OE1 GLN B 8 -0.684 -16.740 -8.488 1.00 0.00 O flip ATOM 1293 NE2 GLN B 8 -0.708 -14.606 -8.926 1.00 0.00 N flip ATOM 0 H GLN B 8 -5.398 -16.758 -7.291 1.00 0.00 H new ATOM 0 HA GLN B 8 -3.002 -18.082 -8.141 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -3.674 -15.862 -6.175 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -2.028 -16.449 -6.305 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -3.415 -15.885 -8.910 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -3.055 -14.481 -7.924 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -1.186 -13.706 -8.969 1.00 0.00 H new ATOM 0 HE22 GLN B 8 0.270 -14.678 -9.207 1.00 0.00 H new ATOM 1302 N CYS B 9 -4.125 -18.867 -5.195 1.00 0.00 N ATOM 1303 CA CYS B 9 -3.909 -19.813 -4.062 1.00 0.00 C ATOM 1304 C CYS B 9 -4.537 -21.175 -4.375 1.00 0.00 C ATOM 1305 O CYS B 9 -5.709 -21.264 -4.685 1.00 0.00 O ATOM 1306 CB CYS B 9 -4.547 -19.238 -2.800 1.00 0.00 C ATOM 1307 SG CYS B 9 -3.613 -17.979 -1.900 1.00 0.00 S ATOM 0 H CYS B 9 -5.017 -18.372 -5.190 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.838 -19.947 -3.911 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -5.512 -18.811 -3.074 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.746 -20.063 -2.116 1.00 0.00 H new ATOM 1312 N ILE B 10 -3.740 -22.205 -4.285 1.00 0.00 N ATOM 1313 CA ILE B 10 -4.269 -23.574 -4.564 1.00 0.00 C ATOM 1314 C ILE B 10 -4.591 -24.286 -3.246 1.00 0.00 C ATOM 1315 O ILE B 10 -5.737 -24.570 -2.956 1.00 0.00 O ATOM 1316 CB ILE B 10 -3.214 -24.372 -5.333 1.00 0.00 C ATOM 1317 CG1 ILE B 10 -3.232 -23.945 -6.804 1.00 0.00 C ATOM 1318 CG2 ILE B 10 -3.539 -25.863 -5.235 1.00 0.00 C ATOM 1319 CD1 ILE B 10 -2.894 -22.455 -6.905 1.00 0.00 C ATOM 0 H ILE B 10 -2.753 -22.161 -4.032 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.179 -23.498 -5.159 1.00 0.00 H new ATOM 0 HB ILE B 10 -2.228 -24.183 -4.908 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -2.511 -24.532 -7.373 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.213 -24.137 -7.238 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.790 -26.435 -5.782 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.536 -26.168 -4.189 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -4.523 -26.050 -5.665 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -2.906 -22.149 -7.951 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -3.632 -21.876 -6.349 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -1.903 -22.278 -6.487 1.00 0.00 H new ATOM 1331 N LYS B 11 -3.565 -24.557 -2.477 1.00 0.00 N ATOM 1332 CA LYS B 11 -3.777 -25.245 -1.164 1.00 0.00 C ATOM 1333 C LYS B 11 -3.496 -24.274 -0.012 1.00 0.00 C ATOM 1334 O LYS B 11 -2.725 -23.345 -0.158 1.00 0.00 O ATOM 1335 CB LYS B 11 -2.825 -26.437 -1.067 1.00 0.00 C ATOM 1336 CG LYS B 11 -3.497 -27.550 -0.261 1.00 0.00 C ATOM 1337 CD LYS B 11 -2.460 -28.624 0.074 1.00 0.00 C ATOM 1338 CE LYS B 11 -1.836 -28.312 1.435 1.00 0.00 C ATOM 1339 NZ LYS B 11 -0.520 -28.996 1.575 1.00 0.00 N ATOM 0 H LYS B 11 -2.595 -24.333 -2.699 1.00 0.00 H new ATOM 0 HA LYS B 11 -4.810 -25.586 -1.097 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.570 -26.796 -2.064 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.893 -26.136 -0.588 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -3.927 -27.144 0.655 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.317 -27.985 -0.832 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -2.930 -29.607 0.093 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -1.688 -28.654 -0.695 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -1.706 -27.235 1.544 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -2.507 -28.634 2.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -0.110 -28.773 2.505 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -0.653 -30.024 1.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 0.123 -28.668 0.826 1.00 0.00 H new ATOM 1353 N THR B 12 -4.128 -24.513 1.110 1.00 0.00 N ATOM 1354 CA THR B 12 -3.915 -23.610 2.285 1.00 0.00 C ATOM 1355 C THR B 12 -3.001 -24.281 3.318 1.00 0.00 C ATOM 1356 O THR B 12 -2.628 -25.429 3.171 1.00 0.00 O ATOM 1357 CB THR B 12 -5.268 -23.303 2.930 1.00 0.00 C ATOM 1358 OG1 THR B 12 -5.860 -24.578 3.157 1.00 0.00 O ATOM 1359 CG2 THR B 12 -6.202 -22.590 1.956 1.00 0.00 C ATOM 0 H THR B 12 -4.776 -25.286 1.264 1.00 0.00 H new ATOM 0 HA THR B 12 -3.443 -22.689 1.945 1.00 0.00 H new ATOM 0 HB THR B 12 -5.127 -22.684 3.816 1.00 0.00 H new ATOM 0 HG1 THR B 12 -6.739 -24.461 3.575 1.00 0.00 H new ATOM 0 HG21 THR B 12 -7.154 -22.387 2.447 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.749 -21.650 1.640 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.371 -23.223 1.085 1.00 0.00 H new ATOM 1367 N TYR B 13 -2.663 -23.543 4.340 1.00 0.00 N ATOM 1368 CA TYR B 13 -1.774 -24.110 5.401 1.00 0.00 C ATOM 1369 C TYR B 13 -2.611 -24.573 6.604 1.00 0.00 C ATOM 1370 O TYR B 13 -3.389 -23.815 7.147 1.00 0.00 O ATOM 1371 CB TYR B 13 -0.791 -23.026 5.843 1.00 0.00 C ATOM 1372 CG TYR B 13 0.514 -23.674 6.313 1.00 0.00 C ATOM 1373 CD1 TYR B 13 1.295 -24.397 5.433 1.00 0.00 C ATOM 1374 CD2 TYR B 13 0.930 -23.542 7.621 1.00 0.00 C ATOM 1375 CE1 TYR B 13 2.470 -24.980 5.857 1.00 0.00 C ATOM 1376 CE2 TYR B 13 2.106 -24.126 8.045 1.00 0.00 C ATOM 1377 CZ TYR B 13 2.886 -24.849 7.167 1.00 0.00 C ATOM 1378 OH TYR B 13 4.061 -25.433 7.590 1.00 0.00 O ATOM 0 H TYR B 13 -2.960 -22.579 4.488 1.00 0.00 H new ATOM 0 HA TYR B 13 -1.233 -24.969 5.005 1.00 0.00 H new ATOM 0 HB2 TYR B 13 -0.592 -22.343 5.017 1.00 0.00 H new ATOM 0 HB3 TYR B 13 -1.225 -22.434 6.649 1.00 0.00 H new ATOM 0 HD1 TYR B 13 0.983 -24.506 4.405 1.00 0.00 H new ATOM 0 HD2 TYR B 13 0.330 -22.977 8.319 1.00 0.00 H new ATOM 0 HE1 TYR B 13 3.070 -25.544 5.159 1.00 0.00 H new ATOM 0 HE2 TYR B 13 2.418 -24.016 9.073 1.00 0.00 H new ATOM 0 HH TYR B 13 4.199 -25.238 8.540 1.00 0.00 H new ATOM 1388 N SER B 14 -2.425 -25.813 6.991 1.00 0.00 N ATOM 1389 CA SER B 14 -3.203 -26.354 8.154 1.00 0.00 C ATOM 1390 C SER B 14 -2.304 -26.488 9.391 1.00 0.00 C ATOM 1391 O SER B 14 -2.548 -27.315 10.249 1.00 0.00 O ATOM 1392 CB SER B 14 -3.756 -27.730 7.784 1.00 0.00 C ATOM 1393 OG SER B 14 -2.598 -28.518 7.550 1.00 0.00 O ATOM 0 H SER B 14 -1.775 -26.469 6.558 1.00 0.00 H new ATOM 0 HA SER B 14 -4.017 -25.667 8.386 1.00 0.00 H new ATOM 0 HB2 SER B 14 -4.364 -28.144 8.588 1.00 0.00 H new ATOM 0 HB3 SER B 14 -4.390 -27.680 6.898 1.00 0.00 H new ATOM 0 HG SER B 14 -2.866 -29.428 7.306 1.00 0.00 H new ATOM 1399 N LYS B 15 -1.285 -25.670 9.451 1.00 0.00 N ATOM 1400 CA LYS B 15 -0.352 -25.723 10.623 1.00 0.00 C ATOM 1401 C LYS B 15 -0.102 -24.282 11.153 1.00 0.00 C ATOM 1402 O LYS B 15 0.661 -23.550 10.565 1.00 0.00 O ATOM 1403 CB LYS B 15 0.978 -26.317 10.157 1.00 0.00 C ATOM 1404 CG LYS B 15 1.090 -27.759 10.665 1.00 0.00 C ATOM 1405 CD LYS B 15 1.289 -27.751 12.186 1.00 0.00 C ATOM 1406 CE LYS B 15 2.673 -28.316 12.515 1.00 0.00 C ATOM 1407 NZ LYS B 15 2.872 -28.378 13.991 1.00 0.00 N ATOM 0 H LYS B 15 -1.057 -24.970 8.745 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.786 -26.332 11.416 1.00 0.00 H new ATOM 0 HB2 LYS B 15 1.038 -26.296 9.069 1.00 0.00 H new ATOM 0 HB3 LYS B 15 1.809 -25.720 10.534 1.00 0.00 H new ATOM 0 HG2 LYS B 15 0.190 -28.317 10.408 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.927 -28.263 10.181 1.00 0.00 H new ATOM 0 HD2 LYS B 15 1.196 -26.736 12.572 1.00 0.00 H new ATOM 0 HD3 LYS B 15 0.515 -28.347 12.669 1.00 0.00 H new ATOM 0 HE2 LYS B 15 2.777 -29.312 12.085 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.444 -27.692 12.064 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 3.815 -28.763 14.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 2.793 -27.422 14.392 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 2.147 -28.992 14.414 1.00 0.00 H new ATOM 1421 N PRO B 16 -0.740 -23.895 12.264 1.00 0.00 N ATOM 1422 CA PRO B 16 -0.576 -22.531 12.799 1.00 0.00 C ATOM 1423 C PRO B 16 0.894 -22.202 13.088 1.00 0.00 C ATOM 1424 O PRO B 16 1.642 -23.036 13.558 1.00 0.00 O ATOM 1425 CB PRO B 16 -1.404 -22.496 14.087 1.00 0.00 C ATOM 1426 CG PRO B 16 -2.159 -23.855 14.191 1.00 0.00 C ATOM 1427 CD PRO B 16 -1.633 -24.759 13.063 1.00 0.00 C ATOM 0 HA PRO B 16 -0.908 -21.785 12.077 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -0.760 -22.347 14.954 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -2.109 -21.665 14.068 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -1.988 -24.316 15.164 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -3.234 -23.705 14.094 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -1.095 -25.618 13.464 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -2.450 -25.149 12.457 1.00 0.00 H new ATOM 1435 N PHE B 17 1.272 -20.978 12.796 1.00 0.00 N ATOM 1436 CA PHE B 17 2.680 -20.568 13.049 1.00 0.00 C ATOM 1437 C PHE B 17 2.751 -19.070 13.406 1.00 0.00 C ATOM 1438 O PHE B 17 1.943 -18.276 12.968 1.00 0.00 O ATOM 1439 CB PHE B 17 3.551 -20.883 11.817 1.00 0.00 C ATOM 1440 CG PHE B 17 3.013 -20.187 10.552 1.00 0.00 C ATOM 1441 CD1 PHE B 17 1.771 -20.519 10.023 1.00 0.00 C ATOM 1442 CD2 PHE B 17 3.770 -19.217 9.915 1.00 0.00 C ATOM 1443 CE1 PHE B 17 1.305 -19.891 8.889 1.00 0.00 C ATOM 1444 CE2 PHE B 17 3.296 -18.597 8.778 1.00 0.00 C ATOM 1445 CZ PHE B 17 2.066 -18.932 8.269 1.00 0.00 C ATOM 0 H PHE B 17 0.670 -20.257 12.398 1.00 0.00 H new ATOM 0 HA PHE B 17 3.065 -21.134 13.897 1.00 0.00 H new ATOM 0 HB2 PHE B 17 4.576 -20.561 12.003 1.00 0.00 H new ATOM 0 HB3 PHE B 17 3.580 -21.961 11.656 1.00 0.00 H new ATOM 0 HD1 PHE B 17 1.167 -21.274 10.504 1.00 0.00 H new ATOM 0 HD2 PHE B 17 4.737 -18.945 10.311 1.00 0.00 H new ATOM 0 HE1 PHE B 17 0.338 -20.154 8.487 1.00 0.00 H new ATOM 0 HE2 PHE B 17 3.895 -17.845 8.286 1.00 0.00 H new ATOM 0 HZ PHE B 17 1.697 -18.441 7.381 1.00 0.00 H new ATOM 1455 N HIS B 18 3.731 -18.739 14.199 1.00 0.00 N ATOM 1456 CA HIS B 18 3.908 -17.321 14.669 1.00 0.00 C ATOM 1457 C HIS B 18 4.410 -16.397 13.519 1.00 0.00 C ATOM 1458 O HIS B 18 5.201 -16.823 12.701 1.00 0.00 O ATOM 1459 CB HIS B 18 4.978 -17.365 15.758 1.00 0.00 C ATOM 1460 CG HIS B 18 5.037 -16.037 16.484 1.00 0.00 C ATOM 1461 ND1 HIS B 18 5.511 -14.917 15.971 1.00 0.00 N ATOM 1462 CD2 HIS B 18 4.619 -15.733 17.766 1.00 0.00 C ATOM 1463 CE1 HIS B 18 5.400 -13.985 16.860 1.00 0.00 C ATOM 1464 NE2 HIS B 18 4.872 -14.472 17.920 1.00 0.00 N ATOM 0 H HIS B 18 4.430 -19.394 14.550 1.00 0.00 H new ATOM 0 HA HIS B 18 2.957 -16.923 15.024 1.00 0.00 H new ATOM 0 HB2 HIS B 18 4.756 -18.165 16.464 1.00 0.00 H new ATOM 0 HB3 HIS B 18 5.949 -17.590 15.316 1.00 0.00 H new ATOM 0 HD2 HIS B 18 4.176 -16.404 18.486 1.00 0.00 H new ATOM 0 HE1 HIS B 18 5.705 -12.957 16.729 1.00 0.00 H new ATOM 0 HE2 HIS B 18 4.677 -13.940 18.768 1.00 0.00 H new ATOM 1472 N PRO B 19 3.940 -15.133 13.471 1.00 0.00 N ATOM 1473 CA PRO B 19 4.408 -14.197 12.436 1.00 0.00 C ATOM 1474 C PRO B 19 5.934 -14.060 12.509 1.00 0.00 C ATOM 1475 O PRO B 19 6.553 -13.421 11.682 1.00 0.00 O ATOM 1476 CB PRO B 19 3.731 -12.859 12.753 1.00 0.00 C ATOM 1477 CG PRO B 19 2.821 -13.080 13.995 1.00 0.00 C ATOM 1478 CD PRO B 19 2.917 -14.566 14.382 1.00 0.00 C ATOM 0 HA PRO B 19 4.161 -14.539 11.431 1.00 0.00 H new ATOM 0 HB2 PRO B 19 4.477 -12.090 12.956 1.00 0.00 H new ATOM 0 HB3 PRO B 19 3.142 -12.516 11.902 1.00 0.00 H new ATOM 0 HG2 PRO B 19 3.142 -12.447 14.822 1.00 0.00 H new ATOM 0 HG3 PRO B 19 1.790 -12.809 13.768 1.00 0.00 H new ATOM 0 HD2 PRO B 19 3.209 -14.684 15.426 1.00 0.00 H new ATOM 0 HD3 PRO B 19 1.958 -15.069 14.260 1.00 0.00 H new ATOM 1486 N LYS B 20 6.491 -14.659 13.520 1.00 0.00 N ATOM 1487 CA LYS B 20 7.972 -14.626 13.704 1.00 0.00 C ATOM 1488 C LYS B 20 8.677 -15.058 12.407 1.00 0.00 C ATOM 1489 O LYS B 20 9.832 -14.747 12.192 1.00 0.00 O ATOM 1490 CB LYS B 20 8.297 -15.601 14.837 1.00 0.00 C ATOM 1491 CG LYS B 20 9.797 -15.709 15.097 1.00 0.00 C ATOM 1492 CD LYS B 20 10.011 -16.902 16.033 1.00 0.00 C ATOM 1493 CE LYS B 20 11.153 -16.615 16.995 1.00 0.00 C ATOM 1494 NZ LYS B 20 12.204 -15.787 16.336 1.00 0.00 N ATOM 0 H LYS B 20 5.981 -15.176 14.236 1.00 0.00 H new ATOM 0 HA LYS B 20 8.316 -13.620 13.946 1.00 0.00 H new ATOM 0 HB2 LYS B 20 7.795 -15.276 15.748 1.00 0.00 H new ATOM 0 HB3 LYS B 20 7.902 -16.586 14.590 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.340 -15.851 14.163 1.00 0.00 H new ATOM 0 HG3 LYS B 20 10.176 -14.793 15.549 1.00 0.00 H new ATOM 0 HD2 LYS B 20 9.097 -17.104 16.592 1.00 0.00 H new ATOM 0 HD3 LYS B 20 10.233 -17.796 15.450 1.00 0.00 H new ATOM 0 HE2 LYS B 20 10.772 -16.095 17.874 1.00 0.00 H new ATOM 0 HE3 LYS B 20 11.587 -17.553 17.342 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 13.107 -15.908 16.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.315 -16.089 15.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.924 -14.786 16.362 1.00 0.00 H new ATOM 1508 N PHE B 21 7.951 -15.751 11.566 1.00 0.00 N ATOM 1509 CA PHE B 21 8.557 -16.243 10.287 1.00 0.00 C ATOM 1510 C PHE B 21 7.988 -15.490 9.078 1.00 0.00 C ATOM 1511 O PHE B 21 8.396 -15.717 7.956 1.00 0.00 O ATOM 1512 CB PHE B 21 8.242 -17.730 10.168 1.00 0.00 C ATOM 1513 CG PHE B 21 8.653 -18.407 11.478 1.00 0.00 C ATOM 1514 CD1 PHE B 21 9.992 -18.608 11.769 1.00 0.00 C ATOM 1515 CD2 PHE B 21 7.698 -18.822 12.392 1.00 0.00 C ATOM 1516 CE1 PHE B 21 10.368 -19.208 12.953 1.00 0.00 C ATOM 1517 CE2 PHE B 21 8.078 -19.423 13.576 1.00 0.00 C ATOM 1518 CZ PHE B 21 9.413 -19.613 13.856 1.00 0.00 C ATOM 0 H PHE B 21 6.971 -15.997 11.706 1.00 0.00 H new ATOM 0 HA PHE B 21 9.633 -16.072 10.301 1.00 0.00 H new ATOM 0 HB2 PHE B 21 7.179 -17.880 9.978 1.00 0.00 H new ATOM 0 HB3 PHE B 21 8.781 -18.168 9.328 1.00 0.00 H new ATOM 0 HD1 PHE B 21 10.747 -18.293 11.064 1.00 0.00 H new ATOM 0 HD2 PHE B 21 6.650 -18.675 12.177 1.00 0.00 H new ATOM 0 HE1 PHE B 21 11.415 -19.360 13.171 1.00 0.00 H new ATOM 0 HE2 PHE B 21 7.327 -19.744 14.283 1.00 0.00 H new ATOM 0 HZ PHE B 21 9.710 -20.080 14.784 1.00 0.00 H new ATOM 1528 N ILE B 22 7.063 -14.609 9.336 1.00 0.00 N ATOM 1529 CA ILE B 22 6.449 -13.829 8.223 1.00 0.00 C ATOM 1530 C ILE B 22 7.029 -12.416 8.173 1.00 0.00 C ATOM 1531 O ILE B 22 7.112 -11.744 9.182 1.00 0.00 O ATOM 1532 CB ILE B 22 4.951 -13.773 8.453 1.00 0.00 C ATOM 1533 CG1 ILE B 22 4.380 -15.152 8.103 1.00 0.00 C ATOM 1534 CG2 ILE B 22 4.321 -12.713 7.544 1.00 0.00 C ATOM 1535 CD1 ILE B 22 3.186 -15.477 8.999 1.00 0.00 C ATOM 0 H ILE B 22 6.705 -14.395 10.267 1.00 0.00 H new ATOM 0 HA ILE B 22 6.665 -14.312 7.270 1.00 0.00 H new ATOM 0 HB ILE B 22 4.734 -13.513 9.489 1.00 0.00 H new ATOM 0 HG12 ILE B 22 4.074 -15.171 7.057 1.00 0.00 H new ATOM 0 HG13 ILE B 22 5.151 -15.913 8.223 1.00 0.00 H new ATOM 0 HG21 ILE B 22 3.245 -12.679 7.716 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.755 -11.738 7.767 1.00 0.00 H new ATOM 0 HG23 ILE B 22 4.514 -12.966 6.502 1.00 0.00 H new ATOM 0 HD11 ILE B 22 2.792 -16.459 8.738 1.00 0.00 H new ATOM 0 HD12 ILE B 22 3.503 -15.479 10.042 1.00 0.00 H new ATOM 0 HD13 ILE B 22 2.410 -14.725 8.857 1.00 0.00 H new ATOM 1547 N LYS B 23 7.422 -12.001 6.992 1.00 0.00 N ATOM 1548 CA LYS B 23 8.003 -10.642 6.839 1.00 0.00 C ATOM 1549 C LYS B 23 7.253 -9.857 5.762 1.00 0.00 C ATOM 1550 O LYS B 23 7.354 -8.647 5.699 1.00 0.00 O ATOM 1551 CB LYS B 23 9.479 -10.760 6.442 1.00 0.00 C ATOM 1552 CG LYS B 23 10.317 -11.141 7.669 1.00 0.00 C ATOM 1553 CD LYS B 23 11.801 -11.015 7.315 1.00 0.00 C ATOM 1554 CE LYS B 23 12.645 -11.414 8.529 1.00 0.00 C ATOM 1555 NZ LYS B 23 14.016 -11.819 8.103 1.00 0.00 N ATOM 0 H LYS B 23 7.363 -12.548 6.133 1.00 0.00 H new ATOM 0 HA LYS B 23 7.913 -10.114 7.788 1.00 0.00 H new ATOM 0 HB2 LYS B 23 9.596 -11.512 5.662 1.00 0.00 H new ATOM 0 HB3 LYS B 23 9.831 -9.815 6.029 1.00 0.00 H new ATOM 0 HG2 LYS B 23 10.073 -10.490 8.509 1.00 0.00 H new ATOM 0 HG3 LYS B 23 10.089 -12.161 7.979 1.00 0.00 H new ATOM 0 HD2 LYS B 23 12.040 -11.655 6.465 1.00 0.00 H new ATOM 0 HD3 LYS B 23 12.031 -9.992 7.018 1.00 0.00 H new ATOM 0 HE2 LYS B 23 12.707 -10.579 9.227 1.00 0.00 H new ATOM 0 HE3 LYS B 23 12.165 -12.237 9.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 14.217 -12.779 8.449 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 14.075 -11.805 7.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 14.713 -11.156 8.498 1.00 0.00 H new ATOM 1569 N GLU B 24 6.517 -10.560 4.931 1.00 0.00 N ATOM 1570 CA GLU B 24 5.754 -9.845 3.853 1.00 0.00 C ATOM 1571 C GLU B 24 4.338 -10.416 3.727 1.00 0.00 C ATOM 1572 O GLU B 24 4.160 -11.604 3.549 1.00 0.00 O ATOM 1573 CB GLU B 24 6.489 -10.012 2.523 1.00 0.00 C ATOM 1574 CG GLU B 24 5.719 -9.273 1.423 1.00 0.00 C ATOM 1575 CD GLU B 24 4.946 -10.288 0.577 1.00 0.00 C ATOM 1576 OE1 GLU B 24 4.195 -11.036 1.181 1.00 0.00 O ATOM 1577 OE2 GLU B 24 5.152 -10.259 -0.625 1.00 0.00 O ATOM 0 H GLU B 24 6.412 -11.574 4.949 1.00 0.00 H new ATOM 0 HA GLU B 24 5.683 -8.789 4.112 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.502 -9.617 2.602 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.578 -11.069 2.273 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.031 -8.553 1.866 1.00 0.00 H new ATOM 0 HG3 GLU B 24 6.410 -8.710 0.795 1.00 0.00 H new ATOM 1584 N LEU B 25 3.361 -9.549 3.822 1.00 0.00 N ATOM 1585 CA LEU B 25 1.947 -10.009 3.710 1.00 0.00 C ATOM 1586 C LEU B 25 1.389 -9.673 2.324 1.00 0.00 C ATOM 1587 O LEU B 25 1.848 -8.755 1.674 1.00 0.00 O ATOM 1588 CB LEU B 25 1.108 -9.310 4.777 1.00 0.00 C ATOM 1589 CG LEU B 25 -0.147 -10.139 5.057 1.00 0.00 C ATOM 1590 CD1 LEU B 25 0.161 -11.169 6.145 1.00 0.00 C ATOM 1591 CD2 LEU B 25 -1.264 -9.213 5.541 1.00 0.00 C ATOM 0 H LEU B 25 3.482 -8.547 3.972 1.00 0.00 H new ATOM 0 HA LEU B 25 1.909 -11.089 3.854 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.689 -9.189 5.691 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.830 -8.311 4.441 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.461 -10.650 4.147 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.731 -11.762 6.348 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.964 -11.825 5.808 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.470 -10.655 7.055 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.161 -9.799 5.742 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -0.948 -8.708 6.454 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.480 -8.471 4.772 1.00 0.00 H new ATOM 1603 N ARG B 26 0.408 -10.424 1.904 1.00 0.00 N ATOM 1604 CA ARG B 26 -0.191 -10.166 0.564 1.00 0.00 C ATOM 1605 C ARG B 26 -1.675 -10.548 0.564 1.00 0.00 C ATOM 1606 O ARG B 26 -2.039 -11.617 1.014 1.00 0.00 O ATOM 1607 CB ARG B 26 0.548 -10.995 -0.475 1.00 0.00 C ATOM 1608 CG ARG B 26 1.580 -10.112 -1.181 1.00 0.00 C ATOM 1609 CD ARG B 26 2.380 -10.954 -2.182 1.00 0.00 C ATOM 1610 NE ARG B 26 1.807 -10.765 -3.545 1.00 0.00 N ATOM 1611 CZ ARG B 26 2.061 -11.649 -4.471 1.00 0.00 C ATOM 1612 NH1 ARG B 26 2.971 -12.555 -4.244 1.00 0.00 N ATOM 1613 NH2 ARG B 26 1.397 -11.595 -5.594 1.00 0.00 N ATOM 0 H ARG B 26 -0.002 -11.199 2.426 1.00 0.00 H new ATOM 0 HA ARG B 26 -0.103 -9.106 0.327 1.00 0.00 H new ATOM 0 HB2 ARG B 26 1.042 -11.842 0.002 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -0.156 -11.403 -1.200 1.00 0.00 H new ATOM 0 HG2 ARG B 26 1.080 -9.293 -1.698 1.00 0.00 H new ATOM 0 HG3 ARG B 26 2.252 -9.664 -0.449 1.00 0.00 H new ATOM 0 HD2 ARG B 26 3.429 -10.657 -2.170 1.00 0.00 H new ATOM 0 HD3 ARG B 26 2.344 -12.007 -1.901 1.00 0.00 H new ATOM 0 HE ARG B 26 1.223 -9.954 -3.752 1.00 0.00 H new ATOM 0 HH11 ARG B 26 3.470 -12.565 -3.355 1.00 0.00 H new ATOM 0 HH12 ARG B 26 3.183 -13.254 -4.956 1.00 0.00 H new ATOM 0 HH21 ARG B 26 0.693 -10.870 -5.736 1.00 0.00 H new ATOM 0 HH22 ARG B 26 1.582 -12.277 -6.329 1.00 0.00 H new ATOM 1627 N VAL B 27 -2.499 -9.662 0.060 1.00 0.00 N ATOM 1628 CA VAL B 27 -3.967 -9.952 0.018 1.00 0.00 C ATOM 1629 C VAL B 27 -4.527 -9.643 -1.373 1.00 0.00 C ATOM 1630 O VAL B 27 -4.620 -8.496 -1.766 1.00 0.00 O ATOM 1631 CB VAL B 27 -4.677 -9.085 1.057 1.00 0.00 C ATOM 1632 CG1 VAL B 27 -6.139 -9.525 1.166 1.00 0.00 C ATOM 1633 CG2 VAL B 27 -3.995 -9.265 2.414 1.00 0.00 C ATOM 0 H VAL B 27 -2.222 -8.757 -0.321 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.132 -11.007 0.238 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.629 -8.038 0.757 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.650 -8.909 1.906 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -6.627 -9.409 0.198 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.183 -10.570 1.471 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.498 -8.648 3.159 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -4.050 -10.312 2.713 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -2.950 -8.963 2.339 1.00 0.00 H new ATOM 1643 N ILE B 28 -4.887 -10.678 -2.087 1.00 0.00 N ATOM 1644 CA ILE B 28 -5.442 -10.478 -3.461 1.00 0.00 C ATOM 1645 C ILE B 28 -6.957 -10.709 -3.457 1.00 0.00 C ATOM 1646 O ILE B 28 -7.428 -11.763 -3.079 1.00 0.00 O ATOM 1647 CB ILE B 28 -4.767 -11.471 -4.413 1.00 0.00 C ATOM 1648 CG1 ILE B 28 -3.304 -11.044 -4.620 1.00 0.00 C ATOM 1649 CG2 ILE B 28 -5.495 -11.461 -5.760 1.00 0.00 C ATOM 1650 CD1 ILE B 28 -2.543 -12.142 -5.377 1.00 0.00 C ATOM 0 H ILE B 28 -4.822 -11.649 -1.781 1.00 0.00 H new ATOM 0 HA ILE B 28 -5.248 -9.457 -3.790 1.00 0.00 H new ATOM 0 HB ILE B 28 -4.805 -12.475 -3.990 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -3.264 -10.109 -5.180 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -2.830 -10.859 -3.656 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.016 -12.167 -6.438 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -6.536 -11.749 -5.613 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.452 -10.460 -6.189 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -1.507 -11.834 -5.521 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -2.570 -13.067 -4.801 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -3.011 -12.306 -6.348 1.00 0.00 H new ATOM 1662 N GLU B 29 -7.688 -9.712 -3.878 1.00 0.00 N ATOM 1663 CA GLU B 29 -9.175 -9.847 -3.903 1.00 0.00 C ATOM 1664 C GLU B 29 -9.627 -10.534 -5.198 1.00 0.00 C ATOM 1665 O GLU B 29 -8.862 -10.657 -6.134 1.00 0.00 O ATOM 1666 CB GLU B 29 -9.799 -8.453 -3.817 1.00 0.00 C ATOM 1667 CG GLU B 29 -11.319 -8.570 -3.941 1.00 0.00 C ATOM 1668 CD GLU B 29 -11.970 -7.297 -3.396 1.00 0.00 C ATOM 1669 OE1 GLU B 29 -11.329 -6.267 -3.518 1.00 0.00 O ATOM 1670 OE2 GLU B 29 -13.071 -7.427 -2.889 1.00 0.00 O ATOM 0 H GLU B 29 -7.325 -8.816 -4.203 1.00 0.00 H new ATOM 0 HA GLU B 29 -9.497 -10.455 -3.057 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -9.535 -7.982 -2.870 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -9.406 -7.817 -4.610 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.600 -8.718 -4.984 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -11.675 -9.440 -3.388 1.00 0.00 H new ATOM 1677 N SER B 30 -10.865 -10.976 -5.213 1.00 0.00 N ATOM 1678 CA SER B 30 -11.409 -11.652 -6.436 1.00 0.00 C ATOM 1679 C SER B 30 -10.885 -10.971 -7.704 1.00 0.00 C ATOM 1680 O SER B 30 -11.120 -9.798 -7.923 1.00 0.00 O ATOM 1681 CB SER B 30 -12.933 -11.569 -6.412 1.00 0.00 C ATOM 1682 OG SER B 30 -13.203 -10.189 -6.211 1.00 0.00 O ATOM 0 H SER B 30 -11.519 -10.898 -4.434 1.00 0.00 H new ATOM 0 HA SER B 30 -11.087 -12.693 -6.440 1.00 0.00 H new ATOM 0 HB2 SER B 30 -13.366 -11.928 -7.346 1.00 0.00 H new ATOM 0 HB3 SER B 30 -13.353 -12.178 -5.611 1.00 0.00 H new ATOM 0 HG SER B 30 -12.571 -9.653 -6.734 1.00 0.00 H new ATOM 1688 N GLY B 31 -10.186 -11.732 -8.509 1.00 0.00 N ATOM 1689 CA GLY B 31 -9.622 -11.166 -9.773 1.00 0.00 C ATOM 1690 C GLY B 31 -10.154 -11.945 -10.984 1.00 0.00 C ATOM 1691 O GLY B 31 -11.017 -12.790 -10.853 1.00 0.00 O ATOM 0 H GLY B 31 -9.982 -12.718 -8.346 1.00 0.00 H new ATOM 0 HA2 GLY B 31 -9.891 -10.113 -9.861 1.00 0.00 H new ATOM 0 HA3 GLY B 31 -8.533 -11.216 -9.749 1.00 0.00 H new ATOM 1695 N PRO B 32 -9.613 -11.642 -12.146 1.00 0.00 N ATOM 1696 CA PRO B 32 -10.030 -12.305 -13.388 1.00 0.00 C ATOM 1697 C PRO B 32 -9.690 -13.796 -13.325 1.00 0.00 C ATOM 1698 O PRO B 32 -10.007 -14.551 -14.222 1.00 0.00 O ATOM 1699 CB PRO B 32 -9.231 -11.615 -14.501 1.00 0.00 C ATOM 1700 CG PRO B 32 -8.333 -10.532 -13.824 1.00 0.00 C ATOM 1701 CD PRO B 32 -8.553 -10.636 -12.303 1.00 0.00 C ATOM 0 HA PRO B 32 -11.104 -12.229 -13.557 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -8.620 -12.339 -15.041 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -9.901 -11.158 -15.229 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -7.284 -10.694 -14.072 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -8.596 -9.537 -14.183 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -7.640 -10.940 -11.791 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -8.852 -9.677 -11.880 1.00 0.00 H new ATOM 1709 N HIS B 33 -9.049 -14.174 -12.254 1.00 0.00 N ATOM 1710 CA HIS B 33 -8.662 -15.602 -12.073 1.00 0.00 C ATOM 1711 C HIS B 33 -9.314 -16.154 -10.803 1.00 0.00 C ATOM 1712 O HIS B 33 -9.518 -17.346 -10.674 1.00 0.00 O ATOM 1713 CB HIS B 33 -7.148 -15.680 -11.919 1.00 0.00 C ATOM 1714 CG HIS B 33 -6.770 -15.073 -10.567 1.00 0.00 C ATOM 1715 ND1 HIS B 33 -7.135 -13.903 -10.155 1.00 0.00 N ATOM 1716 CD2 HIS B 33 -6.022 -15.615 -9.520 1.00 0.00 C ATOM 1717 CE1 HIS B 33 -6.695 -13.676 -8.976 1.00 0.00 C ATOM 1718 NE2 HIS B 33 -6.013 -14.704 -8.562 1.00 0.00 N ATOM 0 H HIS B 33 -8.775 -13.553 -11.493 1.00 0.00 H new ATOM 0 HA HIS B 33 -8.990 -16.184 -12.935 1.00 0.00 H new ATOM 0 HB2 HIS B 33 -6.813 -16.716 -11.977 1.00 0.00 H new ATOM 0 HB3 HIS B 33 -6.656 -15.140 -12.728 1.00 0.00 H new ATOM 0 HD2 HIS B 33 -5.546 -16.584 -9.497 1.00 0.00 H new ATOM 0 HE1 HIS B 33 -6.863 -12.771 -8.411 1.00 0.00 H new ATOM 0 HE2 HIS B 33 -5.552 -14.792 -7.656 1.00 0.00 H new ATOM 1726 N CYS B 34 -9.623 -15.263 -9.894 1.00 0.00 N ATOM 1727 CA CYS B 34 -10.252 -15.694 -8.608 1.00 0.00 C ATOM 1728 C CYS B 34 -11.549 -14.916 -8.365 1.00 0.00 C ATOM 1729 O CYS B 34 -11.595 -13.714 -8.531 1.00 0.00 O ATOM 1730 CB CYS B 34 -9.277 -15.416 -7.465 1.00 0.00 C ATOM 1731 SG CYS B 34 -9.433 -16.426 -5.970 1.00 0.00 S ATOM 0 H CYS B 34 -9.468 -14.259 -9.986 1.00 0.00 H new ATOM 0 HA CYS B 34 -10.483 -16.758 -8.659 1.00 0.00 H new ATOM 0 HB2 CYS B 34 -8.264 -15.538 -7.849 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -9.385 -14.370 -7.177 1.00 0.00 H new ATOM 1736 N ALA B 35 -12.574 -15.625 -7.975 1.00 0.00 N ATOM 1737 CA ALA B 35 -13.878 -14.952 -7.713 1.00 0.00 C ATOM 1738 C ALA B 35 -14.066 -14.737 -6.208 1.00 0.00 C ATOM 1739 O ALA B 35 -15.179 -14.654 -5.725 1.00 0.00 O ATOM 1740 CB ALA B 35 -15.008 -15.831 -8.247 1.00 0.00 C ATOM 0 H ALA B 35 -12.565 -16.634 -7.827 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.892 -13.983 -8.213 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -15.966 -15.346 -8.059 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -14.879 -15.977 -9.319 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -14.986 -16.798 -7.744 1.00 0.00 H new ATOM 1746 N ASN B 36 -12.973 -14.652 -5.496 1.00 0.00 N ATOM 1747 CA ASN B 36 -13.077 -14.448 -4.021 1.00 0.00 C ATOM 1748 C ASN B 36 -11.814 -13.767 -3.478 1.00 0.00 C ATOM 1749 O ASN B 36 -11.048 -13.191 -4.214 1.00 0.00 O ATOM 1750 CB ASN B 36 -13.254 -15.805 -3.342 1.00 0.00 C ATOM 1751 CG ASN B 36 -14.540 -16.461 -3.851 1.00 0.00 C ATOM 1752 OD1 ASN B 36 -14.475 -17.280 -4.865 1.00 0.00 O flip ATOM 1753 ND2 ASN B 36 -15.613 -16.234 -3.329 1.00 0.00 N flip ATOM 0 H ASN B 36 -12.024 -14.714 -5.866 1.00 0.00 H new ATOM 0 HA ASN B 36 -13.934 -13.807 -3.812 1.00 0.00 H new ATOM 0 HB2 ASN B 36 -12.397 -16.445 -3.553 1.00 0.00 H new ATOM 0 HB3 ASN B 36 -13.299 -15.680 -2.260 1.00 0.00 H new ATOM 0 HD21 ASN B 36 -15.669 -15.595 -2.536 1.00 0.00 H new ATOM 0 HD22 ASN B 36 -16.458 -16.683 -3.683 1.00 0.00 H new ATOM 1760 N THR B 37 -11.640 -13.851 -2.194 1.00 0.00 N ATOM 1761 CA THR B 37 -10.440 -13.220 -1.561 1.00 0.00 C ATOM 1762 C THR B 37 -9.439 -14.292 -1.121 1.00 0.00 C ATOM 1763 O THR B 37 -9.817 -15.323 -0.601 1.00 0.00 O ATOM 1764 CB THR B 37 -10.892 -12.406 -0.352 1.00 0.00 C ATOM 1765 OG1 THR B 37 -10.951 -11.065 -0.825 1.00 0.00 O ATOM 1766 CG2 THR B 37 -9.841 -12.397 0.759 1.00 0.00 C ATOM 0 H THR B 37 -12.272 -14.327 -1.550 1.00 0.00 H new ATOM 0 HA THR B 37 -9.949 -12.570 -2.286 1.00 0.00 H new ATOM 0 HB THR B 37 -11.822 -12.816 0.041 1.00 0.00 H new ATOM 0 HG1 THR B 37 -11.861 -10.719 -0.715 1.00 0.00 H new ATOM 0 HG21 THR B 37 -10.205 -11.806 1.599 1.00 0.00 H new ATOM 0 HG22 THR B 37 -9.651 -13.418 1.089 1.00 0.00 H new ATOM 0 HG23 THR B 37 -8.916 -11.960 0.382 1.00 0.00 H new ATOM 1774 N GLU B 38 -8.177 -14.018 -1.342 1.00 0.00 N ATOM 1775 CA GLU B 38 -7.119 -14.996 -0.944 1.00 0.00 C ATOM 1776 C GLU B 38 -5.998 -14.270 -0.194 1.00 0.00 C ATOM 1777 O GLU B 38 -5.419 -13.329 -0.700 1.00 0.00 O ATOM 1778 CB GLU B 38 -6.550 -15.656 -2.199 1.00 0.00 C ATOM 1779 CG GLU B 38 -7.699 -16.240 -3.025 1.00 0.00 C ATOM 1780 CD GLU B 38 -8.411 -17.320 -2.208 1.00 0.00 C ATOM 1781 OE1 GLU B 38 -7.712 -18.224 -1.780 1.00 0.00 O ATOM 1782 OE2 GLU B 38 -9.614 -17.181 -2.059 1.00 0.00 O ATOM 0 H GLU B 38 -7.835 -13.162 -1.779 1.00 0.00 H new ATOM 0 HA GLU B 38 -7.551 -15.755 -0.292 1.00 0.00 H new ATOM 0 HB2 GLU B 38 -5.996 -14.926 -2.789 1.00 0.00 H new ATOM 0 HB3 GLU B 38 -5.847 -16.443 -1.924 1.00 0.00 H new ATOM 0 HG2 GLU B 38 -8.402 -15.453 -3.299 1.00 0.00 H new ATOM 0 HG3 GLU B 38 -7.316 -16.663 -3.954 1.00 0.00 H new ATOM 1789 N ILE B 39 -5.718 -14.719 0.998 1.00 0.00 N ATOM 1790 CA ILE B 39 -4.644 -14.056 1.793 1.00 0.00 C ATOM 1791 C ILE B 39 -3.307 -14.782 1.610 1.00 0.00 C ATOM 1792 O ILE B 39 -3.042 -15.772 2.261 1.00 0.00 O ATOM 1793 CB ILE B 39 -5.034 -14.077 3.271 1.00 0.00 C ATOM 1794 CG1 ILE B 39 -6.348 -13.310 3.454 1.00 0.00 C ATOM 1795 CG2 ILE B 39 -3.936 -13.401 4.094 1.00 0.00 C ATOM 1796 CD1 ILE B 39 -6.864 -13.527 4.878 1.00 0.00 C ATOM 0 H ILE B 39 -6.179 -15.507 1.453 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.531 -13.029 1.446 1.00 0.00 H new ATOM 0 HB ILE B 39 -5.158 -15.107 3.604 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -6.191 -12.247 3.269 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -7.087 -13.654 2.730 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -4.211 -13.414 5.149 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -2.997 -13.937 3.957 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -3.816 -12.369 3.763 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.799 -12.983 5.013 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -7.035 -14.590 5.045 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.126 -13.162 5.592 1.00 0.00 H new ATOM 1808 N ILE B 40 -2.495 -14.271 0.725 1.00 0.00 N ATOM 1809 CA ILE B 40 -1.167 -14.911 0.497 1.00 0.00 C ATOM 1810 C ILE B 40 -0.131 -14.293 1.437 1.00 0.00 C ATOM 1811 O ILE B 40 -0.354 -13.238 1.995 1.00 0.00 O ATOM 1812 CB ILE B 40 -0.744 -14.687 -0.955 1.00 0.00 C ATOM 1813 CG1 ILE B 40 -1.726 -15.408 -1.878 1.00 0.00 C ATOM 1814 CG2 ILE B 40 0.660 -15.253 -1.167 1.00 0.00 C ATOM 1815 CD1 ILE B 40 -1.907 -14.587 -3.156 1.00 0.00 C ATOM 0 H ILE B 40 -2.690 -13.447 0.156 1.00 0.00 H new ATOM 0 HA ILE B 40 -1.237 -15.980 0.696 1.00 0.00 H new ATOM 0 HB ILE B 40 -0.743 -13.620 -1.179 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -1.353 -16.403 -2.120 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.685 -15.540 -1.377 1.00 0.00 H new ATOM 0 HG21 ILE B 40 0.964 -15.094 -2.202 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.360 -14.748 -0.502 1.00 0.00 H new ATOM 0 HG23 ILE B 40 0.659 -16.321 -0.949 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.607 -15.096 -3.819 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -2.298 -13.602 -2.903 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -0.945 -14.478 -3.658 1.00 0.00 H new ATOM 1827 N VAL B 41 0.979 -14.957 1.596 1.00 0.00 N ATOM 1828 CA VAL B 41 2.023 -14.409 2.508 1.00 0.00 C ATOM 1829 C VAL B 41 3.412 -14.930 2.116 1.00 0.00 C ATOM 1830 O VAL B 41 3.527 -15.909 1.404 1.00 0.00 O ATOM 1831 CB VAL B 41 1.690 -14.836 3.937 1.00 0.00 C ATOM 1832 CG1 VAL B 41 1.837 -16.359 4.062 1.00 0.00 C ATOM 1833 CG2 VAL B 41 2.649 -14.149 4.912 1.00 0.00 C ATOM 0 H VAL B 41 1.208 -15.842 1.143 1.00 0.00 H new ATOM 0 HA VAL B 41 2.037 -13.322 2.433 1.00 0.00 H new ATOM 0 HB VAL B 41 0.665 -14.549 4.173 1.00 0.00 H new ATOM 0 HG11 VAL B 41 1.600 -16.665 5.081 1.00 0.00 H new ATOM 0 HG12 VAL B 41 1.154 -16.849 3.368 1.00 0.00 H new ATOM 0 HG13 VAL B 41 2.862 -16.646 3.826 1.00 0.00 H new ATOM 0 HG21 VAL B 41 2.411 -14.454 5.931 1.00 0.00 H new ATOM 0 HG22 VAL B 41 3.674 -14.436 4.677 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.545 -13.068 4.823 1.00 0.00 H new ATOM 1843 N LYS B 42 4.437 -14.257 2.592 1.00 0.00 N ATOM 1844 CA LYS B 42 5.831 -14.695 2.261 1.00 0.00 C ATOM 1845 C LYS B 42 6.678 -14.799 3.536 1.00 0.00 C ATOM 1846 O LYS B 42 6.743 -13.866 4.331 1.00 0.00 O ATOM 1847 CB LYS B 42 6.475 -13.679 1.314 1.00 0.00 C ATOM 1848 CG LYS B 42 6.976 -14.394 0.052 1.00 0.00 C ATOM 1849 CD LYS B 42 7.871 -13.439 -0.743 1.00 0.00 C ATOM 1850 CE LYS B 42 7.091 -12.164 -1.067 1.00 0.00 C ATOM 1851 NZ LYS B 42 7.689 -11.472 -2.242 1.00 0.00 N ATOM 0 H LYS B 42 4.369 -13.433 3.189 1.00 0.00 H new ATOM 0 HA LYS B 42 5.784 -15.674 1.783 1.00 0.00 H new ATOM 0 HB2 LYS B 42 5.752 -12.909 1.045 1.00 0.00 H new ATOM 0 HB3 LYS B 42 7.304 -13.177 1.813 1.00 0.00 H new ATOM 0 HG2 LYS B 42 7.532 -15.291 0.324 1.00 0.00 H new ATOM 0 HG3 LYS B 42 6.132 -14.714 -0.559 1.00 0.00 H new ATOM 0 HD2 LYS B 42 8.764 -13.196 -0.167 1.00 0.00 H new ATOM 0 HD3 LYS B 42 8.206 -13.918 -1.663 1.00 0.00 H new ATOM 0 HE2 LYS B 42 6.049 -12.410 -1.274 1.00 0.00 H new ATOM 0 HE3 LYS B 42 7.096 -11.498 -0.204 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 7.148 -10.608 -2.449 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 8.676 -11.220 -2.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 7.662 -12.104 -3.068 1.00 0.00 H new ATOM 1865 N LEU B 43 7.314 -15.933 3.697 1.00 0.00 N ATOM 1866 CA LEU B 43 8.167 -16.139 4.901 1.00 0.00 C ATOM 1867 C LEU B 43 9.632 -15.837 4.573 1.00 0.00 C ATOM 1868 O LEU B 43 10.126 -16.200 3.520 1.00 0.00 O ATOM 1869 CB LEU B 43 8.036 -17.589 5.366 1.00 0.00 C ATOM 1870 CG LEU B 43 6.730 -17.750 6.146 1.00 0.00 C ATOM 1871 CD1 LEU B 43 5.553 -17.387 5.239 1.00 0.00 C ATOM 1872 CD2 LEU B 43 6.588 -19.205 6.596 1.00 0.00 C ATOM 0 H LEU B 43 7.278 -16.720 3.049 1.00 0.00 H new ATOM 0 HA LEU B 43 7.839 -15.464 5.691 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.047 -18.261 4.508 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.885 -17.860 5.994 1.00 0.00 H new ATOM 0 HG LEU B 43 6.739 -17.095 7.017 1.00 0.00 H new ATOM 0 HD11 LEU B 43 4.620 -17.500 5.791 1.00 0.00 H new ATOM 0 HD12 LEU B 43 5.655 -16.354 4.907 1.00 0.00 H new ATOM 0 HD13 LEU B 43 5.544 -18.048 4.372 1.00 0.00 H new ATOM 0 HD21 LEU B 43 5.658 -19.325 7.152 1.00 0.00 H new ATOM 0 HD22 LEU B 43 6.574 -19.856 5.722 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.430 -19.472 7.234 1.00 0.00 H new ATOM 1884 N SER B 44 10.294 -15.181 5.493 1.00 0.00 N ATOM 1885 CA SER B 44 11.730 -14.822 5.273 1.00 0.00 C ATOM 1886 C SER B 44 12.526 -16.028 4.765 1.00 0.00 C ATOM 1887 O SER B 44 13.550 -15.872 4.131 1.00 0.00 O ATOM 1888 CB SER B 44 12.328 -14.350 6.595 1.00 0.00 C ATOM 1889 OG SER B 44 12.748 -15.547 7.233 1.00 0.00 O ATOM 0 H SER B 44 9.904 -14.879 6.386 1.00 0.00 H new ATOM 0 HA SER B 44 11.783 -14.033 4.523 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.164 -13.670 6.434 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.593 -13.815 7.196 1.00 0.00 H new ATOM 0 HG SER B 44 13.151 -15.332 8.100 1.00 0.00 H new ATOM 1895 N ASP B 45 12.044 -17.202 5.052 1.00 0.00 N ATOM 1896 CA ASP B 45 12.778 -18.416 4.592 1.00 0.00 C ATOM 1897 C ASP B 45 12.899 -18.404 3.067 1.00 0.00 C ATOM 1898 O ASP B 45 13.580 -19.226 2.487 1.00 0.00 O ATOM 1899 CB ASP B 45 12.014 -19.662 5.035 1.00 0.00 C ATOM 1900 CG ASP B 45 10.526 -19.478 4.730 1.00 0.00 C ATOM 1901 OD1 ASP B 45 10.254 -18.790 3.761 1.00 0.00 O ATOM 1902 OD2 ASP B 45 9.747 -20.038 5.483 1.00 0.00 O ATOM 0 H ASP B 45 11.187 -17.376 5.577 1.00 0.00 H new ATOM 0 HA ASP B 45 13.777 -18.423 5.028 1.00 0.00 H new ATOM 0 HB2 ASP B 45 12.397 -20.541 4.517 1.00 0.00 H new ATOM 0 HB3 ASP B 45 12.160 -19.832 6.102 1.00 0.00 H new ATOM 1907 N GLY B 46 12.233 -17.466 2.451 1.00 0.00 N ATOM 1908 CA GLY B 46 12.294 -17.380 0.967 1.00 0.00 C ATOM 1909 C GLY B 46 11.192 -18.237 0.348 1.00 0.00 C ATOM 1910 O GLY B 46 11.298 -18.656 -0.788 1.00 0.00 O ATOM 0 H GLY B 46 11.654 -16.761 2.908 1.00 0.00 H new ATOM 0 HA2 GLY B 46 12.181 -16.343 0.650 1.00 0.00 H new ATOM 0 HA3 GLY B 46 13.269 -17.717 0.615 1.00 0.00 H new ATOM 1914 N ARG B 47 10.156 -18.477 1.114 1.00 0.00 N ATOM 1915 CA ARG B 47 9.031 -19.322 0.599 1.00 0.00 C ATOM 1916 C ARG B 47 7.717 -18.536 0.607 1.00 0.00 C ATOM 1917 O ARG B 47 7.632 -17.467 1.177 1.00 0.00 O ATOM 1918 CB ARG B 47 8.888 -20.550 1.494 1.00 0.00 C ATOM 1919 CG ARG B 47 10.210 -21.327 1.495 1.00 0.00 C ATOM 1920 CD ARG B 47 10.209 -22.328 2.652 1.00 0.00 C ATOM 1921 NE ARG B 47 9.205 -23.393 2.371 1.00 0.00 N ATOM 1922 CZ ARG B 47 9.450 -24.273 1.439 1.00 0.00 C ATOM 1923 NH1 ARG B 47 10.602 -24.238 0.828 1.00 0.00 N ATOM 1924 NH2 ARG B 47 8.536 -25.158 1.149 1.00 0.00 N ATOM 0 H ARG B 47 10.040 -18.128 2.065 1.00 0.00 H new ATOM 0 HA ARG B 47 9.251 -19.621 -0.426 1.00 0.00 H new ATOM 0 HB2 ARG B 47 8.629 -20.248 2.509 1.00 0.00 H new ATOM 0 HB3 ARG B 47 8.079 -21.185 1.134 1.00 0.00 H new ATOM 0 HG2 ARG B 47 10.338 -21.850 0.547 1.00 0.00 H new ATOM 0 HG3 ARG B 47 11.049 -20.639 1.596 1.00 0.00 H new ATOM 0 HD2 ARG B 47 11.200 -22.767 2.771 1.00 0.00 H new ATOM 0 HD3 ARG B 47 9.970 -21.822 3.587 1.00 0.00 H new ATOM 0 HE ARG B 47 8.335 -23.434 2.902 1.00 0.00 H new ATOM 0 HH11 ARG B 47 11.292 -23.531 1.082 1.00 0.00 H new ATOM 0 HH12 ARG B 47 10.812 -24.917 0.097 1.00 0.00 H new ATOM 0 HH21 ARG B 47 7.646 -25.155 1.648 1.00 0.00 H new ATOM 0 HH22 ARG B 47 8.711 -25.853 0.423 1.00 0.00 H new ATOM 1938 N GLU B 48 6.719 -19.093 -0.031 1.00 0.00 N ATOM 1939 CA GLU B 48 5.393 -18.408 -0.075 1.00 0.00 C ATOM 1940 C GLU B 48 4.271 -19.425 0.150 1.00 0.00 C ATOM 1941 O GLU B 48 4.294 -20.508 -0.400 1.00 0.00 O ATOM 1942 CB GLU B 48 5.216 -17.740 -1.441 1.00 0.00 C ATOM 1943 CG GLU B 48 5.411 -18.784 -2.542 1.00 0.00 C ATOM 1944 CD GLU B 48 5.405 -18.086 -3.904 1.00 0.00 C ATOM 1945 OE1 GLU B 48 6.321 -17.307 -4.118 1.00 0.00 O ATOM 1946 OE2 GLU B 48 4.487 -18.372 -4.654 1.00 0.00 O ATOM 0 H GLU B 48 6.765 -19.987 -0.520 1.00 0.00 H new ATOM 0 HA GLU B 48 5.350 -17.654 0.711 1.00 0.00 H new ATOM 0 HB2 GLU B 48 4.223 -17.296 -1.516 1.00 0.00 H new ATOM 0 HB3 GLU B 48 5.937 -16.931 -1.559 1.00 0.00 H new ATOM 0 HG2 GLU B 48 6.353 -19.313 -2.395 1.00 0.00 H new ATOM 0 HG3 GLU B 48 4.616 -19.529 -2.498 1.00 0.00 H new ATOM 1953 N LEU B 49 3.314 -19.050 0.960 1.00 0.00 N ATOM 1954 CA LEU B 49 2.177 -19.980 1.245 1.00 0.00 C ATOM 1955 C LEU B 49 0.843 -19.232 1.152 1.00 0.00 C ATOM 1956 O LEU B 49 0.803 -18.073 0.785 1.00 0.00 O ATOM 1957 CB LEU B 49 2.342 -20.548 2.654 1.00 0.00 C ATOM 1958 CG LEU B 49 3.685 -21.279 2.748 1.00 0.00 C ATOM 1959 CD1 LEU B 49 4.684 -20.401 3.503 1.00 0.00 C ATOM 1960 CD2 LEU B 49 3.492 -22.591 3.511 1.00 0.00 C ATOM 0 H LEU B 49 3.269 -18.148 1.434 1.00 0.00 H new ATOM 0 HA LEU B 49 2.180 -20.787 0.512 1.00 0.00 H new ATOM 0 HB2 LEU B 49 2.299 -19.745 3.390 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.525 -21.233 2.881 1.00 0.00 H new ATOM 0 HG LEU B 49 4.061 -21.487 1.746 1.00 0.00 H new ATOM 0 HD11 LEU B 49 5.642 -20.917 3.573 1.00 0.00 H new ATOM 0 HD12 LEU B 49 4.817 -19.460 2.970 1.00 0.00 H new ATOM 0 HD13 LEU B 49 4.306 -20.200 4.506 1.00 0.00 H new ATOM 0 HD21 LEU B 49 4.445 -23.115 3.581 1.00 0.00 H new ATOM 0 HD22 LEU B 49 3.121 -22.378 4.514 1.00 0.00 H new ATOM 0 HD23 LEU B 49 2.772 -23.216 2.983 1.00 0.00 H new ATOM 1972 N CYS B 50 -0.221 -19.916 1.486 1.00 0.00 N ATOM 1973 CA CYS B 50 -1.567 -19.269 1.425 1.00 0.00 C ATOM 1974 C CYS B 50 -2.391 -19.644 2.663 1.00 0.00 C ATOM 1975 O CYS B 50 -2.507 -20.807 3.004 1.00 0.00 O ATOM 1976 CB CYS B 50 -2.294 -19.745 0.169 1.00 0.00 C ATOM 1977 SG CYS B 50 -1.896 -18.911 -1.386 1.00 0.00 S ATOM 0 H CYS B 50 -0.217 -20.888 1.796 1.00 0.00 H new ATOM 0 HA CYS B 50 -1.444 -18.186 1.397 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -2.090 -20.808 0.043 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -3.366 -19.645 0.341 1.00 0.00 H new ATOM 1982 N LEU B 51 -2.945 -18.645 3.304 1.00 0.00 N ATOM 1983 CA LEU B 51 -3.768 -18.906 4.526 1.00 0.00 C ATOM 1984 C LEU B 51 -5.236 -18.560 4.254 1.00 0.00 C ATOM 1985 O LEU B 51 -5.529 -17.644 3.511 1.00 0.00 O ATOM 1986 CB LEU B 51 -3.253 -18.036 5.673 1.00 0.00 C ATOM 1987 CG LEU B 51 -1.723 -18.111 5.727 1.00 0.00 C ATOM 1988 CD1 LEU B 51 -1.221 -17.261 6.896 1.00 0.00 C ATOM 1989 CD2 LEU B 51 -1.294 -19.564 5.944 1.00 0.00 C ATOM 0 H LEU B 51 -2.864 -17.664 3.036 1.00 0.00 H new ATOM 0 HA LEU B 51 -3.691 -19.960 4.791 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.572 -17.003 5.531 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.678 -18.374 6.618 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.304 -17.740 4.791 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -0.133 -17.310 6.940 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.532 -16.226 6.753 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.640 -17.641 7.828 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -0.206 -19.620 5.983 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -1.710 -19.930 6.883 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -1.660 -20.178 5.121 1.00 0.00 H new ATOM 2001 N ASP B 52 -6.125 -19.305 4.869 1.00 0.00 N ATOM 2002 CA ASP B 52 -7.585 -19.040 4.670 1.00 0.00 C ATOM 2003 C ASP B 52 -8.219 -18.561 6.010 1.00 0.00 C ATOM 2004 O ASP B 52 -7.945 -19.134 7.045 1.00 0.00 O ATOM 2005 CB ASP B 52 -8.261 -20.340 4.238 1.00 0.00 C ATOM 2006 CG ASP B 52 -9.615 -20.021 3.599 1.00 0.00 C ATOM 2007 OD1 ASP B 52 -10.504 -19.677 4.359 1.00 0.00 O ATOM 2008 OD2 ASP B 52 -9.682 -20.140 2.387 1.00 0.00 O ATOM 0 H ASP B 52 -5.904 -20.079 5.495 1.00 0.00 H new ATOM 0 HA ASP B 52 -7.719 -18.270 3.911 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -7.628 -20.873 3.529 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -8.398 -20.995 5.098 1.00 0.00 H new ATOM 2013 N PRO B 53 -9.060 -17.517 5.978 1.00 0.00 N ATOM 2014 CA PRO B 53 -9.697 -17.027 7.211 1.00 0.00 C ATOM 2015 C PRO B 53 -10.559 -18.125 7.843 1.00 0.00 C ATOM 2016 O PRO B 53 -11.066 -17.971 8.936 1.00 0.00 O ATOM 2017 CB PRO B 53 -10.580 -15.851 6.774 1.00 0.00 C ATOM 2018 CG PRO B 53 -10.471 -15.737 5.225 1.00 0.00 C ATOM 2019 CD PRO B 53 -9.430 -16.768 4.758 1.00 0.00 C ATOM 0 HA PRO B 53 -8.958 -16.730 7.955 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -11.615 -16.015 7.075 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -10.252 -14.927 7.251 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -11.437 -15.929 4.758 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -10.171 -14.730 4.935 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -9.844 -17.431 3.998 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -8.562 -16.280 4.316 1.00 0.00 H new ATOM 2027 N LYS B 54 -10.703 -19.212 7.136 1.00 0.00 N ATOM 2028 CA LYS B 54 -11.531 -20.329 7.665 1.00 0.00 C ATOM 2029 C LYS B 54 -11.024 -20.778 9.040 1.00 0.00 C ATOM 2030 O LYS B 54 -11.761 -21.371 9.804 1.00 0.00 O ATOM 2031 CB LYS B 54 -11.462 -21.504 6.691 1.00 0.00 C ATOM 2032 CG LYS B 54 -12.427 -22.597 7.155 1.00 0.00 C ATOM 2033 CD LYS B 54 -12.506 -23.685 6.082 1.00 0.00 C ATOM 2034 CE LYS B 54 -13.889 -23.647 5.427 1.00 0.00 C ATOM 2035 NZ LYS B 54 -13.974 -24.653 4.332 1.00 0.00 N ATOM 0 H LYS B 54 -10.285 -19.374 6.220 1.00 0.00 H new ATOM 0 HA LYS B 54 -12.560 -19.986 7.771 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -11.723 -21.174 5.685 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -10.446 -21.895 6.645 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -12.086 -23.024 8.098 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -13.415 -22.174 7.335 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -11.731 -23.529 5.332 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -12.328 -24.664 6.526 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -14.657 -23.847 6.174 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -14.083 -22.651 5.030 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -14.918 -24.615 3.898 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -13.253 -24.444 3.612 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -13.810 -25.604 4.720 1.00 0.00 H new ATOM 2049 N GLU B 55 -9.779 -20.481 9.327 1.00 0.00 N ATOM 2050 CA GLU B 55 -9.210 -20.896 10.650 1.00 0.00 C ATOM 2051 C GLU B 55 -9.041 -19.680 11.566 1.00 0.00 C ATOM 2052 O GLU B 55 -8.604 -18.631 11.139 1.00 0.00 O ATOM 2053 CB GLU B 55 -7.857 -21.559 10.429 1.00 0.00 C ATOM 2054 CG GLU B 55 -7.995 -22.642 9.355 1.00 0.00 C ATOM 2055 CD GLU B 55 -7.471 -23.970 9.907 1.00 0.00 C ATOM 2056 OE1 GLU B 55 -8.229 -24.592 10.631 1.00 0.00 O ATOM 2057 OE2 GLU B 55 -6.341 -24.287 9.572 1.00 0.00 O ATOM 0 H GLU B 55 -9.140 -19.977 8.713 1.00 0.00 H new ATOM 0 HA GLU B 55 -9.895 -21.599 11.125 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.121 -20.816 10.121 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.497 -21.997 11.360 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -9.039 -22.745 9.058 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.436 -22.359 8.463 1.00 0.00 H new ATOM 2064 N ASN B 56 -9.385 -19.854 12.811 1.00 0.00 N ATOM 2065 CA ASN B 56 -9.266 -18.718 13.770 1.00 0.00 C ATOM 2066 C ASN B 56 -7.798 -18.338 13.995 1.00 0.00 C ATOM 2067 O ASN B 56 -7.474 -17.171 14.099 1.00 0.00 O ATOM 2068 CB ASN B 56 -9.895 -19.123 15.102 1.00 0.00 C ATOM 2069 CG ASN B 56 -10.090 -17.876 15.969 1.00 0.00 C ATOM 2070 OD1 ASN B 56 -9.790 -16.771 15.562 1.00 0.00 O ATOM 2071 ND2 ASN B 56 -10.590 -18.009 17.167 1.00 0.00 N ATOM 0 H ASN B 56 -9.741 -20.725 13.205 1.00 0.00 H new ATOM 0 HA ASN B 56 -9.783 -17.854 13.353 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -10.853 -19.614 14.931 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -9.256 -19.841 15.616 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -10.727 -17.188 17.756 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -10.844 -18.934 17.514 1.00 0.00 H new ATOM 2078 N TRP B 57 -6.935 -19.318 14.067 1.00 0.00 N ATOM 2079 CA TRP B 57 -5.499 -18.985 14.299 1.00 0.00 C ATOM 2080 C TRP B 57 -4.951 -18.156 13.140 1.00 0.00 C ATOM 2081 O TRP B 57 -3.980 -17.446 13.294 1.00 0.00 O ATOM 2082 CB TRP B 57 -4.667 -20.265 14.469 1.00 0.00 C ATOM 2083 CG TRP B 57 -4.779 -21.164 13.229 1.00 0.00 C ATOM 2084 CD1 TRP B 57 -5.618 -22.191 13.126 1.00 0.00 C ATOM 2085 CD2 TRP B 57 -4.021 -21.068 12.147 1.00 0.00 C ATOM 2086 NE1 TRP B 57 -5.329 -22.720 11.926 1.00 0.00 N ATOM 2087 CE2 TRP B 57 -4.331 -22.071 11.243 1.00 0.00 C ATOM 2088 CE3 TRP B 57 -3.030 -20.151 11.834 1.00 0.00 C ATOM 2089 CZ2 TRP B 57 -3.661 -22.157 10.039 1.00 0.00 C ATOM 2090 CZ3 TRP B 57 -2.362 -20.239 10.626 1.00 0.00 C ATOM 2091 CH2 TRP B 57 -2.677 -21.241 9.731 1.00 0.00 C ATOM 0 H TRP B 57 -7.154 -20.310 13.978 1.00 0.00 H new ATOM 0 HA TRP B 57 -5.429 -18.400 15.216 1.00 0.00 H new ATOM 0 HB2 TRP B 57 -3.623 -20.004 14.640 1.00 0.00 H new ATOM 0 HB3 TRP B 57 -5.008 -20.810 15.349 1.00 0.00 H new ATOM 0 HD1 TRP B 57 -6.358 -22.522 13.840 1.00 0.00 H new ATOM 0 HE1 TRP B 57 -5.812 -23.537 11.553 1.00 0.00 H new ATOM 0 HE3 TRP B 57 -2.779 -19.367 12.534 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 -3.907 -22.941 9.339 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 -1.592 -19.522 10.383 1.00 0.00 H new ATOM 0 HH2 TRP B 57 -2.153 -21.308 8.789 1.00 0.00 H new ATOM 2102 N VAL B 58 -5.577 -18.253 12.003 1.00 0.00 N ATOM 2103 CA VAL B 58 -5.082 -17.458 10.843 1.00 0.00 C ATOM 2104 C VAL B 58 -5.438 -15.992 11.046 1.00 0.00 C ATOM 2105 O VAL B 58 -4.677 -15.107 10.704 1.00 0.00 O ATOM 2106 CB VAL B 58 -5.733 -17.975 9.558 1.00 0.00 C ATOM 2107 CG1 VAL B 58 -5.723 -16.871 8.501 1.00 0.00 C ATOM 2108 CG2 VAL B 58 -4.946 -19.176 9.042 1.00 0.00 C ATOM 0 H VAL B 58 -6.395 -18.836 11.825 1.00 0.00 H new ATOM 0 HA VAL B 58 -3.999 -17.558 10.765 1.00 0.00 H new ATOM 0 HB VAL B 58 -6.761 -18.271 9.764 1.00 0.00 H new ATOM 0 HG11 VAL B 58 -6.187 -17.239 7.586 1.00 0.00 H new ATOM 0 HG12 VAL B 58 -6.281 -16.010 8.869 1.00 0.00 H new ATOM 0 HG13 VAL B 58 -4.695 -16.576 8.293 1.00 0.00 H new ATOM 0 HG21 VAL B 58 -5.407 -19.547 8.127 1.00 0.00 H new ATOM 0 HG22 VAL B 58 -3.919 -18.876 8.835 1.00 0.00 H new ATOM 0 HG23 VAL B 58 -4.949 -19.964 9.795 1.00 0.00 H new ATOM 2118 N GLN B 59 -6.590 -15.767 11.600 1.00 0.00 N ATOM 2119 CA GLN B 59 -7.018 -14.370 11.848 1.00 0.00 C ATOM 2120 C GLN B 59 -6.187 -13.769 12.983 1.00 0.00 C ATOM 2121 O GLN B 59 -6.066 -12.570 13.097 1.00 0.00 O ATOM 2122 CB GLN B 59 -8.494 -14.368 12.244 1.00 0.00 C ATOM 2123 CG GLN B 59 -9.074 -12.971 12.013 1.00 0.00 C ATOM 2124 CD GLN B 59 -9.541 -12.849 10.562 1.00 0.00 C ATOM 2125 OE1 GLN B 59 -10.280 -13.674 10.063 1.00 0.00 O ATOM 2126 NE2 GLN B 59 -9.131 -11.836 9.849 1.00 0.00 N ATOM 0 H GLN B 59 -7.252 -16.487 11.891 1.00 0.00 H new ATOM 0 HA GLN B 59 -6.873 -13.776 10.945 1.00 0.00 H new ATOM 0 HB2 GLN B 59 -9.042 -15.104 11.656 1.00 0.00 H new ATOM 0 HB3 GLN B 59 -8.603 -14.652 13.291 1.00 0.00 H new ATOM 0 HG2 GLN B 59 -9.909 -12.795 12.691 1.00 0.00 H new ATOM 0 HG3 GLN B 59 -8.322 -12.212 12.230 1.00 0.00 H new ATOM 0 HE21 GLN B 59 -8.510 -11.140 10.262 1.00 0.00 H new ATOM 0 HE22 GLN B 59 -9.431 -11.740 8.879 1.00 0.00 H new ATOM 2135 N ARG B 60 -5.617 -14.623 13.791 1.00 0.00 N ATOM 2136 CA ARG B 60 -4.808 -14.116 14.938 1.00 0.00 C ATOM 2137 C ARG B 60 -3.340 -13.895 14.540 1.00 0.00 C ATOM 2138 O ARG B 60 -2.815 -12.813 14.711 1.00 0.00 O ATOM 2139 CB ARG B 60 -4.880 -15.126 16.081 1.00 0.00 C ATOM 2140 CG ARG B 60 -5.632 -14.497 17.257 1.00 0.00 C ATOM 2141 CD ARG B 60 -5.686 -15.497 18.413 1.00 0.00 C ATOM 2142 NE ARG B 60 -6.871 -15.192 19.262 1.00 0.00 N ATOM 2143 CZ ARG B 60 -7.791 -16.102 19.429 1.00 0.00 C ATOM 2144 NH1 ARG B 60 -8.383 -16.601 18.378 1.00 0.00 N ATOM 2145 NH2 ARG B 60 -8.091 -16.483 20.641 1.00 0.00 N ATOM 0 H ARG B 60 -5.675 -15.638 13.709 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.218 -13.156 15.251 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -5.388 -16.032 15.751 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -3.876 -15.418 16.389 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -5.133 -13.582 17.575 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -6.641 -14.220 16.952 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -5.750 -16.515 18.028 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -4.773 -15.438 19.005 1.00 0.00 H new ATOM 0 HE ARG B 60 -6.963 -14.280 19.709 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -8.124 -16.279 17.446 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -9.105 -17.313 18.489 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -7.609 -16.070 21.439 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -8.808 -17.193 20.790 1.00 0.00 H new ATOM 2159 N VAL B 61 -2.699 -14.914 14.020 1.00 0.00 N ATOM 2160 CA VAL B 61 -1.272 -14.739 13.640 1.00 0.00 C ATOM 2161 C VAL B 61 -1.155 -13.640 12.581 1.00 0.00 C ATOM 2162 O VAL B 61 -0.169 -12.935 12.518 1.00 0.00 O ATOM 2163 CB VAL B 61 -0.732 -16.063 13.101 1.00 0.00 C ATOM 2164 CG1 VAL B 61 -0.938 -17.152 14.157 1.00 0.00 C ATOM 2165 CG2 VAL B 61 -1.492 -16.430 11.823 1.00 0.00 C ATOM 0 H VAL B 61 -3.095 -15.838 13.847 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.687 -14.445 14.511 1.00 0.00 H new ATOM 0 HB VAL B 61 0.331 -15.972 12.876 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.555 -18.101 13.781 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -0.404 -16.881 15.068 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.001 -17.251 14.375 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -1.112 -17.374 11.432 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -2.554 -16.531 12.047 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -1.352 -15.646 11.078 1.00 0.00 H new ATOM 2175 N VAL B 62 -2.170 -13.510 11.774 1.00 0.00 N ATOM 2176 CA VAL B 62 -2.133 -12.445 10.734 1.00 0.00 C ATOM 2177 C VAL B 62 -2.366 -11.083 11.396 1.00 0.00 C ATOM 2178 O VAL B 62 -1.661 -10.131 11.124 1.00 0.00 O ATOM 2179 CB VAL B 62 -3.220 -12.711 9.696 1.00 0.00 C ATOM 2180 CG1 VAL B 62 -3.313 -11.514 8.748 1.00 0.00 C ATOM 2181 CG2 VAL B 62 -2.851 -13.960 8.893 1.00 0.00 C ATOM 0 H VAL B 62 -3.012 -14.086 11.788 1.00 0.00 H new ATOM 0 HA VAL B 62 -1.161 -12.444 10.241 1.00 0.00 H new ATOM 0 HB VAL B 62 -4.178 -12.862 10.194 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -4.088 -11.698 8.004 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -3.562 -10.618 9.317 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -2.356 -11.372 8.247 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -3.624 -14.156 8.149 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -1.896 -13.801 8.391 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -2.770 -14.814 9.565 1.00 0.00 H new ATOM 2191 N GLU B 63 -3.355 -11.018 12.255 1.00 0.00 N ATOM 2192 CA GLU B 63 -3.621 -9.727 12.953 1.00 0.00 C ATOM 2193 C GLU B 63 -2.358 -9.281 13.685 1.00 0.00 C ATOM 2194 O GLU B 63 -2.028 -8.112 13.710 1.00 0.00 O ATOM 2195 CB GLU B 63 -4.751 -9.916 13.965 1.00 0.00 C ATOM 2196 CG GLU B 63 -5.118 -8.558 14.570 1.00 0.00 C ATOM 2197 CD GLU B 63 -6.546 -8.194 14.161 1.00 0.00 C ATOM 2198 OE1 GLU B 63 -7.439 -8.623 14.874 1.00 0.00 O ATOM 2199 OE2 GLU B 63 -6.664 -7.507 13.160 1.00 0.00 O ATOM 0 H GLU B 63 -3.977 -11.789 12.498 1.00 0.00 H new ATOM 0 HA GLU B 63 -3.910 -8.971 12.223 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -5.621 -10.358 13.479 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -4.441 -10.605 14.750 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -5.037 -8.597 15.656 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -4.422 -7.793 14.225 1.00 0.00 H new ATOM 2206 N LYS B 64 -1.675 -10.231 14.266 1.00 0.00 N ATOM 2207 CA LYS B 64 -0.426 -9.890 14.997 1.00 0.00 C ATOM 2208 C LYS B 64 0.563 -9.217 14.041 1.00 0.00 C ATOM 2209 O LYS B 64 1.163 -8.215 14.372 1.00 0.00 O ATOM 2210 CB LYS B 64 0.189 -11.171 15.558 1.00 0.00 C ATOM 2211 CG LYS B 64 -0.385 -11.443 16.952 1.00 0.00 C ATOM 2212 CD LYS B 64 0.477 -10.735 17.999 1.00 0.00 C ATOM 2213 CE LYS B 64 -0.179 -10.886 19.373 1.00 0.00 C ATOM 2214 NZ LYS B 64 0.821 -11.332 20.383 1.00 0.00 N ATOM 0 H LYS B 64 -1.927 -11.219 14.265 1.00 0.00 H new ATOM 0 HA LYS B 64 -0.653 -9.205 15.814 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -0.023 -12.010 14.895 1.00 0.00 H new ATOM 0 HB3 LYS B 64 1.273 -11.074 15.612 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -1.414 -11.088 17.010 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -0.407 -12.515 17.146 1.00 0.00 H new ATOM 0 HD2 LYS B 64 1.480 -11.162 18.012 1.00 0.00 H new ATOM 0 HD3 LYS B 64 0.584 -9.680 17.747 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -0.616 -9.936 19.680 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -0.994 -11.608 19.316 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 0.359 -11.429 21.310 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 1.219 -12.249 20.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 1.585 -10.629 20.449 1.00 0.00 H new ATOM 2228 N PHE B 65 0.713 -9.783 12.872 1.00 0.00 N ATOM 2229 CA PHE B 65 1.654 -9.175 11.888 1.00 0.00 C ATOM 2230 C PHE B 65 1.335 -7.690 11.708 1.00 0.00 C ATOM 2231 O PHE B 65 2.212 -6.853 11.754 1.00 0.00 O ATOM 2232 CB PHE B 65 1.518 -9.879 10.550 1.00 0.00 C ATOM 2233 CG PHE B 65 2.443 -9.198 9.536 1.00 0.00 C ATOM 2234 CD1 PHE B 65 3.818 -9.338 9.634 1.00 0.00 C ATOM 2235 CD2 PHE B 65 1.920 -8.434 8.507 1.00 0.00 C ATOM 2236 CE1 PHE B 65 4.652 -8.722 8.721 1.00 0.00 C ATOM 2237 CE2 PHE B 65 2.756 -7.820 7.596 1.00 0.00 C ATOM 2238 CZ PHE B 65 4.120 -7.964 7.704 1.00 0.00 C ATOM 0 H PHE B 65 0.233 -10.627 12.560 1.00 0.00 H new ATOM 0 HA PHE B 65 2.673 -9.284 12.260 1.00 0.00 H new ATOM 0 HB2 PHE B 65 1.779 -10.933 10.650 1.00 0.00 H new ATOM 0 HB3 PHE B 65 0.485 -9.838 10.205 1.00 0.00 H new ATOM 0 HD1 PHE B 65 4.241 -9.933 10.430 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.850 -8.317 8.416 1.00 0.00 H new ATOM 0 HE1 PHE B 65 5.723 -8.836 8.806 1.00 0.00 H new ATOM 0 HE2 PHE B 65 2.338 -7.225 6.797 1.00 0.00 H new ATOM 0 HZ PHE B 65 4.772 -7.482 6.991 1.00 0.00 H new ATOM 2248 N LEU B 66 0.079 -7.396 11.504 1.00 0.00 N ATOM 2249 CA LEU B 66 -0.319 -5.969 11.320 1.00 0.00 C ATOM 2250 C LEU B 66 -0.070 -5.183 12.611 1.00 0.00 C ATOM 2251 O LEU B 66 0.253 -4.012 12.575 1.00 0.00 O ATOM 2252 CB LEU B 66 -1.804 -5.910 10.964 1.00 0.00 C ATOM 2253 CG LEU B 66 -1.991 -5.025 9.726 1.00 0.00 C ATOM 2254 CD1 LEU B 66 -3.479 -4.967 9.372 1.00 0.00 C ATOM 2255 CD2 LEU B 66 -1.491 -3.610 10.029 1.00 0.00 C ATOM 0 H LEU B 66 -0.682 -8.074 11.457 1.00 0.00 H new ATOM 0 HA LEU B 66 0.274 -5.527 10.519 1.00 0.00 H new ATOM 0 HB2 LEU B 66 -2.184 -6.913 10.769 1.00 0.00 H new ATOM 0 HB3 LEU B 66 -2.375 -5.510 11.802 1.00 0.00 H new ATOM 0 HG LEU B 66 -1.426 -5.440 8.891 1.00 0.00 H new ATOM 0 HD11 LEU B 66 -3.619 -4.339 8.492 1.00 0.00 H new ATOM 0 HD12 LEU B 66 -3.842 -5.973 9.162 1.00 0.00 H new ATOM 0 HD13 LEU B 66 -4.036 -4.548 10.210 1.00 0.00 H new ATOM 0 HD21 LEU B 66 -1.624 -2.981 9.149 1.00 0.00 H new ATOM 0 HD22 LEU B 66 -2.059 -3.194 10.861 1.00 0.00 H new ATOM 0 HD23 LEU B 66 -0.434 -3.646 10.293 1.00 0.00 H new ATOM 2267 N LYS B 67 -0.225 -5.845 13.724 1.00 0.00 N ATOM 2268 CA LYS B 67 -0.003 -5.153 15.027 1.00 0.00 C ATOM 2269 C LYS B 67 1.488 -4.847 15.216 1.00 0.00 C ATOM 2270 O LYS B 67 1.849 -3.804 15.723 1.00 0.00 O ATOM 2271 CB LYS B 67 -0.485 -6.056 16.160 1.00 0.00 C ATOM 2272 CG LYS B 67 -0.836 -5.194 17.375 1.00 0.00 C ATOM 2273 CD LYS B 67 -1.035 -6.100 18.591 1.00 0.00 C ATOM 2274 CE LYS B 67 -1.657 -5.286 19.726 1.00 0.00 C ATOM 2275 NZ LYS B 67 -3.121 -5.118 19.505 1.00 0.00 N ATOM 0 H LYS B 67 -0.493 -6.827 13.789 1.00 0.00 H new ATOM 0 HA LYS B 67 -0.559 -4.216 15.036 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.357 -6.627 15.840 1.00 0.00 H new ATOM 0 HB3 LYS B 67 0.290 -6.777 16.422 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -0.040 -4.475 17.568 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -1.743 -4.621 17.180 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -1.681 -6.939 18.333 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -0.080 -6.519 18.908 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -1.482 -5.786 20.679 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -1.178 -4.309 19.786 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.557 -4.714 20.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -3.279 -4.479 18.700 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -3.550 -6.043 19.302 1.00 0.00 H new ATOM 2289 N ARG B 68 2.320 -5.764 14.805 1.00 0.00 N ATOM 2290 CA ARG B 68 3.787 -5.543 14.954 1.00 0.00 C ATOM 2291 C ARG B 68 4.301 -4.642 13.828 1.00 0.00 C ATOM 2292 O ARG B 68 5.201 -3.849 14.024 1.00 0.00 O ATOM 2293 CB ARG B 68 4.504 -6.890 14.896 1.00 0.00 C ATOM 2294 CG ARG B 68 5.846 -6.776 15.621 1.00 0.00 C ATOM 2295 CD ARG B 68 6.615 -8.089 15.463 1.00 0.00 C ATOM 2296 NE ARG B 68 7.901 -7.815 14.761 1.00 0.00 N ATOM 2297 CZ ARG B 68 9.027 -8.137 15.338 1.00 0.00 C ATOM 2298 NH1 ARG B 68 9.257 -7.715 16.552 1.00 0.00 N ATOM 2299 NH2 ARG B 68 9.884 -8.869 14.682 1.00 0.00 N ATOM 0 H ARG B 68 2.051 -6.650 14.376 1.00 0.00 H new ATOM 0 HA ARG B 68 3.983 -5.059 15.911 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.891 -7.662 15.360 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.661 -7.188 13.859 1.00 0.00 H new ATOM 0 HG2 ARG B 68 6.426 -5.949 15.211 1.00 0.00 H new ATOM 0 HG3 ARG B 68 5.685 -6.559 16.677 1.00 0.00 H new ATOM 0 HD2 ARG B 68 6.806 -8.534 16.440 1.00 0.00 H new ATOM 0 HD3 ARG B 68 6.022 -8.807 14.897 1.00 0.00 H new ATOM 0 HE ARG B 68 7.901 -7.380 13.838 1.00 0.00 H new ATOM 0 HH11 ARG B 68 8.563 -7.144 17.034 1.00 0.00 H new ATOM 0 HH12 ARG B 68 10.131 -7.957 17.019 1.00 0.00 H new ATOM 0 HH21 ARG B 68 9.669 -9.180 13.735 1.00 0.00 H new ATOM 0 HH22 ARG B 68 10.769 -9.131 15.116 1.00 0.00 H new ATOM 2313 N ALA B 69 3.718 -4.783 12.670 1.00 0.00 N ATOM 2314 CA ALA B 69 4.156 -3.943 11.519 1.00 0.00 C ATOM 2315 C ALA B 69 3.616 -2.517 11.674 1.00 0.00 C ATOM 2316 O ALA B 69 4.208 -1.570 11.197 1.00 0.00 O ATOM 2317 CB ALA B 69 3.625 -4.556 10.222 1.00 0.00 C ATOM 0 H ALA B 69 2.962 -5.439 12.471 1.00 0.00 H new ATOM 0 HA ALA B 69 5.245 -3.906 11.491 1.00 0.00 H new ATOM 0 HB1 ALA B 69 3.941 -3.947 9.375 1.00 0.00 H new ATOM 0 HB2 ALA B 69 4.018 -5.566 10.109 1.00 0.00 H new ATOM 0 HB3 ALA B 69 2.536 -4.592 10.256 1.00 0.00 H new ATOM 2323 N GLU B 70 2.500 -2.397 12.341 1.00 0.00 N ATOM 2324 CA GLU B 70 1.907 -1.044 12.538 1.00 0.00 C ATOM 2325 C GLU B 70 2.583 -0.338 13.720 1.00 0.00 C ATOM 2326 O GLU B 70 2.712 0.870 13.733 1.00 0.00 O ATOM 2327 CB GLU B 70 0.412 -1.189 12.819 1.00 0.00 C ATOM 2328 CG GLU B 70 -0.169 0.183 13.164 1.00 0.00 C ATOM 2329 CD GLU B 70 -1.697 0.117 13.100 1.00 0.00 C ATOM 2330 OE1 GLU B 70 -2.201 0.318 12.007 1.00 0.00 O ATOM 2331 OE2 GLU B 70 -2.272 -0.133 14.146 1.00 0.00 O ATOM 0 H GLU B 70 1.978 -3.169 12.754 1.00 0.00 H new ATOM 0 HA GLU B 70 2.060 -0.450 11.637 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -0.096 -1.604 11.948 1.00 0.00 H new ATOM 0 HB3 GLU B 70 0.250 -1.884 13.643 1.00 0.00 H new ATOM 0 HG2 GLU B 70 0.152 0.486 14.161 1.00 0.00 H new ATOM 0 HG3 GLU B 70 0.203 0.934 12.467 1.00 0.00 H new ATOM 2338 N ASN B 71 2.999 -1.111 14.686 1.00 0.00 N ATOM 2339 CA ASN B 71 3.668 -0.502 15.874 1.00 0.00 C ATOM 2340 C ASN B 71 5.087 -0.054 15.511 1.00 0.00 C ATOM 2341 O ASN B 71 5.577 0.934 16.017 1.00 0.00 O ATOM 2342 CB ASN B 71 3.732 -1.538 16.995 1.00 0.00 C ATOM 2343 CG ASN B 71 4.142 -0.848 18.299 1.00 0.00 C ATOM 2344 OD1 ASN B 71 4.865 0.129 18.296 1.00 0.00 O ATOM 2345 ND2 ASN B 71 3.702 -1.322 19.432 1.00 0.00 N ATOM 0 H ASN B 71 2.907 -2.127 14.706 1.00 0.00 H new ATOM 0 HA ASN B 71 3.098 0.367 16.201 1.00 0.00 H new ATOM 0 HB2 ASN B 71 2.762 -2.021 17.115 1.00 0.00 H new ATOM 0 HB3 ASN B 71 4.449 -2.320 16.743 1.00 0.00 H new ATOM 0 HD21 ASN B 71 3.965 -0.873 20.309 1.00 0.00 H new ATOM 0 HD22 ASN B 71 3.095 -2.142 19.441 1.00 0.00 H new ATOM 2352 N SER B 72 5.716 -0.794 14.638 1.00 0.00 N ATOM 2353 CA SER B 72 7.104 -0.425 14.230 1.00 0.00 C ATOM 2354 C SER B 72 7.087 0.870 13.411 1.00 0.00 C ATOM 2355 O SER B 72 7.647 1.832 13.909 1.00 0.00 O ATOM 2356 CB SER B 72 7.693 -1.554 13.386 1.00 0.00 C ATOM 2357 OG SER B 72 8.988 -1.088 13.038 1.00 0.00 O ATOM 2358 OXT SER B 72 6.516 0.822 12.334 1.00 0.00 O ATOM 0 H SER B 72 5.335 -1.629 14.193 1.00 0.00 H new ATOM 0 HA SER B 72 7.712 -0.270 15.121 1.00 0.00 H new ATOM 0 HB2 SER B 72 7.743 -2.487 13.947 1.00 0.00 H new ATOM 0 HB3 SER B 72 7.088 -1.747 12.500 1.00 0.00 H new ATOM 0 HG SER B 72 9.442 -1.762 12.490 1.00 0.00 H new