USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1018 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 46 MET CE :methyl -143:sc= -0.0776 (180deg=-0.544) USER MOD Single : A 57 THR OG1 : rot -85:sc= 1.27 USER MOD Single : A 60 LYS NZ :NH3+ -120:sc= 0.08 (180deg=-0.263) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc=-0.00544 K(o=-0.0054,f=1.1) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 160:sc= -0.159 (180deg=-0.551) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -156:sc= -0.128 (180deg=-0.67) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 164:sc= -0.0387 (180deg=-0.28) USER MOD Single : A 85 LYS NZ :NH3+ -141:sc= 0 (180deg=-1.34!) USER MOD Single : A 86 LYS NZ :NH3+ -164:sc= -0.0413 (180deg=-0.301) USER MOD Single : A 91 MET CE :methyl -157:sc= -0.772 (180deg=-1.11) USER MOD Single : A 96 ASN : amide:sc= 0.998 K(o=1,f=0) USER MOD Single : B 46 MET CE :methyl -143:sc= -0.113 (180deg=-0.585) USER MOD Single : B 57 THR OG1 : rot -71:sc= 1.28 USER MOD Single : B 60 LYS NZ :NH3+ -121:sc= 0.0942 (180deg=-0.239) USER MOD Single : B 62 SER OG : rot 180:sc=0.000643 USER MOD Single : B 67 ASN : amide:sc=-0.00779 K(o=-0.0078,f=1.2) USER MOD Single : B 71 SER OG : rot 180:sc= 0 USER MOD Single : B 74 LYS NZ :NH3+ 166:sc= -0.141 (180deg=-0.558) USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 MET CE :methyl -125:sc= -0.0876 (180deg=-0.661) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 163:sc= -0.0427 (180deg=-0.332) USER MOD Single : B 85 LYS NZ :NH3+ -142:sc= 0 (180deg=-1.24!) USER MOD Single : B 86 LYS NZ :NH3+ -164:sc= -0.0587 (180deg=-0.338) USER MOD Single : B 91 MET CE :methyl -170:sc= -0.817 (180deg=-1.11) USER MOD Single : B 96 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 100 N GLY A 42 9.875 -11.152 -7.809 1.00 0.00 N ATOM 101 CA GLY A 42 9.214 -9.887 -7.581 1.00 0.00 C ATOM 102 C GLY A 42 10.139 -8.717 -7.838 1.00 0.00 C ATOM 103 O GLY A 42 11.161 -8.580 -7.157 1.00 0.00 O ATOM 0 HA2 GLY A 42 8.342 -9.810 -8.230 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.852 -9.846 -6.554 1.00 0.00 H new ATOM 107 N PRO A 43 9.829 -7.877 -8.840 1.00 0.00 N ATOM 108 CA PRO A 43 10.604 -6.669 -9.132 1.00 0.00 C ATOM 109 C PRO A 43 10.523 -5.659 -7.994 1.00 0.00 C ATOM 110 O PRO A 43 9.654 -5.781 -7.132 1.00 0.00 O ATOM 111 CB PRO A 43 9.946 -6.101 -10.396 1.00 0.00 C ATOM 112 CG PRO A 43 9.149 -7.226 -10.958 1.00 0.00 C ATOM 113 CD PRO A 43 8.711 -8.042 -9.780 1.00 0.00 C ATOM 0 HA PRO A 43 11.664 -6.887 -9.260 1.00 0.00 H new ATOM 0 HB2 PRO A 43 9.311 -5.247 -10.160 1.00 0.00 H new ATOM 0 HB3 PRO A 43 10.695 -5.754 -11.108 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.291 -6.856 -11.519 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.746 -7.823 -11.647 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.773 -7.678 -9.361 1.00 0.00 H new ATOM 0 HD3 PRO A 43 8.557 -9.088 -10.046 1.00 0.00 H new ATOM 121 N ILE A 44 11.398 -4.665 -7.983 1.00 0.00 N ATOM 122 CA ILE A 44 11.488 -3.757 -6.841 1.00 0.00 C ATOM 123 C ILE A 44 10.152 -3.062 -6.538 1.00 0.00 C ATOM 124 O ILE A 44 9.808 -2.855 -5.370 1.00 0.00 O ATOM 125 CB ILE A 44 12.619 -2.722 -7.017 1.00 0.00 C ATOM 126 CG1 ILE A 44 12.437 -1.907 -8.301 1.00 0.00 C ATOM 127 CG2 ILE A 44 13.971 -3.426 -7.015 1.00 0.00 C ATOM 128 CD1 ILE A 44 13.603 -0.992 -8.611 1.00 0.00 C ATOM 0 H ILE A 44 12.051 -4.465 -8.741 1.00 0.00 H new ATOM 0 HA ILE A 44 11.733 -4.377 -5.979 1.00 0.00 H new ATOM 0 HB ILE A 44 12.578 -2.026 -6.179 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.291 -2.591 -9.137 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.530 -1.309 -8.216 1.00 0.00 H new ATOM 0 HG21 ILE A 44 14.765 -2.690 -7.140 1.00 0.00 H new ATOM 0 HG22 ILE A 44 14.107 -3.950 -6.069 1.00 0.00 H new ATOM 0 HG23 ILE A 44 14.009 -4.143 -7.835 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.403 -0.447 -9.534 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.737 -0.284 -7.793 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.510 -1.585 -8.729 1.00 0.00 H new ATOM 140 N ARG A 45 9.379 -2.747 -7.580 1.00 0.00 N ATOM 141 CA ARG A 45 8.049 -2.162 -7.388 1.00 0.00 C ATOM 142 C ARG A 45 7.152 -3.134 -6.624 1.00 0.00 C ATOM 143 O ARG A 45 6.506 -2.767 -5.639 1.00 0.00 O ATOM 144 CB ARG A 45 7.386 -1.804 -8.727 1.00 0.00 C ATOM 145 CG ARG A 45 7.915 -0.536 -9.389 1.00 0.00 C ATOM 146 CD ARG A 45 9.293 -0.736 -9.995 1.00 0.00 C ATOM 147 NE ARG A 45 9.290 -1.778 -11.019 1.00 0.00 N ATOM 148 CZ ARG A 45 10.285 -1.986 -11.878 1.00 0.00 C ATOM 149 NH1 ARG A 45 11.343 -1.183 -11.889 1.00 0.00 N ATOM 150 NH2 ARG A 45 10.202 -2.980 -12.754 1.00 0.00 N ATOM 0 H ARG A 45 9.646 -2.885 -8.555 1.00 0.00 H new ATOM 0 HA ARG A 45 8.176 -1.244 -6.814 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.519 -2.638 -9.416 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.314 -1.692 -8.566 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.221 -0.218 -10.167 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.957 0.266 -8.652 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.637 0.201 -10.432 1.00 0.00 H new ATOM 0 HD3 ARG A 45 10.001 -1.001 -9.209 1.00 0.00 H new ATOM 0 HE ARG A 45 8.473 -2.385 -11.079 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.397 -0.401 -11.236 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.102 -1.348 -12.550 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.378 -3.581 -12.767 1.00 0.00 H new ATOM 0 HH22 ARG A 45 10.962 -3.143 -13.414 1.00 0.00 H new ATOM 164 N MET A 46 7.135 -4.380 -7.082 1.00 0.00 N ATOM 165 CA MET A 46 6.342 -5.425 -6.451 1.00 0.00 C ATOM 166 C MET A 46 6.815 -5.673 -5.020 1.00 0.00 C ATOM 167 O MET A 46 6.014 -5.990 -4.145 1.00 0.00 O ATOM 168 CB MET A 46 6.427 -6.718 -7.266 1.00 0.00 C ATOM 169 CG MET A 46 5.569 -7.847 -6.718 1.00 0.00 C ATOM 170 SD MET A 46 5.640 -9.340 -7.729 1.00 0.00 S ATOM 171 CE MET A 46 4.882 -8.763 -9.247 1.00 0.00 C ATOM 0 H MET A 46 7.666 -4.692 -7.895 1.00 0.00 H new ATOM 0 HA MET A 46 5.304 -5.095 -6.418 1.00 0.00 H new ATOM 0 HB2 MET A 46 6.125 -6.510 -8.292 1.00 0.00 H new ATOM 0 HB3 MET A 46 7.466 -7.047 -7.300 1.00 0.00 H new ATOM 0 HG2 MET A 46 5.894 -8.085 -5.705 1.00 0.00 H new ATOM 0 HG3 MET A 46 4.535 -7.510 -6.650 1.00 0.00 H new ATOM 0 HE1 MET A 46 4.273 -9.559 -9.675 1.00 0.00 H new ATOM 0 HE2 MET A 46 4.252 -7.900 -9.034 1.00 0.00 H new ATOM 0 HE3 MET A 46 5.659 -8.479 -9.956 1.00 0.00 H new ATOM 181 N VAL A 47 8.116 -5.516 -4.789 1.00 0.00 N ATOM 182 CA VAL A 47 8.688 -5.686 -3.456 1.00 0.00 C ATOM 183 C VAL A 47 8.059 -4.710 -2.468 1.00 0.00 C ATOM 184 O VAL A 47 7.669 -5.102 -1.371 1.00 0.00 O ATOM 185 CB VAL A 47 10.222 -5.498 -3.459 1.00 0.00 C ATOM 186 CG1 VAL A 47 10.795 -5.638 -2.055 1.00 0.00 C ATOM 187 CG2 VAL A 47 10.875 -6.499 -4.398 1.00 0.00 C ATOM 0 H VAL A 47 8.795 -5.271 -5.509 1.00 0.00 H new ATOM 0 HA VAL A 47 8.469 -6.708 -3.146 1.00 0.00 H new ATOM 0 HB VAL A 47 10.438 -4.490 -3.813 1.00 0.00 H new ATOM 0 HG11 VAL A 47 11.876 -5.501 -2.088 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.353 -4.883 -1.405 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.567 -6.630 -1.666 1.00 0.00 H new ATOM 0 HG21 VAL A 47 11.955 -6.355 -4.390 1.00 0.00 H new ATOM 0 HG22 VAL A 47 10.642 -7.512 -4.069 1.00 0.00 H new ATOM 0 HG23 VAL A 47 10.497 -6.350 -5.409 1.00 0.00 H new ATOM 197 N LEU A 48 7.944 -3.446 -2.865 1.00 0.00 N ATOM 198 CA LEU A 48 7.311 -2.438 -2.015 1.00 0.00 C ATOM 199 C LEU A 48 5.830 -2.743 -1.818 1.00 0.00 C ATOM 200 O LEU A 48 5.260 -2.448 -0.766 1.00 0.00 O ATOM 201 CB LEU A 48 7.487 -1.028 -2.593 1.00 0.00 C ATOM 202 CG LEU A 48 8.758 -0.292 -2.149 1.00 0.00 C ATOM 203 CD1 LEU A 48 10.004 -1.003 -2.647 1.00 0.00 C ATOM 204 CD2 LEU A 48 8.735 1.148 -2.635 1.00 0.00 C ATOM 0 H LEU A 48 8.278 -3.095 -3.763 1.00 0.00 H new ATOM 0 HA LEU A 48 7.807 -2.473 -1.045 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.488 -1.096 -3.681 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.622 -0.427 -2.312 1.00 0.00 H new ATOM 0 HG LEU A 48 8.785 -0.291 -1.059 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.889 -0.459 -2.318 1.00 0.00 H new ATOM 0 HD12 LEU A 48 10.030 -2.016 -2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.988 -1.045 -3.736 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.644 1.656 -2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.678 1.164 -3.723 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.866 1.659 -2.219 1.00 0.00 H new ATOM 216 N ALA A 49 5.211 -3.341 -2.828 1.00 0.00 N ATOM 217 CA ALA A 49 3.817 -3.752 -2.728 1.00 0.00 C ATOM 218 C ALA A 49 3.657 -4.884 -1.713 1.00 0.00 C ATOM 219 O ALA A 49 2.760 -4.852 -0.868 1.00 0.00 O ATOM 220 CB ALA A 49 3.290 -4.175 -4.089 1.00 0.00 C ATOM 0 H ALA A 49 5.651 -3.552 -3.724 1.00 0.00 H new ATOM 0 HA ALA A 49 3.232 -2.900 -2.381 1.00 0.00 H new ATOM 0 HB1 ALA A 49 2.247 -4.479 -3.997 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.364 -3.338 -4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 49 3.880 -5.011 -4.464 1.00 0.00 H new ATOM 226 N ILE A 50 4.539 -5.878 -1.796 1.00 0.00 N ATOM 227 CA ILE A 50 4.538 -6.986 -0.846 1.00 0.00 C ATOM 228 C ILE A 50 4.903 -6.473 0.544 1.00 0.00 C ATOM 229 O ILE A 50 4.385 -6.948 1.557 1.00 0.00 O ATOM 230 CB ILE A 50 5.532 -8.099 -1.256 1.00 0.00 C ATOM 231 CG1 ILE A 50 5.254 -8.572 -2.687 1.00 0.00 C ATOM 232 CG2 ILE A 50 5.444 -9.272 -0.286 1.00 0.00 C ATOM 233 CD1 ILE A 50 6.245 -9.598 -3.195 1.00 0.00 C ATOM 0 H ILE A 50 5.263 -5.938 -2.512 1.00 0.00 H new ATOM 0 HA ILE A 50 3.535 -7.414 -0.840 1.00 0.00 H new ATOM 0 HB ILE A 50 6.541 -7.688 -1.219 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.251 -8.997 -2.731 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.265 -7.709 -3.353 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.149 -10.047 -0.587 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.688 -8.931 0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.432 -9.678 -0.297 1.00 0.00 H new ATOM 0 HD11 ILE A 50 5.983 -9.884 -4.214 1.00 0.00 H new ATOM 0 HD12 ILE A 50 7.248 -9.171 -3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 50 6.219 -10.478 -2.553 1.00 0.00 H new ATOM 245 N LEU A 51 5.798 -5.495 0.572 1.00 0.00 N ATOM 246 CA LEU A 51 6.188 -4.832 1.805 1.00 0.00 C ATOM 247 C LEU A 51 4.972 -4.238 2.498 1.00 0.00 C ATOM 248 O LEU A 51 4.707 -4.542 3.657 1.00 0.00 O ATOM 249 CB LEU A 51 7.192 -3.721 1.509 1.00 0.00 C ATOM 250 CG LEU A 51 7.603 -2.884 2.716 1.00 0.00 C ATOM 251 CD1 LEU A 51 8.748 -3.545 3.469 1.00 0.00 C ATOM 252 CD2 LEU A 51 7.971 -1.479 2.277 1.00 0.00 C ATOM 0 H LEU A 51 6.272 -5.141 -0.259 1.00 0.00 H new ATOM 0 HA LEU A 51 6.647 -5.572 2.461 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.086 -4.167 1.074 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.766 -3.059 0.755 1.00 0.00 H new ATOM 0 HG LEU A 51 6.756 -2.817 3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.024 -2.930 4.325 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.435 -4.530 3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.607 -3.650 2.806 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.263 -0.891 3.147 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.803 -1.524 1.574 1.00 0.00 H new ATOM 0 HD23 LEU A 51 7.112 -1.012 1.794 1.00 0.00 H new ATOM 264 N ALA A 52 4.232 -3.400 1.771 1.00 0.00 N ATOM 265 CA ALA A 52 3.039 -2.751 2.307 1.00 0.00 C ATOM 266 C ALA A 52 2.040 -3.787 2.807 1.00 0.00 C ATOM 267 O ALA A 52 1.366 -3.586 3.818 1.00 0.00 O ATOM 268 CB ALA A 52 2.396 -1.863 1.253 1.00 0.00 C ATOM 0 H ALA A 52 4.441 -3.155 0.803 1.00 0.00 H new ATOM 0 HA ALA A 52 3.340 -2.129 3.150 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.508 -1.387 1.670 1.00 0.00 H new ATOM 0 HB2 ALA A 52 3.105 -1.097 0.941 1.00 0.00 H new ATOM 0 HB3 ALA A 52 2.113 -2.468 0.391 1.00 0.00 H new ATOM 274 N PHE A 53 1.968 -4.902 2.099 1.00 0.00 N ATOM 275 CA PHE A 53 1.115 -6.011 2.492 1.00 0.00 C ATOM 276 C PHE A 53 1.528 -6.521 3.868 1.00 0.00 C ATOM 277 O PHE A 53 0.742 -6.498 4.810 1.00 0.00 O ATOM 278 CB PHE A 53 1.206 -7.129 1.448 1.00 0.00 C ATOM 279 CG PHE A 53 0.377 -8.344 1.763 1.00 0.00 C ATOM 280 CD1 PHE A 53 0.958 -9.466 2.332 1.00 0.00 C ATOM 281 CD2 PHE A 53 -0.979 -8.366 1.482 1.00 0.00 C ATOM 282 CE1 PHE A 53 0.202 -10.586 2.616 1.00 0.00 C ATOM 283 CE2 PHE A 53 -1.740 -9.483 1.763 1.00 0.00 C ATOM 284 CZ PHE A 53 -1.149 -10.595 2.330 1.00 0.00 C ATOM 0 H PHE A 53 2.496 -5.063 1.241 1.00 0.00 H new ATOM 0 HA PHE A 53 0.081 -5.672 2.547 1.00 0.00 H new ATOM 0 HB2 PHE A 53 0.895 -6.733 0.481 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.248 -7.432 1.348 1.00 0.00 H new ATOM 0 HD1 PHE A 53 2.015 -9.464 2.556 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -1.446 -7.499 1.038 1.00 0.00 H new ATOM 0 HE1 PHE A 53 0.666 -11.454 3.061 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -2.797 -9.487 1.540 1.00 0.00 H new ATOM 0 HZ PHE A 53 -1.742 -11.470 2.549 1.00 0.00 H new ATOM 294 N LEU A 54 2.784 -6.931 3.987 1.00 0.00 N ATOM 295 CA LEU A 54 3.320 -7.461 5.242 1.00 0.00 C ATOM 296 C LEU A 54 3.457 -6.371 6.295 1.00 0.00 C ATOM 297 O LEU A 54 3.778 -6.645 7.449 1.00 0.00 O ATOM 298 CB LEU A 54 4.684 -8.115 5.001 1.00 0.00 C ATOM 299 CG LEU A 54 4.693 -9.275 4.002 1.00 0.00 C ATOM 300 CD1 LEU A 54 6.115 -9.761 3.768 1.00 0.00 C ATOM 301 CD2 LEU A 54 3.818 -10.417 4.498 1.00 0.00 C ATOM 0 H LEU A 54 3.460 -6.908 3.223 1.00 0.00 H new ATOM 0 HA LEU A 54 2.616 -8.207 5.611 1.00 0.00 H new ATOM 0 HB2 LEU A 54 5.377 -7.350 4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.067 -8.477 5.955 1.00 0.00 H new ATOM 0 HG LEU A 54 4.287 -8.917 3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 54 6.105 -10.586 3.056 1.00 0.00 H new ATOM 0 HD12 LEU A 54 6.718 -8.945 3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 54 6.543 -10.101 4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 54 3.838 -11.232 3.774 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.195 -10.774 5.456 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.794 -10.064 4.619 1.00 0.00 H new ATOM 313 N ARG A 55 3.211 -5.140 5.895 1.00 0.00 N ATOM 314 CA ARG A 55 3.326 -4.020 6.771 1.00 0.00 C ATOM 315 C ARG A 55 1.985 -3.707 7.434 1.00 0.00 C ATOM 316 O ARG A 55 1.933 -3.320 8.602 1.00 0.00 O ATOM 317 CB ARG A 55 3.821 -2.834 5.957 1.00 0.00 C ATOM 318 CG ARG A 55 3.782 -1.554 6.721 1.00 0.00 C ATOM 319 CD ARG A 55 4.637 -1.636 7.968 1.00 0.00 C ATOM 320 NE ARG A 55 4.594 -0.388 8.724 1.00 0.00 N ATOM 321 CZ ARG A 55 4.895 -0.279 10.012 1.00 0.00 C ATOM 322 NH1 ARG A 55 5.321 -1.336 10.691 1.00 0.00 N ATOM 323 NH2 ARG A 55 4.778 0.895 10.619 1.00 0.00 N ATOM 0 H ARG A 55 2.925 -4.900 4.946 1.00 0.00 H new ATOM 0 HA ARG A 55 4.033 -4.243 7.570 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.843 -3.025 5.629 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.211 -2.735 5.059 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.133 -0.739 6.089 1.00 0.00 H new ATOM 0 HG3 ARG A 55 2.753 -1.323 6.997 1.00 0.00 H new ATOM 0 HD2 ARG A 55 4.290 -2.456 8.596 1.00 0.00 H new ATOM 0 HD3 ARG A 55 5.667 -1.861 7.691 1.00 0.00 H new ATOM 0 HE ARG A 55 4.313 0.458 8.228 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.418 -2.237 10.223 1.00 0.00 H new ATOM 0 HH12 ARG A 55 5.551 -1.247 11.681 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.458 1.710 10.096 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.008 0.983 11.609 1.00 0.00 H new ATOM 337 N PHE A 56 0.902 -3.879 6.690 1.00 0.00 N ATOM 338 CA PHE A 56 -0.422 -3.551 7.201 1.00 0.00 C ATOM 339 C PHE A 56 -1.213 -4.798 7.594 1.00 0.00 C ATOM 340 O PHE A 56 -2.114 -4.724 8.428 1.00 0.00 O ATOM 341 CB PHE A 56 -1.197 -2.720 6.178 1.00 0.00 C ATOM 342 CG PHE A 56 -0.680 -1.314 6.042 1.00 0.00 C ATOM 343 CD1 PHE A 56 0.332 -1.014 5.144 1.00 0.00 C ATOM 344 CD2 PHE A 56 -1.201 -0.295 6.822 1.00 0.00 C ATOM 345 CE1 PHE A 56 0.814 0.275 5.026 1.00 0.00 C ATOM 346 CE2 PHE A 56 -0.724 0.997 6.707 1.00 0.00 C ATOM 347 CZ PHE A 56 0.285 1.282 5.808 1.00 0.00 C ATOM 0 H PHE A 56 0.913 -4.241 5.737 1.00 0.00 H new ATOM 0 HA PHE A 56 -0.285 -2.960 8.107 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -1.149 -3.213 5.207 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -2.247 -2.687 6.467 1.00 0.00 H new ATOM 0 HD1 PHE A 56 0.749 -1.798 4.529 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.989 -0.512 7.528 1.00 0.00 H new ATOM 0 HE1 PHE A 56 1.604 0.495 4.323 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.140 1.783 7.320 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.659 2.291 5.717 1.00 0.00 H new ATOM 357 N THR A 57 -0.878 -5.941 7.011 1.00 0.00 N ATOM 358 CA THR A 57 -1.565 -7.181 7.349 1.00 0.00 C ATOM 359 C THR A 57 -0.864 -7.865 8.514 1.00 0.00 C ATOM 360 O THR A 57 -1.483 -8.587 9.298 1.00 0.00 O ATOM 361 CB THR A 57 -1.625 -8.160 6.153 1.00 0.00 C ATOM 362 OG1 THR A 57 -0.312 -8.635 5.836 1.00 0.00 O ATOM 363 CG2 THR A 57 -2.217 -7.488 4.925 1.00 0.00 C ATOM 0 H THR A 57 -0.144 -6.036 6.310 1.00 0.00 H new ATOM 0 HA THR A 57 -2.586 -6.916 7.623 1.00 0.00 H new ATOM 0 HB THR A 57 -2.262 -8.996 6.441 1.00 0.00 H new ATOM 0 HG1 THR A 57 0.131 -7.998 5.237 1.00 0.00 H new ATOM 0 HG21 THR A 57 -2.247 -8.199 4.100 1.00 0.00 H new ATOM 0 HG22 THR A 57 -3.228 -7.148 5.148 1.00 0.00 H new ATOM 0 HG23 THR A 57 -1.601 -6.634 4.645 1.00 0.00 H new ATOM 371 N ALA A 58 0.430 -7.604 8.634 1.00 0.00 N ATOM 372 CA ALA A 58 1.257 -8.263 9.624 1.00 0.00 C ATOM 373 C ALA A 58 2.166 -7.263 10.323 1.00 0.00 C ATOM 374 O ALA A 58 2.127 -6.064 10.042 1.00 0.00 O ATOM 375 CB ALA A 58 2.088 -9.349 8.958 1.00 0.00 C ATOM 0 H ALA A 58 0.930 -6.933 8.050 1.00 0.00 H new ATOM 0 HA ALA A 58 0.608 -8.714 10.374 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.709 -9.842 9.706 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.426 -10.081 8.495 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.725 -8.903 8.195 1.00 0.00 H new ATOM 381 N ILE A 59 2.974 -7.762 11.244 1.00 0.00 N ATOM 382 CA ILE A 59 3.949 -6.940 11.937 1.00 0.00 C ATOM 383 C ILE A 59 5.348 -7.480 11.674 1.00 0.00 C ATOM 384 O ILE A 59 5.588 -8.680 11.829 1.00 0.00 O ATOM 385 CB ILE A 59 3.687 -6.904 13.459 1.00 0.00 C ATOM 386 CG1 ILE A 59 2.264 -6.414 13.745 1.00 0.00 C ATOM 387 CG2 ILE A 59 4.708 -6.011 14.154 1.00 0.00 C ATOM 388 CD1 ILE A 59 1.893 -6.441 15.213 1.00 0.00 C ATOM 0 H ILE A 59 2.972 -8.741 11.530 1.00 0.00 H new ATOM 0 HA ILE A 59 3.861 -5.922 11.557 1.00 0.00 H new ATOM 0 HB ILE A 59 3.789 -7.916 13.852 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.158 -5.395 13.372 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.558 -7.032 13.190 1.00 0.00 H new ATOM 0 HG21 ILE A 59 4.509 -5.997 15.226 1.00 0.00 H new ATOM 0 HG22 ILE A 59 5.711 -6.399 13.976 1.00 0.00 H new ATOM 0 HG23 ILE A 59 4.635 -4.998 13.758 1.00 0.00 H new ATOM 0 HD11 ILE A 59 0.872 -6.080 15.337 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.965 -7.462 15.588 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.575 -5.800 15.772 1.00 0.00 H new ATOM 400 N LYS A 60 6.250 -6.588 11.269 1.00 0.00 N ATOM 401 CA LYS A 60 7.630 -6.942 10.941 1.00 0.00 C ATOM 402 C LYS A 60 7.687 -7.820 9.691 1.00 0.00 C ATOM 403 O LYS A 60 7.584 -9.046 9.773 1.00 0.00 O ATOM 404 CB LYS A 60 8.319 -7.642 12.120 1.00 0.00 C ATOM 405 CG LYS A 60 9.786 -7.951 11.869 1.00 0.00 C ATOM 406 CD LYS A 60 10.614 -6.682 11.758 1.00 0.00 C ATOM 407 CE LYS A 60 12.034 -6.981 11.309 1.00 0.00 C ATOM 408 NZ LYS A 60 12.078 -7.490 9.910 1.00 0.00 N ATOM 0 H LYS A 60 6.044 -5.595 11.159 1.00 0.00 H new ATOM 0 HA LYS A 60 8.167 -6.016 10.736 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.235 -7.012 13.006 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.793 -8.571 12.339 1.00 0.00 H new ATOM 0 HG2 LYS A 60 10.172 -8.568 12.680 1.00 0.00 H new ATOM 0 HG3 LYS A 60 9.884 -8.532 10.952 1.00 0.00 H new ATOM 0 HD2 LYS A 60 10.143 -6.000 11.050 1.00 0.00 H new ATOM 0 HD3 LYS A 60 10.635 -6.175 12.723 1.00 0.00 H new ATOM 0 HE2 LYS A 60 12.637 -6.076 11.385 1.00 0.00 H new ATOM 0 HE3 LYS A 60 12.479 -7.718 11.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.499 -8.441 9.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.112 -7.535 9.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 12.653 -6.850 9.326 1.00 0.00 H new ATOM 422 N PRO A 61 7.844 -7.192 8.513 1.00 0.00 N ATOM 423 CA PRO A 61 7.947 -7.905 7.234 1.00 0.00 C ATOM 424 C PRO A 61 9.139 -8.859 7.195 1.00 0.00 C ATOM 425 O PRO A 61 10.164 -8.626 7.848 1.00 0.00 O ATOM 426 CB PRO A 61 8.134 -6.782 6.205 1.00 0.00 C ATOM 427 CG PRO A 61 7.625 -5.554 6.875 1.00 0.00 C ATOM 428 CD PRO A 61 7.922 -5.733 8.334 1.00 0.00 C ATOM 0 HA PRO A 61 7.072 -8.528 7.050 1.00 0.00 H new ATOM 0 HB2 PRO A 61 9.182 -6.673 5.926 1.00 0.00 H new ATOM 0 HB3 PRO A 61 7.580 -6.990 5.289 1.00 0.00 H new ATOM 0 HG2 PRO A 61 8.115 -4.663 6.483 1.00 0.00 H new ATOM 0 HG3 PRO A 61 6.555 -5.431 6.706 1.00 0.00 H new ATOM 0 HD2 PRO A 61 8.907 -5.347 8.595 1.00 0.00 H new ATOM 0 HD3 PRO A 61 7.198 -5.211 8.960 1.00 0.00 H new ATOM 436 N SER A 62 8.987 -9.933 6.423 1.00 0.00 N ATOM 437 CA SER A 62 10.013 -10.958 6.293 1.00 0.00 C ATOM 438 C SER A 62 11.314 -10.374 5.744 1.00 0.00 C ATOM 439 O SER A 62 11.309 -9.497 4.873 1.00 0.00 O ATOM 440 CB SER A 62 9.510 -12.071 5.372 1.00 0.00 C ATOM 441 OG SER A 62 8.245 -12.553 5.794 1.00 0.00 O ATOM 0 H SER A 62 8.148 -10.115 5.871 1.00 0.00 H new ATOM 0 HA SER A 62 10.220 -11.365 7.283 1.00 0.00 H new ATOM 0 HB2 SER A 62 9.437 -11.697 4.351 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.229 -12.890 5.361 1.00 0.00 H new ATOM 0 HG SER A 62 7.946 -13.262 5.187 1.00 0.00 H new ATOM 447 N LEU A 63 12.426 -10.891 6.263 1.00 0.00 N ATOM 448 CA LEU A 63 13.756 -10.360 5.981 1.00 0.00 C ATOM 449 C LEU A 63 14.105 -10.408 4.500 1.00 0.00 C ATOM 450 O LEU A 63 14.887 -9.593 4.031 1.00 0.00 O ATOM 451 CB LEU A 63 14.813 -11.121 6.782 1.00 0.00 C ATOM 452 CG LEU A 63 14.719 -10.964 8.301 1.00 0.00 C ATOM 453 CD1 LEU A 63 15.764 -11.823 8.993 1.00 0.00 C ATOM 454 CD2 LEU A 63 14.882 -9.505 8.698 1.00 0.00 C ATOM 0 H LEU A 63 12.429 -11.693 6.893 1.00 0.00 H new ATOM 0 HA LEU A 63 13.745 -9.312 6.281 1.00 0.00 H new ATOM 0 HB2 LEU A 63 14.738 -12.180 6.537 1.00 0.00 H new ATOM 0 HB3 LEU A 63 15.799 -10.788 6.459 1.00 0.00 H new ATOM 0 HG LEU A 63 13.732 -11.300 8.619 1.00 0.00 H new ATOM 0 HD11 LEU A 63 15.681 -11.698 10.073 1.00 0.00 H new ATOM 0 HD12 LEU A 63 15.603 -12.870 8.736 1.00 0.00 H new ATOM 0 HD13 LEU A 63 16.759 -11.518 8.668 1.00 0.00 H new ATOM 0 HD21 LEU A 63 14.812 -9.413 9.782 1.00 0.00 H new ATOM 0 HD22 LEU A 63 15.855 -9.144 8.365 1.00 0.00 H new ATOM 0 HD23 LEU A 63 14.096 -8.911 8.232 1.00 0.00 H new ATOM 466 N GLY A 64 13.537 -11.359 3.770 1.00 0.00 N ATOM 467 CA GLY A 64 13.793 -11.441 2.342 1.00 0.00 C ATOM 468 C GLY A 64 13.335 -10.194 1.619 1.00 0.00 C ATOM 469 O GLY A 64 14.045 -9.658 0.760 1.00 0.00 O ATOM 0 H GLY A 64 12.907 -12.072 4.137 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.859 -11.590 2.171 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.280 -12.310 1.930 1.00 0.00 H new ATOM 473 N LEU A 65 12.152 -9.719 1.981 1.00 0.00 N ATOM 474 CA LEU A 65 11.622 -8.490 1.422 1.00 0.00 C ATOM 475 C LEU A 65 12.452 -7.309 1.892 1.00 0.00 C ATOM 476 O LEU A 65 12.719 -6.397 1.127 1.00 0.00 O ATOM 477 CB LEU A 65 10.153 -8.290 1.817 1.00 0.00 C ATOM 478 CG LEU A 65 9.128 -9.157 1.069 1.00 0.00 C ATOM 479 CD1 LEU A 65 9.237 -8.947 -0.434 1.00 0.00 C ATOM 480 CD2 LEU A 65 9.288 -10.629 1.418 1.00 0.00 C ATOM 0 H LEU A 65 11.541 -10.170 2.662 1.00 0.00 H new ATOM 0 HA LEU A 65 11.674 -8.560 0.335 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.055 -8.487 2.885 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.895 -7.242 1.661 1.00 0.00 H new ATOM 0 HG LEU A 65 8.134 -8.844 1.389 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.502 -9.571 -0.943 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.049 -7.899 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.238 -9.220 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.548 -11.215 0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 65 10.289 -10.961 1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.142 -10.767 2.489 1.00 0.00 H new ATOM 492 N ILE A 66 12.878 -7.356 3.151 1.00 0.00 N ATOM 493 CA ILE A 66 13.682 -6.286 3.740 1.00 0.00 C ATOM 494 C ILE A 66 15.064 -6.203 3.086 1.00 0.00 C ATOM 495 O ILE A 66 15.601 -5.113 2.871 1.00 0.00 O ATOM 496 CB ILE A 66 13.841 -6.492 5.263 1.00 0.00 C ATOM 497 CG1 ILE A 66 12.466 -6.547 5.933 1.00 0.00 C ATOM 498 CG2 ILE A 66 14.691 -5.386 5.878 1.00 0.00 C ATOM 499 CD1 ILE A 66 11.643 -5.285 5.752 1.00 0.00 C ATOM 0 H ILE A 66 12.679 -8.128 3.787 1.00 0.00 H new ATOM 0 HA ILE A 66 13.155 -5.349 3.560 1.00 0.00 H new ATOM 0 HB ILE A 66 14.352 -7.440 5.430 1.00 0.00 H new ATOM 0 HG12 ILE A 66 11.910 -7.393 5.529 1.00 0.00 H new ATOM 0 HG13 ILE A 66 12.599 -6.732 6.999 1.00 0.00 H new ATOM 0 HG21 ILE A 66 14.787 -5.555 6.951 1.00 0.00 H new ATOM 0 HG22 ILE A 66 15.680 -5.390 5.420 1.00 0.00 H new ATOM 0 HG23 ILE A 66 14.214 -4.421 5.704 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.683 -5.401 6.255 1.00 0.00 H new ATOM 0 HD12 ILE A 66 12.177 -4.438 6.182 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.477 -5.108 4.689 1.00 0.00 H new ATOM 511 N ASN A 67 15.635 -7.355 2.769 1.00 0.00 N ATOM 512 CA ASN A 67 16.939 -7.405 2.116 1.00 0.00 C ATOM 513 C ASN A 67 16.870 -6.829 0.708 1.00 0.00 C ATOM 514 O ASN A 67 17.793 -6.144 0.267 1.00 0.00 O ATOM 515 CB ASN A 67 17.483 -8.837 2.076 1.00 0.00 C ATOM 516 CG ASN A 67 18.229 -9.219 3.342 1.00 0.00 C ATOM 517 OD1 ASN A 67 17.649 -9.757 4.283 1.00 0.00 O ATOM 518 ND2 ASN A 67 19.524 -8.942 3.373 1.00 0.00 N ATOM 0 H ASN A 67 15.219 -8.268 2.952 1.00 0.00 H new ATOM 0 HA ASN A 67 17.623 -6.794 2.705 1.00 0.00 H new ATOM 0 HB2 ASN A 67 16.656 -9.531 1.924 1.00 0.00 H new ATOM 0 HB3 ASN A 67 18.150 -8.944 1.221 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.076 -9.176 4.198 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.969 -8.495 2.572 1.00 0.00 H new ATOM 525 N ARG A 68 15.776 -7.087 0.001 1.00 0.00 N ATOM 526 CA ARG A 68 15.611 -6.534 -1.339 1.00 0.00 C ATOM 527 C ARG A 68 15.068 -5.109 -1.258 1.00 0.00 C ATOM 528 O ARG A 68 15.201 -4.325 -2.193 1.00 0.00 O ATOM 529 CB ARG A 68 14.690 -7.418 -2.180 1.00 0.00 C ATOM 530 CG ARG A 68 14.677 -7.045 -3.655 1.00 0.00 C ATOM 531 CD ARG A 68 13.957 -8.092 -4.484 1.00 0.00 C ATOM 532 NE ARG A 68 14.567 -9.410 -4.334 1.00 0.00 N ATOM 533 CZ ARG A 68 14.064 -10.531 -4.842 1.00 0.00 C ATOM 534 NH1 ARG A 68 12.958 -10.497 -5.580 1.00 0.00 N ATOM 535 NH2 ARG A 68 14.677 -11.686 -4.619 1.00 0.00 N ATOM 0 H ARG A 68 15.001 -7.666 0.326 1.00 0.00 H new ATOM 0 HA ARG A 68 16.586 -6.506 -1.825 1.00 0.00 H new ATOM 0 HB2 ARG A 68 15.003 -8.457 -2.078 1.00 0.00 H new ATOM 0 HB3 ARG A 68 13.676 -7.351 -1.787 1.00 0.00 H new ATOM 0 HG2 ARG A 68 14.189 -6.079 -3.783 1.00 0.00 H new ATOM 0 HG3 ARG A 68 15.701 -6.936 -4.013 1.00 0.00 H new ATOM 0 HD2 ARG A 68 12.910 -8.139 -4.183 1.00 0.00 H new ATOM 0 HD3 ARG A 68 13.974 -7.800 -5.534 1.00 0.00 H new ATOM 0 HE ARG A 68 15.436 -9.475 -3.805 1.00 0.00 H new ATOM 0 HH11 ARG A 68 12.491 -9.608 -5.759 1.00 0.00 H new ATOM 0 HH12 ARG A 68 12.577 -11.360 -5.967 1.00 0.00 H new ATOM 0 HH21 ARG A 68 15.530 -11.711 -4.060 1.00 0.00 H new ATOM 0 HH22 ARG A 68 14.295 -12.549 -5.006 1.00 0.00 H new ATOM 549 N TRP A 69 14.477 -4.793 -0.118 1.00 0.00 N ATOM 550 CA TRP A 69 13.951 -3.463 0.175 1.00 0.00 C ATOM 551 C TRP A 69 15.061 -2.421 0.078 1.00 0.00 C ATOM 552 O TRP A 69 14.918 -1.401 -0.590 1.00 0.00 O ATOM 553 CB TRP A 69 13.361 -3.494 1.584 1.00 0.00 C ATOM 554 CG TRP A 69 12.507 -2.330 1.965 1.00 0.00 C ATOM 555 CD1 TRP A 69 11.502 -1.765 1.243 1.00 0.00 C ATOM 556 CD2 TRP A 69 12.555 -1.627 3.205 1.00 0.00 C ATOM 557 NE1 TRP A 69 10.924 -0.747 1.962 1.00 0.00 N ATOM 558 CE2 TRP A 69 11.554 -0.645 3.172 1.00 0.00 C ATOM 559 CE3 TRP A 69 13.356 -1.736 4.338 1.00 0.00 C ATOM 560 CZ2 TRP A 69 11.331 0.223 4.237 1.00 0.00 C ATOM 561 CZ3 TRP A 69 13.134 -0.880 5.394 1.00 0.00 C ATOM 562 CH2 TRP A 69 12.125 0.087 5.338 1.00 0.00 C ATOM 0 H TRP A 69 14.345 -5.460 0.643 1.00 0.00 H new ATOM 0 HA TRP A 69 13.181 -3.191 -0.547 1.00 0.00 H new ATOM 0 HB2 TRP A 69 12.768 -4.403 1.688 1.00 0.00 H new ATOM 0 HB3 TRP A 69 14.182 -3.566 2.298 1.00 0.00 H new ATOM 0 HD1 TRP A 69 11.203 -2.071 0.252 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.151 -0.162 1.645 1.00 0.00 H new ATOM 0 HE3 TRP A 69 14.138 -2.479 4.388 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 10.558 0.976 4.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 13.748 -0.957 6.279 1.00 0.00 H new ATOM 0 HH2 TRP A 69 11.971 0.740 6.184 1.00 0.00 H new ATOM 573 N GLY A 70 16.183 -2.709 0.727 1.00 0.00 N ATOM 574 CA GLY A 70 17.334 -1.829 0.657 1.00 0.00 C ATOM 575 C GLY A 70 18.072 -1.947 -0.665 1.00 0.00 C ATOM 576 O GLY A 70 19.014 -1.199 -0.929 1.00 0.00 O ATOM 0 H GLY A 70 16.316 -3.540 1.303 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.009 -0.798 0.798 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.017 -2.063 1.474 1.00 0.00 H new ATOM 580 N SER A 71 17.637 -2.885 -1.495 1.00 0.00 N ATOM 581 CA SER A 71 18.228 -3.088 -2.809 1.00 0.00 C ATOM 582 C SER A 71 17.464 -2.271 -3.852 1.00 0.00 C ATOM 583 O SER A 71 17.961 -2.023 -4.952 1.00 0.00 O ATOM 584 CB SER A 71 18.202 -4.580 -3.167 1.00 0.00 C ATOM 585 OG SER A 71 18.889 -4.849 -4.378 1.00 0.00 O ATOM 0 H SER A 71 16.870 -3.522 -1.278 1.00 0.00 H new ATOM 0 HA SER A 71 19.265 -2.752 -2.795 1.00 0.00 H new ATOM 0 HB2 SER A 71 18.654 -5.154 -2.359 1.00 0.00 H new ATOM 0 HB3 SER A 71 17.168 -4.913 -3.255 1.00 0.00 H new ATOM 0 HG SER A 71 18.851 -5.809 -4.570 1.00 0.00 H new ATOM 591 N VAL A 72 16.255 -1.858 -3.488 1.00 0.00 N ATOM 592 CA VAL A 72 15.427 -1.021 -4.347 1.00 0.00 C ATOM 593 C VAL A 72 16.099 0.325 -4.574 1.00 0.00 C ATOM 594 O VAL A 72 16.636 0.920 -3.636 1.00 0.00 O ATOM 595 CB VAL A 72 14.032 -0.786 -3.717 1.00 0.00 C ATOM 596 CG1 VAL A 72 13.181 0.140 -4.580 1.00 0.00 C ATOM 597 CG2 VAL A 72 13.320 -2.111 -3.485 1.00 0.00 C ATOM 0 H VAL A 72 15.824 -2.093 -2.594 1.00 0.00 H new ATOM 0 HA VAL A 72 15.305 -1.540 -5.298 1.00 0.00 H new ATOM 0 HB VAL A 72 14.179 -0.298 -2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.208 0.284 -4.109 1.00 0.00 H new ATOM 0 HG12 VAL A 72 13.681 1.103 -4.682 1.00 0.00 H new ATOM 0 HG13 VAL A 72 13.045 -0.305 -5.566 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.342 -1.926 -3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.195 -2.628 -4.436 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.912 -2.729 -2.811 1.00 0.00 H new ATOM 607 N GLY A 73 16.097 0.787 -5.821 1.00 0.00 N ATOM 608 CA GLY A 73 16.587 2.107 -6.113 1.00 0.00 C ATOM 609 C GLY A 73 15.825 3.134 -5.319 1.00 0.00 C ATOM 610 O GLY A 73 14.601 3.203 -5.406 1.00 0.00 O ATOM 0 H GLY A 73 15.763 0.264 -6.630 1.00 0.00 H new ATOM 0 HA2 GLY A 73 17.649 2.169 -5.876 1.00 0.00 H new ATOM 0 HA3 GLY A 73 16.486 2.313 -7.179 1.00 0.00 H new ATOM 614 N LYS A 74 16.541 3.910 -4.530 1.00 0.00 N ATOM 615 CA LYS A 74 15.925 4.876 -3.636 1.00 0.00 C ATOM 616 C LYS A 74 15.124 5.892 -4.434 1.00 0.00 C ATOM 617 O LYS A 74 14.053 6.322 -4.014 1.00 0.00 O ATOM 618 CB LYS A 74 17.008 5.553 -2.802 1.00 0.00 C ATOM 619 CG LYS A 74 17.890 4.542 -2.092 1.00 0.00 C ATOM 620 CD LYS A 74 19.111 5.178 -1.463 1.00 0.00 C ATOM 621 CE LYS A 74 20.042 4.115 -0.902 1.00 0.00 C ATOM 622 NZ LYS A 74 20.507 3.173 -1.953 1.00 0.00 N ATOM 0 H LYS A 74 17.560 3.891 -4.489 1.00 0.00 H new ATOM 0 HA LYS A 74 15.236 4.368 -2.962 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.623 6.182 -3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 74 16.543 6.209 -2.066 1.00 0.00 H new ATOM 0 HG2 LYS A 74 17.309 4.037 -1.320 1.00 0.00 H new ATOM 0 HG3 LYS A 74 18.207 3.779 -2.803 1.00 0.00 H new ATOM 0 HD2 LYS A 74 19.639 5.776 -2.206 1.00 0.00 H new ATOM 0 HD3 LYS A 74 18.804 5.857 -0.667 1.00 0.00 H new ATOM 0 HE2 LYS A 74 20.904 4.595 -0.439 1.00 0.00 H new ATOM 0 HE3 LYS A 74 19.527 3.559 -0.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 21.371 2.692 -1.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 19.766 2.467 -2.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 20.709 3.700 -2.826 1.00 0.00 H new ATOM 636 N LYS A 75 15.643 6.233 -5.603 1.00 0.00 N ATOM 637 CA LYS A 75 14.947 7.100 -6.539 1.00 0.00 C ATOM 638 C LYS A 75 13.664 6.436 -7.024 1.00 0.00 C ATOM 639 O LYS A 75 12.606 7.064 -7.079 1.00 0.00 O ATOM 640 CB LYS A 75 15.852 7.405 -7.729 1.00 0.00 C ATOM 641 CG LYS A 75 15.215 8.313 -8.770 1.00 0.00 C ATOM 642 CD LYS A 75 14.909 9.684 -8.191 1.00 0.00 C ATOM 643 CE LYS A 75 14.229 10.587 -9.205 1.00 0.00 C ATOM 644 NZ LYS A 75 14.036 11.960 -8.671 1.00 0.00 N ATOM 0 H LYS A 75 16.557 5.917 -5.929 1.00 0.00 H new ATOM 0 HA LYS A 75 14.690 8.030 -6.032 1.00 0.00 H new ATOM 0 HB2 LYS A 75 16.768 7.871 -7.366 1.00 0.00 H new ATOM 0 HB3 LYS A 75 16.138 6.467 -8.205 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.885 8.417 -9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 75 14.296 7.858 -9.139 1.00 0.00 H new ATOM 0 HD2 LYS A 75 14.269 9.574 -7.316 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.834 10.150 -7.853 1.00 0.00 H new ATOM 0 HE2 LYS A 75 14.829 10.630 -10.114 1.00 0.00 H new ATOM 0 HE3 LYS A 75 13.263 10.164 -9.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 13.569 12.549 -9.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 13.443 11.920 -7.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 14.960 12.373 -8.432 1.00 0.00 H new ATOM 658 N GLU A 76 13.776 5.158 -7.370 1.00 0.00 N ATOM 659 CA GLU A 76 12.635 4.377 -7.820 1.00 0.00 C ATOM 660 C GLU A 76 11.573 4.341 -6.731 1.00 0.00 C ATOM 661 O GLU A 76 10.401 4.594 -6.989 1.00 0.00 O ATOM 662 CB GLU A 76 13.074 2.953 -8.175 1.00 0.00 C ATOM 663 CG GLU A 76 11.958 2.085 -8.735 1.00 0.00 C ATOM 664 CD GLU A 76 11.674 2.349 -10.199 1.00 0.00 C ATOM 665 OE1 GLU A 76 11.853 1.420 -11.017 1.00 0.00 O ATOM 666 OE2 GLU A 76 11.266 3.477 -10.540 1.00 0.00 O ATOM 0 H GLU A 76 14.654 4.640 -7.346 1.00 0.00 H new ATOM 0 HA GLU A 76 12.216 4.844 -8.711 1.00 0.00 H new ATOM 0 HB2 GLU A 76 13.882 3.004 -8.905 1.00 0.00 H new ATOM 0 HB3 GLU A 76 13.479 2.475 -7.283 1.00 0.00 H new ATOM 0 HG2 GLU A 76 12.223 1.036 -8.607 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.049 2.257 -8.159 1.00 0.00 H new ATOM 673 N ALA A 77 12.009 4.053 -5.507 1.00 0.00 N ATOM 674 CA ALA A 77 11.117 3.998 -4.355 1.00 0.00 C ATOM 675 C ALA A 77 10.338 5.302 -4.206 1.00 0.00 C ATOM 676 O ALA A 77 9.139 5.289 -3.934 1.00 0.00 O ATOM 677 CB ALA A 77 11.908 3.709 -3.090 1.00 0.00 C ATOM 0 H ALA A 77 12.985 3.853 -5.288 1.00 0.00 H new ATOM 0 HA ALA A 77 10.402 3.191 -4.516 1.00 0.00 H new ATOM 0 HB1 ALA A 77 11.230 3.671 -2.238 1.00 0.00 H new ATOM 0 HB2 ALA A 77 12.418 2.751 -3.191 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.644 4.498 -2.933 1.00 0.00 H new ATOM 683 N MET A 78 11.031 6.420 -4.407 1.00 0.00 N ATOM 684 CA MET A 78 10.420 7.745 -4.333 1.00 0.00 C ATOM 685 C MET A 78 9.267 7.852 -5.323 1.00 0.00 C ATOM 686 O MET A 78 8.170 8.298 -4.977 1.00 0.00 O ATOM 687 CB MET A 78 11.461 8.827 -4.644 1.00 0.00 C ATOM 688 CG MET A 78 12.636 8.864 -3.677 1.00 0.00 C ATOM 689 SD MET A 78 12.282 9.754 -2.150 1.00 0.00 S ATOM 690 CE MET A 78 12.166 11.427 -2.776 1.00 0.00 C ATOM 0 H MET A 78 12.027 6.434 -4.625 1.00 0.00 H new ATOM 0 HA MET A 78 10.039 7.892 -3.322 1.00 0.00 H new ATOM 0 HB2 MET A 78 11.841 8.669 -5.653 1.00 0.00 H new ATOM 0 HB3 MET A 78 10.969 9.800 -4.637 1.00 0.00 H new ATOM 0 HG2 MET A 78 12.928 7.843 -3.434 1.00 0.00 H new ATOM 0 HG3 MET A 78 13.488 9.330 -4.171 1.00 0.00 H new ATOM 0 HE1 MET A 78 12.376 12.132 -1.971 1.00 0.00 H new ATOM 0 HE2 MET A 78 12.890 11.566 -3.579 1.00 0.00 H new ATOM 0 HE3 MET A 78 11.161 11.603 -3.160 1.00 0.00 H new ATOM 700 N GLU A 79 9.525 7.426 -6.553 1.00 0.00 N ATOM 701 CA GLU A 79 8.528 7.484 -7.610 1.00 0.00 C ATOM 702 C GLU A 79 7.407 6.480 -7.355 1.00 0.00 C ATOM 703 O GLU A 79 6.238 6.758 -7.630 1.00 0.00 O ATOM 704 CB GLU A 79 9.181 7.219 -8.967 1.00 0.00 C ATOM 705 CG GLU A 79 10.302 8.186 -9.294 1.00 0.00 C ATOM 706 CD GLU A 79 10.692 8.165 -10.757 1.00 0.00 C ATOM 707 OE1 GLU A 79 10.101 8.940 -11.543 1.00 0.00 O ATOM 708 OE2 GLU A 79 11.586 7.380 -11.132 1.00 0.00 O ATOM 0 H GLU A 79 10.422 7.035 -6.842 1.00 0.00 H new ATOM 0 HA GLU A 79 8.094 8.484 -7.617 1.00 0.00 H new ATOM 0 HB2 GLU A 79 9.573 6.202 -8.981 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.421 7.279 -9.746 1.00 0.00 H new ATOM 0 HG2 GLU A 79 9.996 9.195 -9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.174 7.942 -8.687 1.00 0.00 H new ATOM 715 N ILE A 80 7.771 5.316 -6.828 1.00 0.00 N ATOM 716 CA ILE A 80 6.800 4.281 -6.494 1.00 0.00 C ATOM 717 C ILE A 80 5.824 4.780 -5.441 1.00 0.00 C ATOM 718 O ILE A 80 4.616 4.714 -5.635 1.00 0.00 O ATOM 719 CB ILE A 80 7.485 2.998 -5.978 1.00 0.00 C ATOM 720 CG1 ILE A 80 8.376 2.402 -7.065 1.00 0.00 C ATOM 721 CG2 ILE A 80 6.444 1.978 -5.528 1.00 0.00 C ATOM 722 CD1 ILE A 80 9.268 1.287 -6.570 1.00 0.00 C ATOM 0 H ILE A 80 8.738 5.065 -6.622 1.00 0.00 H new ATOM 0 HA ILE A 80 6.262 4.043 -7.412 1.00 0.00 H new ATOM 0 HB ILE A 80 8.105 3.258 -5.120 1.00 0.00 H new ATOM 0 HG12 ILE A 80 7.748 2.023 -7.871 1.00 0.00 H new ATOM 0 HG13 ILE A 80 8.996 3.192 -7.489 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.946 1.080 -5.168 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.841 2.403 -4.726 1.00 0.00 H new ATOM 0 HG23 ILE A 80 5.800 1.720 -6.369 1.00 0.00 H new ATOM 0 HD11 ILE A 80 9.873 0.911 -7.395 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.922 1.666 -5.784 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.654 0.479 -6.173 1.00 0.00 H new ATOM 734 N ILE A 81 6.356 5.298 -4.341 1.00 0.00 N ATOM 735 CA ILE A 81 5.531 5.793 -3.246 1.00 0.00 C ATOM 736 C ILE A 81 4.624 6.928 -3.717 1.00 0.00 C ATOM 737 O ILE A 81 3.469 7.029 -3.298 1.00 0.00 O ATOM 738 CB ILE A 81 6.403 6.266 -2.059 1.00 0.00 C ATOM 739 CG1 ILE A 81 7.209 5.091 -1.489 1.00 0.00 C ATOM 740 CG2 ILE A 81 5.549 6.906 -0.971 1.00 0.00 C ATOM 741 CD1 ILE A 81 6.357 3.952 -0.969 1.00 0.00 C ATOM 0 H ILE A 81 7.360 5.386 -4.183 1.00 0.00 H new ATOM 0 HA ILE A 81 4.907 4.967 -2.906 1.00 0.00 H new ATOM 0 HB ILE A 81 7.097 7.021 -2.428 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.873 4.709 -2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 81 7.841 5.456 -0.680 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.188 7.229 -0.149 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.023 7.768 -1.381 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.824 6.180 -0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.002 3.162 -0.584 1.00 0.00 H new ATOM 0 HD12 ILE A 81 5.712 4.316 -0.170 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.744 3.557 -1.779 1.00 0.00 H new ATOM 753 N LYS A 82 5.144 7.765 -4.606 1.00 0.00 N ATOM 754 CA LYS A 82 4.361 8.859 -5.172 1.00 0.00 C ATOM 755 C LYS A 82 3.157 8.320 -5.947 1.00 0.00 C ATOM 756 O LYS A 82 2.023 8.766 -5.747 1.00 0.00 O ATOM 757 CB LYS A 82 5.240 9.719 -6.083 1.00 0.00 C ATOM 758 CG LYS A 82 4.517 10.914 -6.685 1.00 0.00 C ATOM 759 CD LYS A 82 5.462 11.798 -7.483 1.00 0.00 C ATOM 760 CE LYS A 82 6.069 11.059 -8.667 1.00 0.00 C ATOM 761 NZ LYS A 82 7.007 11.920 -9.434 1.00 0.00 N ATOM 0 H LYS A 82 6.102 7.709 -4.951 1.00 0.00 H new ATOM 0 HA LYS A 82 3.990 9.477 -4.354 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.098 10.075 -5.513 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.628 9.097 -6.890 1.00 0.00 H new ATOM 0 HG2 LYS A 82 3.712 10.565 -7.332 1.00 0.00 H new ATOM 0 HG3 LYS A 82 4.056 11.499 -5.889 1.00 0.00 H new ATOM 0 HD2 LYS A 82 4.923 12.675 -7.841 1.00 0.00 H new ATOM 0 HD3 LYS A 82 6.259 12.157 -6.832 1.00 0.00 H new ATOM 0 HE2 LYS A 82 6.597 10.174 -8.311 1.00 0.00 H new ATOM 0 HE3 LYS A 82 5.273 10.712 -9.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 7.399 11.381 -10.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.498 12.752 -9.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.781 12.230 -8.812 1.00 0.00 H new ATOM 775 N LYS A 83 3.406 7.347 -6.819 1.00 0.00 N ATOM 776 CA LYS A 83 2.341 6.731 -7.605 1.00 0.00 C ATOM 777 C LYS A 83 1.435 5.884 -6.715 1.00 0.00 C ATOM 778 O LYS A 83 0.235 5.766 -6.968 1.00 0.00 O ATOM 779 CB LYS A 83 2.925 5.863 -8.724 1.00 0.00 C ATOM 780 CG LYS A 83 3.656 6.648 -9.805 1.00 0.00 C ATOM 781 CD LYS A 83 2.716 7.580 -10.556 1.00 0.00 C ATOM 782 CE LYS A 83 3.411 8.255 -11.730 1.00 0.00 C ATOM 783 NZ LYS A 83 3.857 7.276 -12.757 1.00 0.00 N ATOM 0 H LYS A 83 4.336 6.968 -6.999 1.00 0.00 H new ATOM 0 HA LYS A 83 1.750 7.530 -8.052 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.614 5.141 -8.286 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.118 5.294 -9.186 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.460 7.229 -9.353 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.120 5.955 -10.507 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.856 7.016 -10.918 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.335 8.339 -9.873 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.732 8.975 -12.187 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.272 8.816 -11.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.073 7.776 -13.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.709 6.784 -12.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.101 6.582 -12.927 1.00 0.00 H new ATOM 797 N PHE A 84 2.024 5.303 -5.677 1.00 0.00 N ATOM 798 CA PHE A 84 1.294 4.474 -4.729 1.00 0.00 C ATOM 799 C PHE A 84 0.223 5.305 -4.034 1.00 0.00 C ATOM 800 O PHE A 84 -0.953 4.944 -4.029 1.00 0.00 O ATOM 801 CB PHE A 84 2.263 3.889 -3.693 1.00 0.00 C ATOM 802 CG PHE A 84 1.826 2.576 -3.102 1.00 0.00 C ATOM 803 CD1 PHE A 84 2.542 1.419 -3.363 1.00 0.00 C ATOM 804 CD2 PHE A 84 0.709 2.497 -2.286 1.00 0.00 C ATOM 805 CE1 PHE A 84 2.153 0.208 -2.822 1.00 0.00 C ATOM 806 CE2 PHE A 84 0.315 1.289 -1.743 1.00 0.00 C ATOM 807 CZ PHE A 84 1.038 0.144 -2.010 1.00 0.00 C ATOM 0 H PHE A 84 3.019 5.394 -5.470 1.00 0.00 H new ATOM 0 HA PHE A 84 0.814 3.655 -5.265 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.238 3.756 -4.161 1.00 0.00 H new ATOM 0 HB3 PHE A 84 2.392 4.611 -2.887 1.00 0.00 H new ATOM 0 HD1 PHE A 84 3.415 1.464 -3.997 1.00 0.00 H new ATOM 0 HD2 PHE A 84 0.140 3.390 -2.072 1.00 0.00 H new ATOM 0 HE1 PHE A 84 2.720 -0.686 -3.034 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -0.559 1.241 -1.110 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.732 -0.800 -1.585 1.00 0.00 H new ATOM 817 N LYS A 85 0.640 6.438 -3.471 1.00 0.00 N ATOM 818 CA LYS A 85 -0.282 7.348 -2.802 1.00 0.00 C ATOM 819 C LYS A 85 -1.355 7.837 -3.769 1.00 0.00 C ATOM 820 O LYS A 85 -2.525 7.963 -3.404 1.00 0.00 O ATOM 821 CB LYS A 85 0.466 8.550 -2.221 1.00 0.00 C ATOM 822 CG LYS A 85 1.443 8.204 -1.109 1.00 0.00 C ATOM 823 CD LYS A 85 2.049 9.461 -0.509 1.00 0.00 C ATOM 824 CE LYS A 85 2.975 9.146 0.654 1.00 0.00 C ATOM 825 NZ LYS A 85 3.525 10.384 1.270 1.00 0.00 N ATOM 0 H LYS A 85 1.612 6.746 -3.466 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.758 6.799 -1.989 1.00 0.00 H new ATOM 0 HB2 LYS A 85 1.010 9.047 -3.024 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.262 9.265 -1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.930 7.636 -0.333 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.235 7.565 -1.501 1.00 0.00 H new ATOM 0 HD2 LYS A 85 2.603 9.999 -1.278 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.251 10.122 -0.169 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.432 8.575 1.407 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.795 8.517 0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.521 10.230 1.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.461 11.168 0.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 2.979 10.620 2.123 1.00 0.00 H new ATOM 839 N LYS A 86 -0.944 8.099 -5.004 1.00 0.00 N ATOM 840 CA LYS A 86 -1.855 8.587 -6.031 1.00 0.00 C ATOM 841 C LYS A 86 -2.941 7.557 -6.341 1.00 0.00 C ATOM 842 O LYS A 86 -4.118 7.903 -6.488 1.00 0.00 O ATOM 843 CB LYS A 86 -1.077 8.932 -7.304 1.00 0.00 C ATOM 844 CG LYS A 86 -1.961 9.400 -8.447 1.00 0.00 C ATOM 845 CD LYS A 86 -1.149 9.738 -9.684 1.00 0.00 C ATOM 846 CE LYS A 86 -2.045 10.124 -10.848 1.00 0.00 C ATOM 847 NZ LYS A 86 -2.961 9.018 -11.240 1.00 0.00 N ATOM 0 H LYS A 86 0.019 7.981 -5.319 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.341 9.487 -5.653 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.349 9.711 -7.076 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.515 8.055 -7.626 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.685 8.622 -8.689 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -2.528 10.277 -8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -0.467 10.559 -9.460 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.536 8.881 -9.964 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.632 11.002 -10.578 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.429 10.404 -11.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.354 9.210 -12.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.434 8.122 -11.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.736 8.948 -10.550 1.00 0.00 H new ATOM 861 N ASP A 87 -2.550 6.292 -6.430 1.00 0.00 N ATOM 862 CA ASP A 87 -3.497 5.232 -6.753 1.00 0.00 C ATOM 863 C ASP A 87 -4.398 4.955 -5.556 1.00 0.00 C ATOM 864 O ASP A 87 -5.578 4.634 -5.715 1.00 0.00 O ATOM 865 CB ASP A 87 -2.771 3.957 -7.176 1.00 0.00 C ATOM 866 CG ASP A 87 -3.656 3.043 -8.001 1.00 0.00 C ATOM 867 OD1 ASP A 87 -4.324 2.164 -7.426 1.00 0.00 O ATOM 868 OD2 ASP A 87 -3.696 3.207 -9.241 1.00 0.00 O ATOM 0 H ASP A 87 -1.591 5.976 -6.284 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.110 5.564 -7.591 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.884 4.220 -7.753 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.428 3.425 -6.289 1.00 0.00 H new ATOM 873 N LEU A 88 -3.835 5.097 -4.356 1.00 0.00 N ATOM 874 CA LEU A 88 -4.616 5.001 -3.126 1.00 0.00 C ATOM 875 C LEU A 88 -5.719 6.047 -3.126 1.00 0.00 C ATOM 876 O LEU A 88 -6.855 5.768 -2.749 1.00 0.00 O ATOM 877 CB LEU A 88 -3.732 5.209 -1.894 1.00 0.00 C ATOM 878 CG LEU A 88 -2.692 4.125 -1.622 1.00 0.00 C ATOM 879 CD1 LEU A 88 -1.859 4.500 -0.410 1.00 0.00 C ATOM 880 CD2 LEU A 88 -3.359 2.774 -1.409 1.00 0.00 C ATOM 0 H LEU A 88 -2.842 5.279 -4.211 1.00 0.00 H new ATOM 0 HA LEU A 88 -5.050 4.002 -3.084 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.214 6.162 -2.001 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -4.377 5.293 -1.019 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.039 4.046 -2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.119 3.722 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.351 5.446 -0.596 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.508 4.602 0.460 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.597 2.018 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.035 2.832 -0.556 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.923 2.502 -2.301 1.00 0.00 H new ATOM 892 N ALA A 89 -5.367 7.253 -3.559 1.00 0.00 N ATOM 893 CA ALA A 89 -6.320 8.348 -3.660 1.00 0.00 C ATOM 894 C ALA A 89 -7.466 7.979 -4.590 1.00 0.00 C ATOM 895 O ALA A 89 -8.632 8.217 -4.280 1.00 0.00 O ATOM 896 CB ALA A 89 -5.624 9.606 -4.153 1.00 0.00 C ATOM 0 H ALA A 89 -4.419 7.496 -3.848 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.731 8.539 -2.669 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -6.348 10.418 -4.224 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.835 9.883 -3.454 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -5.189 9.420 -5.135 1.00 0.00 H new ATOM 902 N ALA A 90 -7.124 7.379 -5.724 1.00 0.00 N ATOM 903 CA ALA A 90 -8.123 6.944 -6.689 1.00 0.00 C ATOM 904 C ALA A 90 -9.054 5.906 -6.074 1.00 0.00 C ATOM 905 O ALA A 90 -10.276 6.043 -6.129 1.00 0.00 O ATOM 906 CB ALA A 90 -7.449 6.385 -7.932 1.00 0.00 C ATOM 0 H ALA A 90 -6.161 7.183 -5.997 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.721 7.809 -6.976 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.209 6.064 -8.645 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.828 7.156 -8.387 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -6.827 5.534 -7.657 1.00 0.00 H new ATOM 912 N MET A 91 -8.467 4.882 -5.463 1.00 0.00 N ATOM 913 CA MET A 91 -9.243 3.803 -4.859 1.00 0.00 C ATOM 914 C MET A 91 -10.098 4.318 -3.705 1.00 0.00 C ATOM 915 O MET A 91 -11.218 3.851 -3.499 1.00 0.00 O ATOM 916 CB MET A 91 -8.322 2.673 -4.386 1.00 0.00 C ATOM 917 CG MET A 91 -7.678 1.910 -5.533 1.00 0.00 C ATOM 918 SD MET A 91 -6.696 0.499 -4.993 1.00 0.00 S ATOM 919 CE MET A 91 -5.379 1.324 -4.102 1.00 0.00 C ATOM 0 H MET A 91 -7.457 4.776 -5.373 1.00 0.00 H new ATOM 0 HA MET A 91 -9.913 3.406 -5.622 1.00 0.00 H new ATOM 0 HB2 MET A 91 -7.541 3.091 -3.751 1.00 0.00 H new ATOM 0 HB3 MET A 91 -8.895 1.978 -3.771 1.00 0.00 H new ATOM 0 HG2 MET A 91 -8.457 1.562 -6.211 1.00 0.00 H new ATOM 0 HG3 MET A 91 -7.042 2.590 -6.100 1.00 0.00 H new ATOM 0 HE1 MET A 91 -4.505 0.674 -4.061 1.00 0.00 H new ATOM 0 HE2 MET A 91 -5.119 2.251 -4.613 1.00 0.00 H new ATOM 0 HE3 MET A 91 -5.711 1.550 -3.089 1.00 0.00 H new ATOM 929 N LEU A 92 -9.572 5.291 -2.971 1.00 0.00 N ATOM 930 CA LEU A 92 -10.313 5.929 -1.888 1.00 0.00 C ATOM 931 C LEU A 92 -11.591 6.571 -2.418 1.00 0.00 C ATOM 932 O LEU A 92 -12.668 6.433 -1.830 1.00 0.00 O ATOM 933 CB LEU A 92 -9.446 6.990 -1.208 1.00 0.00 C ATOM 934 CG LEU A 92 -10.134 7.783 -0.095 1.00 0.00 C ATOM 935 CD1 LEU A 92 -10.636 6.851 0.995 1.00 0.00 C ATOM 936 CD2 LEU A 92 -9.182 8.820 0.482 1.00 0.00 C ATOM 0 H LEU A 92 -8.630 5.658 -3.107 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.580 5.164 -1.159 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.564 6.503 -0.792 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.096 7.690 -1.967 1.00 0.00 H new ATOM 0 HG LEU A 92 -10.993 8.302 -0.521 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.122 7.434 1.777 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.351 6.146 0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.795 6.303 1.421 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.686 9.376 1.273 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.305 8.320 0.892 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -8.873 9.508 -0.305 1.00 0.00 H new ATOM 948 N ARG A 93 -11.468 7.264 -3.539 1.00 0.00 N ATOM 949 CA ARG A 93 -12.608 7.932 -4.143 1.00 0.00 C ATOM 950 C ARG A 93 -13.620 6.915 -4.652 1.00 0.00 C ATOM 951 O ARG A 93 -14.818 7.185 -4.678 1.00 0.00 O ATOM 952 CB ARG A 93 -12.153 8.845 -5.280 1.00 0.00 C ATOM 953 CG ARG A 93 -11.177 9.919 -4.831 1.00 0.00 C ATOM 954 CD ARG A 93 -10.760 10.816 -5.983 1.00 0.00 C ATOM 955 NE ARG A 93 -10.241 10.051 -7.115 1.00 0.00 N ATOM 956 CZ ARG A 93 -9.165 10.393 -7.820 1.00 0.00 C ATOM 957 NH1 ARG A 93 -8.440 11.451 -7.476 1.00 0.00 N ATOM 958 NH2 ARG A 93 -8.805 9.664 -8.866 1.00 0.00 N ATOM 0 H ARG A 93 -10.591 7.378 -4.048 1.00 0.00 H new ATOM 0 HA ARG A 93 -13.089 8.543 -3.379 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -11.686 8.241 -6.058 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -13.026 9.320 -5.727 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -11.635 10.522 -4.047 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -10.294 9.450 -4.397 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -11.615 11.409 -6.308 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.999 11.516 -5.640 1.00 0.00 H new ATOM 0 HE ARG A 93 -10.735 9.200 -7.382 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.706 12.010 -6.665 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -7.617 11.705 -8.023 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.352 8.844 -9.129 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -7.981 9.923 -9.409 1.00 0.00 H new ATOM 972 N ILE A 94 -13.140 5.741 -5.047 1.00 0.00 N ATOM 973 CA ILE A 94 -14.025 4.680 -5.505 1.00 0.00 C ATOM 974 C ILE A 94 -14.788 4.063 -4.332 1.00 0.00 C ATOM 975 O ILE A 94 -15.933 3.638 -4.489 1.00 0.00 O ATOM 976 CB ILE A 94 -13.264 3.576 -6.260 1.00 0.00 C ATOM 977 CG1 ILE A 94 -12.388 4.186 -7.356 1.00 0.00 C ATOM 978 CG2 ILE A 94 -14.251 2.589 -6.866 1.00 0.00 C ATOM 979 CD1 ILE A 94 -11.508 3.179 -8.062 1.00 0.00 C ATOM 0 H ILE A 94 -12.148 5.502 -5.059 1.00 0.00 H new ATOM 0 HA ILE A 94 -14.731 5.139 -6.197 1.00 0.00 H new ATOM 0 HB ILE A 94 -12.620 3.049 -5.556 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -13.028 4.674 -8.091 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.759 4.960 -6.917 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -13.706 1.810 -7.399 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -14.847 2.137 -6.073 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -14.908 3.112 -7.561 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -10.916 3.685 -8.825 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.842 2.708 -7.339 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -12.131 2.417 -8.531 1.00 0.00 H new ATOM 991 N ILE A 95 -14.155 4.011 -3.159 1.00 0.00 N ATOM 992 CA ILE A 95 -14.847 3.583 -1.945 1.00 0.00 C ATOM 993 C ILE A 95 -16.048 4.490 -1.707 1.00 0.00 C ATOM 994 O ILE A 95 -17.173 4.030 -1.505 1.00 0.00 O ATOM 995 CB ILE A 95 -13.945 3.650 -0.692 1.00 0.00 C ATOM 996 CG1 ILE A 95 -12.716 2.762 -0.847 1.00 0.00 C ATOM 997 CG2 ILE A 95 -14.736 3.216 0.532 1.00 0.00 C ATOM 998 CD1 ILE A 95 -13.037 1.292 -0.741 1.00 0.00 C ATOM 0 H ILE A 95 -13.174 4.257 -3.025 1.00 0.00 H new ATOM 0 HA ILE A 95 -15.146 2.546 -2.097 1.00 0.00 H new ATOM 0 HB ILE A 95 -13.609 4.680 -0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.251 2.959 -1.813 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.985 3.025 -0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.097 3.264 1.414 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -15.591 3.879 0.666 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -15.088 2.194 0.394 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -12.123 0.710 -0.859 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -13.475 1.085 0.235 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.746 1.017 -1.522 1.00 0.00 H new ATOM 1010 N ASN A 96 -15.788 5.792 -1.761 1.00 0.00 N ATOM 1011 CA ASN A 96 -16.823 6.802 -1.568 1.00 0.00 C ATOM 1012 C ASN A 96 -17.823 6.781 -2.717 1.00 0.00 C ATOM 1013 O ASN A 96 -18.977 7.171 -2.554 1.00 0.00 O ATOM 1014 CB ASN A 96 -16.202 8.197 -1.451 1.00 0.00 C ATOM 1015 CG ASN A 96 -15.453 8.408 -0.145 1.00 0.00 C ATOM 1016 OD1 ASN A 96 -16.030 8.857 0.845 1.00 0.00 O ATOM 1017 ND2 ASN A 96 -14.165 8.100 -0.131 1.00 0.00 N ATOM 0 H ASN A 96 -14.860 6.176 -1.939 1.00 0.00 H new ATOM 0 HA ASN A 96 -17.347 6.568 -0.642 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.518 8.355 -2.285 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -16.988 8.947 -1.537 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -13.618 8.233 0.720 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -13.720 7.730 -0.971 1.00 0.00 H new ATOM 1024 N ALA A 97 -17.379 6.307 -3.877 1.00 0.00 N ATOM 1025 CA ALA A 97 -18.235 6.237 -5.053 1.00 0.00 C ATOM 1026 C ALA A 97 -19.290 5.148 -4.896 1.00 0.00 C ATOM 1027 O ALA A 97 -20.245 5.076 -5.664 1.00 0.00 O ATOM 1028 CB ALA A 97 -17.408 5.997 -6.308 1.00 0.00 C ATOM 0 H ALA A 97 -16.430 5.966 -4.026 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.745 7.195 -5.153 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -18.067 5.948 -7.174 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -16.698 6.814 -6.438 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -16.865 5.057 -6.212 1.00 0.00 H new ATOM 1034 N ARG A 98 -19.113 4.298 -3.892 1.00 0.00 N ATOM 1035 CA ARG A 98 -20.072 3.241 -3.610 1.00 0.00 C ATOM 1036 C ARG A 98 -21.190 3.770 -2.717 1.00 0.00 C ATOM 1037 O ARG A 98 -22.065 3.021 -2.288 1.00 0.00 O ATOM 1038 CB ARG A 98 -19.381 2.052 -2.932 1.00 0.00 C ATOM 1039 CG ARG A 98 -18.198 1.500 -3.713 1.00 0.00 C ATOM 1040 CD ARG A 98 -18.614 0.982 -5.081 1.00 0.00 C ATOM 1041 NE ARG A 98 -17.463 0.554 -5.877 1.00 0.00 N ATOM 1042 CZ ARG A 98 -17.549 -0.237 -6.949 1.00 0.00 C ATOM 1043 NH1 ARG A 98 -18.725 -0.717 -7.333 1.00 0.00 N ATOM 1044 NH2 ARG A 98 -16.456 -0.559 -7.633 1.00 0.00 N ATOM 0 H ARG A 98 -18.313 4.321 -3.260 1.00 0.00 H new ATOM 0 HA ARG A 98 -20.499 2.904 -4.554 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -19.040 2.358 -1.943 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -20.111 1.256 -2.785 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -17.446 2.280 -3.833 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -17.733 0.694 -3.146 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -19.302 0.145 -4.958 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -19.155 1.763 -5.616 1.00 0.00 H new ATOM 0 HE ARG A 98 -16.538 0.880 -5.596 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -19.568 -0.482 -6.809 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -18.786 -1.321 -8.153 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -15.547 -0.202 -7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -16.526 -1.164 -8.451 1.00 0.00 H new ATOM 1288 N GLY B 42 -10.093 -11.297 7.297 1.00 0.00 N ATOM 1289 CA GLY B 42 -9.425 -10.029 7.111 1.00 0.00 C ATOM 1290 C GLY B 42 -10.339 -8.861 7.410 1.00 0.00 C ATOM 1291 O GLY B 42 -11.359 -8.690 6.735 1.00 0.00 O ATOM 0 HA2 GLY B 42 -8.550 -9.981 7.760 1.00 0.00 H new ATOM 0 HA3 GLY B 42 -9.065 -9.955 6.085 1.00 0.00 H new ATOM 1295 N PRO B 43 -10.019 -8.057 8.439 1.00 0.00 N ATOM 1296 CA PRO B 43 -10.783 -6.854 8.774 1.00 0.00 C ATOM 1297 C PRO B 43 -10.694 -5.805 7.672 1.00 0.00 C ATOM 1298 O PRO B 43 -9.825 -5.907 6.806 1.00 0.00 O ATOM 1299 CB PRO B 43 -10.119 -6.336 10.056 1.00 0.00 C ATOM 1300 CG PRO B 43 -9.326 -7.484 10.576 1.00 0.00 C ATOM 1301 CD PRO B 43 -8.900 -8.264 9.370 1.00 0.00 C ATOM 0 HA PRO B 43 -11.845 -7.068 8.896 1.00 0.00 H new ATOM 0 HB2 PRO B 43 -9.480 -5.477 9.849 1.00 0.00 H new ATOM 0 HB3 PRO B 43 -10.864 -6.011 10.782 1.00 0.00 H new ATOM 0 HG2 PRO B 43 -8.462 -7.138 11.143 1.00 0.00 H new ATOM 0 HG3 PRO B 43 -9.923 -8.099 11.249 1.00 0.00 H new ATOM 0 HD2 PRO B 43 -7.959 -7.895 8.961 1.00 0.00 H new ATOM 0 HD3 PRO B 43 -8.755 -9.319 9.601 1.00 0.00 H new ATOM 1309 N ILE B 44 -11.558 -4.803 7.695 1.00 0.00 N ATOM 1310 CA ILE B 44 -11.642 -3.857 6.584 1.00 0.00 C ATOM 1311 C ILE B 44 -10.300 -3.164 6.302 1.00 0.00 C ATOM 1312 O ILE B 44 -9.957 -2.917 5.142 1.00 0.00 O ATOM 1313 CB ILE B 44 -12.764 -2.818 6.797 1.00 0.00 C ATOM 1314 CG1 ILE B 44 -12.571 -2.048 8.105 1.00 0.00 C ATOM 1315 CG2 ILE B 44 -14.120 -3.510 6.776 1.00 0.00 C ATOM 1316 CD1 ILE B 44 -13.727 -1.130 8.444 1.00 0.00 C ATOM 0 H ILE B 44 -12.207 -4.621 8.461 1.00 0.00 H new ATOM 0 HA ILE B 44 -11.894 -4.446 5.702 1.00 0.00 H new ATOM 0 HB ILE B 44 -12.720 -2.095 5.983 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -12.432 -2.760 8.919 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -11.657 -1.458 8.038 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -14.908 -2.772 6.927 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -14.263 -4.002 5.814 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -14.162 -4.253 7.573 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -13.521 -0.617 9.383 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -13.853 -0.395 7.649 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -14.640 -1.717 8.544 1.00 0.00 H new ATOM 1328 N ARG B 45 -9.522 -2.892 7.351 1.00 0.00 N ATOM 1329 CA ARG B 45 -8.188 -2.314 7.176 1.00 0.00 C ATOM 1330 C ARG B 45 -7.302 -3.268 6.377 1.00 0.00 C ATOM 1331 O ARG B 45 -6.654 -2.874 5.404 1.00 0.00 O ATOM 1332 CB ARG B 45 -7.518 -2.008 8.525 1.00 0.00 C ATOM 1333 CG ARG B 45 -8.035 -0.761 9.231 1.00 0.00 C ATOM 1334 CD ARG B 45 -9.413 -0.969 9.836 1.00 0.00 C ATOM 1335 NE ARG B 45 -9.417 -2.047 10.823 1.00 0.00 N ATOM 1336 CZ ARG B 45 -10.411 -2.272 11.683 1.00 0.00 C ATOM 1337 NH1 ARG B 45 -11.458 -1.454 11.728 1.00 0.00 N ATOM 1338 NH2 ARG B 45 -10.340 -3.298 12.521 1.00 0.00 N ATOM 0 H ARG B 45 -9.788 -3.060 8.321 1.00 0.00 H new ATOM 0 HA ARG B 45 -8.308 -1.376 6.634 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -7.656 -2.865 9.185 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -6.445 -1.898 8.365 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -7.335 -0.475 10.016 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.073 0.066 8.522 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -9.746 -0.044 10.307 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -10.126 -1.199 9.044 1.00 0.00 H new ATOM 0 HE ARG B 45 -8.608 -2.667 10.856 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -11.504 -0.649 11.103 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -12.215 -1.631 12.388 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -9.526 -3.913 12.507 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -11.099 -3.472 13.180 1.00 0.00 H new ATOM 1352 N MET B 46 -7.297 -4.528 6.792 1.00 0.00 N ATOM 1353 CA MET B 46 -6.515 -5.558 6.125 1.00 0.00 C ATOM 1354 C MET B 46 -6.995 -5.755 4.689 1.00 0.00 C ATOM 1355 O MET B 46 -6.201 -6.051 3.801 1.00 0.00 O ATOM 1356 CB MET B 46 -6.608 -6.876 6.899 1.00 0.00 C ATOM 1357 CG MET B 46 -5.761 -7.993 6.313 1.00 0.00 C ATOM 1358 SD MET B 46 -5.844 -9.518 7.273 1.00 0.00 S ATOM 1359 CE MET B 46 -5.078 -8.999 8.808 1.00 0.00 C ATOM 0 H MET B 46 -7.831 -4.862 7.594 1.00 0.00 H new ATOM 0 HA MET B 46 -5.474 -5.236 6.098 1.00 0.00 H new ATOM 0 HB2 MET B 46 -6.301 -6.703 7.931 1.00 0.00 H new ATOM 0 HB3 MET B 46 -7.649 -7.198 6.926 1.00 0.00 H new ATOM 0 HG2 MET B 46 -6.089 -8.194 5.293 1.00 0.00 H new ATOM 0 HG3 MET B 46 -4.724 -7.663 6.255 1.00 0.00 H new ATOM 0 HE1 MET B 46 -4.476 -9.815 9.208 1.00 0.00 H new ATOM 0 HE2 MET B 46 -4.440 -8.135 8.622 1.00 0.00 H new ATOM 0 HE3 MET B 46 -5.851 -8.731 9.528 1.00 0.00 H new ATOM 1369 N VAL B 47 -8.295 -5.577 4.468 1.00 0.00 N ATOM 1370 CA VAL B 47 -8.871 -5.694 3.132 1.00 0.00 C ATOM 1371 C VAL B 47 -8.233 -4.690 2.177 1.00 0.00 C ATOM 1372 O VAL B 47 -7.848 -5.047 1.066 1.00 0.00 O ATOM 1373 CB VAL B 47 -10.403 -5.491 3.145 1.00 0.00 C ATOM 1374 CG1 VAL B 47 -10.978 -5.581 1.737 1.00 0.00 C ATOM 1375 CG2 VAL B 47 -11.062 -6.517 4.052 1.00 0.00 C ATOM 0 H VAL B 47 -8.970 -5.351 5.198 1.00 0.00 H new ATOM 0 HA VAL B 47 -8.663 -6.706 2.785 1.00 0.00 H new ATOM 0 HB VAL B 47 -10.611 -4.493 3.532 1.00 0.00 H new ATOM 0 HG11 VAL B 47 -12.057 -5.435 1.775 1.00 0.00 H new ATOM 0 HG12 VAL B 47 -10.529 -4.810 1.111 1.00 0.00 H new ATOM 0 HG13 VAL B 47 -10.759 -6.563 1.317 1.00 0.00 H new ATOM 0 HG21 VAL B 47 -12.141 -6.363 4.052 1.00 0.00 H new ATOM 0 HG22 VAL B 47 -10.839 -7.520 3.689 1.00 0.00 H new ATOM 0 HG23 VAL B 47 -10.679 -6.405 5.066 1.00 0.00 H new ATOM 1385 N LEU B 48 -8.104 -3.441 2.617 1.00 0.00 N ATOM 1386 CA LEU B 48 -7.464 -2.412 1.798 1.00 0.00 C ATOM 1387 C LEU B 48 -5.985 -2.724 1.584 1.00 0.00 C ATOM 1388 O LEU B 48 -5.416 -2.397 0.542 1.00 0.00 O ATOM 1389 CB LEU B 48 -7.624 -1.023 2.424 1.00 0.00 C ATOM 1390 CG LEU B 48 -8.887 -0.259 2.009 1.00 0.00 C ATOM 1391 CD1 LEU B 48 -10.141 -0.973 2.482 1.00 0.00 C ATOM 1392 CD2 LEU B 48 -8.850 1.163 2.546 1.00 0.00 C ATOM 0 H LEU B 48 -8.430 -3.117 3.528 1.00 0.00 H new ATOM 0 HA LEU B 48 -7.963 -2.411 0.829 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.623 -1.129 3.509 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -6.753 -0.422 2.162 1.00 0.00 H new ATOM 0 HG LEU B 48 -8.913 -0.220 0.920 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -11.020 -0.408 2.173 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -10.179 -1.971 2.044 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -10.125 -1.054 3.569 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -9.754 1.690 2.242 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -8.792 1.140 3.634 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -7.977 1.680 2.147 1.00 0.00 H new ATOM 1404 N ALA B 49 -5.368 -3.363 2.572 1.00 0.00 N ATOM 1405 CA ALA B 49 -3.977 -3.786 2.456 1.00 0.00 C ATOM 1406 C ALA B 49 -3.831 -4.884 1.403 1.00 0.00 C ATOM 1407 O ALA B 49 -2.935 -4.833 0.558 1.00 0.00 O ATOM 1408 CB ALA B 49 -3.452 -4.261 3.802 1.00 0.00 C ATOM 0 H ALA B 49 -5.808 -3.599 3.461 1.00 0.00 H new ATOM 0 HA ALA B 49 -3.384 -2.929 2.137 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -2.413 -4.573 3.698 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -3.516 -3.448 4.525 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -4.051 -5.103 4.149 1.00 0.00 H new ATOM 1414 N ILE B 50 -4.721 -5.872 1.455 1.00 0.00 N ATOM 1415 CA ILE B 50 -4.734 -6.947 0.466 1.00 0.00 C ATOM 1416 C ILE B 50 -5.098 -6.382 -0.904 1.00 0.00 C ATOM 1417 O ILE B 50 -4.589 -6.828 -1.935 1.00 0.00 O ATOM 1418 CB ILE B 50 -5.738 -8.063 0.841 1.00 0.00 C ATOM 1419 CG1 ILE B 50 -5.462 -8.586 2.254 1.00 0.00 C ATOM 1420 CG2 ILE B 50 -5.665 -9.203 -0.168 1.00 0.00 C ATOM 1421 CD1 ILE B 50 -6.462 -9.619 2.730 1.00 0.00 C ATOM 0 H ILE B 50 -5.443 -5.951 2.172 1.00 0.00 H new ATOM 0 HA ILE B 50 -3.736 -7.384 0.441 1.00 0.00 H new ATOM 0 HB ILE B 50 -6.743 -7.641 0.820 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -4.463 -9.021 2.281 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -5.463 -7.746 2.949 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -6.377 -9.980 0.109 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -5.908 -8.826 -1.161 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -4.658 -9.619 -0.174 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -6.200 -9.941 3.738 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -7.461 -9.183 2.736 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -6.446 -10.478 2.059 1.00 0.00 H new ATOM 1433 N LEU B 51 -5.983 -5.394 -0.895 1.00 0.00 N ATOM 1434 CA LEU B 51 -6.370 -4.686 -2.103 1.00 0.00 C ATOM 1435 C LEU B 51 -5.149 -4.080 -2.779 1.00 0.00 C ATOM 1436 O LEU B 51 -4.893 -4.341 -3.949 1.00 0.00 O ATOM 1437 CB LEU B 51 -7.361 -3.575 -1.768 1.00 0.00 C ATOM 1438 CG LEU B 51 -7.765 -2.692 -2.945 1.00 0.00 C ATOM 1439 CD1 LEU B 51 -8.919 -3.316 -3.717 1.00 0.00 C ATOM 1440 CD2 LEU B 51 -8.118 -1.300 -2.456 1.00 0.00 C ATOM 0 H LEU B 51 -6.451 -5.063 -0.051 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.838 -5.400 -2.781 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -8.260 -4.026 -1.347 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.927 -2.944 -0.992 1.00 0.00 H new ATOM 0 HG LEU B 51 -6.920 -2.609 -3.628 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -9.190 -2.669 -4.552 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -8.617 -4.292 -4.097 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -9.777 -3.434 -3.056 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -8.405 -0.678 -3.304 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -8.949 -1.361 -1.753 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -7.254 -0.859 -1.959 1.00 0.00 H new ATOM 1452 N ALA B 52 -4.400 -3.275 -2.025 1.00 0.00 N ATOM 1453 CA ALA B 52 -3.202 -2.620 -2.541 1.00 0.00 C ATOM 1454 C ALA B 52 -2.214 -3.648 -3.078 1.00 0.00 C ATOM 1455 O ALA B 52 -1.539 -3.418 -4.082 1.00 0.00 O ATOM 1456 CB ALA B 52 -2.549 -1.774 -1.459 1.00 0.00 C ATOM 0 H ALA B 52 -4.605 -3.061 -1.049 1.00 0.00 H new ATOM 0 HA ALA B 52 -3.498 -1.967 -3.362 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -1.657 -1.293 -1.862 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -3.251 -1.012 -1.120 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -2.270 -2.410 -0.619 1.00 0.00 H new ATOM 1462 N PHE B 53 -2.152 -4.787 -2.409 1.00 0.00 N ATOM 1463 CA PHE B 53 -1.310 -5.890 -2.841 1.00 0.00 C ATOM 1464 C PHE B 53 -1.732 -6.350 -4.234 1.00 0.00 C ATOM 1465 O PHE B 53 -0.947 -6.307 -5.177 1.00 0.00 O ATOM 1466 CB PHE B 53 -1.409 -7.042 -1.837 1.00 0.00 C ATOM 1467 CG PHE B 53 -0.593 -8.252 -2.194 1.00 0.00 C ATOM 1468 CD1 PHE B 53 -1.186 -9.350 -2.796 1.00 0.00 C ATOM 1469 CD2 PHE B 53 0.763 -8.296 -1.919 1.00 0.00 C ATOM 1470 CE1 PHE B 53 -0.441 -10.466 -3.118 1.00 0.00 C ATOM 1471 CE2 PHE B 53 1.513 -9.410 -2.240 1.00 0.00 C ATOM 1472 CZ PHE B 53 0.910 -10.497 -2.839 1.00 0.00 C ATOM 0 H PHE B 53 -2.680 -4.973 -1.556 1.00 0.00 H new ATOM 0 HA PHE B 53 -0.273 -5.558 -2.886 1.00 0.00 H new ATOM 0 HB2 PHE B 53 -1.093 -6.682 -0.858 1.00 0.00 H new ATOM 0 HB3 PHE B 53 -2.454 -7.338 -1.745 1.00 0.00 H new ATOM 0 HD1 PHE B 53 -2.243 -9.332 -3.016 1.00 0.00 H new ATOM 0 HD2 PHE B 53 1.240 -7.449 -1.448 1.00 0.00 H new ATOM 0 HE1 PHE B 53 -0.915 -11.315 -3.588 1.00 0.00 H new ATOM 0 HE2 PHE B 53 2.571 -9.431 -2.022 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.494 -11.370 -3.089 1.00 0.00 H new ATOM 1482 N LEU B 54 -2.991 -6.742 -4.363 1.00 0.00 N ATOM 1483 CA LEU B 54 -3.536 -7.223 -5.634 1.00 0.00 C ATOM 1484 C LEU B 54 -3.664 -6.098 -6.649 1.00 0.00 C ATOM 1485 O LEU B 54 -3.991 -6.332 -7.810 1.00 0.00 O ATOM 1486 CB LEU B 54 -4.906 -7.870 -5.414 1.00 0.00 C ATOM 1487 CG LEU B 54 -4.925 -9.063 -4.455 1.00 0.00 C ATOM 1488 CD1 LEU B 54 -6.351 -9.543 -4.234 1.00 0.00 C ATOM 1489 CD2 LEU B 54 -4.062 -10.194 -4.991 1.00 0.00 C ATOM 0 H LEU B 54 -3.664 -6.738 -3.597 1.00 0.00 H new ATOM 0 HA LEU B 54 -2.840 -7.963 -6.029 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -5.590 -7.111 -5.035 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.294 -8.196 -6.379 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.514 -8.741 -3.498 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.347 -10.392 -3.550 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -6.945 -8.735 -3.807 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -6.784 -9.847 -5.187 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -4.088 -11.033 -4.295 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -4.443 -10.514 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -3.035 -9.847 -5.102 1.00 0.00 H new ATOM 1501 N ARG B 55 -3.404 -4.884 -6.209 1.00 0.00 N ATOM 1502 CA ARG B 55 -3.507 -3.735 -7.048 1.00 0.00 C ATOM 1503 C ARG B 55 -2.164 -3.414 -7.703 1.00 0.00 C ATOM 1504 O ARG B 55 -2.111 -2.988 -8.857 1.00 0.00 O ATOM 1505 CB ARG B 55 -3.988 -2.572 -6.193 1.00 0.00 C ATOM 1506 CG ARG B 55 -3.941 -1.266 -6.915 1.00 0.00 C ATOM 1507 CD ARG B 55 -4.800 -1.299 -8.164 1.00 0.00 C ATOM 1508 NE ARG B 55 -4.747 -0.028 -8.880 1.00 0.00 N ATOM 1509 CZ ARG B 55 -5.050 0.126 -10.166 1.00 0.00 C ATOM 1510 NH1 ARG B 55 -5.490 -0.902 -10.879 1.00 0.00 N ATOM 1511 NH2 ARG B 55 -4.917 1.317 -10.733 1.00 0.00 N ATOM 0 H ARG B 55 -3.115 -4.678 -5.253 1.00 0.00 H new ATOM 0 HA ARG B 55 -4.216 -3.924 -7.854 1.00 0.00 H new ATOM 0 HB2 ARG B 55 -5.010 -2.765 -5.867 1.00 0.00 H new ATOM 0 HB3 ARG B 55 -3.373 -2.508 -5.295 1.00 0.00 H new ATOM 0 HG2 ARG B 55 -4.285 -0.470 -6.255 1.00 0.00 H new ATOM 0 HG3 ARG B 55 -2.911 -1.033 -7.185 1.00 0.00 H new ATOM 0 HD2 ARG B 55 -4.462 -2.102 -8.819 1.00 0.00 H new ATOM 0 HD3 ARG B 55 -5.832 -1.523 -7.892 1.00 0.00 H new ATOM 0 HE ARG B 55 -4.458 0.799 -8.358 1.00 0.00 H new ATOM 0 HH11 ARG B 55 -5.598 -1.817 -10.442 1.00 0.00 H new ATOM 0 HH12 ARG B 55 -5.721 -0.777 -11.865 1.00 0.00 H new ATOM 0 HH21 ARG B 55 -4.584 2.109 -10.183 1.00 0.00 H new ATOM 0 HH22 ARG B 55 -5.148 1.441 -11.719 1.00 0.00 H new ATOM 1525 N PHE B 56 -1.082 -3.620 -6.967 1.00 0.00 N ATOM 1526 CA PHE B 56 0.245 -3.286 -7.469 1.00 0.00 C ATOM 1527 C PHE B 56 1.022 -4.524 -7.907 1.00 0.00 C ATOM 1528 O PHE B 56 1.921 -4.429 -8.742 1.00 0.00 O ATOM 1529 CB PHE B 56 1.029 -2.498 -6.418 1.00 0.00 C ATOM 1530 CG PHE B 56 0.524 -1.093 -6.234 1.00 0.00 C ATOM 1531 CD1 PHE B 56 -0.482 -0.813 -5.323 1.00 0.00 C ATOM 1532 CD2 PHE B 56 1.054 -0.052 -6.980 1.00 0.00 C ATOM 1533 CE1 PHE B 56 -0.950 0.475 -5.159 1.00 0.00 C ATOM 1534 CE2 PHE B 56 0.590 1.239 -6.820 1.00 0.00 C ATOM 1535 CZ PHE B 56 -0.413 1.503 -5.908 1.00 0.00 C ATOM 0 H PHE B 56 -1.095 -4.014 -6.026 1.00 0.00 H new ATOM 0 HA PHE B 56 0.113 -2.662 -8.353 1.00 0.00 H new ATOM 0 HB2 PHE B 56 0.977 -3.024 -5.465 1.00 0.00 H new ATOM 0 HB3 PHE B 56 2.080 -2.465 -6.707 1.00 0.00 H new ATOM 0 HD1 PHE B 56 -0.905 -1.613 -4.734 1.00 0.00 H new ATOM 0 HD2 PHE B 56 1.839 -0.253 -7.694 1.00 0.00 H new ATOM 0 HE1 PHE B 56 -1.735 0.678 -4.446 1.00 0.00 H new ATOM 0 HE2 PHE B 56 1.011 2.041 -7.408 1.00 0.00 H new ATOM 0 HZ PHE B 56 -0.777 2.512 -5.781 1.00 0.00 H new ATOM 1545 N THR B 57 0.676 -5.684 -7.361 1.00 0.00 N ATOM 1546 CA THR B 57 1.349 -6.918 -7.742 1.00 0.00 C ATOM 1547 C THR B 57 0.639 -7.553 -8.928 1.00 0.00 C ATOM 1548 O THR B 57 1.252 -8.246 -9.740 1.00 0.00 O ATOM 1549 CB THR B 57 1.401 -7.939 -6.581 1.00 0.00 C ATOM 1550 OG1 THR B 57 0.084 -8.416 -6.279 1.00 0.00 O ATOM 1551 CG2 THR B 57 2.003 -7.316 -5.330 1.00 0.00 C ATOM 0 H THR B 57 -0.058 -5.795 -6.661 1.00 0.00 H new ATOM 0 HA THR B 57 2.373 -6.655 -8.008 1.00 0.00 H new ATOM 0 HB THR B 57 2.030 -8.770 -6.900 1.00 0.00 H new ATOM 0 HG1 THR B 57 -0.431 -7.703 -5.846 1.00 0.00 H new ATOM 0 HG21 THR B 57 2.027 -8.056 -4.530 1.00 0.00 H new ATOM 0 HG22 THR B 57 3.017 -6.979 -5.543 1.00 0.00 H new ATOM 0 HG23 THR B 57 1.396 -6.466 -5.019 1.00 0.00 H new ATOM 1559 N ALA B 58 -0.654 -7.278 -9.036 1.00 0.00 N ATOM 1560 CA ALA B 58 -1.490 -7.896 -10.045 1.00 0.00 C ATOM 1561 C ALA B 58 -2.393 -6.865 -10.705 1.00 0.00 C ATOM 1562 O ALA B 58 -2.345 -5.679 -10.376 1.00 0.00 O ATOM 1563 CB ALA B 58 -2.329 -8.996 -9.416 1.00 0.00 C ATOM 0 H ALA B 58 -1.147 -6.623 -8.428 1.00 0.00 H new ATOM 0 HA ALA B 58 -0.846 -8.327 -10.811 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.956 -9.457 -10.179 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -1.673 -9.750 -8.981 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -2.961 -8.571 -8.636 1.00 0.00 H new ATOM 1569 N ILE B 59 -3.198 -7.321 -11.648 1.00 0.00 N ATOM 1570 CA ILE B 59 -4.169 -6.467 -12.307 1.00 0.00 C ATOM 1571 C ILE B 59 -5.572 -7.003 -12.058 1.00 0.00 C ATOM 1572 O ILE B 59 -5.822 -8.198 -12.248 1.00 0.00 O ATOM 1573 CB ILE B 59 -3.913 -6.380 -13.827 1.00 0.00 C ATOM 1574 CG1 ILE B 59 -2.486 -5.897 -14.100 1.00 0.00 C ATOM 1575 CG2 ILE B 59 -4.924 -5.450 -14.487 1.00 0.00 C ATOM 1576 CD1 ILE B 59 -2.123 -5.878 -15.568 1.00 0.00 C ATOM 0 H ILE B 59 -3.197 -8.287 -11.977 1.00 0.00 H new ATOM 0 HA ILE B 59 -4.071 -5.464 -11.891 1.00 0.00 H new ATOM 0 HB ILE B 59 -4.031 -7.376 -14.254 1.00 0.00 H new ATOM 0 HG12 ILE B 59 -2.367 -4.893 -13.692 1.00 0.00 H new ATOM 0 HG13 ILE B 59 -1.785 -6.542 -13.570 1.00 0.00 H new ATOM 0 HG21 ILE B 59 -4.728 -5.401 -15.558 1.00 0.00 H new ATOM 0 HG22 ILE B 59 -5.932 -5.830 -14.319 1.00 0.00 H new ATOM 0 HG23 ILE B 59 -4.836 -4.453 -14.056 1.00 0.00 H new ATOM 0 HD11 ILE B 59 -1.098 -5.525 -15.685 1.00 0.00 H new ATOM 0 HD12 ILE B 59 -2.209 -6.885 -15.977 1.00 0.00 H new ATOM 0 HD13 ILE B 59 -2.800 -5.210 -16.101 1.00 0.00 H new ATOM 1588 N LYS B 60 -6.466 -6.116 -11.622 1.00 0.00 N ATOM 1589 CA LYS B 60 -7.848 -6.468 -11.302 1.00 0.00 C ATOM 1590 C LYS B 60 -7.910 -7.386 -10.079 1.00 0.00 C ATOM 1591 O LYS B 60 -7.811 -8.609 -10.198 1.00 0.00 O ATOM 1592 CB LYS B 60 -8.547 -7.124 -12.502 1.00 0.00 C ATOM 1593 CG LYS B 60 -10.017 -7.426 -12.258 1.00 0.00 C ATOM 1594 CD LYS B 60 -10.829 -6.152 -12.100 1.00 0.00 C ATOM 1595 CE LYS B 60 -12.253 -6.446 -11.657 1.00 0.00 C ATOM 1596 NZ LYS B 60 -12.303 -7.001 -10.276 1.00 0.00 N ATOM 0 H LYS B 60 -6.251 -5.129 -11.480 1.00 0.00 H new ATOM 0 HA LYS B 60 -8.377 -5.544 -11.066 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -8.458 -6.467 -13.367 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -8.030 -8.051 -12.751 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -10.412 -8.010 -13.089 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -10.120 -8.038 -11.362 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -10.347 -5.501 -11.370 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -10.846 -5.611 -13.046 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -12.843 -5.531 -11.702 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -12.709 -7.154 -12.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -12.754 -7.938 -10.295 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -11.337 -7.089 -9.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -12.854 -6.364 -9.666 1.00 0.00 H new ATOM 1610 N PRO B 61 -8.062 -6.795 -8.883 1.00 0.00 N ATOM 1611 CA PRO B 61 -8.171 -7.549 -7.628 1.00 0.00 C ATOM 1612 C PRO B 61 -9.373 -8.489 -7.623 1.00 0.00 C ATOM 1613 O PRO B 61 -10.394 -8.220 -8.265 1.00 0.00 O ATOM 1614 CB PRO B 61 -8.342 -6.460 -6.561 1.00 0.00 C ATOM 1615 CG PRO B 61 -7.823 -5.215 -7.191 1.00 0.00 C ATOM 1616 CD PRO B 61 -8.126 -5.343 -8.655 1.00 0.00 C ATOM 0 HA PRO B 61 -7.303 -8.188 -7.464 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -9.388 -6.350 -6.274 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -7.787 -6.705 -5.655 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -8.303 -4.333 -6.768 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -6.752 -5.108 -7.021 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -9.108 -4.939 -8.900 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -7.400 -4.807 -9.265 1.00 0.00 H new ATOM 1624 N SER B 62 -9.231 -9.590 -6.893 1.00 0.00 N ATOM 1625 CA SER B 62 -10.263 -10.611 -6.797 1.00 0.00 C ATOM 1626 C SER B 62 -11.558 -10.039 -6.220 1.00 0.00 C ATOM 1627 O SER B 62 -11.542 -9.187 -5.324 1.00 0.00 O ATOM 1628 CB SER B 62 -9.750 -11.752 -5.923 1.00 0.00 C ATOM 1629 OG SER B 62 -8.471 -12.181 -6.362 1.00 0.00 O ATOM 0 H SER B 62 -8.393 -9.798 -6.350 1.00 0.00 H new ATOM 0 HA SER B 62 -10.487 -10.982 -7.797 1.00 0.00 H new ATOM 0 HB2 SER B 62 -9.693 -11.425 -4.885 1.00 0.00 H new ATOM 0 HB3 SER B 62 -10.451 -12.586 -5.956 1.00 0.00 H new ATOM 0 HG SER B 62 -8.157 -12.912 -5.789 1.00 0.00 H new ATOM 1635 N LEU B 63 -12.676 -10.532 -6.749 1.00 0.00 N ATOM 1636 CA LEU B 63 -14.000 -9.998 -6.448 1.00 0.00 C ATOM 1637 C LEU B 63 -14.348 -10.090 -4.971 1.00 0.00 C ATOM 1638 O LEU B 63 -15.124 -9.282 -4.476 1.00 0.00 O ATOM 1639 CB LEU B 63 -15.064 -10.722 -7.272 1.00 0.00 C ATOM 1640 CG LEU B 63 -14.969 -10.516 -8.785 1.00 0.00 C ATOM 1641 CD1 LEU B 63 -16.026 -11.338 -9.503 1.00 0.00 C ATOM 1642 CD2 LEU B 63 -15.119 -9.043 -9.129 1.00 0.00 C ATOM 0 H LEU B 63 -12.688 -11.316 -7.401 1.00 0.00 H new ATOM 0 HA LEU B 63 -13.979 -8.941 -6.713 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -14.999 -11.790 -7.062 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -16.047 -10.391 -6.937 1.00 0.00 H new ATOM 0 HG LEU B 63 -13.987 -10.852 -9.118 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -15.943 -11.178 -10.578 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -15.878 -12.395 -9.280 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -17.016 -11.031 -9.166 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -15.049 -8.913 -10.209 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -16.088 -8.685 -8.782 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -14.327 -8.473 -8.643 1.00 0.00 H new ATOM 1654 N GLY B 64 -13.789 -11.067 -4.271 1.00 0.00 N ATOM 1655 CA GLY B 64 -14.051 -11.194 -2.848 1.00 0.00 C ATOM 1656 C GLY B 64 -13.576 -9.978 -2.082 1.00 0.00 C ATOM 1657 O GLY B 64 -14.278 -9.463 -1.204 1.00 0.00 O ATOM 0 H GLY B 64 -13.162 -11.772 -4.659 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -15.120 -11.332 -2.685 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -13.553 -12.084 -2.464 1.00 0.00 H new ATOM 1661 N LEU B 65 -12.386 -9.507 -2.430 1.00 0.00 N ATOM 1662 CA LEU B 65 -11.839 -8.303 -1.833 1.00 0.00 C ATOM 1663 C LEU B 65 -12.657 -7.098 -2.261 1.00 0.00 C ATOM 1664 O LEU B 65 -12.910 -6.207 -1.466 1.00 0.00 O ATOM 1665 CB LEU B 65 -10.368 -8.105 -2.227 1.00 0.00 C ATOM 1666 CG LEU B 65 -9.349 -9.003 -1.513 1.00 0.00 C ATOM 1667 CD1 LEU B 65 -9.455 -8.843 -0.003 1.00 0.00 C ATOM 1668 CD2 LEU B 65 -9.523 -10.462 -1.910 1.00 0.00 C ATOM 0 H LEU B 65 -11.782 -9.944 -3.125 1.00 0.00 H new ATOM 0 HA LEU B 65 -11.887 -8.409 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -10.276 -8.269 -3.301 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -10.100 -7.065 -2.039 1.00 0.00 H new ATOM 0 HG LEU B 65 -8.353 -8.688 -1.825 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -8.724 -9.489 0.484 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -9.260 -7.805 0.268 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -10.457 -9.120 0.323 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -8.786 -11.072 -1.387 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -10.526 -10.795 -1.642 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -9.382 -10.566 -2.986 1.00 0.00 H new ATOM 1680 N ILE B 66 -13.087 -7.099 -3.518 1.00 0.00 N ATOM 1681 CA ILE B 66 -13.880 -6.001 -4.069 1.00 0.00 C ATOM 1682 C ILE B 66 -15.262 -5.924 -3.411 1.00 0.00 C ATOM 1683 O ILE B 66 -15.785 -4.835 -3.159 1.00 0.00 O ATOM 1684 CB ILE B 66 -14.044 -6.152 -5.598 1.00 0.00 C ATOM 1685 CG1 ILE B 66 -12.672 -6.198 -6.274 1.00 0.00 C ATOM 1686 CG2 ILE B 66 -14.884 -5.019 -6.173 1.00 0.00 C ATOM 1687 CD1 ILE B 66 -11.837 -4.952 -6.052 1.00 0.00 C ATOM 0 H ILE B 66 -12.899 -7.852 -4.180 1.00 0.00 H new ATOM 0 HA ILE B 66 -13.341 -5.077 -3.857 1.00 0.00 H new ATOM 0 HB ILE B 66 -14.565 -7.089 -5.795 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -12.123 -7.063 -5.902 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -12.810 -6.345 -7.345 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -14.983 -5.150 -7.251 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -15.872 -5.030 -5.714 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -14.398 -4.065 -5.967 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -10.880 -5.060 -6.562 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -12.364 -4.085 -6.450 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -11.666 -4.814 -4.984 1.00 0.00 H new ATOM 1699 N ASN B 67 -15.845 -7.080 -3.132 1.00 0.00 N ATOM 1700 CA ASN B 67 -17.147 -7.141 -2.477 1.00 0.00 C ATOM 1701 C ASN B 67 -17.070 -6.615 -1.049 1.00 0.00 C ATOM 1702 O ASN B 67 -17.988 -5.944 -0.578 1.00 0.00 O ATOM 1703 CB ASN B 67 -17.704 -8.568 -2.485 1.00 0.00 C ATOM 1704 CG ASN B 67 -18.455 -8.894 -3.763 1.00 0.00 C ATOM 1705 OD1 ASN B 67 -17.883 -9.392 -4.732 1.00 0.00 O ATOM 1706 ND2 ASN B 67 -19.747 -8.612 -3.776 1.00 0.00 N ATOM 0 H ASN B 67 -15.439 -7.990 -3.348 1.00 0.00 H new ATOM 0 HA ASN B 67 -17.826 -6.503 -3.043 1.00 0.00 H new ATOM 0 HB2 ASN B 67 -16.884 -9.275 -2.359 1.00 0.00 H new ATOM 0 HB3 ASN B 67 -18.371 -8.699 -1.633 1.00 0.00 H new ATOM 0 HD21 ASN B 67 -20.303 -8.807 -4.608 1.00 0.00 H new ATOM 0 HD22 ASN B 67 -20.187 -8.199 -2.954 1.00 0.00 H new ATOM 1713 N ARG B 68 -15.976 -6.906 -0.357 1.00 0.00 N ATOM 1714 CA ARG B 68 -15.803 -6.404 1.002 1.00 0.00 C ATOM 1715 C ARG B 68 -15.247 -4.981 0.968 1.00 0.00 C ATOM 1716 O ARG B 68 -15.374 -4.227 1.929 1.00 0.00 O ATOM 1717 CB ARG B 68 -14.889 -7.325 1.811 1.00 0.00 C ATOM 1718 CG ARG B 68 -14.867 -7.002 3.297 1.00 0.00 C ATOM 1719 CD ARG B 68 -14.158 -8.085 4.089 1.00 0.00 C ATOM 1720 NE ARG B 68 -14.780 -9.390 3.892 1.00 0.00 N ATOM 1721 CZ ARG B 68 -14.288 -10.532 4.361 1.00 0.00 C ATOM 1722 NH1 ARG B 68 -13.179 -10.538 5.095 1.00 0.00 N ATOM 1723 NH2 ARG B 68 -14.914 -11.672 4.100 1.00 0.00 N ATOM 0 H ARG B 68 -15.206 -7.477 -0.706 1.00 0.00 H new ATOM 0 HA ARG B 68 -16.776 -6.386 1.492 1.00 0.00 H new ATOM 0 HB2 ARG B 68 -15.214 -8.357 1.676 1.00 0.00 H new ATOM 0 HB3 ARG B 68 -13.875 -7.256 1.417 1.00 0.00 H new ATOM 0 HG2 ARG B 68 -14.367 -6.047 3.456 1.00 0.00 H new ATOM 0 HG3 ARG B 68 -15.888 -6.892 3.662 1.00 0.00 H new ATOM 0 HD2 ARG B 68 -13.112 -8.131 3.787 1.00 0.00 H new ATOM 0 HD3 ARG B 68 -14.173 -7.830 5.149 1.00 0.00 H new ATOM 0 HE ARG B 68 -15.649 -9.428 3.360 1.00 0.00 H new ATOM 0 HH11 ARG B 68 -12.700 -9.662 5.302 1.00 0.00 H new ATOM 0 HH12 ARG B 68 -12.808 -11.419 5.451 1.00 0.00 H new ATOM 0 HH21 ARG B 68 -15.768 -11.669 3.542 1.00 0.00 H new ATOM 0 HH22 ARG B 68 -14.541 -12.552 4.457 1.00 0.00 H new ATOM 1737 N TRP B 69 -14.654 -4.633 -0.162 1.00 0.00 N ATOM 1738 CA TRP B 69 -14.116 -3.299 -0.412 1.00 0.00 C ATOM 1739 C TRP B 69 -15.217 -2.251 -0.278 1.00 0.00 C ATOM 1740 O TRP B 69 -15.063 -1.253 0.422 1.00 0.00 O ATOM 1741 CB TRP B 69 -13.529 -3.289 -1.823 1.00 0.00 C ATOM 1742 CG TRP B 69 -12.662 -2.124 -2.166 1.00 0.00 C ATOM 1743 CD1 TRP B 69 -11.649 -1.595 -1.427 1.00 0.00 C ATOM 1744 CD2 TRP B 69 -12.704 -1.378 -3.381 1.00 0.00 C ATOM 1745 NE1 TRP B 69 -11.061 -0.558 -2.111 1.00 0.00 N ATOM 1746 CE2 TRP B 69 -11.694 -0.407 -3.315 1.00 0.00 C ATOM 1747 CE3 TRP B 69 -13.506 -1.440 -4.515 1.00 0.00 C ATOM 1748 CZ2 TRP B 69 -11.462 0.494 -4.349 1.00 0.00 C ATOM 1749 CZ3 TRP B 69 -13.278 -0.549 -5.539 1.00 0.00 C ATOM 1750 CH2 TRP B 69 -12.260 0.407 -5.451 1.00 0.00 C ATOM 0 H TRP B 69 -14.529 -5.275 -0.944 1.00 0.00 H new ATOM 0 HA TRP B 69 -13.342 -3.057 0.316 1.00 0.00 H new ATOM 0 HB2 TRP B 69 -12.948 -4.201 -1.959 1.00 0.00 H new ATOM 0 HB3 TRP B 69 -14.352 -3.326 -2.537 1.00 0.00 H new ATOM 0 HD1 TRP B 69 -11.351 -1.939 -0.448 1.00 0.00 H new ATOM 0 HE1 TRP B 69 -10.280 0.007 -1.776 1.00 0.00 H new ATOM 0 HE3 TRP B 69 -14.294 -2.174 -4.591 1.00 0.00 H new ATOM 0 HZ2 TRP B 69 -10.679 1.235 -4.281 1.00 0.00 H new ATOM 0 HZ3 TRP B 69 -13.895 -0.588 -6.425 1.00 0.00 H new ATOM 0 HH2 TRP B 69 -12.103 1.090 -6.273 1.00 0.00 H new ATOM 1761 N GLY B 70 -16.345 -2.508 -0.930 1.00 0.00 N ATOM 1762 CA GLY B 70 -17.485 -1.616 -0.827 1.00 0.00 C ATOM 1763 C GLY B 70 -18.225 -1.778 0.489 1.00 0.00 C ATOM 1764 O GLY B 70 -19.174 -1.045 0.774 1.00 0.00 O ATOM 0 H GLY B 70 -16.491 -3.320 -1.530 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -17.147 -0.585 -0.927 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -18.170 -1.808 -1.653 1.00 0.00 H new ATOM 1768 N SER B 71 -17.794 -2.743 1.289 1.00 0.00 N ATOM 1769 CA SER B 71 -18.384 -2.987 2.596 1.00 0.00 C ATOM 1770 C SER B 71 -17.613 -2.208 3.661 1.00 0.00 C ATOM 1771 O SER B 71 -18.107 -1.983 4.765 1.00 0.00 O ATOM 1772 CB SER B 71 -18.368 -4.490 2.905 1.00 0.00 C ATOM 1773 OG SER B 71 -19.051 -4.794 4.112 1.00 0.00 O ATOM 0 H SER B 71 -17.030 -3.375 1.051 1.00 0.00 H new ATOM 0 HA SER B 71 -19.420 -2.647 2.596 1.00 0.00 H new ATOM 0 HB2 SER B 71 -18.829 -5.034 2.081 1.00 0.00 H new ATOM 0 HB3 SER B 71 -17.336 -4.834 2.976 1.00 0.00 H new ATOM 0 HG SER B 71 -19.019 -5.760 4.271 1.00 0.00 H new ATOM 1779 N VAL B 72 -16.399 -1.797 3.309 1.00 0.00 N ATOM 1780 CA VAL B 72 -15.561 -0.999 4.194 1.00 0.00 C ATOM 1781 C VAL B 72 -16.220 0.344 4.469 1.00 0.00 C ATOM 1782 O VAL B 72 -16.760 0.973 3.554 1.00 0.00 O ATOM 1783 CB VAL B 72 -14.165 -0.755 3.569 1.00 0.00 C ATOM 1784 CG1 VAL B 72 -13.302 0.134 4.460 1.00 0.00 C ATOM 1785 CG2 VAL B 72 -13.465 -2.077 3.290 1.00 0.00 C ATOM 0 H VAL B 72 -15.971 -2.007 2.407 1.00 0.00 H new ATOM 0 HA VAL B 72 -15.441 -1.552 5.126 1.00 0.00 H new ATOM 0 HB VAL B 72 -14.311 -0.233 2.623 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -12.330 0.285 3.991 1.00 0.00 H new ATOM 0 HG12 VAL B 72 -13.792 1.098 4.596 1.00 0.00 H new ATOM 0 HG13 VAL B 72 -13.167 -0.345 5.430 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -12.486 -1.885 2.851 1.00 0.00 H new ATOM 0 HG22 VAL B 72 -13.343 -2.628 4.223 1.00 0.00 H new ATOM 0 HG23 VAL B 72 -14.064 -2.667 2.596 1.00 0.00 H new ATOM 1795 N GLY B 73 -16.205 0.765 5.731 1.00 0.00 N ATOM 1796 CA GLY B 73 -16.685 2.080 6.069 1.00 0.00 C ATOM 1797 C GLY B 73 -15.916 3.128 5.311 1.00 0.00 C ATOM 1798 O GLY B 73 -14.693 3.187 5.401 1.00 0.00 O ATOM 0 H GLY B 73 -15.868 0.214 6.520 1.00 0.00 H new ATOM 0 HA2 GLY B 73 -17.747 2.158 5.835 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -16.582 2.248 7.141 1.00 0.00 H new ATOM 1802 N LYS B 74 -16.626 3.937 4.550 1.00 0.00 N ATOM 1803 CA LYS B 74 -16.000 4.925 3.686 1.00 0.00 C ATOM 1804 C LYS B 74 -15.188 5.904 4.517 1.00 0.00 C ATOM 1805 O LYS B 74 -14.115 6.339 4.111 1.00 0.00 O ATOM 1806 CB LYS B 74 -17.077 5.640 2.875 1.00 0.00 C ATOM 1807 CG LYS B 74 -17.973 4.663 2.136 1.00 0.00 C ATOM 1808 CD LYS B 74 -19.190 5.333 1.531 1.00 0.00 C ATOM 1809 CE LYS B 74 -20.137 4.300 0.939 1.00 0.00 C ATOM 1810 NZ LYS B 74 -20.609 3.330 1.961 1.00 0.00 N ATOM 0 H LYS B 74 -17.645 3.931 4.511 1.00 0.00 H new ATOM 0 HA LYS B 74 -15.317 4.433 2.994 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -17.683 6.256 3.540 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -16.605 6.313 2.159 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -17.400 4.176 1.346 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -18.297 3.881 2.823 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -19.709 5.913 2.294 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -18.878 6.033 0.756 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -20.995 4.806 0.495 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -19.633 3.764 0.135 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -21.420 2.798 1.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -19.840 2.670 2.194 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -20.897 3.842 2.819 1.00 0.00 H new ATOM 1824 N LYS B 75 -15.703 6.210 5.698 1.00 0.00 N ATOM 1825 CA LYS B 75 -14.996 7.038 6.662 1.00 0.00 C ATOM 1826 C LYS B 75 -13.719 6.345 7.122 1.00 0.00 C ATOM 1827 O LYS B 75 -12.653 6.960 7.194 1.00 0.00 O ATOM 1828 CB LYS B 75 -15.897 7.312 7.863 1.00 0.00 C ATOM 1829 CG LYS B 75 -15.247 8.178 8.930 1.00 0.00 C ATOM 1830 CD LYS B 75 -14.931 9.566 8.397 1.00 0.00 C ATOM 1831 CE LYS B 75 -14.239 10.426 9.439 1.00 0.00 C ATOM 1832 NZ LYS B 75 -14.028 11.815 8.955 1.00 0.00 N ATOM 0 H LYS B 75 -16.619 5.893 6.014 1.00 0.00 H new ATOM 0 HA LYS B 75 -14.729 7.982 6.186 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -16.809 7.799 7.518 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -16.192 6.362 8.309 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -15.911 8.259 9.790 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -14.330 7.703 9.279 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -14.295 9.481 7.516 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -15.853 10.052 8.079 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -14.837 10.445 10.350 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -13.278 9.981 9.698 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -13.553 12.372 9.694 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -13.436 11.799 8.100 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -14.947 12.248 8.732 1.00 0.00 H new ATOM 1846 N GLU B 76 -13.843 5.059 7.426 1.00 0.00 N ATOM 1847 CA GLU B 76 -12.710 4.252 7.845 1.00 0.00 C ATOM 1848 C GLU B 76 -11.649 4.243 6.754 1.00 0.00 C ATOM 1849 O GLU B 76 -10.473 4.468 7.022 1.00 0.00 O ATOM 1850 CB GLU B 76 -13.161 2.821 8.148 1.00 0.00 C ATOM 1851 CG GLU B 76 -12.051 1.926 8.671 1.00 0.00 C ATOM 1852 CD GLU B 76 -11.760 2.141 10.140 1.00 0.00 C ATOM 1853 OE1 GLU B 76 -11.930 1.186 10.923 1.00 0.00 O ATOM 1854 OE2 GLU B 76 -11.360 3.260 10.520 1.00 0.00 O ATOM 0 H GLU B 76 -14.727 4.551 7.389 1.00 0.00 H new ATOM 0 HA GLU B 76 -12.286 4.685 8.751 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -13.966 2.852 8.882 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -13.573 2.380 7.240 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -12.326 0.884 8.510 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -11.143 2.109 8.096 1.00 0.00 H new ATOM 1861 N ALA B 77 -12.089 4.005 5.519 1.00 0.00 N ATOM 1862 CA ALA B 77 -11.199 3.980 4.365 1.00 0.00 C ATOM 1863 C ALA B 77 -10.407 5.280 4.257 1.00 0.00 C ATOM 1864 O ALA B 77 -9.210 5.266 3.978 1.00 0.00 O ATOM 1865 CB ALA B 77 -11.995 3.740 3.091 1.00 0.00 C ATOM 0 H ALA B 77 -13.067 3.825 5.294 1.00 0.00 H new ATOM 0 HA ALA B 77 -10.492 3.162 4.499 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -11.318 3.724 2.237 1.00 0.00 H new ATOM 0 HB2 ALA B 77 -12.514 2.784 3.161 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -12.724 4.540 2.961 1.00 0.00 H new ATOM 1871 N MET B 78 -11.090 6.399 4.499 1.00 0.00 N ATOM 1872 CA MET B 78 -10.466 7.720 4.468 1.00 0.00 C ATOM 1873 C MET B 78 -9.309 7.783 5.458 1.00 0.00 C ATOM 1874 O MET B 78 -8.207 8.228 5.123 1.00 0.00 O ATOM 1875 CB MET B 78 -11.495 8.802 4.818 1.00 0.00 C ATOM 1876 CG MET B 78 -12.673 8.879 3.856 1.00 0.00 C ATOM 1877 SD MET B 78 -12.314 9.819 2.360 1.00 0.00 S ATOM 1878 CE MET B 78 -12.180 11.467 3.047 1.00 0.00 C ATOM 0 H MET B 78 -12.085 6.415 4.721 1.00 0.00 H new ATOM 0 HA MET B 78 -10.087 7.896 3.461 1.00 0.00 H new ATOM 0 HB2 MET B 78 -11.873 8.616 5.823 1.00 0.00 H new ATOM 0 HB3 MET B 78 -10.994 9.770 4.840 1.00 0.00 H new ATOM 0 HG2 MET B 78 -12.973 7.868 3.578 1.00 0.00 H new ATOM 0 HG3 MET B 78 -13.521 9.334 4.367 1.00 0.00 H new ATOM 0 HE1 MET B 78 -12.866 12.135 2.526 1.00 0.00 H new ATOM 0 HE2 MET B 78 -12.434 11.441 4.107 1.00 0.00 H new ATOM 0 HE3 MET B 78 -11.159 11.829 2.927 1.00 0.00 H new ATOM 1888 N GLU B 79 -9.569 7.315 6.673 1.00 0.00 N ATOM 1889 CA GLU B 79 -8.570 7.326 7.731 1.00 0.00 C ATOM 1890 C GLU B 79 -7.459 6.321 7.437 1.00 0.00 C ATOM 1891 O GLU B 79 -6.285 6.583 7.709 1.00 0.00 O ATOM 1892 CB GLU B 79 -9.221 7.018 9.082 1.00 0.00 C ATOM 1893 CG GLU B 79 -10.334 7.982 9.449 1.00 0.00 C ATOM 1894 CD GLU B 79 -10.734 7.897 10.907 1.00 0.00 C ATOM 1895 OE1 GLU B 79 -10.149 8.635 11.734 1.00 0.00 O ATOM 1896 OE2 GLU B 79 -11.638 7.102 11.238 1.00 0.00 O ATOM 0 H GLU B 79 -10.469 6.922 6.949 1.00 0.00 H new ATOM 0 HA GLU B 79 -8.129 8.322 7.774 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -9.621 6.004 9.061 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -8.457 7.044 9.859 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -10.014 9.000 9.224 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -11.205 7.777 8.827 1.00 0.00 H new ATOM 1903 N ILE B 80 -7.837 5.180 6.871 1.00 0.00 N ATOM 1904 CA ILE B 80 -6.876 4.147 6.502 1.00 0.00 C ATOM 1905 C ILE B 80 -5.897 4.670 5.464 1.00 0.00 C ATOM 1906 O ILE B 80 -4.690 4.582 5.650 1.00 0.00 O ATOM 1907 CB ILE B 80 -7.576 2.888 5.944 1.00 0.00 C ATOM 1908 CG1 ILE B 80 -8.471 2.264 7.011 1.00 0.00 C ATOM 1909 CG2 ILE B 80 -6.546 1.874 5.458 1.00 0.00 C ATOM 1910 CD1 ILE B 80 -9.373 1.174 6.481 1.00 0.00 C ATOM 0 H ILE B 80 -8.807 4.947 6.657 1.00 0.00 H new ATOM 0 HA ILE B 80 -6.339 3.874 7.410 1.00 0.00 H new ATOM 0 HB ILE B 80 -8.195 3.184 5.097 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -7.845 1.853 7.803 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -9.084 3.045 7.461 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -7.058 0.994 5.068 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -5.940 2.320 4.669 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -5.903 1.582 6.288 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -9.980 0.777 7.294 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -10.024 1.584 5.709 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -8.766 0.374 6.057 1.00 0.00 H new ATOM 1922 N ILE B 81 -6.427 5.230 4.383 1.00 0.00 N ATOM 1923 CA ILE B 81 -5.599 5.755 3.304 1.00 0.00 C ATOM 1924 C ILE B 81 -4.682 6.866 3.811 1.00 0.00 C ATOM 1925 O ILE B 81 -3.530 6.974 3.389 1.00 0.00 O ATOM 1926 CB ILE B 81 -6.469 6.276 2.136 1.00 0.00 C ATOM 1927 CG1 ILE B 81 -7.289 5.130 1.529 1.00 0.00 C ATOM 1928 CG2 ILE B 81 -5.612 6.943 1.069 1.00 0.00 C ATOM 1929 CD1 ILE B 81 -6.450 4.000 0.966 1.00 0.00 C ATOM 0 H ILE B 81 -7.430 5.332 4.230 1.00 0.00 H new ATOM 0 HA ILE B 81 -4.982 4.935 2.935 1.00 0.00 H new ATOM 0 HB ILE B 81 -7.155 7.025 2.532 1.00 0.00 H new ATOM 0 HG12 ILE B 81 -7.954 4.728 2.294 1.00 0.00 H new ATOM 0 HG13 ILE B 81 -7.920 5.530 0.736 1.00 0.00 H new ATOM 0 HG21 ILE B 81 -6.250 7.300 0.260 1.00 0.00 H new ATOM 0 HG22 ILE B 81 -5.076 7.785 1.507 1.00 0.00 H new ATOM 0 HG23 ILE B 81 -4.895 6.222 0.675 1.00 0.00 H new ATOM 0 HD11 ILE B 81 -7.104 3.230 0.556 1.00 0.00 H new ATOM 0 HD12 ILE B 81 -5.804 4.385 0.177 1.00 0.00 H new ATOM 0 HD13 ILE B 81 -5.838 3.571 1.759 1.00 0.00 H new ATOM 1941 N LYS B 82 -5.193 7.674 4.732 1.00 0.00 N ATOM 1942 CA LYS B 82 -4.400 8.739 5.333 1.00 0.00 C ATOM 1943 C LYS B 82 -3.200 8.161 6.086 1.00 0.00 C ATOM 1944 O LYS B 82 -2.063 8.602 5.898 1.00 0.00 O ATOM 1945 CB LYS B 82 -5.268 9.577 6.274 1.00 0.00 C ATOM 1946 CG LYS B 82 -4.532 10.744 6.912 1.00 0.00 C ATOM 1947 CD LYS B 82 -5.467 11.612 7.741 1.00 0.00 C ATOM 1948 CE LYS B 82 -6.075 10.840 8.902 1.00 0.00 C ATOM 1949 NZ LYS B 82 -6.997 11.685 9.702 1.00 0.00 N ATOM 0 H LYS B 82 -6.150 7.612 5.078 1.00 0.00 H new ATOM 0 HA LYS B 82 -4.025 9.382 4.537 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -6.124 9.960 5.719 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -5.660 8.933 7.061 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -3.729 10.366 7.545 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -4.066 11.350 6.135 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -4.919 12.473 8.124 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -6.263 11.998 7.105 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -6.615 9.974 8.520 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -5.279 10.462 9.544 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -7.392 11.124 10.484 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -6.476 12.498 10.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -7.770 12.025 9.096 1.00 0.00 H new ATOM 1963 N LYS B 83 -3.455 7.162 6.924 1.00 0.00 N ATOM 1964 CA LYS B 83 -2.393 6.511 7.686 1.00 0.00 C ATOM 1965 C LYS B 83 -1.497 5.685 6.767 1.00 0.00 C ATOM 1966 O LYS B 83 -0.298 5.544 7.016 1.00 0.00 O ATOM 1967 CB LYS B 83 -2.985 5.612 8.775 1.00 0.00 C ATOM 1968 CG LYS B 83 -3.706 6.368 9.883 1.00 0.00 C ATOM 1969 CD LYS B 83 -2.755 7.263 10.664 1.00 0.00 C ATOM 1970 CE LYS B 83 -3.440 7.901 11.863 1.00 0.00 C ATOM 1971 NZ LYS B 83 -3.893 6.887 12.853 1.00 0.00 N ATOM 0 H LYS B 83 -4.387 6.785 7.093 1.00 0.00 H new ATOM 0 HA LYS B 83 -1.792 7.289 8.157 1.00 0.00 H new ATOM 0 HB2 LYS B 83 -3.682 4.913 8.314 1.00 0.00 H new ATOM 0 HB3 LYS B 83 -2.184 5.019 9.216 1.00 0.00 H new ATOM 0 HG2 LYS B 83 -4.503 6.973 9.452 1.00 0.00 H new ATOM 0 HG3 LYS B 83 -4.177 5.657 10.562 1.00 0.00 H new ATOM 0 HD2 LYS B 83 -1.900 6.678 11.002 1.00 0.00 H new ATOM 0 HD3 LYS B 83 -2.368 8.043 10.008 1.00 0.00 H new ATOM 0 HE2 LYS B 83 -2.753 8.596 12.345 1.00 0.00 H new ATOM 0 HE3 LYS B 83 -4.296 8.483 11.523 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 -4.086 7.352 13.763 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -4.760 6.428 12.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 -3.150 6.171 12.981 1.00 0.00 H new ATOM 1985 N PHE B 84 -2.093 5.147 5.711 1.00 0.00 N ATOM 1986 CA PHE B 84 -1.374 4.343 4.732 1.00 0.00 C ATOM 1987 C PHE B 84 -0.295 5.188 4.064 1.00 0.00 C ATOM 1988 O PHE B 84 0.877 4.813 4.040 1.00 0.00 O ATOM 1989 CB PHE B 84 -2.350 3.804 3.680 1.00 0.00 C ATOM 1990 CG PHE B 84 -1.927 2.509 3.043 1.00 0.00 C ATOM 1991 CD1 PHE B 84 -2.653 1.350 3.268 1.00 0.00 C ATOM 1992 CD2 PHE B 84 -0.812 2.446 2.223 1.00 0.00 C ATOM 1993 CE1 PHE B 84 -2.277 0.155 2.685 1.00 0.00 C ATOM 1994 CE2 PHE B 84 -0.431 1.254 1.638 1.00 0.00 C ATOM 1995 CZ PHE B 84 -1.163 0.106 1.870 1.00 0.00 C ATOM 0 H PHE B 84 -3.087 5.256 5.509 1.00 0.00 H new ATOM 0 HA PHE B 84 -0.902 3.500 5.237 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -3.325 3.664 4.146 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -2.474 4.555 2.900 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -3.523 1.381 3.907 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -0.234 3.339 2.039 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -2.854 -0.740 2.866 1.00 0.00 H new ATOM 0 HE2 PHE B 84 0.439 1.220 0.999 1.00 0.00 H new ATOM 0 HZ PHE B 84 -0.865 -0.827 1.415 1.00 0.00 H new ATOM 2005 N LYS B 85 -0.701 6.344 3.542 1.00 0.00 N ATOM 2006 CA LYS B 85 0.228 7.267 2.901 1.00 0.00 C ATOM 2007 C LYS B 85 1.306 7.717 3.882 1.00 0.00 C ATOM 2008 O LYS B 85 2.476 7.853 3.517 1.00 0.00 O ATOM 2009 CB LYS B 85 -0.511 8.495 2.360 1.00 0.00 C ATOM 2010 CG LYS B 85 -1.493 8.194 1.240 1.00 0.00 C ATOM 2011 CD LYS B 85 -2.091 9.476 0.685 1.00 0.00 C ATOM 2012 CE LYS B 85 -3.021 9.208 -0.487 1.00 0.00 C ATOM 2013 NZ LYS B 85 -3.557 10.469 -1.063 1.00 0.00 N ATOM 0 H LYS B 85 -1.670 6.662 3.552 1.00 0.00 H new ATOM 0 HA LYS B 85 0.698 6.740 2.071 1.00 0.00 H new ATOM 0 HB2 LYS B 85 -1.049 8.971 3.180 1.00 0.00 H new ATOM 0 HB3 LYS B 85 0.223 9.216 1.999 1.00 0.00 H new ATOM 0 HG2 LYS B 85 -0.986 7.649 0.443 1.00 0.00 H new ATOM 0 HG3 LYS B 85 -2.288 7.548 1.612 1.00 0.00 H new ATOM 0 HD2 LYS B 85 -2.640 9.991 1.473 1.00 0.00 H new ATOM 0 HD3 LYS B 85 -1.289 10.142 0.367 1.00 0.00 H new ATOM 0 HE2 LYS B 85 -2.485 8.655 -1.258 1.00 0.00 H new ATOM 0 HE3 LYS B 85 -3.847 8.578 -0.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 85 -4.549 10.329 -1.341 1.00 0.00 H new ATOM 0 HZ2 LYS B 85 -3.500 11.227 -0.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 85 -2.998 10.734 -1.899 1.00 0.00 H new ATOM 2027 N LYS B 86 0.901 7.937 5.127 1.00 0.00 N ATOM 2028 CA LYS B 86 1.820 8.379 6.167 1.00 0.00 C ATOM 2029 C LYS B 86 2.896 7.328 6.435 1.00 0.00 C ATOM 2030 O LYS B 86 4.078 7.655 6.576 1.00 0.00 O ATOM 2031 CB LYS B 86 1.051 8.686 7.455 1.00 0.00 C ATOM 2032 CG LYS B 86 1.943 9.106 8.609 1.00 0.00 C ATOM 2033 CD LYS B 86 1.137 9.410 9.859 1.00 0.00 C ATOM 2034 CE LYS B 86 2.042 9.744 11.034 1.00 0.00 C ATOM 2035 NZ LYS B 86 2.948 8.614 11.384 1.00 0.00 N ATOM 0 H LYS B 86 -0.062 7.816 5.441 1.00 0.00 H new ATOM 0 HA LYS B 86 2.313 9.287 5.820 1.00 0.00 H new ATOM 0 HB2 LYS B 86 0.329 9.479 7.257 1.00 0.00 H new ATOM 0 HB3 LYS B 86 0.483 7.803 7.748 1.00 0.00 H new ATOM 0 HG2 LYS B 86 2.660 8.313 8.822 1.00 0.00 H new ATOM 0 HG3 LYS B 86 2.518 9.987 8.323 1.00 0.00 H new ATOM 0 HD2 LYS B 86 0.465 10.246 9.666 1.00 0.00 H new ATOM 0 HD3 LYS B 86 0.514 8.552 10.110 1.00 0.00 H new ATOM 0 HE2 LYS B 86 2.638 10.624 10.793 1.00 0.00 H new ATOM 0 HE3 LYS B 86 1.431 10.000 11.900 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 3.345 8.769 12.333 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 2.411 7.723 11.374 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.720 8.560 10.690 1.00 0.00 H new ATOM 2049 N ASP B 87 2.491 6.066 6.487 1.00 0.00 N ATOM 2050 CA ASP B 87 3.428 4.985 6.769 1.00 0.00 C ATOM 2051 C ASP B 87 4.326 4.742 5.562 1.00 0.00 C ATOM 2052 O ASP B 87 5.505 4.408 5.708 1.00 0.00 O ATOM 2053 CB ASP B 87 2.686 3.703 7.146 1.00 0.00 C ATOM 2054 CG ASP B 87 3.552 2.750 7.947 1.00 0.00 C ATOM 2055 OD1 ASP B 87 4.223 1.891 7.348 1.00 0.00 O ATOM 2056 OD2 ASP B 87 3.560 2.855 9.193 1.00 0.00 O ATOM 0 H ASP B 87 1.527 5.766 6.339 1.00 0.00 H new ATOM 0 HA ASP B 87 4.046 5.280 7.617 1.00 0.00 H new ATOM 0 HB2 ASP B 87 1.798 3.957 7.725 1.00 0.00 H new ATOM 0 HB3 ASP B 87 2.344 3.204 6.239 1.00 0.00 H new ATOM 2061 N LEU B 88 3.762 4.929 4.369 1.00 0.00 N ATOM 2062 CA LEU B 88 4.539 4.868 3.134 1.00 0.00 C ATOM 2063 C LEU B 88 5.653 5.903 3.168 1.00 0.00 C ATOM 2064 O LEU B 88 6.785 5.626 2.779 1.00 0.00 O ATOM 2065 CB LEU B 88 3.654 5.127 1.912 1.00 0.00 C ATOM 2066 CG LEU B 88 2.601 4.062 1.606 1.00 0.00 C ATOM 2067 CD1 LEU B 88 1.767 4.487 0.410 1.00 0.00 C ATOM 2068 CD2 LEU B 88 3.256 2.713 1.344 1.00 0.00 C ATOM 0 H LEU B 88 2.770 5.124 4.233 1.00 0.00 H new ATOM 0 HA LEU B 88 4.963 3.867 3.056 1.00 0.00 H new ATOM 0 HB2 LEU B 88 3.146 6.081 2.052 1.00 0.00 H new ATOM 0 HB3 LEU B 88 4.298 5.234 1.039 1.00 0.00 H new ATOM 0 HG LEU B 88 1.950 3.959 2.474 1.00 0.00 H new ATOM 0 HD11 LEU B 88 1.019 3.723 0.198 1.00 0.00 H new ATOM 0 HD12 LEU B 88 1.269 5.431 0.631 1.00 0.00 H new ATOM 0 HD13 LEU B 88 2.414 4.612 -0.458 1.00 0.00 H new ATOM 0 HD21 LEU B 88 2.487 1.971 1.129 1.00 0.00 H new ATOM 0 HD22 LEU B 88 3.930 2.795 0.491 1.00 0.00 H new ATOM 0 HD23 LEU B 88 3.820 2.406 2.224 1.00 0.00 H new ATOM 2080 N ALA B 89 5.313 7.097 3.644 1.00 0.00 N ATOM 2081 CA ALA B 89 6.276 8.180 3.779 1.00 0.00 C ATOM 2082 C ALA B 89 7.420 7.767 4.693 1.00 0.00 C ATOM 2083 O ALA B 89 8.587 8.004 4.388 1.00 0.00 O ATOM 2084 CB ALA B 89 5.592 9.427 4.316 1.00 0.00 C ATOM 0 H ALA B 89 4.369 7.338 3.945 1.00 0.00 H new ATOM 0 HA ALA B 89 6.687 8.403 2.794 1.00 0.00 H new ATOM 0 HB1 ALA B 89 6.323 10.230 4.413 1.00 0.00 H new ATOM 0 HB2 ALA B 89 4.804 9.734 3.629 1.00 0.00 H new ATOM 0 HB3 ALA B 89 5.158 9.212 5.293 1.00 0.00 H new ATOM 2090 N ALA B 90 7.073 7.132 5.806 1.00 0.00 N ATOM 2091 CA ALA B 90 8.068 6.656 6.754 1.00 0.00 C ATOM 2092 C ALA B 90 8.987 5.629 6.103 1.00 0.00 C ATOM 2093 O ALA B 90 10.210 5.754 6.163 1.00 0.00 O ATOM 2094 CB ALA B 90 7.390 6.062 7.979 1.00 0.00 C ATOM 0 H ALA B 90 6.108 6.935 6.073 1.00 0.00 H new ATOM 0 HA ALA B 90 8.675 7.505 7.069 1.00 0.00 H new ATOM 0 HB1 ALA B 90 8.147 5.710 8.679 1.00 0.00 H new ATOM 0 HB2 ALA B 90 6.777 6.824 8.460 1.00 0.00 H new ATOM 0 HB3 ALA B 90 6.759 5.226 7.676 1.00 0.00 H new ATOM 2100 N MET B 91 8.391 4.631 5.458 1.00 0.00 N ATOM 2101 CA MET B 91 9.157 3.566 4.817 1.00 0.00 C ATOM 2102 C MET B 91 10.015 4.112 3.681 1.00 0.00 C ATOM 2103 O MET B 91 11.132 3.646 3.459 1.00 0.00 O ATOM 2104 CB MET B 91 8.225 2.461 4.308 1.00 0.00 C ATOM 2105 CG MET B 91 7.575 1.666 5.432 1.00 0.00 C ATOM 2106 SD MET B 91 6.569 0.289 4.845 1.00 0.00 S ATOM 2107 CE MET B 91 5.264 1.157 3.982 1.00 0.00 C ATOM 0 H MET B 91 7.380 4.537 5.365 1.00 0.00 H new ATOM 0 HA MET B 91 9.824 3.137 5.564 1.00 0.00 H new ATOM 0 HB2 MET B 91 7.447 2.907 3.689 1.00 0.00 H new ATOM 0 HB3 MET B 91 8.790 1.782 3.670 1.00 0.00 H new ATOM 0 HG2 MET B 91 8.352 1.283 6.093 1.00 0.00 H new ATOM 0 HG3 MET B 91 6.952 2.334 6.027 1.00 0.00 H new ATOM 0 HE1 MET B 91 4.473 0.455 3.718 1.00 0.00 H new ATOM 0 HE2 MET B 91 4.857 1.936 4.627 1.00 0.00 H new ATOM 0 HE3 MET B 91 5.666 1.609 3.075 1.00 0.00 H new ATOM 2117 N LEU B 92 9.496 5.114 2.980 1.00 0.00 N ATOM 2118 CA LEU B 92 10.241 5.780 1.918 1.00 0.00 C ATOM 2119 C LEU B 92 11.528 6.389 2.465 1.00 0.00 C ATOM 2120 O LEU B 92 12.602 6.255 1.871 1.00 0.00 O ATOM 2121 CB LEU B 92 9.383 6.873 1.276 1.00 0.00 C ATOM 2122 CG LEU B 92 10.077 7.697 0.190 1.00 0.00 C ATOM 2123 CD1 LEU B 92 10.569 6.798 -0.934 1.00 0.00 C ATOM 2124 CD2 LEU B 92 9.134 8.763 -0.350 1.00 0.00 C ATOM 0 H LEU B 92 8.557 5.484 3.129 1.00 0.00 H new ATOM 0 HA LEU B 92 10.499 5.037 1.163 1.00 0.00 H new ATOM 0 HB2 LEU B 92 8.496 6.409 0.845 1.00 0.00 H new ATOM 0 HB3 LEU B 92 9.041 7.550 2.059 1.00 0.00 H new ATOM 0 HG LEU B 92 10.941 8.192 0.632 1.00 0.00 H new ATOM 0 HD11 LEU B 92 11.059 7.404 -1.696 1.00 0.00 H new ATOM 0 HD12 LEU B 92 11.278 6.072 -0.536 1.00 0.00 H new ATOM 0 HD13 LEU B 92 9.723 6.273 -1.377 1.00 0.00 H new ATOM 0 HD21 LEU B 92 9.642 9.341 -1.122 1.00 0.00 H new ATOM 0 HD22 LEU B 92 8.251 8.286 -0.776 1.00 0.00 H new ATOM 0 HD23 LEU B 92 8.832 9.426 0.461 1.00 0.00 H new ATOM 2136 N ARG B 93 11.416 7.047 3.608 1.00 0.00 N ATOM 2137 CA ARG B 93 12.562 7.685 4.232 1.00 0.00 C ATOM 2138 C ARG B 93 13.568 6.643 4.701 1.00 0.00 C ATOM 2139 O ARG B 93 14.769 6.898 4.721 1.00 0.00 O ATOM 2140 CB ARG B 93 12.117 8.562 5.401 1.00 0.00 C ATOM 2141 CG ARG B 93 11.149 9.658 4.989 1.00 0.00 C ATOM 2142 CD ARG B 93 10.740 10.519 6.170 1.00 0.00 C ATOM 2143 NE ARG B 93 10.216 9.723 7.279 1.00 0.00 N ATOM 2144 CZ ARG B 93 9.144 10.054 7.995 1.00 0.00 C ATOM 2145 NH1 ARG B 93 8.441 11.138 7.689 1.00 0.00 N ATOM 2146 NH2 ARG B 93 8.774 9.297 9.018 1.00 0.00 N ATOM 0 H ARG B 93 10.542 7.153 4.122 1.00 0.00 H new ATOM 0 HA ARG B 93 13.046 8.319 3.489 1.00 0.00 H new ATOM 0 HB2 ARG B 93 11.646 7.936 6.159 1.00 0.00 H new ATOM 0 HB3 ARG B 93 12.995 9.015 5.862 1.00 0.00 H new ATOM 0 HG2 ARG B 93 11.611 10.284 4.225 1.00 0.00 H new ATOM 0 HG3 ARG B 93 10.262 9.210 4.540 1.00 0.00 H new ATOM 0 HD2 ARG B 93 11.600 11.095 6.513 1.00 0.00 H new ATOM 0 HD3 ARG B 93 9.984 11.236 5.850 1.00 0.00 H new ATOM 0 HE ARG B 93 10.703 8.859 7.519 1.00 0.00 H new ATOM 0 HH11 ARG B 93 8.722 11.722 6.901 1.00 0.00 H new ATOM 0 HH12 ARG B 93 7.620 11.386 8.241 1.00 0.00 H new ATOM 0 HH21 ARG B 93 9.310 8.463 9.255 1.00 0.00 H new ATOM 0 HH22 ARG B 93 7.953 9.549 9.568 1.00 0.00 H new ATOM 2160 N ILE B 94 13.077 5.462 5.063 1.00 0.00 N ATOM 2161 CA ILE B 94 13.952 4.376 5.482 1.00 0.00 C ATOM 2162 C ILE B 94 14.707 3.792 4.288 1.00 0.00 C ATOM 2163 O ILE B 94 15.848 3.350 4.427 1.00 0.00 O ATOM 2164 CB ILE B 94 13.181 3.253 6.200 1.00 0.00 C ATOM 2165 CG1 ILE B 94 12.313 3.834 7.318 1.00 0.00 C ATOM 2166 CG2 ILE B 94 14.159 2.235 6.769 1.00 0.00 C ATOM 2167 CD1 ILE B 94 11.422 2.813 7.990 1.00 0.00 C ATOM 0 H ILE B 94 12.083 5.234 5.074 1.00 0.00 H new ATOM 0 HA ILE B 94 14.664 4.804 6.188 1.00 0.00 H new ATOM 0 HB ILE B 94 12.531 2.756 5.480 1.00 0.00 H new ATOM 0 HG12 ILE B 94 12.960 4.289 8.069 1.00 0.00 H new ATOM 0 HG13 ILE B 94 11.692 4.630 6.907 1.00 0.00 H new ATOM 0 HG21 ILE B 94 13.607 1.444 7.276 1.00 0.00 H new ATOM 0 HG22 ILE B 94 14.749 1.805 5.959 1.00 0.00 H new ATOM 0 HG23 ILE B 94 14.823 2.726 7.480 1.00 0.00 H new ATOM 0 HD11 ILE B 94 10.837 3.299 8.771 1.00 0.00 H new ATOM 0 HD12 ILE B 94 10.750 2.375 7.252 1.00 0.00 H new ATOM 0 HD13 ILE B 94 12.036 2.028 8.432 1.00 0.00 H new ATOM 2179 N ILE B 95 14.071 3.786 3.114 1.00 0.00 N ATOM 2180 CA ILE B 95 14.755 3.392 1.884 1.00 0.00 C ATOM 2181 C ILE B 95 15.965 4.295 1.675 1.00 0.00 C ATOM 2182 O ILE B 95 17.087 3.833 1.459 1.00 0.00 O ATOM 2183 CB ILE B 95 13.849 3.509 0.638 1.00 0.00 C ATOM 2184 CG1 ILE B 95 12.612 2.627 0.769 1.00 0.00 C ATOM 2185 CG2 ILE B 95 14.633 3.107 -0.601 1.00 0.00 C ATOM 2186 CD1 ILE B 95 12.915 1.156 0.612 1.00 0.00 C ATOM 0 H ILE B 95 13.093 4.047 2.991 1.00 0.00 H new ATOM 0 HA ILE B 95 15.045 2.348 1.998 1.00 0.00 H new ATOM 0 HB ILE B 95 13.521 4.545 0.551 1.00 0.00 H new ATOM 0 HG12 ILE B 95 12.154 2.796 1.744 1.00 0.00 H new ATOM 0 HG13 ILE B 95 11.880 2.924 0.018 1.00 0.00 H new ATOM 0 HG21 ILE B 95 13.993 3.190 -1.479 1.00 0.00 H new ATOM 0 HG22 ILE B 95 15.494 3.765 -0.716 1.00 0.00 H new ATOM 0 HG23 ILE B 95 14.975 2.077 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE B 95 11.994 0.582 0.716 1.00 0.00 H new ATOM 0 HD12 ILE B 95 13.346 0.976 -0.373 1.00 0.00 H new ATOM 0 HD13 ILE B 95 13.624 0.847 1.380 1.00 0.00 H new ATOM 2198 N ASN B 96 15.717 5.596 1.771 1.00 0.00 N ATOM 2199 CA ASN B 96 16.761 6.602 1.610 1.00 0.00 C ATOM 2200 C ASN B 96 17.763 6.535 2.756 1.00 0.00 C ATOM 2201 O ASN B 96 18.922 6.917 2.601 1.00 0.00 O ATOM 2202 CB ASN B 96 16.153 8.006 1.541 1.00 0.00 C ATOM 2203 CG ASN B 96 15.409 8.269 0.243 1.00 0.00 C ATOM 2204 OD1 ASN B 96 15.993 8.742 -0.733 1.00 0.00 O ATOM 2205 ND2 ASN B 96 14.115 7.975 0.220 1.00 0.00 N ATOM 0 H ASN B 96 14.792 5.982 1.961 1.00 0.00 H new ATOM 0 HA ASN B 96 17.281 6.393 0.675 1.00 0.00 H new ATOM 0 HB2 ASN B 96 15.469 8.141 2.379 1.00 0.00 H new ATOM 0 HB3 ASN B 96 16.946 8.745 1.655 1.00 0.00 H new ATOM 0 HD21 ASN B 96 13.570 8.140 -0.626 1.00 0.00 H new ATOM 0 HD22 ASN B 96 13.666 7.584 1.048 1.00 0.00 H new ATOM 2212 N ALA B 97 17.317 6.032 3.901 1.00 0.00 N ATOM 2213 CA ALA B 97 18.175 5.914 5.070 1.00 0.00 C ATOM 2214 C ALA B 97 19.220 4.822 4.870 1.00 0.00 C ATOM 2215 O ALA B 97 20.185 4.726 5.624 1.00 0.00 O ATOM 2216 CB ALA B 97 17.348 5.635 6.317 1.00 0.00 C ATOM 0 H ALA B 97 16.363 5.699 4.043 1.00 0.00 H new ATOM 0 HA ALA B 97 18.694 6.863 5.204 1.00 0.00 H new ATOM 0 HB1 ALA B 97 18.008 5.550 7.180 1.00 0.00 H new ATOM 0 HB2 ALA B 97 16.644 6.452 6.477 1.00 0.00 H new ATOM 0 HB3 ALA B 97 16.798 4.703 6.188 1.00 0.00 H new ATOM 2222 N ARG B 98 19.027 4.003 3.844 1.00 0.00 N ATOM 2223 CA ARG B 98 19.977 2.945 3.523 1.00 0.00 C ATOM 2224 C ARG B 98 21.096 3.492 2.645 1.00 0.00 C ATOM 2225 O ARG B 98 21.956 2.747 2.178 1.00 0.00 O ATOM 2226 CB ARG B 98 19.273 1.786 2.809 1.00 0.00 C ATOM 2227 CG ARG B 98 18.087 1.219 3.574 1.00 0.00 C ATOM 2228 CD ARG B 98 18.500 0.647 4.920 1.00 0.00 C ATOM 2229 NE ARG B 98 17.345 0.204 5.700 1.00 0.00 N ATOM 2230 CZ ARG B 98 17.423 -0.624 6.741 1.00 0.00 C ATOM 2231 NH1 ARG B 98 18.595 -1.128 7.109 1.00 0.00 N ATOM 2232 NH2 ARG B 98 16.328 -0.957 7.411 1.00 0.00 N ATOM 0 H ARG B 98 18.222 4.051 3.220 1.00 0.00 H new ATOM 0 HA ARG B 98 20.404 2.573 4.454 1.00 0.00 H new ATOM 0 HB2 ARG B 98 18.932 2.128 1.832 1.00 0.00 H new ATOM 0 HB3 ARG B 98 19.995 0.988 2.634 1.00 0.00 H new ATOM 0 HG2 ARG B 98 17.345 2.003 3.725 1.00 0.00 H new ATOM 0 HG3 ARG B 98 17.611 0.439 2.979 1.00 0.00 H new ATOM 0 HD2 ARG B 98 19.178 -0.193 4.765 1.00 0.00 H new ATOM 0 HD3 ARG B 98 19.050 1.402 5.482 1.00 0.00 H new ATOM 0 HE ARG B 98 16.424 0.550 5.431 1.00 0.00 H new ATOM 0 HH11 ARG B 98 19.440 -0.882 6.594 1.00 0.00 H new ATOM 0 HH12 ARG B 98 18.650 -1.761 7.907 1.00 0.00 H new ATOM 0 HH21 ARG B 98 15.423 -0.579 7.130 1.00 0.00 H new ATOM 0 HH22 ARG B 98 16.391 -1.591 8.208 1.00 0.00 H new