USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1101 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 5 LYS NZ :NH3+ -125:sc= 0.609 (180deg=-1.63!) USER MOD Single : A 7 LYS NZ :NH3+ -130:sc= -1.23 (180deg=-4.37!) USER MOD Single : A 14 GLN : amide:sc= -0.936 K(o=-0.94,f=-2.8) USER MOD Single : A 20 ASN : amide:sc= -0.0642 K(o=-0.064,f=-1.6) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 27 GLN : amide:sc= 0.43 K(o=0.43,f=-4.2!) USER MOD Single : A 28 LYS NZ :NH3+ -175:sc=-0.00272 (180deg=-0.0389) USER MOD Single : A 29 GLN : amide:sc= -0.165 K(o=-0.16,f=-3.5!) USER MOD Single : A 31 LYS NZ :NH3+ 177:sc= 0.886 (180deg=0.873) USER MOD Single : A 32 LYS NZ :NH3+ 173:sc= -0.0097 (180deg=-0.0912) USER MOD Single : A 34 THR OG1 : rot -76:sc= 1.03 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -169:sc= 0.491 (180deg=0.423) USER MOD Single : A 40 LYS NZ :NH3+ -173:sc=-0.00236 (180deg=-0.0491) USER MOD Single : A 54 LYS NZ :NH3+ -169:sc= 0.361 (180deg=0.295) USER MOD Single : A 57 THR OG1 : rot 29:sc= -0.47 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 MET CE :methyl -142:sc= 0 (180deg=-0.5) USER MOD Single : B 5 LYS NZ :NH3+ 173:sc= 0.528 (180deg=0.493) USER MOD Single : B 7 LYS NZ :NH3+ 161:sc= -0.54 (180deg=-1.5!) USER MOD Single : B 14 GLN : amide:sc= -0.367 K(o=-0.37,f=-2.7!) USER MOD Single : B 20 ASN : amide:sc= -0.281 K(o=-0.28,f=-3.1!) USER MOD Single : B 22 THR OG1 : rot -52:sc= 1.17 USER MOD Single : B 26 THR OG1 : rot 138:sc= 0.0982 USER MOD Single : B 27 GLN : amide:sc= -0.916 K(o=-0.92,f=-2.8!) USER MOD Single : B 28 LYS NZ :NH3+ 169:sc= -0.0231 (180deg=-0.209) USER MOD Single : B 29 GLN : amide:sc= -0.227 K(o=-0.23,f=-3.5!) USER MOD Single : B 31 LYS NZ :NH3+ 161:sc= 0.774 (180deg=0.706) USER MOD Single : B 32 LYS NZ :NH3+ -171:sc=-0.00856 (180deg=-0.0908) USER MOD Single : B 34 THR OG1 : rot -70:sc= 1.08 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 LYS NZ :NH3+ -170:sc= 0.594 (180deg=0.485) USER MOD Single : B 54 LYS NZ :NH3+ -151:sc= 0.793 (180deg=0.349) USER MOD Single : B 57 THR OG1 : rot 71:sc= 0.403 USER MOD Single : B 58 SER OG : rot -26:sc= -0.0402 USER MOD Single : B 67 LYS NZ :NH3+ -133:sc= -0.397 (180deg=-1.52!) USER MOD ----------------------------------------------------------------- ATOM 59 N LEU A 4 2.722 11.056 1.512 1.00 51.40 N ATOM 60 CA LEU A 4 2.218 9.668 1.696 1.00 3.44 C ATOM 61 C LEU A 4 3.377 8.645 1.774 1.00 54.11 C ATOM 62 O LEU A 4 3.430 7.831 2.696 1.00 22.21 O ATOM 63 CB LEU A 4 1.222 9.314 0.548 1.00 13.50 C ATOM 64 CG LEU A 4 0.587 7.866 0.571 1.00 43.41 C ATOM 65 CD1 LEU A 4 -0.849 7.873 0.030 1.00 55.34 C ATOM 66 CD2 LEU A 4 1.432 6.820 -0.209 1.00 1.21 C ATOM 0 HA LEU A 4 1.689 9.615 2.648 1.00 3.44 H new ATOM 0 HB2 LEU A 4 0.410 10.041 0.568 1.00 13.50 H new ATOM 0 HB3 LEU A 4 1.741 9.442 -0.402 1.00 13.50 H new ATOM 0 HG LEU A 4 0.576 7.568 1.619 1.00 43.41 H new ATOM 0 HD11 LEU A 4 -1.254 6.862 0.060 1.00 55.34 H new ATOM 0 HD12 LEU A 4 -1.466 8.530 0.644 1.00 55.34 H new ATOM 0 HD13 LEU A 4 -0.848 8.233 -0.999 1.00 55.34 H new ATOM 0 HD21 LEU A 4 0.945 5.846 -0.157 1.00 1.21 H new ATOM 0 HD22 LEU A 4 1.519 7.127 -1.251 1.00 1.21 H new ATOM 0 HD23 LEU A 4 2.426 6.752 0.233 1.00 1.21 H new ATOM 78 N LYS A 5 4.289 8.725 0.793 1.00 32.25 N ATOM 79 CA LYS A 5 5.487 7.860 0.688 1.00 15.41 C ATOM 80 C LYS A 5 6.374 7.916 1.962 1.00 20.14 C ATOM 81 O LYS A 5 6.816 6.880 2.468 1.00 3.21 O ATOM 82 CB LYS A 5 6.307 8.300 -0.554 1.00 12.52 C ATOM 83 CG LYS A 5 7.489 7.376 -0.925 1.00 24.20 C ATOM 84 CD LYS A 5 8.220 7.832 -2.205 1.00 4.11 C ATOM 85 CE LYS A 5 9.264 6.810 -2.687 1.00 31.25 C ATOM 86 NZ LYS A 5 10.335 6.577 -1.683 1.00 34.52 N ATOM 0 H LYS A 5 4.219 9.403 0.034 1.00 32.25 H new ATOM 0 HA LYS A 5 5.155 6.827 0.584 1.00 15.41 H new ATOM 0 HB2 LYS A 5 5.634 8.364 -1.409 1.00 12.52 H new ATOM 0 HB3 LYS A 5 6.693 9.304 -0.377 1.00 12.52 H new ATOM 0 HG2 LYS A 5 8.197 7.348 -0.097 1.00 24.20 H new ATOM 0 HG3 LYS A 5 7.121 6.359 -1.064 1.00 24.20 H new ATOM 0 HD2 LYS A 5 7.489 8.000 -2.996 1.00 4.11 H new ATOM 0 HD3 LYS A 5 8.711 8.787 -2.018 1.00 4.11 H new ATOM 0 HE2 LYS A 5 8.768 5.866 -2.910 1.00 31.25 H new ATOM 0 HE3 LYS A 5 9.711 7.163 -3.616 1.00 31.25 H new ATOM 0 HZ1 LYS A 5 11.263 6.749 -2.119 1.00 34.52 H new ATOM 0 HZ2 LYS A 5 10.204 7.224 -0.880 1.00 34.52 H new ATOM 0 HZ3 LYS A 5 10.288 5.594 -1.347 1.00 34.52 H new ATOM 100 N GLU A 6 6.597 9.139 2.481 1.00 30.34 N ATOM 101 CA GLU A 6 7.496 9.378 3.632 1.00 14.14 C ATOM 102 C GLU A 6 6.883 8.859 4.957 1.00 31.30 C ATOM 103 O GLU A 6 7.549 8.161 5.733 1.00 61.44 O ATOM 104 CB GLU A 6 7.830 10.891 3.742 1.00 0.32 C ATOM 105 CG GLU A 6 8.365 11.541 2.443 1.00 35.31 C ATOM 106 CD GLU A 6 9.521 10.762 1.788 1.00 55.23 C ATOM 107 OE1 GLU A 6 10.638 10.749 2.350 1.00 3.44 O ATOM 108 OE2 GLU A 6 9.317 10.154 0.711 1.00 40.11 O ATOM 0 H GLU A 6 6.162 9.987 2.118 1.00 30.34 H new ATOM 0 HA GLU A 6 8.416 8.820 3.459 1.00 14.14 H new ATOM 0 HB2 GLU A 6 6.932 11.424 4.053 1.00 0.32 H new ATOM 0 HB3 GLU A 6 8.571 11.027 4.530 1.00 0.32 H new ATOM 0 HG2 GLU A 6 7.547 11.628 1.728 1.00 35.31 H new ATOM 0 HG3 GLU A 6 8.702 12.553 2.667 1.00 35.31 H new ATOM 115 N LYS A 7 5.600 9.204 5.199 1.00 53.11 N ATOM 116 CA LYS A 7 4.881 8.793 6.427 1.00 34.22 C ATOM 117 C LYS A 7 4.508 7.290 6.397 1.00 50.41 C ATOM 118 O LYS A 7 4.270 6.692 7.443 1.00 1.41 O ATOM 119 CB LYS A 7 3.639 9.710 6.662 1.00 0.31 C ATOM 120 CG LYS A 7 2.438 9.535 5.677 1.00 10.12 C ATOM 121 CD LYS A 7 1.306 8.643 6.252 1.00 4.13 C ATOM 122 CE LYS A 7 0.634 9.257 7.500 1.00 51.21 C ATOM 123 NZ LYS A 7 -0.404 8.370 8.082 1.00 14.13 N ATOM 0 H LYS A 7 5.039 9.767 4.560 1.00 53.11 H new ATOM 0 HA LYS A 7 5.551 8.922 7.277 1.00 34.22 H new ATOM 0 HB2 LYS A 7 3.276 9.537 7.675 1.00 0.31 H new ATOM 0 HB3 LYS A 7 3.969 10.748 6.615 1.00 0.31 H new ATOM 0 HG2 LYS A 7 2.031 10.516 5.432 1.00 10.12 H new ATOM 0 HG3 LYS A 7 2.800 9.098 4.746 1.00 10.12 H new ATOM 0 HD2 LYS A 7 0.552 8.480 5.482 1.00 4.13 H new ATOM 0 HD3 LYS A 7 1.715 7.666 6.509 1.00 4.13 H new ATOM 0 HE2 LYS A 7 1.394 9.464 8.253 1.00 51.21 H new ATOM 0 HE3 LYS A 7 0.182 10.212 7.232 1.00 51.21 H new ATOM 0 HZ1 LYS A 7 -1.280 8.911 8.229 1.00 14.13 H new ATOM 0 HZ2 LYS A 7 -0.590 7.580 7.432 1.00 14.13 H new ATOM 0 HZ3 LYS A 7 -0.070 7.997 8.994 1.00 14.13 H new ATOM 137 N ALA A 8 4.466 6.699 5.181 1.00 50.33 N ATOM 138 CA ALA A 8 4.330 5.231 4.996 1.00 73.53 C ATOM 139 C ALA A 8 5.543 4.489 5.596 1.00 50.03 C ATOM 140 O ALA A 8 5.395 3.419 6.188 1.00 45.53 O ATOM 141 CB ALA A 8 4.169 4.883 3.507 1.00 5.43 C ATOM 0 H ALA A 8 4.525 7.219 4.305 1.00 50.33 H new ATOM 0 HA ALA A 8 3.434 4.905 5.524 1.00 73.53 H new ATOM 0 HB1 ALA A 8 4.071 3.803 3.394 1.00 5.43 H new ATOM 0 HB2 ALA A 8 3.277 5.371 3.114 1.00 5.43 H new ATOM 0 HB3 ALA A 8 5.044 5.227 2.956 1.00 5.43 H new ATOM 147 N GLY A 9 6.741 5.094 5.435 1.00 23.14 N ATOM 148 CA GLY A 9 7.972 4.599 6.064 1.00 43.25 C ATOM 149 C GLY A 9 7.991 4.750 7.595 1.00 73.03 C ATOM 150 O GLY A 9 8.541 3.899 8.304 1.00 3.14 O ATOM 0 H GLY A 9 6.875 5.932 4.869 1.00 23.14 H new ATOM 0 HA2 GLY A 9 8.101 3.547 5.810 1.00 43.25 H new ATOM 0 HA3 GLY A 9 8.824 5.134 5.645 1.00 43.25 H new ATOM 154 N ALA A 10 7.392 5.848 8.096 1.00 22.03 N ATOM 155 CA ALA A 10 7.231 6.095 9.550 1.00 22.15 C ATOM 156 C ALA A 10 6.250 5.081 10.202 1.00 50.03 C ATOM 157 O ALA A 10 6.440 4.658 11.351 1.00 53.20 O ATOM 158 CB ALA A 10 6.751 7.534 9.787 1.00 35.23 C ATOM 0 H ALA A 10 7.006 6.588 7.510 1.00 22.03 H new ATOM 0 HA ALA A 10 8.203 5.957 10.023 1.00 22.15 H new ATOM 0 HB1 ALA A 10 6.635 7.707 10.857 1.00 35.23 H new ATOM 0 HB2 ALA A 10 7.483 8.233 9.383 1.00 35.23 H new ATOM 0 HB3 ALA A 10 5.793 7.685 9.289 1.00 35.23 H new ATOM 164 N LEU A 11 5.202 4.707 9.443 1.00 22.40 N ATOM 165 CA LEU A 11 4.227 3.668 9.839 1.00 54.44 C ATOM 166 C LEU A 11 4.834 2.254 9.705 1.00 45.21 C ATOM 167 O LEU A 11 4.505 1.364 10.484 1.00 21.45 O ATOM 168 CB LEU A 11 2.956 3.795 8.960 1.00 61.01 C ATOM 169 CG LEU A 11 2.117 5.094 9.168 1.00 13.41 C ATOM 170 CD1 LEU A 11 1.085 5.282 8.041 1.00 60.40 C ATOM 171 CD2 LEU A 11 1.444 5.091 10.558 1.00 34.22 C ATOM 0 H LEU A 11 5.005 5.119 8.531 1.00 22.40 H new ATOM 0 HA LEU A 11 3.963 3.817 10.886 1.00 54.44 H new ATOM 0 HB2 LEU A 11 3.254 3.741 7.913 1.00 61.01 H new ATOM 0 HB3 LEU A 11 2.315 2.935 9.154 1.00 61.01 H new ATOM 0 HG LEU A 11 2.796 5.945 9.126 1.00 13.41 H new ATOM 0 HD11 LEU A 11 0.517 6.196 8.216 1.00 60.40 H new ATOM 0 HD12 LEU A 11 1.601 5.353 7.083 1.00 60.40 H new ATOM 0 HD13 LEU A 11 0.405 4.430 8.024 1.00 60.40 H new ATOM 0 HD21 LEU A 11 0.864 6.005 10.683 1.00 34.22 H new ATOM 0 HD22 LEU A 11 0.784 4.228 10.641 1.00 34.22 H new ATOM 0 HD23 LEU A 11 2.209 5.038 11.333 1.00 34.22 H new ATOM 183 N ALA A 12 5.730 2.073 8.714 1.00 10.12 N ATOM 184 CA ALA A 12 6.392 0.772 8.430 1.00 3.31 C ATOM 185 C ALA A 12 7.114 0.188 9.655 1.00 2.33 C ATOM 186 O ALA A 12 7.050 -1.021 9.909 1.00 25.45 O ATOM 187 CB ALA A 12 7.378 0.918 7.276 1.00 3.53 C ATOM 0 H ALA A 12 6.019 2.822 8.084 1.00 10.12 H new ATOM 0 HA ALA A 12 5.600 0.075 8.157 1.00 3.31 H new ATOM 0 HB1 ALA A 12 7.854 -0.043 7.081 1.00 3.53 H new ATOM 0 HB2 ALA A 12 6.847 1.248 6.383 1.00 3.53 H new ATOM 0 HB3 ALA A 12 8.139 1.653 7.538 1.00 3.53 H new ATOM 193 N GLY A 13 7.795 1.074 10.402 1.00 14.53 N ATOM 194 CA GLY A 13 8.405 0.712 11.680 1.00 74.22 C ATOM 195 C GLY A 13 7.400 0.103 12.666 1.00 22.32 C ATOM 196 O GLY A 13 7.634 -0.977 13.196 1.00 40.14 O ATOM 0 H GLY A 13 7.934 2.049 10.136 1.00 14.53 H new ATOM 0 HA2 GLY A 13 9.211 0.000 11.504 1.00 74.22 H new ATOM 0 HA3 GLY A 13 8.854 1.599 12.127 1.00 74.22 H new ATOM 200 N GLN A 14 6.248 0.787 12.832 1.00 20.14 N ATOM 201 CA GLN A 14 5.167 0.377 13.768 1.00 14.24 C ATOM 202 C GLN A 14 4.611 -1.041 13.452 1.00 73.23 C ATOM 203 O GLN A 14 4.569 -1.913 14.330 1.00 13.00 O ATOM 204 CB GLN A 14 3.990 1.391 13.708 1.00 10.01 C ATOM 205 CG GLN A 14 4.375 2.864 13.921 1.00 43.23 C ATOM 206 CD GLN A 14 3.180 3.818 13.817 1.00 14.54 C ATOM 207 OE1 GLN A 14 2.047 3.455 14.113 1.00 32.31 O ATOM 208 NE2 GLN A 14 3.418 5.043 13.406 1.00 32.24 N ATOM 0 H GLN A 14 6.036 1.644 12.321 1.00 20.14 H new ATOM 0 HA GLN A 14 5.610 0.358 14.764 1.00 14.24 H new ATOM 0 HB2 GLN A 14 3.502 1.298 12.738 1.00 10.01 H new ATOM 0 HB3 GLN A 14 3.255 1.113 14.463 1.00 10.01 H new ATOM 0 HG2 GLN A 14 4.836 2.975 14.902 1.00 43.23 H new ATOM 0 HG3 GLN A 14 5.125 3.148 13.182 1.00 43.23 H new ATOM 0 HE21 GLN A 14 4.368 5.324 13.165 1.00 32.24 H new ATOM 0 HE22 GLN A 14 2.653 5.713 13.328 1.00 32.24 H new ATOM 217 N ILE A 15 4.195 -1.250 12.180 1.00 42.14 N ATOM 218 CA ILE A 15 3.581 -2.529 11.726 1.00 24.12 C ATOM 219 C ILE A 15 4.609 -3.697 11.830 1.00 3.01 C ATOM 220 O ILE A 15 4.258 -4.801 12.254 1.00 12.22 O ATOM 221 CB ILE A 15 2.956 -2.427 10.252 1.00 61.45 C ATOM 222 CG1 ILE A 15 1.643 -1.548 10.203 1.00 11.11 C ATOM 223 CG2 ILE A 15 2.640 -3.831 9.665 1.00 75.51 C ATOM 224 CD1 ILE A 15 1.790 -0.079 10.528 1.00 61.44 C ATOM 0 H ILE A 15 4.272 -0.548 11.444 1.00 42.14 H new ATOM 0 HA ILE A 15 2.747 -2.741 12.395 1.00 24.12 H new ATOM 0 HB ILE A 15 3.720 -1.940 9.647 1.00 61.45 H new ATOM 0 HG12 ILE A 15 1.215 -1.633 9.204 1.00 11.11 H new ATOM 0 HG13 ILE A 15 0.921 -1.978 10.897 1.00 11.11 H new ATOM 0 HG21 ILE A 15 2.218 -3.721 8.666 1.00 75.51 H new ATOM 0 HG22 ILE A 15 3.557 -4.417 9.609 1.00 75.51 H new ATOM 0 HG23 ILE A 15 1.922 -4.341 10.308 1.00 75.51 H new ATOM 0 HD11 ILE A 15 0.817 0.408 10.458 1.00 61.44 H new ATOM 0 HD12 ILE A 15 2.180 0.033 11.540 1.00 61.44 H new ATOM 0 HD13 ILE A 15 2.479 0.383 9.821 1.00 61.44 H new ATOM 236 N TRP A 16 5.884 -3.420 11.485 1.00 64.24 N ATOM 237 CA TRP A 16 6.992 -4.402 11.622 1.00 22.14 C ATOM 238 C TRP A 16 7.204 -4.822 13.106 1.00 60.21 C ATOM 239 O TRP A 16 7.397 -6.005 13.399 1.00 72.31 O ATOM 240 CB TRP A 16 8.302 -3.812 11.032 1.00 23.24 C ATOM 241 CG TRP A 16 9.454 -4.796 10.969 1.00 35.42 C ATOM 242 CD1 TRP A 16 9.748 -5.643 9.937 1.00 53.11 C ATOM 243 CD2 TRP A 16 10.454 -5.034 11.977 1.00 41.33 C ATOM 244 NE1 TRP A 16 10.857 -6.389 10.242 1.00 14.12 N ATOM 245 CE2 TRP A 16 11.309 -6.035 11.486 1.00 3.40 C ATOM 246 CE3 TRP A 16 10.701 -4.495 13.248 1.00 45.05 C ATOM 247 CZ2 TRP A 16 12.393 -6.516 12.221 1.00 40.35 C ATOM 248 CZ3 TRP A 16 11.775 -4.966 13.975 1.00 71.34 C ATOM 249 CH2 TRP A 16 12.612 -5.969 13.459 1.00 20.13 C ATOM 0 H TRP A 16 6.178 -2.519 11.107 1.00 64.24 H new ATOM 0 HA TRP A 16 6.720 -5.297 11.063 1.00 22.14 H new ATOM 0 HB2 TRP A 16 8.100 -3.442 10.027 1.00 23.24 H new ATOM 0 HB3 TRP A 16 8.604 -2.954 11.633 1.00 23.24 H new ATOM 0 HD1 TRP A 16 9.188 -5.714 9.016 1.00 53.11 H new ATOM 0 HE1 TRP A 16 11.279 -7.095 9.639 1.00 14.12 H new ATOM 0 HE3 TRP A 16 10.061 -3.724 13.651 1.00 45.05 H new ATOM 0 HZ2 TRP A 16 13.036 -7.290 11.829 1.00 40.35 H new ATOM 0 HZ3 TRP A 16 11.975 -4.558 14.955 1.00 71.34 H new ATOM 0 HH2 TRP A 16 13.446 -6.317 14.050 1.00 20.13 H new ATOM 260 N GLU A 17 7.163 -3.831 14.025 1.00 5.52 N ATOM 261 CA GLU A 17 7.297 -4.051 15.494 1.00 44.10 C ATOM 262 C GLU A 17 6.150 -4.927 16.068 1.00 62.33 C ATOM 263 O GLU A 17 6.285 -5.507 17.148 1.00 44.42 O ATOM 264 CB GLU A 17 7.378 -2.690 16.247 1.00 1.51 C ATOM 265 CG GLU A 17 8.671 -1.885 15.987 1.00 72.23 C ATOM 266 CD GLU A 17 8.651 -0.488 16.638 1.00 62.31 C ATOM 267 OE1 GLU A 17 9.041 -0.358 17.820 1.00 33.42 O ATOM 268 OE2 GLU A 17 8.228 0.487 15.979 1.00 25.41 O ATOM 0 H GLU A 17 7.036 -2.851 13.774 1.00 5.52 H new ATOM 0 HA GLU A 17 8.226 -4.598 15.652 1.00 44.10 H new ATOM 0 HB2 GLU A 17 6.522 -2.080 15.959 1.00 1.51 H new ATOM 0 HB3 GLU A 17 7.291 -2.877 17.317 1.00 1.51 H new ATOM 0 HG2 GLU A 17 9.524 -2.446 16.369 1.00 72.23 H new ATOM 0 HG3 GLU A 17 8.815 -1.777 14.912 1.00 72.23 H new ATOM 275 N ALA A 18 5.003 -4.961 15.373 1.00 71.20 N ATOM 276 CA ALA A 18 3.902 -5.892 15.703 1.00 21.25 C ATOM 277 C ALA A 18 4.247 -7.349 15.277 1.00 51.33 C ATOM 278 O ALA A 18 3.966 -8.303 16.008 1.00 15.32 O ATOM 279 CB ALA A 18 2.602 -5.414 15.033 1.00 64.32 C ATOM 0 H ALA A 18 4.809 -4.355 14.576 1.00 71.20 H new ATOM 0 HA ALA A 18 3.762 -5.897 16.784 1.00 21.25 H new ATOM 0 HB1 ALA A 18 1.792 -6.102 15.278 1.00 64.32 H new ATOM 0 HB2 ALA A 18 2.352 -4.416 15.394 1.00 64.32 H new ATOM 0 HB3 ALA A 18 2.739 -5.385 13.952 1.00 64.32 H new ATOM 285 N LEU A 19 4.867 -7.505 14.093 1.00 13.03 N ATOM 286 CA LEU A 19 5.163 -8.839 13.495 1.00 35.34 C ATOM 287 C LEU A 19 6.460 -9.501 14.049 1.00 43.51 C ATOM 288 O LEU A 19 6.561 -10.738 14.034 1.00 13.33 O ATOM 289 CB LEU A 19 5.241 -8.731 11.940 1.00 25.15 C ATOM 290 CG LEU A 19 3.886 -8.762 11.153 1.00 60.13 C ATOM 291 CD1 LEU A 19 2.929 -7.640 11.586 1.00 34.12 C ATOM 292 CD2 LEU A 19 4.137 -8.714 9.630 1.00 71.22 C ATOM 0 H LEU A 19 5.179 -6.721 13.520 1.00 13.03 H new ATOM 0 HA LEU A 19 4.337 -9.489 13.784 1.00 35.34 H new ATOM 0 HB2 LEU A 19 5.756 -7.803 11.691 1.00 25.15 H new ATOM 0 HB3 LEU A 19 5.863 -9.548 11.575 1.00 25.15 H new ATOM 0 HG LEU A 19 3.397 -9.705 11.397 1.00 60.13 H new ATOM 0 HD11 LEU A 19 2.006 -7.707 11.010 1.00 34.12 H new ATOM 0 HD12 LEU A 19 2.703 -7.744 12.647 1.00 34.12 H new ATOM 0 HD13 LEU A 19 3.398 -6.673 11.408 1.00 34.12 H new ATOM 0 HD21 LEU A 19 3.183 -8.737 9.103 1.00 71.22 H new ATOM 0 HD22 LEU A 19 4.669 -7.797 9.378 1.00 71.22 H new ATOM 0 HD23 LEU A 19 4.736 -9.575 9.333 1.00 71.22 H new ATOM 304 N ASN A 20 7.453 -8.703 14.506 1.00 31.13 N ATOM 305 CA ASN A 20 8.769 -9.251 14.945 1.00 44.31 C ATOM 306 C ASN A 20 8.646 -10.103 16.240 1.00 13.45 C ATOM 307 O ASN A 20 7.941 -9.730 17.187 1.00 70.31 O ATOM 308 CB ASN A 20 9.849 -8.138 15.096 1.00 52.22 C ATOM 309 CG ASN A 20 9.662 -7.196 16.290 1.00 2.34 C ATOM 310 OD1 ASN A 20 8.561 -6.943 16.734 1.00 4.53 O ATOM 311 ND2 ASN A 20 10.752 -6.673 16.821 1.00 1.42 N ATOM 0 H ASN A 20 7.375 -7.689 14.582 1.00 31.13 H new ATOM 0 HA ASN A 20 9.104 -9.918 14.151 1.00 44.31 H new ATOM 0 HB2 ASN A 20 10.826 -8.613 15.180 1.00 52.22 H new ATOM 0 HB3 ASN A 20 9.862 -7.542 14.184 1.00 52.22 H new ATOM 0 HD21 ASN A 20 10.678 -6.043 17.620 1.00 1.42 H new ATOM 0 HD22 ASN A 20 11.668 -6.899 16.432 1.00 1.42 H new ATOM 318 N GLY A 21 9.313 -11.271 16.240 1.00 11.34 N ATOM 319 CA GLY A 21 9.227 -12.240 17.346 1.00 30.13 C ATOM 320 C GLY A 21 7.890 -13.002 17.404 1.00 23.41 C ATOM 321 O GLY A 21 7.646 -13.759 18.343 1.00 12.15 O ATOM 0 H GLY A 21 9.923 -11.568 15.478 1.00 11.34 H new ATOM 0 HA2 GLY A 21 10.040 -12.959 17.250 1.00 30.13 H new ATOM 0 HA3 GLY A 21 9.376 -11.714 18.289 1.00 30.13 H new ATOM 325 N THR A 22 7.044 -12.805 16.375 1.00 1.01 N ATOM 326 CA THR A 22 5.679 -13.379 16.294 1.00 3.01 C ATOM 327 C THR A 22 5.537 -14.245 15.016 1.00 5.45 C ATOM 328 O THR A 22 6.277 -14.055 14.042 1.00 33.42 O ATOM 329 CB THR A 22 4.602 -12.219 16.290 1.00 45.12 C ATOM 330 OG1 THR A 22 4.844 -11.335 17.401 1.00 21.14 O ATOM 331 CG2 THR A 22 3.150 -12.729 16.382 1.00 61.22 C ATOM 0 H THR A 22 7.288 -12.236 15.564 1.00 1.01 H new ATOM 0 HA THR A 22 5.512 -14.012 17.165 1.00 3.01 H new ATOM 0 HB THR A 22 4.709 -11.704 15.335 1.00 45.12 H new ATOM 0 HG1 THR A 22 4.178 -10.616 17.398 1.00 21.14 H new ATOM 0 HG21 THR A 22 2.465 -11.881 16.374 1.00 61.22 H new ATOM 0 HG22 THR A 22 2.937 -13.375 15.531 1.00 61.22 H new ATOM 0 HG23 THR A 22 3.020 -13.292 17.306 1.00 61.22 H new ATOM 339 N GLU A 23 4.565 -15.186 15.022 1.00 24.51 N ATOM 340 CA GLU A 23 4.222 -16.031 13.841 1.00 22.30 C ATOM 341 C GLU A 23 3.542 -15.213 12.705 1.00 65.43 C ATOM 342 O GLU A 23 3.269 -15.741 11.623 1.00 73.52 O ATOM 343 CB GLU A 23 3.264 -17.166 14.282 1.00 73.22 C ATOM 344 CG GLU A 23 1.879 -16.676 14.762 1.00 52.20 C ATOM 345 CD GLU A 23 0.928 -17.785 15.245 1.00 54.42 C ATOM 346 OE1 GLU A 23 1.186 -18.985 15.000 1.00 33.22 O ATOM 347 OE2 GLU A 23 -0.103 -17.454 15.865 1.00 25.13 O ATOM 0 H GLU A 23 3.993 -15.385 15.843 1.00 24.51 H new ATOM 0 HA GLU A 23 5.155 -16.437 13.450 1.00 22.30 H new ATOM 0 HB2 GLU A 23 3.125 -17.853 13.447 1.00 73.22 H new ATOM 0 HB3 GLU A 23 3.735 -17.732 15.086 1.00 73.22 H new ATOM 0 HG2 GLU A 23 2.024 -15.963 15.574 1.00 52.20 H new ATOM 0 HG3 GLU A 23 1.399 -16.136 13.946 1.00 52.20 H new ATOM 354 N GLY A 24 3.275 -13.926 12.979 1.00 5.05 N ATOM 355 CA GLY A 24 2.494 -13.064 12.101 1.00 51.32 C ATOM 356 C GLY A 24 1.161 -12.687 12.721 1.00 73.04 C ATOM 357 O GLY A 24 0.640 -13.408 13.576 1.00 52.14 O ATOM 0 H GLY A 24 3.601 -13.458 13.825 1.00 5.05 H new ATOM 0 HA2 GLY A 24 3.061 -12.160 11.881 1.00 51.32 H new ATOM 0 HA3 GLY A 24 2.323 -13.572 11.152 1.00 51.32 H new ATOM 361 N LEU A 25 0.593 -11.561 12.283 1.00 1.52 N ATOM 362 CA LEU A 25 -0.665 -11.025 12.844 1.00 61.15 C ATOM 363 C LEU A 25 -1.665 -10.669 11.731 1.00 43.33 C ATOM 364 O LEU A 25 -1.288 -10.482 10.569 1.00 14.13 O ATOM 365 CB LEU A 25 -0.380 -9.768 13.716 1.00 4.31 C ATOM 366 CG LEU A 25 0.413 -9.989 15.041 1.00 63.24 C ATOM 367 CD1 LEU A 25 0.600 -8.658 15.796 1.00 32.32 C ATOM 368 CD2 LEU A 25 -0.274 -11.043 15.935 1.00 22.03 C ATOM 0 H LEU A 25 0.985 -10.992 11.533 1.00 1.52 H new ATOM 0 HA LEU A 25 -1.106 -11.802 13.468 1.00 61.15 H new ATOM 0 HB2 LEU A 25 0.171 -9.051 13.107 1.00 4.31 H new ATOM 0 HB3 LEU A 25 -1.335 -9.306 13.966 1.00 4.31 H new ATOM 0 HG LEU A 25 1.400 -10.371 14.781 1.00 63.24 H new ATOM 0 HD11 LEU A 25 1.156 -8.837 16.717 1.00 32.32 H new ATOM 0 HD12 LEU A 25 1.153 -7.958 15.169 1.00 32.32 H new ATOM 0 HD13 LEU A 25 -0.376 -8.236 16.037 1.00 32.32 H new ATOM 0 HD21 LEU A 25 0.302 -11.175 16.851 1.00 22.03 H new ATOM 0 HD22 LEU A 25 -1.281 -10.708 16.185 1.00 22.03 H new ATOM 0 HD23 LEU A 25 -0.330 -11.992 15.402 1.00 22.03 H new ATOM 380 N THR A 26 -2.942 -10.580 12.119 1.00 55.41 N ATOM 381 CA THR A 26 -4.026 -10.071 11.253 1.00 71.33 C ATOM 382 C THR A 26 -4.120 -8.539 11.366 1.00 61.21 C ATOM 383 O THR A 26 -3.563 -7.950 12.305 1.00 44.54 O ATOM 384 CB THR A 26 -5.404 -10.686 11.653 1.00 70.45 C ATOM 385 OG1 THR A 26 -5.735 -10.312 13.005 1.00 51.11 O ATOM 386 CG2 THR A 26 -5.404 -12.221 11.521 1.00 35.30 C ATOM 0 H THR A 26 -3.260 -10.859 13.047 1.00 55.41 H new ATOM 0 HA THR A 26 -3.791 -10.359 10.228 1.00 71.33 H new ATOM 0 HB THR A 26 -6.155 -10.292 10.968 1.00 70.45 H new ATOM 0 HG1 THR A 26 -6.601 -10.700 13.249 1.00 51.11 H new ATOM 0 HG21 THR A 26 -6.380 -12.611 11.808 1.00 35.30 H new ATOM 0 HG22 THR A 26 -5.193 -12.497 10.488 1.00 35.30 H new ATOM 0 HG23 THR A 26 -4.639 -12.642 12.173 1.00 35.30 H new ATOM 394 N GLN A 27 -4.846 -7.907 10.422 1.00 14.40 N ATOM 395 CA GLN A 27 -5.025 -6.436 10.385 1.00 14.34 C ATOM 396 C GLN A 27 -5.512 -5.861 11.745 1.00 71.52 C ATOM 397 O GLN A 27 -4.970 -4.869 12.226 1.00 23.33 O ATOM 398 CB GLN A 27 -5.982 -6.045 9.220 1.00 43.55 C ATOM 399 CG GLN A 27 -7.353 -6.754 9.219 1.00 31.41 C ATOM 400 CD GLN A 27 -8.207 -6.391 8.004 1.00 73.31 C ATOM 401 OE1 GLN A 27 -8.152 -7.044 6.967 1.00 64.30 O ATOM 402 NE2 GLN A 27 -8.981 -5.332 8.109 1.00 1.01 N ATOM 0 H GLN A 27 -5.324 -8.397 9.666 1.00 14.40 H new ATOM 0 HA GLN A 27 -4.049 -5.987 10.202 1.00 14.34 H new ATOM 0 HB2 GLN A 27 -6.149 -4.969 9.256 1.00 43.55 H new ATOM 0 HB3 GLN A 27 -5.482 -6.258 8.275 1.00 43.55 H new ATOM 0 HG2 GLN A 27 -7.199 -7.833 9.240 1.00 31.41 H new ATOM 0 HG3 GLN A 27 -7.893 -6.492 10.129 1.00 31.41 H new ATOM 0 HE21 GLN A 27 -9.009 -4.806 8.982 1.00 1.01 H new ATOM 0 HE22 GLN A 27 -9.553 -5.038 7.317 1.00 1.01 H new ATOM 411 N LYS A 28 -6.489 -6.544 12.366 1.00 14.54 N ATOM 412 CA LYS A 28 -7.063 -6.165 13.683 1.00 4.15 C ATOM 413 C LYS A 28 -6.004 -6.126 14.818 1.00 22.23 C ATOM 414 O LYS A 28 -5.948 -5.162 15.593 1.00 60.02 O ATOM 415 CB LYS A 28 -8.192 -7.164 14.049 1.00 20.11 C ATOM 416 CG LYS A 28 -9.441 -7.089 13.145 1.00 51.24 C ATOM 417 CD LYS A 28 -10.257 -5.790 13.341 1.00 62.23 C ATOM 418 CE LYS A 28 -10.808 -5.633 14.774 1.00 42.22 C ATOM 419 NZ LYS A 28 -11.700 -6.761 15.168 1.00 50.54 N ATOM 0 H LYS A 28 -6.911 -7.384 11.970 1.00 14.54 H new ATOM 0 HA LYS A 28 -7.457 -5.153 13.590 1.00 4.15 H new ATOM 0 HB2 LYS A 28 -7.790 -8.176 14.006 1.00 20.11 H new ATOM 0 HB3 LYS A 28 -8.496 -6.985 15.080 1.00 20.11 H new ATOM 0 HG2 LYS A 28 -9.132 -7.163 12.102 1.00 51.24 H new ATOM 0 HG3 LYS A 28 -10.081 -7.947 13.349 1.00 51.24 H new ATOM 0 HD2 LYS A 28 -9.627 -4.933 13.104 1.00 62.23 H new ATOM 0 HD3 LYS A 28 -11.088 -5.780 12.635 1.00 62.23 H new ATOM 0 HE2 LYS A 28 -9.976 -5.570 15.475 1.00 42.22 H new ATOM 0 HE3 LYS A 28 -11.359 -4.695 14.848 1.00 42.22 H new ATOM 0 HZ1 LYS A 28 -12.111 -6.568 16.104 1.00 50.54 H new ATOM 0 HZ2 LYS A 28 -12.463 -6.861 14.469 1.00 50.54 H new ATOM 0 HZ3 LYS A 28 -11.149 -7.642 15.207 1.00 50.54 H new ATOM 433 N GLN A 29 -5.179 -7.188 14.903 1.00 70.01 N ATOM 434 CA GLN A 29 -4.139 -7.328 15.956 1.00 34.24 C ATOM 435 C GLN A 29 -3.080 -6.210 15.862 1.00 14.21 C ATOM 436 O GLN A 29 -2.653 -5.643 16.877 1.00 54.21 O ATOM 437 CB GLN A 29 -3.448 -8.711 15.841 1.00 1.42 C ATOM 438 CG GLN A 29 -4.376 -9.937 15.993 1.00 21.14 C ATOM 439 CD GLN A 29 -4.909 -10.177 17.417 1.00 41.43 C ATOM 440 OE1 GLN A 29 -5.129 -9.255 18.198 1.00 51.04 O ATOM 441 NE2 GLN A 29 -5.107 -11.427 17.775 1.00 64.00 N ATOM 0 H GLN A 29 -5.209 -7.972 14.251 1.00 70.01 H new ATOM 0 HA GLN A 29 -4.635 -7.244 16.923 1.00 34.24 H new ATOM 0 HB2 GLN A 29 -2.954 -8.770 14.871 1.00 1.42 H new ATOM 0 HB3 GLN A 29 -2.669 -8.772 16.600 1.00 1.42 H new ATOM 0 HG2 GLN A 29 -5.224 -9.817 15.319 1.00 21.14 H new ATOM 0 HG3 GLN A 29 -3.835 -10.826 15.669 1.00 21.14 H new ATOM 0 HE21 GLN A 29 -4.920 -12.182 17.115 1.00 64.00 H new ATOM 0 HE22 GLN A 29 -5.448 -11.641 18.712 1.00 64.00 H new ATOM 450 N ILE A 30 -2.681 -5.911 14.622 1.00 3.32 N ATOM 451 CA ILE A 30 -1.672 -4.886 14.318 1.00 25.01 C ATOM 452 C ILE A 30 -2.189 -3.466 14.659 1.00 53.43 C ATOM 453 O ILE A 30 -1.433 -2.655 15.188 1.00 11.34 O ATOM 454 CB ILE A 30 -1.243 -4.991 12.809 1.00 40.44 C ATOM 455 CG1 ILE A 30 -0.710 -6.432 12.512 1.00 4.42 C ATOM 456 CG2 ILE A 30 -0.183 -3.930 12.442 1.00 42.12 C ATOM 457 CD1 ILE A 30 -0.513 -6.775 11.045 1.00 72.03 C ATOM 0 H ILE A 30 -3.051 -6.376 13.793 1.00 3.32 H new ATOM 0 HA ILE A 30 -0.797 -5.065 14.942 1.00 25.01 H new ATOM 0 HB ILE A 30 -2.119 -4.797 12.191 1.00 40.44 H new ATOM 0 HG12 ILE A 30 0.242 -6.560 13.027 1.00 4.42 H new ATOM 0 HG13 ILE A 30 -1.405 -7.152 12.944 1.00 4.42 H new ATOM 0 HG21 ILE A 30 0.088 -4.035 11.391 1.00 42.12 H new ATOM 0 HG22 ILE A 30 -0.591 -2.934 12.614 1.00 42.12 H new ATOM 0 HG23 ILE A 30 0.703 -4.072 13.061 1.00 42.12 H new ATOM 0 HD11 ILE A 30 -0.141 -7.796 10.957 1.00 72.03 H new ATOM 0 HD12 ILE A 30 -1.464 -6.688 10.520 1.00 72.03 H new ATOM 0 HD13 ILE A 30 0.208 -6.087 10.604 1.00 72.03 H new ATOM 469 N LYS A 31 -3.487 -3.196 14.389 1.00 11.34 N ATOM 470 CA LYS A 31 -4.145 -1.909 14.764 1.00 60.23 C ATOM 471 C LYS A 31 -4.042 -1.632 16.280 1.00 62.31 C ATOM 472 O LYS A 31 -3.814 -0.497 16.690 1.00 33.10 O ATOM 473 CB LYS A 31 -5.645 -1.902 14.364 1.00 11.15 C ATOM 474 CG LYS A 31 -5.928 -1.957 12.849 1.00 1.31 C ATOM 475 CD LYS A 31 -7.440 -2.095 12.543 1.00 31.40 C ATOM 476 CE LYS A 31 -8.247 -0.821 12.872 1.00 3.33 C ATOM 477 NZ LYS A 31 -7.870 0.316 11.998 1.00 61.42 N ATOM 0 H LYS A 31 -4.107 -3.850 13.911 1.00 11.34 H new ATOM 0 HA LYS A 31 -3.616 -1.127 14.219 1.00 60.23 H new ATOM 0 HB2 LYS A 31 -6.134 -2.753 14.838 1.00 11.15 H new ATOM 0 HB3 LYS A 31 -6.107 -1.002 14.770 1.00 11.15 H new ATOM 0 HG2 LYS A 31 -5.544 -1.053 12.376 1.00 1.31 H new ATOM 0 HG3 LYS A 31 -5.392 -2.799 12.411 1.00 1.31 H new ATOM 0 HD2 LYS A 31 -7.570 -2.337 11.488 1.00 31.40 H new ATOM 0 HD3 LYS A 31 -7.845 -2.931 13.114 1.00 31.40 H new ATOM 0 HE2 LYS A 31 -9.311 -1.027 12.760 1.00 3.33 H new ATOM 0 HE3 LYS A 31 -8.083 -0.547 13.914 1.00 3.33 H new ATOM 0 HZ1 LYS A 31 -8.470 1.137 12.218 1.00 61.42 H new ATOM 0 HZ2 LYS A 31 -6.873 0.563 12.160 1.00 61.42 H new ATOM 0 HZ3 LYS A 31 -8.002 0.047 11.002 1.00 61.42 H new ATOM 491 N LYS A 32 -4.239 -2.683 17.099 1.00 72.42 N ATOM 492 CA LYS A 32 -4.205 -2.574 18.576 1.00 13.43 C ATOM 493 C LYS A 32 -2.771 -2.280 19.097 1.00 11.11 C ATOM 494 O LYS A 32 -2.589 -1.481 20.022 1.00 31.45 O ATOM 495 CB LYS A 32 -4.763 -3.881 19.207 1.00 72.11 C ATOM 496 CG LYS A 32 -4.913 -3.866 20.751 1.00 60.24 C ATOM 497 CD LYS A 32 -5.955 -2.843 21.265 1.00 71.23 C ATOM 498 CE LYS A 32 -7.382 -3.134 20.764 1.00 52.45 C ATOM 499 NZ LYS A 32 -7.846 -4.507 21.120 1.00 75.02 N ATOM 0 H LYS A 32 -4.425 -3.627 16.761 1.00 72.42 H new ATOM 0 HA LYS A 32 -4.832 -1.733 18.873 1.00 13.43 H new ATOM 0 HB2 LYS A 32 -5.738 -4.089 18.767 1.00 72.11 H new ATOM 0 HB3 LYS A 32 -4.106 -4.706 18.931 1.00 72.11 H new ATOM 0 HG2 LYS A 32 -5.198 -4.862 21.089 1.00 60.24 H new ATOM 0 HG3 LYS A 32 -3.945 -3.642 21.199 1.00 60.24 H new ATOM 0 HD2 LYS A 32 -5.951 -2.845 22.355 1.00 71.23 H new ATOM 0 HD3 LYS A 32 -5.661 -1.843 20.947 1.00 71.23 H new ATOM 0 HE2 LYS A 32 -8.068 -2.401 21.188 1.00 52.45 H new ATOM 0 HE3 LYS A 32 -7.415 -3.013 19.681 1.00 52.45 H new ATOM 0 HZ1 LYS A 32 -8.849 -4.611 20.866 1.00 75.02 H new ATOM 0 HZ2 LYS A 32 -7.282 -5.210 20.600 1.00 75.02 H new ATOM 0 HZ3 LYS A 32 -7.730 -4.658 22.142 1.00 75.02 H new ATOM 513 N ALA A 33 -1.767 -2.928 18.479 1.00 10.21 N ATOM 514 CA ALA A 33 -0.343 -2.774 18.864 1.00 30.53 C ATOM 515 C ALA A 33 0.212 -1.376 18.475 1.00 60.24 C ATOM 516 O ALA A 33 0.890 -0.710 19.264 1.00 31.21 O ATOM 517 CB ALA A 33 0.485 -3.891 18.211 1.00 21.13 C ATOM 0 H ALA A 33 -1.914 -3.572 17.701 1.00 10.21 H new ATOM 0 HA ALA A 33 -0.269 -2.854 19.949 1.00 30.53 H new ATOM 0 HB1 ALA A 33 1.532 -3.780 18.493 1.00 21.13 H new ATOM 0 HB2 ALA A 33 0.119 -4.860 18.549 1.00 21.13 H new ATOM 0 HB3 ALA A 33 0.392 -3.827 17.127 1.00 21.13 H new ATOM 523 N THR A 34 -0.113 -0.948 17.246 1.00 4.22 N ATOM 524 CA THR A 34 0.345 0.341 16.658 1.00 30.13 C ATOM 525 C THR A 34 -0.526 1.537 17.111 1.00 44.45 C ATOM 526 O THR A 34 -0.100 2.695 17.003 1.00 14.54 O ATOM 527 CB THR A 34 0.315 0.261 15.098 1.00 61.01 C ATOM 528 OG1 THR A 34 -1.037 0.050 14.642 1.00 21.24 O ATOM 529 CG2 THR A 34 1.203 -0.879 14.565 1.00 51.34 C ATOM 0 H THR A 34 -0.708 -1.487 16.617 1.00 4.22 H new ATOM 0 HA THR A 34 1.362 0.506 17.013 1.00 30.13 H new ATOM 0 HB THR A 34 0.702 1.206 14.717 1.00 61.01 H new ATOM 0 HG1 THR A 34 -1.288 -0.886 14.786 1.00 21.24 H new ATOM 0 HG21 THR A 34 1.154 -0.900 13.476 1.00 51.34 H new ATOM 0 HG22 THR A 34 2.234 -0.714 14.879 1.00 51.34 H new ATOM 0 HG23 THR A 34 0.851 -1.831 14.962 1.00 51.34 H new ATOM 537 N LYS A 35 -1.750 1.227 17.596 1.00 30.21 N ATOM 538 CA LYS A 35 -2.764 2.223 18.042 1.00 10.11 C ATOM 539 C LYS A 35 -3.275 3.102 16.864 1.00 73.11 C ATOM 540 O LYS A 35 -3.654 4.270 17.048 1.00 14.30 O ATOM 541 CB LYS A 35 -2.248 3.074 19.242 1.00 10.25 C ATOM 542 CG LYS A 35 -1.995 2.259 20.535 1.00 61.35 C ATOM 543 CD LYS A 35 -1.372 3.103 21.676 1.00 70.03 C ATOM 544 CE LYS A 35 -2.265 4.276 22.133 1.00 41.50 C ATOM 545 NZ LYS A 35 -1.599 5.116 23.166 1.00 74.44 N ATOM 0 H LYS A 35 -2.071 0.264 17.692 1.00 30.21 H new ATOM 0 HA LYS A 35 -3.627 1.664 18.404 1.00 10.11 H new ATOM 0 HB2 LYS A 35 -1.322 3.569 18.950 1.00 10.25 H new ATOM 0 HB3 LYS A 35 -2.974 3.858 19.456 1.00 10.25 H new ATOM 0 HG2 LYS A 35 -2.938 1.834 20.879 1.00 61.35 H new ATOM 0 HG3 LYS A 35 -1.333 1.424 20.307 1.00 61.35 H new ATOM 0 HD2 LYS A 35 -1.173 2.455 22.529 1.00 70.03 H new ATOM 0 HD3 LYS A 35 -0.411 3.496 21.343 1.00 70.03 H new ATOM 0 HE2 LYS A 35 -2.520 4.894 21.272 1.00 41.50 H new ATOM 0 HE3 LYS A 35 -3.201 3.885 22.532 1.00 41.50 H new ATOM 0 HZ1 LYS A 35 -2.233 5.892 23.445 1.00 74.44 H new ATOM 0 HZ2 LYS A 35 -1.379 4.533 23.999 1.00 74.44 H new ATOM 0 HZ3 LYS A 35 -0.719 5.511 22.778 1.00 74.44 H new ATOM 559 N LEU A 36 -3.326 2.488 15.663 1.00 0.25 N ATOM 560 CA LEU A 36 -3.847 3.123 14.431 1.00 43.45 C ATOM 561 C LEU A 36 -5.373 2.890 14.315 1.00 42.32 C ATOM 562 O LEU A 36 -5.833 1.748 14.167 1.00 42.32 O ATOM 563 CB LEU A 36 -3.109 2.568 13.181 1.00 1.21 C ATOM 564 CG LEU A 36 -1.579 2.871 13.113 1.00 63.44 C ATOM 565 CD1 LEU A 36 -0.931 2.191 11.888 1.00 4.22 C ATOM 566 CD2 LEU A 36 -1.298 4.394 13.141 1.00 3.30 C ATOM 0 H LEU A 36 -3.005 1.531 15.519 1.00 0.25 H new ATOM 0 HA LEU A 36 -3.665 4.196 14.485 1.00 43.45 H new ATOM 0 HB2 LEU A 36 -3.249 1.488 13.148 1.00 1.21 H new ATOM 0 HB3 LEU A 36 -3.583 2.978 12.289 1.00 1.21 H new ATOM 0 HG LEU A 36 -1.118 2.446 14.005 1.00 63.44 H new ATOM 0 HD11 LEU A 36 0.135 2.419 11.866 1.00 4.22 H new ATOM 0 HD12 LEU A 36 -1.070 1.112 11.955 1.00 4.22 H new ATOM 0 HD13 LEU A 36 -1.400 2.561 10.976 1.00 4.22 H new ATOM 0 HD21 LEU A 36 -0.223 4.567 13.092 1.00 3.30 H new ATOM 0 HD22 LEU A 36 -1.781 4.869 12.287 1.00 3.30 H new ATOM 0 HD23 LEU A 36 -1.692 4.820 14.064 1.00 3.30 H new ATOM 578 N LYS A 37 -6.134 3.998 14.380 1.00 55.24 N ATOM 579 CA LYS A 37 -7.615 3.992 14.361 1.00 34.35 C ATOM 580 C LYS A 37 -8.148 3.599 12.968 1.00 61.24 C ATOM 581 O LYS A 37 -9.079 2.800 12.859 1.00 13.45 O ATOM 582 CB LYS A 37 -8.189 5.385 14.788 1.00 4.32 C ATOM 583 CG LYS A 37 -7.995 5.755 16.283 1.00 12.21 C ATOM 584 CD LYS A 37 -6.520 6.036 16.665 1.00 11.55 C ATOM 585 CE LYS A 37 -6.334 6.292 18.165 1.00 25.52 C ATOM 586 NZ LYS A 37 -4.922 6.593 18.508 1.00 61.43 N ATOM 0 H LYS A 37 -5.737 4.935 14.448 1.00 55.24 H new ATOM 0 HA LYS A 37 -7.951 3.247 15.082 1.00 34.35 H new ATOM 0 HB2 LYS A 37 -7.719 6.155 14.177 1.00 4.32 H new ATOM 0 HB3 LYS A 37 -9.255 5.405 14.562 1.00 4.32 H new ATOM 0 HG2 LYS A 37 -8.595 6.636 16.512 1.00 12.21 H new ATOM 0 HG3 LYS A 37 -8.374 4.942 16.902 1.00 12.21 H new ATOM 0 HD2 LYS A 37 -5.904 5.188 16.367 1.00 11.55 H new ATOM 0 HD3 LYS A 37 -6.163 6.901 16.106 1.00 11.55 H new ATOM 0 HE2 LYS A 37 -6.967 7.125 18.472 1.00 25.52 H new ATOM 0 HE3 LYS A 37 -6.664 5.418 18.725 1.00 25.52 H new ATOM 0 HZ1 LYS A 37 -4.804 6.575 19.541 1.00 61.43 H new ATOM 0 HZ2 LYS A 37 -4.300 5.880 18.077 1.00 61.43 H new ATOM 0 HZ3 LYS A 37 -4.670 7.535 18.147 1.00 61.43 H new ATOM 600 N ALA A 38 -7.533 4.155 11.905 1.00 65.00 N ATOM 601 CA ALA A 38 -7.919 3.862 10.503 1.00 42.24 C ATOM 602 C ALA A 38 -7.038 2.745 9.890 1.00 20.22 C ATOM 603 O ALA A 38 -5.831 2.671 10.150 1.00 42.33 O ATOM 604 CB ALA A 38 -7.841 5.141 9.643 1.00 22.51 C ATOM 0 H ALA A 38 -6.760 4.815 11.989 1.00 65.00 H new ATOM 0 HA ALA A 38 -8.949 3.505 10.512 1.00 42.24 H new ATOM 0 HB1 ALA A 38 -8.127 4.908 8.617 1.00 22.51 H new ATOM 0 HB2 ALA A 38 -8.519 5.893 10.047 1.00 22.51 H new ATOM 0 HB3 ALA A 38 -6.822 5.527 9.656 1.00 22.51 H new ATOM 610 N ASP A 39 -7.665 1.871 9.076 1.00 13.25 N ATOM 611 CA ASP A 39 -6.957 0.823 8.296 1.00 64.21 C ATOM 612 C ASP A 39 -6.049 1.438 7.215 1.00 50.24 C ATOM 613 O ASP A 39 -5.110 0.799 6.761 1.00 42.22 O ATOM 614 CB ASP A 39 -7.966 -0.134 7.631 1.00 62.05 C ATOM 615 CG ASP A 39 -8.950 -0.734 8.632 1.00 41.45 C ATOM 616 OD1 ASP A 39 -8.523 -1.544 9.471 1.00 0.35 O ATOM 617 OD2 ASP A 39 -10.142 -0.366 8.607 1.00 35.41 O ATOM 0 H ASP A 39 -8.676 1.868 8.938 1.00 13.25 H new ATOM 0 HA ASP A 39 -6.334 0.266 8.996 1.00 64.21 H new ATOM 0 HB2 ASP A 39 -8.519 0.404 6.861 1.00 62.05 H new ATOM 0 HB3 ASP A 39 -7.425 -0.938 7.132 1.00 62.05 H new ATOM 622 N LYS A 40 -6.384 2.666 6.786 1.00 22.35 N ATOM 623 CA LYS A 40 -5.620 3.421 5.769 1.00 50.30 C ATOM 624 C LYS A 40 -4.140 3.648 6.187 1.00 62.45 C ATOM 625 O LYS A 40 -3.240 3.607 5.346 1.00 50.34 O ATOM 626 CB LYS A 40 -6.327 4.772 5.492 1.00 23.33 C ATOM 627 CG LYS A 40 -7.813 4.642 5.081 1.00 70.20 C ATOM 628 CD LYS A 40 -8.013 3.803 3.796 1.00 12.51 C ATOM 629 CE LYS A 40 -9.491 3.705 3.370 1.00 50.13 C ATOM 630 NZ LYS A 40 -10.339 3.067 4.416 1.00 25.33 N ATOM 0 H LYS A 40 -7.199 3.170 7.136 1.00 22.35 H new ATOM 0 HA LYS A 40 -5.596 2.826 4.856 1.00 50.30 H new ATOM 0 HB2 LYS A 40 -6.263 5.392 6.386 1.00 23.33 H new ATOM 0 HB3 LYS A 40 -5.788 5.295 4.702 1.00 23.33 H new ATOM 0 HG2 LYS A 40 -8.372 4.185 5.898 1.00 70.20 H new ATOM 0 HG3 LYS A 40 -8.230 5.637 4.927 1.00 70.20 H new ATOM 0 HD2 LYS A 40 -7.435 4.246 2.985 1.00 12.51 H new ATOM 0 HD3 LYS A 40 -7.619 2.800 3.958 1.00 12.51 H new ATOM 0 HE2 LYS A 40 -9.872 4.703 3.155 1.00 50.13 H new ATOM 0 HE3 LYS A 40 -9.563 3.131 2.446 1.00 50.13 H new ATOM 0 HZ1 LYS A 40 -11.297 2.915 4.041 1.00 25.33 H new ATOM 0 HZ2 LYS A 40 -9.925 2.153 4.689 1.00 25.33 H new ATOM 0 HZ3 LYS A 40 -10.388 3.687 5.249 1.00 25.33 H new ATOM 644 N ASP A 41 -3.904 3.868 7.498 1.00 43.04 N ATOM 645 CA ASP A 41 -2.540 3.992 8.064 1.00 33.43 C ATOM 646 C ASP A 41 -1.819 2.621 8.040 1.00 74.33 C ATOM 647 O ASP A 41 -0.612 2.536 7.782 1.00 61.25 O ATOM 648 CB ASP A 41 -2.610 4.543 9.508 1.00 45.21 C ATOM 649 CG ASP A 41 -3.281 5.923 9.594 1.00 73.22 C ATOM 650 OD1 ASP A 41 -2.584 6.950 9.447 1.00 72.35 O ATOM 651 OD2 ASP A 41 -4.512 5.985 9.791 1.00 23.51 O ATOM 0 H ASP A 41 -4.646 3.964 8.191 1.00 43.04 H new ATOM 0 HA ASP A 41 -1.969 4.691 7.453 1.00 33.43 H new ATOM 0 HB2 ASP A 41 -3.159 3.839 10.133 1.00 45.21 H new ATOM 0 HB3 ASP A 41 -1.601 4.610 9.914 1.00 45.21 H new ATOM 656 N PHE A 42 -2.592 1.552 8.293 1.00 50.43 N ATOM 657 CA PHE A 42 -2.095 0.163 8.230 1.00 21.25 C ATOM 658 C PHE A 42 -1.669 -0.231 6.787 1.00 31.15 C ATOM 659 O PHE A 42 -0.644 -0.875 6.605 1.00 25.44 O ATOM 660 CB PHE A 42 -3.175 -0.816 8.781 1.00 71.21 C ATOM 661 CG PHE A 42 -2.846 -2.291 8.560 1.00 65.13 C ATOM 662 CD1 PHE A 42 -1.752 -2.870 9.194 1.00 30.52 C ATOM 663 CD2 PHE A 42 -3.610 -3.088 7.702 1.00 64.33 C ATOM 664 CE1 PHE A 42 -1.431 -4.188 8.980 1.00 24.31 C ATOM 665 CE2 PHE A 42 -3.286 -4.415 7.496 1.00 23.13 C ATOM 666 CZ PHE A 42 -2.197 -4.963 8.138 1.00 13.03 C ATOM 0 H PHE A 42 -3.577 1.623 8.547 1.00 50.43 H new ATOM 0 HA PHE A 42 -1.205 0.093 8.856 1.00 21.25 H new ATOM 0 HB2 PHE A 42 -3.301 -0.638 9.849 1.00 71.21 H new ATOM 0 HB3 PHE A 42 -4.130 -0.592 8.306 1.00 71.21 H new ATOM 0 HD1 PHE A 42 -1.147 -2.276 9.863 1.00 30.52 H new ATOM 0 HD2 PHE A 42 -4.463 -2.661 7.195 1.00 64.33 H new ATOM 0 HE1 PHE A 42 -0.573 -4.619 9.475 1.00 24.31 H new ATOM 0 HE2 PHE A 42 -3.885 -5.022 6.833 1.00 23.13 H new ATOM 0 HZ PHE A 42 -1.944 -6.001 7.981 1.00 13.03 H new ATOM 676 N PHE A 43 -2.466 0.169 5.774 1.00 61.01 N ATOM 677 CA PHE A 43 -2.201 -0.166 4.345 1.00 32.54 C ATOM 678 C PHE A 43 -0.888 0.471 3.831 1.00 62.43 C ATOM 679 O PHE A 43 -0.161 -0.141 3.043 1.00 74.12 O ATOM 680 CB PHE A 43 -3.396 0.271 3.450 1.00 22.23 C ATOM 681 CG PHE A 43 -4.731 -0.414 3.776 1.00 11.40 C ATOM 682 CD1 PHE A 43 -4.773 -1.745 4.197 1.00 22.21 C ATOM 683 CD2 PHE A 43 -5.942 0.275 3.660 1.00 62.42 C ATOM 684 CE1 PHE A 43 -5.972 -2.361 4.491 1.00 43.23 C ATOM 685 CE2 PHE A 43 -7.143 -0.345 3.952 1.00 33.21 C ATOM 686 CZ PHE A 43 -7.156 -1.662 4.367 1.00 65.41 C ATOM 0 H PHE A 43 -3.307 0.729 5.914 1.00 61.01 H new ATOM 0 HA PHE A 43 -2.086 -1.248 4.285 1.00 32.54 H new ATOM 0 HB2 PHE A 43 -3.525 1.349 3.543 1.00 22.23 H new ATOM 0 HB3 PHE A 43 -3.145 0.068 2.409 1.00 22.23 H new ATOM 0 HD1 PHE A 43 -3.852 -2.301 4.294 1.00 22.21 H new ATOM 0 HD2 PHE A 43 -5.939 1.306 3.338 1.00 62.42 H new ATOM 0 HE1 PHE A 43 -5.984 -3.390 4.818 1.00 43.23 H new ATOM 0 HE2 PHE A 43 -8.070 0.200 3.856 1.00 33.21 H new ATOM 0 HZ PHE A 43 -8.094 -2.146 4.595 1.00 65.41 H new ATOM 696 N LEU A 44 -0.604 1.700 4.289 1.00 41.40 N ATOM 697 CA LEU A 44 0.649 2.424 3.962 1.00 74.42 C ATOM 698 C LEU A 44 1.873 1.779 4.662 1.00 71.45 C ATOM 699 O LEU A 44 2.905 1.543 4.025 1.00 15.34 O ATOM 700 CB LEU A 44 0.512 3.929 4.346 1.00 4.14 C ATOM 701 CG LEU A 44 -0.126 4.875 3.268 1.00 14.45 C ATOM 702 CD1 LEU A 44 -1.503 4.382 2.770 1.00 65.25 C ATOM 703 CD2 LEU A 44 -0.213 6.322 3.801 1.00 12.02 C ATOM 0 H LEU A 44 -1.232 2.226 4.897 1.00 41.40 H new ATOM 0 HA LEU A 44 0.816 2.352 2.887 1.00 74.42 H new ATOM 0 HB2 LEU A 44 -0.087 3.995 5.254 1.00 4.14 H new ATOM 0 HB3 LEU A 44 1.504 4.310 4.589 1.00 4.14 H new ATOM 0 HG LEU A 44 0.535 4.857 2.401 1.00 14.45 H new ATOM 0 HD11 LEU A 44 -1.892 5.078 2.027 1.00 65.25 H new ATOM 0 HD12 LEU A 44 -1.395 3.395 2.321 1.00 65.25 H new ATOM 0 HD13 LEU A 44 -2.195 4.325 3.610 1.00 65.25 H new ATOM 0 HD21 LEU A 44 -0.658 6.964 3.040 1.00 12.02 H new ATOM 0 HD22 LEU A 44 -0.830 6.342 4.699 1.00 12.02 H new ATOM 0 HD23 LEU A 44 0.788 6.682 4.040 1.00 12.02 H new ATOM 715 N GLY A 45 1.733 1.495 5.976 1.00 33.40 N ATOM 716 CA GLY A 45 2.805 0.859 6.764 1.00 75.22 C ATOM 717 C GLY A 45 3.183 -0.536 6.266 1.00 41.23 C ATOM 718 O GLY A 45 4.340 -0.797 5.938 1.00 11.31 O ATOM 0 H GLY A 45 0.888 1.697 6.510 1.00 33.40 H new ATOM 0 HA2 GLY A 45 3.689 1.496 6.741 1.00 75.22 H new ATOM 0 HA3 GLY A 45 2.488 0.791 7.805 1.00 75.22 H new ATOM 722 N LEU A 46 2.172 -1.414 6.179 1.00 53.04 N ATOM 723 CA LEU A 46 2.308 -2.788 5.635 1.00 44.32 C ATOM 724 C LEU A 46 2.830 -2.783 4.176 1.00 51.41 C ATOM 725 O LEU A 46 3.645 -3.623 3.793 1.00 41.42 O ATOM 726 CB LEU A 46 0.938 -3.513 5.683 1.00 42.55 C ATOM 727 CG LEU A 46 0.910 -4.948 5.069 1.00 3.34 C ATOM 728 CD1 LEU A 46 1.880 -5.879 5.817 1.00 35.23 C ATOM 729 CD2 LEU A 46 -0.524 -5.520 5.024 1.00 64.44 C ATOM 0 H LEU A 46 1.224 -1.195 6.486 1.00 53.04 H new ATOM 0 HA LEU A 46 3.035 -3.314 6.254 1.00 44.32 H new ATOM 0 HB2 LEU A 46 0.617 -3.576 6.723 1.00 42.55 H new ATOM 0 HB3 LEU A 46 0.204 -2.899 5.160 1.00 42.55 H new ATOM 0 HG LEU A 46 1.250 -4.880 4.036 1.00 3.34 H new ATOM 0 HD11 LEU A 46 1.845 -6.874 5.373 1.00 35.23 H new ATOM 0 HD12 LEU A 46 2.893 -5.484 5.743 1.00 35.23 H new ATOM 0 HD13 LEU A 46 1.590 -5.939 6.866 1.00 35.23 H new ATOM 0 HD21 LEU A 46 -0.503 -6.520 4.591 1.00 64.44 H new ATOM 0 HD22 LEU A 46 -0.927 -5.571 6.035 1.00 64.44 H new ATOM 0 HD23 LEU A 46 -1.155 -4.873 4.414 1.00 64.44 H new ATOM 741 N GLY A 47 2.352 -1.807 3.397 1.00 23.22 N ATOM 742 CA GLY A 47 2.720 -1.660 1.979 1.00 10.20 C ATOM 743 C GLY A 47 4.200 -1.346 1.782 1.00 62.35 C ATOM 744 O GLY A 47 4.809 -1.733 0.778 1.00 51.22 O ATOM 0 H GLY A 47 1.700 -1.096 3.728 1.00 23.22 H new ATOM 0 HA2 GLY A 47 2.474 -2.579 1.447 1.00 10.20 H new ATOM 0 HA3 GLY A 47 2.122 -0.865 1.534 1.00 10.20 H new ATOM 748 N TRP A 48 4.773 -0.641 2.768 1.00 72.25 N ATOM 749 CA TRP A 48 6.205 -0.316 2.801 1.00 3.42 C ATOM 750 C TRP A 48 7.058 -1.549 3.242 1.00 34.21 C ATOM 751 O TRP A 48 8.250 -1.643 2.933 1.00 32.24 O ATOM 752 CB TRP A 48 6.436 0.891 3.735 1.00 54.32 C ATOM 753 CG TRP A 48 7.755 1.583 3.512 1.00 3.34 C ATOM 754 CD1 TRP A 48 8.939 1.339 4.136 1.00 52.11 C ATOM 755 CD2 TRP A 48 8.007 2.620 2.569 1.00 54.12 C ATOM 756 NE1 TRP A 48 9.910 2.176 3.650 1.00 54.14 N ATOM 757 CE2 TRP A 48 9.361 2.974 2.683 1.00 25.10 C ATOM 758 CE3 TRP A 48 7.212 3.286 1.642 1.00 64.23 C ATOM 759 CZ2 TRP A 48 9.936 3.969 1.898 1.00 40.15 C ATOM 760 CZ3 TRP A 48 7.780 4.265 0.865 1.00 11.11 C ATOM 761 CH2 TRP A 48 9.129 4.602 0.996 1.00 4.44 C ATOM 0 H TRP A 48 4.254 -0.279 3.568 1.00 72.25 H new ATOM 0 HA TRP A 48 6.530 -0.050 1.795 1.00 3.42 H new ATOM 0 HB2 TRP A 48 5.629 1.610 3.592 1.00 54.32 H new ATOM 0 HB3 TRP A 48 6.383 0.554 4.770 1.00 54.32 H new ATOM 0 HD1 TRP A 48 9.092 0.594 4.903 1.00 52.11 H new ATOM 0 HE1 TRP A 48 10.882 2.200 3.958 1.00 54.14 H new ATOM 0 HE3 TRP A 48 6.166 3.037 1.535 1.00 64.23 H new ATOM 0 HZ2 TRP A 48 10.979 4.230 1.998 1.00 40.15 H new ATOM 0 HZ3 TRP A 48 7.172 4.784 0.139 1.00 11.11 H new ATOM 0 HH2 TRP A 48 9.543 5.379 0.371 1.00 4.44 H new ATOM 772 N LEU A 49 6.441 -2.483 3.981 1.00 31.21 N ATOM 773 CA LEU A 49 7.063 -3.803 4.283 1.00 53.30 C ATOM 774 C LEU A 49 7.066 -4.698 3.020 1.00 52.14 C ATOM 775 O LEU A 49 8.013 -5.460 2.786 1.00 73.33 O ATOM 776 CB LEU A 49 6.315 -4.516 5.450 1.00 2.00 C ATOM 777 CG LEU A 49 6.676 -4.088 6.907 1.00 64.45 C ATOM 778 CD1 LEU A 49 6.725 -2.576 7.056 1.00 13.43 C ATOM 779 CD2 LEU A 49 5.679 -4.697 7.912 1.00 51.33 C ATOM 0 H LEU A 49 5.513 -2.359 4.385 1.00 31.21 H new ATOM 0 HA LEU A 49 8.093 -3.631 4.594 1.00 53.30 H new ATOM 0 HB2 LEU A 49 5.246 -4.360 5.309 1.00 2.00 H new ATOM 0 HB3 LEU A 49 6.495 -5.587 5.360 1.00 2.00 H new ATOM 0 HG LEU A 49 7.673 -4.471 7.123 1.00 64.45 H new ATOM 0 HD11 LEU A 49 6.979 -2.320 8.084 1.00 13.43 H new ATOM 0 HD12 LEU A 49 7.480 -2.168 6.383 1.00 13.43 H new ATOM 0 HD13 LEU A 49 5.751 -2.154 6.807 1.00 13.43 H new ATOM 0 HD21 LEU A 49 5.946 -4.388 8.922 1.00 51.33 H new ATOM 0 HD22 LEU A 49 4.672 -4.350 7.681 1.00 51.33 H new ATOM 0 HD23 LEU A 49 5.713 -5.784 7.844 1.00 51.33 H new ATOM 791 N LEU A 50 5.981 -4.582 2.219 1.00 20.55 N ATOM 792 CA LEU A 50 5.841 -5.287 0.927 1.00 23.12 C ATOM 793 C LEU A 50 6.863 -4.743 -0.097 1.00 43.41 C ATOM 794 O LEU A 50 7.439 -5.512 -0.868 1.00 14.20 O ATOM 795 CB LEU A 50 4.389 -5.125 0.367 1.00 3.24 C ATOM 796 CG LEU A 50 3.234 -5.740 1.227 1.00 54.01 C ATOM 797 CD1 LEU A 50 1.845 -5.450 0.610 1.00 13.41 C ATOM 798 CD2 LEU A 50 3.444 -7.249 1.439 1.00 34.45 C ATOM 0 H LEU A 50 5.179 -3.996 2.452 1.00 20.55 H new ATOM 0 HA LEU A 50 6.037 -6.346 1.094 1.00 23.12 H new ATOM 0 HB2 LEU A 50 4.190 -4.061 0.240 1.00 3.24 H new ATOM 0 HB3 LEU A 50 4.354 -5.577 -0.624 1.00 3.24 H new ATOM 0 HG LEU A 50 3.262 -5.257 2.204 1.00 54.01 H new ATOM 0 HD11 LEU A 50 1.070 -5.893 1.235 1.00 13.41 H new ATOM 0 HD12 LEU A 50 1.691 -4.373 0.550 1.00 13.41 H new ATOM 0 HD13 LEU A 50 1.794 -5.880 -0.390 1.00 13.41 H new ATOM 0 HD21 LEU A 50 2.627 -7.649 2.039 1.00 34.45 H new ATOM 0 HD22 LEU A 50 3.465 -7.753 0.473 1.00 34.45 H new ATOM 0 HD23 LEU A 50 4.389 -7.416 1.955 1.00 34.45 H new ATOM 810 N ARG A 51 7.086 -3.403 -0.071 1.00 43.41 N ATOM 811 CA ARG A 51 8.034 -2.716 -0.984 1.00 10.44 C ATOM 812 C ARG A 51 9.504 -3.149 -0.706 1.00 43.44 C ATOM 813 O ARG A 51 10.337 -3.141 -1.611 1.00 72.11 O ATOM 814 CB ARG A 51 7.846 -1.146 -0.901 1.00 75.33 C ATOM 815 CG ARG A 51 8.687 -0.366 0.166 1.00 42.45 C ATOM 816 CD ARG A 51 10.024 0.205 -0.353 1.00 64.12 C ATOM 817 NE ARG A 51 10.845 0.771 0.730 1.00 33.41 N ATOM 818 CZ ARG A 51 12.076 1.220 0.595 1.00 34.43 C ATOM 819 NH1 ARG A 51 12.671 1.264 -0.558 1.00 12.34 N ATOM 820 NH2 ARG A 51 12.727 1.602 1.640 1.00 43.31 N ATOM 0 H ARG A 51 6.616 -2.773 0.579 1.00 43.41 H new ATOM 0 HA ARG A 51 7.808 -3.019 -2.006 1.00 10.44 H new ATOM 0 HB2 ARG A 51 8.078 -0.728 -1.881 1.00 75.33 H new ATOM 0 HB3 ARG A 51 6.792 -0.944 -0.710 1.00 75.33 H new ATOM 0 HG2 ARG A 51 8.084 0.455 0.554 1.00 42.45 H new ATOM 0 HG3 ARG A 51 8.894 -1.033 1.003 1.00 42.45 H new ATOM 0 HD2 ARG A 51 10.583 -0.584 -0.856 1.00 64.12 H new ATOM 0 HD3 ARG A 51 9.823 0.977 -1.096 1.00 64.12 H new ATOM 0 HE ARG A 51 10.427 0.819 1.659 1.00 33.41 H new ATOM 0 HH11 ARG A 51 12.184 0.945 -1.396 1.00 12.34 H new ATOM 0 HH12 ARG A 51 13.625 1.618 -0.626 1.00 12.34 H new ATOM 0 HH21 ARG A 51 12.288 1.555 2.560 1.00 43.31 H new ATOM 0 HH22 ARG A 51 13.681 1.951 1.547 1.00 43.31 H new ATOM 834 N GLU A 52 9.811 -3.501 0.562 1.00 23.12 N ATOM 835 CA GLU A 52 11.155 -4.008 0.963 1.00 73.34 C ATOM 836 C GLU A 52 11.224 -5.551 1.012 1.00 75.42 C ATOM 837 O GLU A 52 12.254 -6.107 1.423 1.00 52.20 O ATOM 838 CB GLU A 52 11.562 -3.399 2.337 1.00 55.03 C ATOM 839 CG GLU A 52 11.813 -1.879 2.305 1.00 31.02 C ATOM 840 CD GLU A 52 12.261 -1.259 3.640 1.00 35.42 C ATOM 841 OE1 GLU A 52 13.103 -1.857 4.340 1.00 33.31 O ATOM 842 OE2 GLU A 52 11.814 -0.142 3.973 1.00 53.41 O ATOM 0 H GLU A 52 9.146 -3.445 1.334 1.00 23.12 H new ATOM 0 HA GLU A 52 11.862 -3.690 0.197 1.00 73.34 H new ATOM 0 HB2 GLU A 52 10.777 -3.611 3.063 1.00 55.03 H new ATOM 0 HB3 GLU A 52 12.465 -3.898 2.690 1.00 55.03 H new ATOM 0 HG2 GLU A 52 12.573 -1.668 1.552 1.00 31.02 H new ATOM 0 HG3 GLU A 52 10.898 -1.383 1.982 1.00 31.02 H new ATOM 849 N ASP A 53 10.119 -6.230 0.618 1.00 63.21 N ATOM 850 CA ASP A 53 10.047 -7.715 0.489 1.00 12.13 C ATOM 851 C ASP A 53 10.224 -8.441 1.865 1.00 71.25 C ATOM 852 O ASP A 53 10.450 -9.656 1.908 1.00 41.31 O ATOM 853 CB ASP A 53 11.103 -8.233 -0.543 1.00 55.31 C ATOM 854 CG ASP A 53 11.008 -7.547 -1.918 1.00 51.41 C ATOM 855 OD1 ASP A 53 10.227 -7.995 -2.779 1.00 61.42 O ATOM 856 OD2 ASP A 53 11.722 -6.545 -2.152 1.00 44.41 O ATOM 0 H ASP A 53 9.244 -5.764 0.378 1.00 63.21 H new ATOM 0 HA ASP A 53 9.048 -7.954 0.124 1.00 12.13 H new ATOM 0 HB2 ASP A 53 12.102 -8.077 -0.137 1.00 55.31 H new ATOM 0 HB3 ASP A 53 10.975 -9.308 -0.673 1.00 55.31 H new ATOM 861 N LYS A 54 10.087 -7.689 2.981 1.00 4.23 N ATOM 862 CA LYS A 54 10.376 -8.193 4.350 1.00 43.52 C ATOM 863 C LYS A 54 9.222 -9.029 4.935 1.00 20.22 C ATOM 864 O LYS A 54 9.383 -9.643 5.995 1.00 14.33 O ATOM 865 CB LYS A 54 10.687 -7.004 5.298 1.00 51.41 C ATOM 866 CG LYS A 54 11.937 -6.190 4.899 1.00 63.13 C ATOM 867 CD LYS A 54 12.253 -5.032 5.876 1.00 32.33 C ATOM 868 CE LYS A 54 11.088 -4.029 6.030 1.00 12.20 C ATOM 869 NZ LYS A 54 11.509 -2.801 6.742 1.00 72.45 N ATOM 0 H LYS A 54 9.774 -6.718 2.962 1.00 4.23 H new ATOM 0 HA LYS A 54 11.243 -8.849 4.268 1.00 43.52 H new ATOM 0 HB2 LYS A 54 9.825 -6.337 5.322 1.00 51.41 H new ATOM 0 HB3 LYS A 54 10.823 -7.386 6.310 1.00 51.41 H new ATOM 0 HG2 LYS A 54 12.796 -6.859 4.849 1.00 63.13 H new ATOM 0 HG3 LYS A 54 11.792 -5.782 3.899 1.00 63.13 H new ATOM 0 HD2 LYS A 54 12.498 -5.447 6.854 1.00 32.33 H new ATOM 0 HD3 LYS A 54 13.137 -4.500 5.525 1.00 32.33 H new ATOM 0 HE2 LYS A 54 10.704 -3.764 5.045 1.00 12.20 H new ATOM 0 HE3 LYS A 54 10.271 -4.502 6.574 1.00 12.20 H new ATOM 0 HZ1 LYS A 54 10.670 -2.239 6.990 1.00 72.45 H new ATOM 0 HZ2 LYS A 54 12.021 -3.061 7.609 1.00 72.45 H new ATOM 0 HZ3 LYS A 54 12.132 -2.240 6.127 1.00 72.45 H new ATOM 883 N VAL A 55 8.058 -9.040 4.253 1.00 62.35 N ATOM 884 CA VAL A 55 6.856 -9.767 4.725 1.00 11.43 C ATOM 885 C VAL A 55 6.145 -10.521 3.577 1.00 32.44 C ATOM 886 O VAL A 55 6.350 -10.234 2.393 1.00 13.33 O ATOM 887 CB VAL A 55 5.818 -8.818 5.432 1.00 2.43 C ATOM 888 CG1 VAL A 55 6.401 -8.162 6.700 1.00 40.43 C ATOM 889 CG2 VAL A 55 5.274 -7.753 4.457 1.00 1.43 C ATOM 0 H VAL A 55 7.923 -8.551 3.368 1.00 62.35 H new ATOM 0 HA VAL A 55 7.223 -10.489 5.454 1.00 11.43 H new ATOM 0 HB VAL A 55 4.983 -9.443 5.748 1.00 2.43 H new ATOM 0 HG11 VAL A 55 5.649 -7.516 7.154 1.00 40.43 H new ATOM 0 HG12 VAL A 55 6.691 -8.937 7.410 1.00 40.43 H new ATOM 0 HG13 VAL A 55 7.276 -7.569 6.433 1.00 40.43 H new ATOM 0 HG21 VAL A 55 4.560 -7.114 4.977 1.00 1.43 H new ATOM 0 HG22 VAL A 55 6.099 -7.146 4.084 1.00 1.43 H new ATOM 0 HG23 VAL A 55 4.778 -8.245 3.620 1.00 1.43 H new ATOM 899 N VAL A 56 5.295 -11.484 3.966 1.00 15.12 N ATOM 900 CA VAL A 56 4.475 -12.286 3.045 1.00 71.24 C ATOM 901 C VAL A 56 2.997 -12.290 3.509 1.00 42.12 C ATOM 902 O VAL A 56 2.698 -12.475 4.697 1.00 71.11 O ATOM 903 CB VAL A 56 5.051 -13.752 2.885 1.00 53.03 C ATOM 904 CG1 VAL A 56 5.220 -14.458 4.254 1.00 53.24 C ATOM 905 CG2 VAL A 56 4.198 -14.601 1.899 1.00 1.01 C ATOM 0 H VAL A 56 5.156 -11.731 4.946 1.00 15.12 H new ATOM 0 HA VAL A 56 4.514 -11.827 2.057 1.00 71.24 H new ATOM 0 HB VAL A 56 6.046 -13.659 2.450 1.00 53.03 H new ATOM 0 HG11 VAL A 56 5.617 -15.461 4.099 1.00 53.24 H new ATOM 0 HG12 VAL A 56 5.909 -13.886 4.876 1.00 53.24 H new ATOM 0 HG13 VAL A 56 4.252 -14.524 4.751 1.00 53.24 H new ATOM 0 HG21 VAL A 56 4.625 -15.600 1.816 1.00 1.01 H new ATOM 0 HG22 VAL A 56 3.176 -14.673 2.271 1.00 1.01 H new ATOM 0 HG23 VAL A 56 4.194 -14.125 0.918 1.00 1.01 H new ATOM 915 N THR A 57 2.083 -12.071 2.553 1.00 61.00 N ATOM 916 CA THR A 57 0.641 -11.879 2.822 1.00 2.44 C ATOM 917 C THR A 57 -0.198 -13.073 2.298 1.00 75.23 C ATOM 918 O THR A 57 -0.052 -13.486 1.142 1.00 64.41 O ATOM 919 CB THR A 57 0.136 -10.573 2.132 1.00 51.33 C ATOM 920 OG1 THR A 57 0.518 -10.599 0.743 1.00 11.12 O ATOM 921 CG2 THR A 57 0.683 -9.292 2.795 1.00 54.43 C ATOM 0 H THR A 57 2.320 -12.021 1.562 1.00 61.00 H new ATOM 0 HA THR A 57 0.517 -11.808 3.903 1.00 2.44 H new ATOM 0 HB THR A 57 -0.948 -10.545 2.238 1.00 51.33 H new ATOM 0 HG1 THR A 57 0.575 -11.528 0.437 1.00 11.12 H new ATOM 0 HG21 THR A 57 0.297 -8.418 2.271 1.00 54.43 H new ATOM 0 HG22 THR A 57 0.368 -9.259 3.838 1.00 54.43 H new ATOM 0 HG23 THR A 57 1.772 -9.293 2.745 1.00 54.43 H new ATOM 929 N SER A 58 -1.110 -13.566 3.148 1.00 75.02 N ATOM 930 CA SER A 58 -2.066 -14.650 2.812 1.00 64.55 C ATOM 931 C SER A 58 -3.519 -14.171 3.033 1.00 54.51 C ATOM 932 O SER A 58 -3.771 -13.222 3.792 1.00 3.14 O ATOM 933 CB SER A 58 -1.781 -15.911 3.672 1.00 52.44 C ATOM 934 OG SER A 58 -2.686 -16.972 3.374 1.00 3.41 O ATOM 0 H SER A 58 -1.212 -13.223 4.103 1.00 75.02 H new ATOM 0 HA SER A 58 -1.938 -14.910 1.761 1.00 64.55 H new ATOM 0 HB2 SER A 58 -0.758 -16.246 3.498 1.00 52.44 H new ATOM 0 HB3 SER A 58 -1.857 -15.655 4.729 1.00 52.44 H new ATOM 0 HG SER A 58 -2.475 -17.749 3.933 1.00 3.41 H new ATOM 940 N GLU A 59 -4.471 -14.847 2.374 1.00 21.22 N ATOM 941 CA GLU A 59 -5.907 -14.535 2.485 1.00 14.11 C ATOM 942 C GLU A 59 -6.572 -15.522 3.463 1.00 5.02 C ATOM 943 O GLU A 59 -6.811 -16.683 3.118 1.00 23.44 O ATOM 944 CB GLU A 59 -6.583 -14.614 1.091 1.00 32.23 C ATOM 945 CG GLU A 59 -8.098 -14.325 1.097 1.00 55.41 C ATOM 946 CD GLU A 59 -8.765 -14.556 -0.267 1.00 4.43 C ATOM 947 OE1 GLU A 59 -9.049 -15.726 -0.607 1.00 21.21 O ATOM 948 OE2 GLU A 59 -9.014 -13.575 -0.998 1.00 75.43 O ATOM 0 H GLU A 59 -4.269 -15.627 1.748 1.00 21.22 H new ATOM 0 HA GLU A 59 -6.027 -13.521 2.866 1.00 14.11 H new ATOM 0 HB2 GLU A 59 -6.093 -13.905 0.423 1.00 32.23 H new ATOM 0 HB3 GLU A 59 -6.417 -15.609 0.677 1.00 32.23 H new ATOM 0 HG2 GLU A 59 -8.579 -14.960 1.841 1.00 55.41 H new ATOM 0 HG3 GLU A 59 -8.263 -13.292 1.404 1.00 55.41 H new ATOM 955 N VAL A 60 -6.856 -15.058 4.691 1.00 32.41 N ATOM 956 CA VAL A 60 -7.542 -15.875 5.713 1.00 42.42 C ATOM 957 C VAL A 60 -8.985 -15.367 5.925 1.00 72.22 C ATOM 958 O VAL A 60 -9.208 -14.295 6.505 1.00 65.10 O ATOM 959 CB VAL A 60 -6.743 -15.892 7.072 1.00 22.22 C ATOM 960 CG1 VAL A 60 -7.533 -16.609 8.203 1.00 13.14 C ATOM 961 CG2 VAL A 60 -5.359 -16.557 6.867 1.00 62.32 C ATOM 0 H VAL A 60 -6.621 -14.116 5.004 1.00 32.41 H new ATOM 0 HA VAL A 60 -7.585 -16.902 5.350 1.00 42.42 H new ATOM 0 HB VAL A 60 -6.600 -14.858 7.386 1.00 22.22 H new ATOM 0 HG11 VAL A 60 -6.945 -16.597 9.121 1.00 13.14 H new ATOM 0 HG12 VAL A 60 -8.478 -16.092 8.371 1.00 13.14 H new ATOM 0 HG13 VAL A 60 -7.730 -17.641 7.911 1.00 13.14 H new ATOM 0 HG21 VAL A 60 -4.815 -16.564 7.812 1.00 62.32 H new ATOM 0 HG22 VAL A 60 -5.495 -17.581 6.519 1.00 62.32 H new ATOM 0 HG23 VAL A 60 -4.791 -15.995 6.126 1.00 62.32 H new ATOM 971 N GLU A 61 -9.940 -16.173 5.416 1.00 52.23 N ATOM 972 CA GLU A 61 -11.405 -16.005 5.583 1.00 0.03 C ATOM 973 C GLU A 61 -11.934 -14.570 5.273 1.00 20.54 C ATOM 974 O GLU A 61 -12.954 -14.143 5.829 1.00 30.14 O ATOM 975 CB GLU A 61 -11.829 -16.478 7.005 1.00 12.32 C ATOM 976 CG GLU A 61 -11.279 -17.868 7.404 1.00 50.34 C ATOM 977 CD GLU A 61 -11.917 -18.421 8.690 1.00 23.22 C ATOM 978 OE1 GLU A 61 -11.399 -18.148 9.791 1.00 32.11 O ATOM 979 OE2 GLU A 61 -12.950 -19.121 8.602 1.00 13.31 O ATOM 0 H GLU A 61 -9.706 -16.992 4.855 1.00 52.23 H new ATOM 0 HA GLU A 61 -11.876 -16.635 4.829 1.00 0.03 H new ATOM 0 HB2 GLU A 61 -11.491 -15.743 7.735 1.00 12.32 H new ATOM 0 HB3 GLU A 61 -12.917 -16.502 7.058 1.00 12.32 H new ATOM 0 HG2 GLU A 61 -11.453 -18.569 6.588 1.00 50.34 H new ATOM 0 HG3 GLU A 61 -10.200 -17.800 7.541 1.00 50.34 H new ATOM 986 N GLY A 62 -11.274 -13.860 4.338 1.00 53.11 N ATOM 987 CA GLY A 62 -11.721 -12.520 3.900 1.00 21.10 C ATOM 988 C GLY A 62 -11.011 -11.329 4.567 1.00 62.42 C ATOM 989 O GLY A 62 -11.395 -10.178 4.318 1.00 0.13 O ATOM 0 H GLY A 62 -10.430 -14.190 3.871 1.00 53.11 H new ATOM 0 HA2 GLY A 62 -11.581 -12.445 2.822 1.00 21.10 H new ATOM 0 HA3 GLY A 62 -12.791 -12.434 4.090 1.00 21.10 H new ATOM 993 N GLU A 63 -9.981 -11.574 5.408 1.00 24.52 N ATOM 994 CA GLU A 63 -9.166 -10.474 6.007 1.00 52.52 C ATOM 995 C GLU A 63 -7.659 -10.677 5.744 1.00 53.31 C ATOM 996 O GLU A 63 -7.208 -11.787 5.414 1.00 3.22 O ATOM 997 CB GLU A 63 -9.436 -10.317 7.536 1.00 40.21 C ATOM 998 CG GLU A 63 -8.776 -11.372 8.456 1.00 13.54 C ATOM 999 CD GLU A 63 -9.032 -11.103 9.955 1.00 13.33 C ATOM 1000 OE1 GLU A 63 -8.551 -10.064 10.472 1.00 72.43 O ATOM 1001 OE2 GLU A 63 -9.721 -11.910 10.618 1.00 12.30 O ATOM 0 H GLU A 63 -9.691 -12.510 5.690 1.00 24.52 H new ATOM 0 HA GLU A 63 -9.476 -9.552 5.516 1.00 52.52 H new ATOM 0 HB2 GLU A 63 -9.093 -9.330 7.845 1.00 40.21 H new ATOM 0 HB3 GLU A 63 -10.513 -10.346 7.699 1.00 40.21 H new ATOM 0 HG2 GLU A 63 -9.156 -12.361 8.199 1.00 13.54 H new ATOM 0 HG3 GLU A 63 -7.702 -11.386 8.272 1.00 13.54 H new ATOM 1008 N ILE A 64 -6.891 -9.584 5.886 1.00 14.42 N ATOM 1009 CA ILE A 64 -5.438 -9.577 5.644 1.00 62.25 C ATOM 1010 C ILE A 64 -4.666 -10.209 6.829 1.00 22.00 C ATOM 1011 O ILE A 64 -4.666 -9.672 7.941 1.00 71.10 O ATOM 1012 CB ILE A 64 -4.909 -8.113 5.385 1.00 71.20 C ATOM 1013 CG1 ILE A 64 -5.685 -7.446 4.199 1.00 21.22 C ATOM 1014 CG2 ILE A 64 -3.377 -8.104 5.131 1.00 51.21 C ATOM 1015 CD1 ILE A 64 -5.264 -6.013 3.878 1.00 40.55 C ATOM 0 H ILE A 64 -7.261 -8.678 6.173 1.00 14.42 H new ATOM 0 HA ILE A 64 -5.260 -10.177 4.752 1.00 62.25 H new ATOM 0 HB ILE A 64 -5.094 -7.524 6.283 1.00 71.20 H new ATOM 0 HG12 ILE A 64 -5.550 -8.057 3.307 1.00 21.22 H new ATOM 0 HG13 ILE A 64 -6.750 -7.453 4.432 1.00 21.22 H new ATOM 0 HG21 ILE A 64 -3.043 -7.081 4.956 1.00 51.21 H new ATOM 0 HG22 ILE A 64 -2.861 -8.510 6.001 1.00 51.21 H new ATOM 0 HG23 ILE A 64 -3.149 -8.714 4.257 1.00 51.21 H new ATOM 0 HD11 ILE A 64 -5.857 -5.638 3.044 1.00 40.55 H new ATOM 0 HD12 ILE A 64 -5.426 -5.382 4.752 1.00 40.55 H new ATOM 0 HD13 ILE A 64 -4.208 -5.996 3.609 1.00 40.55 H new ATOM 1027 N PHE A 65 -4.038 -11.367 6.568 1.00 62.24 N ATOM 1028 CA PHE A 65 -3.038 -11.982 7.466 1.00 74.33 C ATOM 1029 C PHE A 65 -1.641 -11.802 6.841 1.00 24.34 C ATOM 1030 O PHE A 65 -1.455 -12.065 5.649 1.00 51.34 O ATOM 1031 CB PHE A 65 -3.339 -13.492 7.696 1.00 12.24 C ATOM 1032 CG PHE A 65 -2.245 -14.235 8.475 1.00 72.21 C ATOM 1033 CD1 PHE A 65 -2.014 -13.952 9.822 1.00 33.23 C ATOM 1034 CD2 PHE A 65 -1.426 -15.184 7.851 1.00 0.31 C ATOM 1035 CE1 PHE A 65 -1.007 -14.595 10.518 1.00 12.52 C ATOM 1036 CE2 PHE A 65 -0.415 -15.820 8.549 1.00 30.32 C ATOM 1037 CZ PHE A 65 -0.207 -15.526 9.884 1.00 61.14 C ATOM 0 H PHE A 65 -4.209 -11.910 5.722 1.00 62.24 H new ATOM 0 HA PHE A 65 -3.079 -11.491 8.438 1.00 74.33 H new ATOM 0 HB2 PHE A 65 -4.282 -13.586 8.235 1.00 12.24 H new ATOM 0 HB3 PHE A 65 -3.475 -13.976 6.729 1.00 12.24 H new ATOM 0 HD1 PHE A 65 -2.629 -13.222 10.327 1.00 33.23 H new ATOM 0 HD2 PHE A 65 -1.586 -15.423 6.810 1.00 0.31 H new ATOM 0 HE1 PHE A 65 -0.845 -14.369 11.562 1.00 12.52 H new ATOM 0 HE2 PHE A 65 0.211 -16.546 8.052 1.00 30.32 H new ATOM 0 HZ PHE A 65 0.580 -16.024 10.431 1.00 61.14 H new ATOM 1047 N VAL A 66 -0.671 -11.345 7.638 1.00 33.34 N ATOM 1048 CA VAL A 66 0.709 -11.125 7.164 1.00 70.43 C ATOM 1049 C VAL A 66 1.755 -11.571 8.221 1.00 31.32 C ATOM 1050 O VAL A 66 1.488 -11.520 9.423 1.00 64.13 O ATOM 1051 CB VAL A 66 0.910 -9.621 6.760 1.00 21.25 C ATOM 1052 CG1 VAL A 66 0.644 -8.670 7.956 1.00 72.00 C ATOM 1053 CG2 VAL A 66 2.307 -9.402 6.141 1.00 13.33 C ATOM 0 H VAL A 66 -0.812 -11.117 8.622 1.00 33.34 H new ATOM 0 HA VAL A 66 0.867 -11.744 6.281 1.00 70.43 H new ATOM 0 HB VAL A 66 0.173 -9.374 5.996 1.00 21.25 H new ATOM 0 HG11 VAL A 66 0.793 -7.637 7.640 1.00 72.00 H new ATOM 0 HG12 VAL A 66 -0.381 -8.799 8.303 1.00 72.00 H new ATOM 0 HG13 VAL A 66 1.334 -8.904 8.767 1.00 72.00 H new ATOM 0 HG21 VAL A 66 2.424 -8.353 5.869 1.00 13.33 H new ATOM 0 HG22 VAL A 66 3.073 -9.676 6.866 1.00 13.33 H new ATOM 0 HG23 VAL A 66 2.412 -10.022 5.250 1.00 13.33 H new ATOM 1063 N LYS A 67 2.948 -12.004 7.755 1.00 43.20 N ATOM 1064 CA LYS A 67 4.062 -12.431 8.638 1.00 44.13 C ATOM 1065 C LYS A 67 5.429 -12.112 8.001 1.00 71.12 C ATOM 1066 O LYS A 67 5.521 -11.979 6.789 1.00 62.44 O ATOM 1067 CB LYS A 67 3.942 -13.945 8.939 1.00 63.34 C ATOM 1068 CG LYS A 67 3.967 -14.862 7.699 1.00 65.01 C ATOM 1069 CD LYS A 67 3.728 -16.346 8.052 1.00 70.34 C ATOM 1070 CE LYS A 67 4.778 -16.906 9.033 1.00 50.22 C ATOM 1071 NZ LYS A 67 4.493 -18.308 9.410 1.00 42.45 N ATOM 0 H LYS A 67 3.167 -12.068 6.761 1.00 43.20 H new ATOM 0 HA LYS A 67 3.994 -11.876 9.573 1.00 44.13 H new ATOM 0 HB2 LYS A 67 4.758 -14.234 9.602 1.00 63.34 H new ATOM 0 HB3 LYS A 67 3.013 -14.119 9.482 1.00 63.34 H new ATOM 0 HG2 LYS A 67 3.204 -14.533 6.993 1.00 65.01 H new ATOM 0 HG3 LYS A 67 4.930 -14.762 7.197 1.00 65.01 H new ATOM 0 HD2 LYS A 67 2.735 -16.455 8.489 1.00 70.34 H new ATOM 0 HD3 LYS A 67 3.740 -16.938 7.137 1.00 70.34 H new ATOM 0 HE2 LYS A 67 5.767 -16.847 8.578 1.00 50.22 H new ATOM 0 HE3 LYS A 67 4.802 -16.287 9.930 1.00 50.22 H new ATOM 0 HZ1 LYS A 67 5.223 -18.645 10.070 1.00 42.45 H new ATOM 0 HZ2 LYS A 67 3.561 -18.362 9.868 1.00 42.45 H new ATOM 0 HZ3 LYS A 67 4.495 -18.904 8.558 1.00 42.45 H new ATOM 1085 N LEU A 68 6.486 -12.001 8.826 1.00 0.21 N ATOM 1086 CA LEU A 68 7.859 -11.712 8.334 1.00 24.10 C ATOM 1087 C LEU A 68 8.426 -12.888 7.496 1.00 64.32 C ATOM 1088 O LEU A 68 8.268 -14.057 7.872 1.00 43.52 O ATOM 1089 CB LEU A 68 8.838 -11.440 9.511 1.00 14.53 C ATOM 1090 CG LEU A 68 8.498 -10.269 10.488 1.00 53.45 C ATOM 1091 CD1 LEU A 68 9.635 -10.059 11.512 1.00 5.12 C ATOM 1092 CD2 LEU A 68 8.189 -8.962 9.736 1.00 74.35 C ATOM 0 H LEU A 68 6.422 -12.106 9.839 1.00 0.21 H new ATOM 0 HA LEU A 68 7.777 -10.823 7.708 1.00 24.10 H new ATOM 0 HB2 LEU A 68 8.916 -12.354 10.099 1.00 14.53 H new ATOM 0 HB3 LEU A 68 9.824 -11.247 9.088 1.00 14.53 H new ATOM 0 HG LEU A 68 7.595 -10.552 11.029 1.00 53.45 H new ATOM 0 HD11 LEU A 68 9.375 -9.239 12.181 1.00 5.12 H new ATOM 0 HD12 LEU A 68 9.774 -10.971 12.093 1.00 5.12 H new ATOM 0 HD13 LEU A 68 10.559 -9.819 10.986 1.00 5.12 H new ATOM 0 HD21 LEU A 68 7.958 -8.175 10.454 1.00 74.35 H new ATOM 0 HD22 LEU A 68 9.056 -8.670 9.143 1.00 74.35 H new ATOM 0 HD23 LEU A 68 7.334 -9.115 9.077 1.00 74.35 H new ATOM 1104 N VAL A 69 9.083 -12.569 6.365 1.00 23.32 N ATOM 1105 CA VAL A 69 9.924 -13.540 5.638 1.00 15.14 C ATOM 1106 C VAL A 69 11.269 -13.696 6.391 1.00 13.41 C ATOM 1107 O VAL A 69 12.231 -12.957 6.141 1.00 13.20 O ATOM 1108 CB VAL A 69 10.188 -13.116 4.139 1.00 12.42 C ATOM 1109 CG1 VAL A 69 11.036 -14.182 3.387 1.00 63.25 C ATOM 1110 CG2 VAL A 69 8.864 -12.846 3.394 1.00 24.13 C ATOM 0 H VAL A 69 9.048 -11.645 5.934 1.00 23.32 H new ATOM 0 HA VAL A 69 9.389 -14.489 5.604 1.00 15.14 H new ATOM 0 HB VAL A 69 10.760 -12.188 4.160 1.00 12.42 H new ATOM 0 HG11 VAL A 69 11.199 -13.858 2.359 1.00 63.25 H new ATOM 0 HG12 VAL A 69 11.997 -14.301 3.887 1.00 63.25 H new ATOM 0 HG13 VAL A 69 10.507 -15.135 3.388 1.00 63.25 H new ATOM 0 HG21 VAL A 69 9.078 -12.556 2.365 1.00 24.13 H new ATOM 0 HG22 VAL A 69 8.254 -13.749 3.397 1.00 24.13 H new ATOM 0 HG23 VAL A 69 8.324 -12.041 3.893 1.00 24.13 H new ATOM 1302 N MET B 3 -1.045 -14.389 -3.575 1.00 1.24 N ATOM 1303 CA MET B 3 -0.299 -13.465 -2.702 1.00 3.21 C ATOM 1304 C MET B 3 -0.764 -12.008 -2.939 1.00 24.10 C ATOM 1305 O MET B 3 -0.755 -11.522 -4.080 1.00 44.21 O ATOM 1306 CB MET B 3 1.228 -13.605 -2.948 1.00 11.13 C ATOM 1307 CG MET B 3 1.826 -15.002 -2.664 1.00 5.21 C ATOM 1308 SD MET B 3 1.789 -15.461 -0.906 1.00 0.23 S ATOM 1309 CE MET B 3 0.239 -16.361 -0.731 1.00 74.43 C ATOM 0 HA MET B 3 -0.502 -13.723 -1.663 1.00 3.21 H new ATOM 0 HB2 MET B 3 1.436 -13.345 -3.986 1.00 11.13 H new ATOM 0 HB3 MET B 3 1.746 -12.875 -2.327 1.00 11.13 H new ATOM 0 HG2 MET B 3 1.276 -15.748 -3.238 1.00 5.21 H new ATOM 0 HG3 MET B 3 2.857 -15.026 -3.016 1.00 5.21 H new ATOM 0 HE1 MET B 3 -0.219 -16.113 0.226 1.00 74.43 H new ATOM 0 HE2 MET B 3 -0.437 -16.083 -1.540 1.00 74.43 H new ATOM 0 HE3 MET B 3 0.434 -17.433 -0.774 1.00 74.43 H new ATOM 1319 N LEU B 4 -1.169 -11.328 -1.853 1.00 35.14 N ATOM 1320 CA LEU B 4 -1.561 -9.894 -1.896 1.00 13.13 C ATOM 1321 C LEU B 4 -0.331 -8.999 -2.243 1.00 25.20 C ATOM 1322 O LEU B 4 -0.473 -7.873 -2.714 1.00 31.52 O ATOM 1323 CB LEU B 4 -2.235 -9.445 -0.557 1.00 44.32 C ATOM 1324 CG LEU B 4 -3.636 -10.070 -0.194 1.00 63.24 C ATOM 1325 CD1 LEU B 4 -3.558 -11.595 0.069 1.00 44.14 C ATOM 1326 CD2 LEU B 4 -4.263 -9.331 1.013 1.00 52.34 C ATOM 0 H LEU B 4 -1.236 -11.745 -0.925 1.00 35.14 H new ATOM 0 HA LEU B 4 -2.302 -9.770 -2.686 1.00 13.13 H new ATOM 0 HB2 LEU B 4 -1.546 -9.671 0.257 1.00 44.32 H new ATOM 0 HB3 LEU B 4 -2.349 -8.361 -0.586 1.00 44.32 H new ATOM 0 HG LEU B 4 -4.281 -9.937 -1.063 1.00 63.24 H new ATOM 0 HD11 LEU B 4 -4.550 -11.973 0.314 1.00 44.14 H new ATOM 0 HD12 LEU B 4 -3.188 -12.100 -0.823 1.00 44.14 H new ATOM 0 HD13 LEU B 4 -2.881 -11.787 0.901 1.00 44.14 H new ATOM 0 HD21 LEU B 4 -5.230 -9.776 1.250 1.00 52.34 H new ATOM 0 HD22 LEU B 4 -3.603 -9.418 1.876 1.00 52.34 H new ATOM 0 HD23 LEU B 4 -4.399 -8.278 0.765 1.00 52.34 H new ATOM 1338 N LYS B 5 0.874 -9.545 -2.025 1.00 43.52 N ATOM 1339 CA LYS B 5 2.147 -8.922 -2.433 1.00 54.11 C ATOM 1340 C LYS B 5 2.375 -9.061 -3.965 1.00 73.54 C ATOM 1341 O LYS B 5 2.919 -8.161 -4.607 1.00 21.32 O ATOM 1342 CB LYS B 5 3.293 -9.590 -1.616 1.00 63.04 C ATOM 1343 CG LYS B 5 4.695 -8.914 -1.705 1.00 11.11 C ATOM 1344 CD LYS B 5 5.648 -9.589 -2.715 1.00 30.41 C ATOM 1345 CE LYS B 5 7.048 -8.964 -2.699 1.00 34.25 C ATOM 1346 NZ LYS B 5 7.949 -9.586 -3.699 1.00 14.11 N ATOM 0 H LYS B 5 0.996 -10.442 -1.555 1.00 43.52 H new ATOM 0 HA LYS B 5 2.125 -7.853 -2.224 1.00 54.11 H new ATOM 0 HB2 LYS B 5 2.994 -9.618 -0.568 1.00 63.04 H new ATOM 0 HB3 LYS B 5 3.391 -10.624 -1.948 1.00 63.04 H new ATOM 0 HG2 LYS B 5 4.567 -7.868 -1.983 1.00 11.11 H new ATOM 0 HG3 LYS B 5 5.158 -8.927 -0.718 1.00 11.11 H new ATOM 0 HD2 LYS B 5 5.724 -10.652 -2.485 1.00 30.41 H new ATOM 0 HD3 LYS B 5 5.228 -9.509 -3.718 1.00 30.41 H new ATOM 0 HE2 LYS B 5 6.969 -7.895 -2.898 1.00 34.25 H new ATOM 0 HE3 LYS B 5 7.481 -9.072 -1.705 1.00 34.25 H new ATOM 0 HZ1 LYS B 5 8.844 -9.057 -3.737 1.00 14.11 H new ATOM 0 HZ2 LYS B 5 8.141 -10.572 -3.428 1.00 14.11 H new ATOM 0 HZ3 LYS B 5 7.496 -9.566 -4.635 1.00 14.11 H new ATOM 1360 N GLU B 6 1.937 -10.196 -4.540 1.00 63.54 N ATOM 1361 CA GLU B 6 2.178 -10.518 -5.965 1.00 20.12 C ATOM 1362 C GLU B 6 1.264 -9.686 -6.901 1.00 22.54 C ATOM 1363 O GLU B 6 1.739 -9.107 -7.888 1.00 1.02 O ATOM 1364 CB GLU B 6 1.962 -12.032 -6.210 1.00 72.03 C ATOM 1365 CG GLU B 6 2.519 -12.571 -7.546 1.00 75.03 C ATOM 1366 CD GLU B 6 4.055 -12.464 -7.659 1.00 61.41 C ATOM 1367 OE1 GLU B 6 4.766 -13.177 -6.916 1.00 60.43 O ATOM 1368 OE2 GLU B 6 4.561 -11.662 -8.476 1.00 53.11 O ATOM 0 H GLU B 6 1.411 -10.912 -4.039 1.00 63.54 H new ATOM 0 HA GLU B 6 3.211 -10.259 -6.197 1.00 20.12 H new ATOM 0 HB2 GLU B 6 2.425 -12.585 -5.393 1.00 72.03 H new ATOM 0 HB3 GLU B 6 0.893 -12.241 -6.171 1.00 72.03 H new ATOM 0 HG2 GLU B 6 2.226 -13.615 -7.658 1.00 75.03 H new ATOM 0 HG3 GLU B 6 2.063 -12.021 -8.369 1.00 75.03 H new ATOM 1375 N LYS B 7 -0.048 -9.635 -6.567 1.00 3.31 N ATOM 1376 CA LYS B 7 -1.051 -8.807 -7.299 1.00 34.42 C ATOM 1377 C LYS B 7 -0.621 -7.320 -7.359 1.00 21.54 C ATOM 1378 O LYS B 7 -0.867 -6.634 -8.345 1.00 30.24 O ATOM 1379 CB LYS B 7 -2.443 -8.898 -6.611 1.00 61.45 C ATOM 1380 CG LYS B 7 -2.454 -8.291 -5.190 1.00 74.31 C ATOM 1381 CD LYS B 7 -3.812 -8.271 -4.476 1.00 23.41 C ATOM 1382 CE LYS B 7 -4.818 -7.233 -5.021 1.00 51.20 C ATOM 1383 NZ LYS B 7 -5.434 -7.639 -6.309 1.00 43.24 N ATOM 0 H LYS B 7 -0.444 -10.161 -5.788 1.00 3.31 H new ATOM 0 HA LYS B 7 -1.113 -9.200 -8.314 1.00 34.42 H new ATOM 0 HB2 LYS B 7 -3.181 -8.383 -7.226 1.00 61.45 H new ATOM 0 HB3 LYS B 7 -2.748 -9.943 -6.556 1.00 61.45 H new ATOM 0 HG2 LYS B 7 -1.750 -8.849 -4.573 1.00 74.31 H new ATOM 0 HG3 LYS B 7 -2.083 -7.268 -5.251 1.00 74.31 H new ATOM 0 HD2 LYS B 7 -4.259 -9.262 -4.549 1.00 23.41 H new ATOM 0 HD3 LYS B 7 -3.646 -8.074 -3.417 1.00 23.41 H new ATOM 0 HE2 LYS B 7 -5.604 -7.076 -4.283 1.00 51.20 H new ATOM 0 HE3 LYS B 7 -4.310 -6.278 -5.153 1.00 51.20 H new ATOM 0 HZ1 LYS B 7 -6.306 -7.094 -6.464 1.00 43.24 H new ATOM 0 HZ2 LYS B 7 -4.768 -7.454 -7.086 1.00 43.24 H new ATOM 0 HZ3 LYS B 7 -5.661 -8.654 -6.281 1.00 43.24 H new ATOM 1397 N ALA B 8 0.034 -6.858 -6.270 1.00 61.20 N ATOM 1398 CA ALA B 8 0.471 -5.466 -6.096 1.00 2.32 C ATOM 1399 C ALA B 8 1.470 -5.040 -7.197 1.00 53.24 C ATOM 1400 O ALA B 8 1.491 -3.886 -7.625 1.00 52.24 O ATOM 1401 CB ALA B 8 1.102 -5.317 -4.706 1.00 61.11 C ATOM 0 H ALA B 8 0.274 -7.456 -5.479 1.00 61.20 H new ATOM 0 HA ALA B 8 -0.396 -4.811 -6.183 1.00 2.32 H new ATOM 0 HB1 ALA B 8 1.431 -4.288 -4.564 1.00 61.11 H new ATOM 0 HB2 ALA B 8 0.366 -5.571 -3.943 1.00 61.11 H new ATOM 0 HB3 ALA B 8 1.958 -5.986 -4.621 1.00 61.11 H new ATOM 1407 N GLY B 9 2.270 -6.021 -7.650 1.00 52.43 N ATOM 1408 CA GLY B 9 3.265 -5.812 -8.714 1.00 5.54 C ATOM 1409 C GLY B 9 2.656 -5.677 -10.117 1.00 62.52 C ATOM 1410 O GLY B 9 3.117 -4.862 -10.926 1.00 4.24 O ATOM 0 H GLY B 9 2.245 -6.975 -7.291 1.00 52.43 H new ATOM 0 HA2 GLY B 9 3.839 -4.913 -8.490 1.00 5.54 H new ATOM 0 HA3 GLY B 9 3.966 -6.647 -8.712 1.00 5.54 H new ATOM 1414 N ALA B 10 1.632 -6.503 -10.402 1.00 61.41 N ATOM 1415 CA ALA B 10 0.864 -6.431 -11.670 1.00 40.12 C ATOM 1416 C ALA B 10 0.064 -5.109 -11.774 1.00 32.11 C ATOM 1417 O ALA B 10 0.110 -4.416 -12.798 1.00 72.20 O ATOM 1418 CB ALA B 10 -0.087 -7.631 -11.786 1.00 1.12 C ATOM 0 H ALA B 10 1.312 -7.235 -9.769 1.00 61.41 H new ATOM 0 HA ALA B 10 1.579 -6.458 -12.492 1.00 40.12 H new ATOM 0 HB1 ALA B 10 -0.644 -7.565 -12.721 1.00 1.12 H new ATOM 0 HB2 ALA B 10 0.490 -8.555 -11.772 1.00 1.12 H new ATOM 0 HB3 ALA B 10 -0.784 -7.626 -10.948 1.00 1.12 H new ATOM 1424 N LEU B 11 -0.648 -4.769 -10.677 1.00 45.31 N ATOM 1425 CA LEU B 11 -1.432 -3.516 -10.556 1.00 65.53 C ATOM 1426 C LEU B 11 -0.525 -2.272 -10.633 1.00 73.32 C ATOM 1427 O LEU B 11 -0.954 -1.228 -11.113 1.00 25.25 O ATOM 1428 CB LEU B 11 -2.228 -3.516 -9.224 1.00 62.44 C ATOM 1429 CG LEU B 11 -3.300 -4.645 -9.075 1.00 4.15 C ATOM 1430 CD1 LEU B 11 -3.862 -4.690 -7.645 1.00 50.30 C ATOM 1431 CD2 LEU B 11 -4.429 -4.488 -10.118 1.00 10.55 C ATOM 0 H LEU B 11 -0.696 -5.358 -9.846 1.00 45.31 H new ATOM 0 HA LEU B 11 -2.128 -3.472 -11.394 1.00 65.53 H new ATOM 0 HB2 LEU B 11 -1.520 -3.601 -8.399 1.00 62.44 H new ATOM 0 HB3 LEU B 11 -2.725 -2.552 -9.119 1.00 62.44 H new ATOM 0 HG LEU B 11 -2.807 -5.598 -9.267 1.00 4.15 H new ATOM 0 HD11 LEU B 11 -4.605 -5.484 -7.571 1.00 50.30 H new ATOM 0 HD12 LEU B 11 -3.052 -4.884 -6.942 1.00 50.30 H new ATOM 0 HD13 LEU B 11 -4.328 -3.734 -7.407 1.00 50.30 H new ATOM 0 HD21 LEU B 11 -5.158 -5.288 -9.988 1.00 10.55 H new ATOM 0 HD22 LEU B 11 -4.919 -3.524 -9.981 1.00 10.55 H new ATOM 0 HD23 LEU B 11 -4.007 -4.541 -11.122 1.00 10.55 H new ATOM 1443 N ALA B 12 0.734 -2.411 -10.164 1.00 60.25 N ATOM 1444 CA ALA B 12 1.754 -1.341 -10.256 1.00 63.11 C ATOM 1445 C ALA B 12 2.008 -0.907 -11.716 1.00 30.25 C ATOM 1446 O ALA B 12 2.057 0.292 -12.018 1.00 73.23 O ATOM 1447 CB ALA B 12 3.069 -1.794 -9.614 1.00 61.42 C ATOM 0 H ALA B 12 1.071 -3.262 -9.714 1.00 60.25 H new ATOM 0 HA ALA B 12 1.364 -0.480 -9.714 1.00 63.11 H new ATOM 0 HB1 ALA B 12 3.806 -0.995 -9.691 1.00 61.42 H new ATOM 0 HB2 ALA B 12 2.899 -2.030 -8.564 1.00 61.42 H new ATOM 0 HB3 ALA B 12 3.439 -2.680 -10.130 1.00 61.42 H new ATOM 1453 N GLY B 13 2.156 -1.909 -12.605 1.00 13.03 N ATOM 1454 CA GLY B 13 2.326 -1.669 -14.043 1.00 20.20 C ATOM 1455 C GLY B 13 1.146 -0.925 -14.679 1.00 60.32 C ATOM 1456 O GLY B 13 1.337 0.006 -15.458 1.00 1.21 O ATOM 0 H GLY B 13 2.161 -2.895 -12.346 1.00 13.03 H new ATOM 0 HA2 GLY B 13 3.238 -1.093 -14.203 1.00 20.20 H new ATOM 0 HA3 GLY B 13 2.460 -2.625 -14.550 1.00 20.20 H new ATOM 1460 N GLN B 14 -0.071 -1.328 -14.297 1.00 13.13 N ATOM 1461 CA GLN B 14 -1.329 -0.788 -14.863 1.00 52.23 C ATOM 1462 C GLN B 14 -1.618 0.654 -14.368 1.00 33.23 C ATOM 1463 O GLN B 14 -2.100 1.496 -15.133 1.00 13.05 O ATOM 1464 CB GLN B 14 -2.491 -1.751 -14.500 1.00 34.32 C ATOM 1465 CG GLN B 14 -2.203 -3.215 -14.888 1.00 22.23 C ATOM 1466 CD GLN B 14 -3.303 -4.191 -14.477 1.00 3.23 C ATOM 1467 OE1 GLN B 14 -3.295 -4.719 -13.372 1.00 52.11 O ATOM 1468 NE2 GLN B 14 -4.242 -4.464 -15.363 1.00 64.32 N ATOM 0 H GLN B 14 -0.220 -2.041 -13.583 1.00 13.13 H new ATOM 0 HA GLN B 14 -1.230 -0.724 -15.947 1.00 52.23 H new ATOM 0 HB2 GLN B 14 -2.680 -1.695 -13.428 1.00 34.32 H new ATOM 0 HB3 GLN B 14 -3.400 -1.420 -15.002 1.00 34.32 H new ATOM 0 HG2 GLN B 14 -2.063 -3.274 -15.967 1.00 22.23 H new ATOM 0 HG3 GLN B 14 -1.265 -3.525 -14.428 1.00 22.23 H new ATOM 0 HE21 GLN B 14 -4.228 -4.012 -16.277 1.00 64.32 H new ATOM 0 HE22 GLN B 14 -4.982 -5.127 -15.134 1.00 64.32 H new ATOM 1477 N ILE B 15 -1.299 0.923 -13.086 1.00 73.14 N ATOM 1478 CA ILE B 15 -1.469 2.260 -12.460 1.00 70.01 C ATOM 1479 C ILE B 15 -0.456 3.286 -13.033 1.00 33.24 C ATOM 1480 O ILE B 15 -0.834 4.405 -13.407 1.00 45.30 O ATOM 1481 CB ILE B 15 -1.348 2.160 -10.879 1.00 23.01 C ATOM 1482 CG1 ILE B 15 -2.575 1.380 -10.285 1.00 74.42 C ATOM 1483 CG2 ILE B 15 -1.194 3.551 -10.205 1.00 71.11 C ATOM 1484 CD1 ILE B 15 -2.540 1.164 -8.773 1.00 43.32 C ATOM 0 H ILE B 15 -0.916 0.223 -12.451 1.00 73.14 H new ATOM 0 HA ILE B 15 -2.470 2.618 -12.703 1.00 70.01 H new ATOM 0 HB ILE B 15 -0.436 1.605 -10.659 1.00 23.01 H new ATOM 0 HG12 ILE B 15 -3.486 1.922 -10.537 1.00 74.42 H new ATOM 0 HG13 ILE B 15 -2.637 0.407 -10.773 1.00 74.42 H new ATOM 0 HG21 ILE B 15 -1.115 3.425 -9.125 1.00 71.11 H new ATOM 0 HG22 ILE B 15 -0.295 4.039 -10.580 1.00 71.11 H new ATOM 0 HG23 ILE B 15 -2.064 4.166 -10.436 1.00 71.11 H new ATOM 0 HD11 ILE B 15 -3.430 0.617 -8.463 1.00 43.32 H new ATOM 0 HD12 ILE B 15 -1.651 0.591 -8.508 1.00 43.32 H new ATOM 0 HD13 ILE B 15 -2.513 2.130 -8.268 1.00 43.32 H new ATOM 1496 N TRP B 16 0.822 2.875 -13.113 1.00 15.34 N ATOM 1497 CA TRP B 16 1.920 3.741 -13.595 1.00 70.35 C ATOM 1498 C TRP B 16 1.741 4.090 -15.100 1.00 2.24 C ATOM 1499 O TRP B 16 1.860 5.256 -15.492 1.00 13.05 O ATOM 1500 CB TRP B 16 3.293 3.054 -13.336 1.00 31.12 C ATOM 1501 CG TRP B 16 4.479 3.970 -13.539 1.00 64.33 C ATOM 1502 CD1 TRP B 16 5.100 4.734 -12.592 1.00 64.22 C ATOM 1503 CD2 TRP B 16 5.166 4.228 -14.767 1.00 72.00 C ATOM 1504 NE1 TRP B 16 6.130 5.446 -13.157 1.00 53.52 N ATOM 1505 CE2 TRP B 16 6.183 5.159 -14.495 1.00 20.20 C ATOM 1506 CE3 TRP B 16 5.007 3.762 -16.071 1.00 63.12 C ATOM 1507 CZ2 TRP B 16 7.041 5.629 -15.489 1.00 13.11 C ATOM 1508 CZ3 TRP B 16 5.845 4.227 -17.048 1.00 75.21 C ATOM 1509 CH2 TRP B 16 6.849 5.154 -16.762 1.00 3.43 C ATOM 0 H TRP B 16 1.125 1.938 -12.847 1.00 15.34 H new ATOM 0 HA TRP B 16 1.891 4.678 -13.039 1.00 70.35 H new ATOM 0 HB2 TRP B 16 3.311 2.671 -12.315 1.00 31.12 H new ATOM 0 HB3 TRP B 16 3.391 2.195 -14.000 1.00 31.12 H new ATOM 0 HD1 TRP B 16 4.821 4.773 -11.549 1.00 64.22 H new ATOM 0 HE1 TRP B 16 6.753 6.084 -12.661 1.00 53.52 H new ATOM 0 HE3 TRP B 16 4.234 3.045 -16.307 1.00 63.12 H new ATOM 0 HZ2 TRP B 16 7.825 6.338 -15.266 1.00 13.11 H new ATOM 0 HZ3 TRP B 16 5.727 3.870 -18.060 1.00 75.21 H new ATOM 0 HH2 TRP B 16 7.488 5.505 -17.559 1.00 3.43 H new ATOM 1520 N GLU B 17 1.456 3.066 -15.931 1.00 34.25 N ATOM 1521 CA GLU B 17 1.207 3.248 -17.388 1.00 44.22 C ATOM 1522 C GLU B 17 -0.033 4.130 -17.672 1.00 1.34 C ATOM 1523 O GLU B 17 -0.084 4.813 -18.700 1.00 34.03 O ATOM 1524 CB GLU B 17 1.056 1.870 -18.087 1.00 44.51 C ATOM 1525 CG GLU B 17 2.381 1.106 -18.324 1.00 42.33 C ATOM 1526 CD GLU B 17 3.233 1.683 -19.477 1.00 31.34 C ATOM 1527 OE1 GLU B 17 3.020 1.286 -20.643 1.00 61.12 O ATOM 1528 OE2 GLU B 17 4.115 2.529 -19.230 1.00 35.04 O ATOM 0 H GLU B 17 1.391 2.096 -15.621 1.00 34.25 H new ATOM 0 HA GLU B 17 2.073 3.769 -17.796 1.00 44.22 H new ATOM 0 HB2 GLU B 17 0.397 1.245 -17.485 1.00 44.51 H new ATOM 0 HB3 GLU B 17 0.564 2.019 -19.048 1.00 44.51 H new ATOM 0 HG2 GLU B 17 2.969 1.123 -17.406 1.00 42.33 H new ATOM 0 HG3 GLU B 17 2.155 0.062 -18.539 1.00 42.33 H new ATOM 1535 N ALA B 18 -1.029 4.098 -16.765 1.00 4.02 N ATOM 1536 CA ALA B 18 -2.220 4.978 -16.846 1.00 31.23 C ATOM 1537 C ALA B 18 -1.836 6.474 -16.689 1.00 12.50 C ATOM 1538 O ALA B 18 -2.503 7.362 -17.234 1.00 45.24 O ATOM 1539 CB ALA B 18 -3.242 4.567 -15.776 1.00 53.32 C ATOM 0 H ALA B 18 -1.035 3.469 -15.962 1.00 4.02 H new ATOM 0 HA ALA B 18 -2.666 4.859 -17.834 1.00 31.23 H new ATOM 0 HB1 ALA B 18 -4.115 5.216 -15.839 1.00 53.32 H new ATOM 0 HB2 ALA B 18 -3.545 3.533 -15.941 1.00 53.32 H new ATOM 0 HB3 ALA B 18 -2.791 4.660 -14.788 1.00 53.32 H new ATOM 1545 N LEU B 19 -0.760 6.729 -15.926 1.00 32.12 N ATOM 1546 CA LEU B 19 -0.222 8.086 -15.687 1.00 63.33 C ATOM 1547 C LEU B 19 0.903 8.466 -16.690 1.00 50.43 C ATOM 1548 O LEU B 19 1.274 9.643 -16.774 1.00 72.11 O ATOM 1549 CB LEU B 19 0.314 8.178 -14.234 1.00 31.34 C ATOM 1550 CG LEU B 19 -0.707 7.833 -13.106 1.00 4.53 C ATOM 1551 CD1 LEU B 19 -0.050 7.896 -11.710 1.00 44.41 C ATOM 1552 CD2 LEU B 19 -1.941 8.751 -13.191 1.00 12.15 C ATOM 0 H LEU B 19 -0.232 5.996 -15.452 1.00 32.12 H new ATOM 0 HA LEU B 19 -1.037 8.795 -15.837 1.00 63.33 H new ATOM 0 HB2 LEU B 19 1.169 7.509 -14.140 1.00 31.34 H new ATOM 0 HB3 LEU B 19 0.682 9.190 -14.067 1.00 31.34 H new ATOM 0 HG LEU B 19 -1.041 6.806 -13.257 1.00 4.53 H new ATOM 0 HD11 LEU B 19 -0.790 7.650 -10.948 1.00 44.41 H new ATOM 0 HD12 LEU B 19 0.772 7.181 -11.662 1.00 44.41 H new ATOM 0 HD13 LEU B 19 0.333 8.901 -11.533 1.00 44.41 H new ATOM 0 HD21 LEU B 19 -2.641 8.494 -12.396 1.00 12.15 H new ATOM 0 HD22 LEU B 19 -1.630 9.790 -13.079 1.00 12.15 H new ATOM 0 HD23 LEU B 19 -2.426 8.619 -14.158 1.00 12.15 H new ATOM 1564 N ASN B 20 1.460 7.473 -17.421 1.00 31.41 N ATOM 1565 CA ASN B 20 2.570 7.709 -18.385 1.00 53.01 C ATOM 1566 C ASN B 20 2.092 8.604 -19.559 1.00 23.13 C ATOM 1567 O ASN B 20 1.163 8.249 -20.289 1.00 61.33 O ATOM 1568 CB ASN B 20 3.147 6.356 -18.899 1.00 20.12 C ATOM 1569 CG ASN B 20 4.450 6.478 -19.708 1.00 31.11 C ATOM 1570 OD1 ASN B 20 4.820 7.539 -20.200 1.00 43.05 O ATOM 1571 ND2 ASN B 20 5.131 5.369 -19.896 1.00 22.25 N ATOM 0 H ASN B 20 1.162 6.499 -17.365 1.00 31.41 H new ATOM 0 HA ASN B 20 3.372 8.237 -17.870 1.00 53.01 H new ATOM 0 HB2 ASN B 20 3.326 5.705 -18.043 1.00 20.12 H new ATOM 0 HB3 ASN B 20 2.395 5.868 -19.519 1.00 20.12 H new ATOM 0 HD21 ASN B 20 5.982 5.382 -20.459 1.00 22.25 H new ATOM 0 HD22 ASN B 20 4.809 4.496 -19.479 1.00 22.25 H new ATOM 1578 N GLY B 21 2.758 9.763 -19.718 1.00 54.24 N ATOM 1579 CA GLY B 21 2.373 10.781 -20.712 1.00 61.31 C ATOM 1580 C GLY B 21 1.677 12.000 -20.089 1.00 34.43 C ATOM 1581 O GLY B 21 1.828 13.124 -20.579 1.00 31.11 O ATOM 0 H GLY B 21 3.575 10.019 -19.163 1.00 54.24 H new ATOM 0 HA2 GLY B 21 3.263 11.113 -21.247 1.00 61.31 H new ATOM 0 HA3 GLY B 21 1.709 10.328 -21.448 1.00 61.31 H new ATOM 1585 N THR B 22 0.902 11.768 -19.007 1.00 54.35 N ATOM 1586 CA THR B 22 0.162 12.843 -18.282 1.00 62.21 C ATOM 1587 C THR B 22 1.075 13.572 -17.265 1.00 65.11 C ATOM 1588 O THR B 22 2.215 13.155 -17.025 1.00 1.21 O ATOM 1589 CB THR B 22 -1.102 12.284 -17.518 1.00 3.40 C ATOM 1590 OG1 THR B 22 -0.721 11.602 -16.308 1.00 64.41 O ATOM 1591 CG2 THR B 22 -1.929 11.326 -18.396 1.00 14.42 C ATOM 0 H THR B 22 0.767 10.839 -18.608 1.00 54.35 H new ATOM 0 HA THR B 22 -0.170 13.547 -19.045 1.00 62.21 H new ATOM 0 HB THR B 22 -1.718 13.148 -17.269 1.00 3.40 H new ATOM 0 HG1 THR B 22 -0.033 10.934 -16.512 1.00 64.41 H new ATOM 0 HG21 THR B 22 -2.789 10.965 -17.831 1.00 14.42 H new ATOM 0 HG22 THR B 22 -2.274 11.854 -19.285 1.00 14.42 H new ATOM 0 HG23 THR B 22 -1.310 10.480 -18.694 1.00 14.42 H new ATOM 1599 N GLU B 23 0.557 14.657 -16.656 1.00 54.43 N ATOM 1600 CA GLU B 23 1.273 15.405 -15.585 1.00 25.11 C ATOM 1601 C GLU B 23 1.123 14.727 -14.186 1.00 11.03 C ATOM 1602 O GLU B 23 1.663 15.219 -13.188 1.00 62.13 O ATOM 1603 CB GLU B 23 0.746 16.864 -15.521 1.00 35.42 C ATOM 1604 CG GLU B 23 0.866 17.661 -16.842 1.00 43.34 C ATOM 1605 CD GLU B 23 0.410 19.128 -16.706 1.00 70.31 C ATOM 1606 OE1 GLU B 23 -0.811 19.372 -16.577 1.00 21.43 O ATOM 1607 OE2 GLU B 23 1.268 20.040 -16.706 1.00 43.43 O ATOM 0 H GLU B 23 -0.359 15.042 -16.884 1.00 54.43 H new ATOM 0 HA GLU B 23 2.333 15.401 -15.837 1.00 25.11 H new ATOM 0 HB2 GLU B 23 -0.302 16.843 -15.221 1.00 35.42 H new ATOM 0 HB3 GLU B 23 1.290 17.397 -14.742 1.00 35.42 H new ATOM 0 HG2 GLU B 23 1.902 17.638 -17.180 1.00 43.34 H new ATOM 0 HG3 GLU B 23 0.269 17.171 -17.611 1.00 43.34 H new ATOM 1614 N GLY B 24 0.414 13.580 -14.141 1.00 15.14 N ATOM 1615 CA GLY B 24 0.072 12.898 -12.884 1.00 62.51 C ATOM 1616 C GLY B 24 -1.360 13.193 -12.431 1.00 14.33 C ATOM 1617 O GLY B 24 -1.827 14.331 -12.543 1.00 62.32 O ATOM 0 H GLY B 24 0.065 13.105 -14.974 1.00 15.14 H new ATOM 0 HA2 GLY B 24 0.195 11.823 -13.012 1.00 62.51 H new ATOM 0 HA3 GLY B 24 0.768 13.208 -12.105 1.00 62.51 H new ATOM 1621 N LEU B 25 -2.064 12.168 -11.914 1.00 12.22 N ATOM 1622 CA LEU B 25 -3.505 12.272 -11.560 1.00 4.13 C ATOM 1623 C LEU B 25 -3.773 11.805 -10.109 1.00 23.30 C ATOM 1624 O LEU B 25 -2.926 11.160 -9.489 1.00 42.40 O ATOM 1625 CB LEU B 25 -4.352 11.443 -12.564 1.00 22.45 C ATOM 1626 CG LEU B 25 -4.255 11.866 -14.070 1.00 71.23 C ATOM 1627 CD1 LEU B 25 -5.000 10.866 -14.979 1.00 20.02 C ATOM 1628 CD2 LEU B 25 -4.770 13.310 -14.284 1.00 1.11 C ATOM 0 H LEU B 25 -1.661 11.250 -11.729 1.00 12.22 H new ATOM 0 HA LEU B 25 -3.795 13.321 -11.622 1.00 4.13 H new ATOM 0 HB2 LEU B 25 -4.053 10.398 -12.482 1.00 22.45 H new ATOM 0 HB3 LEU B 25 -5.397 11.501 -12.259 1.00 22.45 H new ATOM 0 HG LEU B 25 -3.202 11.848 -14.350 1.00 71.23 H new ATOM 0 HD11 LEU B 25 -4.915 11.186 -16.018 1.00 20.02 H new ATOM 0 HD12 LEU B 25 -4.560 9.875 -14.867 1.00 20.02 H new ATOM 0 HD13 LEU B 25 -6.052 10.830 -14.695 1.00 20.02 H new ATOM 0 HD21 LEU B 25 -4.689 13.573 -15.339 1.00 1.11 H new ATOM 0 HD22 LEU B 25 -5.813 13.374 -13.973 1.00 1.11 H new ATOM 0 HD23 LEU B 25 -4.171 14.001 -13.691 1.00 1.11 H new ATOM 1640 N THR B 26 -4.978 12.124 -9.583 1.00 11.23 N ATOM 1641 CA THR B 26 -5.392 11.725 -8.210 1.00 51.12 C ATOM 1642 C THR B 26 -5.910 10.273 -8.187 1.00 42.31 C ATOM 1643 O THR B 26 -6.158 9.684 -9.242 1.00 45.10 O ATOM 1644 CB THR B 26 -6.516 12.653 -7.635 1.00 1.43 C ATOM 1645 OG1 THR B 26 -7.693 12.590 -8.463 1.00 73.00 O ATOM 1646 CG2 THR B 26 -6.059 14.111 -7.499 1.00 12.24 C ATOM 0 H THR B 26 -5.685 12.658 -10.087 1.00 11.23 H new ATOM 0 HA THR B 26 -4.501 11.819 -7.589 1.00 51.12 H new ATOM 0 HB THR B 26 -6.748 12.285 -6.636 1.00 1.43 H new ATOM 0 HG1 THR B 26 -8.490 12.545 -7.895 1.00 73.00 H new ATOM 0 HG21 THR B 26 -6.874 14.712 -7.096 1.00 12.24 H new ATOM 0 HG22 THR B 26 -5.203 14.163 -6.826 1.00 12.24 H new ATOM 0 HG23 THR B 26 -5.774 14.496 -8.478 1.00 12.24 H new ATOM 1654 N GLN B 27 -6.101 9.724 -6.967 1.00 74.43 N ATOM 1655 CA GLN B 27 -6.600 8.343 -6.763 1.00 22.41 C ATOM 1656 C GLN B 27 -7.924 8.075 -7.516 1.00 71.31 C ATOM 1657 O GLN B 27 -8.108 7.003 -8.074 1.00 62.35 O ATOM 1658 CB GLN B 27 -6.768 8.053 -5.247 1.00 24.52 C ATOM 1659 CG GLN B 27 -7.738 8.996 -4.492 1.00 63.33 C ATOM 1660 CD GLN B 27 -7.870 8.693 -2.993 1.00 2.33 C ATOM 1661 OE1 GLN B 27 -8.088 9.591 -2.187 1.00 60.51 O ATOM 1662 NE2 GLN B 27 -7.765 7.435 -2.603 1.00 12.32 N ATOM 0 H GLN B 27 -5.915 10.223 -6.097 1.00 74.43 H new ATOM 0 HA GLN B 27 -5.855 7.665 -7.180 1.00 22.41 H new ATOM 0 HB2 GLN B 27 -7.119 7.028 -5.127 1.00 24.52 H new ATOM 0 HB3 GLN B 27 -5.788 8.112 -4.773 1.00 24.52 H new ATOM 0 HG2 GLN B 27 -7.397 10.024 -4.615 1.00 63.33 H new ATOM 0 HG3 GLN B 27 -8.724 8.930 -4.953 1.00 63.33 H new ATOM 0 HE21 GLN B 27 -7.583 6.702 -3.289 1.00 12.32 H new ATOM 0 HE22 GLN B 27 -7.866 7.197 -1.616 1.00 12.32 H new ATOM 1671 N LYS B 28 -8.815 9.081 -7.531 1.00 72.34 N ATOM 1672 CA LYS B 28 -10.115 9.019 -8.236 1.00 3.33 C ATOM 1673 C LYS B 28 -9.924 8.821 -9.772 1.00 34.43 C ATOM 1674 O LYS B 28 -10.584 7.977 -10.390 1.00 13.30 O ATOM 1675 CB LYS B 28 -10.903 10.322 -7.930 1.00 44.22 C ATOM 1676 CG LYS B 28 -12.343 10.384 -8.474 1.00 31.05 C ATOM 1677 CD LYS B 28 -13.260 9.284 -7.890 1.00 10.14 C ATOM 1678 CE LYS B 28 -14.688 9.360 -8.458 1.00 34.24 C ATOM 1679 NZ LYS B 28 -14.704 9.247 -9.942 1.00 34.53 N ATOM 0 H LYS B 28 -8.656 9.968 -7.052 1.00 72.34 H new ATOM 0 HA LYS B 28 -10.679 8.157 -7.880 1.00 3.33 H new ATOM 0 HB2 LYS B 28 -10.938 10.456 -6.849 1.00 44.22 H new ATOM 0 HB3 LYS B 28 -10.345 11.165 -8.338 1.00 44.22 H new ATOM 0 HG2 LYS B 28 -12.769 11.362 -8.248 1.00 31.05 H new ATOM 0 HG3 LYS B 28 -12.319 10.290 -9.560 1.00 31.05 H new ATOM 0 HD2 LYS B 28 -12.835 8.304 -8.109 1.00 10.14 H new ATOM 0 HD3 LYS B 28 -13.296 9.381 -6.805 1.00 10.14 H new ATOM 0 HE2 LYS B 28 -15.293 8.562 -8.027 1.00 34.24 H new ATOM 0 HE3 LYS B 28 -15.147 10.303 -8.161 1.00 34.24 H new ATOM 0 HZ1 LYS B 28 -15.682 9.116 -10.270 1.00 34.53 H new ATOM 0 HZ2 LYS B 28 -14.312 10.115 -10.360 1.00 34.53 H new ATOM 0 HZ3 LYS B 28 -14.129 8.432 -10.234 1.00 34.53 H new ATOM 1693 N GLN B 29 -8.985 9.590 -10.359 1.00 32.34 N ATOM 1694 CA GLN B 29 -8.671 9.541 -11.812 1.00 71.34 C ATOM 1695 C GLN B 29 -7.868 8.270 -12.207 1.00 42.31 C ATOM 1696 O GLN B 29 -7.953 7.806 -13.349 1.00 3.31 O ATOM 1697 CB GLN B 29 -7.902 10.825 -12.227 1.00 31.11 C ATOM 1698 CG GLN B 29 -8.703 12.149 -12.116 1.00 2.15 C ATOM 1699 CD GLN B 29 -9.807 12.321 -13.178 1.00 33.32 C ATOM 1700 OE1 GLN B 29 -10.406 11.360 -13.659 1.00 1.11 O ATOM 1701 NE2 GLN B 29 -10.087 13.553 -13.552 1.00 40.40 N ATOM 0 H GLN B 29 -8.420 10.265 -9.844 1.00 32.34 H new ATOM 0 HA GLN B 29 -9.617 9.491 -12.351 1.00 71.34 H new ATOM 0 HB2 GLN B 29 -7.009 10.908 -11.608 1.00 31.11 H new ATOM 0 HB3 GLN B 29 -7.566 10.709 -13.258 1.00 31.11 H new ATOM 0 HG2 GLN B 29 -9.157 12.202 -11.127 1.00 2.15 H new ATOM 0 HG3 GLN B 29 -8.009 12.986 -12.193 1.00 2.15 H new ATOM 0 HE21 GLN B 29 -9.580 14.338 -13.143 1.00 40.40 H new ATOM 0 HE22 GLN B 29 -10.810 13.722 -14.251 1.00 40.40 H new ATOM 1710 N ILE B 30 -7.086 7.730 -11.264 1.00 64.32 N ATOM 1711 CA ILE B 30 -6.342 6.465 -11.461 1.00 63.32 C ATOM 1712 C ILE B 30 -7.309 5.259 -11.449 1.00 21.10 C ATOM 1713 O ILE B 30 -7.255 4.404 -12.328 1.00 22.12 O ATOM 1714 CB ILE B 30 -5.232 6.301 -10.360 1.00 52.14 C ATOM 1715 CG1 ILE B 30 -4.189 7.461 -10.477 1.00 64.24 C ATOM 1716 CG2 ILE B 30 -4.545 4.919 -10.447 1.00 65.31 C ATOM 1717 CD1 ILE B 30 -3.122 7.500 -9.396 1.00 32.21 C ATOM 0 H ILE B 30 -6.947 8.150 -10.345 1.00 64.32 H new ATOM 0 HA ILE B 30 -5.854 6.500 -12.435 1.00 63.32 H new ATOM 0 HB ILE B 30 -5.709 6.358 -9.381 1.00 52.14 H new ATOM 0 HG12 ILE B 30 -3.696 7.385 -11.446 1.00 64.24 H new ATOM 0 HG13 ILE B 30 -4.726 8.410 -10.466 1.00 64.24 H new ATOM 0 HG21 ILE B 30 -3.784 4.842 -9.671 1.00 65.31 H new ATOM 0 HG22 ILE B 30 -5.288 4.134 -10.306 1.00 65.31 H new ATOM 0 HG23 ILE B 30 -4.078 4.806 -11.426 1.00 65.31 H new ATOM 0 HD11 ILE B 30 -2.454 8.342 -9.575 1.00 32.21 H new ATOM 0 HD12 ILE B 30 -3.596 7.613 -8.421 1.00 32.21 H new ATOM 0 HD13 ILE B 30 -2.550 6.572 -9.416 1.00 32.21 H new ATOM 1729 N LYS B 31 -8.202 5.227 -10.444 1.00 11.23 N ATOM 1730 CA LYS B 31 -9.295 4.225 -10.331 1.00 34.53 C ATOM 1731 C LYS B 31 -10.256 4.280 -11.549 1.00 52.14 C ATOM 1732 O LYS B 31 -10.924 3.296 -11.857 1.00 65.44 O ATOM 1733 CB LYS B 31 -10.075 4.445 -9.006 1.00 11.34 C ATOM 1734 CG LYS B 31 -9.271 4.099 -7.723 1.00 55.44 C ATOM 1735 CD LYS B 31 -9.924 4.658 -6.434 1.00 20.43 C ATOM 1736 CE LYS B 31 -11.340 4.110 -6.163 1.00 72.53 C ATOM 1737 NZ LYS B 31 -11.340 2.672 -5.793 1.00 53.13 N ATOM 0 H LYS B 31 -8.191 5.899 -9.677 1.00 11.23 H new ATOM 0 HA LYS B 31 -8.844 3.232 -10.322 1.00 34.53 H new ATOM 0 HB2 LYS B 31 -10.390 5.487 -8.953 1.00 11.34 H new ATOM 0 HB3 LYS B 31 -10.981 3.839 -9.027 1.00 11.34 H new ATOM 0 HG2 LYS B 31 -9.180 3.016 -7.638 1.00 55.44 H new ATOM 0 HG3 LYS B 31 -8.261 4.497 -7.815 1.00 55.44 H new ATOM 0 HD2 LYS B 31 -9.285 4.423 -5.583 1.00 20.43 H new ATOM 0 HD3 LYS B 31 -9.973 5.745 -6.505 1.00 20.43 H new ATOM 0 HE2 LYS B 31 -11.800 4.687 -5.361 1.00 72.53 H new ATOM 0 HE3 LYS B 31 -11.956 4.252 -7.051 1.00 72.53 H new ATOM 0 HZ1 LYS B 31 -12.235 2.435 -5.319 1.00 53.13 H new ATOM 0 HZ2 LYS B 31 -11.239 2.093 -6.651 1.00 53.13 H new ATOM 0 HZ3 LYS B 31 -10.546 2.479 -5.149 1.00 53.13 H new ATOM 1751 N LYS B 32 -10.335 5.455 -12.202 1.00 61.31 N ATOM 1752 CA LYS B 32 -11.066 5.635 -13.476 1.00 60.31 C ATOM 1753 C LYS B 32 -10.348 4.883 -14.637 1.00 64.34 C ATOM 1754 O LYS B 32 -10.936 4.004 -15.278 1.00 33.31 O ATOM 1755 CB LYS B 32 -11.168 7.160 -13.786 1.00 22.35 C ATOM 1756 CG LYS B 32 -11.811 7.539 -15.143 1.00 2.52 C ATOM 1757 CD LYS B 32 -13.322 7.228 -15.212 1.00 54.41 C ATOM 1758 CE LYS B 32 -13.936 7.595 -16.578 1.00 31.52 C ATOM 1759 NZ LYS B 32 -13.734 9.029 -16.932 1.00 71.31 N ATOM 0 H LYS B 32 -9.894 6.309 -11.862 1.00 61.31 H new ATOM 0 HA LYS B 32 -12.067 5.214 -13.383 1.00 60.31 H new ATOM 0 HB2 LYS B 32 -11.742 7.634 -12.990 1.00 22.35 H new ATOM 0 HB3 LYS B 32 -10.165 7.585 -13.751 1.00 22.35 H new ATOM 0 HG2 LYS B 32 -11.658 8.603 -15.325 1.00 2.52 H new ATOM 0 HG3 LYS B 32 -11.300 7.002 -15.942 1.00 2.52 H new ATOM 0 HD2 LYS B 32 -13.481 6.167 -15.019 1.00 54.41 H new ATOM 0 HD3 LYS B 32 -13.839 7.777 -14.425 1.00 54.41 H new ATOM 0 HE2 LYS B 32 -13.493 6.968 -17.351 1.00 31.52 H new ATOM 0 HE3 LYS B 32 -15.004 7.375 -16.563 1.00 31.52 H new ATOM 0 HZ1 LYS B 32 -14.292 9.259 -17.779 1.00 71.31 H new ATOM 0 HZ2 LYS B 32 -14.043 9.629 -16.140 1.00 71.31 H new ATOM 0 HZ3 LYS B 32 -12.726 9.201 -17.124 1.00 71.31 H new ATOM 1773 N ALA B 33 -9.058 5.212 -14.849 1.00 53.10 N ATOM 1774 CA ALA B 33 -8.254 4.702 -15.992 1.00 42.53 C ATOM 1775 C ALA B 33 -7.961 3.181 -15.902 1.00 30.51 C ATOM 1776 O ALA B 33 -7.913 2.485 -16.919 1.00 20.21 O ATOM 1777 CB ALA B 33 -6.942 5.492 -16.078 1.00 22.43 C ATOM 0 H ALA B 33 -8.538 5.839 -14.235 1.00 53.10 H new ATOM 0 HA ALA B 33 -8.845 4.846 -16.896 1.00 42.53 H new ATOM 0 HB1 ALA B 33 -6.349 5.122 -16.914 1.00 22.43 H new ATOM 0 HB2 ALA B 33 -7.163 6.549 -16.229 1.00 22.43 H new ATOM 0 HB3 ALA B 33 -6.381 5.367 -15.152 1.00 22.43 H new ATOM 1783 N THR B 34 -7.751 2.687 -14.673 1.00 65.12 N ATOM 1784 CA THR B 34 -7.453 1.254 -14.398 1.00 44.13 C ATOM 1785 C THR B 34 -8.731 0.445 -14.080 1.00 62.15 C ATOM 1786 O THR B 34 -8.690 -0.790 -14.028 1.00 73.41 O ATOM 1787 CB THR B 34 -6.456 1.111 -13.202 1.00 72.43 C ATOM 1788 OG1 THR B 34 -7.049 1.651 -12.003 1.00 11.11 O ATOM 1789 CG2 THR B 34 -5.120 1.828 -13.478 1.00 71.03 C ATOM 0 H THR B 34 -7.781 3.263 -13.832 1.00 65.12 H new ATOM 0 HA THR B 34 -7.003 0.853 -15.306 1.00 44.13 H new ATOM 0 HB THR B 34 -6.249 0.049 -13.073 1.00 72.43 H new ATOM 0 HG1 THR B 34 -7.103 2.627 -12.076 1.00 11.11 H new ATOM 0 HG21 THR B 34 -4.457 1.704 -12.622 1.00 71.03 H new ATOM 0 HG22 THR B 34 -4.653 1.399 -14.364 1.00 71.03 H new ATOM 0 HG23 THR B 34 -5.304 2.890 -13.643 1.00 71.03 H new ATOM 1797 N LYS B 35 -9.846 1.168 -13.829 1.00 21.41 N ATOM 1798 CA LYS B 35 -11.185 0.594 -13.508 1.00 62.24 C ATOM 1799 C LYS B 35 -11.195 -0.114 -12.120 1.00 25.35 C ATOM 1800 O LYS B 35 -12.103 -0.904 -11.822 1.00 53.42 O ATOM 1801 CB LYS B 35 -11.715 -0.356 -14.629 1.00 33.34 C ATOM 1802 CG LYS B 35 -11.735 0.264 -16.048 1.00 4.11 C ATOM 1803 CD LYS B 35 -12.399 -0.654 -17.105 1.00 4.23 C ATOM 1804 CE LYS B 35 -11.799 -2.075 -17.143 1.00 40.20 C ATOM 1805 NZ LYS B 35 -10.334 -2.087 -17.422 1.00 34.45 N ATOM 0 H LYS B 35 -9.847 2.188 -13.843 1.00 21.41 H new ATOM 0 HA LYS B 35 -11.872 1.438 -13.456 1.00 62.24 H new ATOM 0 HB2 LYS B 35 -11.096 -1.253 -14.648 1.00 33.34 H new ATOM 0 HB3 LYS B 35 -12.726 -0.671 -14.371 1.00 33.34 H new ATOM 0 HG2 LYS B 35 -12.268 1.214 -16.015 1.00 4.11 H new ATOM 0 HG3 LYS B 35 -10.713 0.483 -16.357 1.00 4.11 H new ATOM 0 HD2 LYS B 35 -13.467 -0.723 -16.896 1.00 4.23 H new ATOM 0 HD3 LYS B 35 -12.296 -0.197 -18.089 1.00 4.23 H new ATOM 0 HE2 LYS B 35 -11.984 -2.566 -16.188 1.00 40.20 H new ATOM 0 HE3 LYS B 35 -12.313 -2.659 -17.907 1.00 40.20 H new ATOM 0 HZ1 LYS B 35 -9.991 -3.069 -17.435 1.00 34.45 H new ATOM 0 HZ2 LYS B 35 -10.153 -1.645 -18.346 1.00 34.45 H new ATOM 0 HZ3 LYS B 35 -9.835 -1.555 -16.680 1.00 34.45 H new ATOM 1819 N LEU B 36 -10.201 0.218 -11.261 1.00 70.32 N ATOM 1820 CA LEU B 36 -10.085 -0.351 -9.899 1.00 42.12 C ATOM 1821 C LEU B 36 -11.106 0.314 -8.947 1.00 42.42 C ATOM 1822 O LEU B 36 -10.781 1.261 -8.225 1.00 13.45 O ATOM 1823 CB LEU B 36 -8.633 -0.208 -9.345 1.00 43.13 C ATOM 1824 CG LEU B 36 -7.520 -0.997 -10.108 1.00 74.33 C ATOM 1825 CD1 LEU B 36 -6.134 -0.763 -9.462 1.00 60.31 C ATOM 1826 CD2 LEU B 36 -7.857 -2.506 -10.201 1.00 62.23 C ATOM 0 H LEU B 36 -9.463 0.883 -11.492 1.00 70.32 H new ATOM 0 HA LEU B 36 -10.310 -1.416 -9.959 1.00 42.12 H new ATOM 0 HB2 LEU B 36 -8.367 0.849 -9.350 1.00 43.13 H new ATOM 0 HB3 LEU B 36 -8.630 -0.533 -8.304 1.00 43.13 H new ATOM 0 HG LEU B 36 -7.479 -0.613 -11.127 1.00 74.33 H new ATOM 0 HD11 LEU B 36 -5.377 -1.323 -10.011 1.00 60.31 H new ATOM 0 HD12 LEU B 36 -5.893 0.300 -9.493 1.00 60.31 H new ATOM 0 HD13 LEU B 36 -6.154 -1.101 -8.426 1.00 60.31 H new ATOM 0 HD21 LEU B 36 -7.062 -3.024 -10.738 1.00 62.23 H new ATOM 0 HD22 LEU B 36 -7.948 -2.921 -9.197 1.00 62.23 H new ATOM 0 HD23 LEU B 36 -8.799 -2.636 -10.734 1.00 62.23 H new ATOM 1838 N LYS B 37 -12.358 -0.179 -8.992 1.00 11.22 N ATOM 1839 CA LYS B 37 -13.475 0.352 -8.178 1.00 1.24 C ATOM 1840 C LYS B 37 -13.279 0.089 -6.662 1.00 51.12 C ATOM 1841 O LYS B 37 -13.876 0.780 -5.834 1.00 71.33 O ATOM 1842 CB LYS B 37 -14.820 -0.235 -8.681 1.00 5.43 C ATOM 1843 CG LYS B 37 -15.197 0.201 -10.124 1.00 74.41 C ATOM 1844 CD LYS B 37 -16.472 -0.495 -10.655 1.00 53.41 C ATOM 1845 CE LYS B 37 -16.289 -2.013 -10.820 1.00 13.20 C ATOM 1846 NZ LYS B 37 -17.516 -2.679 -11.310 1.00 22.11 N ATOM 0 H LYS B 37 -12.627 -0.958 -9.594 1.00 11.22 H new ATOM 0 HA LYS B 37 -13.491 1.435 -8.301 1.00 1.24 H new ATOM 0 HB2 LYS B 37 -14.767 -1.323 -8.643 1.00 5.43 H new ATOM 0 HB3 LYS B 37 -15.615 0.070 -8.001 1.00 5.43 H new ATOM 0 HG2 LYS B 37 -15.345 1.281 -10.144 1.00 74.41 H new ATOM 0 HG3 LYS B 37 -14.365 -0.019 -10.793 1.00 74.41 H new ATOM 0 HD2 LYS B 37 -17.298 -0.304 -9.970 1.00 53.41 H new ATOM 0 HD3 LYS B 37 -16.747 -0.059 -11.615 1.00 53.41 H new ATOM 0 HE2 LYS B 37 -15.472 -2.204 -11.516 1.00 13.20 H new ATOM 0 HE3 LYS B 37 -16.000 -2.448 -9.863 1.00 13.20 H new ATOM 0 HZ1 LYS B 37 -17.343 -3.700 -11.405 1.00 22.11 H new ATOM 0 HZ2 LYS B 37 -18.290 -2.521 -10.634 1.00 22.11 H new ATOM 0 HZ3 LYS B 37 -17.779 -2.285 -12.236 1.00 22.11 H new ATOM 1860 N ALA B 38 -12.416 -0.885 -6.305 1.00 40.24 N ATOM 1861 CA ALA B 38 -12.029 -1.128 -4.903 1.00 41.31 C ATOM 1862 C ALA B 38 -10.807 -0.260 -4.541 1.00 54.22 C ATOM 1863 O ALA B 38 -9.858 -0.141 -5.328 1.00 53.44 O ATOM 1864 CB ALA B 38 -11.730 -2.614 -4.650 1.00 60.12 C ATOM 0 H ALA B 38 -11.974 -1.517 -6.972 1.00 40.24 H new ATOM 0 HA ALA B 38 -12.868 -0.851 -4.265 1.00 41.31 H new ATOM 0 HB1 ALA B 38 -11.448 -2.756 -3.607 1.00 60.12 H new ATOM 0 HB2 ALA B 38 -12.618 -3.206 -4.870 1.00 60.12 H new ATOM 0 HB3 ALA B 38 -10.911 -2.935 -5.294 1.00 60.12 H new ATOM 1870 N ASP B 39 -10.867 0.365 -3.361 1.00 43.21 N ATOM 1871 CA ASP B 39 -9.781 1.207 -2.804 1.00 43.02 C ATOM 1872 C ASP B 39 -8.501 0.376 -2.521 1.00 60.35 C ATOM 1873 O ASP B 39 -7.379 0.855 -2.710 1.00 55.23 O ATOM 1874 CB ASP B 39 -10.300 1.914 -1.511 1.00 44.41 C ATOM 1875 CG ASP B 39 -10.722 0.942 -0.379 1.00 72.21 C ATOM 1876 OD1 ASP B 39 -11.580 0.064 -0.618 1.00 24.44 O ATOM 1877 OD2 ASP B 39 -10.190 1.038 0.752 1.00 20.42 O ATOM 0 H ASP B 39 -11.681 0.305 -2.749 1.00 43.21 H new ATOM 0 HA ASP B 39 -9.503 1.962 -3.540 1.00 43.02 H new ATOM 0 HB2 ASP B 39 -9.520 2.575 -1.134 1.00 44.41 H new ATOM 0 HB3 ASP B 39 -11.152 2.542 -1.771 1.00 44.41 H new ATOM 1882 N LYS B 40 -8.721 -0.874 -2.101 1.00 33.41 N ATOM 1883 CA LYS B 40 -7.667 -1.828 -1.675 1.00 5.42 C ATOM 1884 C LYS B 40 -6.598 -2.085 -2.772 1.00 34.34 C ATOM 1885 O LYS B 40 -5.393 -2.028 -2.500 1.00 4.32 O ATOM 1886 CB LYS B 40 -8.345 -3.161 -1.281 1.00 71.12 C ATOM 1887 CG LYS B 40 -9.503 -3.012 -0.271 1.00 53.21 C ATOM 1888 CD LYS B 40 -9.041 -2.632 1.149 1.00 55.31 C ATOM 1889 CE LYS B 40 -10.221 -2.577 2.136 1.00 30.13 C ATOM 1890 NZ LYS B 40 -11.213 -1.522 1.781 1.00 12.35 N ATOM 0 H LYS B 40 -9.659 -1.270 -2.043 1.00 33.41 H new ATOM 0 HA LYS B 40 -7.140 -1.387 -0.829 1.00 5.42 H new ATOM 0 HB2 LYS B 40 -8.725 -3.642 -2.182 1.00 71.12 H new ATOM 0 HB3 LYS B 40 -7.593 -3.826 -0.857 1.00 71.12 H new ATOM 0 HG2 LYS B 40 -10.195 -2.252 -0.634 1.00 53.21 H new ATOM 0 HG3 LYS B 40 -10.056 -3.950 -0.225 1.00 53.21 H new ATOM 0 HD2 LYS B 40 -8.307 -3.358 1.499 1.00 55.31 H new ATOM 0 HD3 LYS B 40 -8.543 -1.663 1.123 1.00 55.31 H new ATOM 0 HE2 LYS B 40 -10.718 -3.547 2.157 1.00 30.13 H new ATOM 0 HE3 LYS B 40 -9.842 -2.391 3.141 1.00 30.13 H new ATOM 0 HZ1 LYS B 40 -11.894 -1.410 2.559 1.00 12.35 H new ATOM 0 HZ2 LYS B 40 -10.719 -0.621 1.620 1.00 12.35 H new ATOM 0 HZ3 LYS B 40 -11.719 -1.798 0.916 1.00 12.35 H new ATOM 1904 N ASP B 41 -7.068 -2.333 -4.011 1.00 55.33 N ATOM 1905 CA ASP B 41 -6.200 -2.642 -5.172 1.00 72.31 C ATOM 1906 C ASP B 41 -5.287 -1.445 -5.529 1.00 34.35 C ATOM 1907 O ASP B 41 -4.146 -1.633 -5.978 1.00 13.10 O ATOM 1908 CB ASP B 41 -7.068 -3.034 -6.391 1.00 64.21 C ATOM 1909 CG ASP B 41 -7.855 -4.333 -6.172 1.00 10.33 C ATOM 1910 OD1 ASP B 41 -8.936 -4.289 -5.546 1.00 54.24 O ATOM 1911 OD2 ASP B 41 -7.385 -5.413 -6.602 1.00 45.23 O ATOM 0 H ASP B 41 -8.062 -2.325 -4.238 1.00 55.33 H new ATOM 0 HA ASP B 41 -5.559 -3.481 -4.901 1.00 72.31 H new ATOM 0 HB2 ASP B 41 -7.765 -2.225 -6.609 1.00 64.21 H new ATOM 0 HB3 ASP B 41 -6.427 -3.147 -7.266 1.00 64.21 H new ATOM 1916 N PHE B 42 -5.803 -0.221 -5.306 1.00 1.04 N ATOM 1917 CA PHE B 42 -5.039 1.019 -5.523 1.00 33.30 C ATOM 1918 C PHE B 42 -3.842 1.121 -4.542 1.00 21.14 C ATOM 1919 O PHE B 42 -2.728 1.400 -4.967 1.00 24.51 O ATOM 1920 CB PHE B 42 -5.953 2.270 -5.397 1.00 24.32 C ATOM 1921 CG PHE B 42 -5.187 3.587 -5.512 1.00 55.44 C ATOM 1922 CD1 PHE B 42 -4.625 3.971 -6.728 1.00 61.23 C ATOM 1923 CD2 PHE B 42 -4.992 4.413 -4.405 1.00 21.11 C ATOM 1924 CE1 PHE B 42 -3.903 5.138 -6.832 1.00 60.11 C ATOM 1925 CE2 PHE B 42 -4.264 5.578 -4.514 1.00 23.33 C ATOM 1926 CZ PHE B 42 -3.720 5.941 -5.728 1.00 52.54 C ATOM 0 H PHE B 42 -6.754 -0.066 -4.973 1.00 1.04 H new ATOM 0 HA PHE B 42 -4.644 0.985 -6.538 1.00 33.30 H new ATOM 0 HB2 PHE B 42 -6.718 2.233 -6.172 1.00 24.32 H new ATOM 0 HB3 PHE B 42 -6.470 2.240 -4.438 1.00 24.32 H new ATOM 0 HD1 PHE B 42 -4.758 3.346 -7.599 1.00 61.23 H new ATOM 0 HD2 PHE B 42 -5.417 4.136 -3.451 1.00 21.11 H new ATOM 0 HE1 PHE B 42 -3.478 5.425 -7.783 1.00 60.11 H new ATOM 0 HE2 PHE B 42 -4.119 6.207 -3.648 1.00 23.33 H new ATOM 0 HZ PHE B 42 -3.151 6.855 -5.813 1.00 52.54 H new ATOM 1936 N PHE B 43 -4.094 0.883 -3.236 1.00 51.40 N ATOM 1937 CA PHE B 43 -3.069 1.066 -2.165 1.00 65.45 C ATOM 1938 C PHE B 43 -1.868 0.109 -2.336 1.00 72.53 C ATOM 1939 O PHE B 43 -0.715 0.503 -2.140 1.00 42.34 O ATOM 1940 CB PHE B 43 -3.693 0.860 -0.760 1.00 35.30 C ATOM 1941 CG PHE B 43 -4.889 1.760 -0.461 1.00 3.21 C ATOM 1942 CD1 PHE B 43 -4.849 3.125 -0.757 1.00 5.35 C ATOM 1943 CD2 PHE B 43 -6.047 1.243 0.112 1.00 21.52 C ATOM 1944 CE1 PHE B 43 -5.931 3.939 -0.492 1.00 22.11 C ATOM 1945 CE2 PHE B 43 -7.127 2.054 0.378 1.00 40.23 C ATOM 1946 CZ PHE B 43 -7.073 3.403 0.074 1.00 71.12 C ATOM 0 H PHE B 43 -4.998 0.563 -2.890 1.00 51.40 H new ATOM 0 HA PHE B 43 -2.705 2.089 -2.256 1.00 65.45 H new ATOM 0 HB2 PHE B 43 -4.004 -0.180 -0.663 1.00 35.30 H new ATOM 0 HB3 PHE B 43 -2.925 1.035 -0.006 1.00 35.30 H new ATOM 0 HD1 PHE B 43 -3.959 3.548 -1.199 1.00 5.35 H new ATOM 0 HD2 PHE B 43 -6.099 0.191 0.351 1.00 21.52 H new ATOM 0 HE1 PHE B 43 -5.886 4.992 -0.726 1.00 22.11 H new ATOM 0 HE2 PHE B 43 -8.018 1.637 0.824 1.00 40.23 H new ATOM 0 HZ PHE B 43 -7.923 4.037 0.279 1.00 71.12 H new ATOM 1956 N LEU B 44 -2.164 -1.148 -2.694 1.00 51.02 N ATOM 1957 CA LEU B 44 -1.138 -2.188 -2.917 1.00 53.52 C ATOM 1958 C LEU B 44 -0.299 -1.894 -4.190 1.00 31.13 C ATOM 1959 O LEU B 44 0.937 -1.993 -4.158 1.00 12.40 O ATOM 1960 CB LEU B 44 -1.809 -3.596 -2.978 1.00 33.13 C ATOM 1961 CG LEU B 44 -2.134 -4.269 -1.592 1.00 11.45 C ATOM 1962 CD1 LEU B 44 -3.093 -3.424 -0.721 1.00 5.25 C ATOM 1963 CD2 LEU B 44 -2.681 -5.697 -1.786 1.00 40.20 C ATOM 0 H LEU B 44 -3.119 -1.477 -2.838 1.00 51.02 H new ATOM 0 HA LEU B 44 -0.445 -2.177 -2.076 1.00 53.52 H new ATOM 0 HB2 LEU B 44 -2.737 -3.510 -3.543 1.00 33.13 H new ATOM 0 HB3 LEU B 44 -1.155 -4.264 -3.539 1.00 33.13 H new ATOM 0 HG LEU B 44 -1.191 -4.327 -1.048 1.00 11.45 H new ATOM 0 HD11 LEU B 44 -3.279 -3.940 0.221 1.00 5.25 H new ATOM 0 HD12 LEU B 44 -2.641 -2.453 -0.520 1.00 5.25 H new ATOM 0 HD13 LEU B 44 -4.036 -3.283 -1.250 1.00 5.25 H new ATOM 0 HD21 LEU B 44 -2.897 -6.139 -0.813 1.00 40.20 H new ATOM 0 HD22 LEU B 44 -3.595 -5.659 -2.379 1.00 40.20 H new ATOM 0 HD23 LEU B 44 -1.938 -6.304 -2.303 1.00 40.20 H new ATOM 1975 N GLY B 45 -0.981 -1.508 -5.293 1.00 72.54 N ATOM 1976 CA GLY B 45 -0.293 -1.112 -6.541 1.00 35.40 C ATOM 1977 C GLY B 45 0.612 0.118 -6.361 1.00 25.50 C ATOM 1978 O GLY B 45 1.769 0.114 -6.774 1.00 65.41 O ATOM 0 H GLY B 45 -1.999 -1.463 -5.343 1.00 72.54 H new ATOM 0 HA2 GLY B 45 0.306 -1.948 -6.901 1.00 35.40 H new ATOM 0 HA3 GLY B 45 -1.037 -0.900 -7.309 1.00 35.40 H new ATOM 1982 N LEU B 46 0.069 1.145 -5.683 1.00 33.33 N ATOM 1983 CA LEU B 46 0.788 2.403 -5.354 1.00 11.20 C ATOM 1984 C LEU B 46 2.014 2.144 -4.443 1.00 3.00 C ATOM 1985 O LEU B 46 3.063 2.767 -4.608 1.00 72.25 O ATOM 1986 CB LEU B 46 -0.194 3.383 -4.658 1.00 31.13 C ATOM 1987 CG LEU B 46 0.405 4.719 -4.110 1.00 71.14 C ATOM 1988 CD1 LEU B 46 1.028 5.573 -5.236 1.00 71.03 C ATOM 1989 CD2 LEU B 46 -0.657 5.508 -3.314 1.00 73.43 C ATOM 0 H LEU B 46 -0.892 1.131 -5.341 1.00 33.33 H new ATOM 0 HA LEU B 46 1.158 2.838 -6.282 1.00 11.20 H new ATOM 0 HB2 LEU B 46 -0.984 3.632 -5.367 1.00 31.13 H new ATOM 0 HB3 LEU B 46 -0.665 2.857 -3.827 1.00 31.13 H new ATOM 0 HG LEU B 46 1.215 4.465 -3.426 1.00 71.14 H new ATOM 0 HD11 LEU B 46 1.433 6.493 -4.814 1.00 71.03 H new ATOM 0 HD12 LEU B 46 1.829 5.012 -5.718 1.00 71.03 H new ATOM 0 HD13 LEU B 46 0.263 5.818 -5.972 1.00 71.03 H new ATOM 0 HD21 LEU B 46 -0.219 6.434 -2.942 1.00 73.43 H new ATOM 0 HD22 LEU B 46 -1.500 5.741 -3.964 1.00 73.43 H new ATOM 0 HD23 LEU B 46 -1.003 4.907 -2.473 1.00 73.43 H new ATOM 2001 N GLY B 47 1.861 1.192 -3.508 1.00 51.34 N ATOM 2002 CA GLY B 47 2.933 0.806 -2.573 1.00 12.24 C ATOM 2003 C GLY B 47 4.162 0.233 -3.284 1.00 35.01 C ATOM 2004 O GLY B 47 5.302 0.384 -2.825 1.00 11.33 O ATOM 0 H GLY B 47 0.995 0.670 -3.378 1.00 51.34 H new ATOM 0 HA2 GLY B 47 3.230 1.677 -1.988 1.00 12.24 H new ATOM 0 HA3 GLY B 47 2.548 0.067 -1.871 1.00 12.24 H new ATOM 2008 N TRP B 48 3.907 -0.425 -4.425 1.00 31.40 N ATOM 2009 CA TRP B 48 4.956 -0.979 -5.296 1.00 42.03 C ATOM 2010 C TRP B 48 5.634 0.142 -6.144 1.00 2.51 C ATOM 2011 O TRP B 48 6.808 0.045 -6.497 1.00 25.41 O ATOM 2012 CB TRP B 48 4.343 -2.068 -6.208 1.00 71.43 C ATOM 2013 CG TRP B 48 5.352 -3.058 -6.721 1.00 35.11 C ATOM 2014 CD1 TRP B 48 6.223 -2.906 -7.764 1.00 42.13 C ATOM 2015 CD2 TRP B 48 5.592 -4.359 -6.185 1.00 14.22 C ATOM 2016 NE1 TRP B 48 6.998 -4.023 -7.889 1.00 74.12 N ATOM 2017 CE2 TRP B 48 6.624 -4.933 -6.937 1.00 4.20 C ATOM 2018 CE3 TRP B 48 5.030 -5.084 -5.133 1.00 62.32 C ATOM 2019 CZ2 TRP B 48 7.108 -6.202 -6.675 1.00 43.12 C ATOM 2020 CZ3 TRP B 48 5.505 -6.348 -4.874 1.00 60.34 C ATOM 2021 CH2 TRP B 48 6.539 -6.898 -5.636 1.00 32.40 C ATOM 0 H TRP B 48 2.962 -0.589 -4.772 1.00 31.40 H new ATOM 0 HA TRP B 48 5.731 -1.428 -4.675 1.00 42.03 H new ATOM 0 HB2 TRP B 48 3.571 -2.602 -5.654 1.00 71.43 H new ATOM 0 HB3 TRP B 48 3.853 -1.588 -7.055 1.00 71.43 H new ATOM 0 HD1 TRP B 48 6.288 -2.032 -8.395 1.00 42.13 H new ATOM 0 HE1 TRP B 48 7.736 -4.158 -8.580 1.00 74.12 H new ATOM 0 HE3 TRP B 48 4.237 -4.660 -4.534 1.00 62.32 H new ATOM 0 HZ2 TRP B 48 7.904 -6.630 -7.266 1.00 43.12 H new ATOM 0 HZ3 TRP B 48 5.072 -6.924 -4.070 1.00 60.34 H new ATOM 0 HH2 TRP B 48 6.898 -7.890 -5.404 1.00 32.40 H new ATOM 2032 N LEU B 49 4.874 1.198 -6.480 1.00 3.10 N ATOM 2033 CA LEU B 49 5.435 2.420 -7.135 1.00 43.12 C ATOM 2034 C LEU B 49 6.467 3.119 -6.213 1.00 74.32 C ATOM 2035 O LEU B 49 7.425 3.751 -6.688 1.00 71.12 O ATOM 2036 CB LEU B 49 4.285 3.407 -7.529 1.00 54.40 C ATOM 2037 CG LEU B 49 3.552 3.152 -8.890 1.00 70.21 C ATOM 2038 CD1 LEU B 49 3.249 1.683 -9.097 1.00 54.34 C ATOM 2039 CD2 LEU B 49 2.254 3.985 -8.995 1.00 52.22 C ATOM 0 H LEU B 49 3.869 1.242 -6.314 1.00 3.10 H new ATOM 0 HA LEU B 49 5.952 2.112 -8.044 1.00 43.12 H new ATOM 0 HB2 LEU B 49 3.538 3.388 -6.735 1.00 54.40 H new ATOM 0 HB3 LEU B 49 4.699 4.415 -7.553 1.00 54.40 H new ATOM 0 HG LEU B 49 4.232 3.471 -9.680 1.00 70.21 H new ATOM 0 HD11 LEU B 49 2.741 1.547 -10.052 1.00 54.34 H new ATOM 0 HD12 LEU B 49 4.180 1.116 -9.098 1.00 54.34 H new ATOM 0 HD13 LEU B 49 2.608 1.327 -8.291 1.00 54.34 H new ATOM 0 HD21 LEU B 49 1.770 3.785 -9.951 1.00 52.22 H new ATOM 0 HD22 LEU B 49 1.580 3.713 -8.183 1.00 52.22 H new ATOM 0 HD23 LEU B 49 2.496 5.046 -8.926 1.00 52.22 H new ATOM 2051 N LEU B 50 6.245 2.990 -4.894 1.00 24.50 N ATOM 2052 CA LEU B 50 7.125 3.564 -3.862 1.00 53.55 C ATOM 2053 C LEU B 50 8.499 2.831 -3.779 1.00 22.11 C ATOM 2054 O LEU B 50 9.510 3.487 -3.519 1.00 10.25 O ATOM 2055 CB LEU B 50 6.413 3.571 -2.478 1.00 12.51 C ATOM 2056 CG LEU B 50 4.982 4.216 -2.424 1.00 4.12 C ATOM 2057 CD1 LEU B 50 4.433 4.273 -0.981 1.00 60.01 C ATOM 2058 CD2 LEU B 50 4.952 5.604 -3.099 1.00 74.33 C ATOM 0 H LEU B 50 5.447 2.483 -4.512 1.00 24.50 H new ATOM 0 HA LEU B 50 7.334 4.593 -4.153 1.00 53.55 H new ATOM 0 HB2 LEU B 50 6.335 2.541 -2.130 1.00 12.51 H new ATOM 0 HB3 LEU B 50 7.051 4.099 -1.770 1.00 12.51 H new ATOM 0 HG LEU B 50 4.319 3.567 -2.996 1.00 4.12 H new ATOM 0 HD11 LEU B 50 3.441 4.726 -0.987 1.00 60.01 H new ATOM 0 HD12 LEU B 50 4.369 3.263 -0.576 1.00 60.01 H new ATOM 0 HD13 LEU B 50 5.101 4.871 -0.361 1.00 60.01 H new ATOM 0 HD21 LEU B 50 3.944 6.016 -3.040 1.00 74.33 H new ATOM 0 HD22 LEU B 50 5.647 6.271 -2.590 1.00 74.33 H new ATOM 0 HD23 LEU B 50 5.243 5.506 -4.145 1.00 74.33 H new ATOM 2070 N ARG B 51 8.538 1.477 -4.004 1.00 3.33 N ATOM 2071 CA ARG B 51 9.817 0.692 -3.902 1.00 53.44 C ATOM 2072 C ARG B 51 10.880 1.130 -4.927 1.00 3.43 C ATOM 2073 O ARG B 51 12.078 1.115 -4.632 1.00 2.34 O ATOM 2074 CB ARG B 51 9.616 -0.860 -4.004 1.00 21.34 C ATOM 2075 CG ARG B 51 9.196 -1.436 -5.382 1.00 11.13 C ATOM 2076 CD ARG B 51 9.515 -2.930 -5.537 1.00 60.23 C ATOM 2077 NE ARG B 51 8.835 -3.769 -4.540 1.00 5.25 N ATOM 2078 CZ ARG B 51 9.267 -4.937 -4.118 1.00 50.12 C ATOM 2079 NH1 ARG B 51 10.372 -5.451 -4.550 1.00 11.14 N ATOM 2080 NH2 ARG B 51 8.585 -5.585 -3.246 1.00 41.12 N ATOM 0 H ARG B 51 7.721 0.918 -4.251 1.00 3.33 H new ATOM 0 HA ARG B 51 10.179 0.922 -2.900 1.00 53.44 H new ATOM 0 HB2 ARG B 51 10.548 -1.341 -3.708 1.00 21.34 H new ATOM 0 HB3 ARG B 51 8.861 -1.151 -3.273 1.00 21.34 H new ATOM 0 HG2 ARG B 51 8.126 -1.284 -5.521 1.00 11.13 H new ATOM 0 HG3 ARG B 51 9.702 -0.879 -6.171 1.00 11.13 H new ATOM 0 HD2 ARG B 51 9.226 -3.256 -6.536 1.00 60.23 H new ATOM 0 HD3 ARG B 51 10.592 -3.077 -5.453 1.00 60.23 H new ATOM 0 HE ARG B 51 7.962 -3.419 -4.146 1.00 5.25 H new ATOM 0 HH11 ARG B 51 10.934 -4.948 -5.237 1.00 11.14 H new ATOM 0 HH12 ARG B 51 10.682 -6.359 -4.204 1.00 11.14 H new ATOM 0 HH21 ARG B 51 7.715 -5.194 -2.885 1.00 41.12 H new ATOM 0 HH22 ARG B 51 8.913 -6.492 -2.913 1.00 41.12 H new ATOM 2094 N GLU B 52 10.432 1.507 -6.131 1.00 73.33 N ATOM 2095 CA GLU B 52 11.332 1.906 -7.230 1.00 3.25 C ATOM 2096 C GLU B 52 11.523 3.432 -7.266 1.00 22.22 C ATOM 2097 O GLU B 52 12.354 3.930 -8.034 1.00 33.31 O ATOM 2098 CB GLU B 52 10.778 1.364 -8.578 1.00 34.21 C ATOM 2099 CG GLU B 52 10.628 -0.173 -8.598 1.00 14.53 C ATOM 2100 CD GLU B 52 10.081 -0.738 -9.918 1.00 21.01 C ATOM 2101 OE1 GLU B 52 8.857 -0.690 -10.126 1.00 71.52 O ATOM 2102 OE2 GLU B 52 10.871 -1.247 -10.742 1.00 32.11 O ATOM 0 H GLU B 52 9.442 1.545 -6.374 1.00 73.33 H new ATOM 0 HA GLU B 52 12.316 1.470 -7.060 1.00 3.25 H new ATOM 0 HB2 GLU B 52 9.808 1.820 -8.775 1.00 34.21 H new ATOM 0 HB3 GLU B 52 11.443 1.669 -9.386 1.00 34.21 H new ATOM 0 HG2 GLU B 52 11.600 -0.624 -8.399 1.00 14.53 H new ATOM 0 HG3 GLU B 52 9.965 -0.472 -7.786 1.00 14.53 H new ATOM 2109 N ASP B 53 10.726 4.160 -6.434 1.00 20.44 N ATOM 2110 CA ASP B 53 10.776 5.640 -6.312 1.00 65.30 C ATOM 2111 C ASP B 53 10.371 6.311 -7.647 1.00 11.53 C ATOM 2112 O ASP B 53 10.752 7.451 -7.929 1.00 22.41 O ATOM 2113 CB ASP B 53 12.182 6.119 -5.813 1.00 44.44 C ATOM 2114 CG ASP B 53 12.482 5.714 -4.357 1.00 40.24 C ATOM 2115 OD1 ASP B 53 12.562 4.502 -4.065 1.00 34.54 O ATOM 2116 OD2 ASP B 53 12.618 6.603 -3.492 1.00 41.52 O ATOM 0 H ASP B 53 10.028 3.731 -5.827 1.00 20.44 H new ATOM 0 HA ASP B 53 10.051 5.949 -5.559 1.00 65.30 H new ATOM 0 HB2 ASP B 53 12.952 5.704 -6.464 1.00 44.44 H new ATOM 0 HB3 ASP B 53 12.241 7.204 -5.901 1.00 44.44 H new ATOM 2121 N LYS B 54 9.526 5.604 -8.420 1.00 33.34 N ATOM 2122 CA LYS B 54 9.156 5.985 -9.798 1.00 32.20 C ATOM 2123 C LYS B 54 7.985 6.997 -9.827 1.00 54.01 C ATOM 2124 O LYS B 54 7.582 7.462 -10.901 1.00 51.52 O ATOM 2125 CB LYS B 54 8.811 4.695 -10.584 1.00 14.14 C ATOM 2126 CG LYS B 54 7.572 3.920 -10.057 1.00 4.31 C ATOM 2127 CD LYS B 54 7.538 2.434 -10.499 1.00 43.13 C ATOM 2128 CE LYS B 54 7.707 2.228 -12.018 1.00 34.34 C ATOM 2129 NZ LYS B 54 7.695 0.793 -12.390 1.00 74.33 N ATOM 0 H LYS B 54 9.076 4.745 -8.104 1.00 33.34 H new ATOM 0 HA LYS B 54 9.999 6.490 -10.269 1.00 32.20 H new ATOM 0 HB2 LYS B 54 8.640 4.958 -11.628 1.00 14.14 H new ATOM 0 HB3 LYS B 54 9.675 4.030 -10.560 1.00 14.14 H new ATOM 0 HG2 LYS B 54 7.560 3.967 -8.968 1.00 4.31 H new ATOM 0 HG3 LYS B 54 6.667 4.416 -10.408 1.00 4.31 H new ATOM 0 HD2 LYS B 54 8.328 1.893 -9.979 1.00 43.13 H new ATOM 0 HD3 LYS B 54 6.591 1.994 -10.186 1.00 43.13 H new ATOM 0 HE2 LYS B 54 6.906 2.746 -12.545 1.00 34.34 H new ATOM 0 HE3 LYS B 54 8.645 2.679 -12.343 1.00 34.34 H new ATOM 0 HZ1 LYS B 54 8.268 0.652 -13.246 1.00 74.33 H new ATOM 0 HZ2 LYS B 54 8.091 0.229 -11.611 1.00 74.33 H new ATOM 0 HZ3 LYS B 54 6.717 0.490 -12.574 1.00 74.33 H new ATOM 2143 N VAL B 55 7.438 7.325 -8.630 1.00 3.05 N ATOM 2144 CA VAL B 55 6.344 8.319 -8.475 1.00 12.24 C ATOM 2145 C VAL B 55 6.613 9.323 -7.330 1.00 1.25 C ATOM 2146 O VAL B 55 7.408 9.062 -6.421 1.00 51.12 O ATOM 2147 CB VAL B 55 4.948 7.637 -8.211 1.00 43.34 C ATOM 2148 CG1 VAL B 55 4.540 6.730 -9.390 1.00 13.22 C ATOM 2149 CG2 VAL B 55 4.931 6.874 -6.859 1.00 13.20 C ATOM 0 H VAL B 55 7.740 6.911 -7.748 1.00 3.05 H new ATOM 0 HA VAL B 55 6.315 8.853 -9.425 1.00 12.24 H new ATOM 0 HB VAL B 55 4.202 8.428 -8.136 1.00 43.34 H new ATOM 0 HG11 VAL B 55 3.573 6.273 -9.180 1.00 13.22 H new ATOM 0 HG12 VAL B 55 4.470 7.326 -10.300 1.00 13.22 H new ATOM 0 HG13 VAL B 55 5.289 5.949 -9.525 1.00 13.22 H new ATOM 0 HG21 VAL B 55 3.953 6.417 -6.711 1.00 13.20 H new ATOM 0 HG22 VAL B 55 5.696 6.098 -6.870 1.00 13.20 H new ATOM 0 HG23 VAL B 55 5.132 7.571 -6.045 1.00 13.20 H new ATOM 2159 N VAL B 56 5.938 10.482 -7.412 1.00 35.51 N ATOM 2160 CA VAL B 56 5.835 11.456 -6.309 1.00 64.44 C ATOM 2161 C VAL B 56 4.387 11.471 -5.771 1.00 14.44 C ATOM 2162 O VAL B 56 3.448 11.716 -6.526 1.00 61.01 O ATOM 2163 CB VAL B 56 6.244 12.903 -6.779 1.00 15.31 C ATOM 2164 CG1 VAL B 56 6.116 13.937 -5.624 1.00 43.23 C ATOM 2165 CG2 VAL B 56 7.675 12.909 -7.369 1.00 4.41 C ATOM 0 H VAL B 56 5.443 10.773 -8.255 1.00 35.51 H new ATOM 0 HA VAL B 56 6.523 11.153 -5.520 1.00 64.44 H new ATOM 0 HB VAL B 56 5.550 13.201 -7.565 1.00 15.31 H new ATOM 0 HG11 VAL B 56 6.406 14.924 -5.985 1.00 43.23 H new ATOM 0 HG12 VAL B 56 5.084 13.967 -5.276 1.00 43.23 H new ATOM 0 HG13 VAL B 56 6.768 13.646 -4.801 1.00 43.23 H new ATOM 0 HG21 VAL B 56 7.934 13.919 -7.686 1.00 4.41 H new ATOM 0 HG22 VAL B 56 8.383 12.574 -6.610 1.00 4.41 H new ATOM 0 HG23 VAL B 56 7.718 12.237 -8.227 1.00 4.41 H new ATOM 2175 N THR B 57 4.219 11.237 -4.461 1.00 44.13 N ATOM 2176 CA THR B 57 2.889 11.227 -3.810 1.00 23.13 C ATOM 2177 C THR B 57 2.687 12.525 -3.004 1.00 62.32 C ATOM 2178 O THR B 57 3.564 12.930 -2.237 1.00 12.13 O ATOM 2179 CB THR B 57 2.726 9.996 -2.858 1.00 64.20 C ATOM 2180 OG1 THR B 57 3.753 10.002 -1.843 1.00 51.23 O ATOM 2181 CG2 THR B 57 2.778 8.665 -3.631 1.00 22.52 C ATOM 0 H THR B 57 4.992 11.050 -3.822 1.00 44.13 H new ATOM 0 HA THR B 57 2.136 11.156 -4.595 1.00 23.13 H new ATOM 0 HB THR B 57 1.746 10.081 -2.388 1.00 64.20 H new ATOM 0 HG1 THR B 57 3.582 10.729 -1.209 1.00 51.23 H new ATOM 0 HG21 THR B 57 2.661 7.835 -2.934 1.00 22.52 H new ATOM 0 HG22 THR B 57 1.973 8.639 -4.365 1.00 22.52 H new ATOM 0 HG23 THR B 57 3.737 8.578 -4.142 1.00 22.52 H new ATOM 2189 N SER B 58 1.517 13.150 -3.166 1.00 14.14 N ATOM 2190 CA SER B 58 1.185 14.436 -2.512 1.00 75.32 C ATOM 2191 C SER B 58 -0.288 14.443 -2.057 1.00 64.44 C ATOM 2192 O SER B 58 -1.103 13.638 -2.519 1.00 31.23 O ATOM 2193 CB SER B 58 1.481 15.619 -3.470 1.00 53.04 C ATOM 2194 OG SER B 58 0.746 15.510 -4.676 1.00 34.41 O ATOM 0 H SER B 58 0.767 12.785 -3.753 1.00 14.14 H new ATOM 0 HA SER B 58 1.811 14.553 -1.627 1.00 75.32 H new ATOM 0 HB2 SER B 58 1.233 16.559 -2.976 1.00 53.04 H new ATOM 0 HB3 SER B 58 2.547 15.648 -3.694 1.00 53.04 H new ATOM 0 HG SER B 58 0.542 14.568 -4.851 1.00 34.41 H new ATOM 2200 N GLU B 59 -0.608 15.365 -1.140 1.00 12.12 N ATOM 2201 CA GLU B 59 -1.932 15.459 -0.487 1.00 3.41 C ATOM 2202 C GLU B 59 -2.719 16.654 -1.060 1.00 44.32 C ATOM 2203 O GLU B 59 -2.378 17.806 -0.783 1.00 43.11 O ATOM 2204 CB GLU B 59 -1.717 15.636 1.045 1.00 1.11 C ATOM 2205 CG GLU B 59 -2.995 15.588 1.908 1.00 75.20 C ATOM 2206 CD GLU B 59 -2.731 15.959 3.381 1.00 61.41 C ATOM 2207 OE1 GLU B 59 -2.060 15.181 4.090 1.00 14.21 O ATOM 2208 OE2 GLU B 59 -3.151 17.053 3.825 1.00 33.32 O ATOM 0 H GLU B 59 0.049 16.078 -0.823 1.00 12.12 H new ATOM 0 HA GLU B 59 -2.506 14.552 -0.675 1.00 3.41 H new ATOM 0 HB2 GLU B 59 -1.037 14.857 1.391 1.00 1.11 H new ATOM 0 HB3 GLU B 59 -1.220 16.591 1.216 1.00 1.11 H new ATOM 0 HG2 GLU B 59 -3.735 16.271 1.492 1.00 75.20 H new ATOM 0 HG3 GLU B 59 -3.423 14.587 1.861 1.00 75.20 H new ATOM 2215 N VAL B 60 -3.747 16.383 -1.886 1.00 13.40 N ATOM 2216 CA VAL B 60 -4.638 17.441 -2.427 1.00 23.35 C ATOM 2217 C VAL B 60 -6.088 17.210 -1.952 1.00 15.51 C ATOM 2218 O VAL B 60 -6.780 16.307 -2.441 1.00 54.24 O ATOM 2219 CB VAL B 60 -4.573 17.522 -4.004 1.00 24.34 C ATOM 2220 CG1 VAL B 60 -5.607 18.534 -4.580 1.00 11.41 C ATOM 2221 CG2 VAL B 60 -3.142 17.892 -4.460 1.00 53.00 C ATOM 0 H VAL B 60 -3.986 15.441 -2.197 1.00 13.40 H new ATOM 0 HA VAL B 60 -4.286 18.398 -2.042 1.00 23.35 H new ATOM 0 HB VAL B 60 -4.831 16.538 -4.395 1.00 24.34 H new ATOM 0 HG11 VAL B 60 -5.527 18.557 -5.667 1.00 11.41 H new ATOM 0 HG12 VAL B 60 -6.614 18.227 -4.297 1.00 11.41 H new ATOM 0 HG13 VAL B 60 -5.405 19.528 -4.180 1.00 11.41 H new ATOM 0 HG21 VAL B 60 -3.109 17.945 -5.548 1.00 53.00 H new ATOM 0 HG22 VAL B 60 -2.865 18.860 -4.041 1.00 53.00 H new ATOM 0 HG23 VAL B 60 -2.442 17.133 -4.112 1.00 53.00 H new ATOM 2231 N GLU B 61 -6.514 18.078 -1.009 1.00 33.54 N ATOM 2232 CA GLU B 61 -7.883 18.129 -0.440 1.00 61.33 C ATOM 2233 C GLU B 61 -8.396 16.739 0.052 1.00 64.10 C ATOM 2234 O GLU B 61 -9.577 16.398 -0.095 1.00 44.12 O ATOM 2235 CB GLU B 61 -8.838 18.798 -1.472 1.00 72.33 C ATOM 2236 CG GLU B 61 -8.284 20.121 -2.060 1.00 14.22 C ATOM 2237 CD GLU B 61 -9.306 20.897 -2.901 1.00 22.43 C ATOM 2238 OE1 GLU B 61 -10.155 21.612 -2.321 1.00 3.51 O ATOM 2239 OE2 GLU B 61 -9.268 20.803 -4.144 1.00 72.02 O ATOM 0 H GLU B 61 -5.898 18.785 -0.609 1.00 33.54 H new ATOM 0 HA GLU B 61 -7.860 18.740 0.462 1.00 61.33 H new ATOM 0 HB2 GLU B 61 -9.027 18.099 -2.286 1.00 72.33 H new ATOM 0 HB3 GLU B 61 -9.797 18.996 -0.993 1.00 72.33 H new ATOM 0 HG2 GLU B 61 -7.942 20.756 -1.243 1.00 14.22 H new ATOM 0 HG3 GLU B 61 -7.413 19.898 -2.677 1.00 14.22 H new ATOM 2246 N GLY B 62 -7.477 15.958 0.657 1.00 22.14 N ATOM 2247 CA GLY B 62 -7.782 14.608 1.170 1.00 45.33 C ATOM 2248 C GLY B 62 -7.432 13.465 0.195 1.00 11.02 C ATOM 2249 O GLY B 62 -7.254 12.315 0.621 1.00 21.21 O ATOM 0 H GLY B 62 -6.509 16.244 0.803 1.00 22.14 H new ATOM 0 HA2 GLY B 62 -7.238 14.455 2.102 1.00 45.33 H new ATOM 0 HA3 GLY B 62 -8.844 14.554 1.409 1.00 45.33 H new ATOM 2253 N GLU B 63 -7.346 13.782 -1.110 1.00 54.04 N ATOM 2254 CA GLU B 63 -7.053 12.786 -2.170 1.00 3.42 C ATOM 2255 C GLU B 63 -5.545 12.511 -2.335 1.00 34.13 C ATOM 2256 O GLU B 63 -4.703 13.412 -2.221 1.00 75.13 O ATOM 2257 CB GLU B 63 -7.648 13.222 -3.536 1.00 35.24 C ATOM 2258 CG GLU B 63 -9.185 13.160 -3.602 1.00 44.15 C ATOM 2259 CD GLU B 63 -9.734 13.392 -5.015 1.00 74.33 C ATOM 2260 OE1 GLU B 63 -9.476 12.548 -5.897 1.00 65.53 O ATOM 2261 OE2 GLU B 63 -10.415 14.416 -5.249 1.00 33.52 O ATOM 0 H GLU B 63 -7.476 14.730 -1.463 1.00 54.04 H new ATOM 0 HA GLU B 63 -7.528 11.861 -1.844 1.00 3.42 H new ATOM 0 HB2 GLU B 63 -7.327 14.241 -3.751 1.00 35.24 H new ATOM 0 HB3 GLU B 63 -7.236 12.586 -4.319 1.00 35.24 H new ATOM 0 HG2 GLU B 63 -9.520 12.187 -3.244 1.00 44.15 H new ATOM 0 HG3 GLU B 63 -9.603 13.908 -2.929 1.00 44.15 H new ATOM 2268 N ILE B 64 -5.241 11.237 -2.609 1.00 30.44 N ATOM 2269 CA ILE B 64 -3.895 10.764 -2.949 1.00 20.53 C ATOM 2270 C ILE B 64 -3.528 11.179 -4.403 1.00 11.01 C ATOM 2271 O ILE B 64 -3.939 10.531 -5.370 1.00 41.32 O ATOM 2272 CB ILE B 64 -3.833 9.198 -2.789 1.00 52.10 C ATOM 2273 CG1 ILE B 64 -4.270 8.769 -1.348 1.00 54.43 C ATOM 2274 CG2 ILE B 64 -2.430 8.657 -3.139 1.00 3.22 C ATOM 2275 CD1 ILE B 64 -4.408 7.262 -1.135 1.00 51.04 C ATOM 0 H ILE B 64 -5.938 10.492 -2.600 1.00 30.44 H new ATOM 0 HA ILE B 64 -3.172 11.220 -2.273 1.00 20.53 H new ATOM 0 HB ILE B 64 -4.537 8.757 -3.495 1.00 52.10 H new ATOM 0 HG12 ILE B 64 -3.543 9.156 -0.634 1.00 54.43 H new ATOM 0 HG13 ILE B 64 -5.225 9.242 -1.119 1.00 54.43 H new ATOM 0 HG21 ILE B 64 -2.418 7.574 -3.019 1.00 3.22 H new ATOM 0 HG22 ILE B 64 -2.189 8.911 -4.171 1.00 3.22 H new ATOM 0 HG23 ILE B 64 -1.691 9.104 -2.474 1.00 3.22 H new ATOM 0 HD11 ILE B 64 -4.714 7.066 -0.107 1.00 51.04 H new ATOM 0 HD12 ILE B 64 -5.158 6.865 -1.819 1.00 51.04 H new ATOM 0 HD13 ILE B 64 -3.450 6.778 -1.327 1.00 51.04 H new ATOM 2287 N PHE B 65 -2.789 12.292 -4.536 1.00 62.31 N ATOM 2288 CA PHE B 65 -2.363 12.842 -5.846 1.00 72.03 C ATOM 2289 C PHE B 65 -0.982 12.259 -6.253 1.00 14.11 C ATOM 2290 O PHE B 65 0.057 12.625 -5.686 1.00 3.42 O ATOM 2291 CB PHE B 65 -2.329 14.396 -5.783 1.00 63.14 C ATOM 2292 CG PHE B 65 -1.987 15.105 -7.105 1.00 75.02 C ATOM 2293 CD1 PHE B 65 -2.577 14.711 -8.306 1.00 44.34 C ATOM 2294 CD2 PHE B 65 -1.091 16.176 -7.141 1.00 2.42 C ATOM 2295 CE1 PHE B 65 -2.276 15.354 -9.491 1.00 31.23 C ATOM 2296 CE2 PHE B 65 -0.796 16.818 -8.327 1.00 54.42 C ATOM 2297 CZ PHE B 65 -1.391 16.409 -9.501 1.00 24.31 C ATOM 0 H PHE B 65 -2.466 12.842 -3.740 1.00 62.31 H new ATOM 0 HA PHE B 65 -3.083 12.550 -6.610 1.00 72.03 H new ATOM 0 HB2 PHE B 65 -3.302 14.750 -5.442 1.00 63.14 H new ATOM 0 HB3 PHE B 65 -1.599 14.696 -5.031 1.00 63.14 H new ATOM 0 HD1 PHE B 65 -3.280 13.891 -8.309 1.00 44.34 H new ATOM 0 HD2 PHE B 65 -0.622 16.507 -6.226 1.00 2.42 H new ATOM 0 HE1 PHE B 65 -2.736 15.028 -10.412 1.00 31.23 H new ATOM 0 HE2 PHE B 65 -0.098 17.642 -8.335 1.00 54.42 H new ATOM 0 HZ PHE B 65 -1.163 16.915 -10.427 1.00 24.31 H new ATOM 2307 N VAL B 66 -0.991 11.343 -7.236 1.00 41.52 N ATOM 2308 CA VAL B 66 0.211 10.598 -7.667 1.00 33.00 C ATOM 2309 C VAL B 66 0.724 11.110 -9.037 1.00 64.14 C ATOM 2310 O VAL B 66 0.026 11.018 -10.051 1.00 22.14 O ATOM 2311 CB VAL B 66 -0.094 9.058 -7.760 1.00 23.30 C ATOM 2312 CG1 VAL B 66 1.182 8.238 -8.090 1.00 1.31 C ATOM 2313 CG2 VAL B 66 -0.771 8.548 -6.465 1.00 62.01 C ATOM 0 H VAL B 66 -1.832 11.096 -7.757 1.00 41.52 H new ATOM 0 HA VAL B 66 0.987 10.764 -6.919 1.00 33.00 H new ATOM 0 HB VAL B 66 -0.792 8.911 -8.584 1.00 23.30 H new ATOM 0 HG11 VAL B 66 0.930 7.179 -8.146 1.00 1.31 H new ATOM 0 HG12 VAL B 66 1.587 8.565 -9.047 1.00 1.31 H new ATOM 0 HG13 VAL B 66 1.926 8.393 -7.309 1.00 1.31 H new ATOM 0 HG21 VAL B 66 -0.971 7.480 -6.555 1.00 62.01 H new ATOM 0 HG22 VAL B 66 -0.110 8.723 -5.616 1.00 62.01 H new ATOM 0 HG23 VAL B 66 -1.709 9.081 -6.311 1.00 62.01 H new ATOM 2323 N LYS B 67 1.951 11.652 -9.045 1.00 62.24 N ATOM 2324 CA LYS B 67 2.654 12.087 -10.277 1.00 52.31 C ATOM 2325 C LYS B 67 3.818 11.125 -10.570 1.00 13.00 C ATOM 2326 O LYS B 67 4.198 10.352 -9.702 1.00 12.20 O ATOM 2327 CB LYS B 67 3.172 13.535 -10.090 1.00 1.32 C ATOM 2328 CG LYS B 67 2.063 14.560 -9.762 1.00 22.24 C ATOM 2329 CD LYS B 67 2.583 16.004 -9.530 1.00 60.33 C ATOM 2330 CE LYS B 67 3.535 16.152 -8.311 1.00 22.44 C ATOM 2331 NZ LYS B 67 4.949 15.822 -8.639 1.00 0.33 N ATOM 0 H LYS B 67 2.493 11.805 -8.195 1.00 62.24 H new ATOM 0 HA LYS B 67 1.967 12.069 -11.123 1.00 52.31 H new ATOM 0 HB2 LYS B 67 3.911 13.545 -9.289 1.00 1.32 H new ATOM 0 HB3 LYS B 67 3.684 13.847 -11.000 1.00 1.32 H new ATOM 0 HG2 LYS B 67 1.341 14.572 -10.579 1.00 22.24 H new ATOM 0 HG3 LYS B 67 1.530 14.230 -8.870 1.00 22.24 H new ATOM 0 HD2 LYS B 67 3.105 16.338 -10.427 1.00 60.33 H new ATOM 0 HD3 LYS B 67 1.729 16.667 -9.392 1.00 60.33 H new ATOM 0 HE2 LYS B 67 3.483 17.175 -7.937 1.00 22.44 H new ATOM 0 HE3 LYS B 67 3.192 15.501 -7.507 1.00 22.44 H new ATOM 0 HZ1 LYS B 67 5.337 15.192 -7.908 1.00 0.33 H new ATOM 0 HZ2 LYS B 67 4.989 15.347 -9.563 1.00 0.33 H new ATOM 0 HZ3 LYS B 67 5.510 16.697 -8.675 1.00 0.33 H new ATOM 2345 N LEU B 68 4.386 11.161 -11.788 1.00 25.42 N ATOM 2346 CA LEU B 68 5.547 10.297 -12.135 1.00 42.24 C ATOM 2347 C LEU B 68 6.866 11.085 -12.041 1.00 61.40 C ATOM 2348 O LEU B 68 6.921 12.254 -12.440 1.00 44.30 O ATOM 2349 CB LEU B 68 5.400 9.707 -13.564 1.00 11.21 C ATOM 2350 CG LEU B 68 4.080 8.928 -13.871 1.00 72.34 C ATOM 2351 CD1 LEU B 68 4.176 8.185 -15.213 1.00 74.21 C ATOM 2352 CD2 LEU B 68 3.698 7.963 -12.735 1.00 61.20 C ATOM 0 H LEU B 68 4.071 11.768 -12.545 1.00 25.42 H new ATOM 0 HA LEU B 68 5.568 9.478 -11.416 1.00 42.24 H new ATOM 0 HB2 LEU B 68 5.487 10.524 -14.280 1.00 11.21 H new ATOM 0 HB3 LEU B 68 6.240 9.036 -13.743 1.00 11.21 H new ATOM 0 HG LEU B 68 3.283 9.668 -13.945 1.00 72.34 H new ATOM 0 HD11 LEU B 68 3.244 7.652 -15.401 1.00 74.21 H new ATOM 0 HD12 LEU B 68 4.352 8.903 -16.014 1.00 74.21 H new ATOM 0 HD13 LEU B 68 5.000 7.473 -15.176 1.00 74.21 H new ATOM 0 HD21 LEU B 68 2.775 7.444 -12.993 1.00 61.20 H new ATOM 0 HD22 LEU B 68 4.496 7.234 -12.593 1.00 61.20 H new ATOM 0 HD23 LEU B 68 3.552 8.526 -11.813 1.00 61.20 H new ATOM 2364 N VAL B 69 7.927 10.440 -11.515 1.00 65.54 N ATOM 2365 CA VAL B 69 9.292 11.008 -11.545 1.00 34.25 C ATOM 2366 C VAL B 69 9.839 10.974 -12.998 1.00 74.31 C ATOM 2367 O VAL B 69 10.422 9.974 -13.447 1.00 31.44 O ATOM 2368 CB VAL B 69 10.276 10.265 -10.559 1.00 2.14 C ATOM 2369 CG1 VAL B 69 11.715 10.855 -10.633 1.00 4.32 C ATOM 2370 CG2 VAL B 69 9.738 10.307 -9.107 1.00 32.53 C ATOM 0 H VAL B 69 7.866 9.527 -11.065 1.00 65.54 H new ATOM 0 HA VAL B 69 9.230 12.041 -11.202 1.00 34.25 H new ATOM 0 HB VAL B 69 10.331 9.223 -10.874 1.00 2.14 H new ATOM 0 HG11 VAL B 69 12.364 10.319 -9.941 1.00 4.32 H new ATOM 0 HG12 VAL B 69 12.100 10.749 -11.647 1.00 4.32 H new ATOM 0 HG13 VAL B 69 11.690 11.911 -10.363 1.00 4.32 H new ATOM 0 HG21 VAL B 69 10.433 9.789 -8.446 1.00 32.53 H new ATOM 0 HG22 VAL B 69 9.637 11.344 -8.786 1.00 32.53 H new ATOM 0 HG23 VAL B 69 8.765 9.818 -9.065 1.00 32.53 H new