USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 THR OG1 : rot -73:sc= 1.19 USER MOD Set 1.2: A 25 ASN : amide:sc= 1.52 K(o=2.7,f=-6.6!) USER MOD Single : A 1 MET CE :methyl -172:sc= 0 (180deg=-0.0758) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.26 (180deg=1.16) USER MOD Single : A 2 GLN : amide:sc= 1.16 K(o=1.2,f=-0.27) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -136:sc= 1.14 (180deg=-0.317!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00224 USER MOD Single : A 27 LYS NZ :NH3+ -166:sc= 1.59 (180deg=1.25!) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= 1.25 (180deg=1.13) USER MOD Single : A 31 GLN : amide:sc= -0.226 K(o=-0.23,f=-1.4) USER MOD Single : A 33 LYS NZ :NH3+ -174:sc= 1.07 (180deg=1.04) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 41 GLN : amide:sc= 1.2 K(o=1.2,f=-2.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.791 K(o=0.79,f=-6.3!) USER MOD Single : A 55 THR OG1 : rot -86:sc= 1.36 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 151:sc= 0.573 USER MOD Single : A 60 ASN : amide:sc= -0.0571 X(o=-0.057,f=-0.057) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 108:sc= 1.25 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.108 X(o=-0.11,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.847 51.977 20.063 1.00 0.00 N ATOM 2 CA MET A 1 33.209 52.212 21.469 1.00 0.00 C ATOM 3 C MET A 1 34.718 52.424 21.598 1.00 0.00 C ATOM 4 O MET A 1 35.470 52.016 20.715 1.00 0.00 O ATOM 5 CB MET A 1 32.708 51.098 22.383 1.00 0.00 C ATOM 6 CG MET A 1 33.409 49.761 22.157 1.00 0.00 C ATOM 7 SD MET A 1 32.819 48.402 23.196 1.00 0.00 S ATOM 8 CE MET A 1 34.006 47.148 22.650 1.00 0.00 C ATOM 0 H1 MET A 1 31.851 51.685 20.005 1.00 0.00 H new ATOM 0 H2 MET A 1 32.983 52.853 19.518 1.00 0.00 H new ATOM 0 H3 MET A 1 33.451 51.227 19.670 1.00 0.00 H new ATOM 0 HA MET A 1 32.709 53.123 21.799 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.847 51.401 23.421 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.637 50.968 22.230 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.289 49.477 21.111 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.477 49.894 22.331 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.730 46.180 23.067 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.999 47.090 21.562 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.005 47.419 22.992 1.00 0.00 H new ATOM 20 N GLN A 2 35.171 53.023 22.696 1.00 0.00 N ATOM 21 CA GLN A 2 36.575 53.229 22.986 1.00 0.00 C ATOM 22 C GLN A 2 37.144 52.209 23.976 1.00 0.00 C ATOM 23 O GLN A 2 36.453 51.783 24.898 1.00 0.00 O ATOM 24 CB GLN A 2 36.819 54.655 23.474 1.00 0.00 C ATOM 25 CG GLN A 2 36.813 55.626 22.296 1.00 0.00 C ATOM 26 CD GLN A 2 37.037 57.084 22.700 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.066 57.472 23.866 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.213 57.958 21.713 1.00 0.00 N ATOM 0 H GLN A 2 34.552 53.385 23.422 1.00 0.00 H new ATOM 0 HA GLN A 2 37.111 53.075 22.049 1.00 0.00 H new ATOM 0 HB2 GLN A 2 36.049 54.938 24.191 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.775 54.710 23.995 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.589 55.331 21.589 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.859 55.545 21.775 1.00 0.00 H new ATOM 0 HE21 GLN A 2 37.190 57.643 20.743 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.371 58.943 21.926 1.00 0.00 H new ATOM 37 N ILE A 3 38.427 51.900 23.813 1.00 0.00 N ATOM 38 CA ILE A 3 39.257 51.216 24.784 1.00 0.00 C ATOM 39 C ILE A 3 40.609 51.923 24.910 1.00 0.00 C ATOM 40 O ILE A 3 41.043 52.591 23.975 1.00 0.00 O ATOM 41 CB ILE A 3 39.418 49.732 24.469 1.00 0.00 C ATOM 42 CG1 ILE A 3 40.084 49.484 23.119 1.00 0.00 C ATOM 43 CG2 ILE A 3 38.080 49.008 24.587 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.350 48.021 22.772 1.00 0.00 C ATOM 0 H ILE A 3 38.934 52.133 22.959 1.00 0.00 H new ATOM 0 HA ILE A 3 38.752 51.263 25.749 1.00 0.00 H new ATOM 0 HB ILE A 3 40.095 49.316 25.215 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.455 49.915 22.340 1.00 0.00 H new ATOM 0 HG13 ILE A 3 41.032 50.022 23.098 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.217 47.951 24.358 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.698 49.113 25.602 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.368 49.442 23.885 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.825 47.960 21.793 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.008 47.583 23.522 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.407 47.474 22.753 1.00 0.00 H new ATOM 56 N PHE A 4 41.282 51.771 26.047 1.00 0.00 N ATOM 57 CA PHE A 4 42.520 52.454 26.365 1.00 0.00 C ATOM 58 C PHE A 4 43.667 51.472 26.608 1.00 0.00 C ATOM 59 O PHE A 4 43.578 50.629 27.497 1.00 0.00 O ATOM 60 CB PHE A 4 42.325 53.370 27.570 1.00 0.00 C ATOM 61 CG PHE A 4 41.123 54.279 27.485 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.105 55.331 26.560 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.021 54.069 28.321 1.00 0.00 C ATOM 64 CE1 PHE A 4 39.983 56.163 26.463 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.902 54.906 28.234 1.00 0.00 C ATOM 66 CZ PHE A 4 38.881 55.950 27.300 1.00 0.00 C ATOM 0 H PHE A 4 40.966 51.149 26.791 1.00 0.00 H new ATOM 0 HA PHE A 4 42.795 53.061 25.502 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.236 52.755 28.466 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.218 53.982 27.692 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.958 55.501 25.920 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.034 53.259 29.035 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.968 56.968 25.743 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.056 54.747 28.886 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.015 56.591 27.226 1.00 0.00 H new ATOM 76 N VAL A 5 44.756 51.598 25.854 1.00 0.00 N ATOM 77 CA VAL A 5 45.918 50.737 25.947 1.00 0.00 C ATOM 78 C VAL A 5 47.055 51.444 26.686 1.00 0.00 C ATOM 79 O VAL A 5 47.442 52.541 26.290 1.00 0.00 O ATOM 80 CB VAL A 5 46.375 50.260 24.571 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.500 49.234 24.687 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.237 49.614 23.786 1.00 0.00 C ATOM 0 H VAL A 5 44.851 52.324 25.144 1.00 0.00 H new ATOM 0 HA VAL A 5 45.632 49.855 26.519 1.00 0.00 H new ATOM 0 HB VAL A 5 46.725 51.148 24.045 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.804 48.913 23.691 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.351 49.683 25.199 1.00 0.00 H new ATOM 0 HG13 VAL A 5 47.149 48.372 25.254 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.605 49.289 22.813 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.858 48.753 24.337 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.434 50.338 23.647 1.00 0.00 H new ATOM 92 N LYS A 6 47.597 50.817 27.725 1.00 0.00 N ATOM 93 CA LYS A 6 48.694 51.310 28.532 1.00 0.00 C ATOM 94 C LYS A 6 50.010 50.589 28.228 1.00 0.00 C ATOM 95 O LYS A 6 50.038 49.363 28.156 1.00 0.00 O ATOM 96 CB LYS A 6 48.330 51.218 30.011 1.00 0.00 C ATOM 97 CG LYS A 6 47.183 52.153 30.382 1.00 0.00 C ATOM 98 CD LYS A 6 46.775 52.089 31.851 1.00 0.00 C ATOM 99 CE LYS A 6 47.904 52.459 32.808 1.00 0.00 C ATOM 100 NZ LYS A 6 47.404 52.670 34.176 1.00 0.00 N ATOM 0 H LYS A 6 47.262 49.906 28.038 1.00 0.00 H new ATOM 0 HA LYS A 6 48.858 52.357 28.276 1.00 0.00 H new ATOM 0 HB2 LYS A 6 48.052 50.192 30.252 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.205 51.461 30.614 1.00 0.00 H new ATOM 0 HG2 LYS A 6 47.470 53.176 30.140 1.00 0.00 H new ATOM 0 HG3 LYS A 6 46.318 51.911 29.765 1.00 0.00 H new ATOM 0 HD2 LYS A 6 45.933 52.761 32.017 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.429 51.081 32.081 1.00 0.00 H new ATOM 0 HE2 LYS A 6 48.653 51.668 32.811 1.00 0.00 H new ATOM 0 HE3 LYS A 6 48.398 53.365 32.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 48.197 52.920 34.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 46.707 53.442 34.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.954 51.798 34.520 1.00 0.00 H new ATOM 168 N LYS A 11 52.727 55.520 28.458 1.00 0.00 N ATOM 169 CA LYS A 11 51.841 56.072 27.453 1.00 0.00 C ATOM 170 C LYS A 11 50.446 55.452 27.557 1.00 0.00 C ATOM 171 O LYS A 11 50.318 54.288 27.931 1.00 0.00 O ATOM 172 CB LYS A 11 52.490 55.861 26.089 1.00 0.00 C ATOM 173 CG LYS A 11 51.953 56.774 24.990 1.00 0.00 C ATOM 174 CD LYS A 11 52.790 56.549 23.735 1.00 0.00 C ATOM 175 CE LYS A 11 52.356 57.479 22.605 1.00 0.00 C ATOM 176 NZ LYS A 11 53.139 57.191 21.394 1.00 0.00 N ATOM 0 HA LYS A 11 51.696 57.141 27.607 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.565 56.018 26.183 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.344 54.824 25.787 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.904 56.555 24.792 1.00 0.00 H new ATOM 0 HG3 LYS A 11 52.007 57.817 25.302 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.843 56.716 23.963 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.694 55.512 23.413 1.00 0.00 H new ATOM 0 HE2 LYS A 11 51.293 57.348 22.402 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.498 58.518 22.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 53.444 58.084 20.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.975 56.627 21.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 52.553 56.658 20.720 1.00 0.00 H new ATOM 190 N THR A 12 49.416 56.222 27.219 1.00 0.00 N ATOM 191 CA THR A 12 48.043 55.779 27.086 1.00 0.00 C ATOM 192 C THR A 12 47.569 56.071 25.661 1.00 0.00 C ATOM 193 O THR A 12 47.738 57.187 25.175 1.00 0.00 O ATOM 194 CB THR A 12 47.134 56.446 28.114 1.00 0.00 C ATOM 195 OG1 THR A 12 47.646 56.296 29.420 1.00 0.00 O ATOM 196 CG2 THR A 12 45.739 55.823 28.125 1.00 0.00 C ATOM 0 H THR A 12 49.527 57.217 27.023 1.00 0.00 H new ATOM 0 HA THR A 12 47.995 54.707 27.276 1.00 0.00 H new ATOM 0 HB THR A 12 47.084 57.497 27.828 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.046 56.734 30.059 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.122 56.325 28.870 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.283 55.934 27.141 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.815 54.764 28.372 1.00 0.00 H new ATOM 204 N ILE A 13 46.978 55.085 24.991 1.00 0.00 N ATOM 205 CA ILE A 13 46.509 55.163 23.622 1.00 0.00 C ATOM 206 C ILE A 13 45.007 54.874 23.570 1.00 0.00 C ATOM 207 O ILE A 13 44.580 53.807 24.006 1.00 0.00 O ATOM 208 CB ILE A 13 47.303 54.228 22.715 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.789 54.570 22.644 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.738 54.251 21.298 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.656 53.833 23.661 1.00 0.00 C ATOM 0 H ILE A 13 46.808 54.172 25.412 1.00 0.00 H new ATOM 0 HA ILE A 13 46.671 56.174 23.248 1.00 0.00 H new ATOM 0 HB ILE A 13 47.207 53.237 23.158 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.154 54.343 21.642 1.00 0.00 H new ATOM 0 HG13 ILE A 13 48.910 55.643 22.792 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.316 53.578 20.665 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.697 53.927 21.316 1.00 0.00 H new ATOM 0 HG23 ILE A 13 46.796 55.264 20.900 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.696 54.136 23.540 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.322 54.078 24.669 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.570 52.758 23.501 1.00 0.00 H new ATOM 223 N THR A 14 44.219 55.786 23.010 1.00 0.00 N ATOM 224 CA THR A 14 42.809 55.590 22.739 1.00 0.00 C ATOM 225 C THR A 14 42.627 54.852 21.411 1.00 0.00 C ATOM 226 O THR A 14 43.155 55.291 20.392 1.00 0.00 O ATOM 227 CB THR A 14 42.057 56.918 22.696 1.00 0.00 C ATOM 228 OG1 THR A 14 42.241 57.658 23.882 1.00 0.00 O ATOM 229 CG2 THR A 14 40.549 56.742 22.546 1.00 0.00 C ATOM 0 H THR A 14 44.558 56.705 22.726 1.00 0.00 H new ATOM 0 HA THR A 14 42.395 54.992 23.551 1.00 0.00 H new ATOM 0 HB THR A 14 42.468 57.436 21.829 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.748 58.502 23.821 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.069 57.720 22.522 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.335 56.210 21.619 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.164 56.170 23.390 1.00 0.00 H new ATOM 237 N LEU A 15 41.862 53.763 21.407 1.00 0.00 N ATOM 238 CA LEU A 15 41.497 53.021 20.218 1.00 0.00 C ATOM 239 C LEU A 15 39.984 53.002 19.994 1.00 0.00 C ATOM 240 O LEU A 15 39.212 52.962 20.950 1.00 0.00 O ATOM 241 CB LEU A 15 42.037 51.595 20.282 1.00 0.00 C ATOM 242 CG LEU A 15 43.544 51.446 20.469 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.885 49.958 20.494 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.354 52.093 19.349 1.00 0.00 C ATOM 0 H LEU A 15 41.470 53.366 22.261 1.00 0.00 H new ATOM 0 HA LEU A 15 41.950 53.535 19.370 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.539 51.078 21.102 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.755 51.082 19.363 1.00 0.00 H new ATOM 0 HG LEU A 15 43.803 51.949 21.401 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.960 49.833 20.627 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.359 49.478 21.319 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.580 49.499 19.554 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.418 51.952 19.541 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.093 51.631 18.397 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.131 53.159 19.308 1.00 0.00 H new ATOM 256 N GLU A 16 39.574 52.974 18.729 1.00 0.00 N ATOM 257 CA GLU A 16 38.198 52.910 18.283 1.00 0.00 C ATOM 258 C GLU A 16 37.857 51.495 17.812 1.00 0.00 C ATOM 259 O GLU A 16 38.481 51.000 16.877 1.00 0.00 O ATOM 260 CB GLU A 16 38.010 53.909 17.143 1.00 0.00 C ATOM 261 CG GLU A 16 38.150 55.373 17.549 1.00 0.00 C ATOM 262 CD GLU A 16 37.009 55.882 18.433 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.899 55.309 18.409 1.00 0.00 O ATOM 264 OE2 GLU A 16 37.180 56.929 19.093 1.00 0.00 O ATOM 0 H GLU A 16 40.233 52.997 17.951 1.00 0.00 H new ATOM 0 HA GLU A 16 37.530 53.160 19.107 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.739 53.691 16.363 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.022 53.760 16.706 1.00 0.00 H new ATOM 0 HG2 GLU A 16 39.094 55.505 18.079 1.00 0.00 H new ATOM 0 HG3 GLU A 16 38.201 55.986 16.649 1.00 0.00 H new ATOM 271 N VAL A 17 36.906 50.826 18.457 1.00 0.00 N ATOM 272 CA VAL A 17 36.596 49.423 18.268 1.00 0.00 C ATOM 273 C VAL A 17 35.096 49.126 18.319 1.00 0.00 C ATOM 274 O VAL A 17 34.314 49.884 18.891 1.00 0.00 O ATOM 275 CB VAL A 17 37.321 48.553 19.290 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.837 48.585 19.118 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.995 48.930 20.733 1.00 0.00 C ATOM 0 H VAL A 17 36.308 51.271 19.154 1.00 0.00 H new ATOM 0 HA VAL A 17 36.946 49.178 17.265 1.00 0.00 H new ATOM 0 HB VAL A 17 36.955 47.545 19.095 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.302 47.949 19.871 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.098 48.221 18.124 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.195 49.608 19.236 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.541 48.275 21.412 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.286 49.965 20.913 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.924 48.819 20.905 1.00 0.00 H new ATOM 287 N GLU A 18 34.689 47.980 17.779 1.00 0.00 N ATOM 288 CA GLU A 18 33.399 47.357 17.997 1.00 0.00 C ATOM 289 C GLU A 18 33.549 46.049 18.775 1.00 0.00 C ATOM 290 O GLU A 18 34.584 45.398 18.651 1.00 0.00 O ATOM 291 CB GLU A 18 32.685 47.079 16.678 1.00 0.00 C ATOM 292 CG GLU A 18 32.512 48.265 15.734 1.00 0.00 C ATOM 293 CD GLU A 18 31.811 49.476 16.352 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.782 49.339 17.048 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.257 50.610 16.073 1.00 0.00 O ATOM 0 H GLU A 18 35.282 47.440 17.149 1.00 0.00 H new ATOM 0 HA GLU A 18 32.800 48.057 18.580 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.235 46.300 16.150 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.698 46.675 16.903 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.494 48.574 15.377 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.944 47.939 14.863 1.00 0.00 H new ATOM 302 N PRO A 19 32.547 45.581 19.514 1.00 0.00 N ATOM 303 CA PRO A 19 32.606 44.339 20.260 1.00 0.00 C ATOM 304 C PRO A 19 33.012 43.093 19.470 1.00 0.00 C ATOM 305 O PRO A 19 33.584 42.168 20.043 1.00 0.00 O ATOM 306 CB PRO A 19 31.212 44.155 20.853 1.00 0.00 C ATOM 307 CG PRO A 19 30.724 45.588 21.045 1.00 0.00 C ATOM 308 CD PRO A 19 31.331 46.298 19.838 1.00 0.00 C ATOM 0 HA PRO A 19 33.401 44.429 21.001 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.560 43.594 20.183 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.244 43.611 21.797 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.636 45.651 21.050 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.072 46.014 21.986 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.640 46.292 18.995 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.545 47.342 20.068 1.00 0.00 H new ATOM 316 N SER A 20 32.743 43.052 18.169 1.00 0.00 N ATOM 317 CA SER A 20 33.092 41.961 17.283 1.00 0.00 C ATOM 318 C SER A 20 34.499 42.025 16.684 1.00 0.00 C ATOM 319 O SER A 20 34.868 41.121 15.937 1.00 0.00 O ATOM 320 CB SER A 20 32.036 41.822 16.191 1.00 0.00 C ATOM 321 OG SER A 20 31.820 43.040 15.511 1.00 0.00 O ATOM 0 H SER A 20 32.257 43.810 17.690 1.00 0.00 H new ATOM 0 HA SER A 20 33.110 41.070 17.910 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.349 41.059 15.478 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.099 41.481 16.633 1.00 0.00 H new ATOM 0 HG SER A 20 31.139 42.912 14.818 1.00 0.00 H new ATOM 327 N ASP A 21 35.295 43.050 16.976 1.00 0.00 N ATOM 328 CA ASP A 21 36.663 43.149 16.508 1.00 0.00 C ATOM 329 C ASP A 21 37.554 42.122 17.209 1.00 0.00 C ATOM 330 O ASP A 21 37.420 41.896 18.410 1.00 0.00 O ATOM 331 CB ASP A 21 37.191 44.569 16.692 1.00 0.00 C ATOM 332 CG ASP A 21 36.515 45.620 15.810 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.645 46.831 16.097 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.924 45.271 14.766 1.00 0.00 O ATOM 0 H ASP A 21 35.000 43.840 17.550 1.00 0.00 H new ATOM 0 HA ASP A 21 36.681 42.923 15.442 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.067 44.856 17.736 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.261 44.574 16.485 1.00 0.00 H new ATOM 339 N THR A 22 38.472 41.494 16.480 1.00 0.00 N ATOM 340 CA THR A 22 39.374 40.496 17.019 1.00 0.00 C ATOM 341 C THR A 22 40.607 41.113 17.683 1.00 0.00 C ATOM 342 O THR A 22 41.006 42.228 17.353 1.00 0.00 O ATOM 343 CB THR A 22 39.795 39.421 16.022 1.00 0.00 C ATOM 344 OG1 THR A 22 40.657 39.915 15.022 1.00 0.00 O ATOM 345 CG2 THR A 22 38.612 38.739 15.342 1.00 0.00 C ATOM 0 H THR A 22 38.608 41.671 15.485 1.00 0.00 H new ATOM 0 HA THR A 22 38.780 39.996 17.784 1.00 0.00 H new ATOM 0 HB THR A 22 40.326 38.687 16.628 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.147 40.471 14.396 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.978 37.985 14.645 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.984 38.263 16.095 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.027 39.481 14.799 1.00 0.00 H new ATOM 353 N ILE A 23 41.272 40.372 18.565 1.00 0.00 N ATOM 354 CA ILE A 23 42.523 40.785 19.169 1.00 0.00 C ATOM 355 C ILE A 23 43.592 41.093 18.117 1.00 0.00 C ATOM 356 O ILE A 23 44.342 42.050 18.290 1.00 0.00 O ATOM 357 CB ILE A 23 42.974 39.739 20.184 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.020 39.600 21.368 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.394 39.963 20.693 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.761 40.857 22.194 1.00 0.00 C ATOM 0 H ILE A 23 40.948 39.458 18.880 1.00 0.00 H new ATOM 0 HA ILE A 23 42.364 41.722 19.703 1.00 0.00 H new ATOM 0 HB ILE A 23 42.960 38.804 19.624 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.063 39.237 20.993 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.414 38.831 22.033 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.650 39.184 21.411 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.091 39.928 19.855 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.457 40.938 21.177 1.00 0.00 H new ATOM 0 HD11 ILE A 23 41.068 40.625 23.003 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.701 41.217 22.613 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.329 41.629 21.557 1.00 0.00 H new ATOM 372 N GLU A 24 43.625 40.399 16.982 1.00 0.00 N ATOM 373 CA GLU A 24 44.509 40.733 15.884 1.00 0.00 C ATOM 374 C GLU A 24 44.153 42.049 15.190 1.00 0.00 C ATOM 375 O GLU A 24 45.047 42.739 14.704 1.00 0.00 O ATOM 376 CB GLU A 24 44.554 39.556 14.913 1.00 0.00 C ATOM 377 CG GLU A 24 45.747 39.599 13.963 1.00 0.00 C ATOM 378 CD GLU A 24 45.805 38.362 13.067 1.00 0.00 C ATOM 379 OE1 GLU A 24 46.910 37.808 12.876 1.00 0.00 O ATOM 380 OE2 GLU A 24 44.758 37.925 12.540 1.00 0.00 O ATOM 0 H GLU A 24 43.034 39.587 16.804 1.00 0.00 H new ATOM 0 HA GLU A 24 45.505 40.906 16.290 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.585 38.627 15.482 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.634 39.541 14.329 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.686 40.494 13.344 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.669 39.673 14.540 1.00 0.00 H new ATOM 387 N ASN A 25 42.891 42.468 15.210 1.00 0.00 N ATOM 388 CA ASN A 25 42.498 43.795 14.779 1.00 0.00 C ATOM 389 C ASN A 25 42.902 44.864 15.796 1.00 0.00 C ATOM 390 O ASN A 25 43.360 45.932 15.400 1.00 0.00 O ATOM 391 CB ASN A 25 41.007 43.865 14.462 1.00 0.00 C ATOM 392 CG ASN A 25 40.530 42.792 13.481 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.621 42.022 13.784 1.00 0.00 O ATOM 394 ND2 ASN A 25 41.102 42.703 12.284 1.00 0.00 N ATOM 0 H ASN A 25 42.113 41.890 15.528 1.00 0.00 H new ATOM 0 HA ASN A 25 43.039 44.004 13.856 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.444 43.771 15.390 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.779 44.848 14.049 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.786 41.997 11.619 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.856 43.341 12.031 1.00 0.00 H new ATOM 401 N VAL A 26 42.811 44.588 17.094 1.00 0.00 N ATOM 402 CA VAL A 26 43.290 45.496 18.117 1.00 0.00 C ATOM 403 C VAL A 26 44.807 45.669 18.026 1.00 0.00 C ATOM 404 O VAL A 26 45.286 46.801 18.030 1.00 0.00 O ATOM 405 CB VAL A 26 42.865 45.070 19.520 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.285 46.100 20.565 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.353 44.922 19.649 1.00 0.00 C ATOM 0 H VAL A 26 42.403 43.728 17.460 1.00 0.00 H new ATOM 0 HA VAL A 26 42.823 46.463 17.930 1.00 0.00 H new ATOM 0 HB VAL A 26 43.355 44.111 19.688 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.967 45.766 21.553 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.369 46.211 20.551 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.819 47.059 20.339 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.103 44.618 20.665 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.874 45.876 19.427 1.00 0.00 H new ATOM 0 HG23 VAL A 26 41.000 44.167 18.947 1.00 0.00 H new ATOM 417 N LYS A 27 45.566 44.595 17.825 1.00 0.00 N ATOM 418 CA LYS A 27 46.989 44.653 17.562 1.00 0.00 C ATOM 419 C LYS A 27 47.323 45.483 16.320 1.00 0.00 C ATOM 420 O LYS A 27 48.279 46.257 16.351 1.00 0.00 O ATOM 421 CB LYS A 27 47.568 43.252 17.389 1.00 0.00 C ATOM 422 CG LYS A 27 47.700 42.412 18.657 1.00 0.00 C ATOM 423 CD LYS A 27 48.297 41.062 18.274 1.00 0.00 C ATOM 424 CE LYS A 27 48.840 40.300 19.479 1.00 0.00 C ATOM 425 NZ LYS A 27 49.619 39.130 19.045 1.00 0.00 N ATOM 0 H LYS A 27 45.196 43.645 17.842 1.00 0.00 H new ATOM 0 HA LYS A 27 47.438 45.138 18.429 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.941 42.708 16.682 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.555 43.344 16.935 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.337 42.917 19.383 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.726 42.277 19.127 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.535 40.459 17.780 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.100 41.215 17.553 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.467 40.959 20.080 1.00 0.00 H new ATOM 0 HE3 LYS A 27 48.015 39.979 20.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.778 38.499 19.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 49.095 38.619 18.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.535 39.444 18.666 1.00 0.00 H new ATOM 439 N ALA A 28 46.543 45.365 15.250 1.00 0.00 N ATOM 440 CA ALA A 28 46.710 46.173 14.059 1.00 0.00 C ATOM 441 C ALA A 28 46.393 47.650 14.297 1.00 0.00 C ATOM 442 O ALA A 28 47.116 48.514 13.806 1.00 0.00 O ATOM 443 CB ALA A 28 45.861 45.579 12.939 1.00 0.00 C ATOM 0 H ALA A 28 45.773 44.699 15.190 1.00 0.00 H new ATOM 0 HA ALA A 28 47.760 46.150 13.768 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.978 46.179 12.036 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.184 44.557 12.740 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.813 45.576 13.239 1.00 0.00 H new ATOM 449 N LYS A 29 45.393 47.967 15.115 1.00 0.00 N ATOM 450 CA LYS A 29 45.078 49.319 15.533 1.00 0.00 C ATOM 451 C LYS A 29 46.177 49.936 16.399 1.00 0.00 C ATOM 452 O LYS A 29 46.428 51.133 16.279 1.00 0.00 O ATOM 453 CB LYS A 29 43.719 49.339 16.229 1.00 0.00 C ATOM 454 CG LYS A 29 42.546 49.172 15.267 1.00 0.00 C ATOM 455 CD LYS A 29 41.231 48.988 16.019 1.00 0.00 C ATOM 456 CE LYS A 29 40.053 48.822 15.065 1.00 0.00 C ATOM 457 NZ LYS A 29 39.579 50.104 14.520 1.00 0.00 N ATOM 0 H LYS A 29 44.766 47.268 15.513 1.00 0.00 H new ATOM 0 HA LYS A 29 45.022 49.945 14.643 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.687 48.542 16.972 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.608 50.281 16.767 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.477 50.046 14.619 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.722 48.311 14.622 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.301 48.113 16.666 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.058 49.849 16.665 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.346 48.168 14.243 1.00 0.00 H new ATOM 0 HE3 LYS A 29 39.234 48.329 15.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.018 49.930 13.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.988 50.585 15.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 40.395 50.704 14.285 1.00 0.00 H new ATOM 471 N ILE A 30 46.878 49.137 17.199 1.00 0.00 N ATOM 472 CA ILE A 30 48.070 49.531 17.923 1.00 0.00 C ATOM 473 C ILE A 30 49.240 49.770 16.966 1.00 0.00 C ATOM 474 O ILE A 30 49.897 50.803 17.073 1.00 0.00 O ATOM 475 CB ILE A 30 48.411 48.506 19.002 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.342 48.519 20.092 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.784 48.740 19.622 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.382 47.319 21.033 1.00 0.00 C ATOM 0 H ILE A 30 46.618 48.164 17.363 1.00 0.00 H new ATOM 0 HA ILE A 30 47.871 50.477 18.426 1.00 0.00 H new ATOM 0 HB ILE A 30 48.438 47.530 18.517 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.453 49.430 20.681 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.360 48.562 19.620 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.974 47.982 20.382 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.549 48.676 18.848 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.813 49.729 20.080 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.588 47.411 21.774 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.239 46.403 20.460 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.348 47.284 21.537 1.00 0.00 H new ATOM 490 N GLN A 31 49.481 48.888 16.001 1.00 0.00 N ATOM 491 CA GLN A 31 50.499 49.049 14.982 1.00 0.00 C ATOM 492 C GLN A 31 50.331 50.354 14.203 1.00 0.00 C ATOM 493 O GLN A 31 51.321 50.993 13.852 1.00 0.00 O ATOM 494 CB GLN A 31 50.476 47.826 14.070 1.00 0.00 C ATOM 495 CG GLN A 31 51.473 47.876 12.916 1.00 0.00 C ATOM 496 CD GLN A 31 51.393 46.636 12.022 1.00 0.00 C ATOM 497 OE1 GLN A 31 52.332 45.852 11.912 1.00 0.00 O ATOM 498 NE2 GLN A 31 50.280 46.395 11.335 1.00 0.00 N ATOM 0 H GLN A 31 48.956 48.019 15.908 1.00 0.00 H new ATOM 0 HA GLN A 31 51.476 49.119 15.459 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.678 46.938 14.669 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.472 47.713 13.661 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.285 48.766 12.316 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.483 47.968 13.316 1.00 0.00 H new ATOM 0 HE21 GLN A 31 49.487 47.032 11.410 1.00 0.00 H new ATOM 0 HE22 GLN A 31 50.220 45.574 10.733 1.00 0.00 H new ATOM 507 N ASP A 32 49.097 50.796 13.977 1.00 0.00 N ATOM 508 CA ASP A 32 48.768 52.025 13.283 1.00 0.00 C ATOM 509 C ASP A 32 48.953 53.311 14.092 1.00 0.00 C ATOM 510 O ASP A 32 48.743 54.397 13.557 1.00 0.00 O ATOM 511 CB ASP A 32 47.342 51.890 12.757 1.00 0.00 C ATOM 512 CG ASP A 32 46.949 52.988 11.768 1.00 0.00 C ATOM 513 OD1 ASP A 32 45.796 53.467 11.847 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.756 53.338 10.880 1.00 0.00 O ATOM 0 H ASP A 32 48.271 50.284 14.287 1.00 0.00 H new ATOM 0 HA ASP A 32 49.486 52.143 12.472 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.232 50.920 12.273 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.650 51.906 13.599 1.00 0.00 H new ATOM 519 N LYS A 33 49.335 53.230 15.364 1.00 0.00 N ATOM 520 CA LYS A 33 49.690 54.375 16.178 1.00 0.00 C ATOM 521 C LYS A 33 51.109 54.291 16.742 1.00 0.00 C ATOM 522 O LYS A 33 51.836 55.282 16.712 1.00 0.00 O ATOM 523 CB LYS A 33 48.641 54.620 17.257 1.00 0.00 C ATOM 524 CG LYS A 33 47.252 54.878 16.680 1.00 0.00 C ATOM 525 CD LYS A 33 46.259 55.447 17.689 1.00 0.00 C ATOM 526 CE LYS A 33 44.919 55.697 17.003 1.00 0.00 C ATOM 527 NZ LYS A 33 43.912 56.306 17.885 1.00 0.00 N ATOM 0 H LYS A 33 49.406 52.343 15.863 1.00 0.00 H new ATOM 0 HA LYS A 33 49.697 55.246 15.523 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.600 53.756 17.921 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.942 55.474 17.864 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.340 55.570 15.842 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.855 53.944 16.282 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.130 54.752 18.519 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.643 56.377 18.108 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.076 56.347 16.142 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.533 54.751 16.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.000 56.355 17.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.808 55.729 18.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.215 57.266 18.147 1.00 0.00 H new ATOM 541 N GLU A 34 51.543 53.113 17.183 1.00 0.00 N ATOM 542 CA GLU A 34 52.817 52.877 17.829 1.00 0.00 C ATOM 543 C GLU A 34 53.869 52.180 16.965 1.00 0.00 C ATOM 544 O GLU A 34 55.017 52.073 17.393 1.00 0.00 O ATOM 545 CB GLU A 34 52.601 52.087 19.118 1.00 0.00 C ATOM 546 CG GLU A 34 51.759 52.811 20.164 1.00 0.00 C ATOM 547 CD GLU A 34 52.321 54.197 20.491 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.521 54.315 20.817 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.578 55.196 20.385 1.00 0.00 O ATOM 0 H GLU A 34 50.986 52.263 17.092 1.00 0.00 H new ATOM 0 HA GLU A 34 53.225 53.867 18.033 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.120 51.140 18.874 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.572 51.849 19.552 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.736 52.911 19.801 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.717 52.212 21.074 1.00 0.00 H new ATOM 556 N GLY A 35 53.520 51.693 15.777 1.00 0.00 N ATOM 557 CA GLY A 35 54.440 51.070 14.848 1.00 0.00 C ATOM 558 C GLY A 35 54.877 49.640 15.175 1.00 0.00 C ATOM 559 O GLY A 35 55.658 49.066 14.419 1.00 0.00 O ATOM 0 H GLY A 35 52.561 51.725 15.431 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.979 51.068 13.860 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.332 51.693 14.782 1.00 0.00 H new ATOM 563 N ILE A 36 54.397 49.055 16.268 1.00 0.00 N ATOM 564 CA ILE A 36 54.822 47.762 16.769 1.00 0.00 C ATOM 565 C ILE A 36 54.089 46.648 16.019 1.00 0.00 C ATOM 566 O ILE A 36 52.863 46.618 16.096 1.00 0.00 O ATOM 567 CB ILE A 36 54.599 47.652 18.275 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.233 48.818 19.026 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.146 46.323 18.788 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.050 48.804 20.542 1.00 0.00 C ATOM 0 H ILE A 36 53.676 49.487 16.846 1.00 0.00 H new ATOM 0 HA ILE A 36 55.892 47.656 16.593 1.00 0.00 H new ATOM 0 HB ILE A 36 53.525 47.692 18.459 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.301 48.830 18.807 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.817 49.747 18.636 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.983 46.253 19.863 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.633 45.501 18.289 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.214 46.264 18.579 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.539 49.676 20.976 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.987 48.828 20.780 1.00 0.00 H new ATOM 0 HD13 ILE A 36 55.493 47.897 20.954 1.00 0.00 H new ATOM 582 N PRO A 37 54.756 45.716 15.343 1.00 0.00 N ATOM 583 CA PRO A 37 54.086 44.649 14.626 1.00 0.00 C ATOM 584 C PRO A 37 53.289 43.699 15.522 1.00 0.00 C ATOM 585 O PRO A 37 53.711 43.428 16.644 1.00 0.00 O ATOM 586 CB PRO A 37 55.166 43.914 13.838 1.00 0.00 C ATOM 587 CG PRO A 37 56.261 44.966 13.680 1.00 0.00 C ATOM 588 CD PRO A 37 56.166 45.708 15.010 1.00 0.00 C ATOM 0 HA PRO A 37 53.329 45.077 13.969 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.526 43.035 14.373 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.796 43.570 12.872 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.243 44.517 13.530 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.078 45.623 12.830 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.750 45.207 15.782 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.556 46.722 14.923 1.00 0.00 H new ATOM 596 N PRO A 38 52.184 43.127 15.052 1.00 0.00 N ATOM 597 CA PRO A 38 51.320 42.270 15.837 1.00 0.00 C ATOM 598 C PRO A 38 51.995 41.000 16.359 1.00 0.00 C ATOM 599 O PRO A 38 51.592 40.471 17.391 1.00 0.00 O ATOM 600 CB PRO A 38 50.140 41.937 14.928 1.00 0.00 C ATOM 601 CG PRO A 38 50.728 42.057 13.525 1.00 0.00 C ATOM 602 CD PRO A 38 51.673 43.243 13.701 1.00 0.00 C ATOM 0 HA PRO A 38 51.018 42.791 16.746 1.00 0.00 H new ATOM 0 HB2 PRO A 38 49.757 40.935 15.118 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.311 42.629 15.077 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.255 41.153 13.221 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.963 42.249 12.773 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.482 43.213 12.971 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.149 44.188 13.558 1.00 0.00 H new ATOM 610 N ASP A 39 53.058 40.546 15.700 1.00 0.00 N ATOM 611 CA ASP A 39 53.860 39.410 16.104 1.00 0.00 C ATOM 612 C ASP A 39 54.643 39.650 17.396 1.00 0.00 C ATOM 613 O ASP A 39 55.160 38.712 17.997 1.00 0.00 O ATOM 614 CB ASP A 39 54.857 39.045 15.007 1.00 0.00 C ATOM 615 CG ASP A 39 54.361 39.125 13.561 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.166 39.570 12.714 1.00 0.00 O ATOM 617 OD2 ASP A 39 53.198 38.778 13.263 1.00 0.00 O ATOM 0 H ASP A 39 53.391 40.980 14.839 1.00 0.00 H new ATOM 0 HA ASP A 39 53.154 38.599 16.281 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.723 39.700 15.105 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.204 38.028 15.190 1.00 0.00 H new ATOM 622 N GLN A 40 54.775 40.910 17.803 1.00 0.00 N ATOM 623 CA GLN A 40 55.611 41.382 18.889 1.00 0.00 C ATOM 624 C GLN A 40 54.809 41.938 20.067 1.00 0.00 C ATOM 625 O GLN A 40 55.392 42.473 21.007 1.00 0.00 O ATOM 626 CB GLN A 40 56.602 42.401 18.335 1.00 0.00 C ATOM 627 CG GLN A 40 57.437 41.866 17.175 1.00 0.00 C ATOM 628 CD GLN A 40 58.484 42.859 16.669 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.107 43.602 17.425 1.00 0.00 O ATOM 630 NE2 GLN A 40 58.719 42.922 15.361 1.00 0.00 N ATOM 0 H GLN A 40 54.267 41.671 17.351 1.00 0.00 H new ATOM 0 HA GLN A 40 56.155 40.532 19.301 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.056 43.284 18.003 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.269 42.721 19.136 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.938 40.951 17.490 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.773 41.599 16.353 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.210 42.312 14.721 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.408 43.580 14.998 1.00 0.00 H new ATOM 639 N GLN A 41 53.487 41.802 20.040 1.00 0.00 N ATOM 640 CA GLN A 41 52.549 42.282 21.036 1.00 0.00 C ATOM 641 C GLN A 41 51.822 41.132 21.736 1.00 0.00 C ATOM 642 O GLN A 41 51.504 40.134 21.094 1.00 0.00 O ATOM 643 CB GLN A 41 51.483 43.151 20.374 1.00 0.00 C ATOM 644 CG GLN A 41 51.937 44.386 19.601 1.00 0.00 C ATOM 645 CD GLN A 41 50.733 45.114 18.999 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.651 45.162 19.580 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.814 45.680 17.798 1.00 0.00 N ATOM 0 H GLN A 41 53.018 41.323 19.272 1.00 0.00 H new ATOM 0 HA GLN A 41 53.129 42.847 21.766 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.917 42.519 19.690 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.792 43.480 21.150 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.481 45.058 20.265 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.626 44.093 18.809 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.695 45.661 17.284 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.995 46.133 17.391 1.00 0.00 H new ATOM 656 N ARG A 42 51.423 41.302 22.994 1.00 0.00 N ATOM 657 CA ARG A 42 50.397 40.541 23.679 1.00 0.00 C ATOM 658 C ARG A 42 49.553 41.499 24.522 1.00 0.00 C ATOM 659 O ARG A 42 50.103 42.388 25.168 1.00 0.00 O ATOM 660 CB ARG A 42 51.051 39.449 24.523 1.00 0.00 C ATOM 661 CG ARG A 42 50.166 38.738 25.542 1.00 0.00 C ATOM 662 CD ARG A 42 48.908 38.049 25.020 1.00 0.00 C ATOM 663 NE ARG A 42 49.175 36.965 24.075 1.00 0.00 N ATOM 664 CZ ARG A 42 49.616 35.733 24.366 1.00 0.00 C ATOM 665 NH1 ARG A 42 49.966 35.357 25.603 1.00 0.00 N ATOM 666 NH2 ARG A 42 49.717 34.815 23.395 1.00 0.00 N ATOM 0 H ARG A 42 51.835 42.018 23.592 1.00 0.00 H new ATOM 0 HA ARG A 42 49.736 40.048 22.966 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.460 38.698 23.847 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.893 39.891 25.056 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.773 37.990 26.051 1.00 0.00 H new ATOM 0 HG3 ARG A 42 49.863 39.468 26.293 1.00 0.00 H new ATOM 0 HD2 ARG A 42 48.346 37.651 25.865 1.00 0.00 H new ATOM 0 HD3 ARG A 42 48.273 38.791 24.536 1.00 0.00 H new ATOM 0 HE ARG A 42 49.008 37.168 23.090 1.00 0.00 H new ATOM 0 HH11 ARG A 42 49.903 36.021 26.375 1.00 0.00 H new ATOM 0 HH12 ARG A 42 50.296 34.407 25.773 1.00 0.00 H new ATOM 0 HH21 ARG A 42 49.459 35.055 22.438 1.00 0.00 H new ATOM 0 HH22 ARG A 42 50.052 33.877 23.613 1.00 0.00 H new ATOM 680 N LEU A 43 48.233 41.339 24.514 1.00 0.00 N ATOM 681 CA LEU A 43 47.319 42.164 25.279 1.00 0.00 C ATOM 682 C LEU A 43 46.802 41.440 26.523 1.00 0.00 C ATOM 683 O LEU A 43 46.529 40.244 26.462 1.00 0.00 O ATOM 684 CB LEU A 43 46.185 42.659 24.387 1.00 0.00 C ATOM 685 CG LEU A 43 46.618 43.365 23.105 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.398 43.869 22.337 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.538 44.555 23.363 1.00 0.00 C ATOM 0 H LEU A 43 47.766 40.618 23.964 1.00 0.00 H new ATOM 0 HA LEU A 43 47.866 43.034 25.642 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.559 41.808 24.119 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.563 43.342 24.965 1.00 0.00 H new ATOM 0 HG LEU A 43 47.168 42.624 22.525 1.00 0.00 H new ATOM 0 HD11 LEU A 43 45.723 44.370 21.425 1.00 0.00 H new ATOM 0 HD12 LEU A 43 44.757 43.026 22.079 1.00 0.00 H new ATOM 0 HD13 LEU A 43 44.842 44.571 22.958 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.812 45.016 22.414 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.022 45.286 23.986 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.439 44.215 23.874 1.00 0.00 H new ATOM 699 N ILE A 44 46.664 42.171 27.626 1.00 0.00 N ATOM 700 CA ILE A 44 46.170 41.696 28.903 1.00 0.00 C ATOM 701 C ILE A 44 44.988 42.558 29.350 1.00 0.00 C ATOM 702 O ILE A 44 45.101 43.782 29.356 1.00 0.00 O ATOM 703 CB ILE A 44 47.260 41.719 29.970 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.626 41.184 29.546 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.793 41.000 31.233 1.00 0.00 C ATOM 706 CD1 ILE A 44 48.700 39.700 29.201 1.00 0.00 C ATOM 0 H ILE A 44 46.908 43.161 27.648 1.00 0.00 H new ATOM 0 HA ILE A 44 45.848 40.662 28.777 1.00 0.00 H new ATOM 0 HB ILE A 44 47.420 42.780 30.160 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.961 41.753 28.678 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.335 41.383 30.350 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.585 41.028 31.981 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.905 41.495 31.626 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.555 39.963 30.995 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.720 39.443 28.916 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.406 39.110 30.069 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.026 39.485 28.371 1.00 0.00 H new ATOM 718 N PHE A 45 43.883 41.944 29.762 1.00 0.00 N ATOM 719 CA PHE A 45 42.753 42.628 30.359 1.00 0.00 C ATOM 720 C PHE A 45 42.187 41.885 31.571 1.00 0.00 C ATOM 721 O PHE A 45 41.876 40.698 31.495 1.00 0.00 O ATOM 722 CB PHE A 45 41.654 42.863 29.326 1.00 0.00 C ATOM 723 CG PHE A 45 40.428 43.520 29.912 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.455 44.883 30.230 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.287 42.765 30.209 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.351 45.486 30.845 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.172 43.369 30.803 1.00 0.00 C ATOM 728 CZ PHE A 45 38.204 44.732 31.120 1.00 0.00 C ATOM 0 H PHE A 45 43.751 40.935 29.686 1.00 0.00 H new ATOM 0 HA PHE A 45 43.124 43.589 30.714 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.045 43.487 28.522 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.371 41.909 28.880 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.331 45.472 30.000 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.267 41.710 29.979 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.384 46.533 31.107 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.289 42.784 31.016 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.345 45.201 31.576 1.00 0.00 H new ATOM 738 N ALA A 46 42.021 42.597 32.682 1.00 0.00 N ATOM 739 CA ALA A 46 41.599 42.069 33.963 1.00 0.00 C ATOM 740 C ALA A 46 42.356 40.800 34.364 1.00 0.00 C ATOM 741 O ALA A 46 41.761 39.805 34.769 1.00 0.00 O ATOM 742 CB ALA A 46 40.077 41.964 33.995 1.00 0.00 C ATOM 0 H ALA A 46 42.186 43.603 32.708 1.00 0.00 H new ATOM 0 HA ALA A 46 41.877 42.768 34.752 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.760 41.567 34.959 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.641 42.952 33.849 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.741 41.298 33.200 1.00 0.00 H new ATOM 748 N GLY A 47 43.672 40.805 34.174 1.00 0.00 N ATOM 749 CA GLY A 47 44.564 39.693 34.434 1.00 0.00 C ATOM 750 C GLY A 47 44.535 38.537 33.432 1.00 0.00 C ATOM 751 O GLY A 47 45.359 37.634 33.558 1.00 0.00 O ATOM 0 H GLY A 47 44.163 41.625 33.818 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.583 40.078 34.479 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.330 39.293 35.421 1.00 0.00 H new ATOM 755 N LYS A 48 43.632 38.535 32.455 1.00 0.00 N ATOM 756 CA LYS A 48 43.472 37.488 31.467 1.00 0.00 C ATOM 757 C LYS A 48 44.307 37.768 30.216 1.00 0.00 C ATOM 758 O LYS A 48 44.258 38.871 29.673 1.00 0.00 O ATOM 759 CB LYS A 48 41.987 37.291 31.173 1.00 0.00 C ATOM 760 CG LYS A 48 41.655 35.915 30.606 1.00 0.00 C ATOM 761 CD LYS A 48 40.149 35.680 30.519 1.00 0.00 C ATOM 762 CE LYS A 48 39.842 34.244 30.104 1.00 0.00 C ATOM 763 NZ LYS A 48 38.400 33.967 30.015 1.00 0.00 N ATOM 0 H LYS A 48 42.967 39.298 32.331 1.00 0.00 H new ATOM 0 HA LYS A 48 43.855 36.548 31.864 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.420 37.443 32.091 1.00 0.00 H new ATOM 0 HB3 LYS A 48 41.660 38.054 30.467 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.095 35.816 29.614 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.106 35.146 31.233 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.688 35.890 31.484 1.00 0.00 H new ATOM 0 HD3 LYS A 48 39.710 36.372 29.800 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.305 34.044 29.138 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.294 33.560 30.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.254 32.978 29.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 37.958 34.129 30.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 37.968 34.598 29.310 1.00 0.00 H new ATOM 777 N GLN A 49 45.064 36.777 29.753 1.00 0.00 N ATOM 778 CA GLN A 49 45.824 36.808 28.520 1.00 0.00 C ATOM 779 C GLN A 49 44.875 36.786 27.320 1.00 0.00 C ATOM 780 O GLN A 49 43.996 35.929 27.265 1.00 0.00 O ATOM 781 CB GLN A 49 46.743 35.592 28.460 1.00 0.00 C ATOM 782 CG GLN A 49 47.869 35.565 29.490 1.00 0.00 C ATOM 783 CD GLN A 49 49.136 36.325 29.090 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.323 36.747 27.952 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.082 36.497 30.008 1.00 0.00 N ATOM 0 H GLN A 49 45.165 35.894 30.254 1.00 0.00 H new ATOM 0 HA GLN A 49 46.419 37.721 28.490 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.137 34.695 28.587 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.184 35.541 27.465 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.495 35.982 30.425 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.135 34.526 29.687 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.940 36.152 30.957 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.950 36.974 29.763 1.00 0.00 H new ATOM 794 N LEU A 50 45.049 37.679 26.349 1.00 0.00 N ATOM 795 CA LEU A 50 44.171 37.799 25.203 1.00 0.00 C ATOM 796 C LEU A 50 44.826 37.270 23.925 1.00 0.00 C ATOM 797 O LEU A 50 45.917 37.697 23.556 1.00 0.00 O ATOM 798 CB LEU A 50 43.705 39.242 25.037 1.00 0.00 C ATOM 799 CG LEU A 50 43.171 39.949 26.279 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.685 41.341 25.883 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.011 39.216 26.945 1.00 0.00 C ATOM 0 H LEU A 50 45.819 38.348 26.342 1.00 0.00 H new ATOM 0 HA LEU A 50 43.295 37.177 25.387 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.541 39.825 24.650 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.925 39.260 24.276 1.00 0.00 H new ATOM 0 HG LEU A 50 43.991 39.985 26.996 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.301 41.856 26.763 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.514 41.910 25.463 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.893 41.252 25.140 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.682 39.775 27.821 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.184 39.127 26.240 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.336 38.222 27.251 1.00 0.00 H new ATOM 813 N GLU A 51 44.165 36.348 23.231 1.00 0.00 N ATOM 814 CA GLU A 51 44.698 35.597 22.113 1.00 0.00 C ATOM 815 C GLU A 51 44.062 35.984 20.777 1.00 0.00 C ATOM 816 O GLU A 51 42.884 36.322 20.688 1.00 0.00 O ATOM 817 CB GLU A 51 44.606 34.099 22.392 1.00 0.00 C ATOM 818 CG GLU A 51 45.539 33.657 23.517 1.00 0.00 C ATOM 819 CD GLU A 51 45.355 32.179 23.866 1.00 0.00 C ATOM 820 OE1 GLU A 51 44.513 31.868 24.736 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.052 31.322 23.280 1.00 0.00 O ATOM 0 H GLU A 51 43.200 36.097 23.447 1.00 0.00 H new ATOM 0 HA GLU A 51 45.751 35.859 22.012 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.579 33.844 22.654 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.850 33.548 21.484 1.00 0.00 H new ATOM 0 HG2 GLU A 51 46.573 33.834 23.221 1.00 0.00 H new ATOM 0 HG3 GLU A 51 45.353 34.265 24.403 1.00 0.00 H new ATOM 828 N ASP A 52 44.860 35.942 19.713 1.00 0.00 N ATOM 829 CA ASP A 52 44.684 36.698 18.489 1.00 0.00 C ATOM 830 C ASP A 52 43.410 36.413 17.691 1.00 0.00 C ATOM 831 O ASP A 52 42.967 37.277 16.939 1.00 0.00 O ATOM 832 CB ASP A 52 45.913 36.492 17.610 1.00 0.00 C ATOM 833 CG ASP A 52 47.177 37.184 18.129 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.967 37.684 17.299 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.423 37.242 19.352 1.00 0.00 O ATOM 0 H ASP A 52 45.688 35.347 19.686 1.00 0.00 H new ATOM 0 HA ASP A 52 44.567 37.736 18.801 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.108 35.423 17.521 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.695 36.861 16.608 1.00 0.00 H new ATOM 840 N GLY A 53 42.814 35.232 17.825 1.00 0.00 N ATOM 841 CA GLY A 53 41.622 34.833 17.103 1.00 0.00 C ATOM 842 C GLY A 53 40.282 35.227 17.727 1.00 0.00 C ATOM 843 O GLY A 53 39.267 35.173 17.036 1.00 0.00 O ATOM 0 H GLY A 53 43.160 34.510 18.457 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.671 35.260 16.101 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.639 33.749 16.988 1.00 0.00 H new ATOM 847 N ARG A 54 40.252 35.604 19.003 1.00 0.00 N ATOM 848 CA ARG A 54 39.043 35.902 19.742 1.00 0.00 C ATOM 849 C ARG A 54 38.662 37.383 19.674 1.00 0.00 C ATOM 850 O ARG A 54 39.496 38.231 19.361 1.00 0.00 O ATOM 851 CB ARG A 54 39.167 35.363 21.163 1.00 0.00 C ATOM 852 CG ARG A 54 38.959 33.852 21.171 1.00 0.00 C ATOM 853 CD ARG A 54 38.949 33.243 22.571 1.00 0.00 C ATOM 854 NE ARG A 54 38.579 31.831 22.477 1.00 0.00 N ATOM 855 CZ ARG A 54 38.313 30.973 23.472 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.455 31.259 24.774 1.00 0.00 N ATOM 857 NH2 ARG A 54 37.886 29.739 23.173 1.00 0.00 N ATOM 0 H ARG A 54 41.098 35.712 19.562 1.00 0.00 H new ATOM 0 HA ARG A 54 38.205 35.390 19.269 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.150 35.605 21.567 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.430 35.843 21.808 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.015 33.621 20.677 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.749 33.382 20.585 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.932 33.344 23.032 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.242 33.775 23.207 1.00 0.00 H new ATOM 0 HE ARG A 54 38.515 31.450 21.533 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.785 32.181 25.061 1.00 0.00 H new ATOM 0 HH12 ARG A 54 38.233 30.555 25.478 1.00 0.00 H new ATOM 0 HH21 ARG A 54 37.767 29.463 22.198 1.00 0.00 H new ATOM 0 HH22 ARG A 54 37.680 29.076 23.920 1.00 0.00 H new ATOM 871 N THR A 55 37.395 37.695 19.932 1.00 0.00 N ATOM 872 CA THR A 55 36.852 39.038 19.899 1.00 0.00 C ATOM 873 C THR A 55 36.825 39.721 21.268 1.00 0.00 C ATOM 874 O THR A 55 36.892 39.058 22.301 1.00 0.00 O ATOM 875 CB THR A 55 35.457 39.101 19.286 1.00 0.00 C ATOM 876 OG1 THR A 55 34.521 38.445 20.113 1.00 0.00 O ATOM 877 CG2 THR A 55 35.372 38.484 17.892 1.00 0.00 C ATOM 0 H THR A 55 36.699 36.991 20.178 1.00 0.00 H new ATOM 0 HA THR A 55 37.545 39.584 19.258 1.00 0.00 H new ATOM 0 HB THR A 55 35.229 40.163 19.198 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.505 37.490 19.895 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.351 38.565 17.520 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.047 39.012 17.218 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.658 37.433 17.941 1.00 0.00 H new ATOM 885 N LEU A 56 36.650 41.039 21.289 1.00 0.00 N ATOM 886 CA LEU A 56 36.348 41.771 22.504 1.00 0.00 C ATOM 887 C LEU A 56 35.116 41.214 23.220 1.00 0.00 C ATOM 888 O LEU A 56 35.129 41.110 24.446 1.00 0.00 O ATOM 889 CB LEU A 56 36.178 43.254 22.189 1.00 0.00 C ATOM 890 CG LEU A 56 37.420 43.953 21.642 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.106 45.424 21.386 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.604 43.895 22.603 1.00 0.00 C ATOM 0 H LEU A 56 36.715 41.627 20.458 1.00 0.00 H new ATOM 0 HA LEU A 56 37.188 41.649 23.187 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.371 43.364 21.465 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.863 43.767 23.097 1.00 0.00 H new ATOM 0 HG LEU A 56 37.692 43.430 20.725 1.00 0.00 H new ATOM 0 HD11 LEU A 56 37.993 45.923 20.995 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.297 45.502 20.660 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.804 45.899 22.319 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.458 44.408 22.160 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.335 44.381 23.541 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.866 42.855 22.795 1.00 0.00 H new ATOM 904 N SER A 57 34.097 40.779 22.486 1.00 0.00 N ATOM 905 CA SER A 57 32.912 40.130 23.010 1.00 0.00 C ATOM 906 C SER A 57 33.182 38.756 23.629 1.00 0.00 C ATOM 907 O SER A 57 32.592 38.433 24.656 1.00 0.00 O ATOM 908 CB SER A 57 31.874 40.027 21.897 1.00 0.00 C ATOM 909 OG SER A 57 30.651 39.531 22.395 1.00 0.00 O ATOM 0 H SER A 57 34.079 40.875 21.471 1.00 0.00 H new ATOM 0 HA SER A 57 32.539 40.746 23.828 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.718 41.008 21.448 1.00 0.00 H new ATOM 0 HB3 SER A 57 32.244 39.371 21.109 1.00 0.00 H new ATOM 0 HG SER A 57 29.999 39.474 21.665 1.00 0.00 H new ATOM 915 N ASP A 58 34.130 37.986 23.103 1.00 0.00 N ATOM 916 CA ASP A 58 34.575 36.728 23.669 1.00 0.00 C ATOM 917 C ASP A 58 35.338 36.872 24.987 1.00 0.00 C ATOM 918 O ASP A 58 35.523 35.886 25.698 1.00 0.00 O ATOM 919 CB ASP A 58 35.439 35.964 22.668 1.00 0.00 C ATOM 920 CG ASP A 58 34.677 35.533 21.413 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.655 34.828 21.547 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.114 35.872 20.291 1.00 0.00 O ATOM 0 H ASP A 58 34.622 38.233 22.244 1.00 0.00 H new ATOM 0 HA ASP A 58 33.664 36.173 23.891 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.282 36.590 22.375 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.851 35.080 23.155 1.00 0.00 H new ATOM 927 N TYR A 59 35.755 38.089 25.327 1.00 0.00 N ATOM 928 CA TYR A 59 36.318 38.476 26.605 1.00 0.00 C ATOM 929 C TYR A 59 35.426 39.438 27.394 1.00 0.00 C ATOM 930 O TYR A 59 35.818 39.881 28.471 1.00 0.00 O ATOM 931 CB TYR A 59 37.723 39.028 26.379 1.00 0.00 C ATOM 932 CG TYR A 59 38.708 38.039 25.804 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.193 36.993 26.599 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.179 38.193 24.495 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.150 36.104 26.095 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.134 37.311 23.976 1.00 0.00 C ATOM 937 CZ TYR A 59 40.621 36.259 24.776 1.00 0.00 C ATOM 938 OH TYR A 59 41.555 35.408 24.263 1.00 0.00 O ATOM 0 H TYR A 59 35.703 38.872 24.676 1.00 0.00 H new ATOM 0 HA TYR A 59 36.380 37.589 27.236 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.658 39.885 25.709 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.111 39.395 27.329 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.826 36.871 27.608 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.803 38.998 23.881 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.526 35.303 26.714 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.496 37.437 22.966 1.00 0.00 H new ATOM 0 HH TYR A 59 41.432 35.333 23.294 1.00 0.00 H new ATOM 948 N ASN A 60 34.234 39.748 26.894 1.00 0.00 N ATOM 949 CA ASN A 60 33.272 40.674 27.457 1.00 0.00 C ATOM 950 C ASN A 60 33.841 42.051 27.801 1.00 0.00 C ATOM 951 O ASN A 60 33.537 42.624 28.846 1.00 0.00 O ATOM 952 CB ASN A 60 32.488 39.977 28.566 1.00 0.00 C ATOM 953 CG ASN A 60 31.210 40.728 28.945 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.058 41.225 30.059 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.217 40.801 28.064 1.00 0.00 N ATOM 0 H ASN A 60 33.897 39.328 26.027 1.00 0.00 H new ATOM 0 HA ASN A 60 32.553 40.942 26.683 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.230 38.968 28.244 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.122 39.879 29.447 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.344 41.265 28.317 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.328 40.393 27.136 1.00 0.00 H new ATOM 962 N ILE A 61 34.695 42.601 26.943 1.00 0.00 N ATOM 963 CA ILE A 61 35.332 43.890 27.121 1.00 0.00 C ATOM 964 C ILE A 61 34.403 44.977 26.578 1.00 0.00 C ATOM 965 O ILE A 61 34.288 45.146 25.365 1.00 0.00 O ATOM 966 CB ILE A 61 36.711 43.913 26.468 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.590 42.783 26.997 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.381 45.264 26.700 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.993 42.690 26.406 1.00 0.00 C ATOM 0 H ILE A 61 34.968 42.140 26.075 1.00 0.00 H new ATOM 0 HA ILE A 61 35.500 44.082 28.181 1.00 0.00 H new ATOM 0 HB ILE A 61 36.582 43.763 25.396 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.680 42.896 28.077 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.079 41.838 26.816 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.364 45.268 26.229 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.768 46.054 26.266 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.490 45.437 27.771 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.523 41.851 26.857 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.925 42.539 25.329 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.535 43.613 26.609 1.00 0.00 H new ATOM 981 N GLN A 62 33.711 45.686 27.466 1.00 0.00 N ATOM 982 CA GLN A 62 32.738 46.710 27.149 1.00 0.00 C ATOM 983 C GLN A 62 33.368 48.099 27.027 1.00 0.00 C ATOM 984 O GLN A 62 34.574 48.250 27.210 1.00 0.00 O ATOM 985 CB GLN A 62 31.614 46.640 28.180 1.00 0.00 C ATOM 986 CG GLN A 62 30.845 45.323 28.130 1.00 0.00 C ATOM 987 CD GLN A 62 29.835 45.165 29.269 1.00 0.00 C ATOM 988 OE1 GLN A 62 28.634 45.369 29.114 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.280 44.777 30.462 1.00 0.00 N ATOM 0 H GLN A 62 33.824 45.551 28.471 1.00 0.00 H new ATOM 0 HA GLN A 62 32.316 46.523 26.161 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.034 46.773 29.177 1.00 0.00 H new ATOM 0 HB3 GLN A 62 30.922 47.466 28.013 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.321 45.253 27.177 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.554 44.496 28.165 1.00 0.00 H new ATOM 0 HE21 GLN A 62 31.275 44.604 30.604 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.626 44.652 31.235 1.00 0.00 H new ATOM 998 N LYS A 63 32.585 49.124 26.706 1.00 0.00 N ATOM 999 CA LYS A 63 33.035 50.484 26.494 1.00 0.00 C ATOM 1000 C LYS A 63 33.874 51.066 27.633 1.00 0.00 C ATOM 1001 O LYS A 63 33.590 50.836 28.806 1.00 0.00 O ATOM 1002 CB LYS A 63 31.844 51.385 26.179 1.00 0.00 C ATOM 1003 CG LYS A 63 30.928 51.642 27.372 1.00 0.00 C ATOM 1004 CD LYS A 63 29.627 52.346 26.997 1.00 0.00 C ATOM 1005 CE LYS A 63 28.774 52.500 28.253 1.00 0.00 C ATOM 1006 NZ LYS A 63 27.439 53.033 27.948 1.00 0.00 N ATOM 0 H LYS A 63 31.578 49.019 26.583 1.00 0.00 H new ATOM 0 HA LYS A 63 33.712 50.445 25.640 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.213 52.340 25.805 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.261 50.932 25.377 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.693 50.692 27.851 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.461 52.246 28.106 1.00 0.00 H new ATOM 0 HD2 LYS A 63 29.838 53.323 26.561 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.089 51.770 26.243 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.675 51.532 28.745 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.278 53.164 28.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 26.892 53.122 28.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 27.532 53.968 27.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 26.947 52.387 27.298 1.00 0.00 H new ATOM 1020 N GLU A 64 34.866 51.880 27.283 1.00 0.00 N ATOM 1021 CA GLU A 64 35.754 52.579 28.190 1.00 0.00 C ATOM 1022 C GLU A 64 36.532 51.650 29.124 1.00 0.00 C ATOM 1023 O GLU A 64 36.734 51.944 30.301 1.00 0.00 O ATOM 1024 CB GLU A 64 35.048 53.744 28.878 1.00 0.00 C ATOM 1025 CG GLU A 64 34.568 54.813 27.901 1.00 0.00 C ATOM 1026 CD GLU A 64 33.924 55.998 28.624 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.625 56.704 29.381 1.00 0.00 O ATOM 1028 OE2 GLU A 64 32.716 56.249 28.431 1.00 0.00 O ATOM 0 H GLU A 64 35.078 52.076 26.305 1.00 0.00 H new ATOM 0 HA GLU A 64 36.540 53.032 27.586 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.195 53.364 29.439 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.727 54.198 29.599 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.410 55.165 27.305 1.00 0.00 H new ATOM 0 HG3 GLU A 64 33.849 54.376 27.209 1.00 0.00 H new ATOM 1035 N SER A 65 36.991 50.522 28.590 1.00 0.00 N ATOM 1036 CA SER A 65 37.850 49.569 29.262 1.00 0.00 C ATOM 1037 C SER A 65 39.333 49.901 29.088 1.00 0.00 C ATOM 1038 O SER A 65 39.756 50.323 28.014 1.00 0.00 O ATOM 1039 CB SER A 65 37.589 48.153 28.759 1.00 0.00 C ATOM 1040 OG SER A 65 36.297 47.728 29.134 1.00 0.00 O ATOM 0 H SER A 65 36.761 50.241 27.637 1.00 0.00 H new ATOM 0 HA SER A 65 37.610 49.631 30.323 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.688 48.122 27.674 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.336 47.472 29.167 1.00 0.00 H new ATOM 0 HG SER A 65 35.718 47.704 28.343 1.00 0.00 H new ATOM 1046 N THR A 66 40.133 49.666 30.126 1.00 0.00 N ATOM 1047 CA THR A 66 41.566 49.874 30.159 1.00 0.00 C ATOM 1048 C THR A 66 42.299 48.532 30.156 1.00 0.00 C ATOM 1049 O THR A 66 42.024 47.665 30.983 1.00 0.00 O ATOM 1050 CB THR A 66 41.985 50.704 31.370 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.381 51.978 31.348 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.486 50.969 31.418 1.00 0.00 C ATOM 0 H THR A 66 39.773 49.306 31.010 1.00 0.00 H new ATOM 0 HA THR A 66 41.841 50.431 29.263 1.00 0.00 H new ATOM 0 HB THR A 66 41.673 50.113 32.231 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.665 52.488 32.135 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.723 51.563 32.301 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.022 50.021 31.465 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.788 51.513 30.523 1.00 0.00 H new ATOM 1060 N LEU A 67 43.253 48.367 29.245 1.00 0.00 N ATOM 1061 CA LEU A 67 44.045 47.171 29.037 1.00 0.00 C ATOM 1062 C LEU A 67 45.531 47.504 28.902 1.00 0.00 C ATOM 1063 O LEU A 67 45.905 48.654 28.679 1.00 0.00 O ATOM 1064 CB LEU A 67 43.515 46.387 27.839 1.00 0.00 C ATOM 1065 CG LEU A 67 43.606 47.103 26.494 1.00 0.00 C ATOM 1066 CD1 LEU A 67 43.913 46.106 25.381 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.308 47.817 26.125 1.00 0.00 C ATOM 0 H LEU A 67 43.505 49.113 28.596 1.00 0.00 H new ATOM 0 HA LEU A 67 43.951 46.533 29.916 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.064 45.448 27.769 1.00 0.00 H new ATOM 0 HB3 LEU A 67 42.472 46.133 28.026 1.00 0.00 H new ATOM 0 HG LEU A 67 44.403 47.840 26.595 1.00 0.00 H new ATOM 0 HD11 LEU A 67 43.975 46.632 24.428 1.00 0.00 H new ATOM 0 HD12 LEU A 67 44.864 45.613 25.586 1.00 0.00 H new ATOM 0 HD13 LEU A 67 43.120 45.359 25.333 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.426 48.310 25.160 1.00 0.00 H new ATOM 0 HD22 LEU A 67 41.498 47.091 26.065 1.00 0.00 H new ATOM 0 HD23 LEU A 67 42.073 48.561 26.886 1.00 0.00 H new ATOM 1079 N HIS A 68 46.391 46.496 29.023 1.00 0.00 N ATOM 1080 CA HIS A 68 47.829 46.664 29.021 1.00 0.00 C ATOM 1081 C HIS A 68 48.473 45.911 27.855 1.00 0.00 C ATOM 1082 O HIS A 68 48.069 44.798 27.528 1.00 0.00 O ATOM 1083 CB HIS A 68 48.412 46.252 30.370 1.00 0.00 C ATOM 1084 CG HIS A 68 47.780 46.955 31.540 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.285 48.080 32.191 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.605 46.590 32.143 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.430 48.350 33.180 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.404 47.484 33.176 1.00 0.00 N ATOM 0 H HIS A 68 46.096 45.525 29.127 1.00 0.00 H new ATOM 0 HA HIS A 68 48.058 47.719 28.873 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.291 45.176 30.495 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.483 46.455 30.371 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.964 45.767 31.865 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.548 49.157 33.888 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.615 47.486 33.822 1.00 0.00 H new ATOM 1096 N LEU A 69 49.483 46.528 27.247 1.00 0.00 N ATOM 1097 CA LEU A 69 50.272 45.968 26.169 1.00 0.00 C ATOM 1098 C LEU A 69 51.602 45.440 26.708 1.00 0.00 C ATOM 1099 O LEU A 69 52.416 46.220 27.198 1.00 0.00 O ATOM 1100 CB LEU A 69 50.451 47.042 25.100 1.00 0.00 C ATOM 1101 CG LEU A 69 51.473 46.731 24.009 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.091 45.514 23.171 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.597 47.932 23.076 1.00 0.00 C ATOM 0 H LEU A 69 49.781 47.468 27.507 1.00 0.00 H new ATOM 0 HA LEU A 69 49.766 45.116 25.716 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.486 47.221 24.627 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.743 47.971 25.590 1.00 0.00 H new ATOM 0 HG LEU A 69 52.416 46.514 24.511 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.854 45.341 22.412 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.015 44.638 23.815 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.131 45.693 22.687 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.326 47.713 22.296 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.629 48.140 22.620 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.925 48.802 23.645 1.00 0.00 H new ATOM 1115 N VAL A 70 51.850 44.143 26.550 1.00 0.00 N ATOM 1116 CA VAL A 70 53.102 43.463 26.815 1.00 0.00 C ATOM 1117 C VAL A 70 53.811 43.178 25.490 1.00 0.00 C ATOM 1118 O VAL A 70 53.155 42.916 24.485 1.00 0.00 O ATOM 1119 CB VAL A 70 52.829 42.189 27.610 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.058 41.299 27.763 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.322 42.517 29.011 1.00 0.00 C ATOM 0 H VAL A 70 51.132 43.503 26.211 1.00 0.00 H new ATOM 0 HA VAL A 70 53.761 44.090 27.416 1.00 0.00 H new ATOM 0 HB VAL A 70 52.076 41.651 27.035 1.00 0.00 H new ATOM 0 HG11 VAL A 70 53.795 40.411 28.338 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.416 41.001 26.778 1.00 0.00 H new ATOM 0 HG13 VAL A 70 54.843 41.848 28.283 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.135 41.592 29.556 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.071 43.105 29.541 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.397 43.088 28.939 1.00 0.00 H new