USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=16 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 55 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 6 LYS NZ :NH3+ -171:sc= 0.591 (180deg=-0.0563) USER MOD Set 2.2: A 12 THR OG1 : rot 180:sc= 0.667 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 165:sc= 1.24 (180deg=1.19) USER MOD Single : A 2 GLN : amide:sc= 0.927 K(o=0.93,f=-0.19) USER MOD Single : A 11 LYS NZ :NH3+ 159:sc= 1.09 (180deg=0.324) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0833 USER MOD Single : A 25 ASN : amide:sc= 1.58 K(o=1.6,f=-2.4!) USER MOD Single : A 27 LYS NZ :NH3+ -179:sc= 2.77 (180deg=2.74) USER MOD Single : A 29 LYS NZ :NH3+ -179:sc= 2.42 (180deg=2.37) USER MOD Single : A 31 GLN : amide:sc= -0.67 K(o=-0.67,f=-1.2) USER MOD Single : A 33 LYS NZ :NH3+ 149:sc= 1.26 (180deg=0.975) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 41 GLN : amide:sc= 1.57 K(o=1.6,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 X(o=0,f=-0.4) USER MOD Single : A 59 TYR OH : rot 110:sc= 0.447 USER MOD Single : A 60 ASN : amide:sc= -0.059 X(o=-0.059,f=-0.36) USER MOD Single : A 62 GLN : amide:sc= 0.559 K(o=0.56,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 164:sc= -0.0463 (180deg=-0.277) USER MOD Single : A 65 SER OG : rot -150:sc= 0.3 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.760 52.183 19.367 1.00 0.00 N ATOM 2 CA MET A 1 33.040 52.478 20.781 1.00 0.00 C ATOM 3 C MET A 1 34.539 52.702 20.994 1.00 0.00 C ATOM 4 O MET A 1 35.350 52.132 20.267 1.00 0.00 O ATOM 5 CB MET A 1 32.498 51.402 21.716 1.00 0.00 C ATOM 6 CG MET A 1 33.308 50.108 21.736 1.00 0.00 C ATOM 7 SD MET A 1 32.613 48.831 22.813 1.00 0.00 S ATOM 8 CE MET A 1 33.968 47.631 22.802 1.00 0.00 C ATOM 0 H1 MET A 1 31.802 51.789 19.278 1.00 0.00 H new ATOM 0 H2 MET A 1 32.827 53.059 18.810 1.00 0.00 H new ATOM 0 H3 MET A 1 33.453 51.493 19.013 1.00 0.00 H new ATOM 0 HA MET A 1 32.514 53.399 21.034 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.458 51.805 22.728 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.474 51.169 21.425 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.376 49.717 20.721 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.324 50.331 22.061 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.701 46.775 23.422 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.149 47.296 21.781 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.871 48.098 23.196 1.00 0.00 H new ATOM 20 N GLN A 2 34.895 53.465 22.023 1.00 0.00 N ATOM 21 CA GLN A 2 36.268 53.768 22.376 1.00 0.00 C ATOM 22 C GLN A 2 36.799 52.818 23.452 1.00 0.00 C ATOM 23 O GLN A 2 36.048 52.446 24.351 1.00 0.00 O ATOM 24 CB GLN A 2 36.317 55.235 22.794 1.00 0.00 C ATOM 25 CG GLN A 2 37.732 55.735 23.073 1.00 0.00 C ATOM 26 CD GLN A 2 37.774 57.263 23.111 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.658 57.893 24.161 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.954 57.910 21.963 1.00 0.00 N ATOM 0 H GLN A 2 34.215 53.898 22.647 1.00 0.00 H new ATOM 0 HA GLN A 2 36.929 53.615 21.523 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.872 55.845 22.008 1.00 0.00 H new ATOM 0 HB3 GLN A 2 35.708 55.372 23.687 1.00 0.00 H new ATOM 0 HG2 GLN A 2 38.083 55.334 24.024 1.00 0.00 H new ATOM 0 HG3 GLN A 2 38.410 55.368 22.303 1.00 0.00 H new ATOM 0 HE21 GLN A 2 38.050 57.387 21.093 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.996 58.929 21.953 1.00 0.00 H new ATOM 37 N ILE A 3 38.078 52.457 23.409 1.00 0.00 N ATOM 38 CA ILE A 3 38.781 51.739 24.453 1.00 0.00 C ATOM 39 C ILE A 3 40.152 52.355 24.738 1.00 0.00 C ATOM 40 O ILE A 3 40.691 53.082 23.906 1.00 0.00 O ATOM 41 CB ILE A 3 38.911 50.247 24.162 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.701 49.960 22.888 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.543 49.572 24.160 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.074 48.496 22.680 1.00 0.00 C ATOM 0 H ILE A 3 38.673 52.669 22.608 1.00 0.00 H new ATOM 0 HA ILE A 3 38.168 51.838 25.349 1.00 0.00 H new ATOM 0 HB ILE A 3 39.494 49.811 24.973 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.116 50.296 22.032 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.615 50.554 22.903 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.662 48.509 23.950 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.073 49.699 25.135 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.915 50.025 23.393 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.633 48.391 21.750 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.689 48.155 23.513 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.167 47.893 22.628 1.00 0.00 H new ATOM 56 N PHE A 4 40.744 52.027 25.883 1.00 0.00 N ATOM 57 CA PHE A 4 42.080 52.446 26.261 1.00 0.00 C ATOM 58 C PHE A 4 43.058 51.270 26.318 1.00 0.00 C ATOM 59 O PHE A 4 42.672 50.143 26.617 1.00 0.00 O ATOM 60 CB PHE A 4 42.040 53.177 27.599 1.00 0.00 C ATOM 61 CG PHE A 4 41.105 54.363 27.654 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.346 55.481 26.845 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.007 54.355 28.522 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.488 56.586 26.905 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.164 55.470 28.600 1.00 0.00 C ATOM 66 CZ PHE A 4 39.396 56.581 27.780 1.00 0.00 C ATOM 0 H PHE A 4 40.291 51.447 26.589 1.00 0.00 H new ATOM 0 HA PHE A 4 42.443 53.127 25.491 1.00 0.00 H new ATOM 0 HB2 PHE A 4 41.749 52.468 28.374 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.047 53.517 27.840 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.193 55.491 26.175 1.00 0.00 H new ATOM 0 HD2 PHE A 4 39.810 53.487 29.133 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.669 57.444 26.275 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.335 55.473 29.292 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.733 57.433 27.823 1.00 0.00 H new ATOM 76 N VAL A 5 44.338 51.532 26.074 1.00 0.00 N ATOM 77 CA VAL A 5 45.419 50.567 26.120 1.00 0.00 C ATOM 78 C VAL A 5 46.646 51.178 26.798 1.00 0.00 C ATOM 79 O VAL A 5 47.140 52.207 26.342 1.00 0.00 O ATOM 80 CB VAL A 5 45.772 50.055 24.727 1.00 0.00 C ATOM 81 CG1 VAL A 5 46.814 48.943 24.803 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.573 49.481 23.978 1.00 0.00 C ATOM 0 H VAL A 5 44.660 52.468 25.828 1.00 0.00 H new ATOM 0 HA VAL A 5 45.082 49.713 26.707 1.00 0.00 H new ATOM 0 HB VAL A 5 46.151 50.926 24.192 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.049 48.595 23.797 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.719 49.324 25.275 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.419 48.114 25.391 1.00 0.00 H new ATOM 0 HG21 VAL A 5 44.890 49.134 22.995 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.158 48.645 24.541 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.813 50.253 23.862 1.00 0.00 H new ATOM 92 N LYS A 6 47.157 50.572 27.866 1.00 0.00 N ATOM 93 CA LYS A 6 48.294 51.050 28.625 1.00 0.00 C ATOM 94 C LYS A 6 49.574 50.265 28.332 1.00 0.00 C ATOM 95 O LYS A 6 49.507 49.052 28.143 1.00 0.00 O ATOM 96 CB LYS A 6 47.983 51.018 30.119 1.00 0.00 C ATOM 97 CG LYS A 6 46.833 51.944 30.504 1.00 0.00 C ATOM 98 CD LYS A 6 46.590 51.999 32.009 1.00 0.00 C ATOM 99 CE LYS A 6 47.681 52.728 32.788 1.00 0.00 C ATOM 100 NZ LYS A 6 47.667 54.173 32.509 1.00 0.00 N ATOM 0 H LYS A 6 46.772 49.703 28.235 1.00 0.00 H new ATOM 0 HA LYS A 6 48.475 52.078 28.312 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.735 49.998 30.412 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.875 51.303 30.677 1.00 0.00 H new ATOM 0 HG2 LYS A 6 47.045 52.949 30.139 1.00 0.00 H new ATOM 0 HG3 LYS A 6 45.923 51.610 30.007 1.00 0.00 H new ATOM 0 HD2 LYS A 6 45.635 52.491 32.195 1.00 0.00 H new ATOM 0 HD3 LYS A 6 46.504 50.981 32.390 1.00 0.00 H new ATOM 0 HE2 LYS A 6 47.541 52.561 33.856 1.00 0.00 H new ATOM 0 HE3 LYS A 6 48.655 52.315 32.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 48.509 54.616 32.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.672 54.328 31.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.811 54.597 32.919 1.00 0.00 H new ATOM 168 N LYS A 11 52.560 55.039 28.803 1.00 0.00 N ATOM 169 CA LYS A 11 51.654 55.700 27.885 1.00 0.00 C ATOM 170 C LYS A 11 50.266 55.060 27.949 1.00 0.00 C ATOM 171 O LYS A 11 50.162 53.837 27.999 1.00 0.00 O ATOM 172 CB LYS A 11 52.231 55.694 26.473 1.00 0.00 C ATOM 173 CG LYS A 11 51.431 56.569 25.512 1.00 0.00 C ATOM 174 CD LYS A 11 52.039 56.635 24.114 1.00 0.00 C ATOM 175 CE LYS A 11 51.174 57.529 23.230 1.00 0.00 C ATOM 176 NZ LYS A 11 51.706 57.669 21.867 1.00 0.00 N ATOM 0 HA LYS A 11 51.540 56.742 28.182 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.263 56.043 26.504 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.252 54.671 26.097 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.414 56.184 25.441 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.363 57.578 25.920 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.055 57.027 24.165 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.105 55.635 23.686 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.166 57.117 23.181 1.00 0.00 H new ATOM 0 HE3 LYS A 11 51.094 58.515 23.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 50.943 57.967 21.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 52.462 58.383 21.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 52.089 56.756 21.549 1.00 0.00 H new ATOM 190 N THR A 12 49.215 55.873 27.876 1.00 0.00 N ATOM 191 CA THR A 12 47.852 55.424 27.668 1.00 0.00 C ATOM 192 C THR A 12 47.375 55.833 26.273 1.00 0.00 C ATOM 193 O THR A 12 47.212 57.011 25.962 1.00 0.00 O ATOM 194 CB THR A 12 46.911 55.932 28.756 1.00 0.00 C ATOM 195 OG1 THR A 12 47.394 55.551 30.025 1.00 0.00 O ATOM 196 CG2 THR A 12 45.518 55.322 28.624 1.00 0.00 C ATOM 0 H THR A 12 49.296 56.886 27.963 1.00 0.00 H new ATOM 0 HA THR A 12 47.838 54.336 27.734 1.00 0.00 H new ATOM 0 HB THR A 12 46.861 57.015 28.648 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.786 55.882 30.719 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.876 55.707 29.416 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.096 55.585 27.654 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.586 54.237 28.708 1.00 0.00 H new ATOM 204 N ILE A 13 47.184 54.833 25.417 1.00 0.00 N ATOM 205 CA ILE A 13 46.735 54.907 24.041 1.00 0.00 C ATOM 206 C ILE A 13 45.212 54.758 24.016 1.00 0.00 C ATOM 207 O ILE A 13 44.642 54.068 24.858 1.00 0.00 O ATOM 208 CB ILE A 13 47.436 53.818 23.235 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.956 53.959 23.249 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.973 53.765 21.781 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.679 52.622 23.120 1.00 0.00 C ATOM 0 H ILE A 13 47.356 53.868 25.699 1.00 0.00 H new ATOM 0 HA ILE A 13 46.986 55.867 23.590 1.00 0.00 H new ATOM 0 HB ILE A 13 47.156 52.890 23.734 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.262 54.612 22.432 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.262 54.444 24.176 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.507 52.971 21.258 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.902 53.566 21.747 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.180 54.720 21.298 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.756 52.788 23.136 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.399 51.975 23.951 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.399 52.146 22.180 1.00 0.00 H new ATOM 223 N THR A 14 44.544 55.376 23.047 1.00 0.00 N ATOM 224 CA THR A 14 43.112 55.323 22.827 1.00 0.00 C ATOM 225 C THR A 14 42.824 54.725 21.449 1.00 0.00 C ATOM 226 O THR A 14 43.507 55.091 20.494 1.00 0.00 O ATOM 227 CB THR A 14 42.527 56.729 22.917 1.00 0.00 C ATOM 228 OG1 THR A 14 42.888 57.357 24.126 1.00 0.00 O ATOM 229 CG2 THR A 14 41.001 56.731 22.879 1.00 0.00 C ATOM 0 H THR A 14 45.019 55.959 22.358 1.00 0.00 H new ATOM 0 HA THR A 14 42.652 54.696 23.590 1.00 0.00 H new ATOM 0 HB THR A 14 42.929 57.259 22.053 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.501 58.257 24.156 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.637 57.756 22.946 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.660 56.285 21.945 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.615 56.153 23.719 1.00 0.00 H new ATOM 237 N LEU A 15 41.852 53.827 21.324 1.00 0.00 N ATOM 238 CA LEU A 15 41.488 53.167 20.087 1.00 0.00 C ATOM 239 C LEU A 15 39.977 53.166 19.844 1.00 0.00 C ATOM 240 O LEU A 15 39.199 53.122 20.793 1.00 0.00 O ATOM 241 CB LEU A 15 41.973 51.720 20.088 1.00 0.00 C ATOM 242 CG LEU A 15 43.466 51.483 20.297 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.701 49.986 20.470 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.317 51.962 19.125 1.00 0.00 C ATOM 0 H LEU A 15 41.278 53.532 22.114 1.00 0.00 H new ATOM 0 HA LEU A 15 41.968 53.733 19.289 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.434 51.184 20.869 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.689 51.268 19.137 1.00 0.00 H new ATOM 0 HG LEU A 15 43.762 52.053 21.178 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.764 49.800 20.621 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.144 49.628 21.336 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.363 49.459 19.578 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.368 51.765 19.335 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.022 51.431 18.220 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.170 53.032 18.982 1.00 0.00 H new ATOM 256 N GLU A 16 39.579 53.118 18.575 1.00 0.00 N ATOM 257 CA GLU A 16 38.206 52.928 18.151 1.00 0.00 C ATOM 258 C GLU A 16 37.971 51.492 17.678 1.00 0.00 C ATOM 259 O GLU A 16 38.687 50.971 16.827 1.00 0.00 O ATOM 260 CB GLU A 16 37.819 53.924 17.063 1.00 0.00 C ATOM 261 CG GLU A 16 38.010 55.391 17.438 1.00 0.00 C ATOM 262 CD GLU A 16 37.272 55.820 18.708 1.00 0.00 C ATOM 263 OE1 GLU A 16 36.129 55.369 18.938 1.00 0.00 O ATOM 264 OE2 GLU A 16 37.815 56.672 19.445 1.00 0.00 O ATOM 0 H GLU A 16 40.228 53.214 17.794 1.00 0.00 H new ATOM 0 HA GLU A 16 37.567 53.111 19.015 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.408 53.712 16.171 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.773 53.764 16.800 1.00 0.00 H new ATOM 0 HG2 GLU A 16 39.075 55.584 17.568 1.00 0.00 H new ATOM 0 HG3 GLU A 16 37.672 56.012 16.609 1.00 0.00 H new ATOM 271 N VAL A 17 36.968 50.829 18.247 1.00 0.00 N ATOM 272 CA VAL A 17 36.628 49.434 18.052 1.00 0.00 C ATOM 273 C VAL A 17 35.113 49.228 18.058 1.00 0.00 C ATOM 274 O VAL A 17 34.345 50.174 18.213 1.00 0.00 O ATOM 275 CB VAL A 17 37.294 48.570 19.120 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.818 48.635 19.075 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.836 48.919 20.533 1.00 0.00 C ATOM 0 H VAL A 17 36.332 51.288 18.899 1.00 0.00 H new ATOM 0 HA VAL A 17 37.001 49.128 17.075 1.00 0.00 H new ATOM 0 HB VAL A 17 36.976 47.555 18.881 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.233 48.000 19.858 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.168 48.288 18.103 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.143 49.664 19.232 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.343 48.273 21.250 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.079 49.960 20.748 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.759 48.774 20.612 1.00 0.00 H new ATOM 287 N GLU A 18 34.670 47.979 17.934 1.00 0.00 N ATOM 288 CA GLU A 18 33.380 47.508 18.394 1.00 0.00 C ATOM 289 C GLU A 18 33.540 46.194 19.162 1.00 0.00 C ATOM 290 O GLU A 18 34.607 45.590 19.082 1.00 0.00 O ATOM 291 CB GLU A 18 32.411 47.413 17.219 1.00 0.00 C ATOM 292 CG GLU A 18 32.522 46.129 16.401 1.00 0.00 C ATOM 293 CD GLU A 18 31.826 46.292 15.048 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.623 46.627 15.015 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.487 46.079 14.009 1.00 0.00 O ATOM 0 H GLU A 18 35.225 47.246 17.493 1.00 0.00 H new ATOM 0 HA GLU A 18 32.948 48.222 19.096 1.00 0.00 H new ATOM 0 HB2 GLU A 18 31.393 47.499 17.598 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.578 48.264 16.558 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.572 45.878 16.248 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.073 45.301 16.950 1.00 0.00 H new ATOM 302 N PRO A 19 32.539 45.686 19.874 1.00 0.00 N ATOM 303 CA PRO A 19 32.668 44.453 20.624 1.00 0.00 C ATOM 304 C PRO A 19 33.076 43.223 19.811 1.00 0.00 C ATOM 305 O PRO A 19 33.635 42.281 20.369 1.00 0.00 O ATOM 306 CB PRO A 19 31.317 44.242 21.300 1.00 0.00 C ATOM 307 CG PRO A 19 30.750 45.653 21.425 1.00 0.00 C ATOM 308 CD PRO A 19 31.265 46.319 20.152 1.00 0.00 C ATOM 0 HA PRO A 19 33.492 44.559 21.329 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.667 43.601 20.704 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.427 43.767 22.275 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.661 45.652 21.472 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.108 46.158 22.322 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.568 46.179 19.326 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.382 47.394 20.291 1.00 0.00 H new ATOM 316 N SER A 20 32.830 43.231 18.504 1.00 0.00 N ATOM 317 CA SER A 20 33.148 42.171 17.569 1.00 0.00 C ATOM 318 C SER A 20 34.466 42.355 16.813 1.00 0.00 C ATOM 319 O SER A 20 34.725 41.626 15.858 1.00 0.00 O ATOM 320 CB SER A 20 31.985 41.946 16.607 1.00 0.00 C ATOM 321 OG SER A 20 30.776 41.769 17.311 1.00 0.00 O ATOM 0 H SER A 20 32.378 44.024 18.050 1.00 0.00 H new ATOM 0 HA SER A 20 33.301 41.279 18.176 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.896 42.797 15.932 1.00 0.00 H new ATOM 0 HB3 SER A 20 32.183 41.070 15.990 1.00 0.00 H new ATOM 0 HG SER A 20 30.044 41.628 16.674 1.00 0.00 H new ATOM 327 N ASP A 21 35.309 43.310 17.193 1.00 0.00 N ATOM 328 CA ASP A 21 36.684 43.416 16.745 1.00 0.00 C ATOM 329 C ASP A 21 37.489 42.183 17.159 1.00 0.00 C ATOM 330 O ASP A 21 37.463 41.798 18.325 1.00 0.00 O ATOM 331 CB ASP A 21 37.346 44.655 17.341 1.00 0.00 C ATOM 332 CG ASP A 21 37.252 45.913 16.478 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.145 46.314 16.056 1.00 0.00 O ATOM 334 OD2 ASP A 21 38.305 46.532 16.213 1.00 0.00 O ATOM 0 H ASP A 21 35.041 44.051 17.841 1.00 0.00 H new ATOM 0 HA ASP A 21 36.671 43.491 15.658 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.891 44.862 18.310 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.398 44.435 17.523 1.00 0.00 H new ATOM 339 N THR A 22 38.241 41.587 16.236 1.00 0.00 N ATOM 340 CA THR A 22 39.171 40.518 16.535 1.00 0.00 C ATOM 341 C THR A 22 40.496 41.049 17.087 1.00 0.00 C ATOM 342 O THR A 22 40.914 42.153 16.746 1.00 0.00 O ATOM 343 CB THR A 22 39.421 39.564 15.370 1.00 0.00 C ATOM 344 OG1 THR A 22 40.023 40.194 14.262 1.00 0.00 O ATOM 345 CG2 THR A 22 38.167 38.863 14.855 1.00 0.00 C ATOM 0 H THR A 22 38.216 41.842 15.249 1.00 0.00 H new ATOM 0 HA THR A 22 38.678 39.932 17.311 1.00 0.00 H new ATOM 0 HB THR A 22 40.094 38.825 15.804 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.161 39.537 13.548 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.432 38.204 14.028 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.722 38.276 15.659 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.450 39.608 14.510 1.00 0.00 H new ATOM 353 N ILE A 23 41.176 40.272 17.925 1.00 0.00 N ATOM 354 CA ILE A 23 42.359 40.719 18.632 1.00 0.00 C ATOM 355 C ILE A 23 43.547 40.960 17.699 1.00 0.00 C ATOM 356 O ILE A 23 44.237 41.966 17.850 1.00 0.00 O ATOM 357 CB ILE A 23 42.696 39.765 19.774 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.576 39.556 20.788 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.959 40.187 20.519 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.842 40.811 21.256 1.00 0.00 C ATOM 0 H ILE A 23 40.915 39.308 18.130 1.00 0.00 H new ATOM 0 HA ILE A 23 42.132 41.691 19.070 1.00 0.00 H new ATOM 0 HB ILE A 23 42.855 38.812 19.270 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.845 38.874 20.354 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.995 39.059 21.663 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.161 39.479 21.323 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.802 40.201 19.828 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.818 41.183 20.939 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.070 40.534 21.974 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.550 41.492 21.729 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.382 41.304 20.400 1.00 0.00 H new ATOM 372 N GLU A 24 43.766 40.134 16.680 1.00 0.00 N ATOM 373 CA GLU A 24 44.772 40.365 15.663 1.00 0.00 C ATOM 374 C GLU A 24 44.572 41.691 14.927 1.00 0.00 C ATOM 375 O GLU A 24 45.539 42.398 14.651 1.00 0.00 O ATOM 376 CB GLU A 24 44.797 39.167 14.718 1.00 0.00 C ATOM 377 CG GLU A 24 45.947 39.135 13.717 1.00 0.00 C ATOM 378 CD GLU A 24 47.335 39.063 14.357 1.00 0.00 C ATOM 379 OE1 GLU A 24 47.505 38.434 15.423 1.00 0.00 O ATOM 380 OE2 GLU A 24 48.276 39.654 13.786 1.00 0.00 O ATOM 0 H GLU A 24 43.238 39.273 16.541 1.00 0.00 H new ATOM 0 HA GLU A 24 45.746 40.458 16.143 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.836 38.257 15.317 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.858 39.145 14.165 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.818 38.275 13.060 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.894 40.026 13.091 1.00 0.00 H new ATOM 387 N ASN A 25 43.321 42.083 14.700 1.00 0.00 N ATOM 388 CA ASN A 25 42.950 43.387 14.188 1.00 0.00 C ATOM 389 C ASN A 25 43.210 44.521 15.181 1.00 0.00 C ATOM 390 O ASN A 25 43.666 45.587 14.775 1.00 0.00 O ATOM 391 CB ASN A 25 41.499 43.330 13.716 1.00 0.00 C ATOM 392 CG ASN A 25 40.686 44.577 14.066 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.668 45.564 13.334 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.043 44.565 15.230 1.00 0.00 N ATOM 0 H ASN A 25 42.518 41.479 14.875 1.00 0.00 H new ATOM 0 HA ASN A 25 43.591 43.626 13.340 1.00 0.00 H new ATOM 0 HB2 ASN A 25 41.484 43.189 12.635 1.00 0.00 H new ATOM 0 HB3 ASN A 25 41.017 42.458 14.158 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.520 45.387 15.532 1.00 0.00 H new ATOM 0 HD22 ASN A 25 40.073 43.734 15.820 1.00 0.00 H new ATOM 401 N VAL A 26 42.981 44.331 16.477 1.00 0.00 N ATOM 402 CA VAL A 26 43.271 45.345 17.471 1.00 0.00 C ATOM 403 C VAL A 26 44.776 45.616 17.531 1.00 0.00 C ATOM 404 O VAL A 26 45.186 46.774 17.567 1.00 0.00 O ATOM 405 CB VAL A 26 42.693 44.995 18.839 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.092 45.987 19.928 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.167 44.991 18.795 1.00 0.00 C ATOM 0 H VAL A 26 42.590 43.471 16.861 1.00 0.00 H new ATOM 0 HA VAL A 26 42.775 46.266 17.165 1.00 0.00 H new ATOM 0 HB VAL A 26 43.096 44.011 19.077 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.650 45.683 20.877 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.178 46.006 20.023 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.734 46.982 19.663 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.775 44.739 19.780 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.809 45.978 18.504 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.826 44.253 18.069 1.00 0.00 H new ATOM 417 N LYS A 27 45.607 44.585 17.403 1.00 0.00 N ATOM 418 CA LYS A 27 47.039 44.741 17.258 1.00 0.00 C ATOM 419 C LYS A 27 47.424 45.479 15.974 1.00 0.00 C ATOM 420 O LYS A 27 48.325 46.314 16.008 1.00 0.00 O ATOM 421 CB LYS A 27 47.736 43.387 17.354 1.00 0.00 C ATOM 422 CG LYS A 27 47.539 42.712 18.709 1.00 0.00 C ATOM 423 CD LYS A 27 48.277 41.384 18.842 1.00 0.00 C ATOM 424 CE LYS A 27 47.901 40.390 17.747 1.00 0.00 C ATOM 425 NZ LYS A 27 48.769 39.203 17.775 1.00 0.00 N ATOM 0 H LYS A 27 45.296 43.613 17.398 1.00 0.00 H new ATOM 0 HA LYS A 27 47.381 45.366 18.082 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.357 42.732 16.569 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.802 43.519 17.171 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.878 43.387 19.495 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.474 42.544 18.871 1.00 0.00 H new ATOM 0 HD2 LYS A 27 49.351 41.565 18.810 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.057 40.946 19.816 1.00 0.00 H new ATOM 0 HE2 LYS A 27 46.862 40.085 17.872 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.976 40.874 16.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.497 38.556 17.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 49.759 39.494 17.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 48.665 38.718 18.689 1.00 0.00 H new ATOM 439 N ALA A 28 46.721 45.263 14.865 1.00 0.00 N ATOM 440 CA ALA A 28 46.925 46.018 13.646 1.00 0.00 C ATOM 441 C ALA A 28 46.519 47.488 13.775 1.00 0.00 C ATOM 442 O ALA A 28 47.189 48.361 13.229 1.00 0.00 O ATOM 443 CB ALA A 28 46.183 45.332 12.503 1.00 0.00 C ATOM 0 H ALA A 28 45.991 44.554 14.793 1.00 0.00 H new ATOM 0 HA ALA A 28 47.994 46.031 13.434 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.333 45.896 11.582 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.567 44.320 12.375 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.119 45.290 12.734 1.00 0.00 H new ATOM 449 N LYS A 29 45.469 47.800 14.529 1.00 0.00 N ATOM 450 CA LYS A 29 45.069 49.152 14.864 1.00 0.00 C ATOM 451 C LYS A 29 46.093 49.860 15.754 1.00 0.00 C ATOM 452 O LYS A 29 46.320 51.054 15.576 1.00 0.00 O ATOM 453 CB LYS A 29 43.696 49.153 15.530 1.00 0.00 C ATOM 454 CG LYS A 29 42.560 48.933 14.535 1.00 0.00 C ATOM 455 CD LYS A 29 41.218 48.900 15.261 1.00 0.00 C ATOM 456 CE LYS A 29 40.075 48.880 14.250 1.00 0.00 C ATOM 457 NZ LYS A 29 38.776 48.888 14.938 1.00 0.00 N ATOM 0 H LYS A 29 44.857 47.092 14.934 1.00 0.00 H new ATOM 0 HA LYS A 29 45.015 49.710 13.929 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.665 48.372 16.290 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.546 50.103 16.043 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.559 49.730 13.792 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.714 47.997 13.998 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.163 48.019 15.901 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.125 49.771 15.909 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.149 49.746 13.592 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.154 47.993 13.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.010 48.857 14.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.708 48.058 15.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.689 49.755 15.506 1.00 0.00 H new ATOM 471 N ILE A 30 46.736 49.136 16.666 1.00 0.00 N ATOM 472 CA ILE A 30 47.849 49.623 17.457 1.00 0.00 C ATOM 473 C ILE A 30 49.080 49.861 16.578 1.00 0.00 C ATOM 474 O ILE A 30 49.719 50.903 16.701 1.00 0.00 O ATOM 475 CB ILE A 30 48.129 48.681 18.623 1.00 0.00 C ATOM 476 CG1 ILE A 30 46.989 48.715 19.636 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.442 49.018 19.325 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.934 47.516 20.579 1.00 0.00 C ATOM 0 H ILE A 30 46.486 48.170 16.877 1.00 0.00 H new ATOM 0 HA ILE A 30 47.583 50.589 17.887 1.00 0.00 H new ATOM 0 HB ILE A 30 48.212 47.678 18.204 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.078 49.624 20.231 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.044 48.779 19.096 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.603 48.323 20.149 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.265 48.936 18.615 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.397 50.036 19.712 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.092 47.629 21.262 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.810 46.602 19.998 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.860 47.460 21.151 1.00 0.00 H new ATOM 490 N GLN A 31 49.395 48.968 15.644 1.00 0.00 N ATOM 491 CA GLN A 31 50.480 49.146 14.701 1.00 0.00 C ATOM 492 C GLN A 31 50.285 50.404 13.853 1.00 0.00 C ATOM 493 O GLN A 31 51.227 51.177 13.695 1.00 0.00 O ATOM 494 CB GLN A 31 50.616 47.904 13.825 1.00 0.00 C ATOM 495 CG GLN A 31 51.911 47.911 13.018 1.00 0.00 C ATOM 496 CD GLN A 31 52.036 46.708 12.080 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.051 46.130 11.629 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.251 46.293 11.733 1.00 0.00 N ATOM 0 H GLN A 31 48.892 48.089 15.524 1.00 0.00 H new ATOM 0 HA GLN A 31 51.405 49.280 15.262 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.585 47.013 14.452 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.766 47.845 13.145 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.963 48.829 12.432 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.759 47.921 13.702 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.076 46.766 12.102 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.358 45.502 11.098 1.00 0.00 H new ATOM 507 N ASP A 32 49.072 50.664 13.371 1.00 0.00 N ATOM 508 CA ASP A 32 48.720 51.852 12.620 1.00 0.00 C ATOM 509 C ASP A 32 48.889 53.160 13.396 1.00 0.00 C ATOM 510 O ASP A 32 49.094 54.206 12.783 1.00 0.00 O ATOM 511 CB ASP A 32 47.284 51.695 12.128 1.00 0.00 C ATOM 512 CG ASP A 32 46.828 52.836 11.216 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.136 52.806 10.005 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.122 53.752 11.690 1.00 0.00 O ATOM 0 H ASP A 32 48.285 50.028 13.500 1.00 0.00 H new ATOM 0 HA ASP A 32 49.417 51.933 11.786 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.193 50.751 11.591 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.617 51.638 12.988 1.00 0.00 H new ATOM 519 N LYS A 33 48.832 53.125 14.724 1.00 0.00 N ATOM 520 CA LYS A 33 48.932 54.290 15.579 1.00 0.00 C ATOM 521 C LYS A 33 50.313 54.483 16.209 1.00 0.00 C ATOM 522 O LYS A 33 50.770 55.619 16.320 1.00 0.00 O ATOM 523 CB LYS A 33 47.801 54.247 16.603 1.00 0.00 C ATOM 524 CG LYS A 33 47.501 55.626 17.184 1.00 0.00 C ATOM 525 CD LYS A 33 46.197 55.632 17.978 1.00 0.00 C ATOM 526 CE LYS A 33 45.813 57.064 18.345 1.00 0.00 C ATOM 527 NZ LYS A 33 44.452 57.121 18.899 1.00 0.00 N ATOM 0 H LYS A 33 48.711 52.256 15.245 1.00 0.00 H new ATOM 0 HA LYS A 33 48.816 55.179 14.959 1.00 0.00 H new ATOM 0 HB2 LYS A 33 46.902 53.848 16.133 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.068 53.564 17.410 1.00 0.00 H new ATOM 0 HG2 LYS A 33 48.322 55.935 17.831 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.439 56.356 16.377 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.402 55.173 17.390 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.310 55.034 18.882 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.522 57.459 19.073 1.00 0.00 H new ATOM 0 HE3 LYS A 33 45.876 57.699 17.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.390 57.897 19.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.771 57.285 18.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.231 56.221 19.371 1.00 0.00 H new ATOM 541 N GLU A 34 51.001 53.409 16.587 1.00 0.00 N ATOM 542 CA GLU A 34 52.193 53.419 17.409 1.00 0.00 C ATOM 543 C GLU A 34 53.378 52.643 16.831 1.00 0.00 C ATOM 544 O GLU A 34 54.480 52.724 17.370 1.00 0.00 O ATOM 545 CB GLU A 34 51.836 52.864 18.786 1.00 0.00 C ATOM 546 CG GLU A 34 50.771 53.635 19.559 1.00 0.00 C ATOM 547 CD GLU A 34 51.201 55.045 19.966 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.237 55.203 20.647 1.00 0.00 O ATOM 549 OE2 GLU A 34 50.485 56.028 19.674 1.00 0.00 O ATOM 0 H GLU A 34 50.724 52.467 16.312 1.00 0.00 H new ATOM 0 HA GLU A 34 52.527 54.455 17.461 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.496 51.835 18.665 1.00 0.00 H new ATOM 0 HB3 GLU A 34 52.743 52.831 19.390 1.00 0.00 H new ATOM 0 HG2 GLU A 34 49.870 53.702 18.949 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.508 53.073 20.455 1.00 0.00 H new ATOM 556 N GLY A 35 53.203 51.890 15.750 1.00 0.00 N ATOM 557 CA GLY A 35 54.285 51.258 15.021 1.00 0.00 C ATOM 558 C GLY A 35 54.816 49.933 15.570 1.00 0.00 C ATOM 559 O GLY A 35 55.843 49.453 15.094 1.00 0.00 O ATOM 0 H GLY A 35 52.283 51.701 15.352 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.950 51.090 13.997 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.116 51.961 14.973 1.00 0.00 H new ATOM 563 N ILE A 36 54.153 49.318 16.545 1.00 0.00 N ATOM 564 CA ILE A 36 54.589 48.092 17.185 1.00 0.00 C ATOM 565 C ILE A 36 54.131 46.881 16.371 1.00 0.00 C ATOM 566 O ILE A 36 52.930 46.779 16.127 1.00 0.00 O ATOM 567 CB ILE A 36 54.080 48.020 18.621 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.370 49.285 19.424 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.704 46.818 19.324 1.00 0.00 C ATOM 570 CD1 ILE A 36 53.697 49.346 20.792 1.00 0.00 C ATOM 0 H ILE A 36 53.273 49.673 16.919 1.00 0.00 H new ATOM 0 HA ILE A 36 55.678 48.085 17.222 1.00 0.00 H new ATOM 0 HB ILE A 36 52.996 47.917 18.568 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.448 49.372 19.561 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.053 50.149 18.840 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.340 46.767 20.350 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.430 45.905 18.796 1.00 0.00 H new ATOM 0 HG23 ILE A 36 55.789 46.922 19.329 1.00 0.00 H new ATOM 0 HD11 ILE A 36 53.962 50.280 21.287 1.00 0.00 H new ATOM 0 HD12 ILE A 36 52.615 49.295 20.668 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.032 48.506 21.400 1.00 0.00 H new ATOM 582 N PRO A 37 54.982 45.943 15.969 1.00 0.00 N ATOM 583 CA PRO A 37 54.568 44.811 15.163 1.00 0.00 C ATOM 584 C PRO A 37 53.602 43.856 15.867 1.00 0.00 C ATOM 585 O PRO A 37 53.865 43.466 17.003 1.00 0.00 O ATOM 586 CB PRO A 37 55.844 44.096 14.728 1.00 0.00 C ATOM 587 CG PRO A 37 56.898 45.198 14.798 1.00 0.00 C ATOM 588 CD PRO A 37 56.430 46.000 16.009 1.00 0.00 C ATOM 0 HA PRO A 37 53.996 45.175 14.310 1.00 0.00 H new ATOM 0 HB2 PRO A 37 56.086 43.264 15.390 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.754 43.687 13.722 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.902 44.796 14.937 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.919 45.802 13.891 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.815 45.574 16.936 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.785 47.030 15.960 1.00 0.00 H new ATOM 596 N PRO A 38 52.506 43.430 15.246 1.00 0.00 N ATOM 597 CA PRO A 38 51.465 42.648 15.882 1.00 0.00 C ATOM 598 C PRO A 38 51.858 41.231 16.306 1.00 0.00 C ATOM 599 O PRO A 38 51.192 40.671 17.174 1.00 0.00 O ATOM 600 CB PRO A 38 50.302 42.621 14.894 1.00 0.00 C ATOM 601 CG PRO A 38 50.973 42.814 13.537 1.00 0.00 C ATOM 602 CD PRO A 38 52.101 43.775 13.898 1.00 0.00 C ATOM 0 HA PRO A 38 51.215 43.122 16.831 1.00 0.00 H new ATOM 0 HB2 PRO A 38 49.759 41.677 14.941 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.583 43.413 15.101 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.347 41.876 13.126 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.293 43.237 12.798 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.935 43.676 13.203 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.763 44.810 13.845 1.00 0.00 H new ATOM 610 N ASP A 39 52.938 40.662 15.780 1.00 0.00 N ATOM 611 CA ASP A 39 53.479 39.400 16.243 1.00 0.00 C ATOM 612 C ASP A 39 54.201 39.540 17.584 1.00 0.00 C ATOM 613 O ASP A 39 54.227 38.603 18.379 1.00 0.00 O ATOM 614 CB ASP A 39 54.402 38.818 15.176 1.00 0.00 C ATOM 615 CG ASP A 39 54.803 37.373 15.475 1.00 0.00 C ATOM 616 OD1 ASP A 39 53.988 36.457 15.230 1.00 0.00 O ATOM 617 OD2 ASP A 39 55.941 37.137 15.935 1.00 0.00 O ATOM 0 H ASP A 39 53.465 41.074 15.010 1.00 0.00 H new ATOM 0 HA ASP A 39 52.649 38.714 16.410 1.00 0.00 H new ATOM 0 HB2 ASP A 39 53.905 38.861 14.207 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.299 39.433 15.101 1.00 0.00 H new ATOM 622 N GLN A 40 54.748 40.718 17.870 1.00 0.00 N ATOM 623 CA GLN A 40 55.396 41.043 19.125 1.00 0.00 C ATOM 624 C GLN A 40 54.384 41.453 20.196 1.00 0.00 C ATOM 625 O GLN A 40 54.560 41.111 21.363 1.00 0.00 O ATOM 626 CB GLN A 40 56.427 42.151 18.929 1.00 0.00 C ATOM 627 CG GLN A 40 57.528 41.782 17.939 1.00 0.00 C ATOM 628 CD GLN A 40 58.522 42.925 17.732 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.750 43.772 18.593 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.152 42.996 16.563 1.00 0.00 N ATOM 0 H GLN A 40 54.749 41.495 17.209 1.00 0.00 H new ATOM 0 HA GLN A 40 55.903 40.142 19.469 1.00 0.00 H new ATOM 0 HB2 GLN A 40 55.921 43.051 18.580 1.00 0.00 H new ATOM 0 HB3 GLN A 40 56.879 42.392 19.891 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.059 40.901 18.300 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.080 41.514 16.982 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.970 42.298 15.842 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.818 43.749 16.387 1.00 0.00 H new ATOM 639 N GLN A 41 53.332 42.175 19.820 1.00 0.00 N ATOM 640 CA GLN A 41 52.295 42.617 20.731 1.00 0.00 C ATOM 641 C GLN A 41 51.539 41.456 21.379 1.00 0.00 C ATOM 642 O GLN A 41 51.176 40.498 20.701 1.00 0.00 O ATOM 643 CB GLN A 41 51.278 43.472 19.982 1.00 0.00 C ATOM 644 CG GLN A 41 51.741 44.842 19.494 1.00 0.00 C ATOM 645 CD GLN A 41 50.558 45.563 18.844 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.468 45.653 19.404 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.680 46.053 17.614 1.00 0.00 N ATOM 0 H GLN A 41 53.179 42.471 18.856 1.00 0.00 H new ATOM 0 HA GLN A 41 52.797 43.184 21.515 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.932 42.905 19.118 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.416 43.619 20.633 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.128 45.428 20.328 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.555 44.732 18.777 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.574 45.991 17.127 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.880 46.491 17.158 1.00 0.00 H new ATOM 656 N ARG A 42 51.213 41.578 22.663 1.00 0.00 N ATOM 657 CA ARG A 42 50.192 40.807 23.345 1.00 0.00 C ATOM 658 C ARG A 42 49.333 41.695 24.247 1.00 0.00 C ATOM 659 O ARG A 42 49.870 42.562 24.934 1.00 0.00 O ATOM 660 CB ARG A 42 50.810 39.677 24.165 1.00 0.00 C ATOM 661 CG ARG A 42 51.415 38.546 23.339 1.00 0.00 C ATOM 662 CD ARG A 42 50.364 37.839 22.487 1.00 0.00 C ATOM 663 NE ARG A 42 50.915 36.685 21.778 1.00 0.00 N ATOM 664 CZ ARG A 42 51.571 36.710 20.611 1.00 0.00 C ATOM 665 NH1 ARG A 42 51.854 37.836 19.940 1.00 0.00 N ATOM 666 NH2 ARG A 42 51.990 35.556 20.074 1.00 0.00 N ATOM 0 H ARG A 42 51.676 42.247 23.278 1.00 0.00 H new ATOM 0 HA ARG A 42 49.552 40.372 22.578 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.586 40.095 24.807 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.044 39.261 24.820 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.197 38.946 22.693 1.00 0.00 H new ATOM 0 HG3 ARG A 42 51.889 37.824 24.004 1.00 0.00 H new ATOM 0 HD2 ARG A 42 49.541 37.514 23.124 1.00 0.00 H new ATOM 0 HD3 ARG A 42 49.950 38.543 21.765 1.00 0.00 H new ATOM 0 HE ARG A 42 50.787 35.772 22.215 1.00 0.00 H new ATOM 0 HH11 ARG A 42 51.566 38.740 20.315 1.00 0.00 H new ATOM 0 HH12 ARG A 42 52.358 37.789 19.054 1.00 0.00 H new ATOM 0 HH21 ARG A 42 51.808 34.674 20.554 1.00 0.00 H new ATOM 0 HH22 ARG A 42 52.491 35.559 19.186 1.00 0.00 H new ATOM 680 N LEU A 43 48.025 41.464 24.253 1.00 0.00 N ATOM 681 CA LEU A 43 47.075 42.184 25.079 1.00 0.00 C ATOM 682 C LEU A 43 46.716 41.396 26.339 1.00 0.00 C ATOM 683 O LEU A 43 46.487 40.189 26.296 1.00 0.00 O ATOM 684 CB LEU A 43 45.825 42.556 24.286 1.00 0.00 C ATOM 685 CG LEU A 43 45.901 43.728 23.312 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.317 45.038 23.976 1.00 0.00 C ATOM 687 CD2 LEU A 43 46.824 43.477 22.123 1.00 0.00 C ATOM 0 H LEU A 43 47.589 40.752 23.667 1.00 0.00 H new ATOM 0 HA LEU A 43 47.555 43.109 25.398 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.517 41.676 23.722 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.031 42.771 25.001 1.00 0.00 H new ATOM 0 HG LEU A 43 44.878 43.820 22.948 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.351 45.830 23.228 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.594 45.300 24.749 1.00 0.00 H new ATOM 0 HD13 LEU A 43 47.303 44.921 24.426 1.00 0.00 H new ATOM 0 HD21 LEU A 43 46.828 44.353 21.474 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.836 43.287 22.482 1.00 0.00 H new ATOM 0 HD23 LEU A 43 46.469 42.612 21.563 1.00 0.00 H new ATOM 699 N ILE A 44 46.635 42.105 27.462 1.00 0.00 N ATOM 700 CA ILE A 44 46.344 41.599 28.788 1.00 0.00 C ATOM 701 C ILE A 44 45.144 42.349 29.371 1.00 0.00 C ATOM 702 O ILE A 44 45.042 43.566 29.235 1.00 0.00 O ATOM 703 CB ILE A 44 47.556 41.703 29.710 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.920 41.403 29.096 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.350 40.836 30.949 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.163 39.980 28.601 1.00 0.00 C ATOM 0 H ILE A 44 46.782 43.114 27.463 1.00 0.00 H new ATOM 0 HA ILE A 44 46.098 40.540 28.707 1.00 0.00 H new ATOM 0 HB ILE A 44 47.600 42.764 29.958 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.070 42.083 28.257 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.684 41.638 29.837 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.221 40.918 31.599 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.463 41.173 31.486 1.00 0.00 H new ATOM 0 HG23 ILE A 44 47.219 39.797 30.648 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.169 39.905 28.189 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.058 39.283 29.432 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.435 39.735 27.828 1.00 0.00 H new ATOM 718 N PHE A 45 44.235 41.639 30.033 1.00 0.00 N ATOM 719 CA PHE A 45 43.091 42.205 30.720 1.00 0.00 C ATOM 720 C PHE A 45 42.855 41.487 32.050 1.00 0.00 C ATOM 721 O PHE A 45 42.644 40.276 32.062 1.00 0.00 O ATOM 722 CB PHE A 45 41.873 42.105 29.806 1.00 0.00 C ATOM 723 CG PHE A 45 40.645 42.860 30.254 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.688 44.253 30.384 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.437 42.185 30.467 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.534 44.970 30.720 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.280 42.901 30.795 1.00 0.00 C ATOM 728 CZ PHE A 45 38.324 44.295 30.918 1.00 0.00 C ATOM 0 H PHE A 45 44.281 40.623 30.105 1.00 0.00 H new ATOM 0 HA PHE A 45 43.276 43.254 30.951 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.156 42.465 28.817 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.609 41.053 29.699 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.618 44.778 30.224 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.398 41.109 30.378 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.577 46.044 30.826 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.350 42.376 30.954 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.429 44.847 31.164 1.00 0.00 H new ATOM 738 N ALA A 46 42.921 42.205 33.167 1.00 0.00 N ATOM 739 CA ALA A 46 42.921 41.660 34.509 1.00 0.00 C ATOM 740 C ALA A 46 43.846 40.453 34.676 1.00 0.00 C ATOM 741 O ALA A 46 43.447 39.384 35.134 1.00 0.00 O ATOM 742 CB ALA A 46 41.479 41.438 34.959 1.00 0.00 C ATOM 0 H ALA A 46 42.978 43.223 33.155 1.00 0.00 H new ATOM 0 HA ALA A 46 43.364 42.387 35.190 1.00 0.00 H new ATOM 0 HB1 ALA A 46 41.472 41.028 35.969 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.945 42.388 34.950 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.989 40.740 34.280 1.00 0.00 H new ATOM 748 N GLY A 47 45.079 40.587 34.198 1.00 0.00 N ATOM 749 CA GLY A 47 46.106 39.565 34.228 1.00 0.00 C ATOM 750 C GLY A 47 45.951 38.425 33.219 1.00 0.00 C ATOM 751 O GLY A 47 46.899 37.660 33.051 1.00 0.00 O ATOM 0 H GLY A 47 45.398 41.451 33.761 1.00 0.00 H new ATOM 0 HA2 GLY A 47 47.071 40.043 34.060 1.00 0.00 H new ATOM 0 HA3 GLY A 47 46.133 39.135 35.229 1.00 0.00 H new ATOM 755 N LYS A 48 44.825 38.303 32.523 1.00 0.00 N ATOM 756 CA LYS A 48 44.563 37.271 31.540 1.00 0.00 C ATOM 757 C LYS A 48 45.136 37.677 30.181 1.00 0.00 C ATOM 758 O LYS A 48 44.783 38.739 29.672 1.00 0.00 O ATOM 759 CB LYS A 48 43.058 37.033 31.474 1.00 0.00 C ATOM 760 CG LYS A 48 42.655 35.799 30.672 1.00 0.00 C ATOM 761 CD LYS A 48 41.147 35.581 30.741 1.00 0.00 C ATOM 762 CE LYS A 48 40.742 34.358 29.923 1.00 0.00 C ATOM 763 NZ LYS A 48 39.289 34.130 29.941 1.00 0.00 N ATOM 0 H LYS A 48 44.043 38.948 32.637 1.00 0.00 H new ATOM 0 HA LYS A 48 45.052 36.340 31.827 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.672 36.935 32.489 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.582 37.910 31.035 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.963 35.917 29.633 1.00 0.00 H new ATOM 0 HG3 LYS A 48 43.173 34.922 31.060 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.841 35.449 31.779 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.629 36.464 30.366 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.075 34.486 28.893 1.00 0.00 H new ATOM 0 HE3 LYS A 48 41.251 33.477 30.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.062 33.289 29.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.973 33.981 30.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.803 34.959 29.543 1.00 0.00 H new ATOM 777 N GLN A 49 45.987 36.853 29.576 1.00 0.00 N ATOM 778 CA GLN A 49 46.493 37.088 28.238 1.00 0.00 C ATOM 779 C GLN A 49 45.448 36.717 27.186 1.00 0.00 C ATOM 780 O GLN A 49 45.024 35.565 27.108 1.00 0.00 O ATOM 781 CB GLN A 49 47.824 36.369 28.030 1.00 0.00 C ATOM 782 CG GLN A 49 48.342 36.529 26.605 1.00 0.00 C ATOM 783 CD GLN A 49 49.742 35.957 26.372 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.587 35.887 27.260 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.053 35.572 25.137 1.00 0.00 N ATOM 0 H GLN A 49 46.344 36.000 30.007 1.00 0.00 H new ATOM 0 HA GLN A 49 46.689 38.154 28.118 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.561 36.761 28.730 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.703 35.309 28.255 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.646 36.042 25.922 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.349 37.589 26.351 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.356 35.628 24.395 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.989 35.221 24.933 1.00 0.00 H new ATOM 794 N LEU A 50 45.066 37.672 26.343 1.00 0.00 N ATOM 795 CA LEU A 50 44.064 37.511 25.309 1.00 0.00 C ATOM 796 C LEU A 50 44.577 36.638 24.162 1.00 0.00 C ATOM 797 O LEU A 50 45.674 36.853 23.652 1.00 0.00 O ATOM 798 CB LEU A 50 43.624 38.872 24.778 1.00 0.00 C ATOM 799 CG LEU A 50 42.537 39.576 25.584 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.911 39.880 27.031 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.179 40.901 24.916 1.00 0.00 C ATOM 0 H LEU A 50 45.464 38.611 26.367 1.00 0.00 H new ATOM 0 HA LEU A 50 43.206 37.008 25.755 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.497 39.523 24.733 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.268 38.745 23.756 1.00 0.00 H new ATOM 0 HG LEU A 50 41.702 38.876 25.604 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.078 40.380 27.525 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.136 38.949 27.552 1.00 0.00 H new ATOM 0 HD13 LEU A 50 43.787 40.528 27.052 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.402 41.402 25.494 1.00 0.00 H new ATOM 0 HD22 LEU A 50 43.064 41.536 24.870 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.815 40.713 23.906 1.00 0.00 H new ATOM 813 N GLU A 51 43.756 35.692 23.714 1.00 0.00 N ATOM 814 CA GLU A 51 44.027 34.875 22.549 1.00 0.00 C ATOM 815 C GLU A 51 43.798 35.659 21.255 1.00 0.00 C ATOM 816 O GLU A 51 42.752 36.270 21.050 1.00 0.00 O ATOM 817 CB GLU A 51 43.190 33.599 22.550 1.00 0.00 C ATOM 818 CG GLU A 51 43.620 32.613 23.632 1.00 0.00 C ATOM 819 CD GLU A 51 42.901 31.264 23.548 1.00 0.00 C ATOM 820 OE1 GLU A 51 42.799 30.584 24.591 1.00 0.00 O ATOM 821 OE2 GLU A 51 42.489 30.836 22.448 1.00 0.00 O ATOM 0 H GLU A 51 42.867 35.473 24.164 1.00 0.00 H new ATOM 0 HA GLU A 51 45.078 34.590 22.597 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.141 33.858 22.696 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.267 33.118 21.575 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.695 32.448 23.556 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.433 33.055 24.611 1.00 0.00 H new ATOM 828 N ASP A 52 44.767 35.602 20.347 1.00 0.00 N ATOM 829 CA ASP A 52 44.829 36.491 19.204 1.00 0.00 C ATOM 830 C ASP A 52 43.819 36.156 18.104 1.00 0.00 C ATOM 831 O ASP A 52 43.590 36.967 17.211 1.00 0.00 O ATOM 832 CB ASP A 52 46.264 36.569 18.690 1.00 0.00 C ATOM 833 CG ASP A 52 47.255 36.933 19.798 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.538 38.135 19.990 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.762 36.010 20.471 1.00 0.00 O ATOM 0 H ASP A 52 45.534 34.931 20.389 1.00 0.00 H new ATOM 0 HA ASP A 52 44.528 37.482 19.543 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.545 35.610 18.254 1.00 0.00 H new ATOM 0 HB3 ASP A 52 46.323 37.311 17.894 1.00 0.00 H new ATOM 840 N GLY A 53 43.167 34.999 18.177 1.00 0.00 N ATOM 841 CA GLY A 53 42.108 34.562 17.290 1.00 0.00 C ATOM 842 C GLY A 53 40.679 34.833 17.766 1.00 0.00 C ATOM 843 O GLY A 53 39.748 34.375 17.109 1.00 0.00 O ATOM 0 H GLY A 53 43.379 34.309 18.897 1.00 0.00 H new ATOM 0 HA2 GLY A 53 42.246 35.048 16.324 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.218 33.490 17.126 1.00 0.00 H new ATOM 847 N ARG A 54 40.484 35.515 18.892 1.00 0.00 N ATOM 848 CA ARG A 54 39.200 35.806 19.494 1.00 0.00 C ATOM 849 C ARG A 54 38.777 37.264 19.308 1.00 0.00 C ATOM 850 O ARG A 54 39.419 38.000 18.561 1.00 0.00 O ATOM 851 CB ARG A 54 39.198 35.336 20.947 1.00 0.00 C ATOM 852 CG ARG A 54 39.481 33.840 21.052 1.00 0.00 C ATOM 853 CD ARG A 54 39.215 33.248 22.433 1.00 0.00 C ATOM 854 NE ARG A 54 37.787 33.075 22.704 1.00 0.00 N ATOM 855 CZ ARG A 54 36.976 32.104 22.262 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.391 31.152 21.415 1.00 0.00 N ATOM 857 NH2 ARG A 54 35.699 32.055 22.665 1.00 0.00 N ATOM 0 H ARG A 54 41.262 35.896 19.431 1.00 0.00 H new ATOM 0 HA ARG A 54 38.428 35.243 18.969 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.949 35.890 21.511 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.232 35.557 21.401 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.869 33.314 20.320 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.522 33.659 20.786 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.716 32.283 22.514 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.649 33.898 23.193 1.00 0.00 H new ATOM 0 HE ARG A 54 37.356 33.780 23.303 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.356 31.150 21.083 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.742 30.430 21.102 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.341 32.759 23.311 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.085 31.314 22.326 1.00 0.00 H new ATOM 871 N THR A 55 37.694 37.686 19.954 1.00 0.00 N ATOM 872 CA THR A 55 37.124 39.017 19.893 1.00 0.00 C ATOM 873 C THR A 55 36.969 39.667 21.270 1.00 0.00 C ATOM 874 O THR A 55 36.941 38.984 22.290 1.00 0.00 O ATOM 875 CB THR A 55 35.769 39.035 19.191 1.00 0.00 C ATOM 876 OG1 THR A 55 34.878 38.126 19.798 1.00 0.00 O ATOM 877 CG2 THR A 55 35.838 38.667 17.712 1.00 0.00 C ATOM 0 H THR A 55 37.164 37.068 20.568 1.00 0.00 H new ATOM 0 HA THR A 55 37.841 39.597 19.313 1.00 0.00 H new ATOM 0 HB THR A 55 35.423 40.065 19.282 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.015 38.154 19.334 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.837 38.702 17.281 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.482 39.375 17.191 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.244 37.661 17.606 1.00 0.00 H new ATOM 885 N LEU A 56 36.857 40.992 21.304 1.00 0.00 N ATOM 886 CA LEU A 56 36.773 41.773 22.522 1.00 0.00 C ATOM 887 C LEU A 56 35.616 41.382 23.443 1.00 0.00 C ATOM 888 O LEU A 56 35.787 41.339 24.659 1.00 0.00 O ATOM 889 CB LEU A 56 36.679 43.251 22.156 1.00 0.00 C ATOM 890 CG LEU A 56 37.922 43.867 21.521 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.655 45.339 21.217 1.00 0.00 C ATOM 892 CD2 LEU A 56 39.149 43.818 22.426 1.00 0.00 C ATOM 0 H LEU A 56 36.822 41.562 20.459 1.00 0.00 H new ATOM 0 HA LEU A 56 37.679 41.565 23.092 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.843 43.382 21.469 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.441 43.813 23.059 1.00 0.00 H new ATOM 0 HG LEU A 56 38.127 43.282 20.624 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.541 45.783 20.763 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.814 45.422 20.528 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.419 45.865 22.142 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.997 44.272 21.914 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.945 44.366 23.346 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.383 42.781 22.666 1.00 0.00 H new ATOM 904 N SER A 57 34.444 41.060 22.902 1.00 0.00 N ATOM 905 CA SER A 57 33.282 40.684 23.681 1.00 0.00 C ATOM 906 C SER A 57 33.447 39.371 24.451 1.00 0.00 C ATOM 907 O SER A 57 32.870 39.241 25.529 1.00 0.00 O ATOM 908 CB SER A 57 32.040 40.625 22.796 1.00 0.00 C ATOM 909 OG SER A 57 32.190 39.658 21.781 1.00 0.00 O ATOM 0 H SER A 57 34.279 41.055 21.895 1.00 0.00 H new ATOM 0 HA SER A 57 33.164 41.464 24.434 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.167 40.388 23.404 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.861 41.603 22.349 1.00 0.00 H new ATOM 0 HG SER A 57 31.382 39.637 21.227 1.00 0.00 H new ATOM 915 N ASP A 58 34.280 38.438 23.999 1.00 0.00 N ATOM 916 CA ASP A 58 34.604 37.223 24.720 1.00 0.00 C ATOM 917 C ASP A 58 35.316 37.498 26.046 1.00 0.00 C ATOM 918 O ASP A 58 35.218 36.720 26.992 1.00 0.00 O ATOM 919 CB ASP A 58 35.454 36.326 23.825 1.00 0.00 C ATOM 920 CG ASP A 58 35.562 34.899 24.366 1.00 0.00 C ATOM 921 OD1 ASP A 58 36.645 34.489 24.840 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.596 34.123 24.204 1.00 0.00 O ATOM 0 H ASP A 58 34.756 38.513 23.100 1.00 0.00 H new ATOM 0 HA ASP A 58 33.671 36.721 24.974 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.022 36.301 22.825 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.453 36.753 23.730 1.00 0.00 H new ATOM 927 N TYR A 59 35.980 38.646 26.157 1.00 0.00 N ATOM 928 CA TYR A 59 36.628 39.143 27.353 1.00 0.00 C ATOM 929 C TYR A 59 35.793 40.216 28.056 1.00 0.00 C ATOM 930 O TYR A 59 36.282 40.889 28.961 1.00 0.00 O ATOM 931 CB TYR A 59 38.045 39.584 27.004 1.00 0.00 C ATOM 932 CG TYR A 59 38.930 38.451 26.544 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.745 37.784 27.466 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.919 38.048 25.203 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.531 36.700 27.055 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.687 36.954 24.788 1.00 0.00 C ATOM 937 CZ TYR A 59 40.489 36.261 25.716 1.00 0.00 C ATOM 938 OH TYR A 59 41.234 35.191 25.316 1.00 0.00 O ATOM 0 H TYR A 59 36.082 39.284 25.368 1.00 0.00 H new ATOM 0 HA TYR A 59 36.707 38.343 28.089 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.999 40.340 26.221 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.496 40.056 27.877 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.768 38.106 28.497 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.315 38.584 24.486 1.00 0.00 H new ATOM 0 HE1 TYR A 59 41.171 36.199 27.766 1.00 0.00 H new ATOM 0 HE2 TYR A 59 39.665 36.641 23.755 1.00 0.00 H new ATOM 0 HH TYR A 59 40.642 34.434 25.122 1.00 0.00 H new ATOM 948 N ASN A 60 34.526 40.388 27.691 1.00 0.00 N ATOM 949 CA ASN A 60 33.611 41.371 28.235 1.00 0.00 C ATOM 950 C ASN A 60 34.122 42.811 28.172 1.00 0.00 C ATOM 951 O ASN A 60 33.793 43.634 29.023 1.00 0.00 O ATOM 952 CB ASN A 60 33.145 40.923 29.619 1.00 0.00 C ATOM 953 CG ASN A 60 31.845 41.586 30.078 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.869 41.675 29.336 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.770 42.017 31.334 1.00 0.00 N ATOM 0 H ASN A 60 34.093 39.812 26.969 1.00 0.00 H new ATOM 0 HA ASN A 60 32.736 41.411 27.587 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.008 39.842 29.613 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.929 41.141 30.344 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.902 42.422 31.683 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.581 41.942 31.948 1.00 0.00 H new ATOM 962 N ILE A 61 34.936 43.134 27.170 1.00 0.00 N ATOM 963 CA ILE A 61 35.491 44.456 26.963 1.00 0.00 C ATOM 964 C ILE A 61 34.411 45.353 26.354 1.00 0.00 C ATOM 965 O ILE A 61 33.676 44.942 25.459 1.00 0.00 O ATOM 966 CB ILE A 61 36.780 44.369 26.152 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.862 43.663 26.964 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.272 45.739 25.690 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.068 43.215 26.144 1.00 0.00 C ATOM 0 H ILE A 61 35.232 42.460 26.464 1.00 0.00 H new ATOM 0 HA ILE A 61 35.784 44.916 27.907 1.00 0.00 H new ATOM 0 HB ILE A 61 36.561 43.790 25.255 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.202 44.332 27.754 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.424 42.792 27.451 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.192 45.621 25.117 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.512 46.206 25.064 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.464 46.369 26.559 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.789 42.723 26.797 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.744 42.519 25.371 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.534 44.083 25.678 1.00 0.00 H new ATOM 981 N GLN A 62 34.287 46.566 26.883 1.00 0.00 N ATOM 982 CA GLN A 62 33.185 47.487 26.682 1.00 0.00 C ATOM 983 C GLN A 62 33.712 48.908 26.479 1.00 0.00 C ATOM 984 O GLN A 62 34.917 49.141 26.549 1.00 0.00 O ATOM 985 CB GLN A 62 32.282 47.386 27.909 1.00 0.00 C ATOM 986 CG GLN A 62 31.512 46.072 27.997 1.00 0.00 C ATOM 987 CD GLN A 62 30.972 45.823 29.407 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.827 46.123 29.736 1.00 0.00 O ATOM 989 NE2 GLN A 62 31.775 45.236 30.290 1.00 0.00 N ATOM 0 H GLN A 62 35.001 46.952 27.501 1.00 0.00 H new ATOM 0 HA GLN A 62 32.617 47.235 25.786 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.889 47.502 28.807 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.572 48.213 27.896 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.684 46.088 27.288 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.164 45.248 27.707 1.00 0.00 H new ATOM 0 HE21 GLN A 62 32.727 44.984 30.025 1.00 0.00 H new ATOM 0 HE22 GLN A 62 31.439 45.038 31.232 1.00 0.00 H new ATOM 998 N LYS A 63 32.841 49.884 26.237 1.00 0.00 N ATOM 999 CA LYS A 63 33.246 51.263 26.055 1.00 0.00 C ATOM 1000 C LYS A 63 34.034 51.786 27.257 1.00 0.00 C ATOM 1001 O LYS A 63 33.627 51.610 28.403 1.00 0.00 O ATOM 1002 CB LYS A 63 32.060 52.148 25.685 1.00 0.00 C ATOM 1003 CG LYS A 63 31.117 52.460 26.843 1.00 0.00 C ATOM 1004 CD LYS A 63 30.003 53.434 26.466 1.00 0.00 C ATOM 1005 CE LYS A 63 29.155 53.812 27.677 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.931 54.499 28.722 1.00 0.00 N ATOM 0 H LYS A 63 31.835 49.734 26.163 1.00 0.00 H new ATOM 0 HA LYS A 63 33.932 51.301 25.209 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.436 53.086 25.277 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.493 51.660 24.892 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.673 51.531 27.202 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.692 52.878 27.669 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.437 54.334 26.030 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.368 52.984 25.703 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.337 54.456 27.355 1.00 0.00 H new ATOM 0 HE3 LYS A 63 28.706 52.912 28.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.281 54.968 29.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.510 53.805 29.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 30.551 55.210 28.283 1.00 0.00 H new ATOM 1020 N GLU A 64 35.180 52.415 27.012 1.00 0.00 N ATOM 1021 CA GLU A 64 36.110 52.922 28.000 1.00 0.00 C ATOM 1022 C GLU A 64 36.639 51.875 28.982 1.00 0.00 C ATOM 1023 O GLU A 64 37.102 52.217 30.068 1.00 0.00 O ATOM 1024 CB GLU A 64 35.567 54.188 28.654 1.00 0.00 C ATOM 1025 CG GLU A 64 35.294 55.312 27.658 1.00 0.00 C ATOM 1026 CD GLU A 64 34.686 56.560 28.300 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.774 56.763 29.530 1.00 0.00 O ATOM 1028 OE2 GLU A 64 34.099 57.371 27.549 1.00 0.00 O ATOM 0 H GLU A 64 35.497 52.592 26.059 1.00 0.00 H new ATOM 0 HA GLU A 64 37.014 53.205 27.461 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.645 53.949 29.183 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.280 54.538 29.400 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.227 55.584 27.165 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.619 54.946 26.884 1.00 0.00 H new ATOM 1035 N SER A 65 36.636 50.598 28.607 1.00 0.00 N ATOM 1036 CA SER A 65 37.479 49.586 29.210 1.00 0.00 C ATOM 1037 C SER A 65 38.955 49.841 28.898 1.00 0.00 C ATOM 1038 O SER A 65 39.288 50.371 27.841 1.00 0.00 O ATOM 1039 CB SER A 65 37.104 48.191 28.717 1.00 0.00 C ATOM 1040 OG SER A 65 35.854 47.775 29.219 1.00 0.00 O ATOM 0 H SER A 65 36.037 50.239 27.864 1.00 0.00 H new ATOM 0 HA SER A 65 37.322 49.642 30.287 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.078 48.186 27.627 1.00 0.00 H new ATOM 0 HB3 SER A 65 37.872 47.480 29.021 1.00 0.00 H new ATOM 0 HG SER A 65 35.846 46.799 29.308 1.00 0.00 H new ATOM 1046 N THR A 66 39.845 49.433 29.800 1.00 0.00 N ATOM 1047 CA THR A 66 41.279 49.592 29.674 1.00 0.00 C ATOM 1048 C THR A 66 41.960 48.226 29.585 1.00 0.00 C ATOM 1049 O THR A 66 41.822 47.404 30.489 1.00 0.00 O ATOM 1050 CB THR A 66 41.864 50.388 30.838 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.253 51.655 30.928 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.359 50.647 30.683 1.00 0.00 C ATOM 0 H THR A 66 39.571 48.968 30.665 1.00 0.00 H new ATOM 0 HA THR A 66 41.466 50.150 28.757 1.00 0.00 H new ATOM 0 HB THR A 66 41.683 49.781 31.725 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.638 52.151 31.680 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.720 51.217 31.539 1.00 0.00 H new ATOM 0 HG22 THR A 66 43.889 49.696 30.630 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.537 51.214 29.769 1.00 0.00 H new ATOM 1060 N LEU A 67 42.726 48.006 28.520 1.00 0.00 N ATOM 1061 CA LEU A 67 43.611 46.872 28.342 1.00 0.00 C ATOM 1062 C LEU A 67 45.040 47.279 28.703 1.00 0.00 C ATOM 1063 O LEU A 67 45.377 48.461 28.717 1.00 0.00 O ATOM 1064 CB LEU A 67 43.547 46.362 26.906 1.00 0.00 C ATOM 1065 CG LEU A 67 42.230 45.783 26.395 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.110 46.806 26.232 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.475 45.172 25.019 1.00 0.00 C ATOM 0 H LEU A 67 42.743 48.645 27.725 1.00 0.00 H new ATOM 0 HA LEU A 67 43.292 46.064 29.001 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.823 47.187 26.249 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.312 45.594 26.793 1.00 0.00 H new ATOM 0 HG LEU A 67 41.908 45.061 27.145 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.213 46.308 25.865 1.00 0.00 H new ATOM 0 HD12 LEU A 67 40.899 47.271 27.195 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.417 47.571 25.519 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.545 44.752 24.636 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.833 45.943 24.337 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.223 44.383 25.099 1.00 0.00 H new ATOM 1079 N HIS A 68 45.918 46.302 28.917 1.00 0.00 N ATOM 1080 CA HIS A 68 47.352 46.500 28.990 1.00 0.00 C ATOM 1081 C HIS A 68 48.033 45.802 27.811 1.00 0.00 C ATOM 1082 O HIS A 68 47.545 44.783 27.327 1.00 0.00 O ATOM 1083 CB HIS A 68 47.875 46.047 30.350 1.00 0.00 C ATOM 1084 CG HIS A 68 47.354 46.887 31.484 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.057 47.905 32.127 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.112 46.789 32.054 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.242 48.383 33.071 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.064 47.739 33.055 1.00 0.00 N ATOM 0 H HIS A 68 45.639 45.330 29.047 1.00 0.00 H new ATOM 0 HA HIS A 68 47.592 47.560 28.906 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.593 45.007 30.515 1.00 0.00 H new ATOM 0 HB3 HIS A 68 48.964 46.085 30.346 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.325 46.104 31.775 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.496 49.180 33.755 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.273 47.920 33.673 1.00 0.00 H new ATOM 1096 N LEU A 69 49.140 46.356 27.326 1.00 0.00 N ATOM 1097 CA LEU A 69 49.861 45.906 26.152 1.00 0.00 C ATOM 1098 C LEU A 69 51.324 45.643 26.516 1.00 0.00 C ATOM 1099 O LEU A 69 51.992 46.517 27.063 1.00 0.00 O ATOM 1100 CB LEU A 69 49.728 46.987 25.083 1.00 0.00 C ATOM 1101 CG LEU A 69 50.583 46.796 23.834 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.138 45.588 23.014 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.488 48.036 22.949 1.00 0.00 C ATOM 0 H LEU A 69 49.574 47.168 27.765 1.00 0.00 H new ATOM 0 HA LEU A 69 49.451 44.971 25.769 1.00 0.00 H new ATOM 0 HB2 LEU A 69 48.683 47.044 24.779 1.00 0.00 H new ATOM 0 HB3 LEU A 69 49.983 47.947 25.531 1.00 0.00 H new ATOM 0 HG LEU A 69 51.607 46.632 24.168 1.00 0.00 H new ATOM 0 HD11 LEU A 69 50.775 45.491 22.135 1.00 0.00 H new ATOM 0 HD12 LEU A 69 50.218 44.686 23.621 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.103 45.723 22.700 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.100 47.895 22.058 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.450 48.194 22.655 1.00 0.00 H new ATOM 0 HD23 LEU A 69 50.845 48.905 23.501 1.00 0.00 H new ATOM 1115 N VAL A 70 51.833 44.473 26.139 1.00 0.00 N ATOM 1116 CA VAL A 70 53.228 44.109 26.283 1.00 0.00 C ATOM 1117 C VAL A 70 53.835 43.624 24.965 1.00 0.00 C ATOM 1118 O VAL A 70 53.147 43.082 24.104 1.00 0.00 O ATOM 1119 CB VAL A 70 53.459 43.096 27.401 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.122 43.693 28.765 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.690 41.792 27.215 1.00 0.00 C ATOM 0 H VAL A 70 51.267 43.738 25.715 1.00 0.00 H new ATOM 0 HA VAL A 70 53.748 45.023 26.569 1.00 0.00 H new ATOM 0 HB VAL A 70 54.521 42.854 27.354 1.00 0.00 H new ATOM 0 HG11 VAL A 70 53.296 42.948 29.541 1.00 0.00 H new ATOM 0 HG12 VAL A 70 53.754 44.562 28.948 1.00 0.00 H new ATOM 0 HG13 VAL A 70 52.075 43.996 28.781 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.904 41.122 28.048 1.00 0.00 H new ATOM 0 HG22 VAL A 70 51.621 42.002 27.183 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.995 41.320 26.281 1.00 0.00 H new