USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=11 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 25 ASN : amide:sc= 0.847 K(o=1.3,f=-3.1) USER MOD Set 1.2: A 29 LYS NZ :NH3+ 180:sc= 0.486 (180deg=0.673) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 2.39 (180deg=2.39) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -95:sc= 0.256 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.011 USER MOD Single : A 27 LYS NZ :NH3+ 136:sc= 1.09 (180deg=-0.167!) USER MOD Single : A 31 GLN : amide:sc=-0.00441 X(o=-0.0044,f=-0.28) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 41 GLN : amide:sc= 0.682 K(o=0.68,f=-0.23) 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=-0.14) USER MOD Single : A 55 THR OG1 : rot -74:sc= 1.28 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -170:sc= 0.0771 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 62 GLN : amide:sc= -0.0875 K(o=-0.087,f=-2.6!) USER MOD Single : A 63 LYS NZ :NH3+ -153:sc= 0.139 (180deg=-0.646) USER MOD Single : A 65 SER OG : rot 61:sc= 1.74 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc=-0.000483 X(o=-0.00048,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.221 51.520 20.927 1.00 0.00 N ATOM 2 CA MET A 1 32.748 51.782 22.275 1.00 0.00 C ATOM 3 C MET A 1 34.204 52.246 22.217 1.00 0.00 C ATOM 4 O MET A 1 34.952 51.785 21.358 1.00 0.00 O ATOM 5 CB MET A 1 32.611 50.579 23.205 1.00 0.00 C ATOM 6 CG MET A 1 33.369 49.329 22.765 1.00 0.00 C ATOM 7 SD MET A 1 33.193 47.946 23.920 1.00 0.00 S ATOM 8 CE MET A 1 34.167 46.700 23.040 1.00 0.00 C ATOM 0 H1 MET A 1 31.232 51.207 20.996 1.00 0.00 H new ATOM 0 H2 MET A 1 32.270 52.390 20.360 1.00 0.00 H new ATOM 0 H3 MET A 1 32.788 50.777 20.471 1.00 0.00 H new ATOM 0 HA MET A 1 32.138 52.583 22.693 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.959 50.865 24.197 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.554 50.330 23.298 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.011 49.022 21.783 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.426 49.572 22.657 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.170 45.771 23.610 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.728 46.522 22.058 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.190 47.056 22.921 1.00 0.00 H new ATOM 20 N GLN A 2 34.624 53.085 23.159 1.00 0.00 N ATOM 21 CA GLN A 2 36.008 53.486 23.313 1.00 0.00 C ATOM 22 C GLN A 2 36.765 52.530 24.237 1.00 0.00 C ATOM 23 O GLN A 2 36.268 52.176 25.304 1.00 0.00 O ATOM 24 CB GLN A 2 36.110 54.914 23.839 1.00 0.00 C ATOM 25 CG GLN A 2 35.521 55.946 22.880 1.00 0.00 C ATOM 26 CD GLN A 2 35.810 57.391 23.292 1.00 0.00 C ATOM 27 OE1 GLN A 2 36.225 57.689 24.409 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.623 58.341 22.379 1.00 0.00 N ATOM 0 H GLN A 2 33.999 53.509 23.844 1.00 0.00 H new ATOM 0 HA GLN A 2 36.469 53.445 22.326 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.594 54.980 24.797 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.157 55.154 24.024 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.922 55.773 21.881 1.00 0.00 H new ATOM 0 HG3 GLN A 2 34.442 55.802 22.820 1.00 0.00 H new ATOM 0 HE21 GLN A 2 35.278 58.096 21.451 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.824 59.315 22.607 1.00 0.00 H new ATOM 37 N ILE A 3 37.991 52.184 23.855 1.00 0.00 N ATOM 38 CA ILE A 3 38.945 51.467 24.677 1.00 0.00 C ATOM 39 C ILE A 3 40.270 52.227 24.772 1.00 0.00 C ATOM 40 O ILE A 3 40.629 52.979 23.869 1.00 0.00 O ATOM 41 CB ILE A 3 39.140 50.028 24.210 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.676 49.931 22.784 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.851 49.231 24.383 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.171 48.539 22.403 1.00 0.00 C ATOM 0 H ILE A 3 38.355 52.406 22.929 1.00 0.00 H new ATOM 0 HA ILE A 3 38.529 51.407 25.683 1.00 0.00 H new ATOM 0 HB ILE A 3 39.908 49.587 24.845 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.890 50.229 22.090 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.493 50.642 22.664 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.008 48.207 24.045 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.565 49.226 25.435 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.058 49.690 23.793 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.536 48.551 21.376 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.980 48.245 23.072 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.352 47.825 22.488 1.00 0.00 H new ATOM 56 N PHE A 4 41.022 51.986 25.842 1.00 0.00 N ATOM 57 CA PHE A 4 42.338 52.544 26.077 1.00 0.00 C ATOM 58 C PHE A 4 43.385 51.427 26.079 1.00 0.00 C ATOM 59 O PHE A 4 43.234 50.452 26.813 1.00 0.00 O ATOM 60 CB PHE A 4 42.361 53.318 27.391 1.00 0.00 C ATOM 61 CG PHE A 4 41.212 54.266 27.640 1.00 0.00 C ATOM 62 CD1 PHE A 4 40.789 55.165 26.654 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.564 54.260 28.881 1.00 0.00 C ATOM 64 CE1 PHE A 4 39.716 56.031 26.892 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.498 55.133 29.130 1.00 0.00 C ATOM 66 CZ PHE A 4 39.071 56.021 28.134 1.00 0.00 C ATOM 0 H PHE A 4 40.714 51.371 26.595 1.00 0.00 H new ATOM 0 HA PHE A 4 42.578 53.240 25.274 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.392 52.598 28.209 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.289 53.889 27.433 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.296 55.190 25.701 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.889 53.577 29.652 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.386 56.707 26.117 1.00 0.00 H new ATOM 0 HE2 PHE A 4 39.005 55.122 30.091 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.248 56.694 28.324 1.00 0.00 H new ATOM 76 N VAL A 5 44.448 51.558 25.291 1.00 0.00 N ATOM 77 CA VAL A 5 45.586 50.662 25.303 1.00 0.00 C ATOM 78 C VAL A 5 46.776 51.407 25.910 1.00 0.00 C ATOM 79 O VAL A 5 47.106 52.492 25.437 1.00 0.00 O ATOM 80 CB VAL A 5 45.890 50.123 23.908 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.147 49.258 23.894 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.753 49.257 23.372 1.00 0.00 C ATOM 0 H VAL A 5 44.538 52.312 24.610 1.00 0.00 H new ATOM 0 HA VAL A 5 45.363 49.787 25.914 1.00 0.00 H new ATOM 0 HB VAL A 5 46.026 51.005 23.282 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.327 48.895 22.882 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.000 49.851 24.224 1.00 0.00 H new ATOM 0 HG13 VAL A 5 47.013 48.410 24.566 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.010 48.894 22.377 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.596 48.409 24.039 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.839 49.849 23.317 1.00 0.00 H new ATOM 92 N LYS A 6 47.400 50.838 26.937 1.00 0.00 N ATOM 93 CA LYS A 6 48.441 51.467 27.725 1.00 0.00 C ATOM 94 C LYS A 6 49.707 50.616 27.841 1.00 0.00 C ATOM 95 O LYS A 6 49.668 49.487 28.326 1.00 0.00 O ATOM 96 CB LYS A 6 47.871 51.867 29.081 1.00 0.00 C ATOM 97 CG LYS A 6 48.867 52.713 29.869 1.00 0.00 C ATOM 98 CD LYS A 6 48.189 53.472 31.007 1.00 0.00 C ATOM 99 CE LYS A 6 49.168 54.497 31.575 1.00 0.00 C ATOM 100 NZ LYS A 6 48.470 55.414 32.489 1.00 0.00 N ATOM 0 H LYS A 6 47.183 49.892 27.250 1.00 0.00 H new ATOM 0 HA LYS A 6 48.768 52.367 27.204 1.00 0.00 H new ATOM 0 HB2 LYS A 6 46.946 52.426 28.939 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.618 50.973 29.651 1.00 0.00 H new ATOM 0 HG2 LYS A 6 49.648 52.071 30.275 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.353 53.421 29.198 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.291 53.971 30.644 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.875 52.779 31.787 1.00 0.00 H new ATOM 0 HE2 LYS A 6 49.973 53.987 32.104 1.00 0.00 H new ATOM 0 HE3 LYS A 6 49.627 55.061 30.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 49.146 56.107 32.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.717 55.912 31.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 48.052 54.872 33.272 1.00 0.00 H new ATOM 168 N LYS A 11 52.687 55.158 28.131 1.00 0.00 N ATOM 169 CA LYS A 11 52.056 55.802 26.997 1.00 0.00 C ATOM 170 C LYS A 11 50.682 55.179 26.741 1.00 0.00 C ATOM 171 O LYS A 11 50.515 53.979 26.948 1.00 0.00 O ATOM 172 CB LYS A 11 52.951 55.699 25.766 1.00 0.00 C ATOM 173 CG LYS A 11 54.352 56.285 25.920 1.00 0.00 C ATOM 174 CD LYS A 11 54.376 57.791 26.161 1.00 0.00 C ATOM 175 CE LYS A 11 55.786 58.314 26.416 1.00 0.00 C ATOM 176 NZ LYS A 11 56.635 58.313 25.214 1.00 0.00 N ATOM 0 HA LYS A 11 51.913 56.860 27.217 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.044 54.648 25.493 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.455 56.201 24.935 1.00 0.00 H new ATOM 0 HG2 LYS A 11 54.853 55.787 26.750 1.00 0.00 H new ATOM 0 HG3 LYS A 11 54.928 56.063 25.021 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.952 58.302 25.296 1.00 0.00 H new ATOM 0 HD3 LYS A 11 53.742 58.030 27.015 1.00 0.00 H new ATOM 0 HE2 LYS A 11 55.724 59.329 26.807 1.00 0.00 H new ATOM 0 HE3 LYS A 11 56.258 57.704 27.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 57.578 58.679 25.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 56.723 57.342 24.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 56.205 58.917 24.485 1.00 0.00 H new ATOM 190 N THR A 12 49.719 55.958 26.257 1.00 0.00 N ATOM 191 CA THR A 12 48.335 55.553 26.110 1.00 0.00 C ATOM 192 C THR A 12 47.756 56.005 24.768 1.00 0.00 C ATOM 193 O THR A 12 48.044 57.111 24.318 1.00 0.00 O ATOM 194 CB THR A 12 47.487 56.079 27.264 1.00 0.00 C ATOM 195 OG1 THR A 12 48.065 55.735 28.503 1.00 0.00 O ATOM 196 CG2 THR A 12 46.077 55.496 27.292 1.00 0.00 C ATOM 0 H THR A 12 49.891 56.915 25.949 1.00 0.00 H new ATOM 0 HA THR A 12 48.311 54.464 26.133 1.00 0.00 H new ATOM 0 HB THR A 12 47.441 57.157 27.108 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.508 56.082 29.231 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.528 55.912 28.137 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.561 55.747 26.365 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.133 54.412 27.394 1.00 0.00 H new ATOM 204 N ILE A 13 46.915 55.177 24.155 1.00 0.00 N ATOM 205 CA ILE A 13 46.148 55.481 22.964 1.00 0.00 C ATOM 206 C ILE A 13 44.664 55.145 23.127 1.00 0.00 C ATOM 207 O ILE A 13 44.316 54.140 23.741 1.00 0.00 O ATOM 208 CB ILE A 13 46.737 54.833 21.714 1.00 0.00 C ATOM 209 CG1 ILE A 13 46.780 53.309 21.777 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.104 55.438 21.409 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.260 52.632 20.496 1.00 0.00 C ATOM 0 H ILE A 13 46.746 54.231 24.497 1.00 0.00 H new ATOM 0 HA ILE A 13 46.217 56.560 22.826 1.00 0.00 H new ATOM 0 HB ILE A 13 46.063 55.055 20.887 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.434 53.011 22.597 1.00 0.00 H new ATOM 0 HG13 ILE A 13 45.782 52.940 22.015 1.00 0.00 H new ATOM 0 HG21 ILE A 13 48.518 54.970 20.516 1.00 0.00 H new ATOM 0 HG22 ILE A 13 47.998 56.510 21.242 1.00 0.00 H new ATOM 0 HG23 ILE A 13 48.774 55.267 22.252 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.258 51.551 20.633 1.00 0.00 H new ATOM 0 HD12 ILE A 13 46.594 52.895 19.674 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.271 52.966 20.265 1.00 0.00 H new ATOM 223 N THR A 14 43.786 55.960 22.549 1.00 0.00 N ATOM 224 CA THR A 14 42.348 55.780 22.554 1.00 0.00 C ATOM 225 C THR A 14 41.826 55.417 21.162 1.00 0.00 C ATOM 226 O THR A 14 42.092 56.136 20.202 1.00 0.00 O ATOM 227 CB THR A 14 41.636 57.031 23.061 1.00 0.00 C ATOM 228 OG1 THR A 14 42.025 57.299 24.390 1.00 0.00 O ATOM 229 CG2 THR A 14 40.119 56.874 23.086 1.00 0.00 C ATOM 0 H THR A 14 44.076 56.798 22.044 1.00 0.00 H new ATOM 0 HA THR A 14 42.132 54.955 23.232 1.00 0.00 H new ATOM 0 HB THR A 14 41.912 57.832 22.376 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.375 56.903 25.007 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.664 57.793 23.455 1.00 0.00 H new ATOM 0 HG22 THR A 14 39.758 56.669 22.078 1.00 0.00 H new ATOM 0 HG23 THR A 14 39.850 56.047 23.743 1.00 0.00 H new ATOM 237 N LEU A 15 41.056 54.337 21.062 1.00 0.00 N ATOM 238 CA LEU A 15 40.512 53.811 19.826 1.00 0.00 C ATOM 239 C LEU A 15 39.023 53.496 19.975 1.00 0.00 C ATOM 240 O LEU A 15 38.580 53.052 21.031 1.00 0.00 O ATOM 241 CB LEU A 15 41.282 52.560 19.412 1.00 0.00 C ATOM 242 CG LEU A 15 42.784 52.727 19.207 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.445 51.368 18.989 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.130 53.606 18.008 1.00 0.00 C ATOM 0 H LEU A 15 40.786 53.786 21.877 1.00 0.00 H new ATOM 0 HA LEU A 15 40.619 54.569 19.050 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.124 51.794 20.171 1.00 0.00 H new ATOM 0 HB3 LEU A 15 40.850 52.184 18.485 1.00 0.00 H new ATOM 0 HG LEU A 15 43.155 53.210 20.111 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.517 51.504 18.844 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.274 50.736 19.860 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.017 50.893 18.106 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.213 53.686 17.916 1.00 0.00 H new ATOM 0 HD22 LEU A 15 42.720 53.162 17.101 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.704 54.599 18.150 1.00 0.00 H new ATOM 256 N GLU A 16 38.260 53.705 18.905 1.00 0.00 N ATOM 257 CA GLU A 16 36.864 53.333 18.794 1.00 0.00 C ATOM 258 C GLU A 16 36.743 51.965 18.119 1.00 0.00 C ATOM 259 O GLU A 16 37.245 51.767 17.016 1.00 0.00 O ATOM 260 CB GLU A 16 36.108 54.418 18.031 1.00 0.00 C ATOM 261 CG GLU A 16 34.642 54.113 17.737 1.00 0.00 C ATOM 262 CD GLU A 16 33.760 53.983 18.980 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.082 54.552 20.046 1.00 0.00 O ATOM 264 OE2 GLU A 16 32.692 53.341 18.891 1.00 0.00 O ATOM 0 H GLU A 16 38.617 54.156 18.063 1.00 0.00 H new ATOM 0 HA GLU A 16 36.418 53.249 19.785 1.00 0.00 H new ATOM 0 HB2 GLU A 16 36.161 55.344 18.603 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.620 54.598 17.086 1.00 0.00 H new ATOM 0 HG2 GLU A 16 34.240 54.903 17.102 1.00 0.00 H new ATOM 0 HG3 GLU A 16 34.584 53.186 17.167 1.00 0.00 H new ATOM 271 N VAL A 17 36.066 51.028 18.777 1.00 0.00 N ATOM 272 CA VAL A 17 35.911 49.645 18.374 1.00 0.00 C ATOM 273 C VAL A 17 34.467 49.175 18.562 1.00 0.00 C ATOM 274 O VAL A 17 33.708 49.778 19.316 1.00 0.00 O ATOM 275 CB VAL A 17 36.869 48.736 19.138 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.332 49.065 18.853 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.644 48.773 20.647 1.00 0.00 C ATOM 0 H VAL A 17 35.586 51.231 19.654 1.00 0.00 H new ATOM 0 HA VAL A 17 36.156 49.584 17.314 1.00 0.00 H new ATOM 0 HB VAL A 17 36.649 47.732 18.776 1.00 0.00 H new ATOM 0 HG11 VAL A 17 38.974 48.391 19.420 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.531 48.945 17.788 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.537 50.094 19.147 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.354 48.107 21.137 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.789 49.790 21.012 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.628 48.448 20.871 1.00 0.00 H new ATOM 287 N GLU A 18 34.098 48.067 17.924 1.00 0.00 N ATOM 288 CA GLU A 18 32.810 47.424 18.087 1.00 0.00 C ATOM 289 C GLU A 18 32.993 46.043 18.719 1.00 0.00 C ATOM 290 O GLU A 18 34.014 45.412 18.459 1.00 0.00 O ATOM 291 CB GLU A 18 32.094 47.320 16.743 1.00 0.00 C ATOM 292 CG GLU A 18 31.819 48.668 16.084 1.00 0.00 C ATOM 293 CD GLU A 18 31.272 48.515 14.664 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.122 48.928 14.402 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.024 48.041 13.787 1.00 0.00 O ATOM 0 H GLU A 18 34.707 47.584 17.264 1.00 0.00 H new ATOM 0 HA GLU A 18 32.192 48.028 18.751 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.696 46.712 16.068 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.149 46.797 16.885 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.105 49.227 16.688 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.739 49.252 16.056 1.00 0.00 H new ATOM 302 N PRO A 19 32.074 45.522 19.527 1.00 0.00 N ATOM 303 CA PRO A 19 32.351 44.364 20.352 1.00 0.00 C ATOM 304 C PRO A 19 32.668 43.066 19.605 1.00 0.00 C ATOM 305 O PRO A 19 33.348 42.192 20.137 1.00 0.00 O ATOM 306 CB PRO A 19 31.133 44.202 21.258 1.00 0.00 C ATOM 307 CG PRO A 19 30.543 45.608 21.330 1.00 0.00 C ATOM 308 CD PRO A 19 30.811 46.116 19.917 1.00 0.00 C ATOM 0 HA PRO A 19 33.275 44.547 20.900 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.419 43.489 20.845 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.415 43.835 22.245 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.479 45.596 21.568 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.032 46.221 22.087 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.012 45.823 19.236 1.00 0.00 H new ATOM 0 HD3 PRO A 19 30.865 47.204 19.895 1.00 0.00 H new ATOM 316 N SER A 20 32.216 42.934 18.361 1.00 0.00 N ATOM 317 CA SER A 20 32.480 41.787 17.516 1.00 0.00 C ATOM 318 C SER A 20 33.844 41.794 16.825 1.00 0.00 C ATOM 319 O SER A 20 34.166 40.828 16.135 1.00 0.00 O ATOM 320 CB SER A 20 31.382 41.651 16.464 1.00 0.00 C ATOM 321 OG SER A 20 30.122 41.532 17.084 1.00 0.00 O ATOM 0 H SER A 20 31.641 43.644 17.907 1.00 0.00 H new ATOM 0 HA SER A 20 32.491 40.931 18.191 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.390 42.520 15.806 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.572 40.777 15.841 1.00 0.00 H new ATOM 0 HG SER A 20 29.427 41.447 16.398 1.00 0.00 H new ATOM 327 N ASP A 21 34.647 42.846 16.964 1.00 0.00 N ATOM 328 CA ASP A 21 35.962 42.900 16.358 1.00 0.00 C ATOM 329 C ASP A 21 36.964 41.928 16.983 1.00 0.00 C ATOM 330 O ASP A 21 36.949 41.698 18.191 1.00 0.00 O ATOM 331 CB ASP A 21 36.528 44.317 16.361 1.00 0.00 C ATOM 332 CG ASP A 21 36.140 45.037 15.068 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.592 44.568 14.002 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.386 46.033 15.102 1.00 0.00 O ATOM 0 H ASP A 21 34.400 43.679 17.499 1.00 0.00 H new ATOM 0 HA ASP A 21 35.814 42.581 15.326 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.148 44.867 17.222 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.613 44.284 16.457 1.00 0.00 H new ATOM 339 N THR A 22 37.852 41.382 16.158 1.00 0.00 N ATOM 340 CA THR A 22 38.906 40.483 16.584 1.00 0.00 C ATOM 341 C THR A 22 40.076 41.225 17.234 1.00 0.00 C ATOM 342 O THR A 22 40.385 42.361 16.883 1.00 0.00 O ATOM 343 CB THR A 22 39.412 39.601 15.446 1.00 0.00 C ATOM 344 OG1 THR A 22 40.011 40.363 14.422 1.00 0.00 O ATOM 345 CG2 THR A 22 38.297 38.766 14.823 1.00 0.00 C ATOM 0 H THR A 22 37.854 41.560 15.154 1.00 0.00 H new ATOM 0 HA THR A 22 38.454 39.837 17.337 1.00 0.00 H new ATOM 0 HB THR A 22 40.151 38.939 15.897 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.325 39.766 13.711 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.706 38.155 14.018 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.859 38.119 15.583 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.528 39.427 14.422 1.00 0.00 H new ATOM 353 N ILE A 23 40.786 40.548 18.131 1.00 0.00 N ATOM 354 CA ILE A 23 41.990 41.078 18.738 1.00 0.00 C ATOM 355 C ILE A 23 43.073 41.320 17.684 1.00 0.00 C ATOM 356 O ILE A 23 43.829 42.280 17.809 1.00 0.00 O ATOM 357 CB ILE A 23 42.411 40.200 19.913 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.675 40.534 21.207 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.899 40.300 20.237 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.149 40.548 21.168 1.00 0.00 C ATOM 0 H ILE A 23 40.537 39.613 18.455 1.00 0.00 H new ATOM 0 HA ILE A 23 41.798 42.063 19.163 1.00 0.00 H new ATOM 0 HB ILE A 23 42.158 39.196 19.574 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.985 39.815 21.965 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.012 41.515 21.541 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.132 39.652 21.082 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.482 39.990 19.370 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.148 41.330 20.491 1.00 0.00 H new ATOM 0 HD11 ILE A 23 39.762 40.800 22.155 1.00 0.00 H new ATOM 0 HD12 ILE A 23 39.810 41.290 20.445 1.00 0.00 H new ATOM 0 HD13 ILE A 23 39.783 39.564 20.876 1.00 0.00 H new ATOM 372 N GLU A 24 43.084 40.558 16.593 1.00 0.00 N ATOM 373 CA GLU A 24 43.916 40.811 15.435 1.00 0.00 C ATOM 374 C GLU A 24 43.690 42.196 14.828 1.00 0.00 C ATOM 375 O GLU A 24 44.651 42.923 14.582 1.00 0.00 O ATOM 376 CB GLU A 24 43.618 39.756 14.373 1.00 0.00 C ATOM 377 CG GLU A 24 44.550 39.854 13.168 1.00 0.00 C ATOM 378 CD GLU A 24 44.163 38.829 12.100 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.835 37.780 12.000 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.194 39.087 11.354 1.00 0.00 O ATOM 0 H GLU A 24 42.498 39.729 16.494 1.00 0.00 H new ATOM 0 HA GLU A 24 44.953 40.766 15.766 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.707 38.764 14.817 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.586 39.864 14.039 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.505 40.859 12.748 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.580 39.686 13.484 1.00 0.00 H new ATOM 387 N ASN A 25 42.435 42.575 14.607 1.00 0.00 N ATOM 388 CA ASN A 25 42.079 43.835 13.985 1.00 0.00 C ATOM 389 C ASN A 25 42.471 45.031 14.855 1.00 0.00 C ATOM 390 O ASN A 25 42.821 46.083 14.326 1.00 0.00 O ATOM 391 CB ASN A 25 40.589 43.815 13.657 1.00 0.00 C ATOM 392 CG ASN A 25 40.174 44.917 12.681 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.959 45.399 11.868 1.00 0.00 O ATOM 394 ND2 ASN A 25 38.920 45.357 12.688 1.00 0.00 N ATOM 0 H ASN A 25 41.629 42.004 14.861 1.00 0.00 H new ATOM 0 HA ASN A 25 42.641 43.954 13.059 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.330 42.845 13.232 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.019 43.922 14.580 1.00 0.00 H new ATOM 0 HD21 ASN A 25 38.629 46.079 12.028 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.249 44.973 13.353 1.00 0.00 H new ATOM 401 N VAL A 26 42.476 44.860 16.174 1.00 0.00 N ATOM 402 CA VAL A 26 42.939 45.852 17.125 1.00 0.00 C ATOM 403 C VAL A 26 44.467 45.895 17.200 1.00 0.00 C ATOM 404 O VAL A 26 45.036 46.982 17.126 1.00 0.00 O ATOM 405 CB VAL A 26 42.304 45.646 18.496 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.746 46.708 19.498 1.00 0.00 C ATOM 407 CG2 VAL A 26 40.782 45.706 18.413 1.00 0.00 C ATOM 0 H VAL A 26 42.148 44.002 16.618 1.00 0.00 H new ATOM 0 HA VAL A 26 42.615 46.828 16.764 1.00 0.00 H new ATOM 0 HB VAL A 26 42.633 44.663 18.831 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.269 46.521 20.460 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.829 46.668 19.616 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.456 47.694 19.135 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.357 45.556 19.406 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.477 46.680 18.031 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.423 44.925 17.743 1.00 0.00 H new ATOM 417 N LYS A 27 45.162 44.762 17.238 1.00 0.00 N ATOM 418 CA LYS A 27 46.609 44.703 17.185 1.00 0.00 C ATOM 419 C LYS A 27 47.178 45.335 15.913 1.00 0.00 C ATOM 420 O LYS A 27 48.198 46.018 15.973 1.00 0.00 O ATOM 421 CB LYS A 27 47.086 43.261 17.330 1.00 0.00 C ATOM 422 CG LYS A 27 47.093 42.804 18.785 1.00 0.00 C ATOM 423 CD LYS A 27 47.438 41.329 18.964 1.00 0.00 C ATOM 424 CE LYS A 27 48.742 40.941 18.272 1.00 0.00 C ATOM 425 NZ LYS A 27 49.062 39.519 18.468 1.00 0.00 N ATOM 0 H LYS A 27 44.721 43.845 17.308 1.00 0.00 H new ATOM 0 HA LYS A 27 46.985 45.291 18.022 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.439 42.605 16.747 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.090 43.168 16.916 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.811 43.406 19.342 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.112 42.994 19.221 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.515 41.105 20.028 1.00 0.00 H new ATOM 0 HD3 LYS A 27 46.626 40.719 18.568 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.664 41.152 17.206 1.00 0.00 H new ATOM 0 HE3 LYS A 27 49.556 41.554 18.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.379 39.107 17.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 49.819 39.428 19.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 48.215 39.015 18.800 1.00 0.00 H new ATOM 439 N ALA A 28 46.475 45.225 14.790 1.00 0.00 N ATOM 440 CA ALA A 28 46.831 45.918 13.569 1.00 0.00 C ATOM 441 C ALA A 28 46.771 47.442 13.698 1.00 0.00 C ATOM 442 O ALA A 28 47.597 48.133 13.107 1.00 0.00 O ATOM 443 CB ALA A 28 45.936 45.407 12.444 1.00 0.00 C ATOM 0 H ALA A 28 45.638 44.648 14.707 1.00 0.00 H new ATOM 0 HA ALA A 28 47.874 45.700 13.342 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.190 45.919 11.516 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.085 44.334 12.320 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.893 45.602 12.692 1.00 0.00 H new ATOM 449 N LYS A 29 45.860 47.977 14.505 1.00 0.00 N ATOM 450 CA LYS A 29 45.814 49.386 14.845 1.00 0.00 C ATOM 451 C LYS A 29 46.925 49.775 15.822 1.00 0.00 C ATOM 452 O LYS A 29 47.446 50.882 15.710 1.00 0.00 O ATOM 453 CB LYS A 29 44.455 49.808 15.393 1.00 0.00 C ATOM 454 CG LYS A 29 43.474 50.393 14.380 1.00 0.00 C ATOM 455 CD LYS A 29 42.646 49.375 13.602 1.00 0.00 C ATOM 456 CE LYS A 29 43.399 48.734 12.439 1.00 0.00 C ATOM 457 NZ LYS A 29 42.620 47.626 11.866 1.00 0.00 N ATOM 0 H LYS A 29 45.122 47.429 14.947 1.00 0.00 H new ATOM 0 HA LYS A 29 45.977 49.925 13.911 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.989 48.940 15.860 1.00 0.00 H new ATOM 0 HB3 LYS A 29 44.616 50.545 16.180 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.793 51.063 14.905 1.00 0.00 H new ATOM 0 HG3 LYS A 29 44.033 51.000 13.668 1.00 0.00 H new ATOM 0 HD2 LYS A 29 42.314 48.592 14.284 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.751 49.865 13.218 1.00 0.00 H new ATOM 0 HE2 LYS A 29 43.597 49.482 11.671 1.00 0.00 H new ATOM 0 HE3 LYS A 29 44.366 48.366 12.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 43.148 47.202 11.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 42.452 46.905 12.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 41.708 47.986 11.519 1.00 0.00 H new ATOM 471 N ILE A 30 47.337 48.900 16.735 1.00 0.00 N ATOM 472 CA ILE A 30 48.453 49.148 17.626 1.00 0.00 C ATOM 473 C ILE A 30 49.759 49.283 16.840 1.00 0.00 C ATOM 474 O ILE A 30 50.521 50.211 17.102 1.00 0.00 O ATOM 475 CB ILE A 30 48.537 48.099 18.731 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.309 48.173 19.634 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.811 48.257 19.555 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.183 47.016 20.622 1.00 0.00 C ATOM 0 H ILE A 30 46.897 47.990 16.874 1.00 0.00 H new ATOM 0 HA ILE A 30 48.282 50.101 18.126 1.00 0.00 H new ATOM 0 HB ILE A 30 48.566 47.119 18.255 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.339 49.109 20.191 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.415 48.201 19.010 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.838 47.494 20.333 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.680 48.145 18.906 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.826 49.245 20.015 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.284 47.148 21.224 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.119 46.076 20.075 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.056 46.998 21.274 1.00 0.00 H new ATOM 490 N GLN A 31 49.998 48.442 15.839 1.00 0.00 N ATOM 491 CA GLN A 31 51.133 48.594 14.950 1.00 0.00 C ATOM 492 C GLN A 31 51.059 49.900 14.157 1.00 0.00 C ATOM 493 O GLN A 31 52.073 50.578 13.995 1.00 0.00 O ATOM 494 CB GLN A 31 51.247 47.375 14.041 1.00 0.00 C ATOM 495 CG GLN A 31 52.567 47.360 13.275 1.00 0.00 C ATOM 496 CD GLN A 31 52.771 46.103 12.427 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.836 45.462 11.952 1.00 0.00 O ATOM 498 NE2 GLN A 31 54.012 45.686 12.198 1.00 0.00 N ATOM 0 H GLN A 31 49.408 47.638 15.625 1.00 0.00 H new ATOM 0 HA GLN A 31 52.040 48.655 15.551 1.00 0.00 H new ATOM 0 HB2 GLN A 31 51.163 46.467 14.638 1.00 0.00 H new ATOM 0 HB3 GLN A 31 50.417 47.370 13.335 1.00 0.00 H new ATOM 0 HG2 GLN A 31 52.611 48.236 12.627 1.00 0.00 H new ATOM 0 HG3 GLN A 31 53.390 47.446 13.985 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.803 46.203 12.583 1.00 0.00 H new ATOM 0 HE22 GLN A 31 54.174 44.849 11.638 1.00 0.00 H new ATOM 507 N ASP A 32 49.875 50.318 13.719 1.00 0.00 N ATOM 508 CA ASP A 32 49.689 51.574 13.022 1.00 0.00 C ATOM 509 C ASP A 32 49.947 52.800 13.900 1.00 0.00 C ATOM 510 O ASP A 32 50.607 53.744 13.473 1.00 0.00 O ATOM 511 CB ASP A 32 48.292 51.611 12.411 1.00 0.00 C ATOM 512 CG ASP A 32 48.157 52.731 11.378 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.420 53.706 11.640 1.00 0.00 O ATOM 514 OD2 ASP A 32 48.809 52.623 10.317 1.00 0.00 O ATOM 0 H ASP A 32 49.014 49.785 13.842 1.00 0.00 H new ATOM 0 HA ASP A 32 50.437 51.624 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 32 48.075 50.653 11.939 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.553 51.752 13.200 1.00 0.00 H new ATOM 519 N LYS A 33 49.459 52.792 15.138 1.00 0.00 N ATOM 520 CA LYS A 33 49.503 53.902 16.067 1.00 0.00 C ATOM 521 C LYS A 33 50.820 54.027 16.837 1.00 0.00 C ATOM 522 O LYS A 33 51.290 55.146 17.027 1.00 0.00 O ATOM 523 CB LYS A 33 48.334 53.775 17.041 1.00 0.00 C ATOM 524 CG LYS A 33 46.969 54.008 16.401 1.00 0.00 C ATOM 525 CD LYS A 33 46.603 55.488 16.322 1.00 0.00 C ATOM 526 CE LYS A 33 45.231 55.644 15.671 1.00 0.00 C ATOM 527 NZ LYS A 33 44.692 57.000 15.854 1.00 0.00 N ATOM 0 H LYS A 33 49.002 51.970 15.532 1.00 0.00 H new ATOM 0 HA LYS A 33 49.427 54.814 15.474 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.351 52.780 17.486 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.471 54.490 17.853 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.965 53.582 15.398 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.208 53.479 16.975 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.594 55.924 17.321 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.354 56.028 15.745 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.306 55.423 14.606 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.541 54.917 16.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.760 57.067 15.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.596 57.201 16.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.338 57.692 15.423 1.00 0.00 H new ATOM 541 N GLU A 34 51.408 52.921 17.284 1.00 0.00 N ATOM 542 CA GLU A 34 52.567 52.876 18.154 1.00 0.00 C ATOM 543 C GLU A 34 53.709 52.003 17.632 1.00 0.00 C ATOM 544 O GLU A 34 54.739 51.874 18.289 1.00 0.00 O ATOM 545 CB GLU A 34 52.136 52.457 19.557 1.00 0.00 C ATOM 546 CG GLU A 34 51.425 53.557 20.339 1.00 0.00 C ATOM 547 CD GLU A 34 52.313 54.772 20.619 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.510 54.608 20.936 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.842 55.922 20.478 1.00 0.00 O ATOM 0 H GLU A 34 51.070 51.992 17.035 1.00 0.00 H new ATOM 0 HA GLU A 34 52.982 53.884 18.181 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.475 51.594 19.481 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.015 52.137 20.116 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.546 53.879 19.781 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.070 53.149 21.286 1.00 0.00 H new ATOM 556 N GLY A 35 53.579 51.412 16.447 1.00 0.00 N ATOM 557 CA GLY A 35 54.683 50.832 15.711 1.00 0.00 C ATOM 558 C GLY A 35 55.066 49.393 16.067 1.00 0.00 C ATOM 559 O GLY A 35 55.658 48.712 15.233 1.00 0.00 O ATOM 0 H GLY A 35 52.683 51.325 15.968 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.440 50.867 14.649 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.559 51.464 15.858 1.00 0.00 H new ATOM 563 N ILE A 36 54.714 48.904 17.253 1.00 0.00 N ATOM 564 CA ILE A 36 55.104 47.592 17.729 1.00 0.00 C ATOM 565 C ILE A 36 54.451 46.498 16.883 1.00 0.00 C ATOM 566 O ILE A 36 53.228 46.513 16.751 1.00 0.00 O ATOM 567 CB ILE A 36 54.800 47.422 19.215 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.365 48.572 20.045 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.357 46.093 19.716 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.080 48.505 21.542 1.00 0.00 C ATOM 0 H ILE A 36 54.139 49.422 17.918 1.00 0.00 H new ATOM 0 HA ILE A 36 56.184 47.497 17.618 1.00 0.00 H new ATOM 0 HB ILE A 36 53.716 47.429 19.333 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.445 48.605 19.900 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.962 49.508 19.658 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.134 45.982 20.777 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.898 45.274 19.162 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.437 46.072 19.568 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.525 49.368 22.036 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.003 48.508 21.708 1.00 0.00 H new ATOM 0 HD13 ILE A 36 55.508 47.591 21.953 1.00 0.00 H new ATOM 582 N PRO A 37 55.183 45.532 16.338 1.00 0.00 N ATOM 583 CA PRO A 37 54.609 44.430 15.593 1.00 0.00 C ATOM 584 C PRO A 37 53.624 43.581 16.399 1.00 0.00 C ATOM 585 O PRO A 37 53.823 43.404 17.598 1.00 0.00 O ATOM 586 CB PRO A 37 55.776 43.569 15.120 1.00 0.00 C ATOM 587 CG PRO A 37 56.958 44.535 15.099 1.00 0.00 C ATOM 588 CD PRO A 37 56.629 45.492 16.241 1.00 0.00 C ATOM 0 HA PRO A 37 54.024 44.835 14.767 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.955 42.733 15.796 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.587 43.147 14.133 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.905 44.020 15.262 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.039 45.056 14.145 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.072 45.148 17.176 1.00 0.00 H new ATOM 0 HD3 PRO A 37 57.033 46.485 16.044 1.00 0.00 H new ATOM 596 N PRO A 38 52.606 42.993 15.777 1.00 0.00 N ATOM 597 CA PRO A 38 51.675 42.114 16.456 1.00 0.00 C ATOM 598 C PRO A 38 52.339 40.864 17.037 1.00 0.00 C ATOM 599 O PRO A 38 51.911 40.373 18.078 1.00 0.00 O ATOM 600 CB PRO A 38 50.609 41.764 15.421 1.00 0.00 C ATOM 601 CG PRO A 38 51.326 41.928 14.084 1.00 0.00 C ATOM 602 CD PRO A 38 52.269 43.093 14.371 1.00 0.00 C ATOM 0 HA PRO A 38 51.246 42.613 17.325 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.241 40.747 15.555 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.747 42.427 15.496 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.867 41.026 13.798 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.633 42.154 13.274 1.00 0.00 H new ATOM 0 HD2 PRO A 38 53.163 43.034 13.750 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.790 44.047 14.151 1.00 0.00 H new ATOM 610 N ASP A 39 53.417 40.378 16.427 1.00 0.00 N ATOM 611 CA ASP A 39 54.144 39.215 16.893 1.00 0.00 C ATOM 612 C ASP A 39 55.118 39.495 18.040 1.00 0.00 C ATOM 613 O ASP A 39 55.604 38.555 18.664 1.00 0.00 O ATOM 614 CB ASP A 39 54.817 38.518 15.714 1.00 0.00 C ATOM 615 CG ASP A 39 56.141 39.177 15.325 1.00 0.00 C ATOM 616 OD1 ASP A 39 56.104 40.283 14.743 1.00 0.00 O ATOM 617 OD2 ASP A 39 57.206 38.596 15.627 1.00 0.00 O ATOM 0 H ASP A 39 53.811 40.792 15.582 1.00 0.00 H new ATOM 0 HA ASP A 39 53.410 38.540 17.333 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.995 37.473 15.967 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.144 38.528 14.857 1.00 0.00 H new ATOM 622 N GLN A 40 55.396 40.758 18.352 1.00 0.00 N ATOM 623 CA GLN A 40 56.339 41.175 19.369 1.00 0.00 C ATOM 624 C GLN A 40 55.674 41.733 20.628 1.00 0.00 C ATOM 625 O GLN A 40 56.365 42.186 21.537 1.00 0.00 O ATOM 626 CB GLN A 40 57.358 42.137 18.764 1.00 0.00 C ATOM 627 CG GLN A 40 58.179 41.478 17.659 1.00 0.00 C ATOM 628 CD GLN A 40 59.358 42.309 17.150 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.501 43.501 17.412 1.00 0.00 O ATOM 630 NE2 GLN A 40 60.258 41.684 16.396 1.00 0.00 N ATOM 0 H GLN A 40 54.949 41.545 17.881 1.00 0.00 H new ATOM 0 HA GLN A 40 56.865 40.285 19.715 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.840 43.008 18.361 1.00 0.00 H new ATOM 0 HB3 GLN A 40 58.026 42.497 19.546 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.557 40.524 18.027 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.520 41.257 16.819 1.00 0.00 H new ATOM 0 HE21 GLN A 40 60.141 40.695 16.177 1.00 0.00 H new ATOM 0 HE22 GLN A 40 61.065 42.194 16.037 1.00 0.00 H new ATOM 639 N GLN A 41 54.350 41.664 20.728 1.00 0.00 N ATOM 640 CA GLN A 41 53.580 42.208 21.830 1.00 0.00 C ATOM 641 C GLN A 41 52.692 41.182 22.537 1.00 0.00 C ATOM 642 O GLN A 41 52.148 40.282 21.900 1.00 0.00 O ATOM 643 CB GLN A 41 52.779 43.417 21.355 1.00 0.00 C ATOM 644 CG GLN A 41 51.634 43.085 20.402 1.00 0.00 C ATOM 645 CD GLN A 41 51.010 44.336 19.780 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.917 44.769 20.138 1.00 0.00 O ATOM 647 NE2 GLN A 41 51.675 44.946 18.803 1.00 0.00 N ATOM 0 H GLN A 41 53.770 41.213 20.020 1.00 0.00 H new ATOM 0 HA GLN A 41 54.296 42.524 22.589 1.00 0.00 H new ATOM 0 HB2 GLN A 41 52.372 43.932 22.225 1.00 0.00 H new ATOM 0 HB3 GLN A 41 53.456 44.113 20.860 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.002 42.434 19.609 1.00 0.00 H new ATOM 0 HG3 GLN A 41 50.867 42.529 20.941 1.00 0.00 H new ATOM 0 HE21 GLN A 41 52.582 44.589 18.504 1.00 0.00 H new ATOM 0 HE22 GLN A 41 51.278 45.771 18.353 1.00 0.00 H new ATOM 656 N ARG A 42 52.490 41.360 23.838 1.00 0.00 N ATOM 657 CA ARG A 42 51.466 40.710 24.631 1.00 0.00 C ATOM 658 C ARG A 42 50.456 41.753 25.114 1.00 0.00 C ATOM 659 O ARG A 42 50.846 42.849 25.514 1.00 0.00 O ATOM 660 CB ARG A 42 52.109 39.912 25.761 1.00 0.00 C ATOM 661 CG ARG A 42 51.109 39.247 26.702 1.00 0.00 C ATOM 662 CD ARG A 42 51.735 38.206 27.627 1.00 0.00 C ATOM 663 NE ARG A 42 52.840 38.748 28.418 1.00 0.00 N ATOM 664 CZ ARG A 42 54.153 38.594 28.199 1.00 0.00 C ATOM 665 NH1 ARG A 42 54.658 37.781 27.260 1.00 0.00 N ATOM 666 NH2 ARG A 42 55.025 39.300 28.931 1.00 0.00 N ATOM 0 H ARG A 42 53.067 41.994 24.391 1.00 0.00 H new ATOM 0 HA ARG A 42 50.912 39.991 24.028 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.751 39.144 25.329 1.00 0.00 H new ATOM 0 HB3 ARG A 42 52.751 40.576 26.340 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.627 40.015 27.307 1.00 0.00 H new ATOM 0 HG3 ARG A 42 50.328 38.771 26.110 1.00 0.00 H new ATOM 0 HD2 ARG A 42 50.970 37.815 28.298 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.096 37.367 27.032 1.00 0.00 H new ATOM 0 HE ARG A 42 52.581 39.308 29.230 1.00 0.00 H new ATOM 0 HH11 ARG A 42 54.032 37.238 26.665 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.668 37.706 27.140 1.00 0.00 H new ATOM 0 HH21 ARG A 42 54.687 39.945 29.645 1.00 0.00 H new ATOM 0 HH22 ARG A 42 56.027 39.192 28.774 1.00 0.00 H new ATOM 680 N LEU A 43 49.175 41.396 25.082 1.00 0.00 N ATOM 681 CA LEU A 43 48.068 42.182 25.589 1.00 0.00 C ATOM 682 C LEU A 43 47.407 41.480 26.777 1.00 0.00 C ATOM 683 O LEU A 43 47.076 40.299 26.689 1.00 0.00 O ATOM 684 CB LEU A 43 47.054 42.435 24.477 1.00 0.00 C ATOM 685 CG LEU A 43 47.430 43.522 23.475 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.461 43.470 22.297 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.330 44.919 24.083 1.00 0.00 C ATOM 0 H LEU A 43 48.873 40.508 24.682 1.00 0.00 H new ATOM 0 HA LEU A 43 48.450 43.142 25.936 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.898 41.503 23.933 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.100 42.701 24.933 1.00 0.00 H new ATOM 0 HG LEU A 43 48.459 43.339 23.167 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.723 44.244 21.576 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.522 42.493 21.818 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.445 43.636 22.654 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.606 45.662 23.335 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.307 45.100 24.413 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.005 44.994 24.936 1.00 0.00 H new ATOM 699 N ILE A 44 47.199 42.218 27.863 1.00 0.00 N ATOM 700 CA ILE A 44 46.617 41.746 29.103 1.00 0.00 C ATOM 701 C ILE A 44 45.371 42.569 29.440 1.00 0.00 C ATOM 702 O ILE A 44 45.384 43.795 29.343 1.00 0.00 O ATOM 703 CB ILE A 44 47.624 41.742 30.250 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.975 41.117 29.915 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.041 40.986 31.441 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.008 42.086 29.346 1.00 0.00 C ATOM 0 H ILE A 44 47.445 43.207 27.898 1.00 0.00 H new ATOM 0 HA ILE A 44 46.318 40.707 28.963 1.00 0.00 H new ATOM 0 HB ILE A 44 47.806 42.793 30.472 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.383 40.663 30.818 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.819 40.312 29.197 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.762 40.984 32.259 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.123 41.474 31.767 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.822 39.959 31.148 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.934 41.550 29.139 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.628 42.522 28.422 1.00 0.00 H new ATOM 0 HD13 ILE A 44 50.201 42.878 30.069 1.00 0.00 H new ATOM 718 N PHE A 45 44.300 41.896 29.846 1.00 0.00 N ATOM 719 CA PHE A 45 43.068 42.485 30.333 1.00 0.00 C ATOM 720 C PHE A 45 42.436 41.613 31.420 1.00 0.00 C ATOM 721 O PHE A 45 42.449 40.389 31.309 1.00 0.00 O ATOM 722 CB PHE A 45 42.107 42.668 29.161 1.00 0.00 C ATOM 723 CG PHE A 45 40.765 43.249 29.538 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.678 44.555 30.035 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.600 42.485 29.402 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.437 45.090 30.402 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.357 43.020 29.758 1.00 0.00 C ATOM 728 CZ PHE A 45 38.272 44.326 30.257 1.00 0.00 C ATOM 0 H PHE A 45 44.271 40.876 29.842 1.00 0.00 H new ATOM 0 HA PHE A 45 43.286 43.455 30.779 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.575 43.317 28.421 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.949 41.702 28.682 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.572 45.153 30.136 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.661 41.477 29.020 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.378 46.093 30.797 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.462 42.425 29.648 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.313 44.742 30.529 1.00 0.00 H new ATOM 738 N ALA A 46 41.891 42.222 32.469 1.00 0.00 N ATOM 739 CA ALA A 46 41.339 41.556 33.631 1.00 0.00 C ATOM 740 C ALA A 46 42.238 40.478 34.240 1.00 0.00 C ATOM 741 O ALA A 46 41.758 39.518 34.837 1.00 0.00 O ATOM 742 CB ALA A 46 39.913 41.108 33.327 1.00 0.00 C ATOM 0 H ALA A 46 41.822 43.238 32.529 1.00 0.00 H new ATOM 0 HA ALA A 46 41.294 42.281 34.444 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.495 40.606 34.200 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.303 41.977 33.082 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.920 40.420 32.482 1.00 0.00 H new ATOM 748 N GLY A 47 43.555 40.596 34.098 1.00 0.00 N ATOM 749 CA GLY A 47 44.528 39.623 34.552 1.00 0.00 C ATOM 750 C GLY A 47 44.682 38.368 33.690 1.00 0.00 C ATOM 751 O GLY A 47 45.217 37.384 34.196 1.00 0.00 O ATOM 0 H GLY A 47 43.984 41.404 33.646 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.499 40.114 34.618 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.258 39.314 35.562 1.00 0.00 H new ATOM 755 N LYS A 48 44.245 38.374 32.434 1.00 0.00 N ATOM 756 CA LYS A 48 44.417 37.305 31.471 1.00 0.00 C ATOM 757 C LYS A 48 44.876 37.803 30.100 1.00 0.00 C ATOM 758 O LYS A 48 44.708 38.977 29.778 1.00 0.00 O ATOM 759 CB LYS A 48 43.155 36.451 31.382 1.00 0.00 C ATOM 760 CG LYS A 48 41.891 37.199 30.971 1.00 0.00 C ATOM 761 CD LYS A 48 40.705 36.254 30.798 1.00 0.00 C ATOM 762 CE LYS A 48 39.452 37.065 30.475 1.00 0.00 C ATOM 763 NZ LYS A 48 38.261 36.211 30.346 1.00 0.00 N ATOM 0 H LYS A 48 43.736 39.168 32.046 1.00 0.00 H new ATOM 0 HA LYS A 48 45.227 36.673 31.835 1.00 0.00 H new ATOM 0 HB2 LYS A 48 43.330 35.646 30.668 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.982 35.984 32.352 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.651 37.949 31.724 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.071 37.731 30.037 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.907 35.542 29.998 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.552 35.675 31.709 1.00 0.00 H new ATOM 0 HE2 LYS A 48 39.286 37.803 31.260 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.606 37.616 29.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 37.433 36.801 30.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.409 35.523 29.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.098 35.705 31.240 1.00 0.00 H new ATOM 777 N GLN A 49 45.469 36.928 29.292 1.00 0.00 N ATOM 778 CA GLN A 49 45.950 37.264 27.969 1.00 0.00 C ATOM 779 C GLN A 49 44.820 37.396 26.945 1.00 0.00 C ATOM 780 O GLN A 49 43.913 36.568 26.907 1.00 0.00 O ATOM 781 CB GLN A 49 47.033 36.287 27.521 1.00 0.00 C ATOM 782 CG GLN A 49 47.619 36.680 26.169 1.00 0.00 C ATOM 783 CD GLN A 49 48.852 35.892 25.721 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.175 34.810 26.207 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.595 36.420 24.752 1.00 0.00 N ATOM 0 H GLN A 49 45.628 35.954 29.548 1.00 0.00 H new ATOM 0 HA GLN A 49 46.404 38.253 28.030 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.827 36.256 28.267 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.614 35.282 27.459 1.00 0.00 H new ATOM 0 HG2 GLN A 49 46.844 36.566 25.412 1.00 0.00 H new ATOM 0 HG3 GLN A 49 47.880 37.738 26.201 1.00 0.00 H new ATOM 0 HE21 GLN A 49 49.336 37.317 24.342 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.424 35.928 24.419 1.00 0.00 H new ATOM 794 N LEU A 50 44.927 38.390 26.067 1.00 0.00 N ATOM 795 CA LEU A 50 44.115 38.558 24.879 1.00 0.00 C ATOM 796 C LEU A 50 44.813 37.967 23.653 1.00 0.00 C ATOM 797 O LEU A 50 46.008 38.190 23.468 1.00 0.00 O ATOM 798 CB LEU A 50 43.824 40.041 24.669 1.00 0.00 C ATOM 799 CG LEU A 50 43.061 40.749 25.785 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.849 42.210 25.399 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.685 40.132 26.017 1.00 0.00 C ATOM 0 H LEU A 50 45.618 39.133 26.176 1.00 0.00 H new ATOM 0 HA LEU A 50 43.175 38.024 25.015 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.773 40.558 24.523 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.256 40.150 23.745 1.00 0.00 H new ATOM 0 HG LEU A 50 43.653 40.652 26.695 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.304 42.721 26.193 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.816 42.692 25.254 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.275 42.262 24.474 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.177 40.667 26.820 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.095 40.204 25.103 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.798 39.084 26.294 1.00 0.00 H new ATOM 813 N GLU A 51 44.091 37.249 22.798 1.00 0.00 N ATOM 814 CA GLU A 51 44.648 36.516 21.679 1.00 0.00 C ATOM 815 C GLU A 51 43.821 36.678 20.403 1.00 0.00 C ATOM 816 O GLU A 51 42.592 36.625 20.422 1.00 0.00 O ATOM 817 CB GLU A 51 44.832 35.056 22.084 1.00 0.00 C ATOM 818 CG GLU A 51 45.926 34.299 21.338 1.00 0.00 C ATOM 819 CD GLU A 51 45.635 33.930 19.882 1.00 0.00 C ATOM 820 OE1 GLU A 51 46.618 33.773 19.126 1.00 0.00 O ATOM 821 OE2 GLU A 51 44.464 33.743 19.487 1.00 0.00 O ATOM 0 H GLU A 51 43.077 37.162 22.871 1.00 0.00 H new ATOM 0 HA GLU A 51 45.624 36.934 21.433 1.00 0.00 H new ATOM 0 HB2 GLU A 51 45.052 35.018 23.151 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.887 34.534 21.934 1.00 0.00 H new ATOM 0 HG2 GLU A 51 46.834 34.902 21.361 1.00 0.00 H new ATOM 0 HG3 GLU A 51 46.139 33.381 21.886 1.00 0.00 H new ATOM 828 N ASP A 52 44.507 36.892 19.284 1.00 0.00 N ATOM 829 CA ASP A 52 44.023 37.272 17.972 1.00 0.00 C ATOM 830 C ASP A 52 42.855 36.484 17.378 1.00 0.00 C ATOM 831 O ASP A 52 42.099 37.044 16.588 1.00 0.00 O ATOM 832 CB ASP A 52 45.200 37.165 17.006 1.00 0.00 C ATOM 833 CG ASP A 52 46.416 37.998 17.414 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.044 37.681 18.448 1.00 0.00 O ATOM 835 OD2 ASP A 52 46.774 38.967 16.710 1.00 0.00 O ATOM 0 H ASP A 52 45.522 36.791 19.280 1.00 0.00 H new ATOM 0 HA ASP A 52 43.619 38.275 18.109 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.498 36.120 16.927 1.00 0.00 H new ATOM 0 HB3 ASP A 52 44.873 37.479 16.015 1.00 0.00 H new ATOM 840 N GLY A 53 42.677 35.215 17.736 1.00 0.00 N ATOM 841 CA GLY A 53 41.635 34.359 17.206 1.00 0.00 C ATOM 842 C GLY A 53 40.207 34.707 17.629 1.00 0.00 C ATOM 843 O GLY A 53 39.270 34.285 16.953 1.00 0.00 O ATOM 0 H GLY A 53 43.272 34.748 18.420 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.688 34.386 16.118 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.844 33.333 17.510 1.00 0.00 H new ATOM 847 N ARG A 54 40.028 35.470 18.703 1.00 0.00 N ATOM 848 CA ARG A 54 38.751 35.784 19.311 1.00 0.00 C ATOM 849 C ARG A 54 38.422 37.278 19.316 1.00 0.00 C ATOM 850 O ARG A 54 39.231 38.102 18.894 1.00 0.00 O ATOM 851 CB ARG A 54 38.685 35.156 20.700 1.00 0.00 C ATOM 852 CG ARG A 54 38.534 33.638 20.727 1.00 0.00 C ATOM 853 CD ARG A 54 37.174 33.119 20.272 1.00 0.00 C ATOM 854 NE ARG A 54 37.096 32.897 18.827 1.00 0.00 N ATOM 855 CZ ARG A 54 36.263 33.446 17.933 1.00 0.00 C ATOM 856 NH1 ARG A 54 35.394 34.419 18.238 1.00 0.00 N ATOM 857 NH2 ARG A 54 36.291 33.027 16.660 1.00 0.00 N ATOM 0 H ARG A 54 40.811 35.904 19.192 1.00 0.00 H new ATOM 0 HA ARG A 54 37.969 35.347 18.691 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.591 35.423 21.244 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.847 35.597 21.240 1.00 0.00 H new ATOM 0 HG2 ARG A 54 39.304 33.200 20.093 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.719 33.287 21.742 1.00 0.00 H new ATOM 0 HD2 ARG A 54 36.957 32.184 20.789 1.00 0.00 H new ATOM 0 HD3 ARG A 54 36.403 33.832 20.566 1.00 0.00 H new ATOM 0 HE ARG A 54 37.770 32.232 18.448 1.00 0.00 H new ATOM 0 HH11 ARG A 54 35.344 34.778 19.192 1.00 0.00 H new ATOM 0 HH12 ARG A 54 34.782 34.801 17.517 1.00 0.00 H new ATOM 0 HH21 ARG A 54 36.943 32.295 16.378 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.660 33.440 15.973 1.00 0.00 H new ATOM 871 N THR A 55 37.208 37.611 19.743 1.00 0.00 N ATOM 872 CA THR A 55 36.635 38.941 19.692 1.00 0.00 C ATOM 873 C THR A 55 36.609 39.662 21.042 1.00 0.00 C ATOM 874 O THR A 55 36.722 39.033 22.092 1.00 0.00 O ATOM 875 CB THR A 55 35.241 38.950 19.071 1.00 0.00 C ATOM 876 OG1 THR A 55 34.288 38.324 19.900 1.00 0.00 O ATOM 877 CG2 THR A 55 35.185 38.257 17.713 1.00 0.00 C ATOM 0 H THR A 55 36.572 36.926 20.152 1.00 0.00 H new ATOM 0 HA THR A 55 37.312 39.499 19.046 1.00 0.00 H new ATOM 0 HB THR A 55 35.006 40.007 18.948 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.419 37.353 19.874 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.167 38.298 17.325 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.858 38.761 17.019 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.490 37.216 17.823 1.00 0.00 H new ATOM 885 N LEU A 56 36.425 40.979 21.034 1.00 0.00 N ATOM 886 CA LEU A 56 36.328 41.777 22.239 1.00 0.00 C ATOM 887 C LEU A 56 35.206 41.319 23.172 1.00 0.00 C ATOM 888 O LEU A 56 35.407 41.262 24.383 1.00 0.00 O ATOM 889 CB LEU A 56 36.181 43.248 21.860 1.00 0.00 C ATOM 890 CG LEU A 56 37.331 43.854 21.060 1.00 0.00 C ATOM 891 CD1 LEU A 56 36.955 45.258 20.597 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.625 43.976 21.860 1.00 0.00 C ATOM 0 H LEU A 56 36.339 41.524 20.176 1.00 0.00 H new ATOM 0 HA LEU A 56 37.249 41.640 22.806 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.264 43.363 21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.057 43.827 22.775 1.00 0.00 H new ATOM 0 HG LEU A 56 37.502 43.176 20.223 1.00 0.00 H new ATOM 0 HD11 LEU A 56 37.779 45.686 20.027 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.066 45.208 19.968 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.751 45.885 21.465 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.401 44.414 21.232 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.457 44.614 22.728 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.942 42.987 22.192 1.00 0.00 H new ATOM 904 N SER A 57 34.060 40.909 22.634 1.00 0.00 N ATOM 905 CA SER A 57 32.989 40.279 23.378 1.00 0.00 C ATOM 906 C SER A 57 33.407 38.975 24.060 1.00 0.00 C ATOM 907 O SER A 57 33.009 38.753 25.202 1.00 0.00 O ATOM 908 CB SER A 57 31.803 39.975 22.466 1.00 0.00 C ATOM 909 OG SER A 57 31.143 41.156 22.072 1.00 0.00 O ATOM 0 H SER A 57 33.852 41.012 21.641 1.00 0.00 H new ATOM 0 HA SER A 57 32.715 40.996 24.152 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.149 39.438 21.583 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.102 39.320 22.984 1.00 0.00 H new ATOM 0 HG SER A 57 30.389 40.930 21.488 1.00 0.00 H new ATOM 915 N ASP A 58 34.228 38.142 23.427 1.00 0.00 N ATOM 916 CA ASP A 58 34.676 36.876 23.973 1.00 0.00 C ATOM 917 C ASP A 58 35.561 37.016 25.213 1.00 0.00 C ATOM 918 O ASP A 58 35.651 36.081 26.004 1.00 0.00 O ATOM 919 CB ASP A 58 35.443 36.066 22.932 1.00 0.00 C ATOM 920 CG ASP A 58 34.600 35.658 21.722 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.502 35.094 21.919 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.050 35.881 20.576 1.00 0.00 O ATOM 0 H ASP A 58 34.606 38.338 22.500 1.00 0.00 H new ATOM 0 HA ASP A 58 33.761 36.362 24.267 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.297 36.650 22.588 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.841 35.168 23.405 1.00 0.00 H new ATOM 927 N TYR A 59 36.177 38.181 25.402 1.00 0.00 N ATOM 928 CA TYR A 59 36.957 38.542 26.567 1.00 0.00 C ATOM 929 C TYR A 59 36.239 39.504 27.516 1.00 0.00 C ATOM 930 O TYR A 59 36.855 39.988 28.463 1.00 0.00 O ATOM 931 CB TYR A 59 38.327 39.049 26.124 1.00 0.00 C ATOM 932 CG TYR A 59 39.156 38.052 25.349 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.758 36.973 26.007 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.370 38.239 23.979 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.562 36.072 25.298 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.189 37.358 23.261 1.00 0.00 C ATOM 937 CZ TYR A 59 40.776 36.258 23.918 1.00 0.00 C ATOM 938 OH TYR A 59 41.561 35.394 23.213 1.00 0.00 O ATOM 0 H TYR A 59 36.139 38.929 24.710 1.00 0.00 H new ATOM 0 HA TYR A 59 37.097 37.643 27.167 1.00 0.00 H new ATOM 0 HB2 TYR A 59 38.187 39.938 25.510 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.887 39.356 27.007 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.602 36.835 27.067 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.900 39.069 23.471 1.00 0.00 H new ATOM 0 HE1 TYR A 59 41.017 35.236 25.808 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.370 37.521 22.209 1.00 0.00 H new ATOM 0 HH TYR A 59 41.727 35.758 22.319 1.00 0.00 H new ATOM 948 N ASN A 60 34.953 39.773 27.309 1.00 0.00 N ATOM 949 CA ASN A 60 34.141 40.641 28.136 1.00 0.00 C ATOM 950 C ASN A 60 34.708 42.054 28.286 1.00 0.00 C ATOM 951 O ASN A 60 34.793 42.599 29.384 1.00 0.00 O ATOM 952 CB ASN A 60 33.759 39.917 29.424 1.00 0.00 C ATOM 953 CG ASN A 60 32.492 40.466 30.082 1.00 0.00 C ATOM 954 OD1 ASN A 60 32.065 41.599 29.871 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.800 39.645 30.867 1.00 0.00 N ATOM 0 H ASN A 60 34.433 39.373 26.528 1.00 0.00 H new ATOM 0 HA ASN A 60 33.201 40.848 27.624 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.616 38.858 29.207 1.00 0.00 H new ATOM 0 HB3 ASN A 60 34.586 39.989 30.131 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.925 39.958 31.287 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.145 38.702 31.049 1.00 0.00 H new ATOM 962 N ILE A 61 35.114 42.648 27.167 1.00 0.00 N ATOM 963 CA ILE A 61 35.554 44.024 27.065 1.00 0.00 C ATOM 964 C ILE A 61 34.345 44.946 26.898 1.00 0.00 C ATOM 965 O ILE A 61 33.325 44.562 26.329 1.00 0.00 O ATOM 966 CB ILE A 61 36.617 44.136 25.975 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.884 43.415 26.423 1.00 0.00 C ATOM 968 CG2 ILE A 61 36.952 45.579 25.607 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.898 43.136 25.316 1.00 0.00 C ATOM 0 H ILE A 61 35.144 42.158 26.273 1.00 0.00 H new ATOM 0 HA ILE A 61 36.039 44.358 27.982 1.00 0.00 H new ATOM 0 HB ILE A 61 36.204 43.670 25.080 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.369 44.012 27.196 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.601 42.468 26.882 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.714 45.588 24.827 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.055 46.080 25.244 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.327 46.101 26.487 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.762 42.621 25.736 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.439 42.510 24.551 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.218 44.078 24.870 1.00 0.00 H new ATOM 981 N GLN A 62 34.454 46.155 27.440 1.00 0.00 N ATOM 982 CA GLN A 62 33.398 47.134 27.604 1.00 0.00 C ATOM 983 C GLN A 62 33.872 48.574 27.395 1.00 0.00 C ATOM 984 O GLN A 62 35.066 48.819 27.234 1.00 0.00 O ATOM 985 CB GLN A 62 32.806 46.951 28.998 1.00 0.00 C ATOM 986 CG GLN A 62 31.636 45.971 29.004 1.00 0.00 C ATOM 987 CD GLN A 62 30.394 46.515 28.298 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.303 47.680 27.915 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.375 45.687 28.091 1.00 0.00 N ATOM 0 H GLN A 62 35.346 46.495 27.799 1.00 0.00 H new ATOM 0 HA GLN A 62 32.645 46.965 26.835 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.581 46.593 29.676 1.00 0.00 H new ATOM 0 HB3 GLN A 62 32.471 47.916 29.378 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.944 45.044 28.521 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.382 45.724 30.035 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.434 44.718 28.402 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.534 46.021 27.621 1.00 0.00 H new ATOM 998 N LYS A 63 32.957 49.538 27.437 1.00 0.00 N ATOM 999 CA LYS A 63 33.269 50.952 27.403 1.00 0.00 C ATOM 1000 C LYS A 63 34.347 51.332 28.420 1.00 0.00 C ATOM 1001 O LYS A 63 34.289 50.897 29.569 1.00 0.00 O ATOM 1002 CB LYS A 63 32.033 51.795 27.707 1.00 0.00 C ATOM 1003 CG LYS A 63 30.931 51.741 26.654 1.00 0.00 C ATOM 1004 CD LYS A 63 29.753 52.652 26.984 1.00 0.00 C ATOM 1005 CE LYS A 63 30.020 54.152 26.900 1.00 0.00 C ATOM 1006 NZ LYS A 63 30.555 54.749 28.135 1.00 0.00 N ATOM 0 H LYS A 63 31.957 49.347 27.497 1.00 0.00 H new ATOM 0 HA LYS A 63 33.633 51.152 26.395 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.617 51.470 28.661 1.00 0.00 H new ATOM 0 HB3 LYS A 63 32.343 52.833 27.832 1.00 0.00 H new ATOM 0 HG2 LYS A 63 31.345 52.026 25.687 1.00 0.00 H new ATOM 0 HG3 LYS A 63 30.575 50.715 26.559 1.00 0.00 H new ATOM 0 HD2 LYS A 63 28.933 52.411 26.307 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.412 52.420 27.993 1.00 0.00 H new ATOM 0 HE2 LYS A 63 30.723 54.338 26.088 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.091 54.659 26.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 30.289 55.754 28.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.162 54.251 28.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 31.592 54.664 28.141 1.00 0.00 H new ATOM 1020 N GLU A 64 35.294 52.172 28.014 1.00 0.00 N ATOM 1021 CA GLU A 64 36.401 52.635 28.827 1.00 0.00 C ATOM 1022 C GLU A 64 37.236 51.509 29.439 1.00 0.00 C ATOM 1023 O GLU A 64 37.706 51.622 30.569 1.00 0.00 O ATOM 1024 CB GLU A 64 35.951 53.680 29.843 1.00 0.00 C ATOM 1025 CG GLU A 64 35.472 55.002 29.250 1.00 0.00 C ATOM 1026 CD GLU A 64 34.033 54.997 28.731 1.00 0.00 C ATOM 1027 OE1 GLU A 64 33.823 55.344 27.549 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.088 54.745 29.509 1.00 0.00 O ATOM 0 H GLU A 64 35.307 52.561 27.071 1.00 0.00 H new ATOM 0 HA GLU A 64 37.091 53.134 28.147 1.00 0.00 H new ATOM 0 HB2 GLU A 64 35.145 53.257 30.443 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.780 53.884 30.521 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.565 55.778 30.010 1.00 0.00 H new ATOM 0 HG3 GLU A 64 36.136 55.277 28.431 1.00 0.00 H new ATOM 1035 N SER A 65 37.408 50.381 28.755 1.00 0.00 N ATOM 1036 CA SER A 65 38.314 49.341 29.197 1.00 0.00 C ATOM 1037 C SER A 65 39.772 49.768 29.017 1.00 0.00 C ATOM 1038 O SER A 65 40.125 50.250 27.943 1.00 0.00 O ATOM 1039 CB SER A 65 38.091 48.030 28.449 1.00 0.00 C ATOM 1040 OG SER A 65 36.805 47.523 28.723 1.00 0.00 O ATOM 0 H SER A 65 36.923 50.169 27.883 1.00 0.00 H new ATOM 0 HA SER A 65 38.104 49.181 30.255 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.205 48.191 27.377 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.847 47.302 28.744 1.00 0.00 H new ATOM 0 HG SER A 65 36.129 48.169 28.429 1.00 0.00 H new ATOM 1046 N THR A 66 40.619 49.553 30.021 1.00 0.00 N ATOM 1047 CA THR A 66 42.055 49.725 29.919 1.00 0.00 C ATOM 1048 C THR A 66 42.717 48.368 29.674 1.00 0.00 C ATOM 1049 O THR A 66 42.645 47.470 30.511 1.00 0.00 O ATOM 1050 CB THR A 66 42.642 50.406 31.151 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.121 51.711 31.273 1.00 0.00 O ATOM 1052 CG2 THR A 66 44.155 50.584 31.059 1.00 0.00 C ATOM 0 H THR A 66 40.314 49.248 30.945 1.00 0.00 H new ATOM 0 HA THR A 66 42.258 50.383 29.074 1.00 0.00 H new ATOM 0 HB THR A 66 42.386 49.764 31.994 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.501 52.142 32.067 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.519 51.074 31.962 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.631 49.608 30.958 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.397 51.197 30.191 1.00 0.00 H new ATOM 1060 N LEU A 67 43.374 48.222 28.527 1.00 0.00 N ATOM 1061 CA LEU A 67 44.138 47.059 28.120 1.00 0.00 C ATOM 1062 C LEU A 67 45.624 47.386 28.277 1.00 0.00 C ATOM 1063 O LEU A 67 46.071 48.442 27.836 1.00 0.00 O ATOM 1064 CB LEU A 67 43.812 46.718 26.669 1.00 0.00 C ATOM 1065 CG LEU A 67 42.493 46.003 26.389 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.237 46.770 26.791 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.398 45.719 24.893 1.00 0.00 C ATOM 0 H LEU A 67 43.385 48.957 27.820 1.00 0.00 H new ATOM 0 HA LEU A 67 43.887 46.197 28.738 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.819 47.645 26.096 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.619 46.097 26.280 1.00 0.00 H new ATOM 0 HG LEU A 67 42.517 45.102 27.002 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.355 46.176 26.550 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.259 46.969 27.863 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.198 47.714 26.248 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.459 45.208 24.679 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.434 46.658 24.341 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.233 45.088 24.589 1.00 0.00 H new ATOM 1079 N HIS A 68 46.402 46.487 28.873 1.00 0.00 N ATOM 1080 CA HIS A 68 47.820 46.692 29.095 1.00 0.00 C ATOM 1081 C HIS A 68 48.649 46.008 28.006 1.00 0.00 C ATOM 1082 O HIS A 68 48.381 44.866 27.639 1.00 0.00 O ATOM 1083 CB HIS A 68 48.196 46.268 30.511 1.00 0.00 C ATOM 1084 CG HIS A 68 47.526 47.110 31.561 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.594 46.650 32.489 1.00 0.00 N ATOM 1086 CD2 HIS A 68 47.732 48.449 31.777 1.00 0.00 C ATOM 1087 CE1 HIS A 68 46.252 47.704 33.234 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.920 48.800 32.837 1.00 0.00 N ATOM 0 H HIS A 68 46.058 45.590 29.216 1.00 0.00 H new ATOM 0 HA HIS A 68 48.053 47.754 29.017 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.923 45.223 30.659 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.277 46.335 30.632 1.00 0.00 H new ATOM 0 HD2 HIS A 68 48.397 49.099 31.227 1.00 0.00 H new ATOM 0 HE1 HIS A 68 45.537 47.679 34.043 1.00 0.00 H new ATOM 0 HE2 HIS A 68 46.841 49.730 33.248 1.00 0.00 H new ATOM 1096 N LEU A 69 49.647 46.718 27.489 1.00 0.00 N ATOM 1097 CA LEU A 69 50.450 46.365 26.335 1.00 0.00 C ATOM 1098 C LEU A 69 51.925 46.249 26.724 1.00 0.00 C ATOM 1099 O LEU A 69 52.490 47.178 27.295 1.00 0.00 O ATOM 1100 CB LEU A 69 50.198 47.424 25.266 1.00 0.00 C ATOM 1101 CG LEU A 69 51.086 47.353 24.026 1.00 0.00 C ATOM 1102 CD1 LEU A 69 50.926 46.048 23.253 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.737 48.495 23.075 1.00 0.00 C ATOM 0 H LEU A 69 49.930 47.610 27.894 1.00 0.00 H new ATOM 0 HA LEU A 69 50.172 45.388 25.939 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.158 47.349 24.948 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.322 48.407 25.721 1.00 0.00 H new ATOM 0 HG LEU A 69 52.114 47.422 24.383 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.583 46.058 22.383 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.189 45.209 23.897 1.00 0.00 H new ATOM 0 HD13 LEU A 69 49.892 45.943 22.926 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.373 48.440 22.192 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.692 48.413 22.775 1.00 0.00 H new ATOM 0 HD23 LEU A 69 50.896 49.449 23.578 1.00 0.00 H new ATOM 1115 N VAL A 70 52.545 45.120 26.392 1.00 0.00 N ATOM 1116 CA VAL A 70 53.897 44.780 26.786 1.00 0.00 C ATOM 1117 C VAL A 70 54.708 44.253 25.600 1.00 0.00 C ATOM 1118 O VAL A 70 54.271 43.345 24.896 1.00 0.00 O ATOM 1119 CB VAL A 70 53.871 43.753 27.914 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.279 43.375 28.363 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.126 44.270 29.141 1.00 0.00 C ATOM 0 H VAL A 70 52.101 44.398 25.824 1.00 0.00 H new ATOM 0 HA VAL A 70 54.384 45.687 27.143 1.00 0.00 H new ATOM 0 HB VAL A 70 53.357 42.883 27.505 1.00 0.00 H new ATOM 0 HG11 VAL A 70 55.220 42.642 29.167 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.827 42.948 27.523 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.798 44.264 28.720 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.132 43.507 29.919 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.616 45.170 29.512 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.096 44.503 28.870 1.00 0.00 H new