USER MOD reduce.3.24.130724 H: found=0, std=0, add=675, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 672 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 171:sc= 0 (180deg=-0.0728) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.0139 (180deg=0) USER MOD Single : A 9 CYS SG : rot 48:sc= -0.282 USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 16 MET CE :methyl 157:sc= -0.34 (180deg=-0.654) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -3.71! USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.0523 K(o=-0.052,f=-2.2!) USER MOD Single : A 42 LYS NZ :NH3+ -163:sc= -0.0222 (180deg=-0.238) USER MOD Single : A 43 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 48:sc= 0.079 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc=-0.00174 K(o=-0.0017,f=-1) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.159 K(o=-0.16,f=-1.4!) USER MOD Single : A 72 TYR OH : rot -155:sc= 0.308 USER MOD Single : A 76 LYS NZ :NH3+ 147:sc= -0.0862 (180deg=-1.25) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 39:sc= 1.16 USER MOD Single : A 83 SER OG : rot 180:sc= -0.254 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.008 0.437 -3.232 1.00 0.00 N ATOM 2 CA MET A 1 1.496 0.023 -4.543 1.00 0.00 C ATOM 3 C MET A 1 3.019 -0.060 -4.555 1.00 0.00 C ATOM 4 O MET A 1 3.700 0.776 -3.963 1.00 0.00 O ATOM 5 CB MET A 1 1.018 0.998 -5.620 1.00 0.00 C ATOM 6 CG MET A 1 -0.420 0.766 -6.056 1.00 0.00 C ATOM 7 SD MET A 1 -0.975 1.960 -7.287 1.00 0.00 S ATOM 8 CE MET A 1 -0.118 1.367 -8.744 1.00 0.00 C ATOM 0 H1 MET A 1 0.251 1.140 -3.350 1.00 0.00 H new ATOM 0 H2 MET A 1 0.637 -0.390 -2.723 1.00 0.00 H new ATOM 0 H3 MET A 1 1.788 0.857 -2.688 1.00 0.00 H new ATOM 0 HA MET A 1 1.094 -0.968 -4.756 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.115 2.017 -5.245 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.670 0.915 -6.489 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.514 -0.240 -6.464 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.073 0.819 -5.185 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.481 1.901 -9.622 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.953 1.538 -8.631 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.304 0.300 -8.866 1.00 0.00 H new ATOM 18 N GLY A 2 3.547 -1.074 -5.235 1.00 0.00 N ATOM 19 CA GLY A 2 4.986 -1.247 -5.311 1.00 0.00 C ATOM 20 C GLY A 2 5.407 -2.089 -6.498 1.00 0.00 C ATOM 21 O GLY A 2 5.668 -3.284 -6.360 1.00 0.00 O ATOM 0 H GLY A 2 3.004 -1.778 -5.734 1.00 0.00 H new ATOM 0 HA2 GLY A 2 5.463 -0.269 -5.376 1.00 0.00 H new ATOM 0 HA3 GLY A 2 5.341 -1.715 -4.393 1.00 0.00 H new ATOM 25 N VAL A 3 5.471 -1.466 -7.671 1.00 0.00 N ATOM 26 CA VAL A 3 5.863 -2.167 -8.888 1.00 0.00 C ATOM 27 C VAL A 3 7.192 -2.890 -8.703 1.00 0.00 C ATOM 28 O VAL A 3 8.107 -2.375 -8.058 1.00 0.00 O ATOM 29 CB VAL A 3 5.979 -1.198 -10.080 1.00 0.00 C ATOM 30 CG1 VAL A 3 6.413 -1.944 -11.333 1.00 0.00 C ATOM 31 CG2 VAL A 3 4.661 -0.475 -10.309 1.00 0.00 C ATOM 0 H VAL A 3 5.256 -0.478 -7.804 1.00 0.00 H new ATOM 0 HA VAL A 3 5.082 -2.898 -9.098 1.00 0.00 H new ATOM 0 HB VAL A 3 6.740 -0.452 -9.848 1.00 0.00 H new ATOM 0 HG11 VAL A 3 6.490 -1.244 -12.165 1.00 0.00 H new ATOM 0 HG12 VAL A 3 7.383 -2.411 -11.161 1.00 0.00 H new ATOM 0 HG13 VAL A 3 5.678 -2.712 -11.572 1.00 0.00 H new ATOM 0 HG21 VAL A 3 4.761 0.205 -11.155 1.00 0.00 H new ATOM 0 HG22 VAL A 3 3.878 -1.204 -10.520 1.00 0.00 H new ATOM 0 HG23 VAL A 3 4.397 0.092 -9.416 1.00 0.00 H new ATOM 41 N LEU A 4 7.293 -4.086 -9.272 1.00 0.00 N ATOM 42 CA LEU A 4 8.512 -4.881 -9.171 1.00 0.00 C ATOM 43 C LEU A 4 9.624 -4.284 -10.027 1.00 0.00 C ATOM 44 O LEU A 4 9.478 -4.142 -11.241 1.00 0.00 O ATOM 45 CB LEU A 4 8.240 -6.324 -9.601 1.00 0.00 C ATOM 46 CG LEU A 4 7.188 -7.079 -8.789 1.00 0.00 C ATOM 47 CD1 LEU A 4 5.806 -6.888 -9.396 1.00 0.00 C ATOM 48 CD2 LEU A 4 7.537 -8.558 -8.709 1.00 0.00 C ATOM 0 H LEU A 4 6.546 -4.527 -9.808 1.00 0.00 H new ATOM 0 HA LEU A 4 8.836 -4.873 -8.130 1.00 0.00 H new ATOM 0 HB2 LEU A 4 7.928 -6.318 -10.646 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.176 -6.880 -9.551 1.00 0.00 H new ATOM 0 HG LEU A 4 7.177 -6.673 -7.778 1.00 0.00 H new ATOM 0 HD11 LEU A 4 5.070 -7.433 -8.804 1.00 0.00 H new ATOM 0 HD12 LEU A 4 5.554 -5.827 -9.401 1.00 0.00 H new ATOM 0 HD13 LEU A 4 5.802 -7.267 -10.418 1.00 0.00 H new ATOM 0 HD21 LEU A 4 6.777 -9.080 -8.127 1.00 0.00 H new ATOM 0 HD22 LEU A 4 7.576 -8.977 -9.714 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.508 -8.677 -8.228 1.00 0.00 H new ATOM 60 N ARG A 5 10.736 -3.938 -9.387 1.00 0.00 N ATOM 61 CA ARG A 5 11.874 -3.357 -10.089 1.00 0.00 C ATOM 62 C ARG A 5 13.150 -4.142 -9.799 1.00 0.00 C ATOM 63 O ARG A 5 13.298 -4.732 -8.729 1.00 0.00 O ATOM 64 CB ARG A 5 12.058 -1.894 -9.684 1.00 0.00 C ATOM 65 CG ARG A 5 12.394 -1.707 -8.213 1.00 0.00 C ATOM 66 CD ARG A 5 11.141 -1.496 -7.378 1.00 0.00 C ATOM 67 NE ARG A 5 10.398 -0.310 -7.796 1.00 0.00 N ATOM 68 CZ ARG A 5 10.807 0.932 -7.564 1.00 0.00 C ATOM 69 NH1 ARG A 5 11.946 1.150 -6.923 1.00 0.00 N ATOM 70 NH2 ARG A 5 10.075 1.960 -7.976 1.00 0.00 N ATOM 0 H ARG A 5 10.873 -4.050 -8.382 1.00 0.00 H new ATOM 0 HA ARG A 5 11.673 -3.407 -11.159 1.00 0.00 H new ATOM 0 HB2 ARG A 5 12.852 -1.456 -10.288 1.00 0.00 H new ATOM 0 HB3 ARG A 5 11.144 -1.345 -9.912 1.00 0.00 H new ATOM 0 HG2 ARG A 5 12.933 -2.581 -7.848 1.00 0.00 H new ATOM 0 HG3 ARG A 5 13.059 -0.851 -8.096 1.00 0.00 H new ATOM 0 HD2 ARG A 5 10.499 -2.373 -7.459 1.00 0.00 H new ATOM 0 HD3 ARG A 5 11.417 -1.399 -6.328 1.00 0.00 H new ATOM 0 HE ARG A 5 9.517 -0.443 -8.293 1.00 0.00 H new ATOM 0 HH11 ARG A 5 12.512 0.363 -6.606 1.00 0.00 H new ATOM 0 HH12 ARG A 5 12.257 2.105 -6.747 1.00 0.00 H new ATOM 0 HH21 ARG A 5 9.198 1.796 -8.471 1.00 0.00 H new ATOM 0 HH22 ARG A 5 10.389 2.914 -7.798 1.00 0.00 H new ATOM 84 N VAL A 6 14.069 -4.143 -10.760 1.00 0.00 N ATOM 85 CA VAL A 6 15.333 -4.854 -10.607 1.00 0.00 C ATOM 86 C VAL A 6 16.128 -4.313 -9.425 1.00 0.00 C ATOM 87 O VAL A 6 16.204 -3.103 -9.215 1.00 0.00 O ATOM 88 CB VAL A 6 16.192 -4.750 -11.881 1.00 0.00 C ATOM 89 CG1 VAL A 6 15.405 -5.216 -13.096 1.00 0.00 C ATOM 90 CG2 VAL A 6 16.690 -3.325 -12.072 1.00 0.00 C ATOM 0 H VAL A 6 13.962 -3.660 -11.652 1.00 0.00 H new ATOM 0 HA VAL A 6 15.088 -5.901 -10.427 1.00 0.00 H new ATOM 0 HB VAL A 6 17.058 -5.402 -11.768 1.00 0.00 H new ATOM 0 HG11 VAL A 6 16.029 -5.135 -13.986 1.00 0.00 H new ATOM 0 HG12 VAL A 6 15.103 -6.254 -12.958 1.00 0.00 H new ATOM 0 HG13 VAL A 6 14.519 -4.593 -13.216 1.00 0.00 H new ATOM 0 HG21 VAL A 6 17.295 -3.269 -12.977 1.00 0.00 H new ATOM 0 HG22 VAL A 6 15.838 -2.651 -12.163 1.00 0.00 H new ATOM 0 HG23 VAL A 6 17.294 -3.032 -11.213 1.00 0.00 H new ATOM 100 N GLY A 7 16.721 -5.219 -8.653 1.00 0.00 N ATOM 101 CA GLY A 7 17.504 -4.814 -7.500 1.00 0.00 C ATOM 102 C GLY A 7 16.709 -4.870 -6.211 1.00 0.00 C ATOM 103 O GLY A 7 17.251 -4.641 -5.128 1.00 0.00 O ATOM 0 H GLY A 7 16.673 -6.226 -8.806 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.378 -5.460 -7.413 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.872 -3.799 -7.653 1.00 0.00 H new ATOM 107 N LEU A 8 15.421 -5.172 -6.325 1.00 0.00 N ATOM 108 CA LEU A 8 14.548 -5.255 -5.158 1.00 0.00 C ATOM 109 C LEU A 8 14.910 -6.457 -4.292 1.00 0.00 C ATOM 110 O LEU A 8 14.688 -6.452 -3.081 1.00 0.00 O ATOM 111 CB LEU A 8 13.086 -5.350 -5.597 1.00 0.00 C ATOM 112 CG LEU A 8 12.594 -6.741 -5.999 1.00 0.00 C ATOM 113 CD1 LEU A 8 11.901 -7.421 -4.828 1.00 0.00 C ATOM 114 CD2 LEU A 8 11.659 -6.651 -7.196 1.00 0.00 C ATOM 0 H LEU A 8 14.957 -5.364 -7.213 1.00 0.00 H new ATOM 0 HA LEU A 8 14.685 -4.350 -4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.459 -4.986 -4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.936 -4.676 -6.440 1.00 0.00 H new ATOM 0 HG LEU A 8 13.457 -7.343 -6.283 1.00 0.00 H new ATOM 0 HD11 LEU A 8 11.558 -8.410 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU A 8 12.601 -7.520 -3.998 1.00 0.00 H new ATOM 0 HD13 LEU A 8 11.047 -6.822 -4.513 1.00 0.00 H new ATOM 0 HD21 LEU A 8 11.319 -7.650 -7.468 1.00 0.00 H new ATOM 0 HD22 LEU A 8 10.799 -6.032 -6.940 1.00 0.00 H new ATOM 0 HD23 LEU A 8 12.188 -6.206 -8.039 1.00 0.00 H new ATOM 126 N CYS A 9 15.471 -7.485 -4.920 1.00 0.00 N ATOM 127 CA CYS A 9 15.865 -8.694 -4.206 1.00 0.00 C ATOM 128 C CYS A 9 16.776 -9.562 -5.069 1.00 0.00 C ATOM 129 O CYS A 9 16.816 -9.437 -6.293 1.00 0.00 O ATOM 130 CB CYS A 9 14.629 -9.491 -3.787 1.00 0.00 C ATOM 131 SG CYS A 9 14.202 -9.324 -2.038 1.00 0.00 S ATOM 0 H CYS A 9 15.663 -7.505 -5.922 1.00 0.00 H new ATOM 0 HA CYS A 9 16.415 -8.396 -3.313 1.00 0.00 H new ATOM 0 HB2 CYS A 9 13.780 -9.168 -4.390 1.00 0.00 H new ATOM 0 HB3 CYS A 9 14.796 -10.545 -4.010 1.00 0.00 H new ATOM 0 HG CYS A 9 14.219 -8.067 -1.705 1.00 0.00 H new ATOM 137 N PRO A 10 17.525 -10.464 -4.418 1.00 0.00 N ATOM 138 CA PRO A 10 18.450 -11.369 -5.106 1.00 0.00 C ATOM 139 C PRO A 10 17.722 -12.426 -5.930 1.00 0.00 C ATOM 140 O PRO A 10 18.104 -12.716 -7.062 1.00 0.00 O ATOM 141 CB PRO A 10 19.223 -12.025 -3.959 1.00 0.00 C ATOM 142 CG PRO A 10 18.306 -11.944 -2.788 1.00 0.00 C ATOM 143 CD PRO A 10 17.528 -10.668 -2.960 1.00 0.00 C ATOM 0 HA PRO A 10 19.083 -10.840 -5.818 1.00 0.00 H new ATOM 0 HB2 PRO A 10 19.476 -13.059 -4.193 1.00 0.00 H new ATOM 0 HB3 PRO A 10 20.160 -11.504 -3.764 1.00 0.00 H new ATOM 0 HG2 PRO A 10 17.640 -12.806 -2.754 1.00 0.00 H new ATOM 0 HG3 PRO A 10 18.866 -11.937 -1.853 1.00 0.00 H new ATOM 0 HD2 PRO A 10 16.516 -10.758 -2.565 1.00 0.00 H new ATOM 0 HD3 PRO A 10 18.001 -9.836 -2.439 1.00 0.00 H new ATOM 151 N GLY A 11 16.669 -12.997 -5.353 1.00 0.00 N ATOM 152 CA GLY A 11 15.903 -14.015 -6.049 1.00 0.00 C ATOM 153 C GLY A 11 15.358 -13.525 -7.375 1.00 0.00 C ATOM 154 O GLY A 11 15.581 -14.146 -8.415 1.00 0.00 O ATOM 0 H GLY A 11 16.333 -12.773 -4.416 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.534 -14.887 -6.219 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.076 -14.338 -5.417 1.00 0.00 H new ATOM 158 N LEU A 12 14.639 -12.408 -7.341 1.00 0.00 N ATOM 159 CA LEU A 12 14.059 -11.834 -8.550 1.00 0.00 C ATOM 160 C LEU A 12 15.149 -11.360 -9.506 1.00 0.00 C ATOM 161 O LEU A 12 16.101 -10.693 -9.098 1.00 0.00 O ATOM 162 CB LEU A 12 13.135 -10.668 -8.193 1.00 0.00 C ATOM 163 CG LEU A 12 11.659 -11.016 -7.999 1.00 0.00 C ATOM 164 CD1 LEU A 12 10.875 -9.789 -7.560 1.00 0.00 C ATOM 165 CD2 LEU A 12 11.075 -11.595 -9.279 1.00 0.00 C ATOM 0 H LEU A 12 14.444 -11.882 -6.489 1.00 0.00 H new ATOM 0 HA LEU A 12 13.478 -12.610 -9.048 1.00 0.00 H new ATOM 0 HB2 LEU A 12 13.502 -10.207 -7.276 1.00 0.00 H new ATOM 0 HB3 LEU A 12 13.210 -9.917 -8.980 1.00 0.00 H new ATOM 0 HG LEU A 12 11.583 -11.770 -7.215 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.827 -10.056 -7.427 1.00 0.00 H new ATOM 0 HD12 LEU A 12 11.278 -9.418 -6.617 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.958 -9.013 -8.321 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.024 -11.837 -9.122 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.163 -10.864 -10.083 1.00 0.00 H new ATOM 0 HD23 LEU A 12 11.619 -12.500 -9.550 1.00 0.00 H new ATOM 177 N THR A 13 15.003 -11.707 -10.781 1.00 0.00 N ATOM 178 CA THR A 13 15.974 -11.316 -11.795 1.00 0.00 C ATOM 179 C THR A 13 15.351 -10.372 -12.817 1.00 0.00 C ATOM 180 O THR A 13 14.133 -10.338 -12.983 1.00 0.00 O ATOM 181 CB THR A 13 16.545 -12.544 -12.529 1.00 0.00 C ATOM 182 OG1 THR A 13 17.339 -12.123 -13.644 1.00 0.00 O ATOM 183 CG2 THR A 13 15.426 -13.455 -13.011 1.00 0.00 C ATOM 0 H THR A 13 14.221 -12.258 -11.136 1.00 0.00 H new ATOM 0 HA THR A 13 16.784 -10.803 -11.276 1.00 0.00 H new ATOM 0 HB THR A 13 17.169 -13.101 -11.829 1.00 0.00 H new ATOM 0 HG1 THR A 13 17.700 -12.909 -14.104 1.00 0.00 H new ATOM 0 HG21 THR A 13 15.854 -14.315 -13.526 1.00 0.00 H new ATOM 0 HG22 THR A 13 14.842 -13.797 -12.157 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.780 -12.906 -13.696 1.00 0.00 H new ATOM 191 N GLU A 14 16.197 -9.606 -13.501 1.00 0.00 N ATOM 192 CA GLU A 14 15.727 -8.661 -14.507 1.00 0.00 C ATOM 193 C GLU A 14 14.945 -9.378 -15.604 1.00 0.00 C ATOM 194 O GLU A 14 14.069 -8.793 -16.238 1.00 0.00 O ATOM 195 CB GLU A 14 16.909 -7.905 -15.119 1.00 0.00 C ATOM 196 CG GLU A 14 17.877 -7.352 -14.087 1.00 0.00 C ATOM 197 CD GLU A 14 18.622 -6.128 -14.583 1.00 0.00 C ATOM 198 OE1 GLU A 14 18.743 -5.967 -15.816 1.00 0.00 O ATOM 199 OE2 GLU A 14 19.083 -5.331 -13.739 1.00 0.00 O ATOM 0 H GLU A 14 17.209 -9.622 -13.377 1.00 0.00 H new ATOM 0 HA GLU A 14 15.063 -7.949 -14.018 1.00 0.00 H new ATOM 0 HB2 GLU A 14 17.449 -8.573 -15.790 1.00 0.00 H new ATOM 0 HB3 GLU A 14 16.529 -7.083 -15.726 1.00 0.00 H new ATOM 0 HG2 GLU A 14 17.329 -7.096 -13.180 1.00 0.00 H new ATOM 0 HG3 GLU A 14 18.596 -8.126 -13.817 1.00 0.00 H new ATOM 206 N GLU A 15 15.271 -10.649 -15.821 1.00 0.00 N ATOM 207 CA GLU A 15 14.600 -11.445 -16.842 1.00 0.00 C ATOM 208 C GLU A 15 13.101 -11.530 -16.567 1.00 0.00 C ATOM 209 O GLU A 15 12.283 -11.335 -17.465 1.00 0.00 O ATOM 210 CB GLU A 15 15.200 -12.851 -16.899 1.00 0.00 C ATOM 211 CG GLU A 15 16.235 -13.026 -17.998 1.00 0.00 C ATOM 212 CD GLU A 15 17.088 -14.265 -17.803 1.00 0.00 C ATOM 213 OE1 GLU A 15 16.659 -15.355 -18.236 1.00 0.00 O ATOM 214 OE2 GLU A 15 18.185 -14.144 -17.218 1.00 0.00 O ATOM 0 H GLU A 15 15.995 -11.148 -15.304 1.00 0.00 H new ATOM 0 HA GLU A 15 14.748 -10.955 -17.805 1.00 0.00 H new ATOM 0 HB2 GLU A 15 15.660 -13.080 -15.938 1.00 0.00 H new ATOM 0 HB3 GLU A 15 14.398 -13.574 -17.048 1.00 0.00 H new ATOM 0 HG2 GLU A 15 15.730 -13.085 -18.962 1.00 0.00 H new ATOM 0 HG3 GLU A 15 16.879 -12.147 -18.029 1.00 0.00 H new ATOM 221 N MET A 16 12.750 -11.824 -15.319 1.00 0.00 N ATOM 222 CA MET A 16 11.350 -11.935 -14.926 1.00 0.00 C ATOM 223 C MET A 16 10.634 -10.597 -15.081 1.00 0.00 C ATOM 224 O MET A 16 9.437 -10.553 -15.365 1.00 0.00 O ATOM 225 CB MET A 16 11.242 -12.421 -13.479 1.00 0.00 C ATOM 226 CG MET A 16 10.314 -13.612 -13.306 1.00 0.00 C ATOM 227 SD MET A 16 9.406 -13.564 -11.749 1.00 0.00 S ATOM 228 CE MET A 16 10.075 -15.005 -10.922 1.00 0.00 C ATOM 0 H MET A 16 13.415 -11.989 -14.563 1.00 0.00 H new ATOM 0 HA MET A 16 10.870 -12.661 -15.582 1.00 0.00 H new ATOM 0 HB2 MET A 16 12.235 -12.690 -13.119 1.00 0.00 H new ATOM 0 HB3 MET A 16 10.888 -11.601 -12.854 1.00 0.00 H new ATOM 0 HG2 MET A 16 9.606 -13.639 -14.134 1.00 0.00 H new ATOM 0 HG3 MET A 16 10.897 -14.532 -13.354 1.00 0.00 H new ATOM 0 HE1 MET A 16 9.947 -14.899 -9.845 1.00 0.00 H new ATOM 0 HE2 MET A 16 9.550 -15.897 -11.264 1.00 0.00 H new ATOM 0 HE3 MET A 16 11.136 -15.098 -11.154 1.00 0.00 H new ATOM 238 N ILE A 17 11.374 -9.510 -14.891 1.00 0.00 N ATOM 239 CA ILE A 17 10.809 -8.172 -15.010 1.00 0.00 C ATOM 240 C ILE A 17 10.306 -7.912 -16.426 1.00 0.00 C ATOM 241 O ILE A 17 9.194 -7.423 -16.620 1.00 0.00 O ATOM 242 CB ILE A 17 11.840 -7.090 -14.637 1.00 0.00 C ATOM 243 CG1 ILE A 17 12.518 -7.437 -13.310 1.00 0.00 C ATOM 244 CG2 ILE A 17 11.170 -5.727 -14.555 1.00 0.00 C ATOM 245 CD1 ILE A 17 11.543 -7.670 -12.176 1.00 0.00 C ATOM 0 H ILE A 17 12.366 -9.530 -14.654 1.00 0.00 H new ATOM 0 HA ILE A 17 9.972 -8.120 -14.314 1.00 0.00 H new ATOM 0 HB ILE A 17 12.603 -7.052 -15.414 1.00 0.00 H new ATOM 0 HG12 ILE A 17 13.126 -8.331 -13.445 1.00 0.00 H new ATOM 0 HG13 ILE A 17 13.196 -6.629 -13.035 1.00 0.00 H new ATOM 0 HG21 ILE A 17 11.911 -4.973 -14.291 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.729 -5.480 -15.521 1.00 0.00 H new ATOM 0 HG23 ILE A 17 10.389 -5.751 -13.795 1.00 0.00 H new ATOM 0 HD11 ILE A 17 12.093 -7.911 -11.267 1.00 0.00 H new ATOM 0 HD12 ILE A 17 10.952 -6.769 -12.014 1.00 0.00 H new ATOM 0 HD13 ILE A 17 10.881 -8.498 -12.430 1.00 0.00 H new ATOM 257 N GLN A 18 11.134 -8.243 -17.412 1.00 0.00 N ATOM 258 CA GLN A 18 10.772 -8.047 -18.811 1.00 0.00 C ATOM 259 C GLN A 18 9.593 -8.933 -19.198 1.00 0.00 C ATOM 260 O GLN A 18 8.703 -8.511 -19.938 1.00 0.00 O ATOM 261 CB GLN A 18 11.968 -8.345 -19.716 1.00 0.00 C ATOM 262 CG GLN A 18 12.086 -7.401 -20.901 1.00 0.00 C ATOM 263 CD GLN A 18 12.897 -7.989 -22.039 1.00 0.00 C ATOM 264 OE1 GLN A 18 13.839 -8.750 -21.816 1.00 0.00 O ATOM 265 NE2 GLN A 18 12.535 -7.640 -23.267 1.00 0.00 N ATOM 0 H GLN A 18 12.059 -8.648 -17.268 1.00 0.00 H new ATOM 0 HA GLN A 18 10.478 -7.006 -18.941 1.00 0.00 H new ATOM 0 HB2 GLN A 18 12.882 -8.289 -19.125 1.00 0.00 H new ATOM 0 HB3 GLN A 18 11.888 -9.368 -20.084 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.088 -7.152 -21.262 1.00 0.00 H new ATOM 0 HG3 GLN A 18 12.549 -6.470 -20.574 1.00 0.00 H new ATOM 0 HE21 GLN A 18 11.748 -7.006 -23.406 1.00 0.00 H new ATOM 0 HE22 GLN A 18 13.044 -8.005 -24.072 1.00 0.00 H new ATOM 274 N LEU A 19 9.592 -10.162 -18.694 1.00 0.00 N ATOM 275 CA LEU A 19 8.522 -11.108 -18.987 1.00 0.00 C ATOM 276 C LEU A 19 7.204 -10.649 -18.371 1.00 0.00 C ATOM 277 O LEU A 19 6.134 -10.845 -18.949 1.00 0.00 O ATOM 278 CB LEU A 19 8.886 -12.499 -18.463 1.00 0.00 C ATOM 279 CG LEU A 19 9.844 -13.314 -19.333 1.00 0.00 C ATOM 280 CD1 LEU A 19 10.168 -14.643 -18.668 1.00 0.00 C ATOM 281 CD2 LEU A 19 9.249 -13.538 -20.715 1.00 0.00 C ATOM 0 H LEU A 19 10.321 -10.527 -18.080 1.00 0.00 H new ATOM 0 HA LEU A 19 8.399 -11.155 -20.069 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.330 -12.388 -17.474 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.966 -13.070 -18.337 1.00 0.00 H new ATOM 0 HG LEU A 19 10.771 -12.752 -19.445 1.00 0.00 H new ATOM 0 HD11 LEU A 19 10.851 -15.210 -19.301 1.00 0.00 H new ATOM 0 HD12 LEU A 19 10.636 -14.461 -17.701 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.249 -15.212 -18.525 1.00 0.00 H new ATOM 0 HD21 LEU A 19 9.944 -14.120 -21.321 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.308 -14.080 -20.622 1.00 0.00 H new ATOM 0 HD23 LEU A 19 9.068 -12.576 -21.194 1.00 0.00 H new ATOM 293 N LEU A 20 7.289 -10.035 -17.196 1.00 0.00 N ATOM 294 CA LEU A 20 6.104 -9.545 -16.502 1.00 0.00 C ATOM 295 C LEU A 20 5.432 -8.427 -17.293 1.00 0.00 C ATOM 296 O LEU A 20 4.209 -8.398 -17.429 1.00 0.00 O ATOM 297 CB LEU A 20 6.478 -9.042 -15.106 1.00 0.00 C ATOM 298 CG LEU A 20 6.522 -10.099 -14.002 1.00 0.00 C ATOM 299 CD1 LEU A 20 7.316 -9.592 -12.808 1.00 0.00 C ATOM 300 CD2 LEU A 20 5.112 -10.489 -13.580 1.00 0.00 C ATOM 0 H LEU A 20 8.166 -9.865 -16.704 1.00 0.00 H new ATOM 0 HA LEU A 20 5.401 -10.372 -16.408 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.456 -8.564 -15.164 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.764 -8.272 -14.816 1.00 0.00 H new ATOM 0 HG LEU A 20 7.021 -10.985 -14.394 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.336 -10.358 -12.033 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.335 -9.364 -13.119 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.846 -8.690 -12.415 1.00 0.00 H new ATOM 0 HD21 LEU A 20 5.163 -11.242 -12.794 1.00 0.00 H new ATOM 0 HD22 LEU A 20 4.588 -9.609 -13.207 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.575 -10.895 -14.437 1.00 0.00 H new ATOM 312 N ARG A 21 6.240 -7.511 -17.816 1.00 0.00 N ATOM 313 CA ARG A 21 5.724 -6.392 -18.596 1.00 0.00 C ATOM 314 C ARG A 21 5.216 -6.865 -19.955 1.00 0.00 C ATOM 315 O ARG A 21 4.314 -6.262 -20.536 1.00 0.00 O ATOM 316 CB ARG A 21 6.809 -5.331 -18.786 1.00 0.00 C ATOM 317 CG ARG A 21 7.082 -4.509 -17.538 1.00 0.00 C ATOM 318 CD ARG A 21 5.957 -3.524 -17.262 1.00 0.00 C ATOM 319 NE ARG A 21 6.316 -2.557 -16.228 1.00 0.00 N ATOM 320 CZ ARG A 21 5.599 -1.473 -15.954 1.00 0.00 C ATOM 321 NH1 ARG A 21 4.490 -1.219 -16.634 1.00 0.00 N ATOM 322 NH2 ARG A 21 5.991 -0.641 -14.998 1.00 0.00 N ATOM 0 H ARG A 21 7.255 -7.521 -17.714 1.00 0.00 H new ATOM 0 HA ARG A 21 4.890 -5.954 -18.048 1.00 0.00 H new ATOM 0 HB2 ARG A 21 7.732 -5.819 -19.098 1.00 0.00 H new ATOM 0 HB3 ARG A 21 6.513 -4.662 -19.594 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.203 -5.174 -16.683 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.020 -3.967 -17.656 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.705 -2.995 -18.181 1.00 0.00 H new ATOM 0 HD3 ARG A 21 5.065 -4.070 -16.954 1.00 0.00 H new ATOM 0 HE ARG A 21 7.164 -2.723 -15.686 1.00 0.00 H new ATOM 0 HH11 ARG A 21 4.185 -1.857 -17.370 1.00 0.00 H new ATOM 0 HH12 ARG A 21 3.941 -0.386 -16.422 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.844 -0.833 -14.473 1.00 0.00 H new ATOM 0 HH22 ARG A 21 5.440 0.191 -14.788 1.00 0.00 H new ATOM 336 N SER A 22 5.801 -7.949 -20.455 1.00 0.00 N ATOM 337 CA SER A 22 5.411 -8.500 -21.747 1.00 0.00 C ATOM 338 C SER A 22 3.919 -8.815 -21.776 1.00 0.00 C ATOM 339 O SER A 22 3.232 -8.532 -22.758 1.00 0.00 O ATOM 340 CB SER A 22 6.216 -9.766 -22.049 1.00 0.00 C ATOM 341 OG SER A 22 5.947 -10.242 -23.357 1.00 0.00 O ATOM 0 H SER A 22 6.546 -8.463 -19.985 1.00 0.00 H new ATOM 0 HA SER A 22 5.622 -7.752 -22.511 1.00 0.00 H new ATOM 0 HB2 SER A 22 7.281 -9.557 -21.947 1.00 0.00 H new ATOM 0 HB3 SER A 22 5.972 -10.539 -21.320 1.00 0.00 H new ATOM 0 HG SER A 22 6.475 -11.050 -23.526 1.00 0.00 H new ATOM 347 N HIS A 23 3.423 -9.401 -20.691 1.00 0.00 N ATOM 348 CA HIS A 23 2.011 -9.754 -20.590 1.00 0.00 C ATOM 349 C HIS A 23 1.219 -8.638 -19.916 1.00 0.00 C ATOM 350 O HIS A 23 0.094 -8.848 -19.463 1.00 0.00 O ATOM 351 CB HIS A 23 1.844 -11.058 -19.809 1.00 0.00 C ATOM 352 CG HIS A 23 2.106 -12.284 -20.627 1.00 0.00 C ATOM 353 ND1 HIS A 23 1.313 -12.664 -21.689 1.00 0.00 N ATOM 354 CD2 HIS A 23 3.081 -13.219 -20.535 1.00 0.00 C ATOM 355 CE1 HIS A 23 1.787 -13.779 -22.214 1.00 0.00 C ATOM 356 NE2 HIS A 23 2.861 -14.137 -21.532 1.00 0.00 N ATOM 0 H HIS A 23 3.978 -9.641 -19.869 1.00 0.00 H new ATOM 0 HA HIS A 23 1.623 -9.892 -21.599 1.00 0.00 H new ATOM 0 HB2 HIS A 23 2.521 -11.050 -18.955 1.00 0.00 H new ATOM 0 HB3 HIS A 23 0.830 -11.106 -19.411 1.00 0.00 H new ATOM 0 HD2 HIS A 23 3.883 -13.239 -19.812 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.368 -14.308 -23.057 1.00 0.00 H new ATOM 0 HE2 HIS A 23 3.433 -14.961 -21.716 1.00 0.00 H new ATOM 364 N ARG A 24 1.815 -7.451 -19.853 1.00 0.00 N ATOM 365 CA ARG A 24 1.165 -6.303 -19.232 1.00 0.00 C ATOM 366 C ARG A 24 0.745 -6.624 -17.801 1.00 0.00 C ATOM 367 O ARG A 24 -0.196 -6.032 -17.273 1.00 0.00 O ATOM 368 CB ARG A 24 -0.055 -5.876 -20.050 1.00 0.00 C ATOM 369 CG ARG A 24 0.284 -5.434 -21.464 1.00 0.00 C ATOM 370 CD ARG A 24 -0.961 -5.018 -22.231 1.00 0.00 C ATOM 371 NE ARG A 24 -1.366 -3.650 -21.917 1.00 0.00 N ATOM 372 CZ ARG A 24 -2.358 -3.017 -22.535 1.00 0.00 C ATOM 373 NH1 ARG A 24 -3.041 -3.626 -23.494 1.00 0.00 N ATOM 374 NH2 ARG A 24 -2.667 -1.773 -22.192 1.00 0.00 N ATOM 0 H ARG A 24 2.746 -7.260 -20.224 1.00 0.00 H new ATOM 0 HA ARG A 24 1.881 -5.482 -19.206 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.759 -6.707 -20.097 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.560 -5.059 -19.534 1.00 0.00 H new ATOM 0 HG2 ARG A 24 0.986 -4.601 -21.428 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.783 -6.248 -21.991 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -0.773 -5.104 -23.301 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -1.777 -5.701 -21.995 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.860 -3.154 -21.184 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.806 -4.582 -23.759 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -3.802 -3.138 -23.967 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.143 -1.302 -21.454 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.428 -1.287 -22.666 1.00 0.00 H new ATOM 388 N ILE A 25 1.448 -7.565 -17.180 1.00 0.00 N ATOM 389 CA ILE A 25 1.148 -7.964 -15.811 1.00 0.00 C ATOM 390 C ILE A 25 1.296 -6.788 -14.851 1.00 0.00 C ATOM 391 O ILE A 25 2.101 -5.885 -15.077 1.00 0.00 O ATOM 392 CB ILE A 25 2.064 -9.111 -15.345 1.00 0.00 C ATOM 393 CG1 ILE A 25 1.935 -10.310 -16.286 1.00 0.00 C ATOM 394 CG2 ILE A 25 1.726 -9.512 -13.917 1.00 0.00 C ATOM 395 CD1 ILE A 25 2.723 -11.520 -15.834 1.00 0.00 C ATOM 0 H ILE A 25 2.229 -8.065 -17.604 1.00 0.00 H new ATOM 0 HA ILE A 25 0.114 -8.310 -15.802 1.00 0.00 H new ATOM 0 HB ILE A 25 3.097 -8.764 -15.369 1.00 0.00 H new ATOM 0 HG12 ILE A 25 0.883 -10.583 -16.372 1.00 0.00 H new ATOM 0 HG13 ILE A 25 2.271 -10.019 -17.281 1.00 0.00 H new ATOM 0 HG21 ILE A 25 2.382 -10.324 -13.602 1.00 0.00 H new ATOM 0 HG22 ILE A 25 1.865 -8.656 -13.256 1.00 0.00 H new ATOM 0 HG23 ILE A 25 0.689 -9.844 -13.868 1.00 0.00 H new ATOM 0 HD11 ILE A 25 2.585 -12.332 -16.548 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.781 -11.264 -15.775 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.372 -11.837 -14.852 1.00 0.00 H new ATOM 407 N LYS A 26 0.514 -6.807 -13.777 1.00 0.00 N ATOM 408 CA LYS A 26 0.559 -5.744 -12.779 1.00 0.00 C ATOM 409 C LYS A 26 1.625 -6.031 -11.726 1.00 0.00 C ATOM 410 O LYS A 26 2.430 -6.951 -11.877 1.00 0.00 O ATOM 411 CB LYS A 26 -0.807 -5.589 -12.107 1.00 0.00 C ATOM 412 CG LYS A 26 -1.975 -5.922 -13.020 1.00 0.00 C ATOM 413 CD LYS A 26 -1.961 -5.068 -14.277 1.00 0.00 C ATOM 414 CE LYS A 26 -3.211 -5.289 -15.114 1.00 0.00 C ATOM 415 NZ LYS A 26 -3.314 -4.305 -16.228 1.00 0.00 N ATOM 0 H LYS A 26 -0.159 -7.547 -13.575 1.00 0.00 H new ATOM 0 HA LYS A 26 0.815 -4.814 -13.287 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.847 -6.235 -11.230 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.914 -4.564 -11.753 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.934 -6.976 -13.295 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.912 -5.768 -12.485 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.887 -4.016 -14.003 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -1.078 -5.306 -14.870 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -3.201 -6.300 -15.522 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.093 -5.211 -14.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.179 -4.489 -16.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.349 -3.342 -15.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.485 -4.397 -16.850 1.00 0.00 H new ATOM 429 N THR A 27 1.624 -5.239 -10.658 1.00 0.00 N ATOM 430 CA THR A 27 2.591 -5.408 -9.581 1.00 0.00 C ATOM 431 C THR A 27 2.305 -6.673 -8.779 1.00 0.00 C ATOM 432 O THR A 27 1.387 -7.428 -9.099 1.00 0.00 O ATOM 433 CB THR A 27 2.587 -4.198 -8.628 1.00 0.00 C ATOM 434 OG1 THR A 27 1.473 -4.284 -7.732 1.00 0.00 O ATOM 435 CG2 THR A 27 2.517 -2.894 -9.409 1.00 0.00 C ATOM 0 H THR A 27 0.964 -4.474 -10.516 1.00 0.00 H new ATOM 0 HA THR A 27 3.573 -5.491 -10.047 1.00 0.00 H new ATOM 0 HB THR A 27 3.515 -4.211 -8.056 1.00 0.00 H new ATOM 0 HG1 THR A 27 1.478 -3.512 -7.128 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.515 -2.054 -8.715 1.00 0.00 H new ATOM 0 HG22 THR A 27 3.381 -2.818 -10.069 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.604 -2.875 -10.004 1.00 0.00 H new ATOM 443 N VAL A 28 3.096 -6.898 -7.735 1.00 0.00 N ATOM 444 CA VAL A 28 2.926 -8.071 -6.886 1.00 0.00 C ATOM 445 C VAL A 28 1.466 -8.256 -6.490 1.00 0.00 C ATOM 446 O VAL A 28 1.017 -9.374 -6.236 1.00 0.00 O ATOM 447 CB VAL A 28 3.783 -7.969 -5.610 1.00 0.00 C ATOM 448 CG1 VAL A 28 3.579 -9.193 -4.730 1.00 0.00 C ATOM 449 CG2 VAL A 28 5.252 -7.798 -5.968 1.00 0.00 C ATOM 0 H VAL A 28 3.861 -6.283 -7.457 1.00 0.00 H new ATOM 0 HA VAL A 28 3.254 -8.933 -7.468 1.00 0.00 H new ATOM 0 HB VAL A 28 3.465 -7.091 -5.048 1.00 0.00 H new ATOM 0 HG11 VAL A 28 4.192 -9.103 -3.834 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.529 -9.266 -4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.869 -10.089 -5.280 1.00 0.00 H new ATOM 0 HG21 VAL A 28 5.843 -7.728 -5.055 1.00 0.00 H new ATOM 0 HG22 VAL A 28 5.586 -8.656 -6.552 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.380 -6.888 -6.554 1.00 0.00 H new ATOM 459 N VAL A 29 0.727 -7.152 -6.440 1.00 0.00 N ATOM 460 CA VAL A 29 -0.684 -7.193 -6.077 1.00 0.00 C ATOM 461 C VAL A 29 -1.449 -8.180 -6.952 1.00 0.00 C ATOM 462 O VAL A 29 -2.273 -8.951 -6.460 1.00 0.00 O ATOM 463 CB VAL A 29 -1.336 -5.802 -6.201 1.00 0.00 C ATOM 464 CG1 VAL A 29 -0.713 -4.830 -5.211 1.00 0.00 C ATOM 465 CG2 VAL A 29 -1.209 -5.280 -7.624 1.00 0.00 C ATOM 0 H VAL A 29 1.082 -6.218 -6.646 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.734 -7.519 -5.038 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.396 -5.894 -5.965 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -1.186 -3.853 -5.313 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.860 -5.200 -4.196 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.354 -4.739 -5.413 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.675 -4.297 -7.694 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -0.155 -5.202 -7.890 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.706 -5.967 -8.309 1.00 0.00 H new ATOM 475 N ASP A 30 -1.170 -8.151 -8.250 1.00 0.00 N ATOM 476 CA ASP A 30 -1.830 -9.045 -9.194 1.00 0.00 C ATOM 477 C ASP A 30 -1.307 -10.470 -9.050 1.00 0.00 C ATOM 478 O ASP A 30 -2.044 -11.437 -9.251 1.00 0.00 O ATOM 479 CB ASP A 30 -1.619 -8.554 -10.627 1.00 0.00 C ATOM 480 CG ASP A 30 -2.006 -9.595 -11.659 1.00 0.00 C ATOM 481 OD1 ASP A 30 -3.218 -9.763 -11.906 1.00 0.00 O ATOM 482 OD2 ASP A 30 -1.096 -10.242 -12.220 1.00 0.00 O ATOM 0 H ASP A 30 -0.491 -7.518 -8.673 1.00 0.00 H new ATOM 0 HA ASP A 30 -2.897 -9.045 -8.971 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -2.207 -7.650 -10.789 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.572 -8.282 -10.764 1.00 0.00 H new ATOM 487 N LEU A 31 -0.031 -10.594 -8.701 1.00 0.00 N ATOM 488 CA LEU A 31 0.591 -11.903 -8.530 1.00 0.00 C ATOM 489 C LEU A 31 -0.229 -12.777 -7.588 1.00 0.00 C ATOM 490 O LEU A 31 -0.318 -13.992 -7.770 1.00 0.00 O ATOM 491 CB LEU A 31 2.014 -11.745 -7.990 1.00 0.00 C ATOM 492 CG LEU A 31 2.948 -12.937 -8.203 1.00 0.00 C ATOM 493 CD1 LEU A 31 4.401 -12.491 -8.156 1.00 0.00 C ATOM 494 CD2 LEU A 31 2.685 -14.014 -7.161 1.00 0.00 C ATOM 0 H LEU A 31 0.593 -9.805 -8.531 1.00 0.00 H new ATOM 0 HA LEU A 31 0.630 -12.390 -9.504 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.463 -10.869 -8.457 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.955 -11.541 -6.921 1.00 0.00 H new ATOM 0 HG LEU A 31 2.750 -13.358 -9.189 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.051 -13.352 -8.309 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.581 -11.756 -8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.613 -12.045 -7.185 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.359 -14.854 -7.328 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.855 -13.606 -6.165 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.653 -14.355 -7.242 1.00 0.00 H new ATOM 506 N VAL A 32 -0.830 -12.152 -6.581 1.00 0.00 N ATOM 507 CA VAL A 32 -1.646 -12.872 -5.611 1.00 0.00 C ATOM 508 C VAL A 32 -2.723 -13.698 -6.306 1.00 0.00 C ATOM 509 O VAL A 32 -3.174 -14.717 -5.781 1.00 0.00 O ATOM 510 CB VAL A 32 -2.317 -11.908 -4.615 1.00 0.00 C ATOM 511 CG1 VAL A 32 -1.308 -10.902 -4.084 1.00 0.00 C ATOM 512 CG2 VAL A 32 -3.494 -11.200 -5.270 1.00 0.00 C ATOM 0 H VAL A 32 -0.767 -11.147 -6.416 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.976 -13.537 -5.065 1.00 0.00 H new ATOM 0 HB VAL A 32 -2.694 -12.488 -3.772 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.800 -10.229 -3.382 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.501 -11.430 -3.576 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.899 -10.325 -4.913 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.957 -10.523 -4.552 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.143 -10.631 -6.131 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -4.227 -11.938 -5.597 1.00 0.00 H new ATOM 522 N SER A 33 -3.131 -13.253 -7.490 1.00 0.00 N ATOM 523 CA SER A 33 -4.158 -13.949 -8.256 1.00 0.00 C ATOM 524 C SER A 33 -3.538 -14.738 -9.405 1.00 0.00 C ATOM 525 O SER A 33 -4.108 -15.721 -9.876 1.00 0.00 O ATOM 526 CB SER A 33 -5.182 -12.952 -8.801 1.00 0.00 C ATOM 527 OG SER A 33 -6.434 -13.577 -9.026 1.00 0.00 O ATOM 0 H SER A 33 -2.766 -12.413 -7.940 1.00 0.00 H new ATOM 0 HA SER A 33 -4.662 -14.648 -7.589 1.00 0.00 H new ATOM 0 HB2 SER A 33 -5.304 -12.130 -8.096 1.00 0.00 H new ATOM 0 HB3 SER A 33 -4.815 -12.521 -9.732 1.00 0.00 H new ATOM 0 HG SER A 33 -7.071 -12.918 -9.373 1.00 0.00 H new ATOM 533 N ALA A 34 -2.365 -14.299 -9.850 1.00 0.00 N ATOM 534 CA ALA A 34 -1.665 -14.964 -10.942 1.00 0.00 C ATOM 535 C ALA A 34 -1.381 -16.423 -10.605 1.00 0.00 C ATOM 536 O ALA A 34 -1.661 -16.879 -9.496 1.00 0.00 O ATOM 537 CB ALA A 34 -0.370 -14.232 -11.262 1.00 0.00 C ATOM 0 H ALA A 34 -1.880 -13.486 -9.471 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.309 -14.941 -11.821 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.142 -14.740 -12.079 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.595 -13.207 -11.556 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.271 -14.225 -10.381 1.00 0.00 H new ATOM 543 N ASP A 35 -0.826 -17.151 -11.567 1.00 0.00 N ATOM 544 CA ASP A 35 -0.504 -18.560 -11.371 1.00 0.00 C ATOM 545 C ASP A 35 0.987 -18.745 -11.106 1.00 0.00 C ATOM 546 O ASP A 35 1.675 -19.457 -11.838 1.00 0.00 O ATOM 547 CB ASP A 35 -0.922 -19.375 -12.596 1.00 0.00 C ATOM 548 CG ASP A 35 -2.427 -19.498 -12.724 1.00 0.00 C ATOM 549 OD1 ASP A 35 -3.131 -18.509 -12.428 1.00 0.00 O ATOM 550 OD2 ASP A 35 -2.902 -20.582 -13.121 1.00 0.00 O ATOM 0 H ASP A 35 -0.589 -16.789 -12.491 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.056 -18.916 -10.501 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.521 -18.906 -13.495 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.483 -20.371 -12.533 1.00 0.00 H new ATOM 555 N LEU A 36 1.480 -18.098 -10.056 1.00 0.00 N ATOM 556 CA LEU A 36 2.891 -18.190 -9.694 1.00 0.00 C ATOM 557 C LEU A 36 3.307 -19.643 -9.490 1.00 0.00 C ATOM 558 O LEU A 36 4.412 -20.039 -9.860 1.00 0.00 O ATOM 559 CB LEU A 36 3.164 -17.385 -8.422 1.00 0.00 C ATOM 560 CG LEU A 36 4.593 -16.867 -8.250 1.00 0.00 C ATOM 561 CD1 LEU A 36 5.570 -18.026 -8.126 1.00 0.00 C ATOM 562 CD2 LEU A 36 4.976 -15.965 -9.414 1.00 0.00 C ATOM 0 H LEU A 36 0.924 -17.504 -9.440 1.00 0.00 H new ATOM 0 HA LEU A 36 3.479 -17.775 -10.512 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.485 -16.533 -8.402 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.918 -18.008 -7.562 1.00 0.00 H new ATOM 0 HG LEU A 36 4.639 -16.281 -7.332 1.00 0.00 H new ATOM 0 HD11 LEU A 36 6.581 -17.638 -8.004 1.00 0.00 H new ATOM 0 HD12 LEU A 36 5.307 -18.632 -7.259 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.523 -18.640 -9.026 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.996 -15.605 -9.275 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.913 -16.527 -10.346 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.294 -15.116 -9.456 1.00 0.00 H new ATOM 574 N GLU A 37 2.414 -20.432 -8.901 1.00 0.00 N ATOM 575 CA GLU A 37 2.689 -21.842 -8.650 1.00 0.00 C ATOM 576 C GLU A 37 2.959 -22.584 -9.955 1.00 0.00 C ATOM 577 O GLU A 37 3.823 -23.458 -10.017 1.00 0.00 O ATOM 578 CB GLU A 37 1.514 -22.491 -7.915 1.00 0.00 C ATOM 579 CG GLU A 37 0.164 -22.196 -8.546 1.00 0.00 C ATOM 580 CD GLU A 37 -0.960 -22.997 -7.919 1.00 0.00 C ATOM 581 OE1 GLU A 37 -1.376 -22.654 -6.792 1.00 0.00 O ATOM 582 OE2 GLU A 37 -1.424 -23.967 -8.554 1.00 0.00 O ATOM 0 H GLU A 37 1.495 -20.119 -8.589 1.00 0.00 H new ATOM 0 HA GLU A 37 3.579 -21.906 -8.025 1.00 0.00 H new ATOM 0 HB2 GLU A 37 1.665 -23.570 -7.888 1.00 0.00 H new ATOM 0 HB3 GLU A 37 1.506 -22.144 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.054 -21.133 -8.448 1.00 0.00 H new ATOM 0 HG3 GLU A 37 0.210 -22.415 -9.613 1.00 0.00 H new ATOM 589 N GLU A 38 2.212 -22.230 -10.996 1.00 0.00 N ATOM 590 CA GLU A 38 2.370 -22.864 -12.300 1.00 0.00 C ATOM 591 C GLU A 38 3.631 -22.364 -12.999 1.00 0.00 C ATOM 592 O GLU A 38 4.428 -23.153 -13.505 1.00 0.00 O ATOM 593 CB GLU A 38 1.145 -22.591 -13.176 1.00 0.00 C ATOM 594 CG GLU A 38 1.152 -23.359 -14.487 1.00 0.00 C ATOM 595 CD GLU A 38 0.627 -24.774 -14.337 1.00 0.00 C ATOM 596 OE1 GLU A 38 1.270 -25.571 -13.623 1.00 0.00 O ATOM 597 OE2 GLU A 38 -0.425 -25.083 -14.934 1.00 0.00 O ATOM 0 H GLU A 38 1.492 -21.508 -10.962 1.00 0.00 H new ATOM 0 HA GLU A 38 2.464 -23.939 -12.144 1.00 0.00 H new ATOM 0 HB2 GLU A 38 0.245 -22.849 -12.618 1.00 0.00 H new ATOM 0 HB3 GLU A 38 1.092 -21.524 -13.390 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.545 -22.826 -15.219 1.00 0.00 H new ATOM 0 HG3 GLU A 38 2.169 -23.392 -14.879 1.00 0.00 H new ATOM 604 N VAL A 39 3.803 -21.046 -13.024 1.00 0.00 N ATOM 605 CA VAL A 39 4.967 -20.439 -13.660 1.00 0.00 C ATOM 606 C VAL A 39 6.260 -20.908 -13.002 1.00 0.00 C ATOM 607 O VAL A 39 7.243 -21.199 -13.681 1.00 0.00 O ATOM 608 CB VAL A 39 4.901 -18.902 -13.600 1.00 0.00 C ATOM 609 CG1 VAL A 39 6.127 -18.289 -14.259 1.00 0.00 C ATOM 610 CG2 VAL A 39 3.625 -18.398 -14.258 1.00 0.00 C ATOM 0 H VAL A 39 3.152 -20.378 -12.611 1.00 0.00 H new ATOM 0 HA VAL A 39 4.959 -20.755 -14.703 1.00 0.00 H new ATOM 0 HB VAL A 39 4.889 -18.597 -12.554 1.00 0.00 H new ATOM 0 HG11 VAL A 39 6.063 -17.202 -14.207 1.00 0.00 H new ATOM 0 HG12 VAL A 39 7.025 -18.625 -13.740 1.00 0.00 H new ATOM 0 HG13 VAL A 39 6.173 -18.600 -15.303 1.00 0.00 H new ATOM 0 HG21 VAL A 39 3.595 -17.310 -14.207 1.00 0.00 H new ATOM 0 HG22 VAL A 39 3.605 -18.713 -15.301 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.760 -18.810 -13.738 1.00 0.00 H new ATOM 620 N ALA A 40 6.250 -20.978 -11.675 1.00 0.00 N ATOM 621 CA ALA A 40 7.421 -21.413 -10.924 1.00 0.00 C ATOM 622 C ALA A 40 7.811 -22.840 -11.294 1.00 0.00 C ATOM 623 O ALA A 40 8.993 -23.177 -11.343 1.00 0.00 O ATOM 624 CB ALA A 40 7.160 -21.306 -9.429 1.00 0.00 C ATOM 0 H ALA A 40 5.444 -20.739 -11.098 1.00 0.00 H new ATOM 0 HA ALA A 40 8.252 -20.758 -11.184 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.043 -21.634 -8.881 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.937 -20.270 -9.172 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.312 -21.937 -9.162 1.00 0.00 H new ATOM 630 N GLN A 41 6.808 -23.674 -11.552 1.00 0.00 N ATOM 631 CA GLN A 41 7.048 -25.066 -11.916 1.00 0.00 C ATOM 632 C GLN A 41 7.708 -25.165 -13.287 1.00 0.00 C ATOM 633 O GLN A 41 8.719 -25.847 -13.453 1.00 0.00 O ATOM 634 CB GLN A 41 5.734 -25.849 -11.912 1.00 0.00 C ATOM 635 CG GLN A 41 5.251 -26.221 -10.519 1.00 0.00 C ATOM 636 CD GLN A 41 5.906 -27.483 -9.993 1.00 0.00 C ATOM 637 OE1 GLN A 41 7.131 -27.576 -9.919 1.00 0.00 O ATOM 638 NE2 GLN A 41 5.090 -28.463 -9.622 1.00 0.00 N ATOM 0 H GLN A 41 5.823 -23.411 -11.516 1.00 0.00 H new ATOM 0 HA GLN A 41 7.723 -25.497 -11.177 1.00 0.00 H new ATOM 0 HB2 GLN A 41 4.966 -25.255 -12.407 1.00 0.00 H new ATOM 0 HB3 GLN A 41 5.861 -26.759 -12.498 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.456 -25.397 -9.835 1.00 0.00 H new ATOM 0 HG3 GLN A 41 4.170 -26.358 -10.538 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.080 -28.343 -9.700 1.00 0.00 H new ATOM 0 HE22 GLN A 41 5.473 -29.336 -9.259 1.00 0.00 H new ATOM 647 N LYS A 42 7.130 -24.479 -14.267 1.00 0.00 N ATOM 648 CA LYS A 42 7.663 -24.488 -15.625 1.00 0.00 C ATOM 649 C LYS A 42 9.032 -23.818 -15.676 1.00 0.00 C ATOM 650 O LYS A 42 9.968 -24.343 -16.281 1.00 0.00 O ATOM 651 CB LYS A 42 6.699 -23.776 -16.577 1.00 0.00 C ATOM 652 CG LYS A 42 5.287 -24.336 -16.544 1.00 0.00 C ATOM 653 CD LYS A 42 5.220 -25.716 -17.176 1.00 0.00 C ATOM 654 CE LYS A 42 5.302 -25.640 -18.693 1.00 0.00 C ATOM 655 NZ LYS A 42 4.082 -25.023 -19.284 1.00 0.00 N ATOM 0 H LYS A 42 6.292 -23.910 -14.147 1.00 0.00 H new ATOM 0 HA LYS A 42 7.774 -25.526 -15.939 1.00 0.00 H new ATOM 0 HB2 LYS A 42 6.667 -22.717 -16.323 1.00 0.00 H new ATOM 0 HB3 LYS A 42 7.086 -23.848 -17.593 1.00 0.00 H new ATOM 0 HG2 LYS A 42 4.940 -24.390 -15.512 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.614 -23.660 -17.072 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.036 -26.331 -16.797 1.00 0.00 H new ATOM 0 HD3 LYS A 42 4.291 -26.206 -16.885 1.00 0.00 H new ATOM 0 HE2 LYS A 42 6.178 -25.059 -18.981 1.00 0.00 H new ATOM 0 HE3 LYS A 42 5.436 -26.642 -19.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 4.039 -25.243 -20.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 3.237 -25.402 -18.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.117 -23.992 -19.155 1.00 0.00 H new ATOM 669 N CYS A 43 9.142 -22.658 -15.038 1.00 0.00 N ATOM 670 CA CYS A 43 10.399 -21.917 -15.011 1.00 0.00 C ATOM 671 C CYS A 43 11.446 -22.653 -14.182 1.00 0.00 C ATOM 672 O CYS A 43 12.647 -22.506 -14.408 1.00 0.00 O ATOM 673 CB CYS A 43 10.175 -20.514 -14.443 1.00 0.00 C ATOM 674 SG CYS A 43 11.491 -19.339 -14.841 1.00 0.00 S ATOM 0 H CYS A 43 8.377 -22.210 -14.533 1.00 0.00 H new ATOM 0 HA CYS A 43 10.765 -21.833 -16.034 1.00 0.00 H new ATOM 0 HB2 CYS A 43 9.229 -20.127 -14.822 1.00 0.00 H new ATOM 0 HB3 CYS A 43 10.079 -20.583 -13.359 1.00 0.00 H new ATOM 0 HG CYS A 43 11.211 -18.181 -14.320 1.00 0.00 H new ATOM 680 N GLY A 44 10.983 -23.446 -13.220 1.00 0.00 N ATOM 681 CA GLY A 44 11.893 -24.192 -12.371 1.00 0.00 C ATOM 682 C GLY A 44 12.377 -23.380 -11.186 1.00 0.00 C ATOM 683 O GLY A 44 13.465 -23.622 -10.661 1.00 0.00 O ATOM 0 H GLY A 44 9.994 -23.585 -13.014 1.00 0.00 H new ATOM 0 HA2 GLY A 44 11.394 -25.092 -12.011 1.00 0.00 H new ATOM 0 HA3 GLY A 44 12.751 -24.517 -12.960 1.00 0.00 H new ATOM 687 N LEU A 45 11.570 -22.413 -10.764 1.00 0.00 N ATOM 688 CA LEU A 45 11.923 -21.561 -9.634 1.00 0.00 C ATOM 689 C LEU A 45 11.386 -22.138 -8.328 1.00 0.00 C ATOM 690 O LEU A 45 10.645 -23.121 -8.331 1.00 0.00 O ATOM 691 CB LEU A 45 11.373 -20.148 -9.844 1.00 0.00 C ATOM 692 CG LEU A 45 12.258 -19.197 -10.651 1.00 0.00 C ATOM 693 CD1 LEU A 45 11.420 -18.097 -11.284 1.00 0.00 C ATOM 694 CD2 LEU A 45 13.344 -18.601 -9.768 1.00 0.00 C ATOM 0 H LEU A 45 10.667 -22.199 -11.187 1.00 0.00 H new ATOM 0 HA LEU A 45 13.010 -21.516 -9.570 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.407 -20.226 -10.344 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.191 -19.701 -8.866 1.00 0.00 H new ATOM 0 HG LEU A 45 12.737 -19.765 -11.448 1.00 0.00 H new ATOM 0 HD11 LEU A 45 12.066 -17.430 -11.854 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.679 -18.541 -11.949 1.00 0.00 H new ATOM 0 HD13 LEU A 45 10.913 -17.531 -10.503 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.964 -17.927 -10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.884 -18.047 -8.949 1.00 0.00 H new ATOM 0 HD23 LEU A 45 13.963 -19.401 -9.362 1.00 0.00 H new ATOM 706 N SER A 46 11.765 -21.520 -7.214 1.00 0.00 N ATOM 707 CA SER A 46 11.323 -21.974 -5.900 1.00 0.00 C ATOM 708 C SER A 46 10.061 -21.235 -5.466 1.00 0.00 C ATOM 709 O SER A 46 10.108 -20.055 -5.118 1.00 0.00 O ATOM 710 CB SER A 46 12.431 -21.766 -4.866 1.00 0.00 C ATOM 711 OG SER A 46 13.060 -20.507 -5.039 1.00 0.00 O ATOM 0 H SER A 46 12.377 -20.704 -7.195 1.00 0.00 H new ATOM 0 HA SER A 46 11.095 -23.038 -5.968 1.00 0.00 H new ATOM 0 HB2 SER A 46 12.013 -21.832 -3.862 1.00 0.00 H new ATOM 0 HB3 SER A 46 13.171 -22.561 -4.956 1.00 0.00 H new ATOM 0 HG SER A 46 12.377 -19.809 -5.126 1.00 0.00 H new ATOM 717 N TYR A 47 8.934 -21.938 -5.490 1.00 0.00 N ATOM 718 CA TYR A 47 7.658 -21.349 -5.102 1.00 0.00 C ATOM 719 C TYR A 47 7.679 -20.920 -3.638 1.00 0.00 C ATOM 720 O TYR A 47 6.952 -20.012 -3.234 1.00 0.00 O ATOM 721 CB TYR A 47 6.521 -22.344 -5.337 1.00 0.00 C ATOM 722 CG TYR A 47 5.177 -21.855 -4.846 1.00 0.00 C ATOM 723 CD1 TYR A 47 4.448 -20.921 -5.572 1.00 0.00 C ATOM 724 CD2 TYR A 47 4.636 -22.326 -3.657 1.00 0.00 C ATOM 725 CE1 TYR A 47 3.220 -20.471 -5.128 1.00 0.00 C ATOM 726 CE2 TYR A 47 3.408 -21.883 -3.205 1.00 0.00 C ATOM 727 CZ TYR A 47 2.704 -20.955 -3.944 1.00 0.00 C ATOM 728 OH TYR A 47 1.482 -20.509 -3.496 1.00 0.00 O ATOM 0 H TYR A 47 8.878 -22.916 -5.774 1.00 0.00 H new ATOM 0 HA TYR A 47 7.492 -20.466 -5.718 1.00 0.00 H new ATOM 0 HB2 TYR A 47 6.452 -22.559 -6.403 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.762 -23.282 -4.837 1.00 0.00 H new ATOM 0 HD1 TYR A 47 4.849 -20.540 -6.500 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.185 -23.052 -3.075 1.00 0.00 H new ATOM 0 HE1 TYR A 47 2.667 -19.744 -5.705 1.00 0.00 H new ATOM 0 HE2 TYR A 47 3.002 -22.261 -2.279 1.00 0.00 H new ATOM 0 HH TYR A 47 1.264 -20.950 -2.648 1.00 0.00 H new ATOM 738 N LYS A 48 8.518 -21.580 -2.847 1.00 0.00 N ATOM 739 CA LYS A 48 8.638 -21.268 -1.428 1.00 0.00 C ATOM 740 C LYS A 48 9.003 -19.802 -1.222 1.00 0.00 C ATOM 741 O LYS A 48 8.528 -19.159 -0.286 1.00 0.00 O ATOM 742 CB LYS A 48 9.692 -22.164 -0.775 1.00 0.00 C ATOM 743 CG LYS A 48 9.162 -23.528 -0.364 1.00 0.00 C ATOM 744 CD LYS A 48 8.565 -23.497 1.033 1.00 0.00 C ATOM 745 CE LYS A 48 7.097 -23.102 1.003 1.00 0.00 C ATOM 746 NZ LYS A 48 6.339 -23.701 2.136 1.00 0.00 N ATOM 0 H LYS A 48 9.125 -22.335 -3.165 1.00 0.00 H new ATOM 0 HA LYS A 48 7.672 -21.453 -0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 48 10.521 -22.300 -1.469 1.00 0.00 H new ATOM 0 HB3 LYS A 48 10.092 -21.659 0.104 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.405 -23.855 -1.077 1.00 0.00 H new ATOM 0 HG3 LYS A 48 9.970 -24.259 -0.399 1.00 0.00 H new ATOM 0 HD2 LYS A 48 8.669 -24.478 1.496 1.00 0.00 H new ATOM 0 HD3 LYS A 48 9.120 -22.792 1.651 1.00 0.00 H new ATOM 0 HE2 LYS A 48 7.012 -22.016 1.043 1.00 0.00 H new ATOM 0 HE3 LYS A 48 6.654 -23.422 0.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.343 -23.408 2.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.399 -24.738 2.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.746 -23.376 3.036 1.00 0.00 H new ATOM 760 N ALA A 49 9.851 -19.279 -2.102 1.00 0.00 N ATOM 761 CA ALA A 49 10.277 -17.887 -2.018 1.00 0.00 C ATOM 762 C ALA A 49 9.079 -16.944 -2.037 1.00 0.00 C ATOM 763 O ALA A 49 9.123 -15.857 -1.459 1.00 0.00 O ATOM 764 CB ALA A 49 11.229 -17.558 -3.158 1.00 0.00 C ATOM 0 H ALA A 49 10.256 -19.798 -2.881 1.00 0.00 H new ATOM 0 HA ALA A 49 10.799 -17.748 -1.071 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.539 -16.516 -3.084 1.00 0.00 H new ATOM 0 HB2 ALA A 49 12.106 -18.203 -3.098 1.00 0.00 H new ATOM 0 HB3 ALA A 49 10.725 -17.719 -4.111 1.00 0.00 H new ATOM 770 N LEU A 50 8.011 -17.365 -2.706 1.00 0.00 N ATOM 771 CA LEU A 50 6.800 -16.556 -2.800 1.00 0.00 C ATOM 772 C LEU A 50 6.040 -16.558 -1.478 1.00 0.00 C ATOM 773 O LEU A 50 5.474 -15.542 -1.074 1.00 0.00 O ATOM 774 CB LEU A 50 5.900 -17.080 -3.921 1.00 0.00 C ATOM 775 CG LEU A 50 5.003 -16.045 -4.600 1.00 0.00 C ATOM 776 CD1 LEU A 50 4.037 -15.435 -3.596 1.00 0.00 C ATOM 777 CD2 LEU A 50 5.843 -14.962 -5.261 1.00 0.00 C ATOM 0 H LEU A 50 7.959 -18.261 -3.191 1.00 0.00 H new ATOM 0 HA LEU A 50 7.093 -15.531 -3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 50 6.531 -17.539 -4.682 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.267 -17.868 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 50 4.422 -16.548 -5.373 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.407 -14.701 -4.097 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.412 -16.219 -3.170 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.600 -14.947 -2.800 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.187 -14.234 -5.739 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.451 -14.462 -4.507 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.493 -15.413 -6.011 1.00 0.00 H new ATOM 789 N VAL A 51 6.032 -17.706 -0.807 1.00 0.00 N ATOM 790 CA VAL A 51 5.344 -17.839 0.471 1.00 0.00 C ATOM 791 C VAL A 51 5.872 -16.833 1.487 1.00 0.00 C ATOM 792 O VAL A 51 5.102 -16.206 2.214 1.00 0.00 O ATOM 793 CB VAL A 51 5.497 -19.260 1.045 1.00 0.00 C ATOM 794 CG1 VAL A 51 4.690 -19.409 2.326 1.00 0.00 C ATOM 795 CG2 VAL A 51 5.076 -20.298 0.017 1.00 0.00 C ATOM 0 H VAL A 51 6.494 -18.557 -1.128 1.00 0.00 H new ATOM 0 HA VAL A 51 4.288 -17.642 0.284 1.00 0.00 H new ATOM 0 HB VAL A 51 6.548 -19.424 1.285 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.811 -20.419 2.717 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.044 -18.690 3.065 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.636 -19.225 2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.191 -21.296 0.440 1.00 0.00 H new ATOM 0 HG22 VAL A 51 4.033 -20.137 -0.256 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.702 -20.206 -0.871 1.00 0.00 H new ATOM 805 N ALA A 52 7.192 -16.682 1.532 1.00 0.00 N ATOM 806 CA ALA A 52 7.824 -15.750 2.457 1.00 0.00 C ATOM 807 C ALA A 52 7.389 -14.316 2.174 1.00 0.00 C ATOM 808 O ALA A 52 7.090 -13.553 3.094 1.00 0.00 O ATOM 809 CB ALA A 52 9.338 -15.870 2.375 1.00 0.00 C ATOM 0 H ALA A 52 7.844 -17.194 0.938 1.00 0.00 H new ATOM 0 HA ALA A 52 7.505 -16.006 3.467 1.00 0.00 H new ATOM 0 HB1 ALA A 52 9.797 -15.168 3.071 1.00 0.00 H new ATOM 0 HB2 ALA A 52 9.637 -16.886 2.634 1.00 0.00 H new ATOM 0 HB3 ALA A 52 9.667 -15.642 1.361 1.00 0.00 H new ATOM 815 N LEU A 53 7.355 -13.954 0.896 1.00 0.00 N ATOM 816 CA LEU A 53 6.957 -12.611 0.491 1.00 0.00 C ATOM 817 C LEU A 53 5.482 -12.365 0.795 1.00 0.00 C ATOM 818 O LEU A 53 5.118 -11.337 1.366 1.00 0.00 O ATOM 819 CB LEU A 53 7.223 -12.406 -1.001 1.00 0.00 C ATOM 820 CG LEU A 53 8.669 -12.604 -1.458 1.00 0.00 C ATOM 821 CD1 LEU A 53 8.751 -12.620 -2.977 1.00 0.00 C ATOM 822 CD2 LEU A 53 9.564 -11.515 -0.884 1.00 0.00 C ATOM 0 H LEU A 53 7.599 -14.573 0.122 1.00 0.00 H new ATOM 0 HA LEU A 53 7.551 -11.896 1.061 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.589 -13.093 -1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.913 -11.396 -1.270 1.00 0.00 H new ATOM 0 HG LEU A 53 9.019 -13.567 -1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.787 -12.762 -3.284 1.00 0.00 H new ATOM 0 HD12 LEU A 53 8.142 -13.437 -3.366 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.382 -11.673 -3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 53 10.589 -11.672 -1.220 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.216 -10.540 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 53 9.529 -11.552 0.205 1.00 0.00 H new ATOM 834 N ARG A 54 4.638 -13.317 0.409 1.00 0.00 N ATOM 835 CA ARG A 54 3.203 -13.204 0.641 1.00 0.00 C ATOM 836 C ARG A 54 2.902 -13.058 2.129 1.00 0.00 C ATOM 837 O ARG A 54 2.095 -12.219 2.530 1.00 0.00 O ATOM 838 CB ARG A 54 2.477 -14.429 0.081 1.00 0.00 C ATOM 839 CG ARG A 54 1.097 -14.117 -0.475 1.00 0.00 C ATOM 840 CD ARG A 54 1.141 -13.878 -1.976 1.00 0.00 C ATOM 841 NE ARG A 54 -0.110 -14.256 -2.628 1.00 0.00 N ATOM 842 CZ ARG A 54 -0.446 -15.512 -2.900 1.00 0.00 C ATOM 843 NH1 ARG A 54 0.371 -16.506 -2.577 1.00 0.00 N ATOM 844 NH2 ARG A 54 -1.602 -15.777 -3.495 1.00 0.00 N ATOM 0 H ARG A 54 4.923 -14.174 -0.065 1.00 0.00 H new ATOM 0 HA ARG A 54 2.847 -12.311 0.127 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.085 -14.873 -0.707 1.00 0.00 H new ATOM 0 HB3 ARG A 54 2.382 -15.176 0.869 1.00 0.00 H new ATOM 0 HG2 ARG A 54 0.421 -14.943 -0.257 1.00 0.00 H new ATOM 0 HG3 ARG A 54 0.694 -13.235 0.023 1.00 0.00 H new ATOM 0 HD2 ARG A 54 1.347 -12.825 -2.169 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.962 -14.448 -2.410 1.00 0.00 H new ATOM 0 HE ARG A 54 -0.761 -13.515 -2.889 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.260 -16.307 -2.118 1.00 0.00 H new ATOM 0 HH12 ARG A 54 0.110 -17.469 -2.787 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -2.234 -15.016 -3.744 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -1.859 -16.742 -3.703 1.00 0.00 H new ATOM 858 N ARG A 55 3.556 -13.880 2.944 1.00 0.00 N ATOM 859 CA ARG A 55 3.358 -13.843 4.387 1.00 0.00 C ATOM 860 C ARG A 55 3.677 -12.459 4.945 1.00 0.00 C ATOM 861 O ARG A 55 2.989 -11.964 5.838 1.00 0.00 O ATOM 862 CB ARG A 55 4.233 -14.895 5.071 1.00 0.00 C ATOM 863 CG ARG A 55 3.614 -15.478 6.330 1.00 0.00 C ATOM 864 CD ARG A 55 4.675 -15.841 7.357 1.00 0.00 C ATOM 865 NE ARG A 55 5.243 -17.164 7.114 1.00 0.00 N ATOM 866 CZ ARG A 55 6.163 -17.724 7.892 1.00 0.00 C ATOM 867 NH1 ARG A 55 6.616 -17.078 8.958 1.00 0.00 N ATOM 868 NH2 ARG A 55 6.630 -18.932 7.605 1.00 0.00 N ATOM 0 H ARG A 55 4.228 -14.580 2.628 1.00 0.00 H new ATOM 0 HA ARG A 55 2.310 -14.065 4.590 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.432 -15.703 4.367 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.194 -14.447 5.323 1.00 0.00 H new ATOM 0 HG2 ARG A 55 2.919 -14.758 6.762 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.035 -16.365 6.075 1.00 0.00 H new ATOM 0 HD2 ARG A 55 5.470 -15.096 7.335 1.00 0.00 H new ATOM 0 HD3 ARG A 55 4.238 -15.812 8.355 1.00 0.00 H new ATOM 0 HE ARG A 55 4.915 -17.687 6.302 1.00 0.00 H new ATOM 0 HH11 ARG A 55 6.258 -16.149 9.182 1.00 0.00 H new ATOM 0 HH12 ARG A 55 7.322 -17.510 9.554 1.00 0.00 H new ATOM 0 HH21 ARG A 55 6.283 -19.432 6.786 1.00 0.00 H new ATOM 0 HH22 ARG A 55 7.336 -19.361 8.203 1.00 0.00 H new ATOM 882 N VAL A 56 4.726 -11.840 4.413 1.00 0.00 N ATOM 883 CA VAL A 56 5.137 -10.513 4.857 1.00 0.00 C ATOM 884 C VAL A 56 4.125 -9.455 4.434 1.00 0.00 C ATOM 885 O VAL A 56 3.835 -8.522 5.185 1.00 0.00 O ATOM 886 CB VAL A 56 6.522 -10.138 4.296 1.00 0.00 C ATOM 887 CG1 VAL A 56 6.918 -8.739 4.743 1.00 0.00 C ATOM 888 CG2 VAL A 56 7.565 -11.159 4.724 1.00 0.00 C ATOM 0 H VAL A 56 5.307 -12.236 3.674 1.00 0.00 H new ATOM 0 HA VAL A 56 5.191 -10.545 5.945 1.00 0.00 H new ATOM 0 HB VAL A 56 6.467 -10.144 3.207 1.00 0.00 H new ATOM 0 HG11 VAL A 56 7.899 -8.491 4.337 1.00 0.00 H new ATOM 0 HG12 VAL A 56 6.183 -8.020 4.381 1.00 0.00 H new ATOM 0 HG13 VAL A 56 6.956 -8.702 5.832 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.537 -10.878 4.319 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.620 -11.188 5.812 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.286 -12.143 4.348 1.00 0.00 H new ATOM 898 N LEU A 57 3.590 -9.604 3.227 1.00 0.00 N ATOM 899 CA LEU A 57 2.608 -8.661 2.703 1.00 0.00 C ATOM 900 C LEU A 57 1.329 -8.689 3.533 1.00 0.00 C ATOM 901 O LEU A 57 0.806 -7.644 3.924 1.00 0.00 O ATOM 902 CB LEU A 57 2.290 -8.985 1.243 1.00 0.00 C ATOM 903 CG LEU A 57 3.108 -8.231 0.194 1.00 0.00 C ATOM 904 CD1 LEU A 57 4.324 -9.045 -0.221 1.00 0.00 C ATOM 905 CD2 LEU A 57 2.248 -7.899 -1.016 1.00 0.00 C ATOM 0 H LEU A 57 3.820 -10.369 2.593 1.00 0.00 H new ATOM 0 HA LEU A 57 3.035 -7.660 2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.436 -10.054 1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.234 -8.779 1.068 1.00 0.00 H new ATOM 0 HG LEU A 57 3.455 -7.297 0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.894 -8.493 -0.968 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.952 -9.231 0.650 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.999 -9.996 -0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.847 -7.363 -1.752 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.870 -8.821 -1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.410 -7.275 -0.706 1.00 0.00 H new ATOM 917 N LEU A 58 0.831 -9.891 3.802 1.00 0.00 N ATOM 918 CA LEU A 58 -0.387 -10.056 4.588 1.00 0.00 C ATOM 919 C LEU A 58 -0.132 -9.743 6.059 1.00 0.00 C ATOM 920 O LEU A 58 -1.009 -9.234 6.756 1.00 0.00 O ATOM 921 CB LEU A 58 -0.921 -11.482 4.444 1.00 0.00 C ATOM 922 CG LEU A 58 -0.275 -12.535 5.344 1.00 0.00 C ATOM 923 CD1 LEU A 58 -1.008 -12.622 6.674 1.00 0.00 C ATOM 924 CD2 LEU A 58 -0.258 -13.891 4.653 1.00 0.00 C ATOM 0 H LEU A 58 1.252 -10.765 3.488 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.132 -9.356 4.210 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.992 -11.469 4.645 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.795 -11.793 3.407 1.00 0.00 H new ATOM 0 HG LEU A 58 0.755 -12.236 5.538 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.534 -13.377 7.302 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.968 -11.655 7.176 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.048 -12.897 6.499 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.206 -14.628 5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.280 -14.197 4.428 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.312 -13.820 3.727 1.00 0.00 H new ATOM 936 N ALA A 59 1.075 -10.048 6.523 1.00 0.00 N ATOM 937 CA ALA A 59 1.447 -9.795 7.909 1.00 0.00 C ATOM 938 C ALA A 59 1.277 -8.322 8.263 1.00 0.00 C ATOM 939 O ALA A 59 0.861 -7.985 9.372 1.00 0.00 O ATOM 940 CB ALA A 59 2.881 -10.239 8.161 1.00 0.00 C ATOM 0 H ALA A 59 1.812 -10.471 5.959 1.00 0.00 H new ATOM 0 HA ALA A 59 0.782 -10.374 8.549 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.145 -10.044 9.200 1.00 0.00 H new ATOM 0 HB2 ALA A 59 2.973 -11.306 7.957 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.554 -9.686 7.506 1.00 0.00 H new ATOM 946 N GLN A 60 1.602 -7.449 7.315 1.00 0.00 N ATOM 947 CA GLN A 60 1.486 -6.011 7.529 1.00 0.00 C ATOM 948 C GLN A 60 0.027 -5.602 7.699 1.00 0.00 C ATOM 949 O GLN A 60 -0.284 -4.666 8.436 1.00 0.00 O ATOM 950 CB GLN A 60 2.109 -5.248 6.358 1.00 0.00 C ATOM 951 CG GLN A 60 3.603 -5.485 6.204 1.00 0.00 C ATOM 952 CD GLN A 60 4.434 -4.548 7.058 1.00 0.00 C ATOM 953 OE1 GLN A 60 3.913 -3.877 7.950 1.00 0.00 O ATOM 954 NE2 GLN A 60 5.733 -4.497 6.790 1.00 0.00 N ATOM 0 H GLN A 60 1.947 -7.712 6.392 1.00 0.00 H new ATOM 0 HA GLN A 60 2.023 -5.761 8.444 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.606 -5.540 5.436 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.931 -4.181 6.494 1.00 0.00 H new ATOM 0 HG2 GLN A 60 3.833 -6.516 6.473 1.00 0.00 H new ATOM 0 HG3 GLN A 60 3.881 -5.359 5.158 1.00 0.00 H new ATOM 0 HE21 GLN A 60 6.122 -5.071 6.042 1.00 0.00 H new ATOM 0 HE22 GLN A 60 6.342 -3.884 7.332 1.00 0.00 H new ATOM 963 N PHE A 61 -0.864 -6.309 7.013 1.00 0.00 N ATOM 964 CA PHE A 61 -2.292 -6.019 7.087 1.00 0.00 C ATOM 965 C PHE A 61 -2.803 -6.167 8.517 1.00 0.00 C ATOM 966 O PHE A 61 -3.698 -5.438 8.946 1.00 0.00 O ATOM 967 CB PHE A 61 -3.072 -6.948 6.155 1.00 0.00 C ATOM 968 CG PHE A 61 -4.530 -6.605 6.050 1.00 0.00 C ATOM 969 CD1 PHE A 61 -4.933 -5.298 5.823 1.00 0.00 C ATOM 970 CD2 PHE A 61 -5.498 -7.588 6.177 1.00 0.00 C ATOM 971 CE1 PHE A 61 -6.275 -4.980 5.726 1.00 0.00 C ATOM 972 CE2 PHE A 61 -6.841 -7.275 6.080 1.00 0.00 C ATOM 973 CZ PHE A 61 -7.230 -5.969 5.854 1.00 0.00 C ATOM 0 H PHE A 61 -0.623 -7.087 6.399 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.445 -4.987 6.770 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.626 -6.911 5.161 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.973 -7.973 6.511 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.191 -4.520 5.721 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -5.200 -8.611 6.354 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.576 -3.958 5.550 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.585 -8.051 6.181 1.00 0.00 H new ATOM 0 HZ PHE A 61 -8.279 -5.722 5.778 1.00 0.00 H new ATOM 983 N SER A 62 -2.229 -7.115 9.250 1.00 0.00 N ATOM 984 CA SER A 62 -2.629 -7.363 10.630 1.00 0.00 C ATOM 985 C SER A 62 -2.414 -6.120 11.489 1.00 0.00 C ATOM 986 O SER A 62 -1.838 -5.131 11.036 1.00 0.00 O ATOM 987 CB SER A 62 -1.840 -8.539 11.209 1.00 0.00 C ATOM 988 OG SER A 62 -2.594 -9.223 12.194 1.00 0.00 O ATOM 0 H SER A 62 -1.485 -7.725 8.911 1.00 0.00 H new ATOM 0 HA SER A 62 -3.691 -7.609 10.636 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.570 -9.229 10.409 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.909 -8.177 11.645 1.00 0.00 H new ATOM 0 HG SER A 62 -2.069 -9.971 12.547 1.00 0.00 H new ATOM 994 N ALA A 63 -2.883 -6.179 12.731 1.00 0.00 N ATOM 995 CA ALA A 63 -2.741 -5.061 13.655 1.00 0.00 C ATOM 996 C ALA A 63 -1.287 -4.613 13.756 1.00 0.00 C ATOM 997 O ALA A 63 -0.386 -5.431 13.938 1.00 0.00 O ATOM 998 CB ALA A 63 -3.275 -5.440 15.028 1.00 0.00 C ATOM 0 H ALA A 63 -3.365 -6.989 13.120 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.325 -4.226 13.268 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -3.163 -4.596 15.708 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.330 -5.704 14.948 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -2.716 -6.293 15.413 1.00 0.00 H new ATOM 1004 N PHE A 64 -1.065 -3.308 13.635 1.00 0.00 N ATOM 1005 CA PHE A 64 0.280 -2.751 13.711 1.00 0.00 C ATOM 1006 C PHE A 64 0.393 -1.755 14.862 1.00 0.00 C ATOM 1007 O PHE A 64 -0.598 -1.191 15.326 1.00 0.00 O ATOM 1008 CB PHE A 64 0.647 -2.067 12.392 1.00 0.00 C ATOM 1009 CG PHE A 64 -0.463 -1.232 11.821 1.00 0.00 C ATOM 1010 CD1 PHE A 64 -0.760 0.011 12.358 1.00 0.00 C ATOM 1011 CD2 PHE A 64 -1.211 -1.690 10.748 1.00 0.00 C ATOM 1012 CE1 PHE A 64 -1.781 0.782 11.834 1.00 0.00 C ATOM 1013 CE2 PHE A 64 -2.232 -0.923 10.220 1.00 0.00 C ATOM 1014 CZ PHE A 64 -2.519 0.314 10.765 1.00 0.00 C ATOM 0 H PHE A 64 -1.800 -2.617 13.484 1.00 0.00 H new ATOM 0 HA PHE A 64 0.975 -3.570 13.894 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.521 -1.436 12.550 1.00 0.00 H new ATOM 0 HB3 PHE A 64 0.930 -2.827 11.664 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.187 0.381 13.195 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.993 -2.657 10.320 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.001 1.750 12.260 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.805 -1.290 9.382 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.319 0.913 10.356 1.00 0.00 H new ATOM 1024 N PRO A 65 1.628 -1.535 15.334 1.00 0.00 N ATOM 1025 CA PRO A 65 1.901 -0.608 16.437 1.00 0.00 C ATOM 1026 C PRO A 65 1.689 0.848 16.036 1.00 0.00 C ATOM 1027 O PRO A 65 1.187 1.136 14.949 1.00 0.00 O ATOM 1028 CB PRO A 65 3.375 -0.865 16.760 1.00 0.00 C ATOM 1029 CG PRO A 65 3.954 -1.392 15.492 1.00 0.00 C ATOM 1030 CD PRO A 65 2.855 -2.174 14.828 1.00 0.00 C ATOM 0 HA PRO A 65 1.231 -0.770 17.281 1.00 0.00 H new ATOM 0 HB2 PRO A 65 3.877 0.050 17.074 1.00 0.00 H new ATOM 0 HB3 PRO A 65 3.483 -1.583 17.573 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.296 -0.579 14.852 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.818 -2.026 15.691 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.920 -2.115 13.742 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.897 -3.230 15.093 1.00 0.00 H new ATOM 1038 N VAL A 66 2.075 1.762 16.920 1.00 0.00 N ATOM 1039 CA VAL A 66 1.929 3.189 16.657 1.00 0.00 C ATOM 1040 C VAL A 66 2.553 3.568 15.318 1.00 0.00 C ATOM 1041 O VAL A 66 3.772 3.532 15.158 1.00 0.00 O ATOM 1042 CB VAL A 66 2.576 4.034 17.770 1.00 0.00 C ATOM 1043 CG1 VAL A 66 1.723 4.002 19.029 1.00 0.00 C ATOM 1044 CG2 VAL A 66 3.986 3.543 18.059 1.00 0.00 C ATOM 0 H VAL A 66 2.491 1.540 17.824 1.00 0.00 H new ATOM 0 HA VAL A 66 0.860 3.398 16.628 1.00 0.00 H new ATOM 0 HB VAL A 66 2.638 5.067 17.429 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.196 4.605 19.804 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.734 4.405 18.809 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.626 2.974 19.377 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.429 4.151 18.848 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.950 2.502 18.380 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.591 3.623 17.156 1.00 0.00 H new ATOM 1054 N ASN A 67 1.707 3.931 14.359 1.00 0.00 N ATOM 1055 CA ASN A 67 2.176 4.318 13.033 1.00 0.00 C ATOM 1056 C ASN A 67 1.134 5.169 12.315 1.00 0.00 C ATOM 1057 O ASN A 67 0.052 5.422 12.843 1.00 0.00 O ATOM 1058 CB ASN A 67 2.497 3.075 12.201 1.00 0.00 C ATOM 1059 CG ASN A 67 3.602 3.323 11.193 1.00 0.00 C ATOM 1060 OD1 ASN A 67 3.338 3.617 10.026 1.00 0.00 O ATOM 1061 ND2 ASN A 67 4.847 3.206 11.639 1.00 0.00 N ATOM 0 H ASN A 67 0.694 3.965 14.475 1.00 0.00 H new ATOM 0 HA ASN A 67 3.083 4.911 13.154 1.00 0.00 H new ATOM 0 HB2 ASN A 67 2.791 2.262 12.865 1.00 0.00 H new ATOM 0 HB3 ASN A 67 1.598 2.749 11.678 1.00 0.00 H new ATOM 0 HD21 ASN A 67 5.632 3.362 11.007 1.00 0.00 H new ATOM 0 HD22 ASN A 67 5.018 2.961 12.614 1.00 0.00 H new ATOM 1068 N GLY A 68 1.468 5.609 11.105 1.00 0.00 N ATOM 1069 CA GLY A 68 0.551 6.427 10.333 1.00 0.00 C ATOM 1070 C GLY A 68 -0.823 5.798 10.210 1.00 0.00 C ATOM 1071 O GLY A 68 -1.012 4.632 10.552 1.00 0.00 O ATOM 0 H GLY A 68 2.358 5.413 10.646 1.00 0.00 H new ATOM 0 HA2 GLY A 68 0.458 7.406 10.803 1.00 0.00 H new ATOM 0 HA3 GLY A 68 0.964 6.589 9.337 1.00 0.00 H new ATOM 1075 N ALA A 69 -1.785 6.574 9.721 1.00 0.00 N ATOM 1076 CA ALA A 69 -3.148 6.086 9.553 1.00 0.00 C ATOM 1077 C ALA A 69 -3.214 4.996 8.489 1.00 0.00 C ATOM 1078 O ALA A 69 -2.199 4.636 7.892 1.00 0.00 O ATOM 1079 CB ALA A 69 -4.079 7.235 9.192 1.00 0.00 C ATOM 0 H ALA A 69 -1.645 7.543 9.434 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.472 5.653 10.500 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.094 6.856 9.069 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.063 7.980 9.988 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.748 7.693 8.260 1.00 0.00 H new ATOM 1085 N ASP A 70 -4.413 4.473 8.258 1.00 0.00 N ATOM 1086 CA ASP A 70 -4.611 3.422 7.266 1.00 0.00 C ATOM 1087 C ASP A 70 -5.927 3.620 6.521 1.00 0.00 C ATOM 1088 O ASP A 70 -7.005 3.550 7.113 1.00 0.00 O ATOM 1089 CB ASP A 70 -4.591 2.048 7.936 1.00 0.00 C ATOM 1090 CG ASP A 70 -4.409 0.920 6.939 1.00 0.00 C ATOM 1091 OD1 ASP A 70 -3.930 1.191 5.818 1.00 0.00 O ATOM 1092 OD2 ASP A 70 -4.744 -0.233 7.281 1.00 0.00 O ATOM 0 H ASP A 70 -5.263 4.759 8.744 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.795 3.477 6.546 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.784 2.016 8.668 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -5.523 1.900 8.482 1.00 0.00 H new ATOM 1097 N LEU A 71 -5.833 3.868 5.219 1.00 0.00 N ATOM 1098 CA LEU A 71 -7.016 4.078 4.392 1.00 0.00 C ATOM 1099 C LEU A 71 -7.908 2.840 4.395 1.00 0.00 C ATOM 1100 O LEU A 71 -7.423 1.713 4.290 1.00 0.00 O ATOM 1101 CB LEU A 71 -6.606 4.422 2.959 1.00 0.00 C ATOM 1102 CG LEU A 71 -7.723 4.384 1.914 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -8.809 5.391 2.258 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -7.162 4.654 0.525 1.00 0.00 C ATOM 0 H LEU A 71 -4.949 3.929 4.713 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.580 4.911 4.812 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -6.168 5.420 2.957 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.823 3.730 2.650 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.166 3.388 1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.595 5.350 1.504 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.230 5.153 3.235 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.381 6.393 2.282 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.970 4.623 -0.206 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.693 5.638 0.507 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.420 3.894 0.278 1.00 0.00 H new ATOM 1116 N TYR A 72 -9.213 3.058 4.513 1.00 0.00 N ATOM 1117 CA TYR A 72 -10.173 1.961 4.529 1.00 0.00 C ATOM 1118 C TYR A 72 -11.233 2.148 3.449 1.00 0.00 C ATOM 1119 O TYR A 72 -11.288 3.187 2.792 1.00 0.00 O ATOM 1120 CB TYR A 72 -10.840 1.860 5.902 1.00 0.00 C ATOM 1121 CG TYR A 72 -11.245 0.452 6.276 1.00 0.00 C ATOM 1122 CD1 TYR A 72 -10.320 -0.585 6.262 1.00 0.00 C ATOM 1123 CD2 TYR A 72 -12.553 0.158 6.643 1.00 0.00 C ATOM 1124 CE1 TYR A 72 -10.686 -1.873 6.602 1.00 0.00 C ATOM 1125 CE2 TYR A 72 -12.927 -1.127 6.986 1.00 0.00 C ATOM 1126 CZ TYR A 72 -11.990 -2.139 6.964 1.00 0.00 C ATOM 1127 OH TYR A 72 -12.359 -3.420 7.304 1.00 0.00 O ATOM 0 H TYR A 72 -9.630 3.985 4.599 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.633 1.036 4.325 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -10.156 2.245 6.658 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -11.723 2.499 5.916 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -9.298 -0.381 5.981 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -13.290 0.948 6.660 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -9.955 -2.668 6.584 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -13.947 -1.338 7.270 1.00 0.00 H new ATOM 0 HH TYR A 72 -13.319 -3.536 7.148 1.00 0.00 H new ATOM 1137 N GLU A 73 -12.073 1.134 3.271 1.00 0.00 N ATOM 1138 CA GLU A 73 -13.132 1.186 2.270 1.00 0.00 C ATOM 1139 C GLU A 73 -14.500 1.330 2.931 1.00 0.00 C ATOM 1140 O GLU A 73 -15.518 0.928 2.369 1.00 0.00 O ATOM 1141 CB GLU A 73 -13.104 -0.072 1.399 1.00 0.00 C ATOM 1142 CG GLU A 73 -11.781 -0.289 0.686 1.00 0.00 C ATOM 1143 CD GLU A 73 -10.719 -0.880 1.593 1.00 0.00 C ATOM 1144 OE1 GLU A 73 -11.054 -1.782 2.389 1.00 0.00 O ATOM 1145 OE2 GLU A 73 -9.553 -0.440 1.507 1.00 0.00 O ATOM 0 H GLU A 73 -12.041 0.267 3.807 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.958 2.059 1.641 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -13.318 -0.940 2.022 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -13.900 -0.008 0.658 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.936 -0.952 -0.165 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -11.426 0.662 0.289 1.00 0.00 H new ATOM 1152 N GLU A 74 -14.513 1.906 4.130 1.00 0.00 N ATOM 1153 CA GLU A 74 -15.755 2.101 4.868 1.00 0.00 C ATOM 1154 C GLU A 74 -16.538 0.795 4.973 1.00 0.00 C ATOM 1155 O GLU A 74 -17.768 0.797 5.018 1.00 0.00 O ATOM 1156 CB GLU A 74 -16.615 3.170 4.190 1.00 0.00 C ATOM 1157 CG GLU A 74 -16.141 4.589 4.454 1.00 0.00 C ATOM 1158 CD GLU A 74 -16.499 5.075 5.845 1.00 0.00 C ATOM 1159 OE1 GLU A 74 -17.656 5.499 6.047 1.00 0.00 O ATOM 1160 OE2 GLU A 74 -15.621 5.031 6.732 1.00 0.00 O ATOM 0 H GLU A 74 -13.679 2.245 4.609 1.00 0.00 H new ATOM 0 HA GLU A 74 -15.500 2.433 5.874 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -16.621 2.992 3.115 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -17.644 3.069 4.535 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -15.060 4.637 4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -16.581 5.258 3.715 1.00 0.00 H new ATOM 1167 N LEU A 75 -15.815 -0.319 5.010 1.00 0.00 N ATOM 1168 CA LEU A 75 -16.440 -1.634 5.109 1.00 0.00 C ATOM 1169 C LEU A 75 -16.196 -2.250 6.483 1.00 0.00 C ATOM 1170 O LEU A 75 -15.307 -3.084 6.653 1.00 0.00 O ATOM 1171 CB LEU A 75 -15.899 -2.560 4.019 1.00 0.00 C ATOM 1172 CG LEU A 75 -16.817 -3.709 3.598 1.00 0.00 C ATOM 1173 CD1 LEU A 75 -18.086 -3.170 2.956 1.00 0.00 C ATOM 1174 CD2 LEU A 75 -16.093 -4.649 2.646 1.00 0.00 C ATOM 0 H LEU A 75 -14.796 -0.338 4.973 1.00 0.00 H new ATOM 0 HA LEU A 75 -17.514 -1.510 4.972 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -15.675 -1.959 3.138 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.956 -2.983 4.365 1.00 0.00 H new ATOM 0 HG LEU A 75 -17.096 -4.271 4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -18.727 -4.001 2.663 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -18.615 -2.538 3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -17.827 -2.583 2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -16.761 -5.460 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -15.784 -4.099 1.757 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -15.214 -5.062 3.141 1.00 0.00 H new ATOM 1186 N LYS A 76 -16.994 -1.835 7.461 1.00 0.00 N ATOM 1187 CA LYS A 76 -16.869 -2.348 8.820 1.00 0.00 C ATOM 1188 C LYS A 76 -17.524 -3.720 8.947 1.00 0.00 C ATOM 1189 O LYS A 76 -17.090 -4.556 9.739 1.00 0.00 O ATOM 1190 CB LYS A 76 -17.505 -1.374 9.815 1.00 0.00 C ATOM 1191 CG LYS A 76 -17.057 -1.592 11.250 1.00 0.00 C ATOM 1192 CD LYS A 76 -17.688 -0.580 12.191 1.00 0.00 C ATOM 1193 CE LYS A 76 -16.867 0.698 12.269 1.00 0.00 C ATOM 1194 NZ LYS A 76 -17.239 1.662 11.197 1.00 0.00 N ATOM 0 H LYS A 76 -17.735 -1.144 7.338 1.00 0.00 H new ATOM 0 HA LYS A 76 -15.808 -2.449 9.047 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -17.262 -0.354 9.518 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -18.589 -1.471 9.763 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -17.324 -2.600 11.566 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -15.971 -1.517 11.309 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -18.697 -0.345 11.851 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -17.780 -1.015 13.186 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -17.013 1.164 13.243 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -15.808 0.455 12.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -17.132 2.634 11.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.618 1.523 10.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -18.227 1.503 10.915 1.00 0.00 H new ATOM 1208 N THR A 77 -18.570 -3.946 8.159 1.00 0.00 N ATOM 1209 CA THR A 77 -19.284 -5.216 8.182 1.00 0.00 C ATOM 1210 C THR A 77 -19.838 -5.561 6.804 1.00 0.00 C ATOM 1211 O THR A 77 -20.353 -4.695 6.097 1.00 0.00 O ATOM 1212 CB THR A 77 -20.443 -5.191 9.197 1.00 0.00 C ATOM 1213 OG1 THR A 77 -21.166 -3.960 9.084 1.00 0.00 O ATOM 1214 CG2 THR A 77 -19.922 -5.351 10.617 1.00 0.00 C ATOM 0 H THR A 77 -18.942 -3.265 7.496 1.00 0.00 H new ATOM 0 HA THR A 77 -18.564 -5.977 8.482 1.00 0.00 H new ATOM 0 HB THR A 77 -21.109 -6.025 8.976 1.00 0.00 H new ATOM 0 HG1 THR A 77 -21.902 -3.952 9.731 1.00 0.00 H new ATOM 0 HG21 THR A 77 -20.758 -5.330 11.316 1.00 0.00 H new ATOM 0 HG22 THR A 77 -19.397 -6.302 10.707 1.00 0.00 H new ATOM 0 HG23 THR A 77 -19.237 -4.535 10.847 1.00 0.00 H new ATOM 1222 N SER A 78 -19.729 -6.831 6.429 1.00 0.00 N ATOM 1223 CA SER A 78 -20.217 -7.290 5.133 1.00 0.00 C ATOM 1224 C SER A 78 -21.482 -8.126 5.294 1.00 0.00 C ATOM 1225 O SER A 78 -21.640 -9.166 4.653 1.00 0.00 O ATOM 1226 CB SER A 78 -19.139 -8.108 4.419 1.00 0.00 C ATOM 1227 OG SER A 78 -18.820 -9.279 5.150 1.00 0.00 O ATOM 0 H SER A 78 -19.307 -7.561 7.004 1.00 0.00 H new ATOM 0 HA SER A 78 -20.456 -6.413 4.531 1.00 0.00 H new ATOM 0 HB2 SER A 78 -19.486 -8.381 3.422 1.00 0.00 H new ATOM 0 HB3 SER A 78 -18.243 -7.501 4.290 1.00 0.00 H new ATOM 0 HG SER A 78 -18.130 -9.785 4.672 1.00 0.00 H new ATOM 1233 N THR A 79 -22.383 -7.665 6.156 1.00 0.00 N ATOM 1234 CA THR A 79 -23.635 -8.369 6.403 1.00 0.00 C ATOM 1235 C THR A 79 -24.610 -8.181 5.247 1.00 0.00 C ATOM 1236 O THR A 79 -25.266 -7.145 5.138 1.00 0.00 O ATOM 1237 CB THR A 79 -24.302 -7.889 7.706 1.00 0.00 C ATOM 1238 OG1 THR A 79 -24.643 -6.502 7.599 1.00 0.00 O ATOM 1239 CG2 THR A 79 -23.378 -8.098 8.896 1.00 0.00 C ATOM 0 H THR A 79 -22.269 -6.807 6.695 1.00 0.00 H new ATOM 0 HA THR A 79 -23.389 -9.427 6.498 1.00 0.00 H new ATOM 0 HB THR A 79 -25.208 -8.475 7.862 1.00 0.00 H new ATOM 0 HG1 THR A 79 -24.965 -6.313 6.693 1.00 0.00 H new ATOM 0 HG21 THR A 79 -23.871 -7.752 9.804 1.00 0.00 H new ATOM 0 HG22 THR A 79 -23.143 -9.158 8.992 1.00 0.00 H new ATOM 0 HG23 THR A 79 -22.457 -7.534 8.745 1.00 0.00 H new ATOM 1247 N ALA A 80 -24.701 -9.188 4.385 1.00 0.00 N ATOM 1248 CA ALA A 80 -25.598 -9.134 3.238 1.00 0.00 C ATOM 1249 C ALA A 80 -26.680 -10.204 3.335 1.00 0.00 C ATOM 1250 O ALA A 80 -27.863 -9.893 3.476 1.00 0.00 O ATOM 1251 CB ALA A 80 -24.812 -9.291 1.945 1.00 0.00 C ATOM 0 H ALA A 80 -24.164 -10.052 4.460 1.00 0.00 H new ATOM 0 HA ALA A 80 -26.087 -8.160 3.237 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -25.495 -9.249 1.097 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -24.082 -8.486 1.863 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -24.295 -10.251 1.947 1.00 0.00 H new ATOM 1257 N ILE A 81 -26.267 -11.465 3.259 1.00 0.00 N ATOM 1258 CA ILE A 81 -27.201 -12.581 3.339 1.00 0.00 C ATOM 1259 C ILE A 81 -27.299 -13.114 4.764 1.00 0.00 C ATOM 1260 O ILE A 81 -28.349 -13.022 5.403 1.00 0.00 O ATOM 1261 CB ILE A 81 -26.788 -13.729 2.400 1.00 0.00 C ATOM 1262 CG1 ILE A 81 -26.673 -13.224 0.961 1.00 0.00 C ATOM 1263 CG2 ILE A 81 -27.789 -14.872 2.489 1.00 0.00 C ATOM 1264 CD1 ILE A 81 -25.981 -14.197 0.032 1.00 0.00 C ATOM 0 H ILE A 81 -25.291 -11.739 3.142 1.00 0.00 H new ATOM 0 HA ILE A 81 -28.174 -12.201 3.028 1.00 0.00 H new ATOM 0 HB ILE A 81 -25.812 -14.102 2.712 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -27.672 -13.015 0.577 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -26.127 -12.281 0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -27.484 -15.676 1.820 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -27.825 -15.246 3.512 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -28.777 -14.514 2.199 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -25.935 -13.773 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -24.970 -14.387 0.392 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -26.539 -15.133 0.005 1.00 0.00 H new ATOM 1276 N LEU A 82 -26.199 -13.670 5.259 1.00 0.00 N ATOM 1277 CA LEU A 82 -26.159 -14.218 6.611 1.00 0.00 C ATOM 1278 C LEU A 82 -24.732 -14.236 7.149 1.00 0.00 C ATOM 1279 O LEU A 82 -23.963 -15.154 6.866 1.00 0.00 O ATOM 1280 CB LEU A 82 -26.741 -15.632 6.627 1.00 0.00 C ATOM 1281 CG LEU A 82 -27.458 -16.049 7.911 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -26.496 -16.029 9.090 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -28.649 -15.140 8.176 1.00 0.00 C ATOM 0 H LEU A 82 -25.322 -13.754 4.745 1.00 0.00 H new ATOM 0 HA LEU A 82 -26.762 -13.577 7.254 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -27.442 -15.724 5.797 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -25.932 -16.338 6.441 1.00 0.00 H new ATOM 0 HG LEU A 82 -27.825 -17.068 7.785 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -27.024 -16.329 9.995 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -25.676 -16.722 8.902 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -26.098 -15.022 9.218 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -29.147 -15.452 9.094 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -28.305 -14.111 8.281 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -29.349 -15.205 7.343 1.00 0.00 H new ATOM 1295 N SER A 83 -24.386 -13.217 7.929 1.00 0.00 N ATOM 1296 CA SER A 83 -23.051 -13.115 8.507 1.00 0.00 C ATOM 1297 C SER A 83 -21.990 -13.049 7.413 1.00 0.00 C ATOM 1298 O SER A 83 -21.569 -14.075 6.880 1.00 0.00 O ATOM 1299 CB SER A 83 -22.779 -14.306 9.427 1.00 0.00 C ATOM 1300 OG SER A 83 -23.930 -14.641 10.183 1.00 0.00 O ATOM 0 H SER A 83 -25.012 -12.450 8.175 1.00 0.00 H new ATOM 0 HA SER A 83 -23.003 -12.196 9.091 1.00 0.00 H new ATOM 0 HB2 SER A 83 -22.468 -15.165 8.832 1.00 0.00 H new ATOM 0 HB3 SER A 83 -21.955 -14.069 10.100 1.00 0.00 H new ATOM 0 HG SER A 83 -23.730 -15.406 10.762 1.00 0.00 H new TER 1306 SER A 83