USER MOD reduce.3.24.130724 H: found=0, std=0, add=722, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 722 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 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -0.191 X(o=-0.19,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 84:sc= 0.695 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 MET CE :methyl -154:sc= -0.076 (180deg=-0.844) USER MOD Single : A 33 GLN : amide:sc= -0.285 X(o=-0.28,f=-0.047) USER MOD Single : A 34 LYS NZ :NH3+ 163:sc= -0.0285 (180deg=-0.25) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ -129:sc= 0.0367 (180deg=0) USER MOD Single : B 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 SER OG : rot -28:sc= 0.891 USER MOD Single : B 21 THR OG1 : rot 70:sc= 0.0622 USER MOD Single : B 24 SER OG : rot 180:sc= 0 USER MOD Single : B 30 MET CE :methyl 143:sc= -0.554 (180deg=-1.21) USER MOD Single : B 33 GLN : amide:sc= -1.3 K(o=-1.3,f=-2.2!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.447 -28.986 10.286 1.00 0.00 N ATOM 2 CA GLY A 1 8.907 -29.056 10.565 1.00 0.00 C ATOM 3 C GLY A 1 9.731 -28.321 9.528 1.00 0.00 C ATOM 4 O GLY A 1 10.196 -27.207 9.771 1.00 0.00 O ATOM 0 H1 GLY A 1 6.927 -29.504 11.023 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.142 -27.992 10.281 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.250 -29.414 9.359 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.106 -28.633 11.550 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.218 -30.100 10.598 1.00 0.00 H new ATOM 10 N HIS A 2 9.913 -28.944 8.368 1.00 0.00 N ATOM 11 CA HIS A 2 10.688 -28.340 7.290 1.00 0.00 C ATOM 12 C HIS A 2 9.786 -27.510 6.382 1.00 0.00 C ATOM 13 O HIS A 2 10.004 -26.310 6.204 1.00 0.00 O ATOM 14 CB HIS A 2 11.399 -29.422 6.474 1.00 0.00 C ATOM 15 CG HIS A 2 12.451 -28.887 5.549 1.00 0.00 C ATOM 16 ND1 HIS A 2 13.793 -29.169 5.697 1.00 0.00 N ATOM 17 CD2 HIS A 2 12.354 -28.091 4.458 1.00 0.00 C ATOM 18 CE1 HIS A 2 14.475 -28.567 4.739 1.00 0.00 C ATOM 19 NE2 HIS A 2 13.626 -27.907 3.973 1.00 0.00 N ATOM 0 H HIS A 2 9.535 -29.866 8.151 1.00 0.00 H new ATOM 0 HA HIS A 2 11.437 -27.683 7.733 1.00 0.00 H new ATOM 0 HB2 HIS A 2 11.858 -30.137 7.157 1.00 0.00 H new ATOM 0 HB3 HIS A 2 10.659 -29.969 5.890 1.00 0.00 H new ATOM 0 HD2 HIS A 2 11.445 -27.678 4.046 1.00 0.00 H new ATOM 0 HE1 HIS A 2 15.546 -28.608 4.605 1.00 0.00 H new ATOM 0 HE2 HIS A 2 13.874 -27.351 3.155 1.00 0.00 H new ATOM 28 N SER A 3 8.776 -28.155 5.810 1.00 0.00 N ATOM 29 CA SER A 3 7.838 -27.477 4.922 1.00 0.00 C ATOM 30 C SER A 3 6.826 -26.664 5.722 1.00 0.00 C ATOM 31 O SER A 3 6.380 -27.089 6.788 1.00 0.00 O ATOM 32 CB SER A 3 7.108 -28.492 4.040 1.00 0.00 C ATOM 33 OG SER A 3 8.021 -29.219 3.236 1.00 0.00 O ATOM 0 H SER A 3 8.585 -29.148 5.945 1.00 0.00 H new ATOM 0 HA SER A 3 8.406 -26.798 4.286 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.541 -29.181 4.666 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.390 -27.975 3.404 1.00 0.00 H new ATOM 0 HG SER A 3 7.530 -29.862 2.683 1.00 0.00 H new ATOM 39 N LEU A 4 6.471 -25.494 5.203 1.00 0.00 N ATOM 40 CA LEU A 4 5.511 -24.620 5.868 1.00 0.00 C ATOM 41 C LEU A 4 4.163 -24.643 5.143 1.00 0.00 C ATOM 42 O LEU A 4 4.118 -24.686 3.914 1.00 0.00 O ATOM 43 CB LEU A 4 6.047 -23.186 5.929 1.00 0.00 C ATOM 44 CG LEU A 4 7.071 -22.911 7.034 1.00 0.00 C ATOM 45 CD1 LEU A 4 8.342 -23.717 6.808 1.00 0.00 C ATOM 46 CD2 LEU A 4 7.388 -21.424 7.105 1.00 0.00 C ATOM 0 H LEU A 4 6.834 -25.128 4.323 1.00 0.00 H new ATOM 0 HA LEU A 4 5.366 -24.987 6.884 1.00 0.00 H new ATOM 0 HB2 LEU A 4 6.502 -22.946 4.968 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.205 -22.507 6.061 1.00 0.00 H new ATOM 0 HG LEU A 4 6.638 -23.220 7.985 1.00 0.00 H new ATOM 0 HD11 LEU A 4 9.054 -23.505 7.606 1.00 0.00 H new ATOM 0 HD12 LEU A 4 8.103 -24.781 6.808 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.780 -23.444 5.848 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.117 -21.245 7.895 1.00 0.00 H new ATOM 0 HD22 LEU A 4 7.798 -21.093 6.151 1.00 0.00 H new ATOM 0 HD23 LEU A 4 6.476 -20.867 7.320 1.00 0.00 H new ATOM 58 N PRO A 5 3.045 -24.616 5.896 1.00 0.00 N ATOM 59 CA PRO A 5 1.700 -24.633 5.309 1.00 0.00 C ATOM 60 C PRO A 5 1.416 -23.379 4.489 1.00 0.00 C ATOM 61 O PRO A 5 2.011 -22.327 4.723 1.00 0.00 O ATOM 62 CB PRO A 5 0.764 -24.694 6.526 1.00 0.00 C ATOM 63 CG PRO A 5 1.627 -25.102 7.671 1.00 0.00 C ATOM 64 CD PRO A 5 2.997 -24.572 7.366 1.00 0.00 C ATOM 0 HA PRO A 5 1.573 -25.469 4.621 1.00 0.00 H new ATOM 0 HB2 PRO A 5 0.297 -23.727 6.711 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -0.041 -25.411 6.366 1.00 0.00 H new ATOM 0 HG2 PRO A 5 1.250 -24.693 8.609 1.00 0.00 H new ATOM 0 HG3 PRO A 5 1.644 -26.186 7.780 1.00 0.00 H new ATOM 0 HD2 PRO A 5 3.132 -23.559 7.745 1.00 0.00 H new ATOM 0 HD3 PRO A 5 3.777 -25.187 7.815 1.00 0.00 H new ATOM 72 N PHE A 6 0.506 -23.496 3.528 1.00 0.00 N ATOM 73 CA PHE A 6 0.147 -22.369 2.676 1.00 0.00 C ATOM 74 C PHE A 6 -0.654 -21.334 3.459 1.00 0.00 C ATOM 75 O PHE A 6 -0.784 -20.186 3.035 1.00 0.00 O ATOM 76 CB PHE A 6 -0.658 -22.848 1.465 1.00 0.00 C ATOM 77 CG PHE A 6 -2.009 -23.407 1.816 1.00 0.00 C ATOM 78 CD1 PHE A 6 -2.143 -24.720 2.234 1.00 0.00 C ATOM 79 CD2 PHE A 6 -3.146 -22.618 1.725 1.00 0.00 C ATOM 80 CE1 PHE A 6 -3.384 -25.237 2.554 1.00 0.00 C ATOM 81 CE2 PHE A 6 -4.389 -23.129 2.043 1.00 0.00 C ATOM 82 CZ PHE A 6 -4.509 -24.441 2.459 1.00 0.00 C ATOM 0 H PHE A 6 0.004 -24.359 3.320 1.00 0.00 H new ATOM 0 HA PHE A 6 1.068 -21.903 2.325 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -0.788 -22.015 0.775 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -0.085 -23.611 0.939 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -1.267 -25.348 2.311 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.058 -21.591 1.401 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -3.474 -26.263 2.878 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -5.266 -22.504 1.967 1.00 0.00 H new ATOM 0 HZ PHE A 6 -5.480 -24.843 2.709 1.00 0.00 H new ATOM 92 N LYS A 7 -1.188 -21.749 4.606 1.00 0.00 N ATOM 93 CA LYS A 7 -1.981 -20.858 5.447 1.00 0.00 C ATOM 94 C LYS A 7 -1.180 -19.627 5.856 1.00 0.00 C ATOM 95 O LYS A 7 -1.620 -18.497 5.652 1.00 0.00 O ATOM 96 CB LYS A 7 -2.465 -21.597 6.695 1.00 0.00 C ATOM 97 CG LYS A 7 -3.426 -22.729 6.390 1.00 0.00 C ATOM 98 CD LYS A 7 -3.979 -23.342 7.665 1.00 0.00 C ATOM 99 CE LYS A 7 -5.026 -24.401 7.364 1.00 0.00 C ATOM 100 NZ LYS A 7 -5.589 -24.990 8.611 1.00 0.00 N ATOM 0 H LYS A 7 -1.086 -22.695 4.973 1.00 0.00 H new ATOM 0 HA LYS A 7 -2.842 -20.530 4.865 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -1.603 -21.996 7.229 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -2.952 -20.887 7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.247 -22.357 5.777 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -2.915 -23.496 5.807 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.166 -23.786 8.239 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -4.418 -22.561 8.285 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.830 -23.960 6.775 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -4.581 -25.190 6.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -6.300 -25.708 8.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -4.826 -25.432 9.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -6.035 -24.241 9.178 1.00 0.00 H new ATOM 114 N VAL A 8 -0.004 -19.855 6.433 1.00 0.00 N ATOM 115 CA VAL A 8 0.855 -18.762 6.870 1.00 0.00 C ATOM 116 C VAL A 8 1.202 -17.841 5.704 1.00 0.00 C ATOM 117 O VAL A 8 1.329 -16.628 5.875 1.00 0.00 O ATOM 118 CB VAL A 8 2.158 -19.284 7.507 1.00 0.00 C ATOM 119 CG1 VAL A 8 2.950 -18.140 8.119 1.00 0.00 C ATOM 120 CG2 VAL A 8 1.851 -20.346 8.554 1.00 0.00 C ATOM 0 H VAL A 8 0.375 -20.786 6.608 1.00 0.00 H new ATOM 0 HA VAL A 8 0.297 -18.202 7.621 1.00 0.00 H new ATOM 0 HB VAL A 8 2.766 -19.739 6.725 1.00 0.00 H new ATOM 0 HG11 VAL A 8 3.866 -18.529 8.564 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.202 -17.416 7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.351 -17.654 8.889 1.00 0.00 H new ATOM 0 HG21 VAL A 8 2.782 -20.704 8.994 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.223 -19.917 9.334 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.328 -21.179 8.085 1.00 0.00 H new ATOM 130 N VAL A 9 1.358 -18.425 4.519 1.00 0.00 N ATOM 131 CA VAL A 9 1.691 -17.657 3.326 1.00 0.00 C ATOM 132 C VAL A 9 0.561 -16.698 2.957 1.00 0.00 C ATOM 133 O VAL A 9 0.803 -15.536 2.631 1.00 0.00 O ATOM 134 CB VAL A 9 1.969 -18.571 2.115 1.00 0.00 C ATOM 135 CG1 VAL A 9 2.743 -17.816 1.045 1.00 0.00 C ATOM 136 CG2 VAL A 9 2.718 -19.823 2.538 1.00 0.00 C ATOM 0 H VAL A 9 1.259 -19.428 4.361 1.00 0.00 H new ATOM 0 HA VAL A 9 2.593 -17.094 3.564 1.00 0.00 H new ATOM 0 HB VAL A 9 1.011 -18.879 1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.931 -18.476 0.198 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.161 -16.956 0.713 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.693 -17.474 1.456 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.901 -20.450 1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 9 3.670 -19.543 2.989 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.121 -20.376 3.263 1.00 0.00 H new ATOM 146 N VAL A 10 -0.671 -17.196 3.010 1.00 0.00 N ATOM 147 CA VAL A 10 -1.841 -16.392 2.675 1.00 0.00 C ATOM 148 C VAL A 10 -2.055 -15.268 3.683 1.00 0.00 C ATOM 149 O VAL A 10 -2.267 -14.116 3.304 1.00 0.00 O ATOM 150 CB VAL A 10 -3.115 -17.256 2.607 1.00 0.00 C ATOM 151 CG1 VAL A 10 -4.326 -16.400 2.267 1.00 0.00 C ATOM 152 CG2 VAL A 10 -2.943 -18.373 1.591 1.00 0.00 C ATOM 0 H VAL A 10 -0.885 -18.155 3.283 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.650 -15.958 1.694 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.281 -17.705 3.586 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.215 -17.029 2.224 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.458 -15.636 3.033 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.173 -15.921 1.300 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.851 -18.975 1.554 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.752 -17.944 0.607 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.102 -19.003 1.881 1.00 0.00 H new ATOM 162 N ILE A 11 -2.003 -15.609 4.965 1.00 0.00 N ATOM 163 CA ILE A 11 -2.194 -14.626 6.025 1.00 0.00 C ATOM 164 C ILE A 11 -1.174 -13.495 5.920 1.00 0.00 C ATOM 165 O ILE A 11 -1.502 -12.330 6.146 1.00 0.00 O ATOM 166 CB ILE A 11 -2.084 -15.281 7.418 1.00 0.00 C ATOM 167 CG1 ILE A 11 -3.088 -16.431 7.551 1.00 0.00 C ATOM 168 CG2 ILE A 11 -2.301 -14.246 8.515 1.00 0.00 C ATOM 169 CD1 ILE A 11 -4.537 -15.996 7.462 1.00 0.00 C ATOM 0 H ILE A 11 -1.830 -16.558 5.296 1.00 0.00 H new ATOM 0 HA ILE A 11 -3.196 -14.214 5.902 1.00 0.00 H new ATOM 0 HB ILE A 11 -1.079 -15.689 7.529 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.891 -17.165 6.769 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -2.927 -16.932 8.506 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.220 -14.727 9.490 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -1.546 -13.464 8.432 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.293 -13.806 8.409 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.185 -16.866 7.565 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.753 -15.286 8.260 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.716 -15.522 6.497 1.00 0.00 H new ATOM 181 N SER A 12 0.061 -13.845 5.569 1.00 0.00 N ATOM 182 CA SER A 12 1.129 -12.858 5.434 1.00 0.00 C ATOM 183 C SER A 12 0.930 -11.996 4.191 1.00 0.00 C ATOM 184 O SER A 12 1.164 -10.788 4.218 1.00 0.00 O ATOM 185 CB SER A 12 2.489 -13.555 5.366 1.00 0.00 C ATOM 186 OG SER A 12 2.774 -14.239 6.572 1.00 0.00 O ATOM 0 H SER A 12 0.347 -14.804 5.373 1.00 0.00 H new ATOM 0 HA SER A 12 1.098 -12.211 6.310 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.498 -14.259 4.534 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.268 -12.819 5.169 1.00 0.00 H new ATOM 0 HG SER A 12 2.355 -15.125 6.553 1.00 0.00 H new ATOM 192 N ALA A 13 0.496 -12.626 3.102 1.00 0.00 N ATOM 193 CA ALA A 13 0.274 -11.919 1.847 1.00 0.00 C ATOM 194 C ALA A 13 -0.850 -10.898 1.974 1.00 0.00 C ATOM 195 O ALA A 13 -0.649 -9.708 1.735 1.00 0.00 O ATOM 196 CB ALA A 13 -0.038 -12.909 0.737 1.00 0.00 C ATOM 0 H ALA A 13 0.292 -13.625 3.065 1.00 0.00 H new ATOM 0 HA ALA A 13 1.188 -11.380 1.599 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.202 -12.370 -0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 13 0.799 -13.596 0.616 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.935 -13.472 0.993 1.00 0.00 H new ATOM 202 N ILE A 14 -2.032 -11.371 2.362 1.00 0.00 N ATOM 203 CA ILE A 14 -3.190 -10.502 2.519 1.00 0.00 C ATOM 204 C ILE A 14 -2.885 -9.340 3.458 1.00 0.00 C ATOM 205 O ILE A 14 -3.198 -8.189 3.156 1.00 0.00 O ATOM 206 CB ILE A 14 -4.409 -11.281 3.055 1.00 0.00 C ATOM 207 CG1 ILE A 14 -4.788 -12.403 2.084 1.00 0.00 C ATOM 208 CG2 ILE A 14 -5.587 -10.343 3.278 1.00 0.00 C ATOM 209 CD1 ILE A 14 -5.874 -13.318 2.607 1.00 0.00 C ATOM 0 H ILE A 14 -2.211 -12.353 2.573 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.427 -10.109 1.530 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.144 -11.727 4.014 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.118 -11.962 1.144 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -3.900 -12.996 1.863 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -6.437 -10.910 3.656 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.310 -9.577 4.003 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.858 -9.869 2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.090 -14.088 1.866 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -5.539 -13.788 3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -6.776 -12.738 2.801 1.00 0.00 H new ATOM 221 N LEU A 15 -2.269 -9.649 4.595 1.00 0.00 N ATOM 222 CA LEU A 15 -1.919 -8.629 5.577 1.00 0.00 C ATOM 223 C LEU A 15 -1.061 -7.540 4.941 1.00 0.00 C ATOM 224 O LEU A 15 -1.208 -6.358 5.253 1.00 0.00 O ATOM 225 CB LEU A 15 -1.172 -9.260 6.755 1.00 0.00 C ATOM 226 CG LEU A 15 -0.791 -8.292 7.879 1.00 0.00 C ATOM 227 CD1 LEU A 15 -2.037 -7.725 8.541 1.00 0.00 C ATOM 228 CD2 LEU A 15 0.091 -8.989 8.906 1.00 0.00 C ATOM 0 H LEU A 15 -2.002 -10.597 4.859 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.841 -8.177 5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.791 -10.053 7.174 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.264 -9.730 6.379 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.227 -7.466 7.446 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.746 -7.039 9.337 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.631 -7.190 7.800 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.628 -8.539 8.961 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.352 -8.287 9.698 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.448 -9.834 9.334 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.000 -9.346 8.422 1.00 0.00 H new ATOM 240 N ALA A 16 -0.166 -7.948 4.048 1.00 0.00 N ATOM 241 CA ALA A 16 0.717 -7.010 3.364 1.00 0.00 C ATOM 242 C ALA A 16 -0.074 -6.083 2.446 1.00 0.00 C ATOM 243 O ALA A 16 0.288 -4.920 2.264 1.00 0.00 O ATOM 244 CB ALA A 16 1.775 -7.765 2.579 1.00 0.00 C ATOM 0 H ALA A 16 -0.033 -8.923 3.781 1.00 0.00 H new ATOM 0 HA ALA A 16 1.211 -6.394 4.115 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.428 -7.055 2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.365 -8.379 3.260 1.00 0.00 H new ATOM 0 HB3 ALA A 16 1.292 -8.405 1.840 1.00 0.00 H new ATOM 250 N LEU A 17 -1.150 -6.604 1.864 1.00 0.00 N ATOM 251 CA LEU A 17 -1.991 -5.812 0.973 1.00 0.00 C ATOM 252 C LEU A 17 -2.781 -4.774 1.761 1.00 0.00 C ATOM 253 O LEU A 17 -3.032 -3.669 1.278 1.00 0.00 O ATOM 254 CB LEU A 17 -2.957 -6.714 0.195 1.00 0.00 C ATOM 255 CG LEU A 17 -2.403 -7.313 -1.105 1.00 0.00 C ATOM 256 CD1 LEU A 17 -2.013 -6.214 -2.083 1.00 0.00 C ATOM 257 CD2 LEU A 17 -1.216 -8.221 -0.820 1.00 0.00 C ATOM 0 H LEU A 17 -1.459 -7.567 1.993 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.339 -5.299 0.266 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.268 -7.531 0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.851 -6.138 -0.043 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.190 -7.914 -1.561 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.623 -6.662 -2.997 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.889 -5.610 -2.320 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.247 -5.582 -1.633 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.841 -8.634 -1.756 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.427 -7.647 -0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.529 -9.034 -0.165 1.00 0.00 H new ATOM 269 N VAL A 18 -3.168 -5.137 2.981 1.00 0.00 N ATOM 270 CA VAL A 18 -3.930 -4.240 3.841 1.00 0.00 C ATOM 271 C VAL A 18 -3.090 -3.040 4.264 1.00 0.00 C ATOM 272 O VAL A 18 -3.537 -1.898 4.177 1.00 0.00 O ATOM 273 CB VAL A 18 -4.440 -4.964 5.103 1.00 0.00 C ATOM 274 CG1 VAL A 18 -5.297 -4.033 5.946 1.00 0.00 C ATOM 275 CG2 VAL A 18 -5.213 -6.218 4.727 1.00 0.00 C ATOM 0 H VAL A 18 -2.966 -6.047 3.395 1.00 0.00 H new ATOM 0 HA VAL A 18 -4.785 -3.897 3.259 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.577 -5.263 5.698 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -5.647 -4.563 6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.705 -3.169 6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -6.154 -3.698 5.361 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.564 -6.714 5.632 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.067 -5.947 4.107 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.562 -6.894 4.172 1.00 0.00 H new ATOM 285 N VAL A 19 -1.870 -3.308 4.719 1.00 0.00 N ATOM 286 CA VAL A 19 -0.970 -2.249 5.159 1.00 0.00 C ATOM 287 C VAL A 19 -0.544 -1.361 3.995 1.00 0.00 C ATOM 288 O VAL A 19 -0.291 -0.171 4.175 1.00 0.00 O ATOM 289 CB VAL A 19 0.286 -2.818 5.846 1.00 0.00 C ATOM 290 CG1 VAL A 19 -0.096 -3.587 7.100 1.00 0.00 C ATOM 291 CG2 VAL A 19 1.067 -3.706 4.890 1.00 0.00 C ATOM 0 H VAL A 19 -1.483 -4.249 4.792 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.526 -1.651 5.881 1.00 0.00 H new ATOM 0 HB VAL A 19 0.926 -1.984 6.135 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.803 -3.982 7.573 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.608 -2.920 7.794 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.758 -4.411 6.834 1.00 0.00 H new ATOM 0 HG21 VAL A 19 1.950 -4.097 5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.437 -4.535 4.566 1.00 0.00 H new ATOM 0 HG23 VAL A 19 1.375 -3.124 4.022 1.00 0.00 H new ATOM 301 N LEU A 20 -0.460 -1.943 2.800 1.00 0.00 N ATOM 302 CA LEU A 20 -0.067 -1.191 1.614 1.00 0.00 C ATOM 303 C LEU A 20 -1.020 -0.020 1.392 1.00 0.00 C ATOM 304 O LEU A 20 -0.599 1.082 1.043 1.00 0.00 O ATOM 305 CB LEU A 20 -0.056 -2.098 0.381 1.00 0.00 C ATOM 306 CG LEU A 20 1.049 -1.797 -0.639 1.00 0.00 C ATOM 307 CD1 LEU A 20 0.924 -0.377 -1.177 1.00 0.00 C ATOM 308 CD2 LEU A 20 2.421 -2.011 -0.018 1.00 0.00 C ATOM 0 H LEU A 20 -0.658 -2.929 2.630 1.00 0.00 H new ATOM 0 HA LEU A 20 0.940 -0.804 1.770 1.00 0.00 H new ATOM 0 HB2 LEU A 20 0.047 -3.132 0.711 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -1.022 -2.018 -0.118 1.00 0.00 H new ATOM 0 HG LEU A 20 0.934 -2.487 -1.475 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.720 -0.190 -1.898 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -0.043 -0.256 -1.665 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.006 0.333 -0.354 1.00 0.00 H new ATOM 0 HD21 LEU A 20 3.193 -1.793 -0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.540 -1.347 0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.515 -3.046 0.309 1.00 0.00 H new ATOM 320 N THR A 21 -2.309 -0.269 1.607 1.00 0.00 N ATOM 321 CA THR A 21 -3.326 0.760 1.435 1.00 0.00 C ATOM 322 C THR A 21 -3.273 1.770 2.577 1.00 0.00 C ATOM 323 O THR A 21 -3.475 2.966 2.370 1.00 0.00 O ATOM 324 CB THR A 21 -4.739 0.151 1.368 1.00 0.00 C ATOM 325 OG1 THR A 21 -4.801 -0.828 0.324 1.00 0.00 O ATOM 326 CG2 THR A 21 -5.785 1.227 1.118 1.00 0.00 C ATOM 0 H THR A 21 -2.672 -1.176 1.901 1.00 0.00 H new ATOM 0 HA THR A 21 -3.114 1.264 0.492 1.00 0.00 H new ATOM 0 HB THR A 21 -4.950 -0.322 2.327 1.00 0.00 H new ATOM 0 HG1 THR A 21 -5.702 -1.212 0.289 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.774 0.770 1.075 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.757 1.957 1.927 1.00 0.00 H new ATOM 0 HG23 THR A 21 -5.575 1.726 0.172 1.00 0.00 H new ATOM 334 N ILE A 22 -3.002 1.278 3.783 1.00 0.00 N ATOM 335 CA ILE A 22 -2.919 2.139 4.958 1.00 0.00 C ATOM 336 C ILE A 22 -1.751 3.112 4.832 1.00 0.00 C ATOM 337 O ILE A 22 -1.848 4.269 5.242 1.00 0.00 O ATOM 338 CB ILE A 22 -2.764 1.313 6.251 1.00 0.00 C ATOM 339 CG1 ILE A 22 -3.953 0.362 6.414 1.00 0.00 C ATOM 340 CG2 ILE A 22 -2.643 2.233 7.459 1.00 0.00 C ATOM 341 CD1 ILE A 22 -3.799 -0.615 7.560 1.00 0.00 C ATOM 0 H ILE A 22 -2.836 0.289 3.972 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.851 2.701 5.015 1.00 0.00 H new ATOM 0 HB ILE A 22 -1.852 0.720 6.181 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.858 0.949 6.568 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.090 -0.197 5.488 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.534 1.634 8.363 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.770 2.875 7.342 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -3.538 2.850 7.538 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.679 -1.255 7.613 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -2.913 -1.229 7.398 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.693 -0.065 8.495 1.00 0.00 H new ATOM 353 N ILE A 23 -0.648 2.637 4.263 1.00 0.00 N ATOM 354 CA ILE A 23 0.535 3.468 4.073 1.00 0.00 C ATOM 355 C ILE A 23 0.252 4.575 3.064 1.00 0.00 C ATOM 356 O ILE A 23 0.591 5.738 3.286 1.00 0.00 O ATOM 357 CB ILE A 23 1.739 2.637 3.590 1.00 0.00 C ATOM 358 CG1 ILE A 23 2.186 1.662 4.682 1.00 0.00 C ATOM 359 CG2 ILE A 23 2.890 3.547 3.181 1.00 0.00 C ATOM 360 CD1 ILE A 23 2.775 2.336 5.904 1.00 0.00 C ATOM 0 H ILE A 23 -0.549 1.680 3.925 1.00 0.00 H new ATOM 0 HA ILE A 23 0.782 3.906 5.040 1.00 0.00 H new ATOM 0 HB ILE A 23 1.432 2.061 2.717 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.331 1.059 4.989 1.00 0.00 H new ATOM 0 HG13 ILE A 23 2.925 0.979 4.265 1.00 0.00 H new ATOM 0 HG21 ILE A 23 3.731 2.941 2.843 1.00 0.00 H new ATOM 0 HG22 ILE A 23 2.566 4.202 2.372 1.00 0.00 H new ATOM 0 HG23 ILE A 23 3.198 4.150 4.035 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.067 1.579 6.632 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.650 2.917 5.613 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.032 2.998 6.348 1.00 0.00 H new ATOM 372 N SER A 24 -0.377 4.199 1.953 1.00 0.00 N ATOM 373 CA SER A 24 -0.712 5.146 0.898 1.00 0.00 C ATOM 374 C SER A 24 -1.873 6.047 1.312 1.00 0.00 C ATOM 375 O SER A 24 -2.086 7.106 0.723 1.00 0.00 O ATOM 376 CB SER A 24 -1.065 4.398 -0.390 1.00 0.00 C ATOM 377 OG SER A 24 -1.444 5.298 -1.417 1.00 0.00 O ATOM 0 H SER A 24 -0.665 3.239 1.762 1.00 0.00 H new ATOM 0 HA SER A 24 0.161 5.775 0.722 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.209 3.808 -0.717 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.879 3.699 -0.197 1.00 0.00 H new ATOM 0 HG SER A 24 -1.663 4.795 -2.229 1.00 0.00 H new ATOM 383 N LEU A 25 -2.623 5.620 2.324 1.00 0.00 N ATOM 384 CA LEU A 25 -3.765 6.391 2.808 1.00 0.00 C ATOM 385 C LEU A 25 -3.311 7.593 3.631 1.00 0.00 C ATOM 386 O LEU A 25 -3.769 8.715 3.412 1.00 0.00 O ATOM 387 CB LEU A 25 -4.686 5.506 3.651 1.00 0.00 C ATOM 388 CG LEU A 25 -5.955 6.193 4.165 1.00 0.00 C ATOM 389 CD1 LEU A 25 -6.878 6.548 3.008 1.00 0.00 C ATOM 390 CD2 LEU A 25 -6.672 5.302 5.167 1.00 0.00 C ATOM 0 H LEU A 25 -2.461 4.746 2.824 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.312 6.756 1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.976 4.640 3.056 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.122 5.132 4.506 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.667 7.116 4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.774 7.035 3.393 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.363 7.224 2.326 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -7.160 5.640 2.475 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.571 5.805 5.523 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.947 4.363 4.687 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.012 5.099 6.011 1.00 0.00 H new ATOM 402 N ILE A 26 -2.413 7.349 4.579 1.00 0.00 N ATOM 403 CA ILE A 26 -1.901 8.409 5.439 1.00 0.00 C ATOM 404 C ILE A 26 -1.227 9.504 4.617 1.00 0.00 C ATOM 405 O ILE A 26 -1.405 10.692 4.887 1.00 0.00 O ATOM 406 CB ILE A 26 -0.893 7.863 6.471 1.00 0.00 C ATOM 407 CG1 ILE A 26 -1.547 6.785 7.343 1.00 0.00 C ATOM 408 CG2 ILE A 26 -0.342 8.992 7.332 1.00 0.00 C ATOM 409 CD1 ILE A 26 -2.718 7.283 8.166 1.00 0.00 C ATOM 0 H ILE A 26 -2.024 6.426 4.771 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.757 8.827 5.968 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.061 7.409 5.932 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -1.887 5.971 6.702 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.795 6.370 8.014 1.00 0.00 H new ATOM 0 HG21 ILE A 26 0.367 8.586 8.054 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.163 9.721 6.697 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.161 9.478 7.862 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.125 6.461 8.755 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.382 8.076 8.834 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.491 7.671 7.502 1.00 0.00 H new ATOM 421 N ILE A 27 -0.459 9.098 3.612 1.00 0.00 N ATOM 422 CA ILE A 27 0.243 10.049 2.760 1.00 0.00 C ATOM 423 C ILE A 27 -0.722 10.759 1.814 1.00 0.00 C ATOM 424 O ILE A 27 -0.551 11.939 1.514 1.00 0.00 O ATOM 425 CB ILE A 27 1.364 9.372 1.945 1.00 0.00 C ATOM 426 CG1 ILE A 27 2.198 10.423 1.210 1.00 0.00 C ATOM 427 CG2 ILE A 27 0.781 8.370 0.962 1.00 0.00 C ATOM 428 CD1 ILE A 27 2.893 11.400 2.134 1.00 0.00 C ATOM 0 H ILE A 27 -0.307 8.119 3.368 1.00 0.00 H new ATOM 0 HA ILE A 27 0.698 10.785 3.422 1.00 0.00 H new ATOM 0 HB ILE A 27 2.015 8.835 2.635 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.946 9.918 0.599 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.551 10.977 0.529 1.00 0.00 H new ATOM 0 HG21 ILE A 27 1.588 7.903 0.397 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.230 7.604 1.507 1.00 0.00 H new ATOM 0 HG23 ILE A 27 0.107 8.883 0.276 1.00 0.00 H new ATOM 0 HD11 ILE A 27 3.465 12.115 1.543 1.00 0.00 H new ATOM 0 HD12 ILE A 27 2.149 11.932 2.727 1.00 0.00 H new ATOM 0 HD13 ILE A 27 3.566 10.857 2.798 1.00 0.00 H new ATOM 440 N LEU A 28 -1.729 10.030 1.337 1.00 0.00 N ATOM 441 CA LEU A 28 -2.717 10.603 0.429 1.00 0.00 C ATOM 442 C LEU A 28 -3.385 11.814 1.067 1.00 0.00 C ATOM 443 O LEU A 28 -3.468 12.883 0.462 1.00 0.00 O ATOM 444 CB LEU A 28 -3.771 9.555 0.059 1.00 0.00 C ATOM 445 CG LEU A 28 -4.868 10.042 -0.892 1.00 0.00 C ATOM 446 CD1 LEU A 28 -4.278 10.419 -2.242 1.00 0.00 C ATOM 447 CD2 LEU A 28 -5.941 8.976 -1.055 1.00 0.00 C ATOM 0 H LEU A 28 -1.881 9.047 1.563 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.206 10.923 -0.479 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.268 8.703 -0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.240 9.195 0.975 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.328 10.931 -0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.073 10.762 -2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.547 11.216 -2.110 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.791 9.549 -2.682 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.713 9.338 -1.734 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.494 8.070 -1.464 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.385 8.756 -0.084 1.00 0.00 H new ATOM 459 N ILE A 29 -3.859 11.637 2.297 1.00 0.00 N ATOM 460 CA ILE A 29 -4.513 12.713 3.029 1.00 0.00 C ATOM 461 C ILE A 29 -3.504 13.782 3.434 1.00 0.00 C ATOM 462 O ILE A 29 -3.821 14.971 3.465 1.00 0.00 O ATOM 463 CB ILE A 29 -5.220 12.176 4.291 1.00 0.00 C ATOM 464 CG1 ILE A 29 -6.198 11.054 3.920 1.00 0.00 C ATOM 465 CG2 ILE A 29 -5.944 13.300 5.022 1.00 0.00 C ATOM 466 CD1 ILE A 29 -7.292 11.484 2.966 1.00 0.00 C ATOM 0 H ILE A 29 -3.801 10.756 2.807 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.258 13.153 2.366 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.464 11.767 4.961 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.640 10.233 3.471 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.655 10.668 4.831 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.436 12.900 5.909 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.225 14.063 5.319 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.690 13.742 4.362 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.942 10.636 2.752 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.877 12.284 3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.846 11.842 2.038 1.00 0.00 H new ATOM 478 N MET A 30 -2.285 13.347 3.742 1.00 0.00 N ATOM 479 CA MET A 30 -1.220 14.261 4.139 1.00 0.00 C ATOM 480 C MET A 30 -0.919 15.257 3.024 1.00 0.00 C ATOM 481 O MET A 30 -0.730 16.448 3.275 1.00 0.00 O ATOM 482 CB MET A 30 0.046 13.478 4.494 1.00 0.00 C ATOM 483 CG MET A 30 1.177 14.351 5.013 1.00 0.00 C ATOM 484 SD MET A 30 2.725 13.445 5.197 1.00 0.00 S ATOM 485 CE MET A 30 2.233 12.157 6.338 1.00 0.00 C ATOM 0 H MET A 30 -2.011 12.365 3.724 1.00 0.00 H new ATOM 0 HA MET A 30 -1.555 14.813 5.017 1.00 0.00 H new ATOM 0 HB2 MET A 30 -0.199 12.730 5.248 1.00 0.00 H new ATOM 0 HB3 MET A 30 0.390 12.940 3.611 1.00 0.00 H new ATOM 0 HG2 MET A 30 1.329 15.187 4.330 1.00 0.00 H new ATOM 0 HG3 MET A 30 0.892 14.774 5.976 1.00 0.00 H new ATOM 0 HE1 MET A 30 3.103 11.816 6.899 1.00 0.00 H new ATOM 0 HE2 MET A 30 1.487 12.549 7.029 1.00 0.00 H new ATOM 0 HE3 MET A 30 1.809 11.321 5.782 1.00 0.00 H new ATOM 495 N LEU A 31 -0.876 14.759 1.792 1.00 0.00 N ATOM 496 CA LEU A 31 -0.600 15.601 0.634 1.00 0.00 C ATOM 497 C LEU A 31 -1.850 16.369 0.219 1.00 0.00 C ATOM 498 O LEU A 31 -1.763 17.477 -0.311 1.00 0.00 O ATOM 499 CB LEU A 31 -0.094 14.746 -0.531 1.00 0.00 C ATOM 500 CG LEU A 31 0.231 15.515 -1.815 1.00 0.00 C ATOM 501 CD1 LEU A 31 1.347 16.519 -1.570 1.00 0.00 C ATOM 502 CD2 LEU A 31 0.613 14.553 -2.931 1.00 0.00 C ATOM 0 H LEU A 31 -1.029 13.775 1.570 1.00 0.00 H new ATOM 0 HA LEU A 31 0.172 16.320 0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 31 0.802 14.215 -0.208 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.846 13.991 -0.760 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.660 16.062 -2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.563 17.055 -2.494 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.036 17.228 -0.803 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.242 15.994 -1.237 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.841 15.117 -3.836 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.489 13.978 -2.632 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.217 13.874 -3.126 1.00 0.00 H new ATOM 514 N TRP A 32 -3.009 15.769 0.464 1.00 0.00 N ATOM 515 CA TRP A 32 -4.283 16.392 0.127 1.00 0.00 C ATOM 516 C TRP A 32 -4.438 17.723 0.855 1.00 0.00 C ATOM 517 O TRP A 32 -5.014 18.672 0.323 1.00 0.00 O ATOM 518 CB TRP A 32 -5.439 15.455 0.485 1.00 0.00 C ATOM 519 CG TRP A 32 -6.793 16.029 0.195 1.00 0.00 C ATOM 520 CD1 TRP A 32 -7.246 16.501 -1.005 1.00 0.00 C ATOM 521 CD2 TRP A 32 -7.872 16.187 1.123 1.00 0.00 C ATOM 522 NE1 TRP A 32 -8.541 16.946 -0.876 1.00 0.00 N ATOM 523 CE2 TRP A 32 -8.947 16.761 0.419 1.00 0.00 C ATOM 524 CE3 TRP A 32 -8.034 15.897 2.481 1.00 0.00 C ATOM 525 CZ2 TRP A 32 -10.165 17.051 1.027 1.00 0.00 C ATOM 526 CZ3 TRP A 32 -9.245 16.185 3.083 1.00 0.00 C ATOM 527 CH2 TRP A 32 -10.296 16.757 2.356 1.00 0.00 C ATOM 0 H TRP A 32 -3.092 14.849 0.896 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.302 16.582 -0.946 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -5.324 14.523 -0.068 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -5.379 15.207 1.545 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -6.672 16.522 -1.920 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -9.107 17.348 -1.623 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -7.228 15.456 3.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -10.978 17.492 0.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -9.382 15.965 4.131 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -11.230 16.970 2.855 1.00 0.00 H new ATOM 538 N GLN A 33 -3.918 17.781 2.077 1.00 0.00 N ATOM 539 CA GLN A 33 -3.986 18.995 2.882 1.00 0.00 C ATOM 540 C GLN A 33 -2.629 19.686 2.927 1.00 0.00 C ATOM 541 O GLN A 33 -2.519 20.830 3.369 1.00 0.00 O ATOM 542 CB GLN A 33 -4.450 18.668 4.303 1.00 0.00 C ATOM 543 CG GLN A 33 -5.845 18.071 4.369 1.00 0.00 C ATOM 544 CD GLN A 33 -6.913 19.028 3.877 1.00 0.00 C ATOM 545 OE1 GLN A 33 -7.465 19.810 4.651 1.00 0.00 O ATOM 546 NE2 GLN A 33 -7.213 18.969 2.585 1.00 0.00 N ATOM 0 H GLN A 33 -3.444 17.000 2.532 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.707 19.669 2.420 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.744 17.970 4.754 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -4.426 19.578 4.902 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.875 17.160 3.771 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -6.065 17.784 5.397 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.730 18.305 1.979 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -7.926 19.587 2.198 1.00 0.00 H new ATOM 555 N LYS A 34 -1.597 18.980 2.468 1.00 0.00 N ATOM 556 CA LYS A 34 -0.240 19.518 2.452 1.00 0.00 C ATOM 557 C LYS A 34 0.247 19.814 3.869 1.00 0.00 C ATOM 558 O LYS A 34 1.204 20.566 4.062 1.00 0.00 O ATOM 559 CB LYS A 34 -0.184 20.789 1.597 1.00 0.00 C ATOM 560 CG LYS A 34 -0.711 20.595 0.182 1.00 0.00 C ATOM 561 CD LYS A 34 -0.790 21.914 -0.571 1.00 0.00 C ATOM 562 CE LYS A 34 0.589 22.413 -0.976 1.00 0.00 C ATOM 563 NZ LYS A 34 1.221 21.534 -1.998 1.00 0.00 N ATOM 0 H LYS A 34 -1.676 18.031 2.101 1.00 0.00 H new ATOM 0 HA LYS A 34 0.419 18.767 2.015 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -0.762 21.572 2.087 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.847 21.138 1.547 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -0.062 19.906 -0.358 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.700 20.138 0.221 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -1.408 21.789 -1.460 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -1.279 22.661 0.054 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.507 23.426 -1.370 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.229 22.464 -0.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.006 22.041 -2.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 1.584 20.674 -1.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.515 21.272 -2.715 1.00 0.00 H new ATOM 577 N LYS A 35 -0.412 19.214 4.858 1.00 0.00 N ATOM 578 CA LYS A 35 -0.043 19.410 6.257 1.00 0.00 C ATOM 579 C LYS A 35 0.531 18.124 6.852 1.00 0.00 C ATOM 580 O LYS A 35 0.206 17.026 6.394 1.00 0.00 O ATOM 581 CB LYS A 35 -1.261 19.865 7.068 1.00 0.00 C ATOM 582 CG LYS A 35 -1.928 21.116 6.514 1.00 0.00 C ATOM 583 CD LYS A 35 -3.123 21.543 7.355 1.00 0.00 C ATOM 584 CE LYS A 35 -2.697 22.039 8.727 1.00 0.00 C ATOM 585 NZ LYS A 35 -3.851 22.561 9.511 1.00 0.00 N ATOM 0 H LYS A 35 -1.205 18.588 4.716 1.00 0.00 H new ATOM 0 HA LYS A 35 0.723 20.184 6.302 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -1.991 19.056 7.096 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -0.953 20.053 8.097 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -1.202 21.928 6.477 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -2.252 20.931 5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -3.670 22.331 6.837 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.807 20.702 7.468 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -2.223 21.225 9.276 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.950 22.825 8.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -3.519 22.890 10.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -4.288 23.354 8.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.553 21.804 9.642 1.00 0.00 H new ATOM 599 N PRO A 36 1.395 18.236 7.881 1.00 0.00 N ATOM 600 CA PRO A 36 2.009 17.068 8.524 1.00 0.00 C ATOM 601 C PRO A 36 1.019 16.278 9.377 1.00 0.00 C ATOM 602 O PRO A 36 0.349 16.834 10.247 1.00 0.00 O ATOM 603 CB PRO A 36 3.098 17.685 9.403 1.00 0.00 C ATOM 604 CG PRO A 36 2.594 19.050 9.719 1.00 0.00 C ATOM 605 CD PRO A 36 1.842 19.503 8.498 1.00 0.00 C ATOM 0 HA PRO A 36 2.382 16.351 7.793 1.00 0.00 H new ATOM 0 HB2 PRO A 36 3.255 17.100 10.309 1.00 0.00 H new ATOM 0 HB3 PRO A 36 4.054 17.726 8.881 1.00 0.00 H new ATOM 0 HG2 PRO A 36 1.945 19.034 10.594 1.00 0.00 H new ATOM 0 HG3 PRO A 36 3.417 19.728 9.945 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.999 20.142 8.760 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.479 20.076 7.824 1.00 0.00 H new ATOM 613 N ARG A 37 0.930 14.977 9.111 1.00 0.00 N ATOM 614 CA ARG A 37 0.028 14.101 9.852 1.00 0.00 C ATOM 615 C ARG A 37 0.750 12.840 10.317 1.00 0.00 C ATOM 616 O ARG A 37 1.566 12.279 9.587 1.00 0.00 O ATOM 617 CB ARG A 37 -1.174 13.726 8.982 1.00 0.00 C ATOM 618 CG ARG A 37 -2.012 14.920 8.554 1.00 0.00 C ATOM 619 CD ARG A 37 -2.690 15.582 9.743 1.00 0.00 C ATOM 620 NE ARG A 37 -3.570 14.658 10.450 1.00 0.00 N ATOM 621 CZ ARG A 37 -4.251 14.980 11.546 1.00 0.00 C ATOM 622 NH1 ARG A 37 -4.153 16.199 12.061 1.00 0.00 N ATOM 623 NH2 ARG A 37 -5.033 14.080 12.129 1.00 0.00 N ATOM 0 H ARG A 37 1.473 14.506 8.387 1.00 0.00 H new ATOM 0 HA ARG A 37 -0.321 14.639 10.733 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -0.820 13.204 8.093 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -1.806 13.028 9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -1.378 15.646 8.045 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -2.767 14.597 7.837 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -1.932 15.959 10.430 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -3.266 16.442 9.400 1.00 0.00 H new ATOM 0 HE ARG A 37 -3.669 13.711 10.083 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -3.553 16.894 11.616 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.677 16.441 12.902 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -5.111 13.142 11.736 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.555 14.326 12.970 1.00 0.00 H new ATOM 637 N TYR A 38 0.444 12.400 11.534 1.00 0.00 N ATOM 638 CA TYR A 38 1.069 11.204 12.093 1.00 0.00 C ATOM 639 C TYR A 38 0.029 10.303 12.753 1.00 0.00 C ATOM 640 O TYR A 38 -0.936 10.782 13.349 1.00 0.00 O ATOM 641 CB TYR A 38 2.143 11.593 13.110 1.00 0.00 C ATOM 642 CG TYR A 38 2.930 10.417 13.648 1.00 0.00 C ATOM 643 CD1 TYR A 38 4.060 9.953 12.985 1.00 0.00 C ATOM 644 CD2 TYR A 38 2.545 9.773 14.818 1.00 0.00 C ATOM 645 CE1 TYR A 38 4.783 8.881 13.473 1.00 0.00 C ATOM 646 CE2 TYR A 38 3.265 8.702 15.313 1.00 0.00 C ATOM 647 CZ TYR A 38 4.381 8.260 14.636 1.00 0.00 C ATOM 648 OH TYR A 38 5.102 7.194 15.128 1.00 0.00 O ATOM 0 H TYR A 38 -0.231 12.852 12.151 1.00 0.00 H new ATOM 0 HA TYR A 38 1.534 10.652 11.276 1.00 0.00 H new ATOM 0 HB2 TYR A 38 2.833 12.297 12.645 1.00 0.00 H new ATOM 0 HB3 TYR A 38 1.670 12.113 13.943 1.00 0.00 H new ATOM 0 HD1 TYR A 38 4.378 10.438 12.074 1.00 0.00 H new ATOM 0 HD2 TYR A 38 1.669 10.115 15.349 1.00 0.00 H new ATOM 0 HE1 TYR A 38 5.658 8.532 12.946 1.00 0.00 H new ATOM 0 HE2 TYR A 38 2.955 8.214 16.225 1.00 0.00 H new ATOM 0 HH TYR A 38 4.686 6.872 15.955 1.00 0.00 H new ATOM 658 N GLU A 39 0.235 8.994 12.640 1.00 0.00 N ATOM 659 CA GLU A 39 -0.678 8.020 13.228 1.00 0.00 C ATOM 660 C GLU A 39 -0.072 6.620 13.191 1.00 0.00 C ATOM 661 O GLU A 39 0.665 6.277 12.265 1.00 0.00 O ATOM 662 CB GLU A 39 -2.017 8.028 12.488 1.00 0.00 C ATOM 663 CG GLU A 39 -3.044 7.075 13.079 1.00 0.00 C ATOM 664 CD GLU A 39 -4.387 7.156 12.381 1.00 0.00 C ATOM 665 OE1 GLU A 39 -4.589 6.419 11.395 1.00 0.00 O ATOM 666 OE2 GLU A 39 -5.238 7.957 12.823 1.00 0.00 O ATOM 667 OXT GLU A 39 -0.358 5.853 14.134 1.00 0.00 O ATOM 0 H GLU A 39 1.027 8.583 12.146 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.847 8.299 14.268 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.423 9.039 12.500 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.847 7.765 11.444 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.666 6.055 13.014 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.175 7.300 14.138 1.00 0.00 H new TER 674 GLU A 39 ATOM 675 N GLY B 1 -6.494 -28.917 -7.019 1.00 0.00 N ATOM 676 CA GLY B 1 -7.932 -28.851 -6.830 1.00 0.00 C ATOM 677 C GLY B 1 -8.543 -27.607 -7.443 1.00 0.00 C ATOM 678 O GLY B 1 -8.023 -27.069 -8.420 1.00 0.00 O ATOM 0 H1 GLY B 1 -6.238 -29.843 -7.416 1.00 0.00 H new ATOM 0 H2 GLY B 1 -6.195 -28.165 -7.673 1.00 0.00 H new ATOM 0 H3 GLY B 1 -6.017 -28.789 -6.104 1.00 0.00 H new ATOM 0 HA2 GLY B 1 -8.394 -29.734 -7.272 1.00 0.00 H new ATOM 0 HA3 GLY B 1 -8.156 -28.874 -5.764 1.00 0.00 H new ATOM 684 N HIS B 2 -9.652 -27.148 -6.869 1.00 0.00 N ATOM 685 CA HIS B 2 -10.336 -25.959 -7.365 1.00 0.00 C ATOM 686 C HIS B 2 -9.725 -24.691 -6.776 1.00 0.00 C ATOM 687 O HIS B 2 -10.115 -23.579 -7.135 1.00 0.00 O ATOM 688 CB HIS B 2 -11.828 -26.024 -7.038 1.00 0.00 C ATOM 689 CG HIS B 2 -12.538 -27.154 -7.717 1.00 0.00 C ATOM 690 ND1 HIS B 2 -12.647 -28.414 -7.168 1.00 0.00 N ATOM 691 CD2 HIS B 2 -13.172 -27.209 -8.913 1.00 0.00 C ATOM 692 CE1 HIS B 2 -13.315 -29.197 -7.997 1.00 0.00 C ATOM 693 NE2 HIS B 2 -13.645 -28.490 -9.062 1.00 0.00 N ATOM 0 H HIS B 2 -10.096 -27.582 -6.060 1.00 0.00 H new ATOM 0 HA HIS B 2 -10.213 -25.928 -8.448 1.00 0.00 H new ATOM 0 HB2 HIS B 2 -11.952 -26.123 -5.960 1.00 0.00 H new ATOM 0 HB3 HIS B 2 -12.297 -25.084 -7.328 1.00 0.00 H new ATOM 0 HD2 HIS B 2 -13.284 -26.398 -9.617 1.00 0.00 H new ATOM 0 HE1 HIS B 2 -13.551 -30.238 -7.831 1.00 0.00 H new ATOM 0 HE2 HIS B 2 -14.167 -28.839 -9.866 1.00 0.00 H new ATOM 702 N SER B 3 -8.767 -24.865 -5.872 1.00 0.00 N ATOM 703 CA SER B 3 -8.102 -23.735 -5.233 1.00 0.00 C ATOM 704 C SER B 3 -6.834 -23.350 -5.987 1.00 0.00 C ATOM 705 O SER B 3 -6.130 -24.211 -6.515 1.00 0.00 O ATOM 706 CB SER B 3 -7.761 -24.072 -3.781 1.00 0.00 C ATOM 707 OG SER B 3 -6.907 -25.200 -3.706 1.00 0.00 O ATOM 0 H SER B 3 -8.433 -25.779 -5.565 1.00 0.00 H new ATOM 0 HA SER B 3 -8.786 -22.887 -5.252 1.00 0.00 H new ATOM 0 HB2 SER B 3 -7.279 -23.216 -3.309 1.00 0.00 H new ATOM 0 HB3 SER B 3 -8.678 -24.269 -3.225 1.00 0.00 H new ATOM 0 HG SER B 3 -6.703 -25.394 -2.767 1.00 0.00 H new ATOM 713 N LEU B 4 -6.549 -22.052 -6.035 1.00 0.00 N ATOM 714 CA LEU B 4 -5.365 -21.554 -6.726 1.00 0.00 C ATOM 715 C LEU B 4 -4.091 -22.127 -6.106 1.00 0.00 C ATOM 716 O LEU B 4 -4.039 -22.376 -4.901 1.00 0.00 O ATOM 717 CB LEU B 4 -5.325 -20.024 -6.682 1.00 0.00 C ATOM 718 CG LEU B 4 -6.472 -19.321 -7.412 1.00 0.00 C ATOM 719 CD1 LEU B 4 -6.375 -17.813 -7.231 1.00 0.00 C ATOM 720 CD2 LEU B 4 -6.464 -19.681 -8.892 1.00 0.00 C ATOM 0 H LEU B 4 -7.122 -21.327 -5.604 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.420 -21.878 -7.765 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -5.330 -19.706 -5.639 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -4.382 -19.689 -7.113 1.00 0.00 H new ATOM 0 HG LEU B 4 -7.413 -19.661 -6.980 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -7.198 -17.330 -7.757 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.429 -17.570 -6.170 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -5.428 -17.458 -7.637 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -7.286 -19.172 -9.395 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -5.519 -19.370 -9.337 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -6.581 -20.759 -9.005 1.00 0.00 H new ATOM 732 N PRO B 5 -3.043 -22.344 -6.924 1.00 0.00 N ATOM 733 CA PRO B 5 -1.769 -22.896 -6.444 1.00 0.00 C ATOM 734 C PRO B 5 -1.127 -22.022 -5.371 1.00 0.00 C ATOM 735 O PRO B 5 -1.191 -20.795 -5.434 1.00 0.00 O ATOM 736 CB PRO B 5 -0.890 -22.933 -7.701 1.00 0.00 C ATOM 737 CG PRO B 5 -1.845 -22.896 -8.844 1.00 0.00 C ATOM 738 CD PRO B 5 -3.011 -22.074 -8.373 1.00 0.00 C ATOM 0 HA PRO B 5 -1.903 -23.872 -5.977 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -0.208 -22.084 -7.730 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -0.278 -23.835 -7.728 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -1.383 -22.452 -9.726 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -2.162 -23.901 -9.122 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -2.869 -21.014 -8.583 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -3.939 -22.374 -8.860 1.00 0.00 H new ATOM 746 N PHE B 6 -0.509 -22.669 -4.387 1.00 0.00 N ATOM 747 CA PHE B 6 0.150 -21.957 -3.297 1.00 0.00 C ATOM 748 C PHE B 6 1.308 -21.118 -3.826 1.00 0.00 C ATOM 749 O PHE B 6 1.736 -20.156 -3.188 1.00 0.00 O ATOM 750 CB PHE B 6 0.659 -22.951 -2.249 1.00 0.00 C ATOM 751 CG PHE B 6 1.879 -23.720 -2.678 1.00 0.00 C ATOM 752 CD1 PHE B 6 1.827 -24.596 -3.752 1.00 0.00 C ATOM 753 CD2 PHE B 6 3.080 -23.564 -2.005 1.00 0.00 C ATOM 754 CE1 PHE B 6 2.949 -25.301 -4.145 1.00 0.00 C ATOM 755 CE2 PHE B 6 4.205 -24.267 -2.392 1.00 0.00 C ATOM 756 CZ PHE B 6 4.140 -25.137 -3.464 1.00 0.00 C ATOM 0 H PHE B 6 -0.451 -23.685 -4.322 1.00 0.00 H new ATOM 0 HA PHE B 6 -0.577 -21.291 -2.832 1.00 0.00 H new ATOM 0 HB2 PHE B 6 0.887 -22.410 -1.331 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -0.138 -23.656 -2.014 1.00 0.00 H new ATOM 0 HD1 PHE B 6 0.899 -24.729 -4.288 1.00 0.00 H new ATOM 0 HD2 PHE B 6 3.138 -22.885 -1.168 1.00 0.00 H new ATOM 0 HE1 PHE B 6 2.895 -25.979 -4.984 1.00 0.00 H new ATOM 0 HE2 PHE B 6 5.134 -24.137 -1.857 1.00 0.00 H new ATOM 0 HZ PHE B 6 5.018 -25.687 -3.769 1.00 0.00 H new ATOM 766 N LYS B 7 1.808 -21.493 -4.998 1.00 0.00 N ATOM 767 CA LYS B 7 2.918 -20.787 -5.627 1.00 0.00 C ATOM 768 C LYS B 7 2.574 -19.317 -5.846 1.00 0.00 C ATOM 769 O LYS B 7 3.443 -18.447 -5.766 1.00 0.00 O ATOM 770 CB LYS B 7 3.273 -21.451 -6.959 1.00 0.00 C ATOM 771 CG LYS B 7 4.426 -20.783 -7.691 1.00 0.00 C ATOM 772 CD LYS B 7 4.960 -21.662 -8.812 1.00 0.00 C ATOM 773 CE LYS B 7 3.908 -21.921 -9.880 1.00 0.00 C ATOM 774 NZ LYS B 7 4.399 -22.852 -10.932 1.00 0.00 N ATOM 0 H LYS B 7 1.459 -22.287 -5.535 1.00 0.00 H new ATOM 0 HA LYS B 7 3.780 -20.839 -4.962 1.00 0.00 H new ATOM 0 HB2 LYS B 7 3.527 -22.495 -6.777 1.00 0.00 H new ATOM 0 HB3 LYS B 7 2.394 -21.444 -7.603 1.00 0.00 H new ATOM 0 HG2 LYS B 7 4.094 -19.830 -8.102 1.00 0.00 H new ATOM 0 HG3 LYS B 7 5.228 -20.564 -6.986 1.00 0.00 H new ATOM 0 HD2 LYS B 7 5.828 -21.184 -9.266 1.00 0.00 H new ATOM 0 HD3 LYS B 7 5.299 -22.612 -8.398 1.00 0.00 H new ATOM 0 HE2 LYS B 7 3.015 -22.338 -9.415 1.00 0.00 H new ATOM 0 HE3 LYS B 7 3.617 -20.976 -10.339 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 3.652 -23.001 -11.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 5.236 -22.443 -11.394 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 4.652 -23.763 -10.499 1.00 0.00 H new ATOM 788 N VAL B 8 1.303 -19.047 -6.123 1.00 0.00 N ATOM 789 CA VAL B 8 0.839 -17.684 -6.355 1.00 0.00 C ATOM 790 C VAL B 8 0.894 -16.861 -5.070 1.00 0.00 C ATOM 791 O VAL B 8 1.194 -15.668 -5.097 1.00 0.00 O ATOM 792 CB VAL B 8 -0.603 -17.666 -6.898 1.00 0.00 C ATOM 793 CG1 VAL B 8 -0.962 -16.286 -7.425 1.00 0.00 C ATOM 794 CG2 VAL B 8 -0.784 -18.721 -7.978 1.00 0.00 C ATOM 0 H VAL B 8 0.574 -19.757 -6.192 1.00 0.00 H new ATOM 0 HA VAL B 8 1.505 -17.244 -7.097 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.280 -17.902 -6.077 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.984 -16.296 -7.804 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.880 -15.556 -6.619 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -0.279 -16.015 -8.230 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.809 -18.691 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -0.096 -18.522 -8.800 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.577 -19.707 -7.562 1.00 0.00 H new ATOM 804 N VAL B 9 0.600 -17.513 -3.948 1.00 0.00 N ATOM 805 CA VAL B 9 0.609 -16.849 -2.648 1.00 0.00 C ATOM 806 C VAL B 9 2.026 -16.487 -2.213 1.00 0.00 C ATOM 807 O VAL B 9 2.257 -15.416 -1.652 1.00 0.00 O ATOM 808 CB VAL B 9 -0.021 -17.737 -1.558 1.00 0.00 C ATOM 809 CG1 VAL B 9 -0.309 -16.922 -0.310 1.00 0.00 C ATOM 810 CG2 VAL B 9 -1.284 -18.409 -2.066 1.00 0.00 C ATOM 0 H VAL B 9 0.352 -18.502 -3.913 1.00 0.00 H new ATOM 0 HA VAL B 9 0.020 -15.939 -2.765 1.00 0.00 H new ATOM 0 HB VAL B 9 0.694 -18.519 -1.301 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -0.754 -17.565 0.450 1.00 0.00 H new ATOM 0 HG12 VAL B 9 0.621 -16.499 0.071 1.00 0.00 H new ATOM 0 HG13 VAL B 9 -1.001 -16.116 -0.554 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -1.708 -19.030 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL B 9 -2.008 -17.649 -2.359 1.00 0.00 H new ATOM 0 HG23 VAL B 9 -1.043 -19.032 -2.928 1.00 0.00 H new ATOM 820 N VAL B 10 2.968 -17.388 -2.469 1.00 0.00 N ATOM 821 CA VAL B 10 4.361 -17.172 -2.087 1.00 0.00 C ATOM 822 C VAL B 10 4.945 -15.928 -2.754 1.00 0.00 C ATOM 823 O VAL B 10 5.434 -15.026 -2.075 1.00 0.00 O ATOM 824 CB VAL B 10 5.234 -18.392 -2.438 1.00 0.00 C ATOM 825 CG1 VAL B 10 6.674 -18.169 -1.995 1.00 0.00 C ATOM 826 CG2 VAL B 10 4.669 -19.654 -1.804 1.00 0.00 C ATOM 0 H VAL B 10 2.793 -18.276 -2.940 1.00 0.00 H new ATOM 0 HA VAL B 10 4.367 -17.026 -1.007 1.00 0.00 H new ATOM 0 HB VAL B 10 5.225 -18.518 -3.521 1.00 0.00 H new ATOM 0 HG11 VAL B 10 7.273 -19.042 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL B 10 7.078 -17.291 -2.499 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.703 -18.014 -0.916 1.00 0.00 H new ATOM 0 HG21 VAL B 10 5.299 -20.505 -2.063 1.00 0.00 H new ATOM 0 HG22 VAL B 10 4.645 -19.537 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL B 10 3.658 -19.825 -2.173 1.00 0.00 H new ATOM 836 N ILE B 11 4.893 -15.885 -4.082 1.00 0.00 N ATOM 837 CA ILE B 11 5.428 -14.750 -4.828 1.00 0.00 C ATOM 838 C ILE B 11 4.717 -13.452 -4.462 1.00 0.00 C ATOM 839 O ILE B 11 5.347 -12.402 -4.357 1.00 0.00 O ATOM 840 CB ILE B 11 5.328 -14.972 -6.352 1.00 0.00 C ATOM 841 CG1 ILE B 11 3.919 -15.433 -6.733 1.00 0.00 C ATOM 842 CG2 ILE B 11 6.372 -15.981 -6.807 1.00 0.00 C ATOM 843 CD1 ILE B 11 3.730 -15.651 -8.220 1.00 0.00 C ATOM 0 H ILE B 11 4.488 -16.620 -4.662 1.00 0.00 H new ATOM 0 HA ILE B 11 6.479 -14.668 -4.551 1.00 0.00 H new ATOM 0 HB ILE B 11 5.523 -14.027 -6.858 1.00 0.00 H new ATOM 0 HG12 ILE B 11 3.696 -16.362 -6.208 1.00 0.00 H new ATOM 0 HG13 ILE B 11 3.198 -14.691 -6.389 1.00 0.00 H new ATOM 0 HG21 ILE B 11 6.290 -16.128 -7.884 1.00 0.00 H new ATOM 0 HG22 ILE B 11 7.368 -15.608 -6.566 1.00 0.00 H new ATOM 0 HG23 ILE B 11 6.207 -16.930 -6.297 1.00 0.00 H new ATOM 0 HD11 ILE B 11 2.708 -15.976 -8.413 1.00 0.00 H new ATOM 0 HD12 ILE B 11 3.920 -14.719 -8.752 1.00 0.00 H new ATOM 0 HD13 ILE B 11 4.426 -16.415 -8.567 1.00 0.00 H new ATOM 855 N SER B 12 3.405 -13.528 -4.266 1.00 0.00 N ATOM 856 CA SER B 12 2.619 -12.350 -3.912 1.00 0.00 C ATOM 857 C SER B 12 3.006 -11.833 -2.529 1.00 0.00 C ATOM 858 O SER B 12 3.058 -10.626 -2.299 1.00 0.00 O ATOM 859 CB SER B 12 1.123 -12.670 -3.950 1.00 0.00 C ATOM 860 OG SER B 12 0.765 -13.566 -2.915 1.00 0.00 O ATOM 0 H SER B 12 2.864 -14.389 -4.346 1.00 0.00 H new ATOM 0 HA SER B 12 2.832 -11.572 -4.645 1.00 0.00 H new ATOM 0 HB2 SER B 12 0.549 -11.749 -3.852 1.00 0.00 H new ATOM 0 HB3 SER B 12 0.866 -13.105 -4.916 1.00 0.00 H new ATOM 0 HG SER B 12 1.537 -14.125 -2.685 1.00 0.00 H new ATOM 866 N ALA B 13 3.275 -12.758 -1.612 1.00 0.00 N ATOM 867 CA ALA B 13 3.654 -12.400 -0.249 1.00 0.00 C ATOM 868 C ALA B 13 5.003 -11.692 -0.214 1.00 0.00 C ATOM 869 O ALA B 13 5.115 -10.577 0.296 1.00 0.00 O ATOM 870 CB ALA B 13 3.688 -13.641 0.633 1.00 0.00 C ATOM 0 H ALA B 13 3.237 -13.762 -1.788 1.00 0.00 H new ATOM 0 HA ALA B 13 2.903 -11.710 0.136 1.00 0.00 H new ATOM 0 HB1 ALA B 13 3.972 -13.359 1.647 1.00 0.00 H new ATOM 0 HB2 ALA B 13 2.701 -14.104 0.648 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.415 -14.350 0.236 1.00 0.00 H new ATOM 876 N ILE B 14 6.028 -12.345 -0.758 1.00 0.00 N ATOM 877 CA ILE B 14 7.371 -11.777 -0.783 1.00 0.00 C ATOM 878 C ILE B 14 7.398 -10.461 -1.558 1.00 0.00 C ATOM 879 O ILE B 14 8.057 -9.506 -1.151 1.00 0.00 O ATOM 880 CB ILE B 14 8.388 -12.759 -1.405 1.00 0.00 C ATOM 881 CG1 ILE B 14 9.802 -12.170 -1.361 1.00 0.00 C ATOM 882 CG2 ILE B 14 7.998 -13.103 -2.835 1.00 0.00 C ATOM 883 CD1 ILE B 14 10.339 -11.987 0.042 1.00 0.00 C ATOM 0 H ILE B 14 5.953 -13.267 -1.187 1.00 0.00 H new ATOM 0 HA ILE B 14 7.655 -11.587 0.252 1.00 0.00 H new ATOM 0 HB ILE B 14 8.379 -13.677 -0.817 1.00 0.00 H new ATOM 0 HG12 ILE B 14 10.476 -12.822 -1.917 1.00 0.00 H new ATOM 0 HG13 ILE B 14 9.801 -11.206 -1.869 1.00 0.00 H new ATOM 0 HG21 ILE B 14 8.727 -13.796 -3.254 1.00 0.00 H new ATOM 0 HG22 ILE B 14 7.012 -13.567 -2.842 1.00 0.00 H new ATOM 0 HG23 ILE B 14 7.975 -12.193 -3.435 1.00 0.00 H new ATOM 0 HD11 ILE B 14 11.343 -11.566 -0.005 1.00 0.00 H new ATOM 0 HD12 ILE B 14 9.688 -11.311 0.596 1.00 0.00 H new ATOM 0 HD13 ILE B 14 10.373 -12.952 0.547 1.00 0.00 H new ATOM 895 N LEU B 15 6.674 -10.420 -2.672 1.00 0.00 N ATOM 896 CA LEU B 15 6.614 -9.223 -3.503 1.00 0.00 C ATOM 897 C LEU B 15 5.917 -8.087 -2.766 1.00 0.00 C ATOM 898 O LEU B 15 6.296 -6.923 -2.894 1.00 0.00 O ATOM 899 CB LEU B 15 5.879 -9.524 -4.814 1.00 0.00 C ATOM 900 CG LEU B 15 5.717 -8.334 -5.761 1.00 0.00 C ATOM 901 CD1 LEU B 15 7.072 -7.865 -6.268 1.00 0.00 C ATOM 902 CD2 LEU B 15 4.807 -8.701 -6.923 1.00 0.00 C ATOM 0 H LEU B 15 6.120 -11.203 -3.020 1.00 0.00 H new ATOM 0 HA LEU B 15 7.635 -8.914 -3.729 1.00 0.00 H new ATOM 0 HB2 LEU B 15 6.416 -10.314 -5.339 1.00 0.00 H new ATOM 0 HB3 LEU B 15 4.890 -9.914 -4.575 1.00 0.00 H new ATOM 0 HG LEU B 15 5.257 -7.514 -5.209 1.00 0.00 H new ATOM 0 HD11 LEU B 15 6.936 -7.018 -6.940 1.00 0.00 H new ATOM 0 HD12 LEU B 15 7.691 -7.562 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU B 15 7.561 -8.678 -6.804 1.00 0.00 H new ATOM 0 HD21 LEU B 15 4.702 -7.844 -7.588 1.00 0.00 H new ATOM 0 HD22 LEU B 15 5.239 -9.536 -7.474 1.00 0.00 H new ATOM 0 HD23 LEU B 15 3.827 -8.986 -6.541 1.00 0.00 H new ATOM 914 N ALA B 16 4.898 -8.435 -1.988 1.00 0.00 N ATOM 915 CA ALA B 16 4.140 -7.449 -1.228 1.00 0.00 C ATOM 916 C ALA B 16 5.035 -6.708 -0.240 1.00 0.00 C ATOM 917 O ALA B 16 4.956 -5.487 -0.117 1.00 0.00 O ATOM 918 CB ALA B 16 2.989 -8.121 -0.501 1.00 0.00 C ATOM 0 H ALA B 16 4.577 -9.396 -1.867 1.00 0.00 H new ATOM 0 HA ALA B 16 3.737 -6.717 -1.928 1.00 0.00 H new ATOM 0 HB1 ALA B 16 2.430 -7.375 0.063 1.00 0.00 H new ATOM 0 HB2 ALA B 16 2.329 -8.597 -1.226 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.381 -8.874 0.182 1.00 0.00 H new ATOM 924 N LEU B 17 5.883 -7.454 0.464 1.00 0.00 N ATOM 925 CA LEU B 17 6.793 -6.858 1.436 1.00 0.00 C ATOM 926 C LEU B 17 7.758 -5.900 0.748 1.00 0.00 C ATOM 927 O LEU B 17 8.073 -4.834 1.277 1.00 0.00 O ATOM 928 CB LEU B 17 7.572 -7.941 2.184 1.00 0.00 C ATOM 929 CG LEU B 17 6.724 -8.902 3.024 1.00 0.00 C ATOM 930 CD1 LEU B 17 7.618 -9.868 3.787 1.00 0.00 C ATOM 931 CD2 LEU B 17 5.829 -8.137 3.987 1.00 0.00 C ATOM 0 H LEU B 17 5.958 -8.468 0.380 1.00 0.00 H new ATOM 0 HA LEU B 17 6.198 -6.298 2.157 1.00 0.00 H new ATOM 0 HB2 LEU B 17 8.138 -8.524 1.458 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.297 -7.456 2.839 1.00 0.00 H new ATOM 0 HG LEU B 17 6.087 -9.473 2.348 1.00 0.00 H new ATOM 0 HD11 LEU B 17 7.001 -10.544 4.379 1.00 0.00 H new ATOM 0 HD12 LEU B 17 8.215 -10.446 3.081 1.00 0.00 H new ATOM 0 HD13 LEU B 17 8.279 -9.307 4.448 1.00 0.00 H new ATOM 0 HD21 LEU B 17 5.237 -8.842 4.572 1.00 0.00 H new ATOM 0 HD22 LEU B 17 6.445 -7.537 4.657 1.00 0.00 H new ATOM 0 HD23 LEU B 17 5.163 -7.484 3.424 1.00 0.00 H new ATOM 943 N VAL B 18 8.226 -6.288 -0.436 1.00 0.00 N ATOM 944 CA VAL B 18 9.144 -5.456 -1.201 1.00 0.00 C ATOM 945 C VAL B 18 8.467 -4.149 -1.591 1.00 0.00 C ATOM 946 O VAL B 18 9.100 -3.094 -1.627 1.00 0.00 O ATOM 947 CB VAL B 18 9.635 -6.174 -2.474 1.00 0.00 C ATOM 948 CG1 VAL B 18 10.566 -5.278 -3.277 1.00 0.00 C ATOM 949 CG2 VAL B 18 10.328 -7.481 -2.114 1.00 0.00 C ATOM 0 H VAL B 18 7.984 -7.172 -0.884 1.00 0.00 H new ATOM 0 HA VAL B 18 10.007 -5.252 -0.567 1.00 0.00 H new ATOM 0 HB VAL B 18 8.767 -6.401 -3.093 1.00 0.00 H new ATOM 0 HG11 VAL B 18 10.899 -5.807 -4.170 1.00 0.00 H new ATOM 0 HG12 VAL B 18 10.036 -4.371 -3.569 1.00 0.00 H new ATOM 0 HG13 VAL B 18 11.431 -5.013 -2.668 1.00 0.00 H new ATOM 0 HG21 VAL B 18 10.668 -7.975 -3.024 1.00 0.00 H new ATOM 0 HG22 VAL B 18 11.184 -7.274 -1.472 1.00 0.00 H new ATOM 0 HG23 VAL B 18 9.628 -8.131 -1.588 1.00 0.00 H new ATOM 959 N VAL B 19 7.171 -4.230 -1.876 1.00 0.00 N ATOM 960 CA VAL B 19 6.394 -3.058 -2.260 1.00 0.00 C ATOM 961 C VAL B 19 6.190 -2.123 -1.073 1.00 0.00 C ATOM 962 O VAL B 19 6.318 -0.908 -1.205 1.00 0.00 O ATOM 963 CB VAL B 19 5.017 -3.455 -2.832 1.00 0.00 C ATOM 964 CG1 VAL B 19 4.145 -2.226 -3.050 1.00 0.00 C ATOM 965 CG2 VAL B 19 5.183 -4.232 -4.129 1.00 0.00 C ATOM 0 H VAL B 19 6.636 -5.098 -1.848 1.00 0.00 H new ATOM 0 HA VAL B 19 6.962 -2.542 -3.034 1.00 0.00 H new ATOM 0 HB VAL B 19 4.519 -4.098 -2.106 1.00 0.00 H new ATOM 0 HG11 VAL B 19 3.180 -2.532 -3.454 1.00 0.00 H new ATOM 0 HG12 VAL B 19 3.995 -1.713 -2.100 1.00 0.00 H new ATOM 0 HG13 VAL B 19 4.635 -1.552 -3.753 1.00 0.00 H new ATOM 0 HG21 VAL B 19 4.202 -4.504 -4.518 1.00 0.00 H new ATOM 0 HG22 VAL B 19 5.705 -3.614 -4.859 1.00 0.00 H new ATOM 0 HG23 VAL B 19 5.762 -5.136 -3.940 1.00 0.00 H new ATOM 975 N LEU B 20 5.881 -2.697 0.089 1.00 0.00 N ATOM 976 CA LEU B 20 5.655 -1.901 1.291 1.00 0.00 C ATOM 977 C LEU B 20 6.878 -1.050 1.611 1.00 0.00 C ATOM 978 O LEU B 20 6.752 0.069 2.110 1.00 0.00 O ATOM 979 CB LEU B 20 5.313 -2.803 2.479 1.00 0.00 C ATOM 980 CG LEU B 20 4.962 -2.064 3.774 1.00 0.00 C ATOM 981 CD1 LEU B 20 3.708 -1.218 3.592 1.00 0.00 C ATOM 982 CD2 LEU B 20 4.775 -3.053 4.914 1.00 0.00 C ATOM 0 H LEU B 20 5.782 -3.703 0.222 1.00 0.00 H new ATOM 0 HA LEU B 20 4.811 -1.238 1.104 1.00 0.00 H new ATOM 0 HB2 LEU B 20 4.472 -3.439 2.202 1.00 0.00 H new ATOM 0 HB3 LEU B 20 6.160 -3.461 2.672 1.00 0.00 H new ATOM 0 HG LEU B 20 5.789 -1.398 4.022 1.00 0.00 H new ATOM 0 HD11 LEU B 20 3.478 -0.703 4.525 1.00 0.00 H new ATOM 0 HD12 LEU B 20 3.875 -0.484 2.804 1.00 0.00 H new ATOM 0 HD13 LEU B 20 2.872 -1.861 3.317 1.00 0.00 H new ATOM 0 HD21 LEU B 20 4.526 -2.513 5.827 1.00 0.00 H new ATOM 0 HD22 LEU B 20 3.967 -3.743 4.669 1.00 0.00 H new ATOM 0 HD23 LEU B 20 5.698 -3.614 5.064 1.00 0.00 H new ATOM 994 N THR B 21 8.060 -1.580 1.315 1.00 0.00 N ATOM 995 CA THR B 21 9.300 -0.854 1.560 1.00 0.00 C ATOM 996 C THR B 21 9.458 0.275 0.548 1.00 0.00 C ATOM 997 O THR B 21 9.854 1.385 0.898 1.00 0.00 O ATOM 998 CB THR B 21 10.530 -1.779 1.482 1.00 0.00 C ATOM 999 OG1 THR B 21 10.389 -2.863 2.408 1.00 0.00 O ATOM 1000 CG2 THR B 21 11.808 -1.009 1.789 1.00 0.00 C ATOM 0 H THR B 21 8.185 -2.506 0.907 1.00 0.00 H new ATOM 0 HA THR B 21 9.242 -0.445 2.569 1.00 0.00 H new ATOM 0 HB THR B 21 10.595 -2.173 0.468 1.00 0.00 H new ATOM 0 HG1 THR B 21 9.681 -3.467 2.100 1.00 0.00 H new ATOM 0 HG21 THR B 21 12.662 -1.683 1.728 1.00 0.00 H new ATOM 0 HG22 THR B 21 11.929 -0.202 1.066 1.00 0.00 H new ATOM 0 HG23 THR B 21 11.748 -0.590 2.793 1.00 0.00 H new ATOM 1008 N ILE B 22 9.138 -0.020 -0.710 1.00 0.00 N ATOM 1009 CA ILE B 22 9.229 0.970 -1.775 1.00 0.00 C ATOM 1010 C ILE B 22 8.297 2.143 -1.495 1.00 0.00 C ATOM 1011 O ILE B 22 8.668 3.301 -1.679 1.00 0.00 O ATOM 1012 CB ILE B 22 8.880 0.358 -3.149 1.00 0.00 C ATOM 1013 CG1 ILE B 22 9.913 -0.706 -3.540 1.00 0.00 C ATOM 1014 CG2 ILE B 22 8.789 1.441 -4.214 1.00 0.00 C ATOM 1015 CD1 ILE B 22 11.317 -0.160 -3.720 1.00 0.00 C ATOM 0 H ILE B 22 8.813 -0.938 -1.015 1.00 0.00 H new ATOM 0 HA ILE B 22 10.261 1.321 -1.803 1.00 0.00 H new ATOM 0 HB ILE B 22 7.905 -0.123 -3.074 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.930 -1.481 -2.774 1.00 0.00 H new ATOM 0 HG13 ILE B 22 9.597 -1.182 -4.468 1.00 0.00 H new ATOM 0 HG21 ILE B 22 8.542 0.987 -5.174 1.00 0.00 H new ATOM 0 HG22 ILE B 22 8.013 2.156 -3.940 1.00 0.00 H new ATOM 0 HG23 ILE B 22 9.746 1.956 -4.292 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.990 -0.972 -3.996 1.00 0.00 H new ATOM 0 HD12 ILE B 22 11.316 0.594 -4.507 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.655 0.290 -2.787 1.00 0.00 H new ATOM 1027 N ILE B 23 7.083 1.832 -1.047 1.00 0.00 N ATOM 1028 CA ILE B 23 6.098 2.857 -0.734 1.00 0.00 C ATOM 1029 C ILE B 23 6.598 3.763 0.386 1.00 0.00 C ATOM 1030 O ILE B 23 6.389 4.975 0.360 1.00 0.00 O ATOM 1031 CB ILE B 23 4.752 2.235 -0.310 1.00 0.00 C ATOM 1032 CG1 ILE B 23 4.191 1.353 -1.430 1.00 0.00 C ATOM 1033 CG2 ILE B 23 3.758 3.326 0.060 1.00 0.00 C ATOM 1034 CD1 ILE B 23 3.762 2.126 -2.659 1.00 0.00 C ATOM 0 H ILE B 23 6.760 0.877 -0.893 1.00 0.00 H new ATOM 0 HA ILE B 23 5.948 3.443 -1.641 1.00 0.00 H new ATOM 0 HB ILE B 23 4.921 1.609 0.566 1.00 0.00 H new ATOM 0 HG12 ILE B 23 4.947 0.622 -1.717 1.00 0.00 H new ATOM 0 HG13 ILE B 23 3.337 0.795 -1.047 1.00 0.00 H new ATOM 0 HG21 ILE B 23 2.813 2.872 0.357 1.00 0.00 H new ATOM 0 HG22 ILE B 23 4.154 3.914 0.888 1.00 0.00 H new ATOM 0 HG23 ILE B 23 3.594 3.976 -0.800 1.00 0.00 H new ATOM 0 HD11 ILE B 23 3.376 1.434 -3.408 1.00 0.00 H new ATOM 0 HD12 ILE B 23 2.983 2.838 -2.387 1.00 0.00 H new ATOM 0 HD13 ILE B 23 4.618 2.663 -3.068 1.00 0.00 H new ATOM 1046 N SER B 24 7.266 3.161 1.366 1.00 0.00 N ATOM 1047 CA SER B 24 7.796 3.904 2.504 1.00 0.00 C ATOM 1048 C SER B 24 8.968 4.793 2.093 1.00 0.00 C ATOM 1049 O SER B 24 9.133 5.894 2.616 1.00 0.00 O ATOM 1050 CB SER B 24 8.238 2.937 3.604 1.00 0.00 C ATOM 1051 OG SER B 24 8.855 3.630 4.673 1.00 0.00 O ATOM 0 H SER B 24 7.453 2.159 1.394 1.00 0.00 H new ATOM 0 HA SER B 24 7.001 4.546 2.883 1.00 0.00 H new ATOM 0 HB2 SER B 24 7.375 2.384 3.975 1.00 0.00 H new ATOM 0 HB3 SER B 24 8.933 2.205 3.192 1.00 0.00 H new ATOM 0 HG SER B 24 9.127 2.990 5.364 1.00 0.00 H new ATOM 1057 N LEU B 25 9.776 4.309 1.154 1.00 0.00 N ATOM 1058 CA LEU B 25 10.932 5.065 0.679 1.00 0.00 C ATOM 1059 C LEU B 25 10.498 6.284 -0.127 1.00 0.00 C ATOM 1060 O LEU B 25 11.047 7.375 0.038 1.00 0.00 O ATOM 1061 CB LEU B 25 11.840 4.171 -0.172 1.00 0.00 C ATOM 1062 CG LEU B 25 12.533 3.034 0.583 1.00 0.00 C ATOM 1063 CD1 LEU B 25 13.320 2.160 -0.379 1.00 0.00 C ATOM 1064 CD2 LEU B 25 13.447 3.591 1.668 1.00 0.00 C ATOM 0 H LEU B 25 9.653 3.400 0.708 1.00 0.00 H new ATOM 0 HA LEU B 25 11.487 5.411 1.551 1.00 0.00 H new ATOM 0 HB2 LEU B 25 11.246 3.740 -0.978 1.00 0.00 H new ATOM 0 HB3 LEU B 25 12.604 4.795 -0.637 1.00 0.00 H new ATOM 0 HG LEU B 25 11.768 2.421 1.060 1.00 0.00 H new ATOM 0 HD11 LEU B 25 13.806 1.357 0.174 1.00 0.00 H new ATOM 0 HD12 LEU B 25 12.643 1.733 -1.119 1.00 0.00 H new ATOM 0 HD13 LEU B 25 14.076 2.763 -0.883 1.00 0.00 H new ATOM 0 HD21 LEU B 25 13.931 2.768 2.194 1.00 0.00 H new ATOM 0 HD22 LEU B 25 14.206 4.227 1.213 1.00 0.00 H new ATOM 0 HD23 LEU B 25 12.858 4.177 2.374 1.00 0.00 H new ATOM 1076 N ILE B 26 9.514 6.095 -1.002 1.00 0.00 N ATOM 1077 CA ILE B 26 9.007 7.181 -1.833 1.00 0.00 C ATOM 1078 C ILE B 26 8.496 8.334 -0.974 1.00 0.00 C ATOM 1079 O ILE B 26 8.757 9.500 -1.265 1.00 0.00 O ATOM 1080 CB ILE B 26 7.873 6.700 -2.762 1.00 0.00 C ATOM 1081 CG1 ILE B 26 8.393 5.623 -3.717 1.00 0.00 C ATOM 1082 CG2 ILE B 26 7.284 7.868 -3.541 1.00 0.00 C ATOM 1083 CD1 ILE B 26 7.307 4.968 -4.544 1.00 0.00 C ATOM 0 H ILE B 26 9.052 5.198 -1.153 1.00 0.00 H new ATOM 0 HA ILE B 26 9.840 7.528 -2.445 1.00 0.00 H new ATOM 0 HB ILE B 26 7.082 6.269 -2.149 1.00 0.00 H new ATOM 0 HG12 ILE B 26 9.129 6.068 -4.387 1.00 0.00 H new ATOM 0 HG13 ILE B 26 8.910 4.857 -3.140 1.00 0.00 H new ATOM 0 HG21 ILE B 26 6.486 7.507 -4.190 1.00 0.00 H new ATOM 0 HG22 ILE B 26 6.881 8.603 -2.845 1.00 0.00 H new ATOM 0 HG23 ILE B 26 8.063 8.331 -4.147 1.00 0.00 H new ATOM 0 HD11 ILE B 26 7.750 4.216 -5.197 1.00 0.00 H new ATOM 0 HD12 ILE B 26 6.583 4.493 -3.883 1.00 0.00 H new ATOM 0 HD13 ILE B 26 6.805 5.723 -5.149 1.00 0.00 H new ATOM 1095 N ILE B 27 7.767 7.997 0.085 1.00 0.00 N ATOM 1096 CA ILE B 27 7.217 9.002 0.987 1.00 0.00 C ATOM 1097 C ILE B 27 8.322 9.672 1.798 1.00 0.00 C ATOM 1098 O ILE B 27 8.278 10.877 2.048 1.00 0.00 O ATOM 1099 CB ILE B 27 6.187 8.383 1.951 1.00 0.00 C ATOM 1100 CG1 ILE B 27 5.028 7.763 1.166 1.00 0.00 C ATOM 1101 CG2 ILE B 27 5.674 9.433 2.927 1.00 0.00 C ATOM 1102 CD1 ILE B 27 4.056 6.986 2.028 1.00 0.00 C ATOM 0 H ILE B 27 7.543 7.035 0.340 1.00 0.00 H new ATOM 0 HA ILE B 27 6.720 9.750 0.369 1.00 0.00 H new ATOM 0 HB ILE B 27 6.676 7.594 2.523 1.00 0.00 H new ATOM 0 HG12 ILE B 27 4.487 8.555 0.648 1.00 0.00 H new ATOM 0 HG13 ILE B 27 5.432 7.100 0.401 1.00 0.00 H new ATOM 0 HG21 ILE B 27 4.947 8.979 3.601 1.00 0.00 H new ATOM 0 HG22 ILE B 27 6.508 9.830 3.506 1.00 0.00 H new ATOM 0 HG23 ILE B 27 5.199 10.243 2.374 1.00 0.00 H new ATOM 0 HD11 ILE B 27 3.263 6.576 1.403 1.00 0.00 H new ATOM 0 HD12 ILE B 27 4.582 6.172 2.526 1.00 0.00 H new ATOM 0 HD13 ILE B 27 3.622 7.650 2.776 1.00 0.00 H new ATOM 1114 N LEU B 28 9.309 8.882 2.205 1.00 0.00 N ATOM 1115 CA LEU B 28 10.426 9.391 2.994 1.00 0.00 C ATOM 1116 C LEU B 28 11.195 10.466 2.234 1.00 0.00 C ATOM 1117 O LEU B 28 11.352 11.588 2.716 1.00 0.00 O ATOM 1118 CB LEU B 28 11.366 8.245 3.373 1.00 0.00 C ATOM 1119 CG LEU B 28 12.581 8.648 4.211 1.00 0.00 C ATOM 1120 CD1 LEU B 28 12.145 9.199 5.560 1.00 0.00 C ATOM 1121 CD2 LEU B 28 13.514 7.460 4.396 1.00 0.00 C ATOM 0 H LEU B 28 9.359 7.884 2.001 1.00 0.00 H new ATOM 0 HA LEU B 28 10.021 9.841 3.901 1.00 0.00 H new ATOM 0 HB2 LEU B 28 10.797 7.497 3.924 1.00 0.00 H new ATOM 0 HB3 LEU B 28 11.718 7.768 2.458 1.00 0.00 H new ATOM 0 HG LEU B 28 13.120 9.433 3.680 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.024 9.479 6.140 1.00 0.00 H new ATOM 0 HD12 LEU B 28 11.515 10.076 5.409 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.582 8.437 6.100 1.00 0.00 H new ATOM 0 HD21 LEU B 28 14.374 7.762 4.994 1.00 0.00 H new ATOM 0 HD22 LEU B 28 12.983 6.656 4.905 1.00 0.00 H new ATOM 0 HD23 LEU B 28 13.855 7.110 3.422 1.00 0.00 H new ATOM 1133 N ILE B 29 11.676 10.116 1.044 1.00 0.00 N ATOM 1134 CA ILE B 29 12.437 11.049 0.221 1.00 0.00 C ATOM 1135 C ILE B 29 11.584 12.235 -0.217 1.00 0.00 C ATOM 1136 O ILE B 29 12.071 13.363 -0.294 1.00 0.00 O ATOM 1137 CB ILE B 29 13.013 10.352 -1.029 1.00 0.00 C ATOM 1138 CG1 ILE B 29 13.892 9.169 -0.618 1.00 0.00 C ATOM 1139 CG2 ILE B 29 13.807 11.343 -1.872 1.00 0.00 C ATOM 1140 CD1 ILE B 29 14.363 8.326 -1.784 1.00 0.00 C ATOM 0 H ILE B 29 11.552 9.193 0.629 1.00 0.00 H new ATOM 0 HA ILE B 29 13.258 11.413 0.839 1.00 0.00 H new ATOM 0 HB ILE B 29 12.186 9.975 -1.631 1.00 0.00 H new ATOM 0 HG12 ILE B 29 14.761 9.544 -0.078 1.00 0.00 H new ATOM 0 HG13 ILE B 29 13.335 8.537 0.074 1.00 0.00 H new ATOM 0 HG21 ILE B 29 14.207 10.836 -2.750 1.00 0.00 H new ATOM 0 HG22 ILE B 29 13.154 12.156 -2.189 1.00 0.00 H new ATOM 0 HG23 ILE B 29 14.629 11.747 -1.281 1.00 0.00 H new ATOM 0 HD11 ILE B 29 14.980 7.507 -1.415 1.00 0.00 H new ATOM 0 HD12 ILE B 29 13.500 7.920 -2.312 1.00 0.00 H new ATOM 0 HD13 ILE B 29 14.948 8.943 -2.466 1.00 0.00 H new ATOM 1152 N MET B 30 10.311 11.978 -0.504 1.00 0.00 N ATOM 1153 CA MET B 30 9.401 13.033 -0.935 1.00 0.00 C ATOM 1154 C MET B 30 9.294 14.124 0.126 1.00 0.00 C ATOM 1155 O MET B 30 9.234 15.310 -0.196 1.00 0.00 O ATOM 1156 CB MET B 30 8.016 12.459 -1.244 1.00 0.00 C ATOM 1157 CG MET B 30 7.054 13.480 -1.830 1.00 0.00 C ATOM 1158 SD MET B 30 5.470 12.755 -2.298 1.00 0.00 S ATOM 1159 CE MET B 30 4.871 12.196 -0.708 1.00 0.00 C ATOM 0 H MET B 30 9.888 11.052 -0.446 1.00 0.00 H new ATOM 0 HA MET B 30 9.806 13.475 -1.845 1.00 0.00 H new ATOM 0 HB2 MET B 30 8.123 11.629 -1.943 1.00 0.00 H new ATOM 0 HB3 MET B 30 7.588 12.052 -0.328 1.00 0.00 H new ATOM 0 HG2 MET B 30 6.885 14.273 -1.102 1.00 0.00 H new ATOM 0 HG3 MET B 30 7.510 13.942 -2.705 1.00 0.00 H new ATOM 0 HE1 MET B 30 3.792 12.342 -0.654 1.00 0.00 H new ATOM 0 HE2 MET B 30 5.101 11.138 -0.584 1.00 0.00 H new ATOM 0 HE3 MET B 30 5.355 12.767 0.084 1.00 0.00 H new ATOM 1169 N LEU B 31 9.272 13.715 1.391 1.00 0.00 N ATOM 1170 CA LEU B 31 9.178 14.662 2.497 1.00 0.00 C ATOM 1171 C LEU B 31 10.549 15.249 2.821 1.00 0.00 C ATOM 1172 O LEU B 31 10.653 16.339 3.381 1.00 0.00 O ATOM 1173 CB LEU B 31 8.595 13.983 3.738 1.00 0.00 C ATOM 1174 CG LEU B 31 8.254 14.928 4.894 1.00 0.00 C ATOM 1175 CD1 LEU B 31 7.091 15.834 4.516 1.00 0.00 C ATOM 1176 CD2 LEU B 31 7.928 14.139 6.153 1.00 0.00 C ATOM 0 H LEU B 31 9.318 12.736 1.675 1.00 0.00 H new ATOM 0 HA LEU B 31 8.513 15.471 2.194 1.00 0.00 H new ATOM 0 HB2 LEU B 31 7.691 13.446 3.449 1.00 0.00 H new ATOM 0 HB3 LEU B 31 9.307 13.239 4.095 1.00 0.00 H new ATOM 0 HG LEU B 31 9.125 15.551 5.096 1.00 0.00 H new ATOM 0 HD11 LEU B 31 6.862 16.499 5.349 1.00 0.00 H new ATOM 0 HD12 LEU B 31 7.361 16.427 3.642 1.00 0.00 H new ATOM 0 HD13 LEU B 31 6.216 15.226 4.286 1.00 0.00 H new ATOM 0 HD21 LEU B 31 7.689 14.828 6.963 1.00 0.00 H new ATOM 0 HD22 LEU B 31 7.073 13.490 5.964 1.00 0.00 H new ATOM 0 HD23 LEU B 31 8.789 13.533 6.435 1.00 0.00 H new ATOM 1188 N TRP B 32 11.599 14.514 2.461 1.00 0.00 N ATOM 1189 CA TRP B 32 12.968 14.955 2.711 1.00 0.00 C ATOM 1190 C TRP B 32 13.320 16.172 1.858 1.00 0.00 C ATOM 1191 O TRP B 32 13.996 17.089 2.324 1.00 0.00 O ATOM 1192 CB TRP B 32 13.952 13.816 2.425 1.00 0.00 C ATOM 1193 CG TRP B 32 15.389 14.204 2.609 1.00 0.00 C ATOM 1194 CD1 TRP B 32 15.986 14.612 3.767 1.00 0.00 C ATOM 1195 CD2 TRP B 32 16.410 14.220 1.604 1.00 0.00 C ATOM 1196 NE1 TRP B 32 17.313 14.886 3.543 1.00 0.00 N ATOM 1197 CE2 TRP B 32 17.599 14.649 2.223 1.00 0.00 C ATOM 1198 CE3 TRP B 32 16.436 13.912 0.241 1.00 0.00 C ATOM 1199 CZ2 TRP B 32 18.799 14.779 1.529 1.00 0.00 C ATOM 1200 CZ3 TRP B 32 17.629 14.040 -0.449 1.00 0.00 C ATOM 1201 CH2 TRP B 32 18.795 14.470 0.195 1.00 0.00 C ATOM 0 H TRP B 32 11.527 13.610 1.995 1.00 0.00 H new ATOM 0 HA TRP B 32 13.042 15.240 3.761 1.00 0.00 H new ATOM 0 HB2 TRP B 32 13.724 12.977 3.082 1.00 0.00 H new ATOM 0 HB3 TRP B 32 13.806 13.469 1.402 1.00 0.00 H new ATOM 0 HD1 TRP B 32 15.487 14.706 4.720 1.00 0.00 H new ATOM 0 HE1 TRP B 32 17.978 15.213 4.244 1.00 0.00 H new ATOM 0 HE3 TRP B 32 15.541 13.580 -0.265 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 19.699 15.111 2.024 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 17.661 13.804 -1.502 1.00 0.00 H new ATOM 0 HH2 TRP B 32 19.710 14.560 -0.372 1.00 0.00 H new ATOM 1212 N GLN B 33 12.857 16.176 0.613 1.00 0.00 N ATOM 1213 CA GLN B 33 13.129 17.281 -0.301 1.00 0.00 C ATOM 1214 C GLN B 33 12.010 18.317 -0.260 1.00 0.00 C ATOM 1215 O GLN B 33 12.192 19.453 -0.697 1.00 0.00 O ATOM 1216 CB GLN B 33 13.298 16.763 -1.729 1.00 0.00 C ATOM 1217 CG GLN B 33 14.491 15.839 -1.910 1.00 0.00 C ATOM 1218 CD GLN B 33 14.608 15.310 -3.326 1.00 0.00 C ATOM 1219 OE1 GLN B 33 15.708 15.048 -3.813 1.00 0.00 O ATOM 1220 NE2 GLN B 33 13.471 15.148 -3.994 1.00 0.00 N ATOM 0 H GLN B 33 12.292 15.427 0.213 1.00 0.00 H new ATOM 0 HA GLN B 33 14.055 17.758 0.021 1.00 0.00 H new ATOM 0 HB2 GLN B 33 12.392 16.233 -2.023 1.00 0.00 H new ATOM 0 HB3 GLN B 33 13.403 17.613 -2.404 1.00 0.00 H new ATOM 0 HG2 GLN B 33 15.404 16.375 -1.649 1.00 0.00 H new ATOM 0 HG3 GLN B 33 14.405 15.001 -1.219 1.00 0.00 H new ATOM 0 HE21 GLN B 33 12.582 15.378 -3.551 1.00 0.00 H new ATOM 0 HE22 GLN B 33 13.487 14.793 -4.950 1.00 0.00 H new ATOM 1229 N LYS B 34 10.855 17.912 0.263 1.00 0.00 N ATOM 1230 CA LYS B 34 9.696 18.799 0.363 1.00 0.00 C ATOM 1231 C LYS B 34 9.229 19.249 -1.018 1.00 0.00 C ATOM 1232 O LYS B 34 8.315 18.657 -1.596 1.00 0.00 O ATOM 1233 CB LYS B 34 10.023 20.015 1.236 1.00 0.00 C ATOM 1234 CG LYS B 34 8.836 20.935 1.469 1.00 0.00 C ATOM 1235 CD LYS B 34 9.147 21.990 2.520 1.00 0.00 C ATOM 1236 CE LYS B 34 7.948 22.884 2.787 1.00 0.00 C ATOM 1237 NZ LYS B 34 8.211 23.851 3.889 1.00 0.00 N ATOM 0 H LYS B 34 10.695 16.972 0.626 1.00 0.00 H new ATOM 0 HA LYS B 34 8.885 18.240 0.831 1.00 0.00 H new ATOM 0 HB2 LYS B 34 10.399 19.670 2.199 1.00 0.00 H new ATOM 0 HB3 LYS B 34 10.826 20.583 0.766 1.00 0.00 H new ATOM 0 HG2 LYS B 34 8.562 21.422 0.533 1.00 0.00 H new ATOM 0 HG3 LYS B 34 7.975 20.347 1.786 1.00 0.00 H new ATOM 0 HD2 LYS B 34 9.452 21.503 3.446 1.00 0.00 H new ATOM 0 HD3 LYS B 34 9.988 22.598 2.188 1.00 0.00 H new ATOM 0 HE2 LYS B 34 7.692 23.429 1.879 1.00 0.00 H new ATOM 0 HE3 LYS B 34 7.086 22.268 3.042 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 7.369 24.442 4.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 8.430 23.331 4.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 9.018 24.456 3.635 1.00 0.00 H new ATOM 1251 N LYS B 35 9.858 20.296 -1.546 1.00 0.00 N ATOM 1252 CA LYS B 35 9.503 20.817 -2.862 1.00 0.00 C ATOM 1253 C LYS B 35 9.993 19.877 -3.965 1.00 0.00 C ATOM 1254 O LYS B 35 11.156 19.473 -3.966 1.00 0.00 O ATOM 1255 CB LYS B 35 10.107 22.210 -3.059 1.00 0.00 C ATOM 1256 CG LYS B 35 9.730 22.856 -4.384 1.00 0.00 C ATOM 1257 CD LYS B 35 10.378 24.223 -4.540 1.00 0.00 C ATOM 1258 CE LYS B 35 9.978 24.885 -5.848 1.00 0.00 C ATOM 1259 NZ LYS B 35 10.601 26.230 -6.003 1.00 0.00 N ATOM 0 H LYS B 35 10.615 20.799 -1.083 1.00 0.00 H new ATOM 0 HA LYS B 35 8.417 20.887 -2.921 1.00 0.00 H new ATOM 0 HB2 LYS B 35 9.782 22.856 -2.244 1.00 0.00 H new ATOM 0 HB3 LYS B 35 11.193 22.138 -2.995 1.00 0.00 H new ATOM 0 HG2 LYS B 35 10.038 22.210 -5.206 1.00 0.00 H new ATOM 0 HG3 LYS B 35 8.646 22.956 -4.446 1.00 0.00 H new ATOM 0 HD2 LYS B 35 10.088 24.861 -3.705 1.00 0.00 H new ATOM 0 HD3 LYS B 35 11.462 24.119 -4.501 1.00 0.00 H new ATOM 0 HE2 LYS B 35 10.274 24.249 -6.682 1.00 0.00 H new ATOM 0 HE3 LYS B 35 8.893 24.980 -5.890 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 10.303 26.648 -6.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 10.298 26.845 -5.221 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 11.637 26.137 -5.989 1.00 0.00 H new ATOM 1273 N PRO B 36 9.116 19.510 -4.921 1.00 0.00 N ATOM 1274 CA PRO B 36 9.482 18.612 -6.025 1.00 0.00 C ATOM 1275 C PRO B 36 10.634 19.162 -6.861 1.00 0.00 C ATOM 1276 O PRO B 36 10.763 20.374 -7.034 1.00 0.00 O ATOM 1277 CB PRO B 36 8.205 18.527 -6.867 1.00 0.00 C ATOM 1278 CG PRO B 36 7.107 18.924 -5.942 1.00 0.00 C ATOM 1279 CD PRO B 36 7.706 19.934 -5.008 1.00 0.00 C ATOM 0 HA PRO B 36 9.828 17.645 -5.660 1.00 0.00 H new ATOM 0 HB2 PRO B 36 8.255 19.193 -7.729 1.00 0.00 H new ATOM 0 HB3 PRO B 36 8.052 17.519 -7.252 1.00 0.00 H new ATOM 0 HG2 PRO B 36 6.267 19.349 -6.491 1.00 0.00 H new ATOM 0 HG3 PRO B 36 6.726 18.062 -5.394 1.00 0.00 H new ATOM 0 HD2 PRO B 36 7.613 20.948 -5.396 1.00 0.00 H new ATOM 0 HD3 PRO B 36 7.219 19.920 -4.033 1.00 0.00 H new ATOM 1287 N ARG B 37 11.467 18.263 -7.379 1.00 0.00 N ATOM 1288 CA ARG B 37 12.608 18.660 -8.197 1.00 0.00 C ATOM 1289 C ARG B 37 12.145 19.218 -9.540 1.00 0.00 C ATOM 1290 O ARG B 37 11.007 18.998 -9.954 1.00 0.00 O ATOM 1291 CB ARG B 37 13.546 17.470 -8.418 1.00 0.00 C ATOM 1292 CG ARG B 37 12.888 16.300 -9.131 1.00 0.00 C ATOM 1293 CD ARG B 37 13.821 15.100 -9.209 1.00 0.00 C ATOM 1294 NE ARG B 37 14.182 14.603 -7.884 1.00 0.00 N ATOM 1295 CZ ARG B 37 15.218 13.804 -7.652 1.00 0.00 C ATOM 1296 NH1 ARG B 37 15.990 13.404 -8.655 1.00 0.00 N ATOM 1297 NH2 ARG B 37 15.483 13.402 -6.417 1.00 0.00 N ATOM 0 H ARG B 37 11.373 17.256 -7.247 1.00 0.00 H new ATOM 0 HA ARG B 37 13.150 19.443 -7.666 1.00 0.00 H new ATOM 0 HB2 ARG B 37 14.408 17.800 -8.998 1.00 0.00 H new ATOM 0 HB3 ARG B 37 13.923 17.131 -7.453 1.00 0.00 H new ATOM 0 HG2 ARG B 37 11.975 16.019 -8.606 1.00 0.00 H new ATOM 0 HG3 ARG B 37 12.597 16.602 -10.137 1.00 0.00 H new ATOM 0 HD2 ARG B 37 13.341 14.303 -9.777 1.00 0.00 H new ATOM 0 HD3 ARG B 37 14.725 15.378 -9.751 1.00 0.00 H new ATOM 0 HE ARG B 37 13.606 14.885 -7.091 1.00 0.00 H new ATOM 0 HH11 ARG B 37 15.789 13.710 -9.607 1.00 0.00 H new ATOM 0 HH12 ARG B 37 16.785 12.791 -8.474 1.00 0.00 H new ATOM 0 HH21 ARG B 37 14.891 13.706 -5.644 1.00 0.00 H new ATOM 0 HH22 ARG B 37 16.279 12.789 -6.240 1.00 0.00 H new ATOM 1311 N TYR B 38 13.035 19.940 -10.213 1.00 0.00 N ATOM 1312 CA TYR B 38 12.719 20.535 -11.507 1.00 0.00 C ATOM 1313 C TYR B 38 13.317 19.717 -12.647 1.00 0.00 C ATOM 1314 O TYR B 38 14.503 19.384 -12.630 1.00 0.00 O ATOM 1315 CB TYR B 38 13.234 21.974 -11.568 1.00 0.00 C ATOM 1316 CG TYR B 38 12.851 22.705 -12.835 1.00 0.00 C ATOM 1317 CD1 TYR B 38 13.667 22.662 -13.960 1.00 0.00 C ATOM 1318 CD2 TYR B 38 11.673 23.439 -12.908 1.00 0.00 C ATOM 1319 CE1 TYR B 38 13.320 23.331 -15.118 1.00 0.00 C ATOM 1320 CE2 TYR B 38 11.320 24.109 -14.063 1.00 0.00 C ATOM 1321 CZ TYR B 38 12.146 24.052 -15.164 1.00 0.00 C ATOM 1322 OH TYR B 38 11.799 24.718 -16.316 1.00 0.00 O ATOM 0 H TYR B 38 13.982 20.127 -9.883 1.00 0.00 H new ATOM 0 HA TYR B 38 11.635 20.539 -11.621 1.00 0.00 H new ATOM 0 HB2 TYR B 38 12.848 22.525 -10.711 1.00 0.00 H new ATOM 0 HB3 TYR B 38 14.320 21.966 -11.478 1.00 0.00 H new ATOM 0 HD1 TYR B 38 14.587 22.097 -13.928 1.00 0.00 H new ATOM 0 HD2 TYR B 38 11.023 23.486 -12.047 1.00 0.00 H new ATOM 0 HE1 TYR B 38 13.965 23.289 -15.983 1.00 0.00 H new ATOM 0 HE2 TYR B 38 10.401 24.675 -14.103 1.00 0.00 H new ATOM 0 HH TYR B 38 10.943 25.176 -16.184 1.00 0.00 H new ATOM 1332 N GLU B 39 12.488 19.398 -13.636 1.00 0.00 N ATOM 1333 CA GLU B 39 12.933 18.619 -14.786 1.00 0.00 C ATOM 1334 C GLU B 39 13.445 19.533 -15.895 1.00 0.00 C ATOM 1335 O GLU B 39 14.573 19.300 -16.380 1.00 0.00 O ATOM 1336 CB GLU B 39 11.794 17.745 -15.316 1.00 0.00 C ATOM 1337 CG GLU B 39 11.386 16.628 -14.366 1.00 0.00 C ATOM 1338 CD GLU B 39 10.777 17.144 -13.078 1.00 0.00 C ATOM 1339 OE1 GLU B 39 9.552 17.391 -13.056 1.00 0.00 O ATOM 1340 OE2 GLU B 39 11.523 17.302 -12.089 1.00 0.00 O ATOM 1341 OXT GLU B 39 12.715 20.475 -16.274 1.00 0.00 O ATOM 0 H GLU B 39 11.505 19.667 -13.664 1.00 0.00 H new ATOM 0 HA GLU B 39 13.750 17.975 -14.460 1.00 0.00 H new ATOM 0 HB2 GLU B 39 10.927 18.375 -15.515 1.00 0.00 H new ATOM 0 HB3 GLU B 39 12.096 17.308 -16.268 1.00 0.00 H new ATOM 0 HG2 GLU B 39 10.669 15.976 -14.866 1.00 0.00 H new ATOM 0 HG3 GLU B 39 12.260 16.020 -14.131 1.00 0.00 H new TER 1348 GLU B 39