USER MOD reduce.3.24.130724 H: found=0, std=0, add=722, rem=0, adj=15 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 X(o=0,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 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot -15:sc= 0.132 USER MOD Single : A 30 MET CE :methyl 177:sc= -0.905 (180deg=-0.926) USER MOD Single : A 33 GLN : amide:sc= -0.768 K(o=-0.77,f=-0.18) USER MOD Single : A 34 LYS NZ :NH3+ -158:sc= -0.735 (180deg=-1.46) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 HIS : no HD1:sc= 0 X(o=0,f=-0.13) 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 81:sc= 0.862 USER MOD Single : B 21 THR OG1 : rot 75:sc= 0.781 USER MOD Single : B 24 SER OG : rot -13:sc= 0.947 USER MOD Single : B 30 MET CE :methyl 148:sc= -0.535 (180deg=-1.19) USER MOD Single : B 33 GLN : amide:sc= -0.675 K(o=-0.68,f=0) USER MOD Single : B 34 LYS NZ :NH3+ -162:sc= -0.0807 (180deg=-0.453) USER MOD Single : B 35 LYS NZ :NH3+ 166:sc= -0.0296 (180deg=-0.255) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.376 -29.231 3.444 1.00 0.00 N ATOM 2 CA GLY A 1 14.039 -28.952 2.849 1.00 0.00 C ATOM 3 C GLY A 1 13.078 -28.328 3.842 1.00 0.00 C ATOM 4 O GLY A 1 13.310 -27.221 4.328 1.00 0.00 O ATOM 0 H1 GLY A 1 15.994 -29.657 2.724 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.798 -28.342 3.781 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.270 -29.889 4.242 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.157 -28.285 1.995 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.613 -29.881 2.471 1.00 0.00 H new ATOM 10 N HIS A 2 11.997 -29.046 4.145 1.00 0.00 N ATOM 11 CA HIS A 2 10.983 -28.564 5.081 1.00 0.00 C ATOM 12 C HIS A 2 10.376 -27.250 4.600 1.00 0.00 C ATOM 13 O HIS A 2 10.951 -26.178 4.796 1.00 0.00 O ATOM 14 CB HIS A 2 11.578 -28.386 6.481 1.00 0.00 C ATOM 15 CG HIS A 2 12.170 -29.641 7.044 1.00 0.00 C ATOM 16 ND1 HIS A 2 11.505 -30.457 7.937 1.00 0.00 N ATOM 17 CD2 HIS A 2 13.376 -30.221 6.839 1.00 0.00 C ATOM 18 CE1 HIS A 2 12.277 -31.480 8.256 1.00 0.00 C ATOM 19 NE2 HIS A 2 13.418 -31.360 7.604 1.00 0.00 N ATOM 0 H HIS A 2 11.801 -29.967 3.754 1.00 0.00 H new ATOM 0 HA HIS A 2 10.192 -29.313 5.129 1.00 0.00 H new ATOM 0 HB2 HIS A 2 12.348 -27.615 6.444 1.00 0.00 H new ATOM 0 HB3 HIS A 2 10.800 -28.027 7.155 1.00 0.00 H new ATOM 0 HD2 HIS A 2 14.160 -29.855 6.193 1.00 0.00 H new ATOM 0 HE1 HIS A 2 12.018 -32.279 8.935 1.00 0.00 H new ATOM 0 HE2 HIS A 2 14.204 -32.008 7.659 1.00 0.00 H new ATOM 28 N SER A 3 9.211 -27.341 3.970 1.00 0.00 N ATOM 29 CA SER A 3 8.522 -26.164 3.456 1.00 0.00 C ATOM 30 C SER A 3 7.396 -25.741 4.395 1.00 0.00 C ATOM 31 O SER A 3 6.746 -26.582 5.017 1.00 0.00 O ATOM 32 CB SER A 3 7.962 -26.447 2.060 1.00 0.00 C ATOM 33 OG SER A 3 7.043 -27.525 2.087 1.00 0.00 O ATOM 0 H SER A 3 8.723 -28.221 3.803 1.00 0.00 H new ATOM 0 HA SER A 3 9.242 -25.348 3.392 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.469 -25.554 1.675 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.779 -26.679 1.377 1.00 0.00 H new ATOM 0 HG SER A 3 6.699 -27.684 1.183 1.00 0.00 H new ATOM 39 N LEU A 4 7.173 -24.434 4.492 1.00 0.00 N ATOM 40 CA LEU A 4 6.127 -23.900 5.359 1.00 0.00 C ATOM 41 C LEU A 4 4.746 -24.092 4.730 1.00 0.00 C ATOM 42 O LEU A 4 4.601 -24.024 3.509 1.00 0.00 O ATOM 43 CB LEU A 4 6.367 -22.411 5.639 1.00 0.00 C ATOM 44 CG LEU A 4 7.566 -22.086 6.538 1.00 0.00 C ATOM 45 CD1 LEU A 4 7.451 -22.806 7.875 1.00 0.00 C ATOM 46 CD2 LEU A 4 8.875 -22.442 5.848 1.00 0.00 C ATOM 0 H LEU A 4 7.701 -23.726 3.982 1.00 0.00 H new ATOM 0 HA LEU A 4 6.161 -24.449 6.300 1.00 0.00 H new ATOM 0 HB2 LEU A 4 6.502 -21.899 4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.469 -21.998 6.099 1.00 0.00 H new ATOM 0 HG LEU A 4 7.563 -21.013 6.727 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.313 -22.560 8.496 1.00 0.00 H new ATOM 0 HD12 LEU A 4 6.538 -22.491 8.380 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.420 -23.883 7.707 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.710 -22.202 6.506 1.00 0.00 H new ATOM 0 HD22 LEU A 4 8.888 -23.508 5.619 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.966 -21.872 4.924 1.00 0.00 H new ATOM 58 N PRO A 5 3.710 -24.336 5.557 1.00 0.00 N ATOM 59 CA PRO A 5 2.341 -24.536 5.069 1.00 0.00 C ATOM 60 C PRO A 5 1.747 -23.266 4.466 1.00 0.00 C ATOM 61 O PRO A 5 2.139 -22.154 4.821 1.00 0.00 O ATOM 62 CB PRO A 5 1.564 -24.945 6.324 1.00 0.00 C ATOM 63 CG PRO A 5 2.355 -24.401 7.463 1.00 0.00 C ATOM 64 CD PRO A 5 3.793 -24.437 7.029 1.00 0.00 C ATOM 0 HA PRO A 5 2.302 -25.276 4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 5 0.554 -24.535 6.314 1.00 0.00 H new ATOM 0 HB3 PRO A 5 1.468 -26.029 6.393 1.00 0.00 H new ATOM 0 HG2 PRO A 5 2.046 -23.383 7.701 1.00 0.00 H new ATOM 0 HG3 PRO A 5 2.205 -24.999 8.362 1.00 0.00 H new ATOM 0 HD2 PRO A 5 4.362 -23.612 7.457 1.00 0.00 H new ATOM 0 HD3 PRO A 5 4.284 -25.359 7.341 1.00 0.00 H new ATOM 72 N PHE A 6 0.796 -23.442 3.551 1.00 0.00 N ATOM 73 CA PHE A 6 0.142 -22.315 2.896 1.00 0.00 C ATOM 74 C PHE A 6 -0.625 -21.468 3.906 1.00 0.00 C ATOM 75 O PHE A 6 -1.011 -20.337 3.617 1.00 0.00 O ATOM 76 CB PHE A 6 -0.807 -22.808 1.797 1.00 0.00 C ATOM 77 CG PHE A 6 -1.985 -23.586 2.312 1.00 0.00 C ATOM 78 CD1 PHE A 6 -1.862 -24.929 2.629 1.00 0.00 C ATOM 79 CD2 PHE A 6 -3.217 -22.973 2.476 1.00 0.00 C ATOM 80 CE1 PHE A 6 -2.945 -25.647 3.099 1.00 0.00 C ATOM 81 CE2 PHE A 6 -4.304 -23.686 2.946 1.00 0.00 C ATOM 82 CZ PHE A 6 -4.168 -25.024 3.258 1.00 0.00 C ATOM 0 H PHE A 6 0.462 -24.357 3.247 1.00 0.00 H new ATOM 0 HA PHE A 6 0.916 -21.696 2.442 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -1.170 -21.949 1.232 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -0.247 -23.433 1.101 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -0.908 -25.421 2.507 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.329 -21.926 2.234 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -2.836 -26.694 3.342 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -5.259 -23.197 3.069 1.00 0.00 H new ATOM 0 HZ PHE A 6 -5.016 -25.583 3.626 1.00 0.00 H new ATOM 92 N LYS A 7 -0.844 -22.026 5.092 1.00 0.00 N ATOM 93 CA LYS A 7 -1.572 -21.329 6.145 1.00 0.00 C ATOM 94 C LYS A 7 -0.913 -19.992 6.480 1.00 0.00 C ATOM 95 O LYS A 7 -1.565 -18.948 6.462 1.00 0.00 O ATOM 96 CB LYS A 7 -1.632 -22.200 7.401 1.00 0.00 C ATOM 97 CG LYS A 7 -2.165 -23.602 7.149 1.00 0.00 C ATOM 98 CD LYS A 7 -3.677 -23.609 6.992 1.00 0.00 C ATOM 99 CE LYS A 7 -4.376 -23.335 8.313 1.00 0.00 C ATOM 100 NZ LYS A 7 -5.857 -23.414 8.187 1.00 0.00 N ATOM 0 H LYS A 7 -0.527 -22.961 5.348 1.00 0.00 H new ATOM 0 HA LYS A 7 -2.582 -21.134 5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -0.633 -22.273 7.830 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -2.262 -21.709 8.143 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -1.704 -24.010 6.250 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -1.882 -24.253 7.976 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.971 -22.856 6.261 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.999 -24.575 6.602 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -4.037 -24.054 9.059 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -4.095 -22.345 8.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -6.295 -23.221 9.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -6.185 -22.711 7.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -6.128 -24.366 7.868 1.00 0.00 H new ATOM 114 N VAL A 8 0.381 -20.032 6.780 1.00 0.00 N ATOM 115 CA VAL A 8 1.127 -18.825 7.126 1.00 0.00 C ATOM 116 C VAL A 8 1.366 -17.944 5.902 1.00 0.00 C ATOM 117 O VAL A 8 1.354 -16.718 5.999 1.00 0.00 O ATOM 118 CB VAL A 8 2.483 -19.172 7.770 1.00 0.00 C ATOM 119 CG1 VAL A 8 3.229 -17.908 8.171 1.00 0.00 C ATOM 120 CG2 VAL A 8 2.282 -20.083 8.971 1.00 0.00 C ATOM 0 H VAL A 8 0.936 -20.888 6.791 1.00 0.00 H new ATOM 0 HA VAL A 8 0.518 -18.276 7.844 1.00 0.00 H new ATOM 0 HB VAL A 8 3.088 -19.701 7.034 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.183 -18.177 8.624 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.406 -17.294 7.288 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.632 -17.346 8.889 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.249 -20.319 9.415 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.657 -19.580 9.709 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.795 -21.004 8.651 1.00 0.00 H new ATOM 130 N VAL A 9 1.585 -18.578 4.754 1.00 0.00 N ATOM 131 CA VAL A 9 1.837 -17.851 3.514 1.00 0.00 C ATOM 132 C VAL A 9 0.672 -16.935 3.148 1.00 0.00 C ATOM 133 O VAL A 9 0.866 -15.756 2.852 1.00 0.00 O ATOM 134 CB VAL A 9 2.100 -18.816 2.342 1.00 0.00 C ATOM 135 CG1 VAL A 9 2.464 -18.044 1.084 1.00 0.00 C ATOM 136 CG2 VAL A 9 3.196 -19.807 2.703 1.00 0.00 C ATOM 0 H VAL A 9 1.593 -19.593 4.657 1.00 0.00 H new ATOM 0 HA VAL A 9 2.724 -17.243 3.689 1.00 0.00 H new ATOM 0 HB VAL A 9 1.185 -19.375 2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.646 -18.743 0.268 1.00 0.00 H new ATOM 0 HG12 VAL A 9 1.644 -17.378 0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.364 -17.456 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.368 -20.481 1.864 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.115 -19.267 2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.891 -20.385 3.575 1.00 0.00 H new ATOM 146 N VAL A 10 -0.539 -17.485 3.167 1.00 0.00 N ATOM 147 CA VAL A 10 -1.735 -16.720 2.826 1.00 0.00 C ATOM 148 C VAL A 10 -1.979 -15.586 3.817 1.00 0.00 C ATOM 149 O VAL A 10 -2.146 -14.432 3.420 1.00 0.00 O ATOM 150 CB VAL A 10 -2.983 -17.624 2.775 1.00 0.00 C ATOM 151 CG1 VAL A 10 -4.230 -16.806 2.470 1.00 0.00 C ATOM 152 CG2 VAL A 10 -2.800 -18.727 1.744 1.00 0.00 C ATOM 0 H VAL A 10 -0.718 -18.458 3.415 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.560 -16.294 1.838 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.111 -18.086 3.754 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.098 -17.464 2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.372 -16.055 3.247 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.114 -16.312 1.505 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.690 -19.355 1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.644 -18.284 0.761 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.934 -19.334 2.010 1.00 0.00 H new ATOM 162 N ILE A 11 -2.003 -15.919 5.104 1.00 0.00 N ATOM 163 CA ILE A 11 -2.231 -14.924 6.146 1.00 0.00 C ATOM 164 C ILE A 11 -1.214 -13.789 6.061 1.00 0.00 C ATOM 165 O ILE A 11 -1.542 -12.628 6.310 1.00 0.00 O ATOM 166 CB ILE A 11 -2.168 -15.558 7.550 1.00 0.00 C ATOM 167 CG1 ILE A 11 -3.224 -16.660 7.679 1.00 0.00 C ATOM 168 CG2 ILE A 11 -2.364 -14.495 8.624 1.00 0.00 C ATOM 169 CD1 ILE A 11 -3.125 -17.448 8.969 1.00 0.00 C ATOM 0 H ILE A 11 -1.868 -16.869 5.450 1.00 0.00 H new ATOM 0 HA ILE A 11 -3.230 -14.519 5.983 1.00 0.00 H new ATOM 0 HB ILE A 11 -1.183 -16.004 7.689 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.215 -16.211 7.613 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.127 -17.345 6.837 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.317 -14.960 9.609 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -1.579 -13.743 8.539 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.337 -14.021 8.493 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.904 -18.210 8.990 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.147 -17.926 9.029 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.252 -16.775 9.817 1.00 0.00 H new ATOM 181 N SER A 12 0.021 -14.131 5.705 1.00 0.00 N ATOM 182 CA SER A 12 1.085 -13.139 5.590 1.00 0.00 C ATOM 183 C SER A 12 0.882 -12.259 4.360 1.00 0.00 C ATOM 184 O SER A 12 1.110 -11.050 4.407 1.00 0.00 O ATOM 185 CB SER A 12 2.448 -13.831 5.519 1.00 0.00 C ATOM 186 OG SER A 12 3.495 -12.884 5.407 1.00 0.00 O ATOM 0 H SER A 12 0.309 -15.086 5.492 1.00 0.00 H new ATOM 0 HA SER A 12 1.052 -12.504 6.475 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.597 -14.439 6.411 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.472 -14.507 4.664 1.00 0.00 H new ATOM 0 HG SER A 12 4.355 -13.351 5.365 1.00 0.00 H new ATOM 192 N ALA A 13 0.453 -12.873 3.262 1.00 0.00 N ATOM 193 CA ALA A 13 0.221 -12.147 2.017 1.00 0.00 C ATOM 194 C ALA A 13 -0.893 -11.119 2.178 1.00 0.00 C ATOM 195 O ALA A 13 -0.707 -9.938 1.886 1.00 0.00 O ATOM 196 CB ALA A 13 -0.118 -13.119 0.897 1.00 0.00 C ATOM 0 H ALA A 13 0.259 -13.873 3.209 1.00 0.00 H new ATOM 0 HA ALA A 13 1.137 -11.615 1.761 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.289 -12.565 -0.026 1.00 0.00 H new ATOM 0 HB2 ALA A 13 0.710 -13.814 0.755 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.018 -13.675 1.158 1.00 0.00 H new ATOM 202 N ILE A 14 -2.051 -11.579 2.641 1.00 0.00 N ATOM 203 CA ILE A 14 -3.202 -10.706 2.839 1.00 0.00 C ATOM 204 C ILE A 14 -2.855 -9.536 3.755 1.00 0.00 C ATOM 205 O ILE A 14 -3.139 -8.382 3.435 1.00 0.00 O ATOM 206 CB ILE A 14 -4.393 -11.481 3.435 1.00 0.00 C ATOM 207 CG1 ILE A 14 -4.777 -12.644 2.517 1.00 0.00 C ATOM 208 CG2 ILE A 14 -5.581 -10.552 3.649 1.00 0.00 C ATOM 209 CD1 ILE A 14 -5.840 -13.552 3.097 1.00 0.00 C ATOM 0 H ILE A 14 -2.217 -12.555 2.887 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.483 -10.320 1.859 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.098 -11.885 4.403 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.132 -12.244 1.568 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -3.886 -13.234 2.301 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -6.413 -11.116 4.070 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.299 -9.754 4.335 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.882 -10.120 2.694 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.060 -14.352 2.390 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -5.481 -13.982 4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -6.746 -12.976 3.287 1.00 0.00 H new ATOM 221 N LEU A 15 -2.239 -9.842 4.892 1.00 0.00 N ATOM 222 CA LEU A 15 -1.853 -8.816 5.856 1.00 0.00 C ATOM 223 C LEU A 15 -0.992 -7.746 5.195 1.00 0.00 C ATOM 224 O LEU A 15 -1.246 -6.551 5.345 1.00 0.00 O ATOM 225 CB LEU A 15 -1.093 -9.445 7.025 1.00 0.00 C ATOM 226 CG LEU A 15 -0.753 -8.485 8.167 1.00 0.00 C ATOM 227 CD1 LEU A 15 -2.015 -8.064 8.904 1.00 0.00 C ATOM 228 CD2 LEU A 15 0.240 -9.126 9.125 1.00 0.00 C ATOM 0 H LEU A 15 -1.996 -10.793 5.169 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.762 -8.346 6.232 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.688 -10.266 7.426 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.167 -9.877 6.646 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.292 -7.593 7.742 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.754 -7.381 9.713 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.691 -7.563 8.211 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.506 -8.945 9.317 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.470 -8.429 9.931 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.193 -10.034 9.544 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.155 -9.375 8.588 1.00 0.00 H new ATOM 240 N ALA A 16 0.028 -8.185 4.466 1.00 0.00 N ATOM 241 CA ALA A 16 0.928 -7.267 3.778 1.00 0.00 C ATOM 242 C ALA A 16 0.178 -6.444 2.737 1.00 0.00 C ATOM 243 O ALA A 16 0.542 -5.304 2.450 1.00 0.00 O ATOM 244 CB ALA A 16 2.072 -8.032 3.131 1.00 0.00 C ATOM 0 H ALA A 16 0.252 -9.172 4.336 1.00 0.00 H new ATOM 0 HA ALA A 16 1.342 -6.580 4.516 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.735 -7.333 2.621 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.631 -8.569 3.898 1.00 0.00 H new ATOM 0 HB3 ALA A 16 1.671 -8.744 2.409 1.00 0.00 H new ATOM 250 N LEU A 17 -0.866 -7.035 2.169 1.00 0.00 N ATOM 251 CA LEU A 17 -1.671 -6.360 1.159 1.00 0.00 C ATOM 252 C LEU A 17 -2.539 -5.279 1.796 1.00 0.00 C ATOM 253 O LEU A 17 -2.824 -4.253 1.176 1.00 0.00 O ATOM 254 CB LEU A 17 -2.546 -7.375 0.423 1.00 0.00 C ATOM 255 CG LEU A 17 -3.258 -6.845 -0.823 1.00 0.00 C ATOM 256 CD1 LEU A 17 -2.252 -6.347 -1.850 1.00 0.00 C ATOM 257 CD2 LEU A 17 -4.140 -7.927 -1.425 1.00 0.00 C ATOM 0 H LEU A 17 -1.175 -7.981 2.391 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.001 -5.884 0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.925 -8.222 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.297 -7.753 1.117 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.886 -6.005 -0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -2.781 -5.975 -2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.658 -5.543 -1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.595 -7.166 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -4.641 -7.537 -2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -3.526 -8.784 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -4.886 -8.237 -0.693 1.00 0.00 H new ATOM 269 N VAL A 18 -2.956 -5.515 3.036 1.00 0.00 N ATOM 270 CA VAL A 18 -3.787 -4.560 3.760 1.00 0.00 C ATOM 271 C VAL A 18 -2.979 -3.339 4.183 1.00 0.00 C ATOM 272 O VAL A 18 -3.396 -2.201 3.965 1.00 0.00 O ATOM 273 CB VAL A 18 -4.423 -5.202 5.013 1.00 0.00 C ATOM 274 CG1 VAL A 18 -5.194 -4.166 5.819 1.00 0.00 C ATOM 275 CG2 VAL A 18 -5.331 -6.359 4.622 1.00 0.00 C ATOM 0 H VAL A 18 -2.732 -6.360 3.561 1.00 0.00 H new ATOM 0 HA VAL A 18 -4.579 -4.250 3.078 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.620 -5.592 5.638 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -5.633 -4.641 6.696 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.516 -3.374 6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -5.986 -3.741 5.202 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.769 -6.797 5.519 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.126 -5.994 3.971 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.750 -7.116 4.095 1.00 0.00 H new ATOM 285 N VAL A 19 -1.817 -3.582 4.782 1.00 0.00 N ATOM 286 CA VAL A 19 -0.953 -2.503 5.246 1.00 0.00 C ATOM 287 C VAL A 19 -0.518 -1.597 4.094 1.00 0.00 C ATOM 288 O VAL A 19 -0.359 -0.391 4.278 1.00 0.00 O ATOM 289 CB VAL A 19 0.295 -3.050 5.968 1.00 0.00 C ATOM 290 CG1 VAL A 19 1.094 -3.960 5.051 1.00 0.00 C ATOM 291 CG2 VAL A 19 1.161 -1.911 6.482 1.00 0.00 C ATOM 0 H VAL A 19 -1.452 -4.518 4.957 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.540 -1.915 5.952 1.00 0.00 H new ATOM 0 HB VAL A 19 -0.039 -3.638 6.823 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.969 -4.334 5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.472 -4.800 4.740 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.414 -3.400 4.172 1.00 0.00 H new ATOM 0 HG21 VAL A 19 2.036 -2.319 6.988 1.00 0.00 H new ATOM 0 HG22 VAL A 19 1.482 -1.292 5.645 1.00 0.00 H new ATOM 0 HG23 VAL A 19 0.587 -1.305 7.182 1.00 0.00 H new ATOM 301 N LEU A 20 -0.328 -2.176 2.910 1.00 0.00 N ATOM 302 CA LEU A 20 0.083 -1.400 1.743 1.00 0.00 C ATOM 303 C LEU A 20 -0.932 -0.292 1.473 1.00 0.00 C ATOM 304 O LEU A 20 -0.562 0.850 1.200 1.00 0.00 O ATOM 305 CB LEU A 20 0.223 -2.309 0.512 1.00 0.00 C ATOM 306 CG LEU A 20 1.144 -1.792 -0.606 1.00 0.00 C ATOM 307 CD1 LEU A 20 0.530 -0.591 -1.311 1.00 0.00 C ATOM 308 CD2 LEU A 20 2.521 -1.433 -0.060 1.00 0.00 C ATOM 0 H LEU A 20 -0.451 -3.173 2.734 1.00 0.00 H new ATOM 0 HA LEU A 20 1.054 -0.949 1.946 1.00 0.00 H new ATOM 0 HB2 LEU A 20 0.594 -3.279 0.842 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.769 -2.473 0.092 1.00 0.00 H new ATOM 0 HG LEU A 20 1.259 -2.596 -1.333 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.203 -0.247 -2.096 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -0.425 -0.877 -1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 20 0.372 0.212 -0.591 1.00 0.00 H new ATOM 0 HD21 LEU A 20 3.151 -1.070 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.421 -0.655 0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.977 -2.317 0.386 1.00 0.00 H new ATOM 320 N THR A 21 -2.213 -0.638 1.564 1.00 0.00 N ATOM 321 CA THR A 21 -3.284 0.327 1.346 1.00 0.00 C ATOM 322 C THR A 21 -3.305 1.361 2.467 1.00 0.00 C ATOM 323 O THR A 21 -3.656 2.522 2.251 1.00 0.00 O ATOM 324 CB THR A 21 -4.660 -0.361 1.269 1.00 0.00 C ATOM 325 OG1 THR A 21 -4.651 -1.362 0.246 1.00 0.00 O ATOM 326 CG2 THR A 21 -5.760 0.651 0.979 1.00 0.00 C ATOM 0 H THR A 21 -2.534 -1.580 1.787 1.00 0.00 H new ATOM 0 HA THR A 21 -3.087 0.819 0.393 1.00 0.00 H new ATOM 0 HB THR A 21 -4.860 -0.826 2.234 1.00 0.00 H new ATOM 0 HG1 THR A 21 -5.529 -1.796 0.205 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.721 0.139 0.930 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.786 1.397 1.773 1.00 0.00 H new ATOM 0 HG23 THR A 21 -5.561 1.142 0.026 1.00 0.00 H new ATOM 334 N ILE A 22 -2.927 0.926 3.665 1.00 0.00 N ATOM 335 CA ILE A 22 -2.891 1.810 4.823 1.00 0.00 C ATOM 336 C ILE A 22 -1.798 2.859 4.667 1.00 0.00 C ATOM 337 O ILE A 22 -1.983 4.021 5.029 1.00 0.00 O ATOM 338 CB ILE A 22 -2.650 1.023 6.128 1.00 0.00 C ATOM 339 CG1 ILE A 22 -3.753 -0.021 6.340 1.00 0.00 C ATOM 340 CG2 ILE A 22 -2.573 1.971 7.317 1.00 0.00 C ATOM 341 CD1 ILE A 22 -5.138 0.573 6.495 1.00 0.00 C ATOM 0 H ILE A 22 -2.641 -0.034 3.858 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.863 2.300 4.882 1.00 0.00 H new ATOM 0 HB ILE A 22 -1.697 0.501 6.043 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -3.756 -0.709 5.495 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -3.518 -0.608 7.228 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.403 1.398 8.229 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.752 2.672 7.170 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -3.509 2.522 7.404 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.863 -0.228 6.641 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -5.154 1.239 7.358 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -5.395 1.136 5.598 1.00 0.00 H new ATOM 353 N ILE A 23 -0.661 2.440 4.122 1.00 0.00 N ATOM 354 CA ILE A 23 0.463 3.343 3.917 1.00 0.00 C ATOM 355 C ILE A 23 0.111 4.434 2.910 1.00 0.00 C ATOM 356 O ILE A 23 0.333 5.620 3.162 1.00 0.00 O ATOM 357 CB ILE A 23 1.717 2.592 3.427 1.00 0.00 C ATOM 358 CG1 ILE A 23 2.155 1.551 4.460 1.00 0.00 C ATOM 359 CG2 ILE A 23 2.846 3.574 3.146 1.00 0.00 C ATOM 360 CD1 ILE A 23 2.561 2.141 5.797 1.00 0.00 C ATOM 0 H ILE A 23 -0.495 1.482 3.815 1.00 0.00 H new ATOM 0 HA ILE A 23 0.681 3.796 4.884 1.00 0.00 H new ATOM 0 HB ILE A 23 1.471 2.074 2.500 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.339 0.846 4.618 1.00 0.00 H new ATOM 0 HG13 ILE A 23 2.993 0.983 4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 23 3.725 3.029 2.801 1.00 0.00 H new ATOM 0 HG22 ILE A 23 2.531 4.280 2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 23 3.091 4.117 4.059 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.858 1.339 6.473 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.398 2.824 5.654 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.719 2.684 6.226 1.00 0.00 H new ATOM 372 N SER A 24 -0.444 4.026 1.771 1.00 0.00 N ATOM 373 CA SER A 24 -0.822 4.964 0.718 1.00 0.00 C ATOM 374 C SER A 24 -2.010 5.825 1.142 1.00 0.00 C ATOM 375 O SER A 24 -2.212 6.918 0.615 1.00 0.00 O ATOM 376 CB SER A 24 -1.160 4.213 -0.571 1.00 0.00 C ATOM 377 OG SER A 24 -2.301 3.389 -0.400 1.00 0.00 O ATOM 0 H SER A 24 -0.642 3.049 1.554 1.00 0.00 H new ATOM 0 HA SER A 24 0.030 5.620 0.538 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.341 4.927 -1.374 1.00 0.00 H new ATOM 0 HB3 SER A 24 -0.309 3.602 -0.873 1.00 0.00 H new ATOM 0 HG SER A 24 -2.493 3.291 0.556 1.00 0.00 H new ATOM 383 N LEU A 25 -2.797 5.324 2.088 1.00 0.00 N ATOM 384 CA LEU A 25 -3.961 6.054 2.577 1.00 0.00 C ATOM 385 C LEU A 25 -3.538 7.318 3.314 1.00 0.00 C ATOM 386 O LEU A 25 -4.073 8.400 3.072 1.00 0.00 O ATOM 387 CB LEU A 25 -4.803 5.167 3.498 1.00 0.00 C ATOM 388 CG LEU A 25 -6.063 5.829 4.066 1.00 0.00 C ATOM 389 CD1 LEU A 25 -7.011 6.230 2.946 1.00 0.00 C ATOM 390 CD2 LEU A 25 -6.757 4.896 5.047 1.00 0.00 C ATOM 0 H LEU A 25 -2.650 4.417 2.531 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.565 6.341 1.716 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.098 4.274 2.947 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.179 4.837 4.329 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.766 6.732 4.600 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.899 6.698 3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.512 6.935 2.282 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -7.303 5.344 2.382 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.650 5.381 5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.040 3.976 4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.079 4.662 5.868 1.00 0.00 H new ATOM 402 N ILE A 26 -2.571 7.174 4.217 1.00 0.00 N ATOM 403 CA ILE A 26 -2.072 8.305 4.991 1.00 0.00 C ATOM 404 C ILE A 26 -1.466 9.366 4.078 1.00 0.00 C ATOM 405 O ILE A 26 -1.646 10.564 4.297 1.00 0.00 O ATOM 406 CB ILE A 26 -1.012 7.859 6.021 1.00 0.00 C ATOM 407 CG1 ILE A 26 -1.594 6.802 6.969 1.00 0.00 C ATOM 408 CG2 ILE A 26 -0.488 9.054 6.805 1.00 0.00 C ATOM 409 CD1 ILE A 26 -2.739 7.308 7.823 1.00 0.00 C ATOM 0 H ILE A 26 -2.118 6.285 4.430 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.924 8.729 5.522 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.176 7.413 5.482 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -1.940 5.952 6.381 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.801 6.437 7.621 1.00 0.00 H new ATOM 0 HG21 ILE A 26 0.258 8.718 7.525 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.033 9.768 6.119 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.313 9.533 7.333 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.096 6.504 8.466 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.394 8.139 8.439 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.551 7.646 7.179 1.00 0.00 H new ATOM 421 N ILE A 27 -0.749 8.918 3.052 1.00 0.00 N ATOM 422 CA ILE A 27 -0.111 9.825 2.107 1.00 0.00 C ATOM 423 C ILE A 27 -1.142 10.526 1.230 1.00 0.00 C ATOM 424 O ILE A 27 -0.982 11.696 0.882 1.00 0.00 O ATOM 425 CB ILE A 27 0.889 9.081 1.200 1.00 0.00 C ATOM 426 CG1 ILE A 27 1.851 8.233 2.040 1.00 0.00 C ATOM 427 CG2 ILE A 27 1.659 10.070 0.335 1.00 0.00 C ATOM 428 CD1 ILE A 27 2.623 9.022 3.077 1.00 0.00 C ATOM 0 H ILE A 27 -0.596 7.929 2.854 1.00 0.00 H new ATOM 0 HA ILE A 27 0.424 10.567 2.699 1.00 0.00 H new ATOM 0 HB ILE A 27 0.330 8.413 0.544 1.00 0.00 H new ATOM 0 HG12 ILE A 27 1.284 7.449 2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 27 2.558 7.738 1.375 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.361 9.529 -0.300 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.961 10.628 -0.289 1.00 0.00 H new ATOM 0 HG23 ILE A 27 2.207 10.762 0.974 1.00 0.00 H new ATOM 0 HD11 ILE A 27 3.281 8.351 3.629 1.00 0.00 H new ATOM 0 HD12 ILE A 27 3.219 9.788 2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 27 1.925 9.495 3.768 1.00 0.00 H new ATOM 440 N LEU A 28 -2.196 9.800 0.869 1.00 0.00 N ATOM 441 CA LEU A 28 -3.251 10.348 0.026 1.00 0.00 C ATOM 442 C LEU A 28 -3.863 11.601 0.647 1.00 0.00 C ATOM 443 O LEU A 28 -3.986 12.634 -0.010 1.00 0.00 O ATOM 444 CB LEU A 28 -4.342 9.301 -0.207 1.00 0.00 C ATOM 445 CG LEU A 28 -5.492 9.753 -1.107 1.00 0.00 C ATOM 446 CD1 LEU A 28 -5.000 9.991 -2.527 1.00 0.00 C ATOM 447 CD2 LEU A 28 -6.614 8.725 -1.093 1.00 0.00 C ATOM 0 H LEU A 28 -2.341 8.830 1.148 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.804 10.623 -0.929 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.885 8.414 -0.645 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.752 9.004 0.759 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.883 10.694 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.833 10.312 -3.152 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.232 10.764 -2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.582 9.067 -2.927 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.425 9.062 -1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.236 7.769 -1.455 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.986 8.606 -0.075 1.00 0.00 H new ATOM 459 N ILE A 29 -4.248 11.501 1.916 1.00 0.00 N ATOM 460 CA ILE A 29 -4.855 12.623 2.622 1.00 0.00 C ATOM 461 C ILE A 29 -3.815 13.685 2.971 1.00 0.00 C ATOM 462 O ILE A 29 -4.090 14.883 2.888 1.00 0.00 O ATOM 463 CB ILE A 29 -5.577 12.158 3.910 1.00 0.00 C ATOM 464 CG1 ILE A 29 -6.871 11.413 3.568 1.00 0.00 C ATOM 465 CG2 ILE A 29 -5.879 13.344 4.817 1.00 0.00 C ATOM 466 CD1 ILE A 29 -6.652 10.064 2.916 1.00 0.00 C ATOM 0 H ILE A 29 -4.150 10.654 2.476 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.592 13.060 1.949 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.913 11.475 4.440 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.450 11.274 4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.470 12.034 2.902 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.386 12.994 5.716 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.947 13.836 5.094 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.520 14.051 4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.616 9.601 2.705 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -6.101 10.195 1.985 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.081 9.424 3.588 1.00 0.00 H new ATOM 478 N MET A 30 -2.622 13.245 3.363 1.00 0.00 N ATOM 479 CA MET A 30 -1.550 14.168 3.723 1.00 0.00 C ATOM 480 C MET A 30 -1.230 15.104 2.561 1.00 0.00 C ATOM 481 O MET A 30 -1.025 16.302 2.757 1.00 0.00 O ATOM 482 CB MET A 30 -0.296 13.400 4.141 1.00 0.00 C ATOM 483 CG MET A 30 0.843 14.299 4.598 1.00 0.00 C ATOM 484 SD MET A 30 2.140 13.396 5.470 1.00 0.00 S ATOM 485 CE MET A 30 2.662 12.241 4.207 1.00 0.00 C ATOM 0 H MET A 30 -2.374 12.259 3.439 1.00 0.00 H new ATOM 0 HA MET A 30 -1.890 14.767 4.568 1.00 0.00 H new ATOM 0 HB2 MET A 30 -0.552 12.713 4.948 1.00 0.00 H new ATOM 0 HB3 MET A 30 0.045 12.793 3.302 1.00 0.00 H new ATOM 0 HG2 MET A 30 1.275 14.800 3.731 1.00 0.00 H new ATOM 0 HG3 MET A 30 0.446 15.077 5.251 1.00 0.00 H new ATOM 0 HE1 MET A 30 3.497 11.648 4.579 1.00 0.00 H new ATOM 0 HE2 MET A 30 1.833 11.581 3.953 1.00 0.00 H new ATOM 0 HE3 MET A 30 2.974 12.790 3.319 1.00 0.00 H new ATOM 495 N LEU A 31 -1.190 14.549 1.355 1.00 0.00 N ATOM 496 CA LEU A 31 -0.906 15.339 0.163 1.00 0.00 C ATOM 497 C LEU A 31 -2.159 16.084 -0.280 1.00 0.00 C ATOM 498 O LEU A 31 -2.081 17.122 -0.939 1.00 0.00 O ATOM 499 CB LEU A 31 -0.400 14.442 -0.970 1.00 0.00 C ATOM 500 CG LEU A 31 0.003 15.176 -2.252 1.00 0.00 C ATOM 501 CD1 LEU A 31 1.225 16.050 -2.010 1.00 0.00 C ATOM 502 CD2 LEU A 31 0.269 14.182 -3.373 1.00 0.00 C ATOM 0 H LEU A 31 -1.350 13.558 1.177 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.128 16.063 0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 31 0.459 13.877 -0.608 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.178 13.718 -1.214 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.823 15.821 -2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.494 16.562 -2.934 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.999 16.787 -1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.058 15.428 -1.684 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.554 14.721 -4.277 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.077 13.511 -3.080 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.633 13.601 -3.566 1.00 0.00 H new ATOM 514 N TRP A 32 -3.315 15.543 0.090 1.00 0.00 N ATOM 515 CA TRP A 32 -4.594 16.150 -0.256 1.00 0.00 C ATOM 516 C TRP A 32 -4.756 17.493 0.446 1.00 0.00 C ATOM 517 O TRP A 32 -5.463 18.379 -0.035 1.00 0.00 O ATOM 518 CB TRP A 32 -5.740 15.209 0.127 1.00 0.00 C ATOM 519 CG TRP A 32 -7.101 15.795 -0.098 1.00 0.00 C ATOM 520 CD1 TRP A 32 -7.593 16.308 -1.263 1.00 0.00 C ATOM 521 CD2 TRP A 32 -8.147 15.924 0.872 1.00 0.00 C ATOM 522 NE1 TRP A 32 -8.879 16.754 -1.076 1.00 0.00 N ATOM 523 CE2 TRP A 32 -9.242 16.529 0.225 1.00 0.00 C ATOM 524 CE3 TRP A 32 -8.264 15.590 2.223 1.00 0.00 C ATOM 525 CZ2 TRP A 32 -10.437 16.805 0.885 1.00 0.00 C ATOM 526 CZ3 TRP A 32 -9.452 15.863 2.877 1.00 0.00 C ATOM 527 CH2 TRP A 32 -10.524 16.465 2.207 1.00 0.00 C ATOM 0 H TRP A 32 -3.392 14.682 0.632 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.620 16.320 -1.332 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -5.651 14.288 -0.450 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -5.640 14.938 1.178 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -7.051 16.356 -2.196 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -9.468 17.183 -1.790 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -7.442 15.127 2.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -11.265 17.271 0.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -9.554 15.608 3.921 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -11.439 16.665 2.745 1.00 0.00 H new ATOM 538 N GLN A 33 -4.090 17.638 1.588 1.00 0.00 N ATOM 539 CA GLN A 33 -4.152 18.870 2.362 1.00 0.00 C ATOM 540 C GLN A 33 -2.879 19.689 2.177 1.00 0.00 C ATOM 541 O GLN A 33 -2.654 20.674 2.880 1.00 0.00 O ATOM 542 CB GLN A 33 -4.367 18.556 3.843 1.00 0.00 C ATOM 543 CG GLN A 33 -5.707 17.902 4.136 1.00 0.00 C ATOM 544 CD GLN A 33 -6.880 18.766 3.712 1.00 0.00 C ATOM 545 OE1 GLN A 33 -7.386 19.572 4.494 1.00 0.00 O ATOM 546 NE2 GLN A 33 -7.316 18.603 2.469 1.00 0.00 N ATOM 0 H GLN A 33 -3.500 16.914 1.997 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.995 19.459 2.001 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.568 17.899 4.187 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -4.289 19.479 4.417 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.761 16.944 3.620 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.780 17.694 5.203 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.866 17.923 1.856 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -8.101 19.158 2.127 1.00 0.00 H new ATOM 555 N LYS A 34 -2.047 19.273 1.226 1.00 0.00 N ATOM 556 CA LYS A 34 -0.798 19.971 0.940 1.00 0.00 C ATOM 557 C LYS A 34 -0.835 20.583 -0.457 1.00 0.00 C ATOM 558 O LYS A 34 -1.397 20.000 -1.385 1.00 0.00 O ATOM 559 CB LYS A 34 0.390 19.013 1.060 1.00 0.00 C ATOM 560 CG LYS A 34 1.737 19.687 0.851 1.00 0.00 C ATOM 561 CD LYS A 34 2.062 20.653 1.979 1.00 0.00 C ATOM 562 CE LYS A 34 3.303 21.476 1.669 1.00 0.00 C ATOM 563 NZ LYS A 34 4.490 20.614 1.414 1.00 0.00 N ATOM 0 H LYS A 34 -2.216 18.455 0.640 1.00 0.00 H new ATOM 0 HA LYS A 34 -0.679 20.772 1.670 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.374 18.549 2.046 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.276 18.212 0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.517 18.929 0.785 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.732 20.223 -0.098 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.215 21.319 2.145 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.215 20.096 2.903 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.115 22.102 0.797 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.513 22.145 2.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.359 21.163 1.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 4.471 19.798 2.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.470 20.278 0.430 1.00 0.00 H new ATOM 577 N LYS A 35 -0.233 21.760 -0.599 1.00 0.00 N ATOM 578 CA LYS A 35 -0.198 22.453 -1.883 1.00 0.00 C ATOM 579 C LYS A 35 0.591 21.647 -2.919 1.00 0.00 C ATOM 580 O LYS A 35 1.801 21.472 -2.781 1.00 0.00 O ATOM 581 CB LYS A 35 0.432 23.839 -1.718 1.00 0.00 C ATOM 582 CG LYS A 35 0.324 24.713 -2.959 1.00 0.00 C ATOM 583 CD LYS A 35 -1.121 25.085 -3.255 1.00 0.00 C ATOM 584 CE LYS A 35 -1.227 25.973 -4.487 1.00 0.00 C ATOM 585 NZ LYS A 35 -2.636 26.362 -4.770 1.00 0.00 N ATOM 0 H LYS A 35 0.237 22.254 0.159 1.00 0.00 H new ATOM 0 HA LYS A 35 -1.223 22.562 -2.236 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -0.048 24.349 -0.883 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.484 23.721 -1.458 1.00 0.00 H new ATOM 0 HG2 LYS A 35 0.913 25.620 -2.819 1.00 0.00 H new ATOM 0 HG3 LYS A 35 0.748 24.186 -3.814 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.707 24.179 -3.407 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.548 25.601 -2.395 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.625 26.870 -4.341 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.815 25.449 -5.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -2.666 26.966 -5.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -3.206 25.508 -4.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -3.022 26.884 -3.958 1.00 0.00 H new ATOM 599 N PRO A 36 -0.083 21.139 -3.974 1.00 0.00 N ATOM 600 CA PRO A 36 0.580 20.355 -5.024 1.00 0.00 C ATOM 601 C PRO A 36 1.705 21.132 -5.697 1.00 0.00 C ATOM 602 O PRO A 36 1.736 22.362 -5.654 1.00 0.00 O ATOM 603 CB PRO A 36 -0.541 20.066 -6.028 1.00 0.00 C ATOM 604 CG PRO A 36 -1.800 20.209 -5.247 1.00 0.00 C ATOM 605 CD PRO A 36 -1.528 21.278 -4.226 1.00 0.00 C ATOM 0 HA PRO A 36 1.048 19.456 -4.623 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.513 20.765 -6.864 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.448 19.064 -6.447 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.632 20.488 -5.894 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.071 19.269 -4.766 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -1.778 22.269 -4.604 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.112 21.126 -3.318 1.00 0.00 H new ATOM 613 N ARG A 37 2.628 20.405 -6.317 1.00 0.00 N ATOM 614 CA ARG A 37 3.756 21.023 -7.002 1.00 0.00 C ATOM 615 C ARG A 37 3.910 20.461 -8.412 1.00 0.00 C ATOM 616 O ARG A 37 4.063 19.254 -8.598 1.00 0.00 O ATOM 617 CB ARG A 37 5.044 20.803 -6.205 1.00 0.00 C ATOM 618 CG ARG A 37 5.053 21.505 -4.856 1.00 0.00 C ATOM 619 CD ARG A 37 6.332 21.218 -4.086 1.00 0.00 C ATOM 620 NE ARG A 37 6.424 19.820 -3.672 1.00 0.00 N ATOM 621 CZ ARG A 37 7.460 19.311 -3.012 1.00 0.00 C ATOM 622 NH1 ARG A 37 8.496 20.080 -2.700 1.00 0.00 N ATOM 623 NH2 ARG A 37 7.459 18.032 -2.664 1.00 0.00 N ATOM 0 H ARG A 37 2.617 19.386 -6.359 1.00 0.00 H new ATOM 0 HA ARG A 37 3.563 22.093 -7.078 1.00 0.00 H new ATOM 0 HB2 ARG A 37 5.187 19.734 -6.050 1.00 0.00 H new ATOM 0 HB3 ARG A 37 5.891 21.155 -6.794 1.00 0.00 H new ATOM 0 HG2 ARG A 37 4.950 22.580 -5.004 1.00 0.00 H new ATOM 0 HG3 ARG A 37 4.194 21.180 -4.270 1.00 0.00 H new ATOM 0 HD2 ARG A 37 7.192 21.469 -4.707 1.00 0.00 H new ATOM 0 HD3 ARG A 37 6.376 21.860 -3.206 1.00 0.00 H new ATOM 0 HE ARG A 37 5.649 19.199 -3.903 1.00 0.00 H new ATOM 0 HH11 ARG A 37 8.499 21.065 -2.967 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.289 19.686 -2.194 1.00 0.00 H new ATOM 0 HH21 ARG A 37 6.664 17.439 -2.903 1.00 0.00 H new ATOM 0 HH22 ARG A 37 8.253 17.641 -2.158 1.00 0.00 H new ATOM 637 N TYR A 38 3.871 21.347 -9.403 1.00 0.00 N ATOM 638 CA TYR A 38 4.006 20.943 -10.799 1.00 0.00 C ATOM 639 C TYR A 38 5.467 20.675 -11.148 1.00 0.00 C ATOM 640 O TYR A 38 6.376 21.213 -10.514 1.00 0.00 O ATOM 641 CB TYR A 38 3.442 22.026 -11.720 1.00 0.00 C ATOM 642 CG TYR A 38 1.989 22.355 -11.456 1.00 0.00 C ATOM 643 CD1 TYR A 38 1.636 23.339 -10.539 1.00 0.00 C ATOM 644 CD2 TYR A 38 0.971 21.685 -12.124 1.00 0.00 C ATOM 645 CE1 TYR A 38 0.309 23.642 -10.295 1.00 0.00 C ATOM 646 CE2 TYR A 38 -0.357 21.985 -11.885 1.00 0.00 C ATOM 647 CZ TYR A 38 -0.682 22.964 -10.971 1.00 0.00 C ATOM 648 OH TYR A 38 -2.003 23.263 -10.729 1.00 0.00 O ATOM 0 H TYR A 38 3.747 22.350 -9.265 1.00 0.00 H new ATOM 0 HA TYR A 38 3.441 20.022 -10.942 1.00 0.00 H new ATOM 0 HB2 TYR A 38 4.037 22.932 -11.606 1.00 0.00 H new ATOM 0 HB3 TYR A 38 3.549 21.702 -12.755 1.00 0.00 H new ATOM 0 HD1 TYR A 38 2.410 23.875 -10.009 1.00 0.00 H new ATOM 0 HD2 TYR A 38 1.222 20.918 -12.841 1.00 0.00 H new ATOM 0 HE1 TYR A 38 0.050 24.407 -9.578 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -1.136 21.455 -12.412 1.00 0.00 H new ATOM 0 HH TYR A 38 -2.574 22.696 -11.288 1.00 0.00 H new ATOM 658 N GLU A 39 5.686 19.839 -12.157 1.00 0.00 N ATOM 659 CA GLU A 39 7.037 19.500 -12.592 1.00 0.00 C ATOM 660 C GLU A 39 7.092 19.321 -14.106 1.00 0.00 C ATOM 661 O GLU A 39 6.058 19.204 -14.766 1.00 0.00 O ATOM 662 CB GLU A 39 7.519 18.224 -11.895 1.00 0.00 C ATOM 663 CG GLU A 39 6.729 16.979 -12.268 1.00 0.00 C ATOM 664 CD GLU A 39 5.294 17.023 -11.779 1.00 0.00 C ATOM 665 OE1 GLU A 39 5.063 16.732 -10.587 1.00 0.00 O ATOM 666 OE2 GLU A 39 4.401 17.347 -12.589 1.00 0.00 O ATOM 667 OXT GLU A 39 8.224 19.307 -14.636 1.00 0.00 O ATOM 0 H GLU A 39 4.945 19.383 -12.690 1.00 0.00 H new ATOM 0 HA GLU A 39 7.696 20.323 -12.318 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.569 18.063 -12.140 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.462 18.368 -10.816 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.735 16.862 -13.352 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.223 16.102 -11.850 1.00 0.00 H new TER 674 GLU A 39 ATOM 675 N GLY B 1 -8.723 -20.750 -0.979 1.00 0.00 N ATOM 676 CA GLY B 1 -8.439 -21.856 -0.085 1.00 0.00 C ATOM 677 C GLY B 1 -7.382 -22.793 -0.640 1.00 0.00 C ATOM 678 O GLY B 1 -6.198 -22.454 -0.671 1.00 0.00 O ATOM 0 H1 GLY B 1 -9.450 -20.139 -0.555 1.00 0.00 H new ATOM 0 H2 GLY B 1 -7.855 -20.198 -1.135 1.00 0.00 H new ATOM 0 H3 GLY B 1 -9.067 -21.118 -1.889 1.00 0.00 H new ATOM 0 HA2 GLY B 1 -8.106 -21.466 0.877 1.00 0.00 H new ATOM 0 HA3 GLY B 1 -9.356 -22.416 0.099 1.00 0.00 H new ATOM 684 N HIS B 2 -7.811 -23.972 -1.078 1.00 0.00 N ATOM 685 CA HIS B 2 -6.893 -24.959 -1.636 1.00 0.00 C ATOM 686 C HIS B 2 -6.934 -24.934 -3.160 1.00 0.00 C ATOM 687 O HIS B 2 -5.936 -25.221 -3.822 1.00 0.00 O ATOM 688 CB HIS B 2 -7.242 -26.358 -1.126 1.00 0.00 C ATOM 689 CG HIS B 2 -6.271 -27.413 -1.557 1.00 0.00 C ATOM 690 ND1 HIS B 2 -6.406 -28.127 -2.729 1.00 0.00 N ATOM 691 CD2 HIS B 2 -5.143 -27.876 -0.966 1.00 0.00 C ATOM 692 CE1 HIS B 2 -5.406 -28.983 -2.840 1.00 0.00 C ATOM 693 NE2 HIS B 2 -4.626 -28.848 -1.784 1.00 0.00 N ATOM 0 H HIS B 2 -8.787 -24.267 -1.058 1.00 0.00 H new ATOM 0 HA HIS B 2 -5.883 -24.706 -1.312 1.00 0.00 H new ATOM 0 HB2 HIS B 2 -7.285 -26.338 -0.037 1.00 0.00 H new ATOM 0 HB3 HIS B 2 -8.238 -26.626 -1.479 1.00 0.00 H new ATOM 0 HD2 HIS B 2 -4.728 -27.542 -0.026 1.00 0.00 H new ATOM 0 HE1 HIS B 2 -5.253 -29.675 -3.655 1.00 0.00 H new ATOM 0 HE2 HIS B 2 -3.775 -29.381 -1.605 1.00 0.00 H new ATOM 702 N SER B 3 -8.094 -24.588 -3.709 1.00 0.00 N ATOM 703 CA SER B 3 -8.270 -24.523 -5.156 1.00 0.00 C ATOM 704 C SER B 3 -7.328 -23.497 -5.775 1.00 0.00 C ATOM 705 O SER B 3 -6.977 -23.589 -6.951 1.00 0.00 O ATOM 706 CB SER B 3 -9.720 -24.173 -5.499 1.00 0.00 C ATOM 707 OG SER B 3 -10.618 -25.122 -4.950 1.00 0.00 O ATOM 0 H SER B 3 -8.928 -24.348 -3.173 1.00 0.00 H new ATOM 0 HA SER B 3 -8.031 -25.503 -5.569 1.00 0.00 H new ATOM 0 HB2 SER B 3 -9.958 -23.180 -5.117 1.00 0.00 H new ATOM 0 HB3 SER B 3 -9.842 -24.136 -6.582 1.00 0.00 H new ATOM 0 HG SER B 3 -11.537 -24.875 -5.182 1.00 0.00 H new ATOM 713 N LEU B 4 -6.922 -22.517 -4.974 1.00 0.00 N ATOM 714 CA LEU B 4 -6.020 -21.470 -5.438 1.00 0.00 C ATOM 715 C LEU B 4 -4.562 -21.923 -5.335 1.00 0.00 C ATOM 716 O LEU B 4 -4.106 -22.309 -4.258 1.00 0.00 O ATOM 717 CB LEU B 4 -6.224 -20.193 -4.620 1.00 0.00 C ATOM 718 CG LEU B 4 -5.276 -19.043 -4.959 1.00 0.00 C ATOM 719 CD1 LEU B 4 -5.602 -18.463 -6.327 1.00 0.00 C ATOM 720 CD2 LEU B 4 -5.348 -17.964 -3.887 1.00 0.00 C ATOM 0 H LEU B 4 -7.205 -22.426 -3.998 1.00 0.00 H new ATOM 0 HA LEU B 4 -6.248 -21.266 -6.484 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -7.249 -19.851 -4.761 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -6.111 -20.436 -3.563 1.00 0.00 H new ATOM 0 HG LEU B 4 -4.258 -19.432 -4.990 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -4.916 -17.646 -6.549 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -5.499 -19.239 -7.085 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -6.625 -18.088 -6.329 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -4.667 -17.152 -4.142 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -6.366 -17.579 -3.826 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -5.062 -18.388 -2.924 1.00 0.00 H new ATOM 732 N PRO B 5 -3.808 -21.886 -6.454 1.00 0.00 N ATOM 733 CA PRO B 5 -2.398 -22.290 -6.461 1.00 0.00 C ATOM 734 C PRO B 5 -1.586 -21.553 -5.403 1.00 0.00 C ATOM 735 O PRO B 5 -1.704 -20.338 -5.248 1.00 0.00 O ATOM 736 CB PRO B 5 -1.922 -21.910 -7.865 1.00 0.00 C ATOM 737 CG PRO B 5 -3.157 -21.925 -8.696 1.00 0.00 C ATOM 738 CD PRO B 5 -4.263 -21.458 -7.791 1.00 0.00 C ATOM 0 HA PRO B 5 -2.275 -23.348 -6.232 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -1.451 -20.927 -7.872 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -1.184 -22.619 -8.239 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -3.055 -21.269 -9.560 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -3.360 -22.926 -9.078 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -4.397 -20.378 -7.844 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -5.218 -21.911 -8.056 1.00 0.00 H new ATOM 746 N PHE B 6 -0.771 -22.298 -4.669 1.00 0.00 N ATOM 747 CA PHE B 6 0.060 -21.723 -3.618 1.00 0.00 C ATOM 748 C PHE B 6 1.200 -20.889 -4.206 1.00 0.00 C ATOM 749 O PHE B 6 1.830 -20.103 -3.506 1.00 0.00 O ATOM 750 CB PHE B 6 0.617 -22.833 -2.722 1.00 0.00 C ATOM 751 CG PHE B 6 1.807 -23.550 -3.299 1.00 0.00 C ATOM 752 CD1 PHE B 6 1.714 -24.219 -4.510 1.00 0.00 C ATOM 753 CD2 PHE B 6 3.017 -23.558 -2.624 1.00 0.00 C ATOM 754 CE1 PHE B 6 2.808 -24.881 -5.036 1.00 0.00 C ATOM 755 CE2 PHE B 6 4.112 -24.218 -3.145 1.00 0.00 C ATOM 756 CZ PHE B 6 4.008 -24.881 -4.353 1.00 0.00 C ATOM 0 H PHE B 6 -0.667 -23.306 -4.782 1.00 0.00 H new ATOM 0 HA PHE B 6 -0.562 -21.060 -3.017 1.00 0.00 H new ATOM 0 HB2 PHE B 6 0.897 -22.403 -1.760 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -0.172 -23.559 -2.529 1.00 0.00 H new ATOM 0 HD1 PHE B 6 0.777 -24.223 -5.048 1.00 0.00 H new ATOM 0 HD2 PHE B 6 3.105 -23.042 -1.679 1.00 0.00 H new ATOM 0 HE1 PHE B 6 2.724 -25.398 -5.981 1.00 0.00 H new ATOM 0 HE2 PHE B 6 5.049 -24.216 -2.609 1.00 0.00 H new ATOM 0 HZ PHE B 6 4.863 -25.398 -4.762 1.00 0.00 H new ATOM 766 N LYS B 7 1.462 -21.075 -5.495 1.00 0.00 N ATOM 767 CA LYS B 7 2.535 -20.349 -6.172 1.00 0.00 C ATOM 768 C LYS B 7 2.249 -18.849 -6.261 1.00 0.00 C ATOM 769 O LYS B 7 3.149 -18.030 -6.073 1.00 0.00 O ATOM 770 CB LYS B 7 2.751 -20.920 -7.575 1.00 0.00 C ATOM 771 CG LYS B 7 3.919 -20.289 -8.316 1.00 0.00 C ATOM 772 CD LYS B 7 4.105 -20.903 -9.696 1.00 0.00 C ATOM 773 CE LYS B 7 4.523 -22.362 -9.608 1.00 0.00 C ATOM 774 NZ LYS B 7 4.759 -22.956 -10.953 1.00 0.00 N ATOM 0 H LYS B 7 0.948 -21.721 -6.093 1.00 0.00 H new ATOM 0 HA LYS B 7 3.440 -20.478 -5.578 1.00 0.00 H new ATOM 0 HB2 LYS B 7 2.918 -21.995 -7.499 1.00 0.00 H new ATOM 0 HB3 LYS B 7 1.842 -20.779 -8.160 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.752 -19.216 -8.414 1.00 0.00 H new ATOM 0 HG3 LYS B 7 4.832 -20.417 -7.734 1.00 0.00 H new ATOM 0 HD2 LYS B 7 3.175 -20.824 -10.258 1.00 0.00 H new ATOM 0 HD3 LYS B 7 4.859 -20.340 -10.246 1.00 0.00 H new ATOM 0 HE2 LYS B 7 5.431 -22.444 -9.011 1.00 0.00 H new ATOM 0 HE3 LYS B 7 3.750 -22.930 -9.091 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 5.042 -23.951 -10.848 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 3.885 -22.902 -11.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 5.515 -22.430 -11.437 1.00 0.00 H new ATOM 788 N VAL B 8 1.001 -18.489 -6.547 1.00 0.00 N ATOM 789 CA VAL B 8 0.621 -17.082 -6.678 1.00 0.00 C ATOM 790 C VAL B 8 0.595 -16.359 -5.334 1.00 0.00 C ATOM 791 O VAL B 8 0.942 -15.179 -5.253 1.00 0.00 O ATOM 792 CB VAL B 8 -0.752 -16.920 -7.361 1.00 0.00 C ATOM 793 CG1 VAL B 8 -0.739 -17.551 -8.744 1.00 0.00 C ATOM 794 CG2 VAL B 8 -1.858 -17.519 -6.505 1.00 0.00 C ATOM 0 H VAL B 8 0.236 -19.148 -6.692 1.00 0.00 H new ATOM 0 HA VAL B 8 1.390 -16.628 -7.303 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.953 -15.854 -7.473 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.716 -17.426 -9.210 1.00 0.00 H new ATOM 0 HG12 VAL B 8 0.020 -17.066 -9.358 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -0.511 -18.613 -8.657 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.817 -17.392 -7.008 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.666 -18.581 -6.353 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -1.885 -17.013 -5.540 1.00 0.00 H new ATOM 804 N VAL B 9 0.181 -17.056 -4.279 1.00 0.00 N ATOM 805 CA VAL B 9 0.102 -16.448 -2.955 1.00 0.00 C ATOM 806 C VAL B 9 1.491 -16.151 -2.387 1.00 0.00 C ATOM 807 O VAL B 9 1.689 -15.137 -1.718 1.00 0.00 O ATOM 808 CB VAL B 9 -0.687 -17.331 -1.965 1.00 0.00 C ATOM 809 CG1 VAL B 9 0.055 -18.621 -1.663 1.00 0.00 C ATOM 810 CG2 VAL B 9 -0.974 -16.562 -0.685 1.00 0.00 C ATOM 0 H VAL B 9 -0.103 -18.035 -4.315 1.00 0.00 H new ATOM 0 HA VAL B 9 -0.432 -15.506 -3.080 1.00 0.00 H new ATOM 0 HB VAL B 9 -1.635 -17.598 -2.432 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -0.527 -19.220 -0.963 1.00 0.00 H new ATOM 0 HG12 VAL B 9 0.201 -19.182 -2.586 1.00 0.00 H new ATOM 0 HG13 VAL B 9 1.025 -18.388 -1.223 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -1.531 -17.197 0.004 1.00 0.00 H new ATOM 0 HG22 VAL B 9 -0.034 -16.262 -0.222 1.00 0.00 H new ATOM 0 HG23 VAL B 9 -1.563 -15.675 -0.918 1.00 0.00 H new ATOM 820 N VAL B 10 2.450 -17.035 -2.656 1.00 0.00 N ATOM 821 CA VAL B 10 3.814 -16.846 -2.170 1.00 0.00 C ATOM 822 C VAL B 10 4.467 -15.648 -2.850 1.00 0.00 C ATOM 823 O VAL B 10 5.142 -14.846 -2.204 1.00 0.00 O ATOM 824 CB VAL B 10 4.683 -18.100 -2.412 1.00 0.00 C ATOM 825 CG1 VAL B 10 6.121 -17.850 -1.979 1.00 0.00 C ATOM 826 CG2 VAL B 10 4.105 -19.299 -1.680 1.00 0.00 C ATOM 0 H VAL B 10 2.309 -17.884 -3.204 1.00 0.00 H new ATOM 0 HA VAL B 10 3.749 -16.668 -1.097 1.00 0.00 H new ATOM 0 HB VAL B 10 4.681 -18.316 -3.480 1.00 0.00 H new ATOM 0 HG11 VAL B 10 6.716 -18.746 -2.158 1.00 0.00 H new ATOM 0 HG12 VAL B 10 6.534 -17.020 -2.551 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.144 -17.606 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL B 10 4.731 -20.173 -1.862 1.00 0.00 H new ATOM 0 HG22 VAL B 10 4.074 -19.092 -0.610 1.00 0.00 H new ATOM 0 HG23 VAL B 10 3.095 -19.494 -2.041 1.00 0.00 H new ATOM 836 N ILE B 11 4.257 -15.534 -4.156 1.00 0.00 N ATOM 837 CA ILE B 11 4.820 -14.437 -4.931 1.00 0.00 C ATOM 838 C ILE B 11 4.203 -13.103 -4.523 1.00 0.00 C ATOM 839 O ILE B 11 4.883 -12.078 -4.494 1.00 0.00 O ATOM 840 CB ILE B 11 4.612 -14.658 -6.441 1.00 0.00 C ATOM 841 CG1 ILE B 11 5.297 -15.953 -6.883 1.00 0.00 C ATOM 842 CG2 ILE B 11 5.143 -13.471 -7.234 1.00 0.00 C ATOM 843 CD1 ILE B 11 4.996 -16.348 -8.314 1.00 0.00 C ATOM 0 H ILE B 11 3.699 -16.191 -4.701 1.00 0.00 H new ATOM 0 HA ILE B 11 5.890 -14.411 -4.722 1.00 0.00 H new ATOM 0 HB ILE B 11 3.543 -14.746 -6.637 1.00 0.00 H new ATOM 0 HG12 ILE B 11 6.375 -15.841 -6.766 1.00 0.00 H new ATOM 0 HG13 ILE B 11 4.987 -16.761 -6.220 1.00 0.00 H new ATOM 0 HG21 ILE B 11 4.987 -13.646 -8.299 1.00 0.00 H new ATOM 0 HG22 ILE B 11 4.614 -12.567 -6.933 1.00 0.00 H new ATOM 0 HG23 ILE B 11 6.208 -13.350 -7.038 1.00 0.00 H new ATOM 0 HD11 ILE B 11 5.517 -17.275 -8.553 1.00 0.00 H new ATOM 0 HD12 ILE B 11 3.922 -16.494 -8.433 1.00 0.00 H new ATOM 0 HD13 ILE B 11 5.332 -15.559 -8.987 1.00 0.00 H new ATOM 855 N SER B 12 2.912 -13.123 -4.207 1.00 0.00 N ATOM 856 CA SER B 12 2.210 -11.913 -3.797 1.00 0.00 C ATOM 857 C SER B 12 2.690 -11.447 -2.427 1.00 0.00 C ATOM 858 O SER B 12 2.838 -10.249 -2.185 1.00 0.00 O ATOM 859 CB SER B 12 0.700 -12.158 -3.765 1.00 0.00 C ATOM 860 OG SER B 12 0.201 -12.438 -5.061 1.00 0.00 O ATOM 0 H SER B 12 2.332 -13.962 -4.227 1.00 0.00 H new ATOM 0 HA SER B 12 2.427 -11.132 -4.525 1.00 0.00 H new ATOM 0 HB2 SER B 12 0.478 -12.991 -3.099 1.00 0.00 H new ATOM 0 HB3 SER B 12 0.195 -11.282 -3.359 1.00 0.00 H new ATOM 0 HG SER B 12 0.370 -13.378 -5.280 1.00 0.00 H new ATOM 866 N ALA B 13 2.933 -12.404 -1.537 1.00 0.00 N ATOM 867 CA ALA B 13 3.397 -12.100 -0.189 1.00 0.00 C ATOM 868 C ALA B 13 4.791 -11.482 -0.205 1.00 0.00 C ATOM 869 O ALA B 13 5.007 -10.404 0.347 1.00 0.00 O ATOM 870 CB ALA B 13 3.387 -13.357 0.666 1.00 0.00 C ATOM 0 H ALA B 13 2.816 -13.399 -1.726 1.00 0.00 H new ATOM 0 HA ALA B 13 2.714 -11.369 0.243 1.00 0.00 H new ATOM 0 HB1 ALA B 13 3.736 -13.117 1.670 1.00 0.00 H new ATOM 0 HB2 ALA B 13 2.373 -13.753 0.719 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.045 -14.104 0.222 1.00 0.00 H new ATOM 876 N ILE B 14 5.735 -12.171 -0.843 1.00 0.00 N ATOM 877 CA ILE B 14 7.111 -11.693 -0.923 1.00 0.00 C ATOM 878 C ILE B 14 7.182 -10.329 -1.607 1.00 0.00 C ATOM 879 O ILE B 14 7.909 -9.440 -1.164 1.00 0.00 O ATOM 880 CB ILE B 14 8.018 -12.694 -1.672 1.00 0.00 C ATOM 881 CG1 ILE B 14 9.479 -12.236 -1.623 1.00 0.00 C ATOM 882 CG2 ILE B 14 7.559 -12.864 -3.113 1.00 0.00 C ATOM 883 CD1 ILE B 14 10.076 -12.263 -0.233 1.00 0.00 C ATOM 0 H ILE B 14 5.571 -13.062 -1.312 1.00 0.00 H new ATOM 0 HA ILE B 14 7.472 -11.596 0.101 1.00 0.00 H new ATOM 0 HB ILE B 14 7.943 -13.661 -1.174 1.00 0.00 H new ATOM 0 HG12 ILE B 14 10.073 -12.874 -2.277 1.00 0.00 H new ATOM 0 HG13 ILE B 14 9.547 -11.223 -2.019 1.00 0.00 H new ATOM 0 HG21 ILE B 14 8.212 -13.573 -3.622 1.00 0.00 H new ATOM 0 HG22 ILE B 14 6.535 -13.239 -3.127 1.00 0.00 H new ATOM 0 HG23 ILE B 14 7.600 -11.902 -3.624 1.00 0.00 H new ATOM 0 HD11 ILE B 14 11.112 -11.926 -0.275 1.00 0.00 H new ATOM 0 HD12 ILE B 14 9.506 -11.603 0.421 1.00 0.00 H new ATOM 0 HD13 ILE B 14 10.041 -13.280 0.158 1.00 0.00 H new ATOM 895 N LEU B 15 6.420 -10.171 -2.685 1.00 0.00 N ATOM 896 CA LEU B 15 6.400 -8.916 -3.426 1.00 0.00 C ATOM 897 C LEU B 15 5.726 -7.813 -2.617 1.00 0.00 C ATOM 898 O LEU B 15 6.027 -6.631 -2.789 1.00 0.00 O ATOM 899 CB LEU B 15 5.681 -9.101 -4.766 1.00 0.00 C ATOM 900 CG LEU B 15 5.606 -7.851 -5.646 1.00 0.00 C ATOM 901 CD1 LEU B 15 7.002 -7.370 -6.013 1.00 0.00 C ATOM 902 CD2 LEU B 15 4.791 -8.133 -6.898 1.00 0.00 C ATOM 0 H LEU B 15 5.810 -10.895 -3.064 1.00 0.00 H new ATOM 0 HA LEU B 15 7.432 -8.619 -3.615 1.00 0.00 H new ATOM 0 HB2 LEU B 15 6.186 -9.889 -5.325 1.00 0.00 H new ATOM 0 HB3 LEU B 15 4.667 -9.449 -4.570 1.00 0.00 H new ATOM 0 HG LEU B 15 5.110 -7.061 -5.082 1.00 0.00 H new ATOM 0 HD11 LEU B 15 6.928 -6.481 -6.639 1.00 0.00 H new ATOM 0 HD12 LEU B 15 7.554 -7.129 -5.105 1.00 0.00 H new ATOM 0 HD13 LEU B 15 7.525 -8.155 -6.559 1.00 0.00 H new ATOM 0 HD21 LEU B 15 4.747 -7.234 -7.513 1.00 0.00 H new ATOM 0 HD22 LEU B 15 5.260 -8.938 -7.464 1.00 0.00 H new ATOM 0 HD23 LEU B 15 3.781 -8.429 -6.615 1.00 0.00 H new ATOM 914 N ALA B 16 4.814 -8.205 -1.733 1.00 0.00 N ATOM 915 CA ALA B 16 4.099 -7.247 -0.898 1.00 0.00 C ATOM 916 C ALA B 16 5.054 -6.521 0.045 1.00 0.00 C ATOM 917 O ALA B 16 4.901 -5.328 0.297 1.00 0.00 O ATOM 918 CB ALA B 16 2.999 -7.943 -0.112 1.00 0.00 C ATOM 0 H ALA B 16 4.553 -9.179 -1.577 1.00 0.00 H new ATOM 0 HA ALA B 16 3.642 -6.504 -1.552 1.00 0.00 H new ATOM 0 HB1 ALA B 16 2.476 -7.213 0.506 1.00 0.00 H new ATOM 0 HB2 ALA B 16 2.294 -8.405 -0.803 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.437 -8.710 0.526 1.00 0.00 H new ATOM 924 N LEU B 17 6.039 -7.249 0.567 1.00 0.00 N ATOM 925 CA LEU B 17 7.018 -6.659 1.474 1.00 0.00 C ATOM 926 C LEU B 17 7.980 -5.759 0.711 1.00 0.00 C ATOM 927 O LEU B 17 8.422 -4.729 1.223 1.00 0.00 O ATOM 928 CB LEU B 17 7.799 -7.749 2.219 1.00 0.00 C ATOM 929 CG LEU B 17 7.085 -8.368 3.428 1.00 0.00 C ATOM 930 CD1 LEU B 17 6.761 -7.304 4.467 1.00 0.00 C ATOM 931 CD2 LEU B 17 5.820 -9.091 2.991 1.00 0.00 C ATOM 0 H LEU B 17 6.179 -8.242 0.379 1.00 0.00 H new ATOM 0 HA LEU B 17 6.478 -6.058 2.206 1.00 0.00 H new ATOM 0 HB2 LEU B 17 8.038 -8.545 1.514 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.746 -7.327 2.556 1.00 0.00 H new ATOM 0 HG LEU B 17 7.757 -9.096 3.883 1.00 0.00 H new ATOM 0 HD11 LEU B 17 6.255 -7.766 5.315 1.00 0.00 H new ATOM 0 HD12 LEU B 17 7.684 -6.834 4.807 1.00 0.00 H new ATOM 0 HD13 LEU B 17 6.111 -6.549 4.024 1.00 0.00 H new ATOM 0 HD21 LEU B 17 5.328 -9.523 3.863 1.00 0.00 H new ATOM 0 HD22 LEU B 17 5.146 -8.384 2.507 1.00 0.00 H new ATOM 0 HD23 LEU B 17 6.078 -9.884 2.290 1.00 0.00 H new ATOM 943 N VAL B 18 8.301 -6.152 -0.518 1.00 0.00 N ATOM 944 CA VAL B 18 9.210 -5.378 -1.356 1.00 0.00 C ATOM 945 C VAL B 18 8.611 -4.019 -1.702 1.00 0.00 C ATOM 946 O VAL B 18 9.309 -3.005 -1.688 1.00 0.00 O ATOM 947 CB VAL B 18 9.552 -6.124 -2.661 1.00 0.00 C ATOM 948 CG1 VAL B 18 10.472 -5.286 -3.537 1.00 0.00 C ATOM 949 CG2 VAL B 18 10.185 -7.473 -2.353 1.00 0.00 C ATOM 0 H VAL B 18 7.945 -7.002 -0.955 1.00 0.00 H new ATOM 0 HA VAL B 18 10.125 -5.236 -0.781 1.00 0.00 H new ATOM 0 HB VAL B 18 8.626 -6.296 -3.210 1.00 0.00 H new ATOM 0 HG11 VAL B 18 10.700 -5.832 -4.452 1.00 0.00 H new ATOM 0 HG12 VAL B 18 9.979 -4.347 -3.788 1.00 0.00 H new ATOM 0 HG13 VAL B 18 11.397 -5.078 -2.999 1.00 0.00 H new ATOM 0 HG21 VAL B 18 10.420 -7.986 -3.286 1.00 0.00 H new ATOM 0 HG22 VAL B 18 11.100 -7.323 -1.781 1.00 0.00 H new ATOM 0 HG23 VAL B 18 9.489 -8.077 -1.772 1.00 0.00 H new ATOM 959 N VAL B 19 7.317 -4.001 -2.007 1.00 0.00 N ATOM 960 CA VAL B 19 6.637 -2.761 -2.358 1.00 0.00 C ATOM 961 C VAL B 19 6.371 -1.907 -1.124 1.00 0.00 C ATOM 962 O VAL B 19 6.497 -0.688 -1.172 1.00 0.00 O ATOM 963 CB VAL B 19 5.308 -3.019 -3.096 1.00 0.00 C ATOM 964 CG1 VAL B 19 5.549 -3.828 -4.360 1.00 0.00 C ATOM 965 CG2 VAL B 19 4.306 -3.721 -2.188 1.00 0.00 C ATOM 0 H VAL B 19 6.721 -4.829 -2.018 1.00 0.00 H new ATOM 0 HA VAL B 19 7.306 -2.223 -3.030 1.00 0.00 H new ATOM 0 HB VAL B 19 4.885 -2.055 -3.380 1.00 0.00 H new ATOM 0 HG11 VAL B 19 4.600 -4.001 -4.868 1.00 0.00 H new ATOM 0 HG12 VAL B 19 6.220 -3.279 -5.021 1.00 0.00 H new ATOM 0 HG13 VAL B 19 6.000 -4.785 -4.099 1.00 0.00 H new ATOM 0 HG21 VAL B 19 3.378 -3.891 -2.733 1.00 0.00 H new ATOM 0 HG22 VAL B 19 4.717 -4.677 -1.864 1.00 0.00 H new ATOM 0 HG23 VAL B 19 4.106 -3.098 -1.316 1.00 0.00 H new ATOM 975 N LEU B 20 6.011 -2.552 -0.016 1.00 0.00 N ATOM 976 CA LEU B 20 5.729 -1.834 1.223 1.00 0.00 C ATOM 977 C LEU B 20 6.948 -1.033 1.669 1.00 0.00 C ATOM 978 O LEU B 20 6.816 0.012 2.306 1.00 0.00 O ATOM 979 CB LEU B 20 5.304 -2.806 2.325 1.00 0.00 C ATOM 980 CG LEU B 20 4.846 -2.148 3.630 1.00 0.00 C ATOM 981 CD1 LEU B 20 3.585 -1.323 3.406 1.00 0.00 C ATOM 982 CD2 LEU B 20 4.610 -3.202 4.701 1.00 0.00 C ATOM 0 H LEU B 20 5.908 -3.565 0.048 1.00 0.00 H new ATOM 0 HA LEU B 20 4.908 -1.142 1.035 1.00 0.00 H new ATOM 0 HB2 LEU B 20 4.494 -3.429 1.946 1.00 0.00 H new ATOM 0 HB3 LEU B 20 6.140 -3.470 2.545 1.00 0.00 H new ATOM 0 HG LEU B 20 5.635 -1.478 3.970 1.00 0.00 H new ATOM 0 HD11 LEU B 20 3.278 -0.865 4.346 1.00 0.00 H new ATOM 0 HD12 LEU B 20 3.786 -0.543 2.671 1.00 0.00 H new ATOM 0 HD13 LEU B 20 2.787 -1.970 3.040 1.00 0.00 H new ATOM 0 HD21 LEU B 20 4.285 -2.718 5.622 1.00 0.00 H new ATOM 0 HD22 LEU B 20 3.840 -3.896 4.365 1.00 0.00 H new ATOM 0 HD23 LEU B 20 5.536 -3.748 4.885 1.00 0.00 H new ATOM 994 N THR B 21 8.134 -1.531 1.330 1.00 0.00 N ATOM 995 CA THR B 21 9.373 -0.854 1.689 1.00 0.00 C ATOM 996 C THR B 21 9.632 0.318 0.750 1.00 0.00 C ATOM 997 O THR B 21 10.067 1.387 1.179 1.00 0.00 O ATOM 998 CB THR B 21 10.578 -1.814 1.640 1.00 0.00 C ATOM 999 OG1 THR B 21 10.333 -2.953 2.472 1.00 0.00 O ATOM 1000 CG2 THR B 21 11.848 -1.110 2.100 1.00 0.00 C ATOM 0 H THR B 21 8.261 -2.398 0.809 1.00 0.00 H new ATOM 0 HA THR B 21 9.257 -0.490 2.710 1.00 0.00 H new ATOM 0 HB THR B 21 10.712 -2.140 0.609 1.00 0.00 H new ATOM 0 HG1 THR B 21 9.695 -3.551 2.029 1.00 0.00 H new ATOM 0 HG21 THR B 21 12.686 -1.806 2.057 1.00 0.00 H new ATOM 0 HG22 THR B 21 12.049 -0.260 1.448 1.00 0.00 H new ATOM 0 HG23 THR B 21 11.719 -0.760 3.124 1.00 0.00 H new ATOM 1008 N ILE B 22 9.357 0.110 -0.534 1.00 0.00 N ATOM 1009 CA ILE B 22 9.556 1.147 -1.537 1.00 0.00 C ATOM 1010 C ILE B 22 8.565 2.289 -1.341 1.00 0.00 C ATOM 1011 O ILE B 22 8.906 3.456 -1.527 1.00 0.00 O ATOM 1012 CB ILE B 22 9.416 0.580 -2.965 1.00 0.00 C ATOM 1013 CG1 ILE B 22 10.494 -0.476 -3.218 1.00 0.00 C ATOM 1014 CG2 ILE B 22 9.508 1.697 -3.998 1.00 0.00 C ATOM 1015 CD1 ILE B 22 10.311 -1.234 -4.514 1.00 0.00 C ATOM 0 H ILE B 22 8.995 -0.769 -0.903 1.00 0.00 H new ATOM 0 HA ILE B 22 10.569 1.529 -1.412 1.00 0.00 H new ATOM 0 HB ILE B 22 8.437 0.111 -3.059 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.470 0.009 -3.226 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.497 -1.185 -2.390 1.00 0.00 H new ATOM 0 HG21 ILE B 22 9.407 1.277 -4.999 1.00 0.00 H new ATOM 0 HG22 ILE B 22 8.710 2.419 -3.825 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.473 2.196 -3.910 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.112 -1.965 -4.624 1.00 0.00 H new ATOM 0 HD12 ILE B 22 9.350 -1.748 -4.502 1.00 0.00 H new ATOM 0 HD13 ILE B 22 10.339 -0.536 -5.351 1.00 0.00 H new ATOM 1027 N ILE B 23 7.337 1.945 -0.962 1.00 0.00 N ATOM 1028 CA ILE B 23 6.304 2.947 -0.735 1.00 0.00 C ATOM 1029 C ILE B 23 6.745 3.930 0.345 1.00 0.00 C ATOM 1030 O ILE B 23 6.564 5.139 0.209 1.00 0.00 O ATOM 1031 CB ILE B 23 4.962 2.305 -0.320 1.00 0.00 C ATOM 1032 CG1 ILE B 23 4.384 1.476 -1.471 1.00 0.00 C ATOM 1033 CG2 ILE B 23 3.972 3.380 0.110 1.00 0.00 C ATOM 1034 CD1 ILE B 23 3.971 2.301 -2.671 1.00 0.00 C ATOM 0 H ILE B 23 7.035 0.983 -0.807 1.00 0.00 H new ATOM 0 HA ILE B 23 6.156 3.474 -1.677 1.00 0.00 H new ATOM 0 HB ILE B 23 5.143 1.641 0.525 1.00 0.00 H new ATOM 0 HG12 ILE B 23 5.125 0.741 -1.785 1.00 0.00 H new ATOM 0 HG13 ILE B 23 3.519 0.921 -1.108 1.00 0.00 H new ATOM 0 HG21 ILE B 23 3.031 2.913 0.400 1.00 0.00 H new ATOM 0 HG22 ILE B 23 4.379 3.932 0.957 1.00 0.00 H new ATOM 0 HG23 ILE B 23 3.797 4.066 -0.719 1.00 0.00 H new ATOM 0 HD11 ILE B 23 3.572 1.644 -3.444 1.00 0.00 H new ATOM 0 HD12 ILE B 23 3.206 3.018 -2.374 1.00 0.00 H new ATOM 0 HD13 ILE B 23 4.837 2.835 -3.061 1.00 0.00 H new ATOM 1046 N SER B 24 7.335 3.398 1.414 1.00 0.00 N ATOM 1047 CA SER B 24 7.802 4.221 2.524 1.00 0.00 C ATOM 1048 C SER B 24 9.057 5.001 2.146 1.00 0.00 C ATOM 1049 O SER B 24 9.255 6.130 2.597 1.00 0.00 O ATOM 1050 CB SER B 24 8.082 3.348 3.750 1.00 0.00 C ATOM 1051 OG SER B 24 9.068 2.370 3.466 1.00 0.00 O ATOM 0 H SER B 24 7.500 2.399 1.533 1.00 0.00 H new ATOM 0 HA SER B 24 7.015 4.936 2.763 1.00 0.00 H new ATOM 0 HB2 SER B 24 8.414 3.974 4.578 1.00 0.00 H new ATOM 0 HB3 SER B 24 7.162 2.859 4.070 1.00 0.00 H new ATOM 0 HG SER B 24 9.211 2.321 2.498 1.00 0.00 H new ATOM 1057 N LEU B 25 9.906 4.394 1.321 1.00 0.00 N ATOM 1058 CA LEU B 25 11.140 5.041 0.887 1.00 0.00 C ATOM 1059 C LEU B 25 10.841 6.295 0.071 1.00 0.00 C ATOM 1060 O LEU B 25 11.515 7.316 0.217 1.00 0.00 O ATOM 1061 CB LEU B 25 11.991 4.070 0.064 1.00 0.00 C ATOM 1062 CG LEU B 25 12.702 2.979 0.870 1.00 0.00 C ATOM 1063 CD1 LEU B 25 13.338 1.960 -0.060 1.00 0.00 C ATOM 1064 CD2 LEU B 25 13.752 3.590 1.787 1.00 0.00 C ATOM 0 H LEU B 25 9.763 3.458 0.941 1.00 0.00 H new ATOM 0 HA LEU B 25 11.698 5.334 1.776 1.00 0.00 H new ATOM 0 HB2 LEU B 25 11.352 3.592 -0.679 1.00 0.00 H new ATOM 0 HB3 LEU B 25 12.741 4.643 -0.482 1.00 0.00 H new ATOM 0 HG LEU B 25 11.961 2.470 1.486 1.00 0.00 H new ATOM 0 HD11 LEU B 25 13.839 1.192 0.530 1.00 0.00 H new ATOM 0 HD12 LEU B 25 12.566 1.499 -0.676 1.00 0.00 H new ATOM 0 HD13 LEU B 25 14.066 2.457 -0.701 1.00 0.00 H new ATOM 0 HD21 LEU B 25 14.246 2.799 2.351 1.00 0.00 H new ATOM 0 HD22 LEU B 25 14.490 4.125 1.189 1.00 0.00 H new ATOM 0 HD23 LEU B 25 13.273 4.284 2.478 1.00 0.00 H new ATOM 1076 N ILE B 26 9.828 6.211 -0.785 1.00 0.00 N ATOM 1077 CA ILE B 26 9.437 7.341 -1.621 1.00 0.00 C ATOM 1078 C ILE B 26 8.969 8.514 -0.768 1.00 0.00 C ATOM 1079 O ILE B 26 9.334 9.662 -1.021 1.00 0.00 O ATOM 1080 CB ILE B 26 8.317 6.949 -2.609 1.00 0.00 C ATOM 1081 CG1 ILE B 26 8.806 5.846 -3.551 1.00 0.00 C ATOM 1082 CG2 ILE B 26 7.854 8.164 -3.402 1.00 0.00 C ATOM 1083 CD1 ILE B 26 7.707 5.239 -4.398 1.00 0.00 C ATOM 0 H ILE B 26 9.263 5.372 -0.918 1.00 0.00 H new ATOM 0 HA ILE B 26 10.318 7.639 -2.189 1.00 0.00 H new ATOM 0 HB ILE B 26 7.468 6.570 -2.040 1.00 0.00 H new ATOM 0 HG12 ILE B 26 9.575 6.255 -4.207 1.00 0.00 H new ATOM 0 HG13 ILE B 26 9.276 5.058 -2.962 1.00 0.00 H new ATOM 0 HG21 ILE B 26 7.065 7.868 -4.093 1.00 0.00 H new ATOM 0 HG22 ILE B 26 7.472 8.921 -2.717 1.00 0.00 H new ATOM 0 HG23 ILE B 26 8.694 8.573 -3.964 1.00 0.00 H new ATOM 0 HD11 ILE B 26 8.128 4.465 -5.040 1.00 0.00 H new ATOM 0 HD12 ILE B 26 6.949 4.800 -3.750 1.00 0.00 H new ATOM 0 HD13 ILE B 26 7.252 6.014 -5.015 1.00 0.00 H new ATOM 1095 N ILE B 27 8.162 8.218 0.246 1.00 0.00 N ATOM 1096 CA ILE B 27 7.645 9.249 1.140 1.00 0.00 C ATOM 1097 C ILE B 27 8.762 9.857 1.981 1.00 0.00 C ATOM 1098 O ILE B 27 8.769 11.060 2.249 1.00 0.00 O ATOM 1099 CB ILE B 27 6.562 8.688 2.082 1.00 0.00 C ATOM 1100 CG1 ILE B 27 5.480 7.951 1.283 1.00 0.00 C ATOM 1101 CG2 ILE B 27 5.951 9.806 2.915 1.00 0.00 C ATOM 1102 CD1 ILE B 27 4.789 8.810 0.246 1.00 0.00 C ATOM 0 H ILE B 27 7.852 7.272 0.469 1.00 0.00 H new ATOM 0 HA ILE B 27 7.204 10.020 0.508 1.00 0.00 H new ATOM 0 HB ILE B 27 7.030 7.973 2.759 1.00 0.00 H new ATOM 0 HG12 ILE B 27 5.931 7.092 0.786 1.00 0.00 H new ATOM 0 HG13 ILE B 27 4.733 7.563 1.975 1.00 0.00 H new ATOM 0 HG21 ILE B 27 5.188 9.393 3.575 1.00 0.00 H new ATOM 0 HG22 ILE B 27 6.729 10.281 3.513 1.00 0.00 H new ATOM 0 HG23 ILE B 27 5.498 10.546 2.255 1.00 0.00 H new ATOM 0 HD11 ILE B 27 4.038 8.217 -0.276 1.00 0.00 H new ATOM 0 HD12 ILE B 27 4.307 9.655 0.737 1.00 0.00 H new ATOM 0 HD13 ILE B 27 5.524 9.177 -0.470 1.00 0.00 H new ATOM 1114 N LEU B 28 9.704 9.015 2.394 1.00 0.00 N ATOM 1115 CA LEU B 28 10.830 9.460 3.208 1.00 0.00 C ATOM 1116 C LEU B 28 11.638 10.534 2.486 1.00 0.00 C ATOM 1117 O LEU B 28 11.869 11.618 3.022 1.00 0.00 O ATOM 1118 CB LEU B 28 11.732 8.271 3.555 1.00 0.00 C ATOM 1119 CG LEU B 28 12.944 8.601 4.430 1.00 0.00 C ATOM 1120 CD1 LEU B 28 12.500 9.085 5.801 1.00 0.00 C ATOM 1121 CD2 LEU B 28 13.851 7.386 4.562 1.00 0.00 C ATOM 0 H LEU B 28 9.710 8.018 2.178 1.00 0.00 H new ATOM 0 HA LEU B 28 10.434 9.891 4.128 1.00 0.00 H new ATOM 0 HB2 LEU B 28 11.131 7.517 4.065 1.00 0.00 H new ATOM 0 HB3 LEU B 28 12.086 7.822 2.627 1.00 0.00 H new ATOM 0 HG LEU B 28 13.506 9.402 3.950 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.376 9.314 6.407 1.00 0.00 H new ATOM 0 HD12 LEU B 28 11.891 9.982 5.690 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.914 8.306 6.290 1.00 0.00 H new ATOM 0 HD21 LEU B 28 14.708 7.638 5.187 1.00 0.00 H new ATOM 0 HD22 LEU B 28 13.297 6.566 5.019 1.00 0.00 H new ATOM 0 HD23 LEU B 28 14.199 7.083 3.575 1.00 0.00 H new ATOM 1133 N ILE B 29 12.062 10.227 1.265 1.00 0.00 N ATOM 1134 CA ILE B 29 12.848 11.161 0.465 1.00 0.00 C ATOM 1135 C ILE B 29 12.010 12.361 0.035 1.00 0.00 C ATOM 1136 O ILE B 29 12.517 13.478 -0.070 1.00 0.00 O ATOM 1137 CB ILE B 29 13.426 10.474 -0.787 1.00 0.00 C ATOM 1138 CG1 ILE B 29 14.239 9.240 -0.382 1.00 0.00 C ATOM 1139 CG2 ILE B 29 14.287 11.447 -1.580 1.00 0.00 C ATOM 1140 CD1 ILE B 29 14.703 8.405 -1.556 1.00 0.00 C ATOM 0 H ILE B 29 11.874 9.336 0.806 1.00 0.00 H new ATOM 0 HA ILE B 29 13.669 11.506 1.094 1.00 0.00 H new ATOM 0 HB ILE B 29 12.601 10.154 -1.423 1.00 0.00 H new ATOM 0 HG12 ILE B 29 15.109 9.561 0.191 1.00 0.00 H new ATOM 0 HG13 ILE B 29 13.634 8.618 0.278 1.00 0.00 H new ATOM 0 HG21 ILE B 29 14.687 10.945 -2.461 1.00 0.00 H new ATOM 0 HG22 ILE B 29 13.682 12.298 -1.891 1.00 0.00 H new ATOM 0 HG23 ILE B 29 15.110 11.796 -0.956 1.00 0.00 H new ATOM 0 HD11 ILE B 29 15.272 7.549 -1.192 1.00 0.00 H new ATOM 0 HD12 ILE B 29 13.837 8.053 -2.117 1.00 0.00 H new ATOM 0 HD13 ILE B 29 15.335 9.010 -2.206 1.00 0.00 H new ATOM 1152 N MET B 30 10.725 12.125 -0.214 1.00 0.00 N ATOM 1153 CA MET B 30 9.818 13.187 -0.630 1.00 0.00 C ATOM 1154 C MET B 30 9.763 14.296 0.416 1.00 0.00 C ATOM 1155 O MET B 30 9.746 15.480 0.081 1.00 0.00 O ATOM 1156 CB MET B 30 8.415 12.623 -0.870 1.00 0.00 C ATOM 1157 CG MET B 30 7.435 13.644 -1.427 1.00 0.00 C ATOM 1158 SD MET B 30 5.799 12.945 -1.723 1.00 0.00 S ATOM 1159 CE MET B 30 5.325 12.471 -0.063 1.00 0.00 C ATOM 0 H MET B 30 10.289 11.206 -0.134 1.00 0.00 H new ATOM 0 HA MET B 30 10.195 13.610 -1.561 1.00 0.00 H new ATOM 0 HB2 MET B 30 8.484 11.783 -1.561 1.00 0.00 H new ATOM 0 HB3 MET B 30 8.024 12.232 0.069 1.00 0.00 H new ATOM 0 HG2 MET B 30 7.349 14.478 -0.730 1.00 0.00 H new ATOM 0 HG3 MET B 30 7.828 14.048 -2.360 1.00 0.00 H new ATOM 0 HE1 MET B 30 4.245 12.566 0.048 1.00 0.00 H new ATOM 0 HE2 MET B 30 5.619 11.437 0.118 1.00 0.00 H new ATOM 0 HE3 MET B 30 5.822 13.121 0.657 1.00 0.00 H new ATOM 1169 N LEU B 31 9.735 13.901 1.685 1.00 0.00 N ATOM 1170 CA LEU B 31 9.684 14.858 2.785 1.00 0.00 C ATOM 1171 C LEU B 31 11.078 15.390 3.108 1.00 0.00 C ATOM 1172 O LEU B 31 11.225 16.484 3.651 1.00 0.00 O ATOM 1173 CB LEU B 31 9.072 14.205 4.028 1.00 0.00 C ATOM 1174 CG LEU B 31 8.924 15.123 5.242 1.00 0.00 C ATOM 1175 CD1 LEU B 31 7.898 16.213 4.969 1.00 0.00 C ATOM 1176 CD2 LEU B 31 8.536 14.320 6.475 1.00 0.00 C ATOM 0 H LEU B 31 9.747 12.924 1.977 1.00 0.00 H new ATOM 0 HA LEU B 31 9.058 15.696 2.478 1.00 0.00 H new ATOM 0 HB2 LEU B 31 8.089 13.815 3.766 1.00 0.00 H new ATOM 0 HB3 LEU B 31 9.689 13.352 4.311 1.00 0.00 H new ATOM 0 HG LEU B 31 9.886 15.599 5.430 1.00 0.00 H new ATOM 0 HD11 LEU B 31 7.808 16.855 5.845 1.00 0.00 H new ATOM 0 HD12 LEU B 31 8.218 16.808 4.114 1.00 0.00 H new ATOM 0 HD13 LEU B 31 6.932 15.757 4.752 1.00 0.00 H new ATOM 0 HD21 LEU B 31 8.435 14.990 7.329 1.00 0.00 H new ATOM 0 HD22 LEU B 31 7.587 13.815 6.296 1.00 0.00 H new ATOM 0 HD23 LEU B 31 9.308 13.579 6.684 1.00 0.00 H new ATOM 1188 N TRP B 32 12.097 14.605 2.769 1.00 0.00 N ATOM 1189 CA TRP B 32 13.479 14.993 3.023 1.00 0.00 C ATOM 1190 C TRP B 32 13.886 16.173 2.146 1.00 0.00 C ATOM 1191 O TRP B 32 14.680 17.020 2.558 1.00 0.00 O ATOM 1192 CB TRP B 32 14.415 13.805 2.773 1.00 0.00 C ATOM 1193 CG TRP B 32 15.863 14.127 2.995 1.00 0.00 C ATOM 1194 CD1 TRP B 32 16.439 14.559 4.155 1.00 0.00 C ATOM 1195 CD2 TRP B 32 16.919 14.037 2.030 1.00 0.00 C ATOM 1196 NE1 TRP B 32 17.787 14.746 3.970 1.00 0.00 N ATOM 1197 CE2 TRP B 32 18.107 14.432 2.675 1.00 0.00 C ATOM 1198 CE3 TRP B 32 16.977 13.661 0.684 1.00 0.00 C ATOM 1199 CZ2 TRP B 32 19.336 14.462 2.021 1.00 0.00 C ATOM 1200 CZ3 TRP B 32 18.198 13.690 0.036 1.00 0.00 C ATOM 1201 CH2 TRP B 32 19.363 14.089 0.705 1.00 0.00 C ATOM 0 H TRP B 32 11.990 13.696 2.318 1.00 0.00 H new ATOM 0 HA TRP B 32 13.560 15.299 4.066 1.00 0.00 H new ATOM 0 HB2 TRP B 32 14.129 12.983 3.429 1.00 0.00 H new ATOM 0 HB3 TRP B 32 14.281 13.457 1.749 1.00 0.00 H new ATOM 0 HD1 TRP B 32 15.912 14.729 5.082 1.00 0.00 H new ATOM 0 HE1 TRP B 32 18.444 15.067 4.681 1.00 0.00 H new ATOM 0 HE3 TRP B 32 16.084 13.354 0.160 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 20.235 14.769 2.534 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 18.255 13.400 -1.003 1.00 0.00 H new ATOM 0 HH2 TRP B 32 20.301 14.102 0.171 1.00 0.00 H new ATOM 1212 N GLN B 33 13.336 16.227 0.936 1.00 0.00 N ATOM 1213 CA GLN B 33 13.645 17.306 0.003 1.00 0.00 C ATOM 1214 C GLN B 33 12.543 18.363 0.006 1.00 0.00 C ATOM 1215 O GLN B 33 12.522 19.249 -0.849 1.00 0.00 O ATOM 1216 CB GLN B 33 13.836 16.751 -1.410 1.00 0.00 C ATOM 1217 CG GLN B 33 14.901 15.669 -1.500 1.00 0.00 C ATOM 1218 CD GLN B 33 15.222 15.281 -2.931 1.00 0.00 C ATOM 1219 OE1 GLN B 33 16.119 15.849 -3.553 1.00 0.00 O ATOM 1220 NE2 GLN B 33 14.487 14.311 -3.461 1.00 0.00 N ATOM 0 H GLN B 33 12.675 15.537 0.579 1.00 0.00 H new ATOM 0 HA GLN B 33 14.573 17.776 0.327 1.00 0.00 H new ATOM 0 HB2 GLN B 33 12.888 16.346 -1.764 1.00 0.00 H new ATOM 0 HB3 GLN B 33 14.103 17.569 -2.080 1.00 0.00 H new ATOM 0 HG2 GLN B 33 15.810 16.018 -1.010 1.00 0.00 H new ATOM 0 HG3 GLN B 33 14.564 14.787 -0.956 1.00 0.00 H new ATOM 0 HE21 GLN B 33 13.753 13.867 -2.909 1.00 0.00 H new ATOM 0 HE22 GLN B 33 14.656 14.009 -4.421 1.00 0.00 H new ATOM 1229 N LYS B 34 11.631 18.262 0.969 1.00 0.00 N ATOM 1230 CA LYS B 34 10.527 19.211 1.085 1.00 0.00 C ATOM 1231 C LYS B 34 11.048 20.642 1.202 1.00 0.00 C ATOM 1232 O LYS B 34 10.475 21.568 0.630 1.00 0.00 O ATOM 1233 CB LYS B 34 9.659 18.873 2.301 1.00 0.00 C ATOM 1234 CG LYS B 34 8.524 19.859 2.535 1.00 0.00 C ATOM 1235 CD LYS B 34 7.807 19.581 3.847 1.00 0.00 C ATOM 1236 CE LYS B 34 6.742 20.629 4.132 1.00 0.00 C ATOM 1237 NZ LYS B 34 7.314 22.002 4.190 1.00 0.00 N ATOM 0 H LYS B 34 11.635 17.532 1.681 1.00 0.00 H new ATOM 0 HA LYS B 34 9.921 19.135 0.182 1.00 0.00 H new ATOM 0 HB2 LYS B 34 9.241 17.875 2.171 1.00 0.00 H new ATOM 0 HB3 LYS B 34 10.290 18.841 3.189 1.00 0.00 H new ATOM 0 HG2 LYS B 34 8.919 20.875 2.543 1.00 0.00 H new ATOM 0 HG3 LYS B 34 7.813 19.800 1.711 1.00 0.00 H new ATOM 0 HD2 LYS B 34 7.347 18.594 3.809 1.00 0.00 H new ATOM 0 HD3 LYS B 34 8.530 19.565 4.662 1.00 0.00 H new ATOM 0 HE2 LYS B 34 5.976 20.588 3.358 1.00 0.00 H new ATOM 0 HE3 LYS B 34 6.252 20.400 5.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 6.647 22.636 4.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 8.213 21.982 4.712 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 7.482 22.349 3.224 1.00 0.00 H new ATOM 1251 N LYS B 35 12.136 20.812 1.948 1.00 0.00 N ATOM 1252 CA LYS B 35 12.731 22.128 2.142 1.00 0.00 C ATOM 1253 C LYS B 35 13.370 22.638 0.849 1.00 0.00 C ATOM 1254 O LYS B 35 14.298 22.019 0.327 1.00 0.00 O ATOM 1255 CB LYS B 35 13.780 22.077 3.256 1.00 0.00 C ATOM 1256 CG LYS B 35 13.192 21.784 4.629 1.00 0.00 C ATOM 1257 CD LYS B 35 12.236 22.880 5.073 1.00 0.00 C ATOM 1258 CE LYS B 35 11.646 22.583 6.442 1.00 0.00 C ATOM 1259 NZ LYS B 35 12.700 22.475 7.487 1.00 0.00 N ATOM 0 H LYS B 35 12.622 20.054 2.427 1.00 0.00 H new ATOM 0 HA LYS B 35 11.937 22.817 2.429 1.00 0.00 H new ATOM 0 HB2 LYS B 35 14.518 21.312 3.015 1.00 0.00 H new ATOM 0 HB3 LYS B 35 14.308 23.030 3.291 1.00 0.00 H new ATOM 0 HG2 LYS B 35 12.666 20.830 4.604 1.00 0.00 H new ATOM 0 HG3 LYS B 35 13.997 21.686 5.357 1.00 0.00 H new ATOM 0 HD2 LYS B 35 12.762 23.834 5.102 1.00 0.00 H new ATOM 0 HD3 LYS B 35 11.433 22.981 4.343 1.00 0.00 H new ATOM 0 HE2 LYS B 35 10.944 23.371 6.714 1.00 0.00 H new ATOM 0 HE3 LYS B 35 11.080 21.653 6.400 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 12.260 22.510 8.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 13.208 21.575 7.375 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 13.369 23.265 7.388 1.00 0.00 H new ATOM 1273 N PRO B 36 12.883 23.774 0.311 1.00 0.00 N ATOM 1274 CA PRO B 36 13.421 24.351 -0.925 1.00 0.00 C ATOM 1275 C PRO B 36 14.886 24.746 -0.782 1.00 0.00 C ATOM 1276 O PRO B 36 15.292 25.302 0.239 1.00 0.00 O ATOM 1277 CB PRO B 36 12.557 25.596 -1.160 1.00 0.00 C ATOM 1278 CG PRO B 36 11.337 25.388 -0.331 1.00 0.00 C ATOM 1279 CD PRO B 36 11.779 24.582 0.855 1.00 0.00 C ATOM 0 HA PRO B 36 13.388 23.638 -1.749 1.00 0.00 H new ATOM 0 HB2 PRO B 36 13.084 26.503 -0.864 1.00 0.00 H new ATOM 0 HB3 PRO B 36 12.303 25.705 -2.214 1.00 0.00 H new ATOM 0 HG2 PRO B 36 10.910 26.341 -0.019 1.00 0.00 H new ATOM 0 HG3 PRO B 36 10.566 24.863 -0.895 1.00 0.00 H new ATOM 0 HD2 PRO B 36 12.111 25.219 1.675 1.00 0.00 H new ATOM 0 HD3 PRO B 36 10.974 23.957 1.242 1.00 0.00 H new ATOM 1287 N ARG B 37 15.676 24.454 -1.810 1.00 0.00 N ATOM 1288 CA ARG B 37 17.097 24.784 -1.797 1.00 0.00 C ATOM 1289 C ARG B 37 17.489 25.530 -3.066 1.00 0.00 C ATOM 1290 O ARG B 37 17.022 25.208 -4.158 1.00 0.00 O ATOM 1291 CB ARG B 37 17.936 23.515 -1.653 1.00 0.00 C ATOM 1292 CG ARG B 37 17.618 22.720 -0.399 1.00 0.00 C ATOM 1293 CD ARG B 37 18.501 21.491 -0.281 1.00 0.00 C ATOM 1294 NE ARG B 37 18.380 20.616 -1.445 1.00 0.00 N ATOM 1295 CZ ARG B 37 19.165 19.568 -1.663 1.00 0.00 C ATOM 1296 NH1 ARG B 37 20.123 19.260 -0.798 1.00 0.00 N ATOM 1297 NH2 ARG B 37 18.996 18.823 -2.749 1.00 0.00 N ATOM 0 H ARG B 37 15.357 23.991 -2.661 1.00 0.00 H new ATOM 0 HA ARG B 37 17.289 25.432 -0.942 1.00 0.00 H new ATOM 0 HB2 ARG B 37 17.776 22.882 -2.526 1.00 0.00 H new ATOM 0 HB3 ARG B 37 18.992 23.786 -1.645 1.00 0.00 H new ATOM 0 HG2 ARG B 37 17.754 23.352 0.478 1.00 0.00 H new ATOM 0 HG3 ARG B 37 16.571 22.417 -0.415 1.00 0.00 H new ATOM 0 HD2 ARG B 37 19.540 21.801 -0.167 1.00 0.00 H new ATOM 0 HD3 ARG B 37 18.233 20.937 0.618 1.00 0.00 H new ATOM 0 HE ARG B 37 17.651 20.822 -2.128 1.00 0.00 H new ATOM 0 HH11 ARG B 37 20.258 19.829 0.038 1.00 0.00 H new ATOM 0 HH12 ARG B 37 20.724 18.454 -0.969 1.00 0.00 H new ATOM 0 HH21 ARG B 37 18.262 19.056 -3.418 1.00 0.00 H new ATOM 0 HH22 ARG B 37 19.600 18.018 -2.914 1.00 0.00 H new ATOM 1311 N TYR B 38 18.350 26.528 -2.914 1.00 0.00 N ATOM 1312 CA TYR B 38 18.804 27.326 -4.046 1.00 0.00 C ATOM 1313 C TYR B 38 20.300 27.140 -4.277 1.00 0.00 C ATOM 1314 O TYR B 38 21.087 27.121 -3.331 1.00 0.00 O ATOM 1315 CB TYR B 38 18.490 28.803 -3.810 1.00 0.00 C ATOM 1316 CG TYR B 38 17.021 29.083 -3.579 1.00 0.00 C ATOM 1317 CD1 TYR B 38 16.441 28.876 -2.333 1.00 0.00 C ATOM 1318 CD2 TYR B 38 16.213 29.555 -4.607 1.00 0.00 C ATOM 1319 CE1 TYR B 38 15.100 29.131 -2.119 1.00 0.00 C ATOM 1320 CE2 TYR B 38 14.872 29.813 -4.400 1.00 0.00 C ATOM 1321 CZ TYR B 38 14.319 29.599 -3.155 1.00 0.00 C ATOM 1322 OH TYR B 38 12.984 29.854 -2.945 1.00 0.00 O ATOM 0 H TYR B 38 18.749 26.805 -2.017 1.00 0.00 H new ATOM 0 HA TYR B 38 18.274 26.987 -4.936 1.00 0.00 H new ATOM 0 HB2 TYR B 38 19.057 29.153 -2.948 1.00 0.00 H new ATOM 0 HB3 TYR B 38 18.830 29.380 -4.670 1.00 0.00 H new ATOM 0 HD1 TYR B 38 17.049 28.510 -1.519 1.00 0.00 H new ATOM 0 HD2 TYR B 38 16.641 29.723 -5.584 1.00 0.00 H new ATOM 0 HE1 TYR B 38 14.665 28.965 -1.145 1.00 0.00 H new ATOM 0 HE2 TYR B 38 14.259 30.181 -5.210 1.00 0.00 H new ATOM 0 HH TYR B 38 12.578 30.179 -3.776 1.00 0.00 H new ATOM 1332 N GLU B 39 20.685 26.999 -5.541 1.00 0.00 N ATOM 1333 CA GLU B 39 22.086 26.815 -5.898 1.00 0.00 C ATOM 1334 C GLU B 39 22.767 28.159 -6.136 1.00 0.00 C ATOM 1335 O GLU B 39 23.836 28.396 -5.533 1.00 0.00 O ATOM 1336 CB GLU B 39 22.205 25.938 -7.144 1.00 0.00 C ATOM 1337 CG GLU B 39 21.598 24.555 -6.972 1.00 0.00 C ATOM 1338 CD GLU B 39 22.248 23.770 -5.849 1.00 0.00 C ATOM 1339 OE1 GLU B 39 23.281 23.115 -6.103 1.00 0.00 O ATOM 1340 OE2 GLU B 39 21.723 23.811 -4.716 1.00 0.00 O ATOM 1341 OXT GLU B 39 22.229 28.967 -6.925 1.00 0.00 O ATOM 0 H GLU B 39 20.045 27.009 -6.336 1.00 0.00 H new ATOM 0 HA GLU B 39 22.586 26.319 -5.066 1.00 0.00 H new ATOM 0 HB2 GLU B 39 21.716 26.439 -7.979 1.00 0.00 H new ATOM 0 HB3 GLU B 39 23.258 25.834 -7.406 1.00 0.00 H new ATOM 0 HG2 GLU B 39 20.531 24.653 -6.772 1.00 0.00 H new ATOM 0 HG3 GLU B 39 21.698 23.999 -7.904 1.00 0.00 H new TER 1348 GLU B 39