USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 928 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: E 17 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: E 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: D 31 ASN : amide:sc= -0.236 K(o=-0.41,f=-3.8!) USER MOD Set 2.2: D 35 HIS : no HD1:sc= -0.176 X(o=-0.41,f=-0.83) USER MOD Single : D 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 6 THR OG1 : rot 180:sc= 0.0105 USER MOD Single : D 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 10 TYR OH : rot 140:sc= 0.0762 USER MOD Single : D 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 16 GLN : amide:sc= -0.0548 X(o=-0.055,f=0) USER MOD Single : D 17 THR OG1 : rot 180:sc= 0.0547 USER MOD Single : D 18 LYS NZ :NH3+ 167:sc= 0.774 (180deg=0.188) USER MOD Single : D 19 THR OG1 : rot -63:sc= 1.21 USER MOD Single : D 21 LYS NZ :NH3+ -144:sc= -0.452 (180deg=-1.94!) USER MOD Single : D 26 TYR OH : rot 180:sc= 0 USER MOD Single : D 27 GLN : amide:sc= -0.158 K(o=-0.16,f=-1.5!) USER MOD Single : D 28 SER OG : rot 180:sc= 0 USER MOD Single : D 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 43 THR OG1 : rot 25:sc= -4.36 USER MOD Single : D 45 ASN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : D 49 SER OG : rot 180:sc= 0 USER MOD Single : D 51 TYR OH : rot -135:sc= 0.00682 USER MOD Single : D 56 LYS NZ :NH3+ -160:sc= -0.0229 (180deg=-0.656) USER MOD Single : E 3 GLN : amide:sc= -0.107 K(o=-0.11,f=-2.4!) USER MOD Single : E 6 THR OG1 : rot 94:sc= 0.0156 USER MOD Single : E 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 10 TYR OH : rot 180:sc= 0 USER MOD Single : E 12 MET CE :methyl -149:sc=-6.89e-05 (180deg=-1.43) USER MOD Single : E 16 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.1) USER MOD Single : E 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 19 THR OG1 : rot -30:sc= -3.31! USER MOD Single : E 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 26 TYR OH : rot 180:sc= 0 USER MOD Single : E 28 SER OG : rot 180:sc= 0 USER MOD Single : E 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : E 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 35 HIS : no HD1:sc= -0.312 X(o=-0.31,f=-0.11) USER MOD Single : E 39 LYS NZ :NH3+ -146:sc= -0.0233 (180deg=-0.0967) USER MOD Single : E 43 THR OG1 : rot 180:sc= 0 USER MOD Single : E 45 ASN : amide:sc= -0.69 K(o=-0.69,f=-2.8!) USER MOD Single : E 49 SER OG : rot 180:sc= 0 USER MOD Single : E 51 TYR OH : rot 180:sc= 0 USER MOD Single : E 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU D 2 -20.189 16.786 -7.566 1.00 0.00 N ATOM 21 CA GLU D 2 -20.352 16.395 -8.994 1.00 0.00 C ATOM 22 C GLU D 2 -20.787 14.930 -9.073 1.00 0.00 C ATOM 23 O GLU D 2 -20.975 14.274 -8.068 1.00 0.00 O ATOM 24 CB GLU D 2 -19.018 16.573 -9.724 1.00 0.00 C ATOM 25 CG GLU D 2 -19.268 17.193 -11.099 1.00 0.00 C ATOM 26 CD GLU D 2 -18.457 18.483 -11.230 1.00 0.00 C ATOM 27 OE1 GLU D 2 -18.861 19.474 -10.645 1.00 0.00 O ATOM 28 OE2 GLU D 2 -17.446 18.458 -11.913 1.00 0.00 O ATOM 0 HA GLU D 2 -21.109 17.024 -9.462 1.00 0.00 H new ATOM 0 HB2 GLU D 2 -18.354 17.211 -9.141 1.00 0.00 H new ATOM 0 HB3 GLU D 2 -18.519 15.610 -9.833 1.00 0.00 H new ATOM 0 HG2 GLU D 2 -18.985 16.491 -11.883 1.00 0.00 H new ATOM 0 HG3 GLU D 2 -20.330 17.403 -11.228 1.00 0.00 H new ATOM 35 N GLN D 3 -20.949 14.412 -10.260 1.00 0.00 N ATOM 36 CA GLN D 3 -21.372 12.989 -10.398 1.00 0.00 C ATOM 37 C GLN D 3 -20.140 12.084 -10.359 1.00 0.00 C ATOM 38 O GLN D 3 -19.719 11.546 -11.365 1.00 0.00 O ATOM 39 CB GLN D 3 -22.104 12.798 -11.730 1.00 0.00 C ATOM 40 CG GLN D 3 -23.045 13.980 -11.972 1.00 0.00 C ATOM 41 CD GLN D 3 -24.266 13.857 -11.060 1.00 0.00 C ATOM 42 OE1 GLN D 3 -25.201 13.144 -11.368 1.00 0.00 O ATOM 43 NE2 GLN D 3 -24.300 14.526 -9.940 1.00 0.00 N ATOM 0 H GLN D 3 -20.807 14.911 -11.138 1.00 0.00 H new ATOM 0 HA GLN D 3 -22.040 12.729 -9.577 1.00 0.00 H new ATOM 0 HB2 GLN D 3 -21.384 12.721 -12.545 1.00 0.00 H new ATOM 0 HB3 GLN D 3 -22.670 11.867 -11.715 1.00 0.00 H new ATOM 0 HG2 GLN D 3 -22.525 14.918 -11.776 1.00 0.00 H new ATOM 0 HG3 GLN D 3 -23.358 14.001 -13.016 1.00 0.00 H new ATOM 0 HE21 GLN D 3 -23.516 15.125 -9.680 1.00 0.00 H new ATOM 0 HE22 GLN D 3 -25.110 14.450 -9.325 1.00 0.00 H new ATOM 52 N ARG D 4 -19.556 11.912 -9.203 1.00 0.00 N ATOM 53 CA ARG D 4 -18.351 11.044 -9.099 1.00 0.00 C ATOM 54 C ARG D 4 -18.714 9.746 -8.373 1.00 0.00 C ATOM 55 O ARG D 4 -19.134 9.755 -7.233 1.00 0.00 O ATOM 56 CB ARG D 4 -17.260 11.777 -8.315 1.00 0.00 C ATOM 57 CG ARG D 4 -16.560 12.779 -9.235 1.00 0.00 C ATOM 58 CD ARG D 4 -15.564 12.037 -10.128 1.00 0.00 C ATOM 59 NE ARG D 4 -14.206 12.100 -9.518 1.00 0.00 N ATOM 60 CZ ARG D 4 -13.148 12.070 -10.280 1.00 0.00 C ATOM 61 NH1 ARG D 4 -12.653 10.926 -10.664 1.00 0.00 N ATOM 62 NH2 ARG D 4 -12.587 13.185 -10.658 1.00 0.00 N ATOM 0 H ARG D 4 -19.863 12.336 -8.327 1.00 0.00 H new ATOM 0 HA ARG D 4 -17.987 10.810 -10.099 1.00 0.00 H new ATOM 0 HB2 ARG D 4 -17.696 12.294 -7.460 1.00 0.00 H new ATOM 0 HB3 ARG D 4 -16.538 11.062 -7.921 1.00 0.00 H new ATOM 0 HG2 ARG D 4 -17.294 13.303 -9.847 1.00 0.00 H new ATOM 0 HG3 ARG D 4 -16.043 13.534 -8.643 1.00 0.00 H new ATOM 0 HD2 ARG D 4 -15.872 10.998 -10.249 1.00 0.00 H new ATOM 0 HD3 ARG D 4 -15.549 12.483 -11.122 1.00 0.00 H new ATOM 0 HE ARG D 4 -14.104 12.167 -8.505 1.00 0.00 H new ATOM 0 HH11 ARG D 4 -13.093 10.055 -10.368 1.00 0.00 H new ATOM 0 HH12 ARG D 4 -11.826 10.903 -11.260 1.00 0.00 H new ATOM 0 HH21 ARG D 4 -12.976 14.079 -10.358 1.00 0.00 H new ATOM 0 HH22 ARG D 4 -11.759 13.163 -11.254 1.00 0.00 H new ATOM 76 N ILE D 5 -18.550 8.628 -9.026 1.00 0.00 N ATOM 77 CA ILE D 5 -18.879 7.326 -8.380 1.00 0.00 C ATOM 78 C ILE D 5 -18.026 6.224 -9.011 1.00 0.00 C ATOM 79 O ILE D 5 -17.809 6.203 -10.206 1.00 0.00 O ATOM 80 CB ILE D 5 -20.359 7.009 -8.591 1.00 0.00 C ATOM 81 CG1 ILE D 5 -21.214 8.039 -7.848 1.00 0.00 C ATOM 82 CG2 ILE D 5 -20.663 5.611 -8.052 1.00 0.00 C ATOM 83 CD1 ILE D 5 -21.477 9.240 -8.759 1.00 0.00 C ATOM 0 H ILE D 5 -18.201 8.560 -9.982 1.00 0.00 H new ATOM 0 HA ILE D 5 -18.673 7.385 -7.311 1.00 0.00 H new ATOM 0 HB ILE D 5 -20.589 7.046 -9.656 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -22.158 7.589 -7.541 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -20.705 8.363 -6.940 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -21.719 5.385 -8.202 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -20.055 4.877 -8.581 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -20.432 5.573 -6.987 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -22.086 9.972 -8.229 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -20.528 9.695 -9.044 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -22.004 8.909 -9.654 1.00 0.00 H new ATOM 95 N THR D 6 -17.542 5.306 -8.220 1.00 0.00 N ATOM 96 CA THR D 6 -16.704 4.208 -8.780 1.00 0.00 C ATOM 97 C THR D 6 -17.536 3.382 -9.765 1.00 0.00 C ATOM 98 O THR D 6 -18.747 3.349 -9.691 1.00 0.00 O ATOM 99 CB THR D 6 -16.215 3.310 -7.640 1.00 0.00 C ATOM 100 OG1 THR D 6 -15.892 4.114 -6.514 1.00 0.00 O ATOM 101 CG2 THR D 6 -14.974 2.535 -8.087 1.00 0.00 C ATOM 0 H THR D 6 -17.690 5.269 -7.212 1.00 0.00 H new ATOM 0 HA THR D 6 -15.846 4.633 -9.301 1.00 0.00 H new ATOM 0 HB THR D 6 -17.001 2.604 -7.373 1.00 0.00 H new ATOM 0 HG1 THR D 6 -15.580 3.542 -5.782 1.00 0.00 H new ATOM 0 HG21 THR D 6 -14.630 1.898 -7.272 1.00 0.00 H new ATOM 0 HG22 THR D 6 -15.222 1.918 -8.951 1.00 0.00 H new ATOM 0 HG23 THR D 6 -14.185 3.236 -8.357 1.00 0.00 H new ATOM 109 N LEU D 7 -16.895 2.716 -10.685 1.00 0.00 N ATOM 110 CA LEU D 7 -17.640 1.892 -11.677 1.00 0.00 C ATOM 111 C LEU D 7 -18.444 0.817 -10.945 1.00 0.00 C ATOM 112 O LEU D 7 -19.330 0.200 -11.503 1.00 0.00 O ATOM 113 CB LEU D 7 -16.638 1.225 -12.625 1.00 0.00 C ATOM 114 CG LEU D 7 -17.357 0.197 -13.500 1.00 0.00 C ATOM 115 CD1 LEU D 7 -18.509 0.872 -14.243 1.00 0.00 C ATOM 116 CD2 LEU D 7 -16.370 -0.383 -14.517 1.00 0.00 C ATOM 0 H LEU D 7 -15.881 2.707 -10.793 1.00 0.00 H new ATOM 0 HA LEU D 7 -18.320 2.525 -12.246 1.00 0.00 H new ATOM 0 HB2 LEU D 7 -16.160 1.978 -13.251 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -15.849 0.739 -12.051 1.00 0.00 H new ATOM 0 HG LEU D 7 -17.749 -0.602 -12.871 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -19.020 0.138 -14.866 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -19.212 1.289 -13.522 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -18.118 1.672 -14.872 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -16.880 -1.116 -15.142 1.00 0.00 H new ATOM 0 HD22 LEU D 7 -15.980 0.419 -15.144 1.00 0.00 H new ATOM 0 HD23 LEU D 7 -15.547 -0.865 -13.990 1.00 0.00 H new ATOM 128 N LYS D 8 -18.138 0.585 -9.699 1.00 0.00 N ATOM 129 CA LYS D 8 -18.877 -0.454 -8.929 1.00 0.00 C ATOM 130 C LYS D 8 -20.083 0.175 -8.228 1.00 0.00 C ATOM 131 O LYS D 8 -21.120 -0.441 -8.085 1.00 0.00 O ATOM 132 CB LYS D 8 -17.940 -1.073 -7.891 1.00 0.00 C ATOM 133 CG LYS D 8 -17.566 -0.026 -6.840 1.00 0.00 C ATOM 134 CD LYS D 8 -16.760 -0.690 -5.720 1.00 0.00 C ATOM 135 CE LYS D 8 -15.665 -1.571 -6.327 1.00 0.00 C ATOM 136 NZ LYS D 8 -14.625 -1.850 -5.297 1.00 0.00 N ATOM 0 H LYS D 8 -17.407 1.071 -9.180 1.00 0.00 H new ATOM 0 HA LYS D 8 -19.230 -1.228 -9.611 1.00 0.00 H new ATOM 0 HB2 LYS D 8 -18.424 -1.925 -7.413 1.00 0.00 H new ATOM 0 HB3 LYS D 8 -17.041 -1.450 -8.378 1.00 0.00 H new ATOM 0 HG2 LYS D 8 -16.982 0.772 -7.298 1.00 0.00 H new ATOM 0 HG3 LYS D 8 -18.467 0.432 -6.432 1.00 0.00 H new ATOM 0 HD2 LYS D 8 -16.315 0.071 -5.079 1.00 0.00 H new ATOM 0 HD3 LYS D 8 -17.418 -1.291 -5.092 1.00 0.00 H new ATOM 0 HE2 LYS D 8 -16.094 -2.506 -6.689 1.00 0.00 H new ATOM 0 HE3 LYS D 8 -15.217 -1.072 -7.186 1.00 0.00 H new ATOM 0 HZ1 LYS D 8 -13.881 -2.448 -5.708 1.00 0.00 H new ATOM 0 HZ2 LYS D 8 -14.209 -0.954 -4.972 1.00 0.00 H new ATOM 0 HZ3 LYS D 8 -15.059 -2.343 -4.490 1.00 0.00 H new ATOM 150 N ASP D 9 -19.958 1.396 -7.788 1.00 0.00 N ATOM 151 CA ASP D 9 -21.101 2.058 -7.097 1.00 0.00 C ATOM 152 C ASP D 9 -22.097 2.571 -8.138 1.00 0.00 C ATOM 153 O ASP D 9 -23.266 2.744 -7.860 1.00 0.00 O ATOM 154 CB ASP D 9 -20.584 3.234 -6.264 1.00 0.00 C ATOM 155 CG ASP D 9 -20.077 2.723 -4.915 1.00 0.00 C ATOM 156 OD1 ASP D 9 -19.089 2.008 -4.908 1.00 0.00 O ATOM 157 OD2 ASP D 9 -20.686 3.057 -3.911 1.00 0.00 O ATOM 0 H ASP D 9 -19.115 1.964 -7.876 1.00 0.00 H new ATOM 0 HA ASP D 9 -21.595 1.339 -6.443 1.00 0.00 H new ATOM 0 HB2 ASP D 9 -19.781 3.744 -6.796 1.00 0.00 H new ATOM 0 HB3 ASP D 9 -21.380 3.963 -6.112 1.00 0.00 H new ATOM 162 N TYR D 10 -21.644 2.813 -9.333 1.00 0.00 N ATOM 163 CA TYR D 10 -22.561 3.313 -10.394 1.00 0.00 C ATOM 164 C TYR D 10 -23.284 2.129 -11.033 1.00 0.00 C ATOM 165 O TYR D 10 -24.423 2.227 -11.443 1.00 0.00 O ATOM 166 CB TYR D 10 -21.742 4.051 -11.456 1.00 0.00 C ATOM 167 CG TYR D 10 -22.590 4.293 -12.682 1.00 0.00 C ATOM 168 CD1 TYR D 10 -23.804 4.980 -12.570 1.00 0.00 C ATOM 169 CD2 TYR D 10 -22.156 3.837 -13.933 1.00 0.00 C ATOM 170 CE1 TYR D 10 -24.587 5.209 -13.709 1.00 0.00 C ATOM 171 CE2 TYR D 10 -22.938 4.068 -15.071 1.00 0.00 C ATOM 172 CZ TYR D 10 -24.152 4.753 -14.959 1.00 0.00 C ATOM 173 OH TYR D 10 -24.922 4.979 -16.081 1.00 0.00 O ATOM 0 H TYR D 10 -20.674 2.686 -9.623 1.00 0.00 H new ATOM 0 HA TYR D 10 -23.294 3.994 -9.962 1.00 0.00 H new ATOM 0 HB2 TYR D 10 -21.384 5.000 -11.057 1.00 0.00 H new ATOM 0 HB3 TYR D 10 -20.862 3.465 -11.721 1.00 0.00 H new ATOM 0 HD1 TYR D 10 -24.137 5.334 -11.606 1.00 0.00 H new ATOM 0 HD2 TYR D 10 -21.219 3.308 -14.020 1.00 0.00 H new ATOM 0 HE1 TYR D 10 -25.525 5.737 -13.623 1.00 0.00 H new ATOM 0 HE2 TYR D 10 -22.603 3.717 -16.036 1.00 0.00 H new ATOM 0 HH TYR D 10 -24.342 5.219 -16.833 1.00 0.00 H new ATOM 183 N ALA D 11 -22.624 1.008 -11.119 1.00 0.00 N ATOM 184 CA ALA D 11 -23.263 -0.189 -11.732 1.00 0.00 C ATOM 185 C ALA D 11 -24.233 -0.826 -10.733 1.00 0.00 C ATOM 186 O ALA D 11 -25.245 -1.382 -11.109 1.00 0.00 O ATOM 187 CB ALA D 11 -22.180 -1.201 -12.111 1.00 0.00 C ATOM 0 H ALA D 11 -21.668 0.869 -10.791 1.00 0.00 H new ATOM 0 HA ALA D 11 -23.813 0.110 -12.624 1.00 0.00 H new ATOM 0 HB1 ALA D 11 -22.644 -2.079 -12.560 1.00 0.00 H new ATOM 0 HB2 ALA D 11 -21.493 -0.748 -12.826 1.00 0.00 H new ATOM 0 HB3 ALA D 11 -21.631 -1.498 -11.218 1.00 0.00 H new ATOM 193 N MET D 12 -23.934 -0.757 -9.462 1.00 0.00 N ATOM 194 CA MET D 12 -24.847 -1.369 -8.454 1.00 0.00 C ATOM 195 C MET D 12 -25.912 -0.356 -8.030 1.00 0.00 C ATOM 196 O MET D 12 -27.079 -0.675 -7.928 1.00 0.00 O ATOM 197 CB MET D 12 -24.040 -1.806 -7.230 1.00 0.00 C ATOM 198 CG MET D 12 -24.117 -3.328 -7.084 1.00 0.00 C ATOM 199 SD MET D 12 -25.543 -3.764 -6.057 1.00 0.00 S ATOM 200 CE MET D 12 -24.664 -4.834 -4.891 1.00 0.00 C ATOM 0 H MET D 12 -23.102 -0.306 -9.081 1.00 0.00 H new ATOM 0 HA MET D 12 -25.336 -2.237 -8.897 1.00 0.00 H new ATOM 0 HB2 MET D 12 -23.001 -1.492 -7.335 1.00 0.00 H new ATOM 0 HB3 MET D 12 -24.429 -1.324 -6.333 1.00 0.00 H new ATOM 0 HG2 MET D 12 -24.206 -3.794 -8.065 1.00 0.00 H new ATOM 0 HG3 MET D 12 -23.200 -3.708 -6.633 1.00 0.00 H new ATOM 0 HE1 MET D 12 -25.366 -5.222 -4.153 1.00 0.00 H new ATOM 0 HE2 MET D 12 -24.210 -5.665 -5.431 1.00 0.00 H new ATOM 0 HE3 MET D 12 -23.886 -4.261 -4.386 1.00 0.00 H new ATOM 210 N ARG D 13 -25.521 0.862 -7.779 1.00 0.00 N ATOM 211 CA ARG D 13 -26.516 1.891 -7.358 1.00 0.00 C ATOM 212 C ARG D 13 -27.422 2.248 -8.539 1.00 0.00 C ATOM 213 O ARG D 13 -28.539 2.693 -8.362 1.00 0.00 O ATOM 214 CB ARG D 13 -25.787 3.148 -6.876 1.00 0.00 C ATOM 215 CG ARG D 13 -24.894 2.796 -5.683 1.00 0.00 C ATOM 216 CD ARG D 13 -25.396 3.527 -4.435 1.00 0.00 C ATOM 217 NE ARG D 13 -26.866 3.334 -4.303 1.00 0.00 N ATOM 218 CZ ARG D 13 -27.481 3.731 -3.221 1.00 0.00 C ATOM 219 NH1 ARG D 13 -26.880 3.662 -2.065 1.00 0.00 N ATOM 220 NH2 ARG D 13 -28.698 4.197 -3.296 1.00 0.00 N ATOM 0 H ARG D 13 -24.558 1.190 -7.847 1.00 0.00 H new ATOM 0 HA ARG D 13 -27.122 1.490 -6.546 1.00 0.00 H new ATOM 0 HB2 ARG D 13 -25.185 3.564 -7.684 1.00 0.00 H new ATOM 0 HB3 ARG D 13 -26.509 3.913 -6.590 1.00 0.00 H new ATOM 0 HG2 ARG D 13 -24.902 1.719 -5.514 1.00 0.00 H new ATOM 0 HG3 ARG D 13 -23.862 3.078 -5.892 1.00 0.00 H new ATOM 0 HD2 ARG D 13 -24.888 3.147 -3.549 1.00 0.00 H new ATOM 0 HD3 ARG D 13 -25.163 4.590 -4.505 1.00 0.00 H new ATOM 0 HE ARG D 13 -27.393 2.892 -5.057 1.00 0.00 H new ATOM 0 HH11 ARG D 13 -25.929 3.298 -2.006 1.00 0.00 H new ATOM 0 HH12 ARG D 13 -27.361 3.972 -1.221 1.00 0.00 H new ATOM 0 HH21 ARG D 13 -29.169 4.251 -4.199 1.00 0.00 H new ATOM 0 HH22 ARG D 13 -29.178 4.507 -2.451 1.00 0.00 H new ATOM 234 N PHE D 14 -26.953 2.059 -9.744 1.00 0.00 N ATOM 235 CA PHE D 14 -27.797 2.392 -10.927 1.00 0.00 C ATOM 236 C PHE D 14 -28.052 1.129 -11.749 1.00 0.00 C ATOM 237 O PHE D 14 -29.130 0.921 -12.269 1.00 0.00 O ATOM 238 CB PHE D 14 -27.079 3.431 -11.791 1.00 0.00 C ATOM 239 CG PHE D 14 -26.652 4.595 -10.927 1.00 0.00 C ATOM 240 CD1 PHE D 14 -25.629 4.429 -9.985 1.00 0.00 C ATOM 241 CD2 PHE D 14 -27.280 5.838 -11.067 1.00 0.00 C ATOM 242 CE1 PHE D 14 -25.236 5.508 -9.182 1.00 0.00 C ATOM 243 CE2 PHE D 14 -26.887 6.916 -10.265 1.00 0.00 C ATOM 244 CZ PHE D 14 -25.864 6.751 -9.322 1.00 0.00 C ATOM 0 H PHE D 14 -26.027 1.690 -9.959 1.00 0.00 H new ATOM 0 HA PHE D 14 -28.750 2.799 -10.588 1.00 0.00 H new ATOM 0 HB2 PHE D 14 -26.209 2.982 -12.271 1.00 0.00 H new ATOM 0 HB3 PHE D 14 -27.739 3.777 -12.586 1.00 0.00 H new ATOM 0 HD1 PHE D 14 -25.143 3.470 -9.878 1.00 0.00 H new ATOM 0 HD2 PHE D 14 -28.068 5.966 -11.794 1.00 0.00 H new ATOM 0 HE1 PHE D 14 -24.448 5.380 -8.455 1.00 0.00 H new ATOM 0 HE2 PHE D 14 -27.372 7.875 -10.373 1.00 0.00 H new ATOM 0 HZ PHE D 14 -25.560 7.583 -8.703 1.00 0.00 H new ATOM 254 N GLY D 15 -27.069 0.283 -11.871 1.00 0.00 N ATOM 255 CA GLY D 15 -27.258 -0.968 -12.660 1.00 0.00 C ATOM 256 C GLY D 15 -26.036 -1.206 -13.551 1.00 0.00 C ATOM 257 O GLY D 15 -25.487 -0.287 -14.125 1.00 0.00 O ATOM 0 H GLY D 15 -26.143 0.402 -11.460 1.00 0.00 H new ATOM 0 HA2 GLY D 15 -27.401 -1.815 -11.989 1.00 0.00 H new ATOM 0 HA3 GLY D 15 -28.157 -0.891 -13.272 1.00 0.00 H new ATOM 261 N GLN D 16 -25.607 -2.432 -13.669 1.00 0.00 N ATOM 262 CA GLN D 16 -24.421 -2.728 -14.522 1.00 0.00 C ATOM 263 C GLN D 16 -24.850 -2.782 -15.988 1.00 0.00 C ATOM 264 O GLN D 16 -24.052 -2.598 -16.885 1.00 0.00 O ATOM 265 CB GLN D 16 -23.821 -4.073 -14.111 1.00 0.00 C ATOM 266 CG GLN D 16 -23.640 -4.108 -12.592 1.00 0.00 C ATOM 267 CD GLN D 16 -23.579 -5.560 -12.116 1.00 0.00 C ATOM 268 OE1 GLN D 16 -22.565 -6.005 -11.617 1.00 0.00 O ATOM 269 NE2 GLN D 16 -24.630 -6.323 -12.248 1.00 0.00 N ATOM 0 H GLN D 16 -26.026 -3.242 -13.212 1.00 0.00 H new ATOM 0 HA GLN D 16 -23.674 -1.945 -14.393 1.00 0.00 H new ATOM 0 HB2 GLN D 16 -24.473 -4.887 -14.429 1.00 0.00 H new ATOM 0 HB3 GLN D 16 -22.861 -4.222 -14.606 1.00 0.00 H new ATOM 0 HG2 GLN D 16 -22.726 -3.584 -12.312 1.00 0.00 H new ATOM 0 HG3 GLN D 16 -24.466 -3.589 -12.105 1.00 0.00 H new ATOM 0 HE21 GLN D 16 -25.482 -5.950 -12.667 1.00 0.00 H new ATOM 0 HE22 GLN D 16 -24.599 -7.292 -11.932 1.00 0.00 H new ATOM 278 N THR D 17 -26.106 -3.030 -16.240 1.00 0.00 N ATOM 279 CA THR D 17 -26.582 -3.092 -17.649 1.00 0.00 C ATOM 280 C THR D 17 -26.541 -1.689 -18.259 1.00 0.00 C ATOM 281 O THR D 17 -26.244 -1.516 -19.424 1.00 0.00 O ATOM 282 CB THR D 17 -28.018 -3.620 -17.680 1.00 0.00 C ATOM 283 OG1 THR D 17 -28.220 -4.503 -16.586 1.00 0.00 O ATOM 284 CG2 THR D 17 -28.260 -4.366 -18.992 1.00 0.00 C ATOM 0 H THR D 17 -26.822 -3.192 -15.532 1.00 0.00 H new ATOM 0 HA THR D 17 -25.939 -3.759 -18.223 1.00 0.00 H new ATOM 0 HB THR D 17 -28.715 -2.785 -17.606 1.00 0.00 H new ATOM 0 HG1 THR D 17 -29.140 -4.841 -16.604 1.00 0.00 H new ATOM 0 HG21 THR D 17 -29.283 -4.742 -19.014 1.00 0.00 H new ATOM 0 HG22 THR D 17 -28.105 -3.687 -19.831 1.00 0.00 H new ATOM 0 HG23 THR D 17 -27.565 -5.202 -19.069 1.00 0.00 H new ATOM 292 N LYS D 18 -26.837 -0.686 -17.479 1.00 0.00 N ATOM 293 CA LYS D 18 -26.814 0.705 -18.012 1.00 0.00 C ATOM 294 C LYS D 18 -25.378 1.232 -18.001 1.00 0.00 C ATOM 295 O LYS D 18 -25.000 2.046 -18.820 1.00 0.00 O ATOM 296 CB LYS D 18 -27.699 1.606 -17.145 1.00 0.00 C ATOM 297 CG LYS D 18 -27.367 1.388 -15.667 1.00 0.00 C ATOM 298 CD LYS D 18 -28.067 2.454 -14.823 1.00 0.00 C ATOM 299 CE LYS D 18 -29.578 2.220 -14.857 1.00 0.00 C ATOM 300 NZ LYS D 18 -30.188 2.727 -13.595 1.00 0.00 N ATOM 0 H LYS D 18 -27.094 -0.770 -16.495 1.00 0.00 H new ATOM 0 HA LYS D 18 -27.193 0.706 -19.034 1.00 0.00 H new ATOM 0 HB2 LYS D 18 -27.543 2.651 -17.412 1.00 0.00 H new ATOM 0 HB3 LYS D 18 -28.750 1.384 -17.328 1.00 0.00 H new ATOM 0 HG2 LYS D 18 -27.687 0.394 -15.354 1.00 0.00 H new ATOM 0 HG3 LYS D 18 -26.289 1.439 -15.514 1.00 0.00 H new ATOM 0 HD2 LYS D 18 -27.705 2.415 -13.796 1.00 0.00 H new ATOM 0 HD3 LYS D 18 -27.833 3.447 -15.206 1.00 0.00 H new ATOM 0 HE2 LYS D 18 -30.016 2.729 -15.715 1.00 0.00 H new ATOM 0 HE3 LYS D 18 -29.790 1.157 -14.974 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 -31.221 2.773 -13.703 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 -29.950 2.085 -12.812 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 -29.819 3.677 -13.388 1.00 0.00 H new ATOM 314 N THR D 19 -24.571 0.772 -17.083 1.00 0.00 N ATOM 315 CA THR D 19 -23.160 1.246 -17.032 1.00 0.00 C ATOM 316 C THR D 19 -22.384 0.625 -18.193 1.00 0.00 C ATOM 317 O THR D 19 -21.450 1.205 -18.711 1.00 0.00 O ATOM 318 CB THR D 19 -22.526 0.829 -15.703 1.00 0.00 C ATOM 319 OG1 THR D 19 -23.351 1.262 -14.630 1.00 0.00 O ATOM 320 CG2 THR D 19 -21.141 1.465 -15.570 1.00 0.00 C ATOM 0 H THR D 19 -24.828 0.091 -16.369 1.00 0.00 H new ATOM 0 HA THR D 19 -23.132 2.333 -17.113 1.00 0.00 H new ATOM 0 HB THR D 19 -22.428 -0.256 -15.674 1.00 0.00 H new ATOM 0 HG1 THR D 19 -23.405 2.241 -14.633 1.00 0.00 H new ATOM 0 HG21 THR D 19 -20.693 1.166 -14.623 1.00 0.00 H new ATOM 0 HG22 THR D 19 -20.507 1.132 -16.392 1.00 0.00 H new ATOM 0 HG23 THR D 19 -21.235 2.551 -15.600 1.00 0.00 H new ATOM 328 N ALA D 20 -22.770 -0.549 -18.612 1.00 0.00 N ATOM 329 CA ALA D 20 -22.062 -1.205 -19.746 1.00 0.00 C ATOM 330 C ALA D 20 -22.551 -0.595 -21.060 1.00 0.00 C ATOM 331 O ALA D 20 -21.834 -0.548 -22.040 1.00 0.00 O ATOM 332 CB ALA D 20 -22.361 -2.706 -19.736 1.00 0.00 C ATOM 0 H ALA D 20 -23.545 -1.082 -18.218 1.00 0.00 H new ATOM 0 HA ALA D 20 -20.987 -1.052 -19.647 1.00 0.00 H new ATOM 0 HB1 ALA D 20 -21.843 -3.186 -20.566 1.00 0.00 H new ATOM 0 HB2 ALA D 20 -22.019 -3.139 -18.796 1.00 0.00 H new ATOM 0 HB3 ALA D 20 -23.435 -2.864 -19.839 1.00 0.00 H new ATOM 338 N LYS D 21 -23.766 -0.118 -21.084 1.00 0.00 N ATOM 339 CA LYS D 21 -24.301 0.498 -22.330 1.00 0.00 C ATOM 340 C LYS D 21 -23.720 1.904 -22.481 1.00 0.00 C ATOM 341 O LYS D 21 -23.440 2.359 -23.571 1.00 0.00 O ATOM 342 CB LYS D 21 -25.827 0.580 -22.245 1.00 0.00 C ATOM 343 CG LYS D 21 -26.448 -0.460 -23.180 1.00 0.00 C ATOM 344 CD LYS D 21 -27.482 0.216 -24.083 1.00 0.00 C ATOM 345 CE LYS D 21 -27.082 0.027 -25.548 1.00 0.00 C ATOM 346 NZ LYS D 21 -25.635 0.344 -25.715 1.00 0.00 N ATOM 0 H LYS D 21 -24.411 -0.129 -20.294 1.00 0.00 H new ATOM 0 HA LYS D 21 -24.021 -0.109 -23.191 1.00 0.00 H new ATOM 0 HB2 LYS D 21 -26.154 0.405 -21.220 1.00 0.00 H new ATOM 0 HB3 LYS D 21 -26.164 1.579 -22.521 1.00 0.00 H new ATOM 0 HG2 LYS D 21 -25.672 -0.929 -23.785 1.00 0.00 H new ATOM 0 HG3 LYS D 21 -26.920 -1.251 -22.598 1.00 0.00 H new ATOM 0 HD2 LYS D 21 -28.469 -0.211 -23.907 1.00 0.00 H new ATOM 0 HD3 LYS D 21 -27.547 1.278 -23.847 1.00 0.00 H new ATOM 0 HE2 LYS D 21 -27.278 -0.999 -25.860 1.00 0.00 H new ATOM 0 HE3 LYS D 21 -27.683 0.675 -26.186 1.00 0.00 H new ATOM 0 HZ1 LYS D 21 -25.484 0.804 -26.635 1.00 0.00 H new ATOM 0 HZ2 LYS D 21 -25.330 0.984 -24.954 1.00 0.00 H new ATOM 0 HZ3 LYS D 21 -25.080 -0.535 -25.672 1.00 0.00 H new ATOM 360 N ASP D 22 -23.533 2.593 -21.389 1.00 0.00 N ATOM 361 CA ASP D 22 -22.966 3.969 -21.461 1.00 0.00 C ATOM 362 C ASP D 22 -21.477 3.888 -21.802 1.00 0.00 C ATOM 363 O ASP D 22 -20.942 4.726 -22.499 1.00 0.00 O ATOM 364 CB ASP D 22 -23.146 4.666 -20.108 1.00 0.00 C ATOM 365 CG ASP D 22 -24.535 5.305 -20.044 1.00 0.00 C ATOM 366 OD1 ASP D 22 -25.154 5.435 -21.087 1.00 0.00 O ATOM 367 OD2 ASP D 22 -24.955 5.654 -18.953 1.00 0.00 O ATOM 0 H ASP D 22 -23.749 2.262 -20.449 1.00 0.00 H new ATOM 0 HA ASP D 22 -23.484 4.538 -22.233 1.00 0.00 H new ATOM 0 HB2 ASP D 22 -23.027 3.947 -19.298 1.00 0.00 H new ATOM 0 HB3 ASP D 22 -22.377 5.427 -19.974 1.00 0.00 H new ATOM 372 N LEU D 23 -20.805 2.883 -21.312 1.00 0.00 N ATOM 373 CA LEU D 23 -19.351 2.743 -21.606 1.00 0.00 C ATOM 374 C LEU D 23 -19.159 1.902 -22.870 1.00 0.00 C ATOM 375 O LEU D 23 -18.096 1.882 -23.459 1.00 0.00 O ATOM 376 CB LEU D 23 -18.659 2.059 -20.425 1.00 0.00 C ATOM 377 CG LEU D 23 -18.468 3.070 -19.295 1.00 0.00 C ATOM 378 CD1 LEU D 23 -18.740 2.393 -17.951 1.00 0.00 C ATOM 379 CD2 LEU D 23 -17.030 3.592 -19.319 1.00 0.00 C ATOM 0 H LEU D 23 -21.200 2.152 -20.720 1.00 0.00 H new ATOM 0 HA LEU D 23 -18.916 3.730 -21.763 1.00 0.00 H new ATOM 0 HB2 LEU D 23 -19.257 1.216 -20.077 1.00 0.00 H new ATOM 0 HB3 LEU D 23 -17.694 1.658 -20.737 1.00 0.00 H new ATOM 0 HG LEU D 23 -19.161 3.900 -19.430 1.00 0.00 H new ATOM 0 HD11 LEU D 23 -18.603 3.115 -17.146 1.00 0.00 H new ATOM 0 HD12 LEU D 23 -19.763 2.018 -17.933 1.00 0.00 H new ATOM 0 HD13 LEU D 23 -18.047 1.563 -17.815 1.00 0.00 H new ATOM 0 HD21 LEU D 23 -16.891 4.313 -18.514 1.00 0.00 H new ATOM 0 HD22 LEU D 23 -16.339 2.760 -19.184 1.00 0.00 H new ATOM 0 HD23 LEU D 23 -16.834 4.075 -20.276 1.00 0.00 H new ATOM 391 N GLY D 24 -20.179 1.206 -23.293 1.00 0.00 N ATOM 392 CA GLY D 24 -20.052 0.368 -24.519 1.00 0.00 C ATOM 393 C GLY D 24 -19.249 -0.895 -24.197 1.00 0.00 C ATOM 394 O GLY D 24 -18.704 -1.536 -25.074 1.00 0.00 O ATOM 0 H GLY D 24 -21.094 1.181 -22.843 1.00 0.00 H new ATOM 0 HA2 GLY D 24 -21.040 0.098 -24.891 1.00 0.00 H new ATOM 0 HA3 GLY D 24 -19.558 0.934 -25.309 1.00 0.00 H new ATOM 398 N VAL D 25 -19.172 -1.256 -22.946 1.00 0.00 N ATOM 399 CA VAL D 25 -18.405 -2.478 -22.566 1.00 0.00 C ATOM 400 C VAL D 25 -19.379 -3.643 -22.375 1.00 0.00 C ATOM 401 O VAL D 25 -20.582 -3.469 -22.400 1.00 0.00 O ATOM 402 CB VAL D 25 -17.641 -2.230 -21.259 1.00 0.00 C ATOM 403 CG1 VAL D 25 -16.296 -2.958 -21.306 1.00 0.00 C ATOM 404 CG2 VAL D 25 -17.392 -0.729 -21.077 1.00 0.00 C ATOM 0 H VAL D 25 -19.607 -0.758 -22.169 1.00 0.00 H new ATOM 0 HA VAL D 25 -17.692 -2.718 -23.355 1.00 0.00 H new ATOM 0 HB VAL D 25 -18.235 -2.604 -20.425 1.00 0.00 H new ATOM 0 HG11 VAL D 25 -15.754 -2.781 -20.377 1.00 0.00 H new ATOM 0 HG12 VAL D 25 -16.465 -4.028 -21.429 1.00 0.00 H new ATOM 0 HG13 VAL D 25 -15.709 -2.584 -22.145 1.00 0.00 H new ATOM 0 HG21 VAL D 25 -16.849 -0.560 -20.147 1.00 0.00 H new ATOM 0 HG22 VAL D 25 -16.803 -0.354 -21.914 1.00 0.00 H new ATOM 0 HG23 VAL D 25 -18.346 -0.204 -21.040 1.00 0.00 H new ATOM 414 N TYR D 26 -18.873 -4.832 -22.188 1.00 0.00 N ATOM 415 CA TYR D 26 -19.775 -6.006 -22.000 1.00 0.00 C ATOM 416 C TYR D 26 -20.155 -6.127 -20.522 1.00 0.00 C ATOM 417 O TYR D 26 -19.510 -5.571 -19.655 1.00 0.00 O ATOM 418 CB TYR D 26 -19.065 -7.291 -22.441 1.00 0.00 C ATOM 419 CG TYR D 26 -17.984 -6.968 -23.445 1.00 0.00 C ATOM 420 CD1 TYR D 26 -18.234 -6.057 -24.477 1.00 0.00 C ATOM 421 CD2 TYR D 26 -16.729 -7.582 -23.340 1.00 0.00 C ATOM 422 CE1 TYR D 26 -17.230 -5.760 -25.407 1.00 0.00 C ATOM 423 CE2 TYR D 26 -15.726 -7.285 -24.269 1.00 0.00 C ATOM 424 CZ TYR D 26 -15.975 -6.374 -25.302 1.00 0.00 C ATOM 425 OH TYR D 26 -14.985 -6.081 -26.218 1.00 0.00 O ATOM 0 H TYR D 26 -17.875 -5.042 -22.157 1.00 0.00 H new ATOM 0 HA TYR D 26 -20.671 -5.863 -22.604 1.00 0.00 H new ATOM 0 HB2 TYR D 26 -18.631 -7.791 -21.575 1.00 0.00 H new ATOM 0 HB3 TYR D 26 -19.785 -7.981 -22.880 1.00 0.00 H new ATOM 0 HD1 TYR D 26 -19.201 -5.583 -24.556 1.00 0.00 H new ATOM 0 HD2 TYR D 26 -16.536 -8.284 -22.542 1.00 0.00 H new ATOM 0 HE1 TYR D 26 -17.423 -5.058 -26.205 1.00 0.00 H new ATOM 0 HE2 TYR D 26 -14.759 -7.759 -24.189 1.00 0.00 H new ATOM 0 HH TYR D 26 -14.177 -6.591 -26.001 1.00 0.00 H new ATOM 435 N GLN D 27 -21.197 -6.858 -20.229 1.00 0.00 N ATOM 436 CA GLN D 27 -21.616 -7.022 -18.809 1.00 0.00 C ATOM 437 C GLN D 27 -20.532 -7.785 -18.050 1.00 0.00 C ATOM 438 O GLN D 27 -20.240 -7.499 -16.905 1.00 0.00 O ATOM 439 CB GLN D 27 -22.929 -7.805 -18.749 1.00 0.00 C ATOM 440 CG GLN D 27 -24.021 -7.025 -19.485 1.00 0.00 C ATOM 441 CD GLN D 27 -25.361 -7.743 -19.316 1.00 0.00 C ATOM 442 OE1 GLN D 27 -25.466 -8.693 -18.566 1.00 0.00 O ATOM 443 NE2 GLN D 27 -26.400 -7.326 -19.987 1.00 0.00 N ATOM 0 H GLN D 27 -21.775 -7.348 -20.912 1.00 0.00 H new ATOM 0 HA GLN D 27 -21.760 -6.042 -18.355 1.00 0.00 H new ATOM 0 HB2 GLN D 27 -22.800 -8.788 -19.203 1.00 0.00 H new ATOM 0 HB3 GLN D 27 -23.220 -7.969 -17.711 1.00 0.00 H new ATOM 0 HG2 GLN D 27 -24.087 -6.011 -19.091 1.00 0.00 H new ATOM 0 HG3 GLN D 27 -23.772 -6.940 -20.543 1.00 0.00 H new ATOM 0 HE21 GLN D 27 -26.314 -6.529 -20.617 1.00 0.00 H new ATOM 0 HE22 GLN D 27 -27.298 -7.798 -19.881 1.00 0.00 H new ATOM 452 N SER D 28 -19.928 -8.753 -18.682 1.00 0.00 N ATOM 453 CA SER D 28 -18.859 -9.535 -18.003 1.00 0.00 C ATOM 454 C SER D 28 -17.627 -8.647 -17.812 1.00 0.00 C ATOM 455 O SER D 28 -16.691 -9.006 -17.125 1.00 0.00 O ATOM 456 CB SER D 28 -18.489 -10.746 -18.858 1.00 0.00 C ATOM 457 OG SER D 28 -18.200 -11.848 -18.009 1.00 0.00 O ATOM 0 H SER D 28 -20.130 -9.036 -19.641 1.00 0.00 H new ATOM 0 HA SER D 28 -19.217 -9.876 -17.032 1.00 0.00 H new ATOM 0 HB2 SER D 28 -19.310 -10.995 -19.531 1.00 0.00 H new ATOM 0 HB3 SER D 28 -17.625 -10.516 -19.481 1.00 0.00 H new ATOM 0 HG SER D 28 -17.964 -12.628 -18.554 1.00 0.00 H new ATOM 463 N ALA D 29 -17.625 -7.483 -18.405 1.00 0.00 N ATOM 464 CA ALA D 29 -16.462 -6.571 -18.245 1.00 0.00 C ATOM 465 C ALA D 29 -16.699 -5.712 -17.010 1.00 0.00 C ATOM 466 O ALA D 29 -15.780 -5.335 -16.309 1.00 0.00 O ATOM 467 CB ALA D 29 -16.333 -5.676 -19.479 1.00 0.00 C ATOM 0 H ALA D 29 -18.379 -7.127 -18.992 1.00 0.00 H new ATOM 0 HA ALA D 29 -15.544 -7.147 -18.134 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -15.479 -5.009 -19.357 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -16.186 -6.295 -20.364 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -17.241 -5.085 -19.596 1.00 0.00 H new ATOM 473 N ILE D 30 -17.936 -5.416 -16.734 1.00 0.00 N ATOM 474 CA ILE D 30 -18.261 -4.598 -15.539 1.00 0.00 C ATOM 475 C ILE D 30 -18.185 -5.490 -14.301 1.00 0.00 C ATOM 476 O ILE D 30 -17.787 -5.064 -13.234 1.00 0.00 O ATOM 477 CB ILE D 30 -19.678 -4.042 -15.682 1.00 0.00 C ATOM 478 CG1 ILE D 30 -19.793 -3.264 -16.997 1.00 0.00 C ATOM 479 CG2 ILE D 30 -19.980 -3.114 -14.509 1.00 0.00 C ATOM 480 CD1 ILE D 30 -18.884 -2.034 -16.949 1.00 0.00 C ATOM 0 H ILE D 30 -18.740 -5.708 -17.289 1.00 0.00 H new ATOM 0 HA ILE D 30 -17.556 -3.772 -15.444 1.00 0.00 H new ATOM 0 HB ILE D 30 -20.393 -4.865 -15.686 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -19.513 -3.903 -17.835 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -20.826 -2.958 -17.161 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -20.990 -2.717 -14.610 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -19.900 -3.670 -13.575 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -19.266 -2.291 -14.503 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -18.968 -1.483 -17.886 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -19.185 -1.391 -16.122 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -17.851 -2.350 -16.806 1.00 0.00 H new ATOM 492 N ASN D 31 -18.558 -6.732 -14.443 1.00 0.00 N ATOM 493 CA ASN D 31 -18.505 -7.665 -13.285 1.00 0.00 C ATOM 494 C ASN D 31 -17.049 -8.037 -13.003 1.00 0.00 C ATOM 495 O ASN D 31 -16.628 -8.114 -11.866 1.00 0.00 O ATOM 496 CB ASN D 31 -19.302 -8.930 -13.609 1.00 0.00 C ATOM 497 CG ASN D 31 -19.924 -9.485 -12.326 1.00 0.00 C ATOM 498 OD1 ASN D 31 -19.826 -8.877 -11.278 1.00 0.00 O ATOM 499 ND2 ASN D 31 -20.566 -10.620 -12.363 1.00 0.00 N ATOM 0 H ASN D 31 -18.898 -7.141 -15.314 1.00 0.00 H new ATOM 0 HA ASN D 31 -18.936 -7.182 -12.408 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -20.082 -8.705 -14.336 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -18.650 -9.677 -14.062 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -20.985 -10.997 -11.513 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -20.649 -11.131 -13.242 1.00 0.00 H new ATOM 506 N LYS D 32 -16.271 -8.265 -14.029 1.00 0.00 N ATOM 507 CA LYS D 32 -14.842 -8.625 -13.811 1.00 0.00 C ATOM 508 C LYS D 32 -14.102 -7.421 -13.227 1.00 0.00 C ATOM 509 O LYS D 32 -13.180 -7.562 -12.449 1.00 0.00 O ATOM 510 CB LYS D 32 -14.202 -9.023 -15.140 1.00 0.00 C ATOM 511 CG LYS D 32 -14.130 -7.800 -16.048 1.00 0.00 C ATOM 512 CD LYS D 32 -13.314 -8.134 -17.299 1.00 0.00 C ATOM 513 CE LYS D 32 -12.862 -6.839 -17.977 1.00 0.00 C ATOM 514 NZ LYS D 32 -11.458 -6.992 -18.453 1.00 0.00 N ATOM 0 H LYS D 32 -16.564 -8.217 -15.005 1.00 0.00 H new ATOM 0 HA LYS D 32 -14.780 -9.464 -13.118 1.00 0.00 H new ATOM 0 HB2 LYS D 32 -13.203 -9.424 -14.970 1.00 0.00 H new ATOM 0 HB3 LYS D 32 -14.785 -9.811 -15.617 1.00 0.00 H new ATOM 0 HG2 LYS D 32 -15.135 -7.485 -16.331 1.00 0.00 H new ATOM 0 HG3 LYS D 32 -13.673 -6.966 -15.516 1.00 0.00 H new ATOM 0 HD2 LYS D 32 -12.447 -8.737 -17.030 1.00 0.00 H new ATOM 0 HD3 LYS D 32 -13.914 -8.728 -17.989 1.00 0.00 H new ATOM 0 HE2 LYS D 32 -13.518 -6.607 -18.816 1.00 0.00 H new ATOM 0 HE3 LYS D 32 -12.932 -6.006 -17.277 1.00 0.00 H new ATOM 0 HZ1 LYS D 32 -11.150 -6.112 -18.914 1.00 0.00 H new ATOM 0 HZ2 LYS D 32 -10.837 -7.195 -17.644 1.00 0.00 H new ATOM 0 HZ3 LYS D 32 -11.406 -7.776 -19.134 1.00 0.00 H new ATOM 528 N ALA D 33 -14.503 -6.233 -13.594 1.00 0.00 N ATOM 529 CA ALA D 33 -13.828 -5.018 -13.058 1.00 0.00 C ATOM 530 C ALA D 33 -14.132 -4.890 -11.565 1.00 0.00 C ATOM 531 O ALA D 33 -13.284 -4.521 -10.777 1.00 0.00 O ATOM 532 CB ALA D 33 -14.341 -3.779 -13.796 1.00 0.00 C ATOM 0 H ALA D 33 -15.270 -6.053 -14.242 1.00 0.00 H new ATOM 0 HA ALA D 33 -12.751 -5.103 -13.205 1.00 0.00 H new ATOM 0 HB1 ALA D 33 -13.846 -2.891 -13.403 1.00 0.00 H new ATOM 0 HB2 ALA D 33 -14.125 -3.874 -14.860 1.00 0.00 H new ATOM 0 HB3 ALA D 33 -15.418 -3.689 -13.651 1.00 0.00 H new ATOM 538 N ILE D 34 -15.337 -5.196 -11.173 1.00 0.00 N ATOM 539 CA ILE D 34 -15.698 -5.098 -9.730 1.00 0.00 C ATOM 540 C ILE D 34 -15.170 -6.330 -8.993 1.00 0.00 C ATOM 541 O ILE D 34 -14.985 -6.317 -7.792 1.00 0.00 O ATOM 542 CB ILE D 34 -17.220 -5.032 -9.593 1.00 0.00 C ATOM 543 CG1 ILE D 34 -17.710 -3.652 -10.039 1.00 0.00 C ATOM 544 CG2 ILE D 34 -17.614 -5.260 -8.131 1.00 0.00 C ATOM 545 CD1 ILE D 34 -19.023 -3.800 -10.811 1.00 0.00 C ATOM 0 H ILE D 34 -16.088 -5.510 -11.788 1.00 0.00 H new ATOM 0 HA ILE D 34 -15.256 -4.200 -9.300 1.00 0.00 H new ATOM 0 HB ILE D 34 -17.674 -5.803 -10.216 1.00 0.00 H new ATOM 0 HG12 ILE D 34 -17.857 -3.009 -9.171 1.00 0.00 H new ATOM 0 HG13 ILE D 34 -16.959 -3.173 -10.667 1.00 0.00 H new ATOM 0 HG21 ILE D 34 -18.699 -5.213 -8.035 1.00 0.00 H new ATOM 0 HG22 ILE D 34 -17.264 -6.240 -7.808 1.00 0.00 H new ATOM 0 HG23 ILE D 34 -17.161 -4.489 -7.508 1.00 0.00 H new ATOM 0 HD11 ILE D 34 -19.371 -2.817 -11.128 1.00 0.00 H new ATOM 0 HD12 ILE D 34 -18.861 -4.428 -11.687 1.00 0.00 H new ATOM 0 HD13 ILE D 34 -19.773 -4.261 -10.168 1.00 0.00 H new ATOM 557 N HIS D 35 -14.925 -7.395 -9.706 1.00 0.00 N ATOM 558 CA HIS D 35 -14.406 -8.628 -9.053 1.00 0.00 C ATOM 559 C HIS D 35 -12.915 -8.457 -8.760 1.00 0.00 C ATOM 560 O HIS D 35 -12.359 -9.120 -7.907 1.00 0.00 O ATOM 561 CB HIS D 35 -14.608 -9.819 -9.991 1.00 0.00 C ATOM 562 CG HIS D 35 -16.024 -10.310 -9.880 1.00 0.00 C ATOM 563 ND1 HIS D 35 -16.409 -11.561 -10.328 1.00 0.00 N ATOM 564 CD2 HIS D 35 -17.159 -9.727 -9.371 1.00 0.00 C ATOM 565 CE1 HIS D 35 -17.726 -11.692 -10.084 1.00 0.00 C ATOM 566 NE2 HIS D 35 -18.231 -10.603 -9.500 1.00 0.00 N ATOM 0 H HIS D 35 -15.062 -7.464 -10.714 1.00 0.00 H new ATOM 0 HA HIS D 35 -14.942 -8.803 -8.120 1.00 0.00 H new ATOM 0 HB2 HIS D 35 -14.393 -9.527 -11.019 1.00 0.00 H new ATOM 0 HB3 HIS D 35 -13.913 -10.619 -9.735 1.00 0.00 H new ATOM 0 HD2 HIS D 35 -17.211 -8.739 -8.937 1.00 0.00 H new ATOM 0 HE1 HIS D 35 -18.304 -12.571 -10.330 1.00 0.00 H new ATOM 0 HE2 HIS D 35 -19.197 -10.447 -9.210 1.00 0.00 H new ATOM 574 N ALA D 36 -12.265 -7.573 -9.463 1.00 0.00 N ATOM 575 CA ALA D 36 -10.810 -7.356 -9.228 1.00 0.00 C ATOM 576 C ALA D 36 -10.622 -6.296 -8.140 1.00 0.00 C ATOM 577 O ALA D 36 -9.550 -6.141 -7.591 1.00 0.00 O ATOM 578 CB ALA D 36 -10.153 -6.880 -10.524 1.00 0.00 C ATOM 0 H ALA D 36 -12.678 -6.990 -10.191 1.00 0.00 H new ATOM 0 HA ALA D 36 -10.348 -8.290 -8.907 1.00 0.00 H new ATOM 0 HB1 ALA D 36 -9.088 -6.720 -10.355 1.00 0.00 H new ATOM 0 HB2 ALA D 36 -10.288 -7.635 -11.299 1.00 0.00 H new ATOM 0 HB3 ALA D 36 -10.614 -5.945 -10.843 1.00 0.00 H new ATOM 584 N GLY D 37 -11.657 -5.567 -7.824 1.00 0.00 N ATOM 585 CA GLY D 37 -11.535 -4.520 -6.771 1.00 0.00 C ATOM 586 C GLY D 37 -10.473 -3.499 -7.185 1.00 0.00 C ATOM 587 O GLY D 37 -9.974 -2.745 -6.373 1.00 0.00 O ATOM 0 H GLY D 37 -12.581 -5.651 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY D 37 -12.494 -4.023 -6.624 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -11.264 -4.977 -5.819 1.00 0.00 H new ATOM 591 N ARG D 38 -10.124 -3.467 -8.443 1.00 0.00 N ATOM 592 CA ARG D 38 -9.094 -2.493 -8.904 1.00 0.00 C ATOM 593 C ARG D 38 -9.594 -1.070 -8.656 1.00 0.00 C ATOM 594 O ARG D 38 -10.761 -0.847 -8.403 1.00 0.00 O ATOM 595 CB ARG D 38 -8.841 -2.688 -10.400 1.00 0.00 C ATOM 596 CG ARG D 38 -8.019 -3.959 -10.621 1.00 0.00 C ATOM 597 CD ARG D 38 -8.160 -4.409 -12.076 1.00 0.00 C ATOM 598 NE ARG D 38 -6.913 -5.101 -12.507 1.00 0.00 N ATOM 599 CZ ARG D 38 -6.947 -5.951 -13.495 1.00 0.00 C ATOM 600 NH1 ARG D 38 -7.830 -5.812 -14.446 1.00 0.00 N ATOM 601 NH2 ARG D 38 -6.097 -6.941 -13.534 1.00 0.00 N ATOM 0 H ARG D 38 -10.507 -4.072 -9.170 1.00 0.00 H new ATOM 0 HA ARG D 38 -8.167 -2.656 -8.354 1.00 0.00 H new ATOM 0 HB2 ARG D 38 -9.789 -2.759 -10.933 1.00 0.00 H new ATOM 0 HB3 ARG D 38 -8.311 -1.826 -10.805 1.00 0.00 H new ATOM 0 HG2 ARG D 38 -6.971 -3.773 -10.386 1.00 0.00 H new ATOM 0 HG3 ARG D 38 -8.361 -4.747 -9.950 1.00 0.00 H new ATOM 0 HD2 ARG D 38 -9.014 -5.078 -12.179 1.00 0.00 H new ATOM 0 HD3 ARG D 38 -8.351 -3.548 -12.717 1.00 0.00 H new ATOM 0 HE ARG D 38 -6.032 -4.910 -12.029 1.00 0.00 H new ATOM 0 HH11 ARG D 38 -8.494 -5.038 -14.416 1.00 0.00 H new ATOM 0 HH12 ARG D 38 -7.856 -6.477 -15.219 1.00 0.00 H new ATOM 0 HH21 ARG D 38 -5.406 -7.050 -12.791 1.00 0.00 H new ATOM 0 HH22 ARG D 38 -6.124 -7.606 -14.307 1.00 0.00 H new ATOM 615 N LYS D 39 -8.722 -0.102 -8.730 1.00 0.00 N ATOM 616 CA LYS D 39 -9.152 1.306 -8.502 1.00 0.00 C ATOM 617 C LYS D 39 -9.690 1.887 -9.805 1.00 0.00 C ATOM 618 O LYS D 39 -9.049 2.684 -10.460 1.00 0.00 O ATOM 619 CB LYS D 39 -7.962 2.136 -8.016 1.00 0.00 C ATOM 620 CG LYS D 39 -7.391 1.511 -6.740 1.00 0.00 C ATOM 621 CD LYS D 39 -8.393 1.674 -5.596 1.00 0.00 C ATOM 622 CE LYS D 39 -8.161 3.016 -4.901 1.00 0.00 C ATOM 623 NZ LYS D 39 -7.440 2.793 -3.616 1.00 0.00 N ATOM 0 H LYS D 39 -7.731 -0.225 -8.938 1.00 0.00 H new ATOM 0 HA LYS D 39 -9.935 1.330 -7.744 1.00 0.00 H new ATOM 0 HB2 LYS D 39 -7.194 2.177 -8.789 1.00 0.00 H new ATOM 0 HB3 LYS D 39 -8.275 3.162 -7.823 1.00 0.00 H new ATOM 0 HG2 LYS D 39 -7.179 0.454 -6.904 1.00 0.00 H new ATOM 0 HG3 LYS D 39 -6.446 1.989 -6.480 1.00 0.00 H new ATOM 0 HD2 LYS D 39 -9.412 1.623 -5.981 1.00 0.00 H new ATOM 0 HD3 LYS D 39 -8.281 0.858 -4.882 1.00 0.00 H new ATOM 0 HE2 LYS D 39 -7.581 3.676 -5.546 1.00 0.00 H new ATOM 0 HE3 LYS D 39 -9.114 3.510 -4.714 1.00 0.00 H new ATOM 0 HZ1 LYS D 39 -7.282 3.706 -3.143 1.00 0.00 H new ATOM 0 HZ2 LYS D 39 -8.010 2.178 -3.000 1.00 0.00 H new ATOM 0 HZ3 LYS D 39 -6.524 2.339 -3.806 1.00 0.00 H new ATOM 637 N ILE D 40 -10.874 1.493 -10.175 1.00 0.00 N ATOM 638 CA ILE D 40 -11.480 2.018 -11.428 1.00 0.00 C ATOM 639 C ILE D 40 -12.618 2.965 -11.059 1.00 0.00 C ATOM 640 O ILE D 40 -13.743 2.556 -10.848 1.00 0.00 O ATOM 641 CB ILE D 40 -12.019 0.857 -12.267 1.00 0.00 C ATOM 642 CG1 ILE D 40 -11.020 -0.302 -12.231 1.00 0.00 C ATOM 643 CG2 ILE D 40 -12.211 1.319 -13.712 1.00 0.00 C ATOM 644 CD1 ILE D 40 -11.596 -1.497 -12.993 1.00 0.00 C ATOM 0 H ILE D 40 -11.451 0.827 -9.661 1.00 0.00 H new ATOM 0 HA ILE D 40 -10.729 2.552 -12.011 1.00 0.00 H new ATOM 0 HB ILE D 40 -12.975 0.527 -11.861 1.00 0.00 H new ATOM 0 HG12 ILE D 40 -10.074 0.005 -12.677 1.00 0.00 H new ATOM 0 HG13 ILE D 40 -10.810 -0.583 -11.199 1.00 0.00 H new ATOM 0 HG21 ILE D 40 -12.595 0.493 -14.310 1.00 0.00 H new ATOM 0 HG22 ILE D 40 -12.920 2.146 -13.738 1.00 0.00 H new ATOM 0 HG23 ILE D 40 -11.255 1.648 -14.119 1.00 0.00 H new ATOM 0 HD11 ILE D 40 -10.884 -2.322 -12.967 1.00 0.00 H new ATOM 0 HD12 ILE D 40 -12.531 -1.809 -12.527 1.00 0.00 H new ATOM 0 HD13 ILE D 40 -11.784 -1.212 -14.028 1.00 0.00 H new ATOM 656 N PHE D 41 -12.326 4.230 -10.965 1.00 0.00 N ATOM 657 CA PHE D 41 -13.374 5.216 -10.591 1.00 0.00 C ATOM 658 C PHE D 41 -14.221 5.560 -11.818 1.00 0.00 C ATOM 659 O PHE D 41 -13.840 5.294 -12.941 1.00 0.00 O ATOM 660 CB PHE D 41 -12.690 6.469 -10.046 1.00 0.00 C ATOM 661 CG PHE D 41 -11.505 6.056 -9.197 1.00 0.00 C ATOM 662 CD1 PHE D 41 -11.532 4.837 -8.502 1.00 0.00 C ATOM 663 CD2 PHE D 41 -10.382 6.888 -9.102 1.00 0.00 C ATOM 664 CE1 PHE D 41 -10.439 4.456 -7.715 1.00 0.00 C ATOM 665 CE2 PHE D 41 -9.291 6.506 -8.313 1.00 0.00 C ATOM 666 CZ PHE D 41 -9.319 5.290 -7.620 1.00 0.00 C ATOM 0 H PHE D 41 -11.401 4.626 -11.132 1.00 0.00 H new ATOM 0 HA PHE D 41 -14.030 4.798 -9.828 1.00 0.00 H new ATOM 0 HB2 PHE D 41 -12.361 7.105 -10.867 1.00 0.00 H new ATOM 0 HB3 PHE D 41 -13.393 7.053 -9.452 1.00 0.00 H new ATOM 0 HD1 PHE D 41 -12.396 4.193 -8.574 1.00 0.00 H new ATOM 0 HD2 PHE D 41 -10.358 7.825 -9.638 1.00 0.00 H new ATOM 0 HE1 PHE D 41 -10.460 3.518 -7.181 1.00 0.00 H new ATOM 0 HE2 PHE D 41 -8.427 7.150 -8.239 1.00 0.00 H new ATOM 0 HZ PHE D 41 -8.476 4.995 -7.012 1.00 0.00 H new ATOM 676 N LEU D 42 -15.375 6.133 -11.614 1.00 0.00 N ATOM 677 CA LEU D 42 -16.254 6.471 -12.769 1.00 0.00 C ATOM 678 C LEU D 42 -16.711 7.932 -12.675 1.00 0.00 C ATOM 679 O LEU D 42 -17.575 8.271 -11.892 1.00 0.00 O ATOM 680 CB LEU D 42 -17.478 5.555 -12.741 1.00 0.00 C ATOM 681 CG LEU D 42 -17.759 5.012 -14.143 1.00 0.00 C ATOM 682 CD1 LEU D 42 -16.655 4.038 -14.554 1.00 0.00 C ATOM 683 CD2 LEU D 42 -19.100 4.276 -14.134 1.00 0.00 C ATOM 0 H LEU D 42 -15.747 6.382 -10.698 1.00 0.00 H new ATOM 0 HA LEU D 42 -15.701 6.333 -13.698 1.00 0.00 H new ATOM 0 HB2 LEU D 42 -17.309 4.729 -12.050 1.00 0.00 H new ATOM 0 HB3 LEU D 42 -18.345 6.105 -12.375 1.00 0.00 H new ATOM 0 HG LEU D 42 -17.791 5.840 -14.852 1.00 0.00 H new ATOM 0 HD11 LEU D 42 -16.861 3.655 -15.553 1.00 0.00 H new ATOM 0 HD12 LEU D 42 -15.695 4.555 -14.554 1.00 0.00 H new ATOM 0 HD13 LEU D 42 -16.620 3.209 -13.848 1.00 0.00 H new ATOM 0 HD21 LEU D 42 -19.308 3.886 -15.130 1.00 0.00 H new ATOM 0 HD22 LEU D 42 -19.058 3.451 -13.423 1.00 0.00 H new ATOM 0 HD23 LEU D 42 -19.892 4.966 -13.842 1.00 0.00 H new ATOM 695 N THR D 43 -16.142 8.797 -13.471 1.00 0.00 N ATOM 696 CA THR D 43 -16.549 10.232 -13.431 1.00 0.00 C ATOM 697 C THR D 43 -17.561 10.501 -14.549 1.00 0.00 C ATOM 698 O THR D 43 -17.199 10.662 -15.697 1.00 0.00 O ATOM 699 CB THR D 43 -15.317 11.119 -13.637 1.00 0.00 C ATOM 700 OG1 THR D 43 -14.514 11.093 -12.466 1.00 0.00 O ATOM 701 CG2 THR D 43 -15.757 12.556 -13.924 1.00 0.00 C ATOM 0 H THR D 43 -15.413 8.572 -14.148 1.00 0.00 H new ATOM 0 HA THR D 43 -17.000 10.457 -12.465 1.00 0.00 H new ATOM 0 HB THR D 43 -14.740 10.744 -14.483 1.00 0.00 H new ATOM 0 HG1 THR D 43 -14.680 10.262 -11.974 1.00 0.00 H new ATOM 0 HG21 THR D 43 -14.878 13.183 -14.070 1.00 0.00 H new ATOM 0 HG22 THR D 43 -16.370 12.576 -14.825 1.00 0.00 H new ATOM 0 HG23 THR D 43 -16.337 12.934 -13.082 1.00 0.00 H new ATOM 709 N ILE D 44 -18.825 10.550 -14.226 1.00 0.00 N ATOM 710 CA ILE D 44 -19.850 10.805 -15.279 1.00 0.00 C ATOM 711 C ILE D 44 -20.038 12.313 -15.459 1.00 0.00 C ATOM 712 O ILE D 44 -20.612 12.981 -14.621 1.00 0.00 O ATOM 713 CB ILE D 44 -21.186 10.173 -14.871 1.00 0.00 C ATOM 714 CG1 ILE D 44 -20.934 8.959 -13.971 1.00 0.00 C ATOM 715 CG2 ILE D 44 -21.938 9.722 -16.125 1.00 0.00 C ATOM 716 CD1 ILE D 44 -21.219 9.334 -12.516 1.00 0.00 C ATOM 0 H ILE D 44 -19.191 10.425 -13.282 1.00 0.00 H new ATOM 0 HA ILE D 44 -19.513 10.363 -16.217 1.00 0.00 H new ATOM 0 HB ILE D 44 -21.779 10.909 -14.328 1.00 0.00 H new ATOM 0 HG12 ILE D 44 -21.572 8.129 -14.275 1.00 0.00 H new ATOM 0 HG13 ILE D 44 -19.902 8.623 -14.076 1.00 0.00 H new ATOM 0 HG21 ILE D 44 -22.888 9.272 -15.837 1.00 0.00 H new ATOM 0 HG22 ILE D 44 -22.124 10.583 -16.767 1.00 0.00 H new ATOM 0 HG23 ILE D 44 -21.338 8.989 -16.665 1.00 0.00 H new ATOM 0 HD11 ILE D 44 -21.040 8.470 -11.876 1.00 0.00 H new ATOM 0 HD12 ILE D 44 -20.563 10.151 -12.216 1.00 0.00 H new ATOM 0 HD13 ILE D 44 -22.258 9.649 -12.418 1.00 0.00 H new ATOM 728 N ASN D 45 -19.560 12.859 -16.546 1.00 0.00 N ATOM 729 CA ASN D 45 -19.715 14.322 -16.775 1.00 0.00 C ATOM 730 C ASN D 45 -21.200 14.687 -16.766 1.00 0.00 C ATOM 731 O ASN D 45 -22.037 13.952 -17.256 1.00 0.00 O ATOM 732 CB ASN D 45 -19.108 14.703 -18.126 1.00 0.00 C ATOM 733 CG ASN D 45 -17.595 14.868 -17.982 1.00 0.00 C ATOM 734 OD1 ASN D 45 -16.899 13.927 -17.404 1.00 0.00 O flip ATOM 735 ND2 ASN D 45 -17.039 15.865 -18.399 1.00 0.00 N flip ATOM 0 H ASN D 45 -19.069 12.354 -17.284 1.00 0.00 H new ATOM 0 HA ASN D 45 -19.200 14.864 -15.982 1.00 0.00 H new ATOM 0 HB2 ASN D 45 -19.331 13.934 -18.866 1.00 0.00 H new ATOM 0 HB3 ASN D 45 -19.552 15.631 -18.487 1.00 0.00 H new ATOM 0 HD21 ASN D 45 -17.582 16.601 -18.851 1.00 0.00 H new ATOM 0 HD22 ASN D 45 -16.029 15.966 -18.297 1.00 0.00 H new ATOM 742 N ALA D 46 -21.523 15.820 -16.207 1.00 0.00 N ATOM 743 CA ALA D 46 -22.947 16.265 -16.144 1.00 0.00 C ATOM 744 C ALA D 46 -23.624 16.087 -17.505 1.00 0.00 C ATOM 745 O ALA D 46 -24.833 16.006 -17.596 1.00 0.00 O ATOM 746 CB ALA D 46 -22.999 17.741 -15.745 1.00 0.00 C ATOM 0 H ALA D 46 -20.855 16.465 -15.786 1.00 0.00 H new ATOM 0 HA ALA D 46 -23.472 15.659 -15.406 1.00 0.00 H new ATOM 0 HB1 ALA D 46 -24.037 18.069 -15.698 1.00 0.00 H new ATOM 0 HB2 ALA D 46 -22.533 17.870 -14.768 1.00 0.00 H new ATOM 0 HB3 ALA D 46 -22.463 18.337 -16.484 1.00 0.00 H new ATOM 752 N ASP D 47 -22.864 16.022 -18.564 1.00 0.00 N ATOM 753 CA ASP D 47 -23.478 15.848 -19.911 1.00 0.00 C ATOM 754 C ASP D 47 -23.731 14.360 -20.175 1.00 0.00 C ATOM 755 O ASP D 47 -23.655 13.900 -21.297 1.00 0.00 O ATOM 756 CB ASP D 47 -22.528 16.399 -20.977 1.00 0.00 C ATOM 757 CG ASP D 47 -23.338 17.066 -22.091 1.00 0.00 C ATOM 758 OD1 ASP D 47 -23.916 16.346 -22.887 1.00 0.00 O ATOM 759 OD2 ASP D 47 -23.365 18.285 -22.128 1.00 0.00 O ATOM 0 H ASP D 47 -21.846 16.082 -18.555 1.00 0.00 H new ATOM 0 HA ASP D 47 -24.424 16.387 -19.949 1.00 0.00 H new ATOM 0 HB2 ASP D 47 -21.843 17.120 -20.530 1.00 0.00 H new ATOM 0 HB3 ASP D 47 -21.920 15.593 -21.388 1.00 0.00 H new ATOM 764 N GLY D 48 -24.029 13.603 -19.152 1.00 0.00 N ATOM 765 CA GLY D 48 -24.282 12.149 -19.349 1.00 0.00 C ATOM 766 C GLY D 48 -23.054 11.510 -19.993 1.00 0.00 C ATOM 767 O GLY D 48 -23.138 10.481 -20.632 1.00 0.00 O ATOM 0 H GLY D 48 -24.108 13.931 -18.189 1.00 0.00 H new ATOM 0 HA2 GLY D 48 -24.496 11.672 -18.393 1.00 0.00 H new ATOM 0 HA3 GLY D 48 -25.157 12.002 -19.982 1.00 0.00 H new ATOM 771 N SER D 49 -21.909 12.115 -19.827 1.00 0.00 N ATOM 772 CA SER D 49 -20.672 11.543 -20.428 1.00 0.00 C ATOM 773 C SER D 49 -20.012 10.595 -19.427 1.00 0.00 C ATOM 774 O SER D 49 -20.106 10.779 -18.231 1.00 0.00 O ATOM 775 CB SER D 49 -19.702 12.672 -20.778 1.00 0.00 C ATOM 776 OG SER D 49 -19.350 12.578 -22.153 1.00 0.00 O ATOM 0 H SER D 49 -21.778 12.979 -19.302 1.00 0.00 H new ATOM 0 HA SER D 49 -20.929 10.994 -21.334 1.00 0.00 H new ATOM 0 HB2 SER D 49 -20.162 13.639 -20.573 1.00 0.00 H new ATOM 0 HB3 SER D 49 -18.809 12.606 -20.157 1.00 0.00 H new ATOM 0 HG SER D 49 -18.729 13.301 -22.382 1.00 0.00 H new ATOM 782 N VAL D 50 -19.345 9.582 -19.904 1.00 0.00 N ATOM 783 CA VAL D 50 -18.679 8.629 -18.973 1.00 0.00 C ATOM 784 C VAL D 50 -17.168 8.860 -19.006 1.00 0.00 C ATOM 785 O VAL D 50 -16.550 8.860 -20.053 1.00 0.00 O ATOM 786 CB VAL D 50 -18.989 7.195 -19.401 1.00 0.00 C ATOM 787 CG1 VAL D 50 -18.437 6.222 -18.359 1.00 0.00 C ATOM 788 CG2 VAL D 50 -20.505 7.015 -19.512 1.00 0.00 C ATOM 0 H VAL D 50 -19.232 9.373 -20.896 1.00 0.00 H new ATOM 0 HA VAL D 50 -19.049 8.790 -17.960 1.00 0.00 H new ATOM 0 HB VAL D 50 -18.526 6.995 -20.367 1.00 0.00 H new ATOM 0 HG11 VAL D 50 -18.658 5.199 -18.664 1.00 0.00 H new ATOM 0 HG12 VAL D 50 -17.358 6.351 -18.276 1.00 0.00 H new ATOM 0 HG13 VAL D 50 -18.901 6.421 -17.393 1.00 0.00 H new ATOM 0 HG21 VAL D 50 -20.729 5.993 -19.817 1.00 0.00 H new ATOM 0 HG22 VAL D 50 -20.967 7.214 -18.545 1.00 0.00 H new ATOM 0 HG23 VAL D 50 -20.901 7.710 -20.253 1.00 0.00 H new ATOM 798 N TYR D 51 -16.568 9.060 -17.865 1.00 0.00 N ATOM 799 CA TYR D 51 -15.097 9.294 -17.825 1.00 0.00 C ATOM 800 C TYR D 51 -14.480 8.438 -16.718 1.00 0.00 C ATOM 801 O TYR D 51 -14.121 8.928 -15.666 1.00 0.00 O ATOM 802 CB TYR D 51 -14.827 10.774 -17.539 1.00 0.00 C ATOM 803 CG TYR D 51 -13.344 11.045 -17.627 1.00 0.00 C ATOM 804 CD1 TYR D 51 -12.758 11.331 -18.865 1.00 0.00 C ATOM 805 CD2 TYR D 51 -12.555 11.011 -16.470 1.00 0.00 C ATOM 806 CE1 TYR D 51 -11.383 11.584 -18.948 1.00 0.00 C ATOM 807 CE2 TYR D 51 -11.181 11.266 -16.552 1.00 0.00 C ATOM 808 CZ TYR D 51 -10.595 11.551 -17.792 1.00 0.00 C ATOM 809 OH TYR D 51 -9.241 11.802 -17.874 1.00 0.00 O ATOM 0 H TYR D 51 -17.034 9.071 -16.958 1.00 0.00 H new ATOM 0 HA TYR D 51 -14.655 9.023 -18.784 1.00 0.00 H new ATOM 0 HB2 TYR D 51 -15.364 11.397 -18.255 1.00 0.00 H new ATOM 0 HB3 TYR D 51 -15.197 11.037 -16.548 1.00 0.00 H new ATOM 0 HD1 TYR D 51 -13.366 11.357 -19.757 1.00 0.00 H new ATOM 0 HD2 TYR D 51 -13.007 10.788 -15.515 1.00 0.00 H new ATOM 0 HE1 TYR D 51 -10.931 11.804 -19.904 1.00 0.00 H new ATOM 0 HE2 TYR D 51 -10.573 11.243 -15.660 1.00 0.00 H new ATOM 0 HH TYR D 51 -8.753 11.139 -17.343 1.00 0.00 H new ATOM 819 N ALA D 52 -14.358 7.159 -16.947 1.00 0.00 N ATOM 820 CA ALA D 52 -13.770 6.269 -15.907 1.00 0.00 C ATOM 821 C ALA D 52 -12.247 6.387 -15.932 1.00 0.00 C ATOM 822 O ALA D 52 -11.647 6.602 -16.967 1.00 0.00 O ATOM 823 CB ALA D 52 -14.174 4.822 -16.193 1.00 0.00 C ATOM 0 H ALA D 52 -14.640 6.692 -17.809 1.00 0.00 H new ATOM 0 HA ALA D 52 -14.138 6.565 -14.925 1.00 0.00 H new ATOM 0 HB1 ALA D 52 -13.745 4.168 -15.434 1.00 0.00 H new ATOM 0 HB2 ALA D 52 -15.261 4.737 -16.174 1.00 0.00 H new ATOM 0 HB3 ALA D 52 -13.804 4.528 -17.176 1.00 0.00 H new ATOM 829 N GLU D 53 -11.617 6.249 -14.798 1.00 0.00 N ATOM 830 CA GLU D 53 -10.134 6.356 -14.753 1.00 0.00 C ATOM 831 C GLU D 53 -9.574 5.311 -13.793 1.00 0.00 C ATOM 832 O GLU D 53 -10.284 4.729 -12.998 1.00 0.00 O ATOM 833 CB GLU D 53 -9.736 7.753 -14.270 1.00 0.00 C ATOM 834 CG GLU D 53 -9.281 8.594 -15.466 1.00 0.00 C ATOM 835 CD GLU D 53 -7.875 9.142 -15.208 1.00 0.00 C ATOM 836 OE1 GLU D 53 -7.384 8.969 -14.104 1.00 0.00 O ATOM 837 OE2 GLU D 53 -7.314 9.726 -16.120 1.00 0.00 O ATOM 0 H GLU D 53 -12.067 6.067 -13.901 1.00 0.00 H new ATOM 0 HA GLU D 53 -9.730 6.186 -15.751 1.00 0.00 H new ATOM 0 HB2 GLU D 53 -10.580 8.233 -13.774 1.00 0.00 H new ATOM 0 HB3 GLU D 53 -8.934 7.681 -13.536 1.00 0.00 H new ATOM 0 HG2 GLU D 53 -9.285 7.987 -16.372 1.00 0.00 H new ATOM 0 HG3 GLU D 53 -9.977 9.416 -15.630 1.00 0.00 H new ATOM 844 N GLU D 54 -8.297 5.084 -13.858 1.00 0.00 N ATOM 845 CA GLU D 54 -7.661 4.091 -12.951 1.00 0.00 C ATOM 846 C GLU D 54 -6.612 4.816 -12.114 1.00 0.00 C ATOM 847 O GLU D 54 -5.886 5.654 -12.611 1.00 0.00 O ATOM 848 CB GLU D 54 -6.997 2.983 -13.770 1.00 0.00 C ATOM 849 CG GLU D 54 -6.828 1.735 -12.899 1.00 0.00 C ATOM 850 CD GLU D 54 -7.638 0.577 -13.490 1.00 0.00 C ATOM 851 OE1 GLU D 54 -8.178 0.746 -14.571 1.00 0.00 O ATOM 852 OE2 GLU D 54 -7.703 -0.460 -12.851 1.00 0.00 O ATOM 0 H GLU D 54 -7.659 5.547 -14.506 1.00 0.00 H new ATOM 0 HA GLU D 54 -8.413 3.638 -12.305 1.00 0.00 H new ATOM 0 HB2 GLU D 54 -7.604 2.749 -14.645 1.00 0.00 H new ATOM 0 HB3 GLU D 54 -6.026 3.318 -14.136 1.00 0.00 H new ATOM 0 HG2 GLU D 54 -5.775 1.461 -12.840 1.00 0.00 H new ATOM 0 HG3 GLU D 54 -7.161 1.942 -11.882 1.00 0.00 H new ATOM 859 N VAL D 55 -6.535 4.519 -10.849 1.00 0.00 N ATOM 860 CA VAL D 55 -5.543 5.220 -9.992 1.00 0.00 C ATOM 861 C VAL D 55 -5.238 4.361 -8.767 1.00 0.00 C ATOM 862 O VAL D 55 -6.057 4.207 -7.882 1.00 0.00 O ATOM 863 CB VAL D 55 -6.111 6.576 -9.542 1.00 0.00 C ATOM 864 CG1 VAL D 55 -5.046 7.657 -9.721 1.00 0.00 C ATOM 865 CG2 VAL D 55 -7.339 6.942 -10.385 1.00 0.00 C ATOM 0 H VAL D 55 -7.112 3.825 -10.374 1.00 0.00 H new ATOM 0 HA VAL D 55 -4.627 5.386 -10.559 1.00 0.00 H new ATOM 0 HB VAL D 55 -6.401 6.506 -8.494 1.00 0.00 H new ATOM 0 HG11 VAL D 55 -5.447 8.619 -9.402 1.00 0.00 H new ATOM 0 HG12 VAL D 55 -4.172 7.410 -9.118 1.00 0.00 H new ATOM 0 HG13 VAL D 55 -4.758 7.714 -10.771 1.00 0.00 H new ATOM 0 HG21 VAL D 55 -7.732 7.904 -10.057 1.00 0.00 H new ATOM 0 HG22 VAL D 55 -7.054 7.006 -11.435 1.00 0.00 H new ATOM 0 HG23 VAL D 55 -8.105 6.176 -10.263 1.00 0.00 H new ATOM 875 N LYS D 56 -4.066 3.796 -8.712 1.00 0.00 N ATOM 876 CA LYS D 56 -3.708 2.942 -7.550 1.00 0.00 C ATOM 877 C LYS D 56 -2.182 2.945 -7.377 1.00 0.00 C ATOM 878 O LYS D 56 -1.458 2.700 -8.322 1.00 0.00 O ATOM 879 CB LYS D 56 -4.199 1.519 -7.818 1.00 0.00 C ATOM 880 CG LYS D 56 -3.698 0.587 -6.714 1.00 0.00 C ATOM 881 CD LYS D 56 -4.623 0.695 -5.500 1.00 0.00 C ATOM 882 CE LYS D 56 -3.940 0.077 -4.281 1.00 0.00 C ATOM 883 NZ LYS D 56 -3.265 -1.190 -4.679 1.00 0.00 N ATOM 0 H LYS D 56 -3.340 3.889 -9.423 1.00 0.00 H new ATOM 0 HA LYS D 56 -4.173 3.323 -6.641 1.00 0.00 H new ATOM 0 HB2 LYS D 56 -5.288 1.501 -7.857 1.00 0.00 H new ATOM 0 HB3 LYS D 56 -3.840 1.176 -8.788 1.00 0.00 H new ATOM 0 HG2 LYS D 56 -3.672 -0.441 -7.075 1.00 0.00 H new ATOM 0 HG3 LYS D 56 -2.679 0.852 -6.433 1.00 0.00 H new ATOM 0 HD2 LYS D 56 -4.863 1.740 -5.304 1.00 0.00 H new ATOM 0 HD3 LYS D 56 -5.565 0.184 -5.700 1.00 0.00 H new ATOM 0 HE2 LYS D 56 -3.212 0.774 -3.866 1.00 0.00 H new ATOM 0 HE3 LYS D 56 -4.674 -0.120 -3.500 1.00 0.00 H new ATOM 0 HZ1 LYS D 56 -3.098 -1.774 -3.835 1.00 0.00 H new ATOM 0 HZ2 LYS D 56 -3.869 -1.710 -5.347 1.00 0.00 H new ATOM 0 HZ3 LYS D 56 -2.356 -0.971 -5.133 1.00 0.00 H new ATOM 897 N PRO D 57 -1.734 3.232 -6.178 1.00 0.00 N ATOM 898 CA PRO D 57 -0.295 3.285 -5.862 1.00 0.00 C ATOM 899 C PRO D 57 0.281 1.876 -5.701 1.00 0.00 C ATOM 900 O PRO D 57 -0.435 0.921 -5.475 1.00 0.00 O ATOM 901 CB PRO D 57 -0.246 4.050 -4.536 1.00 0.00 C ATOM 902 CG PRO D 57 -1.643 3.897 -3.891 1.00 0.00 C ATOM 903 CD PRO D 57 -2.616 3.528 -5.029 1.00 0.00 C ATOM 0 HA PRO D 57 0.294 3.759 -6.647 1.00 0.00 H new ATOM 0 HB2 PRO D 57 0.529 3.647 -3.884 1.00 0.00 H new ATOM 0 HB3 PRO D 57 -0.008 5.101 -4.702 1.00 0.00 H new ATOM 0 HG2 PRO D 57 -1.633 3.123 -3.124 1.00 0.00 H new ATOM 0 HG3 PRO D 57 -1.949 4.823 -3.405 1.00 0.00 H new ATOM 0 HD2 PRO D 57 -3.229 2.666 -4.765 1.00 0.00 H new ATOM 0 HD3 PRO D 57 -3.298 4.348 -5.252 1.00 0.00 H new ATOM 911 N PHE D 58 1.575 1.746 -5.816 1.00 0.00 N ATOM 912 CA PHE D 58 2.213 0.408 -5.671 1.00 0.00 C ATOM 913 C PHE D 58 2.471 0.128 -4.185 1.00 0.00 C ATOM 914 O PHE D 58 2.597 1.044 -3.398 1.00 0.00 O ATOM 915 CB PHE D 58 3.543 0.397 -6.430 1.00 0.00 C ATOM 916 CG PHE D 58 3.463 -0.575 -7.585 1.00 0.00 C ATOM 917 CD1 PHE D 58 2.301 -0.648 -8.361 1.00 0.00 C ATOM 918 CD2 PHE D 58 4.555 -1.401 -7.879 1.00 0.00 C ATOM 919 CE1 PHE D 58 2.230 -1.547 -9.432 1.00 0.00 C ATOM 920 CE2 PHE D 58 4.483 -2.300 -8.950 1.00 0.00 C ATOM 921 CZ PHE D 58 3.321 -2.373 -9.728 1.00 0.00 C ATOM 0 H PHE D 58 2.220 2.513 -6.005 1.00 0.00 H new ATOM 0 HA PHE D 58 1.554 -0.359 -6.078 1.00 0.00 H new ATOM 0 HB2 PHE D 58 3.770 1.397 -6.799 1.00 0.00 H new ATOM 0 HB3 PHE D 58 4.353 0.113 -5.759 1.00 0.00 H new ATOM 0 HD1 PHE D 58 1.459 -0.011 -8.134 1.00 0.00 H new ATOM 0 HD2 PHE D 58 5.452 -1.345 -7.280 1.00 0.00 H new ATOM 0 HE1 PHE D 58 1.333 -1.603 -10.030 1.00 0.00 H new ATOM 0 HE2 PHE D 58 5.325 -2.938 -9.176 1.00 0.00 H new ATOM 0 HZ PHE D 58 3.266 -3.065 -10.555 1.00 0.00 H new ATOM 931 N PRO D 59 2.543 -1.135 -3.849 1.00 0.00 N ATOM 932 CA PRO D 59 2.387 -2.238 -4.814 1.00 0.00 C ATOM 933 C PRO D 59 0.907 -2.465 -5.130 1.00 0.00 C ATOM 934 O PRO D 59 0.037 -1.855 -4.541 1.00 0.00 O ATOM 935 CB PRO D 59 2.981 -3.443 -4.078 1.00 0.00 C ATOM 936 CG PRO D 59 2.915 -3.108 -2.568 1.00 0.00 C ATOM 937 CD PRO D 59 2.789 -1.576 -2.461 1.00 0.00 C ATOM 0 HA PRO D 59 2.874 -2.046 -5.770 1.00 0.00 H new ATOM 0 HB2 PRO D 59 2.418 -4.350 -4.300 1.00 0.00 H new ATOM 0 HB3 PRO D 59 4.009 -3.622 -4.392 1.00 0.00 H new ATOM 0 HG2 PRO D 59 2.063 -3.600 -2.099 1.00 0.00 H new ATOM 0 HG3 PRO D 59 3.809 -3.460 -2.054 1.00 0.00 H new ATOM 0 HD2 PRO D 59 1.971 -1.289 -1.801 1.00 0.00 H new ATOM 0 HD3 PRO D 59 3.697 -1.129 -2.056 1.00 0.00 H new ATOM 1088 N GLN E 3 12.657 13.660 -9.009 1.00 0.00 N ATOM 1089 CA GLN E 3 13.158 12.797 -10.115 1.00 0.00 C ATOM 1090 C GLN E 3 11.988 12.007 -10.704 1.00 0.00 C ATOM 1091 O GLN E 3 11.443 11.129 -10.071 1.00 0.00 O ATOM 1092 CB GLN E 3 14.205 11.824 -9.568 1.00 0.00 C ATOM 1093 CG GLN E 3 15.592 12.237 -10.060 1.00 0.00 C ATOM 1094 CD GLN E 3 16.154 13.328 -9.146 1.00 0.00 C ATOM 1095 OE1 GLN E 3 15.732 13.462 -8.014 1.00 0.00 O ATOM 1096 NE2 GLN E 3 17.092 14.117 -9.591 1.00 0.00 N ATOM 0 HA GLN E 3 13.610 13.417 -10.889 1.00 0.00 H new ATOM 0 HB2 GLN E 3 14.180 11.821 -8.478 1.00 0.00 H new ATOM 0 HB3 GLN E 3 13.979 10.809 -9.895 1.00 0.00 H new ATOM 0 HG2 GLN E 3 16.259 11.375 -10.067 1.00 0.00 H new ATOM 0 HG3 GLN E 3 15.532 12.602 -11.085 1.00 0.00 H new ATOM 0 HE21 GLN E 3 17.446 14.004 -10.541 1.00 0.00 H new ATOM 0 HE22 GLN E 3 17.472 14.847 -8.989 1.00 0.00 H new ATOM 1105 N ARG E 4 11.593 12.313 -11.909 1.00 0.00 N ATOM 1106 CA ARG E 4 10.452 11.578 -12.524 1.00 0.00 C ATOM 1107 C ARG E 4 10.978 10.569 -13.547 1.00 0.00 C ATOM 1108 O ARG E 4 11.663 10.923 -14.486 1.00 0.00 O ATOM 1109 CB ARG E 4 9.522 12.575 -13.220 1.00 0.00 C ATOM 1110 CG ARG E 4 9.331 13.801 -12.326 1.00 0.00 C ATOM 1111 CD ARG E 4 8.612 13.388 -11.041 1.00 0.00 C ATOM 1112 NE ARG E 4 7.159 13.687 -11.169 1.00 0.00 N ATOM 1113 CZ ARG E 4 6.519 14.242 -10.177 1.00 0.00 C ATOM 1114 NH1 ARG E 4 7.002 15.311 -9.604 1.00 0.00 N ATOM 1115 NH2 ARG E 4 5.396 13.727 -9.757 1.00 0.00 N ATOM 0 H ARG E 4 12.010 13.038 -12.493 1.00 0.00 H new ATOM 0 HA ARG E 4 9.903 11.047 -11.746 1.00 0.00 H new ATOM 0 HB2 ARG E 4 9.944 12.873 -14.180 1.00 0.00 H new ATOM 0 HB3 ARG E 4 8.559 12.108 -13.426 1.00 0.00 H new ATOM 0 HG2 ARG E 4 10.298 14.245 -12.088 1.00 0.00 H new ATOM 0 HG3 ARG E 4 8.752 14.561 -12.851 1.00 0.00 H new ATOM 0 HD2 ARG E 4 8.761 12.324 -10.854 1.00 0.00 H new ATOM 0 HD3 ARG E 4 9.031 13.923 -10.189 1.00 0.00 H new ATOM 0 HE ARG E 4 6.665 13.458 -12.031 1.00 0.00 H new ATOM 0 HH11 ARG E 4 7.880 15.713 -9.932 1.00 0.00 H new ATOM 0 HH12 ARG E 4 6.501 15.744 -8.828 1.00 0.00 H new ATOM 0 HH21 ARG E 4 5.019 12.891 -10.204 1.00 0.00 H new ATOM 0 HH22 ARG E 4 4.895 14.160 -8.981 1.00 0.00 H new ATOM 1129 N ILE E 5 10.662 9.313 -13.375 1.00 0.00 N ATOM 1130 CA ILE E 5 11.140 8.281 -14.340 1.00 0.00 C ATOM 1131 C ILE E 5 10.105 7.160 -14.425 1.00 0.00 C ATOM 1132 O ILE E 5 9.444 6.841 -13.459 1.00 0.00 O ATOM 1133 CB ILE E 5 12.477 7.700 -13.866 1.00 0.00 C ATOM 1134 CG1 ILE E 5 13.256 8.761 -13.082 1.00 0.00 C ATOM 1135 CG2 ILE E 5 13.300 7.260 -15.077 1.00 0.00 C ATOM 1136 CD1 ILE E 5 12.717 8.839 -11.652 1.00 0.00 C ATOM 0 H ILE E 5 10.093 8.957 -12.607 1.00 0.00 H new ATOM 0 HA ILE E 5 11.277 8.739 -15.320 1.00 0.00 H new ATOM 0 HB ILE E 5 12.286 6.842 -13.221 1.00 0.00 H new ATOM 0 HG12 ILE E 5 14.317 8.512 -13.069 1.00 0.00 H new ATOM 0 HG13 ILE E 5 13.162 9.731 -13.570 1.00 0.00 H new ATOM 0 HG21 ILE E 5 14.251 6.847 -14.740 1.00 0.00 H new ATOM 0 HG22 ILE E 5 12.751 6.500 -15.633 1.00 0.00 H new ATOM 0 HG23 ILE E 5 13.486 8.119 -15.722 1.00 0.00 H new ATOM 0 HD11 ILE E 5 13.272 9.594 -11.095 1.00 0.00 H new ATOM 0 HD12 ILE E 5 11.661 9.108 -11.675 1.00 0.00 H new ATOM 0 HD13 ILE E 5 12.834 7.870 -11.166 1.00 0.00 H new ATOM 1148 N THR E 6 9.956 6.563 -15.574 1.00 0.00 N ATOM 1149 CA THR E 6 8.959 5.465 -15.712 1.00 0.00 C ATOM 1150 C THR E 6 9.514 4.188 -15.077 1.00 0.00 C ATOM 1151 O THR E 6 10.710 4.002 -14.977 1.00 0.00 O ATOM 1152 CB THR E 6 8.676 5.219 -17.195 1.00 0.00 C ATOM 1153 OG1 THR E 6 8.932 6.408 -17.926 1.00 0.00 O ATOM 1154 CG2 THR E 6 7.214 4.809 -17.376 1.00 0.00 C ATOM 0 H THR E 6 10.479 6.786 -16.421 1.00 0.00 H new ATOM 0 HA THR E 6 8.035 5.747 -15.208 1.00 0.00 H new ATOM 0 HB THR E 6 9.321 4.421 -17.562 1.00 0.00 H new ATOM 0 HG1 THR E 6 9.849 6.389 -18.271 1.00 0.00 H new ATOM 0 HG21 THR E 6 7.013 4.634 -18.433 1.00 0.00 H new ATOM 0 HG22 THR E 6 7.020 3.896 -16.814 1.00 0.00 H new ATOM 0 HG23 THR E 6 6.565 5.605 -17.010 1.00 0.00 H new ATOM 1162 N LEU E 7 8.653 3.307 -14.649 1.00 0.00 N ATOM 1163 CA LEU E 7 9.128 2.041 -14.022 1.00 0.00 C ATOM 1164 C LEU E 7 10.030 1.293 -15.005 1.00 0.00 C ATOM 1165 O LEU E 7 10.795 0.428 -14.627 1.00 0.00 O ATOM 1166 CB LEU E 7 7.920 1.165 -13.668 1.00 0.00 C ATOM 1167 CG LEU E 7 8.393 -0.239 -13.287 1.00 0.00 C ATOM 1168 CD1 LEU E 7 9.106 -0.191 -11.935 1.00 0.00 C ATOM 1169 CD2 LEU E 7 7.186 -1.174 -13.192 1.00 0.00 C ATOM 0 H LEU E 7 7.640 3.409 -14.706 1.00 0.00 H new ATOM 0 HA LEU E 7 9.690 2.270 -13.117 1.00 0.00 H new ATOM 0 HB2 LEU E 7 7.367 1.609 -12.841 1.00 0.00 H new ATOM 0 HB3 LEU E 7 7.237 1.111 -14.516 1.00 0.00 H new ATOM 0 HG LEU E 7 9.082 -0.607 -14.047 1.00 0.00 H new ATOM 0 HD11 LEU E 7 9.442 -1.192 -11.665 1.00 0.00 H new ATOM 0 HD12 LEU E 7 9.966 0.475 -12.001 1.00 0.00 H new ATOM 0 HD13 LEU E 7 8.418 0.178 -11.174 1.00 0.00 H new ATOM 0 HD21 LEU E 7 7.522 -2.175 -12.921 1.00 0.00 H new ATOM 0 HD22 LEU E 7 6.498 -0.804 -12.432 1.00 0.00 H new ATOM 0 HD23 LEU E 7 6.677 -1.211 -14.155 1.00 0.00 H new ATOM 1181 N LYS E 8 9.946 1.617 -16.266 1.00 0.00 N ATOM 1182 CA LYS E 8 10.795 0.918 -17.272 1.00 0.00 C ATOM 1183 C LYS E 8 12.145 1.630 -17.402 1.00 0.00 C ATOM 1184 O LYS E 8 13.161 1.010 -17.649 1.00 0.00 O ATOM 1185 CB LYS E 8 10.074 0.911 -18.625 1.00 0.00 C ATOM 1186 CG LYS E 8 10.181 2.290 -19.281 1.00 0.00 C ATOM 1187 CD LYS E 8 9.623 2.226 -20.704 1.00 0.00 C ATOM 1188 CE LYS E 8 10.722 1.769 -21.664 1.00 0.00 C ATOM 1189 NZ LYS E 8 10.190 0.702 -22.558 1.00 0.00 N ATOM 0 H LYS E 8 9.327 2.335 -16.643 1.00 0.00 H new ATOM 0 HA LYS E 8 10.970 -0.108 -16.949 1.00 0.00 H new ATOM 0 HB2 LYS E 8 10.512 0.154 -19.276 1.00 0.00 H new ATOM 0 HB3 LYS E 8 9.026 0.645 -18.487 1.00 0.00 H new ATOM 0 HG2 LYS E 8 9.629 3.026 -18.696 1.00 0.00 H new ATOM 0 HG3 LYS E 8 11.221 2.614 -19.302 1.00 0.00 H new ATOM 0 HD2 LYS E 8 8.780 1.536 -20.745 1.00 0.00 H new ATOM 0 HD3 LYS E 8 9.248 3.205 -21.003 1.00 0.00 H new ATOM 0 HE2 LYS E 8 11.075 2.613 -22.257 1.00 0.00 H new ATOM 0 HE3 LYS E 8 11.578 1.394 -21.102 1.00 0.00 H new ATOM 0 HZ1 LYS E 8 10.938 0.391 -23.211 1.00 0.00 H new ATOM 0 HZ2 LYS E 8 9.874 -0.106 -21.984 1.00 0.00 H new ATOM 0 HZ3 LYS E 8 9.387 1.075 -23.104 1.00 0.00 H new ATOM 1203 N ASP E 9 12.166 2.923 -17.239 1.00 0.00 N ATOM 1204 CA ASP E 9 13.454 3.666 -17.354 1.00 0.00 C ATOM 1205 C ASP E 9 14.291 3.429 -16.095 1.00 0.00 C ATOM 1206 O ASP E 9 15.504 3.484 -16.122 1.00 0.00 O ATOM 1207 CB ASP E 9 13.169 5.162 -17.504 1.00 0.00 C ATOM 1208 CG ASP E 9 13.107 5.522 -18.990 1.00 0.00 C ATOM 1209 OD1 ASP E 9 12.456 4.800 -19.727 1.00 0.00 O ATOM 1210 OD2 ASP E 9 13.710 6.513 -19.365 1.00 0.00 O ATOM 0 H ASP E 9 11.349 3.498 -17.031 1.00 0.00 H new ATOM 0 HA ASP E 9 14.002 3.312 -18.227 1.00 0.00 H new ATOM 0 HB2 ASP E 9 12.227 5.414 -17.018 1.00 0.00 H new ATOM 0 HB3 ASP E 9 13.948 5.743 -17.010 1.00 0.00 H new ATOM 1215 N TYR E 10 13.648 3.160 -14.994 1.00 0.00 N ATOM 1216 CA TYR E 10 14.394 2.914 -13.727 1.00 0.00 C ATOM 1217 C TYR E 10 14.896 1.469 -13.714 1.00 0.00 C ATOM 1218 O TYR E 10 15.987 1.183 -13.261 1.00 0.00 O ATOM 1219 CB TYR E 10 13.446 3.140 -12.544 1.00 0.00 C ATOM 1220 CG TYR E 10 14.221 3.174 -11.245 1.00 0.00 C ATOM 1221 CD1 TYR E 10 14.945 2.052 -10.827 1.00 0.00 C ATOM 1222 CD2 TYR E 10 14.202 4.329 -10.453 1.00 0.00 C ATOM 1223 CE1 TYR E 10 15.651 2.083 -9.619 1.00 0.00 C ATOM 1224 CE2 TYR E 10 14.909 4.360 -9.245 1.00 0.00 C ATOM 1225 CZ TYR E 10 15.634 3.237 -8.828 1.00 0.00 C ATOM 1226 OH TYR E 10 16.329 3.268 -7.636 1.00 0.00 O ATOM 0 H TYR E 10 12.633 3.099 -14.916 1.00 0.00 H new ATOM 0 HA TYR E 10 15.243 3.593 -13.652 1.00 0.00 H new ATOM 0 HB2 TYR E 10 12.906 4.077 -12.677 1.00 0.00 H new ATOM 0 HB3 TYR E 10 12.701 2.345 -12.510 1.00 0.00 H new ATOM 0 HD1 TYR E 10 14.959 1.161 -11.437 1.00 0.00 H new ATOM 0 HD2 TYR E 10 13.642 5.195 -10.774 1.00 0.00 H new ATOM 0 HE1 TYR E 10 16.209 1.216 -9.297 1.00 0.00 H new ATOM 0 HE2 TYR E 10 14.895 5.251 -8.634 1.00 0.00 H new ATOM 0 HH TYR E 10 16.212 4.144 -7.212 1.00 0.00 H new ATOM 1236 N ALA E 11 14.105 0.558 -14.201 1.00 0.00 N ATOM 1237 CA ALA E 11 14.525 -0.873 -14.211 1.00 0.00 C ATOM 1238 C ALA E 11 15.510 -1.124 -15.358 1.00 0.00 C ATOM 1239 O ALA E 11 16.270 -2.072 -15.335 1.00 0.00 O ATOM 1240 CB ALA E 11 13.293 -1.759 -14.401 1.00 0.00 C ATOM 0 H ALA E 11 13.182 0.741 -14.595 1.00 0.00 H new ATOM 0 HA ALA E 11 15.011 -1.110 -13.264 1.00 0.00 H new ATOM 0 HB1 ALA E 11 13.596 -2.806 -14.409 1.00 0.00 H new ATOM 0 HB2 ALA E 11 12.593 -1.590 -13.583 1.00 0.00 H new ATOM 0 HB3 ALA E 11 12.811 -1.514 -15.347 1.00 0.00 H new ATOM 1246 N MET E 12 15.500 -0.292 -16.364 1.00 0.00 N ATOM 1247 CA MET E 12 16.433 -0.501 -17.511 1.00 0.00 C ATOM 1248 C MET E 12 17.748 0.240 -17.266 1.00 0.00 C ATOM 1249 O MET E 12 18.819 -0.280 -17.506 1.00 0.00 O ATOM 1250 CB MET E 12 15.789 0.026 -18.796 1.00 0.00 C ATOM 1251 CG MET E 12 14.982 -1.091 -19.460 1.00 0.00 C ATOM 1252 SD MET E 12 15.157 -0.974 -21.258 1.00 0.00 S ATOM 1253 CE MET E 12 14.542 0.719 -21.438 1.00 0.00 C ATOM 0 H MET E 12 14.889 0.521 -16.442 1.00 0.00 H new ATOM 0 HA MET E 12 16.637 -1.567 -17.609 1.00 0.00 H new ATOM 0 HB2 MET E 12 15.140 0.872 -18.569 1.00 0.00 H new ATOM 0 HB3 MET E 12 16.558 0.388 -19.478 1.00 0.00 H new ATOM 0 HG2 MET E 12 15.332 -2.063 -19.112 1.00 0.00 H new ATOM 0 HG3 MET E 12 13.932 -1.011 -19.180 1.00 0.00 H new ATOM 0 HE1 MET E 12 14.050 0.827 -22.405 1.00 0.00 H new ATOM 0 HE2 MET E 12 13.829 0.934 -20.642 1.00 0.00 H new ATOM 0 HE3 MET E 12 15.376 1.418 -21.376 1.00 0.00 H new ATOM 1263 N ARG E 13 17.676 1.455 -16.804 1.00 0.00 N ATOM 1264 CA ARG E 13 18.923 2.239 -16.562 1.00 0.00 C ATOM 1265 C ARG E 13 19.555 1.832 -15.229 1.00 0.00 C ATOM 1266 O ARG E 13 20.758 1.870 -15.068 1.00 0.00 O ATOM 1267 CB ARG E 13 18.586 3.730 -16.532 1.00 0.00 C ATOM 1268 CG ARG E 13 18.408 4.238 -17.963 1.00 0.00 C ATOM 1269 CD ARG E 13 18.554 5.760 -17.987 1.00 0.00 C ATOM 1270 NE ARG E 13 19.946 6.131 -17.608 1.00 0.00 N ATOM 1271 CZ ARG E 13 20.673 6.851 -18.417 1.00 0.00 C ATOM 1272 NH1 ARG E 13 20.382 8.108 -18.612 1.00 0.00 N ATOM 1273 NH2 ARG E 13 21.692 6.314 -19.032 1.00 0.00 N ATOM 0 H ARG E 13 16.808 1.942 -16.582 1.00 0.00 H new ATOM 0 HA ARG E 13 19.632 2.036 -17.365 1.00 0.00 H new ATOM 0 HB2 ARG E 13 17.674 3.897 -15.959 1.00 0.00 H new ATOM 0 HB3 ARG E 13 19.381 4.284 -16.034 1.00 0.00 H new ATOM 0 HG2 ARG E 13 19.150 3.781 -18.617 1.00 0.00 H new ATOM 0 HG3 ARG E 13 17.428 3.950 -18.343 1.00 0.00 H new ATOM 0 HD2 ARG E 13 18.322 6.143 -18.981 1.00 0.00 H new ATOM 0 HD3 ARG E 13 17.844 6.215 -17.296 1.00 0.00 H new ATOM 0 HE ARG E 13 20.331 5.822 -16.715 1.00 0.00 H new ATOM 0 HH11 ARG E 13 19.586 8.528 -18.132 1.00 0.00 H new ATOM 0 HH12 ARG E 13 20.951 8.671 -19.245 1.00 0.00 H new ATOM 0 HH21 ARG E 13 21.920 5.331 -18.880 1.00 0.00 H new ATOM 0 HH22 ARG E 13 22.260 6.877 -19.665 1.00 0.00 H new ATOM 1287 N PHE E 14 18.760 1.450 -14.271 1.00 0.00 N ATOM 1288 CA PHE E 14 19.332 1.050 -12.955 1.00 0.00 C ATOM 1289 C PHE E 14 19.317 -0.473 -12.831 1.00 0.00 C ATOM 1290 O PHE E 14 20.061 -1.050 -12.063 1.00 0.00 O ATOM 1291 CB PHE E 14 18.499 1.664 -11.829 1.00 0.00 C ATOM 1292 CG PHE E 14 18.386 3.153 -12.048 1.00 0.00 C ATOM 1293 CD1 PHE E 14 17.557 3.653 -13.060 1.00 0.00 C ATOM 1294 CD2 PHE E 14 19.112 4.035 -11.238 1.00 0.00 C ATOM 1295 CE1 PHE E 14 17.455 5.035 -13.262 1.00 0.00 C ATOM 1296 CE2 PHE E 14 19.010 5.416 -11.440 1.00 0.00 C ATOM 1297 CZ PHE E 14 18.181 5.916 -12.452 1.00 0.00 C ATOM 0 H PHE E 14 17.744 1.397 -14.340 1.00 0.00 H new ATOM 0 HA PHE E 14 20.359 1.408 -12.883 1.00 0.00 H new ATOM 0 HB2 PHE E 14 17.507 1.212 -11.806 1.00 0.00 H new ATOM 0 HB3 PHE E 14 18.964 1.461 -10.864 1.00 0.00 H new ATOM 0 HD1 PHE E 14 16.997 2.973 -13.684 1.00 0.00 H new ATOM 0 HD2 PHE E 14 19.751 3.649 -10.457 1.00 0.00 H new ATOM 0 HE1 PHE E 14 16.816 5.421 -14.043 1.00 0.00 H new ATOM 0 HE2 PHE E 14 19.570 6.096 -10.816 1.00 0.00 H new ATOM 0 HZ PHE E 14 18.102 6.982 -12.608 1.00 0.00 H new ATOM 1307 N GLY E 15 18.475 -1.130 -13.578 1.00 0.00 N ATOM 1308 CA GLY E 15 18.416 -2.615 -13.501 1.00 0.00 C ATOM 1309 C GLY E 15 17.143 -3.036 -12.766 1.00 0.00 C ATOM 1310 O GLY E 15 16.881 -2.605 -11.661 1.00 0.00 O ATOM 0 H GLY E 15 17.825 -0.703 -14.238 1.00 0.00 H new ATOM 0 HA2 GLY E 15 18.428 -3.043 -14.503 1.00 0.00 H new ATOM 0 HA3 GLY E 15 19.293 -2.998 -12.980 1.00 0.00 H new ATOM 1314 N GLN E 16 16.348 -3.874 -13.373 1.00 0.00 N ATOM 1315 CA GLN E 16 15.092 -4.321 -12.710 1.00 0.00 C ATOM 1316 C GLN E 16 15.395 -4.730 -11.265 1.00 0.00 C ATOM 1317 O GLN E 16 14.542 -4.678 -10.402 1.00 0.00 O ATOM 1318 CB GLN E 16 14.515 -5.519 -13.469 1.00 0.00 C ATOM 1319 CG GLN E 16 14.623 -5.272 -14.975 1.00 0.00 C ATOM 1320 CD GLN E 16 15.796 -6.075 -15.539 1.00 0.00 C ATOM 1321 OE1 GLN E 16 16.578 -5.565 -16.317 1.00 0.00 O ATOM 1322 NE2 GLN E 16 15.952 -7.319 -15.176 1.00 0.00 N ATOM 0 H GLN E 16 16.514 -4.268 -14.299 1.00 0.00 H new ATOM 0 HA GLN E 16 14.369 -3.506 -12.712 1.00 0.00 H new ATOM 0 HB2 GLN E 16 15.054 -6.427 -13.200 1.00 0.00 H new ATOM 0 HB3 GLN E 16 13.473 -5.672 -13.189 1.00 0.00 H new ATOM 0 HG2 GLN E 16 13.697 -5.564 -15.470 1.00 0.00 H new ATOM 0 HG3 GLN E 16 14.768 -4.210 -15.171 1.00 0.00 H new ATOM 0 HE21 GLN E 16 15.295 -7.746 -14.523 1.00 0.00 H new ATOM 0 HE22 GLN E 16 16.731 -7.864 -15.545 1.00 0.00 H new ATOM 1331 N THR E 17 16.606 -5.138 -10.997 1.00 0.00 N ATOM 1332 CA THR E 17 16.967 -5.554 -9.611 1.00 0.00 C ATOM 1333 C THR E 17 16.943 -4.335 -8.685 1.00 0.00 C ATOM 1334 O THR E 17 16.393 -4.379 -7.601 1.00 0.00 O ATOM 1335 CB THR E 17 18.372 -6.163 -9.617 1.00 0.00 C ATOM 1336 OG1 THR E 17 18.455 -7.145 -10.642 1.00 0.00 O ATOM 1337 CG2 THR E 17 18.658 -6.813 -8.262 1.00 0.00 C ATOM 0 H THR E 17 17.362 -5.201 -11.679 1.00 0.00 H new ATOM 0 HA THR E 17 16.249 -6.292 -9.253 1.00 0.00 H new ATOM 0 HB THR E 17 19.106 -5.379 -9.801 1.00 0.00 H new ATOM 0 HG1 THR E 17 19.354 -7.535 -10.649 1.00 0.00 H new ATOM 0 HG21 THR E 17 19.659 -7.245 -8.270 1.00 0.00 H new ATOM 0 HG22 THR E 17 18.594 -6.060 -7.477 1.00 0.00 H new ATOM 0 HG23 THR E 17 17.925 -7.597 -8.073 1.00 0.00 H new ATOM 1345 N LYS E 18 17.536 -3.250 -9.098 1.00 0.00 N ATOM 1346 CA LYS E 18 17.549 -2.033 -8.238 1.00 0.00 C ATOM 1347 C LYS E 18 16.123 -1.511 -8.061 1.00 0.00 C ATOM 1348 O LYS E 18 15.719 -1.133 -6.978 1.00 0.00 O ATOM 1349 CB LYS E 18 18.409 -0.952 -8.898 1.00 0.00 C ATOM 1350 CG LYS E 18 19.887 -1.323 -8.769 1.00 0.00 C ATOM 1351 CD LYS E 18 20.722 -0.050 -8.615 1.00 0.00 C ATOM 1352 CE LYS E 18 21.972 -0.149 -9.493 1.00 0.00 C ATOM 1353 NZ LYS E 18 23.176 0.203 -8.688 1.00 0.00 N ATOM 0 H LYS E 18 18.013 -3.153 -9.994 1.00 0.00 H new ATOM 0 HA LYS E 18 17.964 -2.285 -7.262 1.00 0.00 H new ATOM 0 HB2 LYS E 18 18.140 -0.850 -9.949 1.00 0.00 H new ATOM 0 HB3 LYS E 18 18.223 0.013 -8.426 1.00 0.00 H new ATOM 0 HG2 LYS E 18 20.035 -1.974 -7.908 1.00 0.00 H new ATOM 0 HG3 LYS E 18 20.211 -1.879 -9.649 1.00 0.00 H new ATOM 0 HD2 LYS E 18 20.132 0.821 -8.901 1.00 0.00 H new ATOM 0 HD3 LYS E 18 21.007 0.086 -7.572 1.00 0.00 H new ATOM 0 HE2 LYS E 18 22.070 -1.159 -9.891 1.00 0.00 H new ATOM 0 HE3 LYS E 18 21.883 0.523 -10.347 1.00 0.00 H new ATOM 0 HZ1 LYS E 18 24.025 0.136 -9.285 1.00 0.00 H new ATOM 0 HZ2 LYS E 18 23.082 1.174 -8.329 1.00 0.00 H new ATOM 0 HZ3 LYS E 18 23.263 -0.455 -7.887 1.00 0.00 H new ATOM 1367 N THR E 19 15.358 -1.484 -9.114 1.00 0.00 N ATOM 1368 CA THR E 19 13.959 -0.984 -9.007 1.00 0.00 C ATOM 1369 C THR E 19 13.195 -1.819 -7.977 1.00 0.00 C ATOM 1370 O THR E 19 12.429 -1.302 -7.188 1.00 0.00 O ATOM 1371 CB THR E 19 13.265 -1.102 -10.367 1.00 0.00 C ATOM 1372 OG1 THR E 19 14.171 -0.729 -11.393 1.00 0.00 O ATOM 1373 CG2 THR E 19 12.040 -0.184 -10.400 1.00 0.00 C ATOM 0 H THR E 19 15.640 -1.787 -10.046 1.00 0.00 H new ATOM 0 HA THR E 19 13.973 0.060 -8.694 1.00 0.00 H new ATOM 0 HB THR E 19 12.945 -2.132 -10.524 1.00 0.00 H new ATOM 0 HG1 THR E 19 14.798 -0.059 -11.048 1.00 0.00 H new ATOM 0 HG21 THR E 19 11.547 -0.269 -11.369 1.00 0.00 H new ATOM 0 HG22 THR E 19 11.345 -0.476 -9.613 1.00 0.00 H new ATOM 0 HG23 THR E 19 12.354 0.848 -10.242 1.00 0.00 H new ATOM 1381 N ALA E 20 13.389 -3.110 -7.988 1.00 0.00 N ATOM 1382 CA ALA E 20 12.665 -3.983 -7.020 1.00 0.00 C ATOM 1383 C ALA E 20 13.335 -3.910 -5.646 1.00 0.00 C ATOM 1384 O ALA E 20 12.780 -4.342 -4.653 1.00 0.00 O ATOM 1385 CB ALA E 20 12.693 -5.429 -7.523 1.00 0.00 C ATOM 0 H ALA E 20 14.018 -3.598 -8.626 1.00 0.00 H new ATOM 0 HA ALA E 20 11.633 -3.642 -6.932 1.00 0.00 H new ATOM 0 HB1 ALA E 20 12.164 -6.070 -6.817 1.00 0.00 H new ATOM 0 HB2 ALA E 20 12.208 -5.485 -8.498 1.00 0.00 H new ATOM 0 HB3 ALA E 20 13.727 -5.763 -7.613 1.00 0.00 H new ATOM 1391 N LYS E 21 14.522 -3.373 -5.572 1.00 0.00 N ATOM 1392 CA LYS E 21 15.211 -3.286 -4.254 1.00 0.00 C ATOM 1393 C LYS E 21 14.735 -2.042 -3.504 1.00 0.00 C ATOM 1394 O LYS E 21 14.590 -2.051 -2.297 1.00 0.00 O ATOM 1395 CB LYS E 21 16.724 -3.207 -4.467 1.00 0.00 C ATOM 1396 CG LYS E 21 17.414 -4.283 -3.626 1.00 0.00 C ATOM 1397 CD LYS E 21 18.572 -3.658 -2.846 1.00 0.00 C ATOM 1398 CE LYS E 21 18.056 -2.474 -2.026 1.00 0.00 C ATOM 1399 NZ LYS E 21 18.295 -2.729 -0.577 1.00 0.00 N ATOM 0 H LYS E 21 15.042 -2.993 -6.363 1.00 0.00 H new ATOM 0 HA LYS E 21 14.974 -4.174 -3.667 1.00 0.00 H new ATOM 0 HB2 LYS E 21 16.961 -3.347 -5.522 1.00 0.00 H new ATOM 0 HB3 LYS E 21 17.091 -2.220 -4.186 1.00 0.00 H new ATOM 0 HG2 LYS E 21 16.700 -4.735 -2.937 1.00 0.00 H new ATOM 0 HG3 LYS E 21 17.784 -5.081 -4.270 1.00 0.00 H new ATOM 0 HD2 LYS E 21 19.023 -4.400 -2.188 1.00 0.00 H new ATOM 0 HD3 LYS E 21 19.350 -3.326 -3.533 1.00 0.00 H new ATOM 0 HE2 LYS E 21 18.561 -1.558 -2.333 1.00 0.00 H new ATOM 0 HE3 LYS E 21 16.992 -2.328 -2.209 1.00 0.00 H new ATOM 0 HZ1 LYS E 21 17.944 -1.924 -0.020 1.00 0.00 H new ATOM 0 HZ2 LYS E 21 17.794 -3.594 -0.289 1.00 0.00 H new ATOM 0 HZ3 LYS E 21 19.314 -2.848 -0.409 1.00 0.00 H new ATOM 1413 N ASP E 22 14.490 -0.974 -4.205 1.00 0.00 N ATOM 1414 CA ASP E 22 14.021 0.267 -3.529 1.00 0.00 C ATOM 1415 C ASP E 22 12.506 0.196 -3.335 1.00 0.00 C ATOM 1416 O ASP E 22 11.960 0.773 -2.415 1.00 0.00 O ATOM 1417 CB ASP E 22 14.374 1.480 -4.390 1.00 0.00 C ATOM 1418 CG ASP E 22 15.593 2.188 -3.796 1.00 0.00 C ATOM 1419 OD1 ASP E 22 15.702 2.218 -2.581 1.00 0.00 O ATOM 1420 OD2 ASP E 22 16.396 2.688 -4.565 1.00 0.00 O ATOM 0 H ASP E 22 14.594 -0.905 -5.217 1.00 0.00 H new ATOM 0 HA ASP E 22 14.506 0.361 -2.558 1.00 0.00 H new ATOM 0 HB2 ASP E 22 14.585 1.165 -5.412 1.00 0.00 H new ATOM 0 HB3 ASP E 22 13.528 2.166 -4.436 1.00 0.00 H new ATOM 1425 N LEU E 23 11.822 -0.511 -4.191 1.00 0.00 N ATOM 1426 CA LEU E 23 10.344 -0.623 -4.055 1.00 0.00 C ATOM 1427 C LEU E 23 10.001 -1.835 -3.186 1.00 0.00 C ATOM 1428 O LEU E 23 8.907 -1.950 -2.668 1.00 0.00 O ATOM 1429 CB LEU E 23 9.715 -0.789 -5.439 1.00 0.00 C ATOM 1430 CG LEU E 23 9.636 0.577 -6.125 1.00 0.00 C ATOM 1431 CD1 LEU E 23 9.835 0.407 -7.631 1.00 0.00 C ATOM 1432 CD2 LEU E 23 8.265 1.202 -5.861 1.00 0.00 C ATOM 0 H LEU E 23 12.224 -1.017 -4.980 1.00 0.00 H new ATOM 0 HA LEU E 23 9.953 0.280 -3.586 1.00 0.00 H new ATOM 0 HB2 LEU E 23 10.308 -1.477 -6.041 1.00 0.00 H new ATOM 0 HB3 LEU E 23 8.719 -1.222 -5.349 1.00 0.00 H new ATOM 0 HG LEU E 23 10.416 1.226 -5.727 1.00 0.00 H new ATOM 0 HD11 LEU E 23 9.778 1.381 -8.118 1.00 0.00 H new ATOM 0 HD12 LEU E 23 10.812 -0.037 -7.821 1.00 0.00 H new ATOM 0 HD13 LEU E 23 9.057 -0.244 -8.030 1.00 0.00 H new ATOM 0 HD21 LEU E 23 8.208 2.175 -6.349 1.00 0.00 H new ATOM 0 HD22 LEU E 23 7.486 0.551 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU E 23 8.122 1.326 -4.788 1.00 0.00 H new ATOM 1444 N GLY E 24 10.927 -2.742 -3.021 1.00 0.00 N ATOM 1445 CA GLY E 24 10.650 -3.944 -2.185 1.00 0.00 C ATOM 1446 C GLY E 24 10.051 -5.050 -3.056 1.00 0.00 C ATOM 1447 O GLY E 24 10.273 -6.222 -2.824 1.00 0.00 O ATOM 0 H GLY E 24 11.861 -2.702 -3.429 1.00 0.00 H new ATOM 0 HA2 GLY E 24 11.570 -4.294 -1.718 1.00 0.00 H new ATOM 0 HA3 GLY E 24 9.961 -3.688 -1.380 1.00 0.00 H new ATOM 1451 N VAL E 25 9.293 -4.690 -4.055 1.00 0.00 N ATOM 1452 CA VAL E 25 8.682 -5.724 -4.937 1.00 0.00 C ATOM 1453 C VAL E 25 9.776 -6.665 -5.450 1.00 0.00 C ATOM 1454 O VAL E 25 10.917 -6.585 -5.040 1.00 0.00 O ATOM 1455 CB VAL E 25 7.994 -5.043 -6.120 1.00 0.00 C ATOM 1456 CG1 VAL E 25 6.608 -4.557 -5.691 1.00 0.00 C ATOM 1457 CG2 VAL E 25 8.830 -3.845 -6.574 1.00 0.00 C ATOM 0 H VAL E 25 9.070 -3.725 -4.299 1.00 0.00 H new ATOM 0 HA VAL E 25 7.946 -6.297 -4.373 1.00 0.00 H new ATOM 0 HB VAL E 25 7.896 -5.753 -6.941 1.00 0.00 H new ATOM 0 HG11 VAL E 25 6.116 -4.071 -6.534 1.00 0.00 H new ATOM 0 HG12 VAL E 25 6.010 -5.407 -5.363 1.00 0.00 H new ATOM 0 HG13 VAL E 25 6.709 -3.846 -4.871 1.00 0.00 H new ATOM 0 HG21 VAL E 25 8.340 -3.358 -7.418 1.00 0.00 H new ATOM 0 HG22 VAL E 25 8.926 -3.136 -5.752 1.00 0.00 H new ATOM 0 HG23 VAL E 25 9.820 -4.186 -6.876 1.00 0.00 H new ATOM 1467 N TYR E 26 9.440 -7.557 -6.342 1.00 0.00 N ATOM 1468 CA TYR E 26 10.466 -8.498 -6.874 1.00 0.00 C ATOM 1469 C TYR E 26 10.711 -8.209 -8.356 1.00 0.00 C ATOM 1470 O TYR E 26 9.943 -7.525 -9.004 1.00 0.00 O ATOM 1471 CB TYR E 26 9.988 -9.946 -6.704 1.00 0.00 C ATOM 1472 CG TYR E 26 8.478 -9.999 -6.714 1.00 0.00 C ATOM 1473 CD1 TYR E 26 7.755 -9.550 -5.603 1.00 0.00 C ATOM 1474 CD2 TYR E 26 7.802 -10.499 -7.835 1.00 0.00 C ATOM 1475 CE1 TYR E 26 6.356 -9.602 -5.610 1.00 0.00 C ATOM 1476 CE2 TYR E 26 6.403 -10.551 -7.841 1.00 0.00 C ATOM 1477 CZ TYR E 26 5.679 -10.103 -6.729 1.00 0.00 C ATOM 1478 OH TYR E 26 4.301 -10.154 -6.736 1.00 0.00 O ATOM 0 H TYR E 26 8.502 -7.675 -6.724 1.00 0.00 H new ATOM 0 HA TYR E 26 11.395 -8.362 -6.320 1.00 0.00 H new ATOM 0 HB2 TYR E 26 10.387 -10.565 -7.507 1.00 0.00 H new ATOM 0 HB3 TYR E 26 10.368 -10.355 -5.768 1.00 0.00 H new ATOM 0 HD1 TYR E 26 8.276 -9.163 -4.740 1.00 0.00 H new ATOM 0 HD2 TYR E 26 8.360 -10.844 -8.693 1.00 0.00 H new ATOM 0 HE1 TYR E 26 5.799 -9.256 -4.752 1.00 0.00 H new ATOM 0 HE2 TYR E 26 5.881 -10.937 -8.704 1.00 0.00 H new ATOM 0 HH TYR E 26 3.992 -10.527 -7.588 1.00 0.00 H new ATOM 1488 N GLN E 27 11.783 -8.722 -8.897 1.00 0.00 N ATOM 1489 CA GLN E 27 12.092 -8.475 -10.334 1.00 0.00 C ATOM 1490 C GLN E 27 11.036 -9.142 -11.219 1.00 0.00 C ATOM 1491 O GLN E 27 10.857 -8.780 -12.365 1.00 0.00 O ATOM 1492 CB GLN E 27 13.471 -9.052 -10.662 1.00 0.00 C ATOM 1493 CG GLN E 27 14.552 -8.206 -9.987 1.00 0.00 C ATOM 1494 CD GLN E 27 15.403 -9.093 -9.078 1.00 0.00 C ATOM 1495 OE1 GLN E 27 15.176 -9.158 -7.886 1.00 0.00 O ATOM 1496 NE2 GLN E 27 16.382 -9.785 -9.594 1.00 0.00 N ATOM 0 H GLN E 27 12.460 -9.304 -8.403 1.00 0.00 H new ATOM 0 HA GLN E 27 12.088 -7.401 -10.522 1.00 0.00 H new ATOM 0 HB2 GLN E 27 13.536 -10.085 -10.319 1.00 0.00 H new ATOM 0 HB3 GLN E 27 13.625 -9.064 -11.741 1.00 0.00 H new ATOM 0 HG2 GLN E 27 15.180 -7.731 -10.741 1.00 0.00 H new ATOM 0 HG3 GLN E 27 14.092 -7.407 -9.406 1.00 0.00 H new ATOM 0 HE21 GLN E 27 16.573 -9.731 -10.595 1.00 0.00 H new ATOM 0 HE22 GLN E 27 16.956 -10.380 -8.997 1.00 0.00 H new ATOM 1505 N SER E 28 10.335 -10.115 -10.703 1.00 0.00 N ATOM 1506 CA SER E 28 9.296 -10.799 -11.524 1.00 0.00 C ATOM 1507 C SER E 28 8.060 -9.903 -11.637 1.00 0.00 C ATOM 1508 O SER E 28 7.286 -10.011 -12.568 1.00 0.00 O ATOM 1509 CB SER E 28 8.907 -12.120 -10.859 1.00 0.00 C ATOM 1510 OG SER E 28 8.663 -13.097 -11.864 1.00 0.00 O ATOM 0 H SER E 28 10.437 -10.465 -9.750 1.00 0.00 H new ATOM 0 HA SER E 28 9.694 -10.996 -12.519 1.00 0.00 H new ATOM 0 HB2 SER E 28 9.704 -12.455 -10.195 1.00 0.00 H new ATOM 0 HB3 SER E 28 8.017 -11.983 -10.245 1.00 0.00 H new ATOM 0 HG SER E 28 8.415 -13.946 -11.442 1.00 0.00 H new ATOM 1516 N ALA E 29 7.874 -9.012 -10.703 1.00 0.00 N ATOM 1517 CA ALA E 29 6.691 -8.108 -10.762 1.00 0.00 C ATOM 1518 C ALA E 29 7.029 -6.923 -11.659 1.00 0.00 C ATOM 1519 O ALA E 29 6.189 -6.399 -12.364 1.00 0.00 O ATOM 1520 CB ALA E 29 6.359 -7.607 -9.356 1.00 0.00 C ATOM 0 H ALA E 29 8.489 -8.871 -9.902 1.00 0.00 H new ATOM 0 HA ALA E 29 5.831 -8.645 -11.161 1.00 0.00 H new ATOM 0 HB1 ALA E 29 5.494 -6.946 -9.400 1.00 0.00 H new ATOM 0 HB2 ALA E 29 6.134 -8.456 -8.711 1.00 0.00 H new ATOM 0 HB3 ALA E 29 7.212 -7.061 -8.953 1.00 0.00 H new ATOM 1526 N ILE E 30 8.261 -6.507 -11.639 1.00 0.00 N ATOM 1527 CA ILE E 30 8.676 -5.365 -12.490 1.00 0.00 C ATOM 1528 C ILE E 30 8.765 -5.838 -13.943 1.00 0.00 C ATOM 1529 O ILE E 30 8.561 -5.080 -14.870 1.00 0.00 O ATOM 1530 CB ILE E 30 10.042 -4.864 -12.019 1.00 0.00 C ATOM 1531 CG1 ILE E 30 9.870 -4.063 -10.726 1.00 0.00 C ATOM 1532 CG2 ILE E 30 10.661 -3.973 -13.091 1.00 0.00 C ATOM 1533 CD1 ILE E 30 11.140 -4.178 -9.882 1.00 0.00 C ATOM 0 H ILE E 30 9.002 -6.912 -11.066 1.00 0.00 H new ATOM 0 HA ILE E 30 7.951 -4.554 -12.417 1.00 0.00 H new ATOM 0 HB ILE E 30 10.697 -5.716 -11.838 1.00 0.00 H new ATOM 0 HG12 ILE E 30 9.668 -3.017 -10.958 1.00 0.00 H new ATOM 0 HG13 ILE E 30 9.013 -4.437 -10.166 1.00 0.00 H new ATOM 0 HG21 ILE E 30 11.634 -3.618 -12.752 1.00 0.00 H new ATOM 0 HG22 ILE E 30 10.784 -4.543 -14.012 1.00 0.00 H new ATOM 0 HG23 ILE E 30 10.008 -3.120 -13.277 1.00 0.00 H new ATOM 0 HD11 ILE E 30 11.018 -3.608 -8.961 1.00 0.00 H new ATOM 0 HD12 ILE E 30 11.322 -5.225 -9.639 1.00 0.00 H new ATOM 0 HD13 ILE E 30 11.987 -3.783 -10.443 1.00 0.00 H new ATOM 1545 N ASN E 31 9.062 -7.093 -14.145 1.00 0.00 N ATOM 1546 CA ASN E 31 9.159 -7.623 -15.533 1.00 0.00 C ATOM 1547 C ASN E 31 7.753 -7.780 -16.113 1.00 0.00 C ATOM 1548 O ASN E 31 7.489 -7.402 -17.236 1.00 0.00 O ATOM 1549 CB ASN E 31 9.855 -8.985 -15.514 1.00 0.00 C ATOM 1550 CG ASN E 31 11.215 -8.876 -16.203 1.00 0.00 C ATOM 1551 OD1 ASN E 31 12.200 -8.538 -15.578 1.00 0.00 O ATOM 1552 ND2 ASN E 31 11.312 -9.151 -17.474 1.00 0.00 N ATOM 0 H ASN E 31 9.242 -7.774 -13.407 1.00 0.00 H new ATOM 0 HA ASN E 31 9.735 -6.931 -16.147 1.00 0.00 H new ATOM 0 HB2 ASN E 31 9.983 -9.325 -14.486 1.00 0.00 H new ATOM 0 HB3 ASN E 31 9.238 -9.727 -16.021 1.00 0.00 H new ATOM 0 HD21 ASN E 31 12.215 -9.082 -17.943 1.00 0.00 H new ATOM 0 HD22 ASN E 31 10.485 -9.435 -17.999 1.00 0.00 H new ATOM 1559 N LYS E 32 6.847 -8.335 -15.355 1.00 0.00 N ATOM 1560 CA LYS E 32 5.460 -8.515 -15.864 1.00 0.00 C ATOM 1561 C LYS E 32 4.778 -7.152 -15.986 1.00 0.00 C ATOM 1562 O LYS E 32 3.931 -6.944 -16.834 1.00 0.00 O ATOM 1563 CB LYS E 32 4.668 -9.394 -14.897 1.00 0.00 C ATOM 1564 CG LYS E 32 4.419 -8.620 -13.605 1.00 0.00 C ATOM 1565 CD LYS E 32 3.454 -9.406 -12.714 1.00 0.00 C ATOM 1566 CE LYS E 32 2.278 -8.510 -12.319 1.00 0.00 C ATOM 1567 NZ LYS E 32 2.179 -8.448 -10.833 1.00 0.00 N ATOM 0 H LYS E 32 7.008 -8.671 -14.406 1.00 0.00 H new ATOM 0 HA LYS E 32 5.496 -8.993 -16.843 1.00 0.00 H new ATOM 0 HB2 LYS E 32 3.720 -9.688 -15.347 1.00 0.00 H new ATOM 0 HB3 LYS E 32 5.219 -10.311 -14.686 1.00 0.00 H new ATOM 0 HG2 LYS E 32 5.360 -8.454 -13.081 1.00 0.00 H new ATOM 0 HG3 LYS E 32 4.003 -7.638 -13.832 1.00 0.00 H new ATOM 0 HD2 LYS E 32 3.091 -10.288 -13.242 1.00 0.00 H new ATOM 0 HD3 LYS E 32 3.972 -9.759 -11.822 1.00 0.00 H new ATOM 0 HE2 LYS E 32 2.416 -7.509 -12.727 1.00 0.00 H new ATOM 0 HE3 LYS E 32 1.352 -8.901 -12.740 1.00 0.00 H new ATOM 0 HZ1 LYS E 32 1.380 -7.839 -10.563 1.00 0.00 H new ATOM 0 HZ2 LYS E 32 2.028 -9.405 -10.455 1.00 0.00 H new ATOM 0 HZ3 LYS E 32 3.060 -8.056 -10.442 1.00 0.00 H new ATOM 1581 N ALA E 33 5.137 -6.220 -15.148 1.00 0.00 N ATOM 1582 CA ALA E 33 4.507 -4.871 -15.220 1.00 0.00 C ATOM 1583 C ALA E 33 4.984 -4.158 -16.485 1.00 0.00 C ATOM 1584 O ALA E 33 4.228 -3.479 -17.152 1.00 0.00 O ATOM 1585 CB ALA E 33 4.904 -4.051 -13.991 1.00 0.00 C ATOM 0 H ALA E 33 5.839 -6.333 -14.417 1.00 0.00 H new ATOM 0 HA ALA E 33 3.423 -4.977 -15.246 1.00 0.00 H new ATOM 0 HB1 ALA E 33 4.442 -3.065 -14.046 1.00 0.00 H new ATOM 0 HB2 ALA E 33 4.565 -4.560 -13.089 1.00 0.00 H new ATOM 0 HB3 ALA E 33 5.988 -3.942 -13.961 1.00 0.00 H new ATOM 1591 N ILE E 34 6.234 -4.312 -16.820 1.00 0.00 N ATOM 1592 CA ILE E 34 6.767 -3.651 -18.043 1.00 0.00 C ATOM 1593 C ILE E 34 6.333 -4.448 -19.273 1.00 0.00 C ATOM 1594 O ILE E 34 6.238 -3.924 -20.365 1.00 0.00 O ATOM 1595 CB ILE E 34 8.295 -3.612 -17.975 1.00 0.00 C ATOM 1596 CG1 ILE E 34 8.730 -2.626 -16.888 1.00 0.00 C ATOM 1597 CG2 ILE E 34 8.856 -3.162 -19.326 1.00 0.00 C ATOM 1598 CD1 ILE E 34 10.075 -3.067 -16.306 1.00 0.00 C ATOM 0 H ILE E 34 6.911 -4.868 -16.298 1.00 0.00 H new ATOM 0 HA ILE E 34 6.381 -2.634 -18.109 1.00 0.00 H new ATOM 0 HB ILE E 34 8.674 -4.606 -17.739 1.00 0.00 H new ATOM 0 HG12 ILE E 34 8.814 -1.622 -17.305 1.00 0.00 H new ATOM 0 HG13 ILE E 34 7.978 -2.582 -16.100 1.00 0.00 H new ATOM 0 HG21 ILE E 34 9.945 -3.134 -19.277 1.00 0.00 H new ATOM 0 HG22 ILE E 34 8.545 -3.863 -20.101 1.00 0.00 H new ATOM 0 HG23 ILE E 34 8.478 -2.168 -19.564 1.00 0.00 H new ATOM 0 HD11 ILE E 34 10.384 -2.365 -15.532 1.00 0.00 H new ATOM 0 HD12 ILE E 34 9.975 -4.063 -15.874 1.00 0.00 H new ATOM 0 HD13 ILE E 34 10.824 -3.088 -17.097 1.00 0.00 H new ATOM 1610 N HIS E 35 6.070 -5.714 -19.101 1.00 0.00 N ATOM 1611 CA HIS E 35 5.642 -6.554 -20.253 1.00 0.00 C ATOM 1612 C HIS E 35 4.183 -6.247 -20.594 1.00 0.00 C ATOM 1613 O HIS E 35 3.744 -6.435 -21.712 1.00 0.00 O ATOM 1614 CB HIS E 35 5.784 -8.031 -19.880 1.00 0.00 C ATOM 1615 CG HIS E 35 7.215 -8.452 -20.064 1.00 0.00 C ATOM 1616 ND1 HIS E 35 7.571 -9.768 -20.320 1.00 0.00 N ATOM 1617 CD2 HIS E 35 8.389 -7.744 -20.034 1.00 0.00 C ATOM 1618 CE1 HIS E 35 8.911 -9.808 -20.434 1.00 0.00 C ATOM 1619 NE2 HIS E 35 9.460 -8.602 -20.268 1.00 0.00 N ATOM 0 H HIS E 35 6.134 -6.204 -18.209 1.00 0.00 H new ATOM 0 HA HIS E 35 6.267 -6.336 -21.119 1.00 0.00 H new ATOM 0 HB2 HIS E 35 5.476 -8.189 -18.846 1.00 0.00 H new ATOM 0 HB3 HIS E 35 5.130 -8.640 -20.504 1.00 0.00 H new ATOM 0 HD2 HIS E 35 8.470 -6.682 -19.856 1.00 0.00 H new ATOM 0 HE1 HIS E 35 9.475 -10.707 -20.635 1.00 0.00 H new ATOM 0 HE2 HIS E 35 10.451 -8.361 -20.305 1.00 0.00 H new ATOM 1627 N ALA E 36 3.428 -5.774 -19.641 1.00 0.00 N ATOM 1628 CA ALA E 36 1.999 -5.454 -19.914 1.00 0.00 C ATOM 1629 C ALA E 36 1.906 -4.081 -20.581 1.00 0.00 C ATOM 1630 O ALA E 36 0.875 -3.701 -21.101 1.00 0.00 O ATOM 1631 CB ALA E 36 1.221 -5.435 -18.597 1.00 0.00 C ATOM 0 H ALA E 36 3.739 -5.595 -18.686 1.00 0.00 H new ATOM 0 HA ALA E 36 1.575 -6.210 -20.575 1.00 0.00 H new ATOM 0 HB1 ALA E 36 0.175 -5.201 -18.796 1.00 0.00 H new ATOM 0 HB2 ALA E 36 1.290 -6.413 -18.120 1.00 0.00 H new ATOM 0 HB3 ALA E 36 1.643 -4.678 -17.936 1.00 0.00 H new ATOM 1637 N GLY E 37 2.975 -3.333 -20.570 1.00 0.00 N ATOM 1638 CA GLY E 37 2.950 -1.984 -21.203 1.00 0.00 C ATOM 1639 C GLY E 37 1.820 -1.154 -20.592 1.00 0.00 C ATOM 1640 O GLY E 37 1.072 -0.497 -21.287 1.00 0.00 O ATOM 0 H GLY E 37 3.866 -3.598 -20.150 1.00 0.00 H new ATOM 0 HA2 GLY E 37 3.906 -1.482 -21.053 1.00 0.00 H new ATOM 0 HA3 GLY E 37 2.805 -2.078 -22.279 1.00 0.00 H new ATOM 1644 N ARG E 38 1.693 -1.179 -19.293 1.00 0.00 N ATOM 1645 CA ARG E 38 0.614 -0.393 -18.633 1.00 0.00 C ATOM 1646 C ARG E 38 1.128 1.017 -18.328 1.00 0.00 C ATOM 1647 O ARG E 38 2.043 1.502 -18.963 1.00 0.00 O ATOM 1648 CB ARG E 38 0.209 -1.089 -17.333 1.00 0.00 C ATOM 1649 CG ARG E 38 1.414 -1.155 -16.395 1.00 0.00 C ATOM 1650 CD ARG E 38 1.546 -2.570 -15.833 1.00 0.00 C ATOM 1651 NE ARG E 38 0.644 -2.721 -14.657 1.00 0.00 N ATOM 1652 CZ ARG E 38 0.475 -3.893 -14.110 1.00 0.00 C ATOM 1653 NH1 ARG E 38 1.425 -4.418 -13.387 1.00 0.00 N ATOM 1654 NH2 ARG E 38 -0.646 -4.538 -14.285 1.00 0.00 N ATOM 0 H ARG E 38 2.291 -1.711 -18.660 1.00 0.00 H new ATOM 0 HA ARG E 38 -0.251 -0.325 -19.292 1.00 0.00 H new ATOM 0 HB2 ARG E 38 -0.607 -0.546 -16.856 1.00 0.00 H new ATOM 0 HB3 ARG E 38 -0.157 -2.094 -17.544 1.00 0.00 H new ATOM 0 HG2 ARG E 38 2.322 -0.879 -16.932 1.00 0.00 H new ATOM 0 HG3 ARG E 38 1.295 -0.439 -15.582 1.00 0.00 H new ATOM 0 HD2 ARG E 38 1.290 -3.303 -16.598 1.00 0.00 H new ATOM 0 HD3 ARG E 38 2.578 -2.762 -15.541 1.00 0.00 H new ATOM 0 HE ARG E 38 0.158 -1.907 -14.279 1.00 0.00 H new ATOM 0 HH11 ARG E 38 2.300 -3.912 -13.249 1.00 0.00 H new ATOM 0 HH12 ARG E 38 1.293 -5.334 -12.959 1.00 0.00 H new ATOM 0 HH21 ARG E 38 -1.389 -4.126 -14.849 1.00 0.00 H new ATOM 0 HH22 ARG E 38 -0.779 -5.455 -13.858 1.00 0.00 H new ATOM 1668 N LYS E 39 0.547 1.682 -17.365 1.00 0.00 N ATOM 1669 CA LYS E 39 1.004 3.061 -17.030 1.00 0.00 C ATOM 1670 C LYS E 39 1.488 3.111 -15.585 1.00 0.00 C ATOM 1671 O LYS E 39 0.843 3.661 -14.714 1.00 0.00 O ATOM 1672 CB LYS E 39 -0.151 4.043 -17.227 1.00 0.00 C ATOM 1673 CG LYS E 39 -0.902 3.693 -18.515 1.00 0.00 C ATOM 1674 CD LYS E 39 0.067 3.723 -19.699 1.00 0.00 C ATOM 1675 CE LYS E 39 0.123 5.138 -20.278 1.00 0.00 C ATOM 1676 NZ LYS E 39 1.464 5.731 -20.014 1.00 0.00 N ATOM 0 H LYS E 39 -0.223 1.330 -16.797 1.00 0.00 H new ATOM 0 HA LYS E 39 1.828 3.338 -17.688 1.00 0.00 H new ATOM 0 HB2 LYS E 39 -0.829 4.000 -16.375 1.00 0.00 H new ATOM 0 HB3 LYS E 39 0.229 5.063 -17.281 1.00 0.00 H new ATOM 0 HG2 LYS E 39 -1.354 2.705 -18.427 1.00 0.00 H new ATOM 0 HG3 LYS E 39 -1.714 4.402 -18.679 1.00 0.00 H new ATOM 0 HD2 LYS E 39 1.061 3.411 -19.377 1.00 0.00 H new ATOM 0 HD3 LYS E 39 -0.256 3.018 -20.465 1.00 0.00 H new ATOM 0 HE2 LYS E 39 -0.070 5.111 -21.351 1.00 0.00 H new ATOM 0 HE3 LYS E 39 -0.654 5.757 -19.830 1.00 0.00 H new ATOM 0 HZ1 LYS E 39 1.366 6.754 -19.854 1.00 0.00 H new ATOM 0 HZ2 LYS E 39 1.880 5.287 -19.171 1.00 0.00 H new ATOM 0 HZ3 LYS E 39 2.084 5.567 -20.833 1.00 0.00 H new ATOM 1690 N ILE E 40 2.638 2.558 -15.336 1.00 0.00 N ATOM 1691 CA ILE E 40 3.201 2.585 -13.959 1.00 0.00 C ATOM 1692 C ILE E 40 4.322 3.621 -13.927 1.00 0.00 C ATOM 1693 O ILE E 40 5.420 3.378 -14.388 1.00 0.00 O ATOM 1694 CB ILE E 40 3.755 1.207 -13.591 1.00 0.00 C ATOM 1695 CG1 ILE E 40 2.594 0.254 -13.304 1.00 0.00 C ATOM 1696 CG2 ILE E 40 4.632 1.324 -12.344 1.00 0.00 C ATOM 1697 CD1 ILE E 40 3.081 -1.192 -13.409 1.00 0.00 C ATOM 0 H ILE E 40 3.217 2.085 -16.030 1.00 0.00 H new ATOM 0 HA ILE E 40 2.424 2.845 -13.240 1.00 0.00 H new ATOM 0 HB ILE E 40 4.350 0.823 -14.419 1.00 0.00 H new ATOM 0 HG12 ILE E 40 2.193 0.442 -12.308 1.00 0.00 H new ATOM 0 HG13 ILE E 40 1.784 0.428 -14.012 1.00 0.00 H new ATOM 0 HG21 ILE E 40 5.026 0.342 -12.083 1.00 0.00 H new ATOM 0 HG22 ILE E 40 5.459 2.005 -12.543 1.00 0.00 H new ATOM 0 HG23 ILE E 40 4.037 1.708 -11.515 1.00 0.00 H new ATOM 0 HD11 ILE E 40 2.253 -1.871 -13.204 1.00 0.00 H new ATOM 0 HD12 ILE E 40 3.461 -1.376 -14.414 1.00 0.00 H new ATOM 0 HD13 ILE E 40 3.877 -1.361 -12.684 1.00 0.00 H new ATOM 1709 N PHE E 41 4.046 4.781 -13.406 1.00 0.00 N ATOM 1710 CA PHE E 41 5.087 5.843 -13.368 1.00 0.00 C ATOM 1711 C PHE E 41 5.909 5.714 -12.081 1.00 0.00 C ATOM 1712 O PHE E 41 5.476 5.117 -11.116 1.00 0.00 O ATOM 1713 CB PHE E 41 4.398 7.207 -13.430 1.00 0.00 C ATOM 1714 CG PHE E 41 3.245 7.135 -14.410 1.00 0.00 C ATOM 1715 CD1 PHE E 41 3.305 6.260 -15.504 1.00 0.00 C ATOM 1716 CD2 PHE E 41 2.114 7.944 -14.227 1.00 0.00 C ATOM 1717 CE1 PHE E 41 2.238 6.196 -16.410 1.00 0.00 C ATOM 1718 CE2 PHE E 41 1.050 7.878 -15.134 1.00 0.00 C ATOM 1719 CZ PHE E 41 1.112 7.004 -16.225 1.00 0.00 C ATOM 0 H PHE E 41 3.145 5.040 -13.005 1.00 0.00 H new ATOM 0 HA PHE E 41 5.761 5.740 -14.218 1.00 0.00 H new ATOM 0 HB2 PHE E 41 4.035 7.490 -12.442 1.00 0.00 H new ATOM 0 HB3 PHE E 41 5.108 7.973 -13.740 1.00 0.00 H new ATOM 0 HD1 PHE E 41 4.174 5.635 -15.648 1.00 0.00 H new ATOM 0 HD2 PHE E 41 2.064 8.619 -13.385 1.00 0.00 H new ATOM 0 HE1 PHE E 41 2.285 5.522 -17.252 1.00 0.00 H new ATOM 0 HE2 PHE E 41 0.180 8.502 -14.992 1.00 0.00 H new ATOM 0 HZ PHE E 41 0.290 6.954 -16.924 1.00 0.00 H new ATOM 1729 N LEU E 42 7.099 6.256 -12.063 1.00 0.00 N ATOM 1730 CA LEU E 42 7.947 6.145 -10.842 1.00 0.00 C ATOM 1731 C LEU E 42 8.342 7.540 -10.352 1.00 0.00 C ATOM 1732 O LEU E 42 9.187 8.195 -10.929 1.00 0.00 O ATOM 1733 CB LEU E 42 9.213 5.350 -11.174 1.00 0.00 C ATOM 1734 CG LEU E 42 9.210 4.025 -10.409 1.00 0.00 C ATOM 1735 CD1 LEU E 42 7.998 3.192 -10.827 1.00 0.00 C ATOM 1736 CD2 LEU E 42 10.488 3.248 -10.734 1.00 0.00 C ATOM 0 H LEU E 42 7.518 6.769 -12.839 1.00 0.00 H new ATOM 0 HA LEU E 42 7.384 5.635 -10.060 1.00 0.00 H new ATOM 0 HB2 LEU E 42 9.264 5.161 -12.246 1.00 0.00 H new ATOM 0 HB3 LEU E 42 10.097 5.930 -10.910 1.00 0.00 H new ATOM 0 HG LEU E 42 9.162 4.227 -9.339 1.00 0.00 H new ATOM 0 HD11 LEU E 42 7.999 2.249 -10.280 1.00 0.00 H new ATOM 0 HD12 LEU E 42 7.084 3.741 -10.602 1.00 0.00 H new ATOM 0 HD13 LEU E 42 8.046 2.991 -11.897 1.00 0.00 H new ATOM 0 HD21 LEU E 42 10.488 2.304 -10.190 1.00 0.00 H new ATOM 0 HD22 LEU E 42 10.531 3.050 -11.805 1.00 0.00 H new ATOM 0 HD23 LEU E 42 11.357 3.837 -10.439 1.00 0.00 H new ATOM 1748 N THR E 43 7.743 7.995 -9.287 1.00 0.00 N ATOM 1749 CA THR E 43 8.089 9.341 -8.751 1.00 0.00 C ATOM 1750 C THR E 43 9.053 9.175 -7.575 1.00 0.00 C ATOM 1751 O THR E 43 8.694 8.662 -6.534 1.00 0.00 O ATOM 1752 CB THR E 43 6.816 10.044 -8.274 1.00 0.00 C ATOM 1753 OG1 THR E 43 5.925 10.201 -9.370 1.00 0.00 O ATOM 1754 CG2 THR E 43 7.173 11.415 -7.701 1.00 0.00 C ATOM 0 H THR E 43 7.027 7.491 -8.763 1.00 0.00 H new ATOM 0 HA THR E 43 8.559 9.940 -9.531 1.00 0.00 H new ATOM 0 HB THR E 43 6.337 9.445 -7.500 1.00 0.00 H new ATOM 0 HG1 THR E 43 5.108 10.650 -9.066 1.00 0.00 H new ATOM 0 HG21 THR E 43 6.266 11.915 -7.362 1.00 0.00 H new ATOM 0 HG22 THR E 43 7.856 11.291 -6.860 1.00 0.00 H new ATOM 0 HG23 THR E 43 7.653 12.018 -8.472 1.00 0.00 H new ATOM 1762 N ILE E 44 10.279 9.591 -7.736 1.00 0.00 N ATOM 1763 CA ILE E 44 11.271 9.442 -6.632 1.00 0.00 C ATOM 1764 C ILE E 44 11.370 10.748 -5.840 1.00 0.00 C ATOM 1765 O ILE E 44 11.834 11.754 -6.341 1.00 0.00 O ATOM 1766 CB ILE E 44 12.650 9.103 -7.212 1.00 0.00 C ATOM 1767 CG1 ILE E 44 12.501 8.509 -8.617 1.00 0.00 C ATOM 1768 CG2 ILE E 44 13.347 8.086 -6.306 1.00 0.00 C ATOM 1769 CD1 ILE E 44 11.477 7.371 -8.588 1.00 0.00 C ATOM 0 H ILE E 44 10.638 10.028 -8.585 1.00 0.00 H new ATOM 0 HA ILE E 44 10.943 8.638 -5.973 1.00 0.00 H new ATOM 0 HB ILE E 44 13.243 10.015 -7.271 1.00 0.00 H new ATOM 0 HG12 ILE E 44 12.182 9.281 -9.317 1.00 0.00 H new ATOM 0 HG13 ILE E 44 13.463 8.137 -8.969 1.00 0.00 H new ATOM 0 HG21 ILE E 44 14.327 7.844 -6.717 1.00 0.00 H new ATOM 0 HG22 ILE E 44 13.466 8.509 -5.308 1.00 0.00 H new ATOM 0 HG23 ILE E 44 12.745 7.179 -6.246 1.00 0.00 H new ATOM 0 HD11 ILE E 44 11.372 6.950 -9.588 1.00 0.00 H new ATOM 0 HD12 ILE E 44 11.815 6.595 -7.901 1.00 0.00 H new ATOM 0 HD13 ILE E 44 10.514 7.757 -8.254 1.00 0.00 H new ATOM 1781 N ASN E 45 10.943 10.743 -4.605 1.00 0.00 N ATOM 1782 CA ASN E 45 11.021 11.982 -3.785 1.00 0.00 C ATOM 1783 C ASN E 45 12.484 12.410 -3.649 1.00 0.00 C ATOM 1784 O ASN E 45 13.373 11.591 -3.494 1.00 0.00 O ATOM 1785 CB ASN E 45 10.437 11.719 -2.396 1.00 0.00 C ATOM 1786 CG ASN E 45 9.153 10.898 -2.528 1.00 0.00 C ATOM 1787 OD1 ASN E 45 8.553 10.854 -3.583 1.00 0.00 O ATOM 1788 ND2 ASN E 45 8.703 10.242 -1.494 1.00 0.00 N ATOM 0 H ASN E 45 10.544 9.933 -4.131 1.00 0.00 H new ATOM 0 HA ASN E 45 10.451 12.774 -4.272 1.00 0.00 H new ATOM 0 HB2 ASN E 45 11.161 11.185 -1.781 1.00 0.00 H new ATOM 0 HB3 ASN E 45 10.227 12.663 -1.894 1.00 0.00 H new ATOM 0 HD21 ASN E 45 7.847 9.692 -1.572 1.00 0.00 H new ATOM 0 HD22 ASN E 45 9.207 10.279 -0.608 1.00 0.00 H new ATOM 1795 N ALA E 46 12.732 13.692 -3.707 1.00 0.00 N ATOM 1796 CA ALA E 46 14.129 14.210 -3.590 1.00 0.00 C ATOM 1797 C ALA E 46 14.888 13.479 -2.477 1.00 0.00 C ATOM 1798 O ALA E 46 16.103 13.447 -2.470 1.00 0.00 O ATOM 1799 CB ALA E 46 14.087 15.707 -3.273 1.00 0.00 C ATOM 0 H ALA E 46 12.019 14.411 -3.832 1.00 0.00 H new ATOM 0 HA ALA E 46 14.645 14.039 -4.535 1.00 0.00 H new ATOM 0 HB1 ALA E 46 15.104 16.089 -3.187 1.00 0.00 H new ATOM 0 HB2 ALA E 46 13.568 16.234 -4.074 1.00 0.00 H new ATOM 0 HB3 ALA E 46 13.559 15.865 -2.333 1.00 0.00 H new ATOM 1805 N ASP E 47 14.195 12.893 -1.539 1.00 0.00 N ATOM 1806 CA ASP E 47 14.894 12.171 -0.438 1.00 0.00 C ATOM 1807 C ASP E 47 15.282 10.759 -0.897 1.00 0.00 C ATOM 1808 O ASP E 47 15.346 9.839 -0.105 1.00 0.00 O ATOM 1809 CB ASP E 47 13.963 12.073 0.772 1.00 0.00 C ATOM 1810 CG ASP E 47 14.331 13.154 1.789 1.00 0.00 C ATOM 1811 OD1 ASP E 47 13.784 14.241 1.694 1.00 0.00 O ATOM 1812 OD2 ASP E 47 15.156 12.879 2.644 1.00 0.00 O ATOM 0 H ASP E 47 13.176 12.883 -1.487 1.00 0.00 H new ATOM 0 HA ASP E 47 15.797 12.718 -0.168 1.00 0.00 H new ATOM 0 HB2 ASP E 47 12.926 12.193 0.457 1.00 0.00 H new ATOM 0 HB3 ASP E 47 14.045 11.087 1.228 1.00 0.00 H new ATOM 1817 N GLY E 48 15.545 10.577 -2.164 1.00 0.00 N ATOM 1818 CA GLY E 48 15.929 9.226 -2.659 1.00 0.00 C ATOM 1819 C GLY E 48 14.806 8.236 -2.358 1.00 0.00 C ATOM 1820 O GLY E 48 15.014 7.040 -2.315 1.00 0.00 O ATOM 0 H GLY E 48 15.510 11.306 -2.876 1.00 0.00 H new ATOM 0 HA2 GLY E 48 16.120 9.261 -3.732 1.00 0.00 H new ATOM 0 HA3 GLY E 48 16.853 8.901 -2.181 1.00 0.00 H new ATOM 1824 N SER E 49 13.615 8.723 -2.150 1.00 0.00 N ATOM 1825 CA SER E 49 12.479 7.805 -1.855 1.00 0.00 C ATOM 1826 C SER E 49 11.798 7.405 -3.164 1.00 0.00 C ATOM 1827 O SER E 49 11.722 8.182 -4.092 1.00 0.00 O ATOM 1828 CB SER E 49 11.473 8.514 -0.949 1.00 0.00 C ATOM 1829 OG SER E 49 11.659 8.080 0.392 1.00 0.00 O ATOM 0 H SER E 49 13.379 9.715 -2.171 1.00 0.00 H new ATOM 0 HA SER E 49 12.851 6.913 -1.352 1.00 0.00 H new ATOM 0 HB2 SER E 49 11.605 9.594 -1.015 1.00 0.00 H new ATOM 0 HB3 SER E 49 10.456 8.297 -1.276 1.00 0.00 H new ATOM 0 HG SER E 49 11.016 8.535 0.975 1.00 0.00 H new ATOM 1835 N VAL E 50 11.298 6.202 -3.248 1.00 0.00 N ATOM 1836 CA VAL E 50 10.618 5.771 -4.503 1.00 0.00 C ATOM 1837 C VAL E 50 9.104 5.803 -4.290 1.00 0.00 C ATOM 1838 O VAL E 50 8.608 5.481 -3.229 1.00 0.00 O ATOM 1839 CB VAL E 50 11.048 4.347 -4.872 1.00 0.00 C ATOM 1840 CG1 VAL E 50 10.122 3.800 -5.959 1.00 0.00 C ATOM 1841 CG2 VAL E 50 12.484 4.362 -5.400 1.00 0.00 C ATOM 0 H VAL E 50 11.330 5.502 -2.506 1.00 0.00 H new ATOM 0 HA VAL E 50 10.895 6.447 -5.312 1.00 0.00 H new ATOM 0 HB VAL E 50 10.991 3.715 -3.986 1.00 0.00 H new ATOM 0 HG11 VAL E 50 10.428 2.787 -6.222 1.00 0.00 H new ATOM 0 HG12 VAL E 50 9.097 3.785 -5.590 1.00 0.00 H new ATOM 0 HG13 VAL E 50 10.181 4.437 -6.842 1.00 0.00 H new ATOM 0 HG21 VAL E 50 12.786 3.348 -5.661 1.00 0.00 H new ATOM 0 HG22 VAL E 50 12.540 4.997 -6.285 1.00 0.00 H new ATOM 0 HG23 VAL E 50 13.150 4.752 -4.631 1.00 0.00 H new ATOM 1851 N TYR E 51 8.365 6.184 -5.294 1.00 0.00 N ATOM 1852 CA TYR E 51 6.884 6.232 -5.151 1.00 0.00 C ATOM 1853 C TYR E 51 6.240 5.963 -6.510 1.00 0.00 C ATOM 1854 O TYR E 51 5.878 6.874 -7.227 1.00 0.00 O ATOM 1855 CB TYR E 51 6.461 7.613 -4.646 1.00 0.00 C ATOM 1856 CG TYR E 51 5.086 7.522 -4.029 1.00 0.00 C ATOM 1857 CD1 TYR E 51 4.895 6.794 -2.847 1.00 0.00 C ATOM 1858 CD2 TYR E 51 4.000 8.163 -4.638 1.00 0.00 C ATOM 1859 CE1 TYR E 51 3.621 6.708 -2.276 1.00 0.00 C ATOM 1860 CE2 TYR E 51 2.725 8.077 -4.066 1.00 0.00 C ATOM 1861 CZ TYR E 51 2.535 7.350 -2.885 1.00 0.00 C ATOM 1862 OH TYR E 51 1.278 7.265 -2.322 1.00 0.00 O ATOM 0 H TYR E 51 8.723 6.464 -6.207 1.00 0.00 H new ATOM 0 HA TYR E 51 6.560 5.475 -4.436 1.00 0.00 H new ATOM 0 HB2 TYR E 51 7.178 7.979 -3.911 1.00 0.00 H new ATOM 0 HB3 TYR E 51 6.456 8.327 -5.469 1.00 0.00 H new ATOM 0 HD1 TYR E 51 5.732 6.299 -2.377 1.00 0.00 H new ATOM 0 HD2 TYR E 51 4.146 8.724 -5.549 1.00 0.00 H new ATOM 0 HE1 TYR E 51 3.475 6.146 -1.365 1.00 0.00 H new ATOM 0 HE2 TYR E 51 1.888 8.572 -4.536 1.00 0.00 H new ATOM 0 HH TYR E 51 0.640 7.768 -2.870 1.00 0.00 H new ATOM 1872 N ALA E 52 6.094 4.718 -6.871 1.00 0.00 N ATOM 1873 CA ALA E 52 5.477 4.393 -8.186 1.00 0.00 C ATOM 1874 C ALA E 52 3.958 4.530 -8.077 1.00 0.00 C ATOM 1875 O ALA E 52 3.355 4.107 -7.111 1.00 0.00 O ATOM 1876 CB ALA E 52 5.831 2.956 -8.575 1.00 0.00 C ATOM 0 H ALA E 52 6.375 3.913 -6.312 1.00 0.00 H new ATOM 0 HA ALA E 52 5.854 5.078 -8.946 1.00 0.00 H new ATOM 0 HB1 ALA E 52 5.379 2.718 -9.538 1.00 0.00 H new ATOM 0 HB2 ALA E 52 6.914 2.855 -8.647 1.00 0.00 H new ATOM 0 HB3 ALA E 52 5.452 2.270 -7.817 1.00 0.00 H new ATOM 1882 N GLU E 53 3.336 5.122 -9.058 1.00 0.00 N ATOM 1883 CA GLU E 53 1.859 5.289 -9.005 1.00 0.00 C ATOM 1884 C GLU E 53 1.233 4.682 -10.257 1.00 0.00 C ATOM 1885 O GLU E 53 1.860 4.574 -11.292 1.00 0.00 O ATOM 1886 CB GLU E 53 1.512 6.779 -8.935 1.00 0.00 C ATOM 1887 CG GLU E 53 1.432 7.220 -7.473 1.00 0.00 C ATOM 1888 CD GLU E 53 0.018 7.715 -7.165 1.00 0.00 C ATOM 1889 OE1 GLU E 53 -0.444 8.601 -7.866 1.00 0.00 O ATOM 1890 OE2 GLU E 53 -0.579 7.200 -6.235 1.00 0.00 O ATOM 0 H GLU E 53 3.787 5.497 -9.893 1.00 0.00 H new ATOM 0 HA GLU E 53 1.470 4.784 -8.121 1.00 0.00 H new ATOM 0 HB2 GLU E 53 2.267 7.363 -9.461 1.00 0.00 H new ATOM 0 HB3 GLU E 53 0.561 6.965 -9.434 1.00 0.00 H new ATOM 0 HG2 GLU E 53 1.688 6.388 -6.817 1.00 0.00 H new ATOM 0 HG3 GLU E 53 2.156 8.012 -7.281 1.00 0.00 H new ATOM 1897 N GLU E 54 -0.006 4.292 -10.168 1.00 0.00 N ATOM 1898 CA GLU E 54 -0.685 3.700 -11.349 1.00 0.00 C ATOM 1899 C GLU E 54 -1.711 4.702 -11.872 1.00 0.00 C ATOM 1900 O GLU E 54 -2.517 5.224 -11.126 1.00 0.00 O ATOM 1901 CB GLU E 54 -1.391 2.407 -10.937 1.00 0.00 C ATOM 1902 CG GLU E 54 -1.852 1.653 -12.186 1.00 0.00 C ATOM 1903 CD GLU E 54 -1.663 0.150 -11.972 1.00 0.00 C ATOM 1904 OE1 GLU E 54 -0.522 -0.280 -11.913 1.00 0.00 O ATOM 1905 OE2 GLU E 54 -2.659 -0.545 -11.869 1.00 0.00 O ATOM 0 H GLU E 54 -0.578 4.358 -9.326 1.00 0.00 H new ATOM 0 HA GLU E 54 0.044 3.474 -12.127 1.00 0.00 H new ATOM 0 HB2 GLU E 54 -0.716 1.783 -10.352 1.00 0.00 H new ATOM 0 HB3 GLU E 54 -2.246 2.635 -10.301 1.00 0.00 H new ATOM 0 HG2 GLU E 54 -2.900 1.873 -12.391 1.00 0.00 H new ATOM 0 HG3 GLU E 54 -1.281 1.982 -13.054 1.00 0.00 H new ATOM 1912 N VAL E 55 -1.684 4.989 -13.142 1.00 0.00 N ATOM 1913 CA VAL E 55 -2.653 5.972 -13.697 1.00 0.00 C ATOM 1914 C VAL E 55 -3.011 5.575 -15.129 1.00 0.00 C ATOM 1915 O VAL E 55 -2.222 5.718 -16.041 1.00 0.00 O ATOM 1916 CB VAL E 55 -2.038 7.382 -13.688 1.00 0.00 C ATOM 1917 CG1 VAL E 55 -2.982 8.335 -12.955 1.00 0.00 C ATOM 1918 CG2 VAL E 55 -0.684 7.371 -12.966 1.00 0.00 C ATOM 0 H VAL E 55 -1.035 4.587 -13.818 1.00 0.00 H new ATOM 0 HA VAL E 55 -3.553 5.976 -13.082 1.00 0.00 H new ATOM 0 HB VAL E 55 -1.891 7.709 -14.717 1.00 0.00 H new ATOM 0 HG11 VAL E 55 -2.552 9.337 -12.945 1.00 0.00 H new ATOM 0 HG12 VAL E 55 -3.944 8.358 -13.466 1.00 0.00 H new ATOM 0 HG13 VAL E 55 -3.123 7.991 -11.931 1.00 0.00 H new ATOM 0 HG21 VAL E 55 -0.262 8.376 -12.968 1.00 0.00 H new ATOM 0 HG22 VAL E 55 -0.823 7.038 -11.937 1.00 0.00 H new ATOM 0 HG23 VAL E 55 -0.004 6.691 -13.479 1.00 0.00 H new ATOM 1928 N LYS E 56 -4.196 5.065 -15.329 1.00 0.00 N ATOM 1929 CA LYS E 56 -4.607 4.644 -16.696 1.00 0.00 C ATOM 1930 C LYS E 56 -6.132 4.744 -16.818 1.00 0.00 C ATOM 1931 O LYS E 56 -6.845 4.371 -15.911 1.00 0.00 O ATOM 1932 CB LYS E 56 -4.160 3.196 -16.915 1.00 0.00 C ATOM 1933 CG LYS E 56 -4.877 2.594 -18.127 1.00 0.00 C ATOM 1934 CD LYS E 56 -3.850 2.254 -19.208 1.00 0.00 C ATOM 1935 CE LYS E 56 -4.474 1.292 -20.220 1.00 0.00 C ATOM 1936 NZ LYS E 56 -3.473 0.960 -21.272 1.00 0.00 N ATOM 0 H LYS E 56 -4.897 4.922 -14.602 1.00 0.00 H new ATOM 0 HA LYS E 56 -4.147 5.288 -17.446 1.00 0.00 H new ATOM 0 HB2 LYS E 56 -3.081 3.161 -17.068 1.00 0.00 H new ATOM 0 HB3 LYS E 56 -4.375 2.604 -16.026 1.00 0.00 H new ATOM 0 HG2 LYS E 56 -5.422 1.697 -17.832 1.00 0.00 H new ATOM 0 HG3 LYS E 56 -5.611 3.299 -18.516 1.00 0.00 H new ATOM 0 HD2 LYS E 56 -3.520 3.163 -19.710 1.00 0.00 H new ATOM 0 HD3 LYS E 56 -2.967 1.801 -18.756 1.00 0.00 H new ATOM 0 HE2 LYS E 56 -4.805 0.383 -19.718 1.00 0.00 H new ATOM 0 HE3 LYS E 56 -5.356 1.745 -20.672 1.00 0.00 H new ATOM 0 HZ1 LYS E 56 -3.897 0.306 -21.960 1.00 0.00 H new ATOM 0 HZ2 LYS E 56 -3.178 1.831 -21.758 1.00 0.00 H new ATOM 0 HZ3 LYS E 56 -2.644 0.511 -20.833 1.00 0.00 H new ATOM 1950 N PRO E 57 -6.591 5.241 -17.938 1.00 0.00 N ATOM 1951 CA PRO E 57 -8.033 5.401 -18.198 1.00 0.00 C ATOM 1952 C PRO E 57 -8.681 4.048 -18.514 1.00 0.00 C ATOM 1953 O PRO E 57 -8.012 3.040 -18.628 1.00 0.00 O ATOM 1954 CB PRO E 57 -8.080 6.337 -19.410 1.00 0.00 C ATOM 1955 CG PRO E 57 -6.706 6.217 -20.108 1.00 0.00 C ATOM 1956 CD PRO E 57 -5.722 5.685 -19.048 1.00 0.00 C ATOM 0 HA PRO E 57 -8.580 5.797 -17.343 1.00 0.00 H new ATOM 0 HB2 PRO E 57 -8.886 6.055 -20.088 1.00 0.00 H new ATOM 0 HB3 PRO E 57 -8.270 7.365 -19.100 1.00 0.00 H new ATOM 0 HG2 PRO E 57 -6.762 5.540 -20.960 1.00 0.00 H new ATOM 0 HG3 PRO E 57 -6.379 7.184 -20.490 1.00 0.00 H new ATOM 0 HD2 PRO E 57 -5.123 4.862 -19.438 1.00 0.00 H new ATOM 0 HD3 PRO E 57 -5.027 6.460 -18.725 1.00 0.00 H new ATOM 1964 N PHE E 58 -9.979 4.018 -18.643 1.00 0.00 N ATOM 1965 CA PHE E 58 -10.673 2.731 -18.937 1.00 0.00 C ATOM 1966 C PHE E 58 -11.615 2.914 -20.131 1.00 0.00 C ATOM 1967 O PHE E 58 -12.218 3.957 -20.287 1.00 0.00 O ATOM 1968 CB PHE E 58 -11.488 2.308 -17.712 1.00 0.00 C ATOM 1969 CG PHE E 58 -12.405 1.164 -18.072 1.00 0.00 C ATOM 1970 CD1 PHE E 58 -13.577 1.406 -18.799 1.00 0.00 C ATOM 1971 CD2 PHE E 58 -12.082 -0.141 -17.680 1.00 0.00 C ATOM 1972 CE1 PHE E 58 -14.426 0.343 -19.131 1.00 0.00 C ATOM 1973 CE2 PHE E 58 -12.931 -1.203 -18.013 1.00 0.00 C ATOM 1974 CZ PHE E 58 -14.102 -0.961 -18.739 1.00 0.00 C ATOM 0 H PHE E 58 -10.590 4.830 -18.557 1.00 0.00 H new ATOM 0 HA PHE E 58 -9.934 1.966 -19.173 1.00 0.00 H new ATOM 0 HB2 PHE E 58 -10.819 2.009 -16.905 1.00 0.00 H new ATOM 0 HB3 PHE E 58 -12.072 3.152 -17.345 1.00 0.00 H new ATOM 0 HD1 PHE E 58 -13.826 2.412 -19.103 1.00 0.00 H new ATOM 0 HD2 PHE E 58 -11.177 -0.328 -17.120 1.00 0.00 H new ATOM 0 HE1 PHE E 58 -15.331 0.529 -19.690 1.00 0.00 H new ATOM 0 HE2 PHE E 58 -12.682 -2.209 -17.709 1.00 0.00 H new ATOM 0 HZ PHE E 58 -14.756 -1.781 -18.997 1.00 0.00 H new ATOM 1984 N PRO E 59 -11.728 1.883 -20.928 1.00 0.00 N ATOM 1985 CA PRO E 59 -10.993 0.618 -20.732 1.00 0.00 C ATOM 1986 C PRO E 59 -9.564 0.740 -21.270 1.00 0.00 C ATOM 1987 O PRO E 59 -8.641 1.049 -20.543 1.00 0.00 O ATOM 1988 CB PRO E 59 -11.797 -0.391 -21.553 1.00 0.00 C ATOM 1989 CG PRO E 59 -12.581 0.429 -22.606 1.00 0.00 C ATOM 1990 CD PRO E 59 -12.622 1.883 -22.100 1.00 0.00 C ATOM 0 HA PRO E 59 -10.900 0.334 -19.684 1.00 0.00 H new ATOM 0 HB2 PRO E 59 -11.138 -1.113 -22.035 1.00 0.00 H new ATOM 0 HB3 PRO E 59 -12.477 -0.956 -20.916 1.00 0.00 H new ATOM 0 HG2 PRO E 59 -12.095 0.373 -23.580 1.00 0.00 H new ATOM 0 HG3 PRO E 59 -13.590 0.035 -22.730 1.00 0.00 H new ATOM 0 HD2 PRO E 59 -12.278 2.580 -22.864 1.00 0.00 H new ATOM 0 HD3 PRO E 59 -13.634 2.182 -21.829 1.00 0.00 H new