USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=23 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 31 ASN : amide:sc= -0.465 K(o=-1.2,f=-3.3!) USER MOD Set 1.2: E 35 HIS :FLIP no HD1:sc= -0.779 F(o=-2.8,f=-1.2) USER MOD Set 2.1: D 31 ASN : amide:sc= -0.654 K(o=-3.4,f=-4.3!) USER MOD Set 2.2: D 35 HIS : no HE2:sc= -2.79! K(o=-3.4!,f=-4.3) USER MOD Set 3.1: D 17 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: D 27 GLN : amide:sc= -0.187 X(o=-0.19,f=0.19) USER MOD Single : D 3 GLN : amide:sc= 0.282 K(o=0.28,f=-9.2!) USER MOD Single : D 6 THR OG1 : rot 93:sc= 0.0458 USER MOD Single : D 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 10 TYR OH : rot 180:sc= 0 USER MOD Single : D 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 16 GLN : amide:sc= -1.59! C(o=-1.6!,f=-4.2!) USER MOD Single : D 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 THR OG1 : rot -77:sc= 0.919 USER MOD Single : D 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 26 TYR OH : rot 180:sc= 0 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 180:sc= 0 USER MOD Single : D 45 ASN : amide:sc= -0.0429 X(o=-0.043,f=0) USER MOD Single : D 49 SER OG : rot 180:sc= -0.8 USER MOD Single : D 51 TYR OH : rot 180:sc= 0 USER MOD Single : D 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 3 GLN : amide:sc= 0.166 X(o=0.17,f=0) USER MOD Single : E 6 THR OG1 : rot 180:sc= 0.00317 USER MOD Single : E 8 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.00549) USER MOD Single : E 10 TYR OH : rot 180:sc= 0 USER MOD Single : E 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : E 16 GLN : amide:sc= -0.627 K(o=-0.63,f=-2.9!) USER MOD Single : E 17 THR OG1 : rot 180:sc= 0 USER MOD Single : E 18 LYS NZ :NH3+ 144:sc= -0.231 (180deg=-1.09) USER MOD Single : E 19 THR OG1 : rot -66:sc= 1.21 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 27 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : E 28 SER OG : rot 180:sc= 0 USER MOD Single : E 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 39 LYS NZ :NH3+ 161:sc= -0.417 (180deg=-1.35) USER MOD Single : E 43 THR OG1 : rot 180:sc= 0 USER MOD Single : E 45 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.4!) USER MOD Single : E 49 SER OG : rot 180:sc= -0.393 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 -18.331 17.812 -11.305 1.00 0.00 N ATOM 21 CA GLU D 2 -17.912 16.529 -11.938 1.00 0.00 C ATOM 22 C GLU D 2 -18.512 15.352 -11.165 1.00 0.00 C ATOM 23 O GLU D 2 -18.188 15.119 -10.018 1.00 0.00 O ATOM 24 CB GLU D 2 -16.385 16.427 -11.917 1.00 0.00 C ATOM 25 CG GLU D 2 -15.876 16.661 -10.493 1.00 0.00 C ATOM 26 CD GLU D 2 -14.361 16.874 -10.522 1.00 0.00 C ATOM 27 OE1 GLU D 2 -13.870 17.353 -11.531 1.00 0.00 O ATOM 28 OE2 GLU D 2 -13.719 16.553 -9.535 1.00 0.00 O ATOM 0 HA GLU D 2 -18.267 16.502 -12.968 1.00 0.00 H new ATOM 0 HB2 GLU D 2 -16.071 15.445 -12.270 1.00 0.00 H new ATOM 0 HB3 GLU D 2 -15.952 17.163 -12.595 1.00 0.00 H new ATOM 0 HG2 GLU D 2 -16.368 17.531 -10.058 1.00 0.00 H new ATOM 0 HG3 GLU D 2 -16.122 15.807 -9.862 1.00 0.00 H new ATOM 35 N GLN D 3 -19.386 14.609 -11.786 1.00 0.00 N ATOM 36 CA GLN D 3 -20.009 13.448 -11.089 1.00 0.00 C ATOM 37 C GLN D 3 -18.949 12.374 -10.831 1.00 0.00 C ATOM 38 O GLN D 3 -18.719 11.506 -11.649 1.00 0.00 O ATOM 39 CB GLN D 3 -21.120 12.866 -11.965 1.00 0.00 C ATOM 40 CG GLN D 3 -22.387 13.709 -11.810 1.00 0.00 C ATOM 41 CD GLN D 3 -22.533 14.642 -13.014 1.00 0.00 C ATOM 42 OE1 GLN D 3 -21.555 15.146 -13.530 1.00 0.00 O ATOM 43 NE2 GLN D 3 -23.723 14.895 -13.488 1.00 0.00 N ATOM 0 H GLN D 3 -19.696 14.756 -12.747 1.00 0.00 H new ATOM 0 HA GLN D 3 -20.428 13.778 -10.139 1.00 0.00 H new ATOM 0 HB2 GLN D 3 -20.805 12.852 -13.008 1.00 0.00 H new ATOM 0 HB3 GLN D 3 -21.320 11.834 -11.679 1.00 0.00 H new ATOM 0 HG2 GLN D 3 -23.260 13.061 -11.731 1.00 0.00 H new ATOM 0 HG3 GLN D 3 -22.338 14.291 -10.890 1.00 0.00 H new ATOM 0 HE21 GLN D 3 -24.545 14.472 -13.056 1.00 0.00 H new ATOM 0 HE22 GLN D 3 -23.831 15.515 -14.291 1.00 0.00 H new ATOM 52 N ARG D 4 -18.303 12.424 -9.698 1.00 0.00 N ATOM 53 CA ARG D 4 -17.261 11.405 -9.389 1.00 0.00 C ATOM 54 C ARG D 4 -17.886 10.266 -8.580 1.00 0.00 C ATOM 55 O ARG D 4 -18.245 10.431 -7.431 1.00 0.00 O ATOM 56 CB ARG D 4 -16.141 12.051 -8.570 1.00 0.00 C ATOM 57 CG ARG D 4 -15.583 13.258 -9.327 1.00 0.00 C ATOM 58 CD ARG D 4 -14.631 12.777 -10.424 1.00 0.00 C ATOM 59 NE ARG D 4 -13.478 13.716 -10.525 1.00 0.00 N ATOM 60 CZ ARG D 4 -12.486 13.624 -9.680 1.00 0.00 C ATOM 61 NH1 ARG D 4 -12.657 13.016 -8.538 1.00 0.00 N ATOM 62 NH2 ARG D 4 -11.325 14.142 -9.976 1.00 0.00 N ATOM 0 H ARG D 4 -18.452 13.126 -8.973 1.00 0.00 H new ATOM 0 HA ARG D 4 -16.852 11.012 -10.320 1.00 0.00 H new ATOM 0 HB2 ARG D 4 -16.521 12.363 -7.597 1.00 0.00 H new ATOM 0 HB3 ARG D 4 -15.348 11.327 -8.385 1.00 0.00 H new ATOM 0 HG2 ARG D 4 -16.398 13.834 -9.765 1.00 0.00 H new ATOM 0 HG3 ARG D 4 -15.057 13.921 -8.639 1.00 0.00 H new ATOM 0 HD2 ARG D 4 -14.277 11.771 -10.198 1.00 0.00 H new ATOM 0 HD3 ARG D 4 -15.155 12.723 -11.378 1.00 0.00 H new ATOM 0 HE ARG D 4 -13.463 14.430 -11.253 1.00 0.00 H new ATOM 0 HH11 ARG D 4 -13.565 12.613 -8.306 1.00 0.00 H new ATOM 0 HH12 ARG D 4 -11.883 12.944 -7.878 1.00 0.00 H new ATOM 0 HH21 ARG D 4 -11.192 14.619 -10.868 1.00 0.00 H new ATOM 0 HH22 ARG D 4 -10.551 14.070 -9.316 1.00 0.00 H new ATOM 76 N ILE D 5 -18.011 9.108 -9.170 1.00 0.00 N ATOM 77 CA ILE D 5 -18.606 7.954 -8.440 1.00 0.00 C ATOM 78 C ILE D 5 -17.892 6.676 -8.875 1.00 0.00 C ATOM 79 O ILE D 5 -17.410 6.576 -9.983 1.00 0.00 O ATOM 80 CB ILE D 5 -20.095 7.846 -8.773 1.00 0.00 C ATOM 81 CG1 ILE D 5 -20.735 9.235 -8.721 1.00 0.00 C ATOM 82 CG2 ILE D 5 -20.781 6.934 -7.755 1.00 0.00 C ATOM 83 CD1 ILE D 5 -20.760 9.839 -10.126 1.00 0.00 C ATOM 0 H ILE D 5 -17.725 8.912 -10.129 1.00 0.00 H new ATOM 0 HA ILE D 5 -18.491 8.098 -7.366 1.00 0.00 H new ATOM 0 HB ILE D 5 -20.211 7.429 -9.774 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -21.748 9.165 -8.326 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -20.173 9.881 -8.046 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -21.842 6.857 -7.992 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -20.328 5.943 -7.791 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -20.662 7.351 -6.755 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -21.216 10.828 -10.089 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -19.741 9.923 -10.504 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -21.341 9.197 -10.788 1.00 0.00 H new ATOM 95 N THR D 6 -17.814 5.699 -8.017 1.00 0.00 N ATOM 96 CA THR D 6 -17.122 4.437 -8.396 1.00 0.00 C ATOM 97 C THR D 6 -18.022 3.612 -9.321 1.00 0.00 C ATOM 98 O THR D 6 -19.233 3.652 -9.224 1.00 0.00 O ATOM 99 CB THR D 6 -16.811 3.634 -7.131 1.00 0.00 C ATOM 100 OG1 THR D 6 -16.854 4.497 -6.003 1.00 0.00 O ATOM 101 CG2 THR D 6 -15.419 3.012 -7.246 1.00 0.00 C ATOM 0 H THR D 6 -18.198 5.719 -7.072 1.00 0.00 H new ATOM 0 HA THR D 6 -16.194 4.672 -8.918 1.00 0.00 H new ATOM 0 HB THR D 6 -17.550 2.842 -7.013 1.00 0.00 H new ATOM 0 HG1 THR D 6 -17.752 4.478 -5.610 1.00 0.00 H new ATOM 0 HG21 THR D 6 -15.200 2.441 -6.344 1.00 0.00 H new ATOM 0 HG22 THR D 6 -15.387 2.350 -8.111 1.00 0.00 H new ATOM 0 HG23 THR D 6 -14.677 3.801 -7.365 1.00 0.00 H new ATOM 109 N LEU D 7 -17.438 2.865 -10.219 1.00 0.00 N ATOM 110 CA LEU D 7 -18.251 2.034 -11.154 1.00 0.00 C ATOM 111 C LEU D 7 -19.223 1.168 -10.353 1.00 0.00 C ATOM 112 O LEU D 7 -20.232 0.721 -10.859 1.00 0.00 O ATOM 113 CB LEU D 7 -17.316 1.127 -11.963 1.00 0.00 C ATOM 114 CG LEU D 7 -18.136 0.048 -12.676 1.00 0.00 C ATOM 115 CD1 LEU D 7 -19.073 0.704 -13.693 1.00 0.00 C ATOM 116 CD2 LEU D 7 -17.191 -0.914 -13.403 1.00 0.00 C ATOM 0 H LEU D 7 -16.428 2.794 -10.346 1.00 0.00 H new ATOM 0 HA LEU D 7 -18.811 2.683 -11.827 1.00 0.00 H new ATOM 0 HB2 LEU D 7 -16.761 1.718 -12.692 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -16.582 0.664 -11.304 1.00 0.00 H new ATOM 0 HG LEU D 7 -18.725 -0.503 -11.942 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -19.656 -0.065 -14.200 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -19.746 1.389 -13.178 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -18.485 1.256 -14.426 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -17.774 -1.682 -13.911 1.00 0.00 H new ATOM 0 HD22 LEU D 7 -16.602 -0.362 -14.136 1.00 0.00 H new ATOM 0 HD23 LEU D 7 -16.523 -1.383 -12.681 1.00 0.00 H new ATOM 128 N LYS D 8 -18.920 0.917 -9.112 1.00 0.00 N ATOM 129 CA LYS D 8 -19.819 0.067 -8.285 1.00 0.00 C ATOM 130 C LYS D 8 -21.008 0.892 -7.789 1.00 0.00 C ATOM 131 O LYS D 8 -22.110 0.398 -7.676 1.00 0.00 O ATOM 132 CB LYS D 8 -19.030 -0.490 -7.092 1.00 0.00 C ATOM 133 CG LYS D 8 -18.960 0.553 -5.971 1.00 0.00 C ATOM 134 CD LYS D 8 -18.024 0.060 -4.866 1.00 0.00 C ATOM 135 CE LYS D 8 -17.932 1.120 -3.768 1.00 0.00 C ATOM 136 NZ LYS D 8 -17.032 0.637 -2.682 1.00 0.00 N ATOM 0 H LYS D 8 -18.088 1.264 -8.634 1.00 0.00 H new ATOM 0 HA LYS D 8 -20.196 -0.759 -8.888 1.00 0.00 H new ATOM 0 HB2 LYS D 8 -19.506 -1.399 -6.724 1.00 0.00 H new ATOM 0 HB3 LYS D 8 -18.023 -0.763 -7.408 1.00 0.00 H new ATOM 0 HG2 LYS D 8 -18.602 1.503 -6.367 1.00 0.00 H new ATOM 0 HG3 LYS D 8 -19.956 0.732 -5.565 1.00 0.00 H new ATOM 0 HD2 LYS D 8 -18.395 -0.877 -4.452 1.00 0.00 H new ATOM 0 HD3 LYS D 8 -17.034 -0.142 -5.276 1.00 0.00 H new ATOM 0 HE2 LYS D 8 -17.552 2.054 -4.181 1.00 0.00 H new ATOM 0 HE3 LYS D 8 -18.923 1.329 -3.366 1.00 0.00 H new ATOM 0 HZ1 LYS D 8 -16.970 1.359 -1.936 1.00 0.00 H new ATOM 0 HZ2 LYS D 8 -17.413 -0.244 -2.281 1.00 0.00 H new ATOM 0 HZ3 LYS D 8 -16.084 0.459 -3.070 1.00 0.00 H new ATOM 150 N ASP D 9 -20.794 2.140 -7.486 1.00 0.00 N ATOM 151 CA ASP D 9 -21.917 2.984 -6.987 1.00 0.00 C ATOM 152 C ASP D 9 -22.808 3.412 -8.153 1.00 0.00 C ATOM 153 O ASP D 9 -23.993 3.610 -7.994 1.00 0.00 O ATOM 154 CB ASP D 9 -21.353 4.225 -6.293 1.00 0.00 C ATOM 155 CG ASP D 9 -21.611 4.130 -4.788 1.00 0.00 C ATOM 156 OD1 ASP D 9 -21.795 3.023 -4.308 1.00 0.00 O ATOM 157 OD2 ASP D 9 -21.621 5.164 -4.142 1.00 0.00 O ATOM 0 H ASP D 9 -19.893 2.613 -7.561 1.00 0.00 H new ATOM 0 HA ASP D 9 -22.510 2.406 -6.278 1.00 0.00 H new ATOM 0 HB2 ASP D 9 -20.283 4.307 -6.485 1.00 0.00 H new ATOM 0 HB3 ASP D 9 -21.819 5.124 -6.697 1.00 0.00 H new ATOM 162 N TYR D 10 -22.254 3.561 -9.322 1.00 0.00 N ATOM 163 CA TYR D 10 -23.084 3.984 -10.486 1.00 0.00 C ATOM 164 C TYR D 10 -23.876 2.790 -11.020 1.00 0.00 C ATOM 165 O TYR D 10 -24.998 2.926 -11.463 1.00 0.00 O ATOM 166 CB TYR D 10 -22.175 4.524 -11.590 1.00 0.00 C ATOM 167 CG TYR D 10 -22.982 4.737 -12.850 1.00 0.00 C ATOM 168 CD1 TYR D 10 -24.214 5.397 -12.790 1.00 0.00 C ATOM 169 CD2 TYR D 10 -22.496 4.275 -14.080 1.00 0.00 C ATOM 170 CE1 TYR D 10 -24.960 5.597 -13.958 1.00 0.00 C ATOM 171 CE2 TYR D 10 -23.242 4.474 -15.248 1.00 0.00 C ATOM 172 CZ TYR D 10 -24.473 5.135 -15.187 1.00 0.00 C ATOM 173 OH TYR D 10 -25.208 5.332 -16.338 1.00 0.00 O ATOM 0 H TYR D 10 -21.266 3.409 -9.523 1.00 0.00 H new ATOM 0 HA TYR D 10 -23.777 4.763 -10.168 1.00 0.00 H new ATOM 0 HB2 TYR D 10 -21.720 5.463 -11.274 1.00 0.00 H new ATOM 0 HB3 TYR D 10 -21.362 3.824 -11.781 1.00 0.00 H new ATOM 0 HD1 TYR D 10 -24.590 5.753 -11.842 1.00 0.00 H new ATOM 0 HD2 TYR D 10 -21.545 3.765 -14.127 1.00 0.00 H new ATOM 0 HE1 TYR D 10 -25.911 6.107 -13.911 1.00 0.00 H new ATOM 0 HE2 TYR D 10 -22.867 4.117 -16.196 1.00 0.00 H new ATOM 0 HH TYR D 10 -24.727 4.952 -17.102 1.00 0.00 H new ATOM 183 N ALA D 11 -23.298 1.625 -10.991 1.00 0.00 N ATOM 184 CA ALA D 11 -24.012 0.425 -11.510 1.00 0.00 C ATOM 185 C ALA D 11 -25.012 -0.094 -10.469 1.00 0.00 C ATOM 186 O ALA D 11 -25.998 -0.719 -10.807 1.00 0.00 O ATOM 187 CB ALA D 11 -22.993 -0.672 -11.822 1.00 0.00 C ATOM 0 H ALA D 11 -22.360 1.450 -10.630 1.00 0.00 H new ATOM 0 HA ALA D 11 -24.555 0.700 -12.415 1.00 0.00 H new ATOM 0 HB1 ALA D 11 -23.511 -1.552 -12.202 1.00 0.00 H new ATOM 0 HB2 ALA D 11 -22.290 -0.312 -12.573 1.00 0.00 H new ATOM 0 HB3 ALA D 11 -22.451 -0.934 -10.913 1.00 0.00 H new ATOM 193 N MET D 12 -24.765 0.140 -9.207 1.00 0.00 N ATOM 194 CA MET D 12 -25.707 -0.370 -8.165 1.00 0.00 C ATOM 195 C MET D 12 -26.806 0.657 -7.878 1.00 0.00 C ATOM 196 O MET D 12 -27.952 0.306 -7.674 1.00 0.00 O ATOM 197 CB MET D 12 -24.935 -0.660 -6.876 1.00 0.00 C ATOM 198 CG MET D 12 -24.880 -2.171 -6.644 1.00 0.00 C ATOM 199 SD MET D 12 -24.605 -2.500 -4.885 1.00 0.00 S ATOM 200 CE MET D 12 -25.764 -3.881 -4.728 1.00 0.00 C ATOM 0 H MET D 12 -23.960 0.657 -8.854 1.00 0.00 H new ATOM 0 HA MET D 12 -26.171 -1.284 -8.535 1.00 0.00 H new ATOM 0 HB2 MET D 12 -23.925 -0.255 -6.945 1.00 0.00 H new ATOM 0 HB3 MET D 12 -25.418 -0.169 -6.031 1.00 0.00 H new ATOM 0 HG2 MET D 12 -25.811 -2.634 -6.971 1.00 0.00 H new ATOM 0 HG3 MET D 12 -24.079 -2.612 -7.237 1.00 0.00 H new ATOM 0 HE1 MET D 12 -25.756 -4.248 -3.702 1.00 0.00 H new ATOM 0 HE2 MET D 12 -26.768 -3.544 -4.986 1.00 0.00 H new ATOM 0 HE3 MET D 12 -25.466 -4.684 -5.402 1.00 0.00 H new ATOM 210 N ARG D 13 -26.476 1.918 -7.847 1.00 0.00 N ATOM 211 CA ARG D 13 -27.517 2.947 -7.557 1.00 0.00 C ATOM 212 C ARG D 13 -28.279 3.294 -8.838 1.00 0.00 C ATOM 213 O ARG D 13 -29.401 3.758 -8.795 1.00 0.00 O ATOM 214 CB ARG D 13 -26.858 4.212 -7.002 1.00 0.00 C ATOM 215 CG ARG D 13 -26.858 4.161 -5.473 1.00 0.00 C ATOM 216 CD ARG D 13 -27.438 5.465 -4.922 1.00 0.00 C ATOM 217 NE ARG D 13 -28.162 5.188 -3.652 1.00 0.00 N ATOM 218 CZ ARG D 13 -28.792 6.151 -3.038 1.00 0.00 C ATOM 219 NH1 ARG D 13 -28.151 7.236 -2.696 1.00 0.00 N ATOM 220 NH2 ARG D 13 -30.064 6.034 -2.771 1.00 0.00 N ATOM 0 H ARG D 13 -25.536 2.281 -8.009 1.00 0.00 H new ATOM 0 HA ARG D 13 -28.212 2.546 -6.819 1.00 0.00 H new ATOM 0 HB2 ARG D 13 -25.837 4.295 -7.373 1.00 0.00 H new ATOM 0 HB3 ARG D 13 -27.395 5.096 -7.347 1.00 0.00 H new ATOM 0 HG2 ARG D 13 -27.448 3.312 -5.126 1.00 0.00 H new ATOM 0 HG3 ARG D 13 -25.843 4.016 -5.103 1.00 0.00 H new ATOM 0 HD2 ARG D 13 -26.639 6.186 -4.748 1.00 0.00 H new ATOM 0 HD3 ARG D 13 -28.116 5.910 -5.650 1.00 0.00 H new ATOM 0 HE ARG D 13 -28.166 4.246 -3.262 1.00 0.00 H new ATOM 0 HH11 ARG D 13 -27.158 7.330 -2.909 1.00 0.00 H new ATOM 0 HH12 ARG D 13 -28.643 7.989 -2.216 1.00 0.00 H new ATOM 0 HH21 ARG D 13 -30.566 5.189 -3.042 1.00 0.00 H new ATOM 0 HH22 ARG D 13 -30.556 6.788 -2.291 1.00 0.00 H new ATOM 234 N PHE D 14 -27.681 3.081 -9.977 1.00 0.00 N ATOM 235 CA PHE D 14 -28.381 3.407 -11.252 1.00 0.00 C ATOM 236 C PHE D 14 -28.659 2.121 -12.028 1.00 0.00 C ATOM 237 O PHE D 14 -29.688 1.975 -12.658 1.00 0.00 O ATOM 238 CB PHE D 14 -27.500 4.333 -12.092 1.00 0.00 C ATOM 239 CG PHE D 14 -27.056 5.505 -11.247 1.00 0.00 C ATOM 240 CD1 PHE D 14 -26.184 5.303 -10.171 1.00 0.00 C ATOM 241 CD2 PHE D 14 -27.522 6.792 -11.538 1.00 0.00 C ATOM 242 CE1 PHE D 14 -25.777 6.388 -9.387 1.00 0.00 C ATOM 243 CE2 PHE D 14 -27.114 7.877 -10.754 1.00 0.00 C ATOM 244 CZ PHE D 14 -26.241 7.677 -9.679 1.00 0.00 C ATOM 0 H PHE D 14 -26.742 2.697 -10.081 1.00 0.00 H new ATOM 0 HA PHE D 14 -29.325 3.905 -11.031 1.00 0.00 H new ATOM 0 HB2 PHE D 14 -26.632 3.789 -12.464 1.00 0.00 H new ATOM 0 HB3 PHE D 14 -28.052 4.687 -12.963 1.00 0.00 H new ATOM 0 HD1 PHE D 14 -25.825 4.310 -9.946 1.00 0.00 H new ATOM 0 HD2 PHE D 14 -28.196 6.948 -12.367 1.00 0.00 H new ATOM 0 HE1 PHE D 14 -25.105 6.232 -8.556 1.00 0.00 H new ATOM 0 HE2 PHE D 14 -27.474 8.870 -10.979 1.00 0.00 H new ATOM 0 HZ PHE D 14 -25.925 8.515 -9.075 1.00 0.00 H new ATOM 254 N GLY D 15 -27.753 1.186 -11.987 1.00 0.00 N ATOM 255 CA GLY D 15 -27.968 -0.093 -12.724 1.00 0.00 C ATOM 256 C GLY D 15 -26.720 -0.428 -13.542 1.00 0.00 C ATOM 257 O GLY D 15 -26.140 0.423 -14.186 1.00 0.00 O ATOM 0 H GLY D 15 -26.873 1.250 -11.476 1.00 0.00 H new ATOM 0 HA2 GLY D 15 -28.182 -0.898 -12.021 1.00 0.00 H new ATOM 0 HA3 GLY D 15 -28.833 -0.005 -13.381 1.00 0.00 H new ATOM 261 N GLN D 16 -26.304 -1.664 -13.522 1.00 0.00 N ATOM 262 CA GLN D 16 -25.093 -2.057 -14.298 1.00 0.00 C ATOM 263 C GLN D 16 -25.467 -2.223 -15.772 1.00 0.00 C ATOM 264 O GLN D 16 -24.622 -2.193 -16.647 1.00 0.00 O ATOM 265 CB GLN D 16 -24.544 -3.386 -13.765 1.00 0.00 C ATOM 266 CG GLN D 16 -24.909 -3.543 -12.285 1.00 0.00 C ATOM 267 CD GLN D 16 -26.152 -4.427 -12.158 1.00 0.00 C ATOM 268 OE1 GLN D 16 -26.704 -4.866 -13.148 1.00 0.00 O ATOM 269 NE2 GLN D 16 -26.619 -4.712 -10.972 1.00 0.00 N ATOM 0 H GLN D 16 -26.750 -2.420 -13.002 1.00 0.00 H new ATOM 0 HA GLN D 16 -24.333 -1.283 -14.194 1.00 0.00 H new ATOM 0 HB2 GLN D 16 -24.954 -4.216 -14.340 1.00 0.00 H new ATOM 0 HB3 GLN D 16 -23.461 -3.418 -13.887 1.00 0.00 H new ATOM 0 HG2 GLN D 16 -24.076 -3.987 -11.739 1.00 0.00 H new ATOM 0 HG3 GLN D 16 -25.097 -2.566 -11.840 1.00 0.00 H new ATOM 0 HE21 GLN D 16 -26.157 -4.345 -10.140 1.00 0.00 H new ATOM 0 HE22 GLN D 16 -27.446 -5.302 -10.878 1.00 0.00 H new ATOM 278 N THR D 17 -26.729 -2.400 -16.055 1.00 0.00 N ATOM 279 CA THR D 17 -27.162 -2.571 -17.470 1.00 0.00 C ATOM 280 C THR D 17 -27.040 -1.239 -18.211 1.00 0.00 C ATOM 281 O THR D 17 -26.612 -1.187 -19.347 1.00 0.00 O ATOM 282 CB THR D 17 -28.619 -3.039 -17.502 1.00 0.00 C ATOM 283 OG1 THR D 17 -29.062 -3.109 -18.850 1.00 0.00 O ATOM 284 CG2 THR D 17 -29.491 -2.051 -16.726 1.00 0.00 C ATOM 0 H THR D 17 -27.480 -2.434 -15.365 1.00 0.00 H new ATOM 0 HA THR D 17 -26.528 -3.313 -17.955 1.00 0.00 H new ATOM 0 HB THR D 17 -28.695 -4.025 -17.043 1.00 0.00 H new ATOM 0 HG1 THR D 17 -29.994 -3.410 -18.873 1.00 0.00 H new ATOM 0 HG21 THR D 17 -30.528 -2.385 -16.749 1.00 0.00 H new ATOM 0 HG22 THR D 17 -29.150 -1.999 -15.692 1.00 0.00 H new ATOM 0 HG23 THR D 17 -29.417 -1.064 -17.183 1.00 0.00 H new ATOM 292 N LYS D 18 -27.416 -0.159 -17.580 1.00 0.00 N ATOM 293 CA LYS D 18 -27.322 1.166 -18.255 1.00 0.00 C ATOM 294 C LYS D 18 -25.882 1.678 -18.179 1.00 0.00 C ATOM 295 O LYS D 18 -25.453 2.474 -18.991 1.00 0.00 O ATOM 296 CB LYS D 18 -28.258 2.161 -17.565 1.00 0.00 C ATOM 297 CG LYS D 18 -27.849 2.322 -16.101 1.00 0.00 C ATOM 298 CD LYS D 18 -28.597 3.510 -15.492 1.00 0.00 C ATOM 299 CE LYS D 18 -30.021 3.084 -15.127 1.00 0.00 C ATOM 300 NZ LYS D 18 -30.989 3.743 -16.050 1.00 0.00 N ATOM 0 H LYS D 18 -27.783 -0.138 -16.629 1.00 0.00 H new ATOM 0 HA LYS D 18 -27.614 1.061 -19.300 1.00 0.00 H new ATOM 0 HB2 LYS D 18 -28.218 3.125 -18.072 1.00 0.00 H new ATOM 0 HB3 LYS D 18 -29.288 1.810 -17.629 1.00 0.00 H new ATOM 0 HG2 LYS D 18 -28.077 1.412 -15.546 1.00 0.00 H new ATOM 0 HG3 LYS D 18 -26.773 2.479 -16.028 1.00 0.00 H new ATOM 0 HD2 LYS D 18 -28.074 3.866 -14.605 1.00 0.00 H new ATOM 0 HD3 LYS D 18 -28.624 4.338 -16.200 1.00 0.00 H new ATOM 0 HE2 LYS D 18 -30.117 2.000 -15.196 1.00 0.00 H new ATOM 0 HE3 LYS D 18 -30.241 3.359 -14.095 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 -31.957 3.454 -15.802 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 -30.903 4.776 -15.963 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 -30.783 3.460 -17.029 1.00 0.00 H new ATOM 314 N THR D 19 -25.129 1.226 -17.214 1.00 0.00 N ATOM 315 CA THR D 19 -23.717 1.687 -17.094 1.00 0.00 C ATOM 316 C THR D 19 -22.884 1.034 -18.199 1.00 0.00 C ATOM 317 O THR D 19 -21.929 1.603 -18.692 1.00 0.00 O ATOM 318 CB THR D 19 -23.162 1.287 -15.722 1.00 0.00 C ATOM 319 OG1 THR D 19 -23.966 1.865 -14.703 1.00 0.00 O ATOM 320 CG2 THR D 19 -21.722 1.786 -15.581 1.00 0.00 C ATOM 0 H THR D 19 -25.430 0.558 -16.504 1.00 0.00 H new ATOM 0 HA THR D 19 -23.672 2.771 -17.194 1.00 0.00 H new ATOM 0 HB THR D 19 -23.176 0.201 -15.628 1.00 0.00 H new ATOM 0 HG1 THR D 19 -23.751 2.817 -14.618 1.00 0.00 H new ATOM 0 HG21 THR D 19 -21.332 1.500 -14.604 1.00 0.00 H new ATOM 0 HG22 THR D 19 -21.105 1.343 -16.363 1.00 0.00 H new ATOM 0 HG23 THR D 19 -21.702 2.872 -15.675 1.00 0.00 H new ATOM 328 N ALA D 20 -23.244 -0.156 -18.595 1.00 0.00 N ATOM 329 CA ALA D 20 -22.481 -0.851 -19.671 1.00 0.00 C ATOM 330 C ALA D 20 -22.908 -0.304 -21.036 1.00 0.00 C ATOM 331 O ALA D 20 -22.107 -0.169 -21.939 1.00 0.00 O ATOM 332 CB ALA D 20 -22.772 -2.351 -19.611 1.00 0.00 C ATOM 0 H ALA D 20 -24.035 -0.678 -18.219 1.00 0.00 H new ATOM 0 HA ALA D 20 -21.414 -0.680 -19.529 1.00 0.00 H new ATOM 0 HB1 ALA D 20 -22.215 -2.861 -20.397 1.00 0.00 H new ATOM 0 HB2 ALA D 20 -22.469 -2.742 -18.640 1.00 0.00 H new ATOM 0 HB3 ALA D 20 -23.839 -2.521 -19.754 1.00 0.00 H new ATOM 338 N LYS D 21 -24.166 0.007 -21.194 1.00 0.00 N ATOM 339 CA LYS D 21 -24.645 0.541 -22.501 1.00 0.00 C ATOM 340 C LYS D 21 -24.117 1.964 -22.698 1.00 0.00 C ATOM 341 O LYS D 21 -23.860 2.394 -23.805 1.00 0.00 O ATOM 342 CB LYS D 21 -26.175 0.560 -22.514 1.00 0.00 C ATOM 343 CG LYS D 21 -26.678 0.435 -23.954 1.00 0.00 C ATOM 344 CD LYS D 21 -28.189 0.192 -23.947 1.00 0.00 C ATOM 345 CE LYS D 21 -28.921 1.522 -24.139 1.00 0.00 C ATOM 346 NZ LYS D 21 -29.408 1.623 -25.544 1.00 0.00 N ATOM 0 H LYS D 21 -24.883 -0.086 -20.474 1.00 0.00 H new ATOM 0 HA LYS D 21 -24.281 -0.096 -23.307 1.00 0.00 H new ATOM 0 HB2 LYS D 21 -26.564 -0.260 -21.910 1.00 0.00 H new ATOM 0 HB3 LYS D 21 -26.541 1.485 -22.069 1.00 0.00 H new ATOM 0 HG2 LYS D 21 -26.447 1.343 -24.511 1.00 0.00 H new ATOM 0 HG3 LYS D 21 -26.169 -0.386 -24.458 1.00 0.00 H new ATOM 0 HD2 LYS D 21 -28.460 -0.502 -24.742 1.00 0.00 H new ATOM 0 HD3 LYS D 21 -28.490 -0.268 -23.006 1.00 0.00 H new ATOM 0 HE2 LYS D 21 -29.760 1.591 -23.446 1.00 0.00 H new ATOM 0 HE3 LYS D 21 -28.253 2.353 -23.914 1.00 0.00 H new ATOM 0 HZ1 LYS D 21 -29.906 2.527 -25.675 1.00 0.00 H new ATOM 0 HZ2 LYS D 21 -28.599 1.575 -26.196 1.00 0.00 H new ATOM 0 HZ3 LYS D 21 -30.060 0.837 -25.743 1.00 0.00 H new ATOM 360 N ASP D 22 -23.956 2.700 -21.633 1.00 0.00 N ATOM 361 CA ASP D 22 -23.448 4.095 -21.762 1.00 0.00 C ATOM 362 C ASP D 22 -21.938 4.071 -22.002 1.00 0.00 C ATOM 363 O ASP D 22 -21.400 4.888 -22.723 1.00 0.00 O ATOM 364 CB ASP D 22 -23.752 4.870 -20.478 1.00 0.00 C ATOM 365 CG ASP D 22 -24.868 5.883 -20.743 1.00 0.00 C ATOM 366 OD1 ASP D 22 -24.609 6.852 -21.437 1.00 0.00 O ATOM 367 OD2 ASP D 22 -25.963 5.672 -20.249 1.00 0.00 O ATOM 0 H ASP D 22 -24.154 2.396 -20.680 1.00 0.00 H new ATOM 0 HA ASP D 22 -23.939 4.583 -22.604 1.00 0.00 H new ATOM 0 HB2 ASP D 22 -24.052 4.182 -19.688 1.00 0.00 H new ATOM 0 HB3 ASP D 22 -22.856 5.384 -20.130 1.00 0.00 H new ATOM 372 N LEU D 23 -21.250 3.142 -21.401 1.00 0.00 N ATOM 373 CA LEU D 23 -19.772 3.066 -21.591 1.00 0.00 C ATOM 374 C LEU D 23 -19.459 2.356 -22.910 1.00 0.00 C ATOM 375 O LEU D 23 -18.394 2.514 -23.472 1.00 0.00 O ATOM 376 CB LEU D 23 -19.149 2.290 -20.429 1.00 0.00 C ATOM 377 CG LEU D 23 -19.040 3.207 -19.209 1.00 0.00 C ATOM 378 CD1 LEU D 23 -19.569 2.480 -17.972 1.00 0.00 C ATOM 379 CD2 LEU D 23 -17.573 3.584 -18.987 1.00 0.00 C ATOM 0 H LEU D 23 -21.646 2.431 -20.786 1.00 0.00 H new ATOM 0 HA LEU D 23 -19.357 4.074 -21.618 1.00 0.00 H new ATOM 0 HB2 LEU D 23 -19.759 1.419 -20.190 1.00 0.00 H new ATOM 0 HB3 LEU D 23 -18.163 1.921 -20.710 1.00 0.00 H new ATOM 0 HG LEU D 23 -19.629 4.108 -19.379 1.00 0.00 H new ATOM 0 HD11 LEU D 23 -19.491 3.135 -17.104 1.00 0.00 H new ATOM 0 HD12 LEU D 23 -20.613 2.208 -18.128 1.00 0.00 H new ATOM 0 HD13 LEU D 23 -18.981 1.578 -17.801 1.00 0.00 H new ATOM 0 HD21 LEU D 23 -17.493 4.237 -18.118 1.00 0.00 H new ATOM 0 HD22 LEU D 23 -16.987 2.681 -18.817 1.00 0.00 H new ATOM 0 HD23 LEU D 23 -17.193 4.103 -19.867 1.00 0.00 H new ATOM 391 N GLY D 24 -20.378 1.577 -23.410 1.00 0.00 N ATOM 392 CA GLY D 24 -20.131 0.862 -24.695 1.00 0.00 C ATOM 393 C GLY D 24 -19.588 -0.540 -24.412 1.00 0.00 C ATOM 394 O GLY D 24 -19.083 -1.209 -25.292 1.00 0.00 O ATOM 0 H GLY D 24 -21.289 1.404 -22.985 1.00 0.00 H new ATOM 0 HA2 GLY D 24 -21.056 0.795 -25.268 1.00 0.00 H new ATOM 0 HA3 GLY D 24 -19.420 1.422 -25.302 1.00 0.00 H new ATOM 398 N VAL D 25 -19.689 -0.993 -23.193 1.00 0.00 N ATOM 399 CA VAL D 25 -19.179 -2.357 -22.859 1.00 0.00 C ATOM 400 C VAL D 25 -20.365 -3.303 -22.646 1.00 0.00 C ATOM 401 O VAL D 25 -21.509 -2.916 -22.776 1.00 0.00 O ATOM 402 CB VAL D 25 -18.326 -2.306 -21.585 1.00 0.00 C ATOM 403 CG1 VAL D 25 -16.847 -2.226 -21.967 1.00 0.00 C ATOM 404 CG2 VAL D 25 -18.701 -1.076 -20.751 1.00 0.00 C ATOM 0 H VAL D 25 -20.101 -0.480 -22.414 1.00 0.00 H new ATOM 0 HA VAL D 25 -18.562 -2.719 -23.681 1.00 0.00 H new ATOM 0 HB VAL D 25 -18.508 -3.206 -20.998 1.00 0.00 H new ATOM 0 HG11 VAL D 25 -16.239 -2.190 -21.063 1.00 0.00 H new ATOM 0 HG12 VAL D 25 -16.574 -3.104 -22.552 1.00 0.00 H new ATOM 0 HG13 VAL D 25 -16.672 -1.327 -22.558 1.00 0.00 H new ATOM 0 HG21 VAL D 25 -18.090 -1.048 -19.849 1.00 0.00 H new ATOM 0 HG22 VAL D 25 -18.526 -0.173 -21.336 1.00 0.00 H new ATOM 0 HG23 VAL D 25 -19.754 -1.131 -20.475 1.00 0.00 H new ATOM 414 N TYR D 26 -20.105 -4.543 -22.323 1.00 0.00 N ATOM 415 CA TYR D 26 -21.230 -5.499 -22.111 1.00 0.00 C ATOM 416 C TYR D 26 -21.481 -5.694 -20.613 1.00 0.00 C ATOM 417 O TYR D 26 -20.704 -5.271 -19.778 1.00 0.00 O ATOM 418 CB TYR D 26 -20.901 -6.850 -22.756 1.00 0.00 C ATOM 419 CG TYR D 26 -19.414 -7.111 -22.691 1.00 0.00 C ATOM 420 CD1 TYR D 26 -18.582 -6.687 -23.734 1.00 0.00 C ATOM 421 CD2 TYR D 26 -18.870 -7.784 -21.590 1.00 0.00 C ATOM 422 CE1 TYR D 26 -17.205 -6.934 -23.675 1.00 0.00 C ATOM 423 CE2 TYR D 26 -17.492 -8.032 -21.533 1.00 0.00 C ATOM 424 CZ TYR D 26 -16.660 -7.605 -22.574 1.00 0.00 C ATOM 425 OH TYR D 26 -15.303 -7.850 -22.516 1.00 0.00 O ATOM 0 H TYR D 26 -19.170 -4.932 -22.198 1.00 0.00 H new ATOM 0 HA TYR D 26 -22.128 -5.089 -22.574 1.00 0.00 H new ATOM 0 HB2 TYR D 26 -21.440 -7.647 -22.244 1.00 0.00 H new ATOM 0 HB3 TYR D 26 -21.234 -6.856 -23.794 1.00 0.00 H new ATOM 0 HD1 TYR D 26 -19.002 -6.170 -24.584 1.00 0.00 H new ATOM 0 HD2 TYR D 26 -19.512 -8.112 -20.786 1.00 0.00 H new ATOM 0 HE1 TYR D 26 -16.563 -6.607 -24.479 1.00 0.00 H new ATOM 0 HE2 TYR D 26 -17.072 -8.553 -20.685 1.00 0.00 H new ATOM 0 HH TYR D 26 -15.091 -8.324 -21.685 1.00 0.00 H new ATOM 435 N GLN D 27 -22.571 -6.327 -20.272 1.00 0.00 N ATOM 436 CA GLN D 27 -22.892 -6.550 -18.833 1.00 0.00 C ATOM 437 C GLN D 27 -21.835 -7.452 -18.198 1.00 0.00 C ATOM 438 O GLN D 27 -21.420 -7.241 -17.079 1.00 0.00 O ATOM 439 CB GLN D 27 -24.262 -7.219 -18.718 1.00 0.00 C ATOM 440 CG GLN D 27 -25.278 -6.218 -18.165 1.00 0.00 C ATOM 441 CD GLN D 27 -26.691 -6.658 -18.553 1.00 0.00 C ATOM 442 OE1 GLN D 27 -27.032 -7.818 -18.437 1.00 0.00 O ATOM 443 NE2 GLN D 27 -27.533 -5.773 -19.015 1.00 0.00 N ATOM 0 H GLN D 27 -23.255 -6.700 -20.930 1.00 0.00 H new ATOM 0 HA GLN D 27 -22.904 -5.591 -18.315 1.00 0.00 H new ATOM 0 HB2 GLN D 27 -24.585 -7.578 -19.695 1.00 0.00 H new ATOM 0 HB3 GLN D 27 -24.200 -8.088 -18.063 1.00 0.00 H new ATOM 0 HG2 GLN D 27 -25.190 -6.156 -17.080 1.00 0.00 H new ATOM 0 HG3 GLN D 27 -25.075 -5.222 -18.559 1.00 0.00 H new ATOM 0 HE21 GLN D 27 -27.247 -4.799 -19.112 1.00 0.00 H new ATOM 0 HE22 GLN D 27 -28.477 -6.056 -19.278 1.00 0.00 H new ATOM 452 N SER D 28 -21.404 -8.459 -18.901 1.00 0.00 N ATOM 453 CA SER D 28 -20.378 -9.382 -18.335 1.00 0.00 C ATOM 454 C SER D 28 -19.111 -8.596 -17.983 1.00 0.00 C ATOM 455 O SER D 28 -18.279 -9.053 -17.221 1.00 0.00 O ATOM 456 CB SER D 28 -20.040 -10.456 -19.368 1.00 0.00 C ATOM 457 OG SER D 28 -21.013 -11.491 -19.306 1.00 0.00 O ATOM 0 H SER D 28 -21.717 -8.685 -19.845 1.00 0.00 H new ATOM 0 HA SER D 28 -20.772 -9.851 -17.433 1.00 0.00 H new ATOM 0 HB2 SER D 28 -20.018 -10.021 -20.367 1.00 0.00 H new ATOM 0 HB3 SER D 28 -19.047 -10.863 -19.175 1.00 0.00 H new ATOM 0 HG SER D 28 -20.800 -12.181 -19.969 1.00 0.00 H new ATOM 463 N ALA D 29 -18.957 -7.417 -18.519 1.00 0.00 N ATOM 464 CA ALA D 29 -17.745 -6.611 -18.206 1.00 0.00 C ATOM 465 C ALA D 29 -18.023 -5.775 -16.965 1.00 0.00 C ATOM 466 O ALA D 29 -17.141 -5.480 -16.184 1.00 0.00 O ATOM 467 CB ALA D 29 -17.421 -5.687 -19.381 1.00 0.00 C ATOM 0 H ALA D 29 -19.618 -6.977 -19.160 1.00 0.00 H new ATOM 0 HA ALA D 29 -16.897 -7.272 -18.030 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -16.533 -5.099 -19.148 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -17.236 -6.285 -20.274 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -18.263 -5.018 -19.560 1.00 0.00 H new ATOM 473 N ILE D 30 -19.253 -5.395 -16.778 1.00 0.00 N ATOM 474 CA ILE D 30 -19.608 -4.582 -15.590 1.00 0.00 C ATOM 475 C ILE D 30 -19.667 -5.488 -14.359 1.00 0.00 C ATOM 476 O ILE D 30 -19.433 -5.060 -13.245 1.00 0.00 O ATOM 477 CB ILE D 30 -20.972 -3.934 -15.820 1.00 0.00 C ATOM 478 CG1 ILE D 30 -20.955 -3.168 -17.147 1.00 0.00 C ATOM 479 CG2 ILE D 30 -21.276 -2.972 -14.677 1.00 0.00 C ATOM 480 CD1 ILE D 30 -20.134 -1.885 -16.993 1.00 0.00 C ATOM 0 H ILE D 30 -20.030 -5.614 -17.401 1.00 0.00 H new ATOM 0 HA ILE D 30 -18.859 -3.806 -15.431 1.00 0.00 H new ATOM 0 HB ILE D 30 -21.741 -4.705 -15.857 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -20.528 -3.792 -17.932 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -21.973 -2.925 -17.451 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -22.249 -2.509 -14.840 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -21.288 -3.519 -13.734 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -20.508 -2.199 -14.638 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -20.124 -1.343 -17.939 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -20.580 -1.258 -16.220 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -19.112 -2.139 -16.710 1.00 0.00 H new ATOM 492 N ASN D 31 -19.971 -6.741 -14.553 1.00 0.00 N ATOM 493 CA ASN D 31 -20.040 -7.680 -13.401 1.00 0.00 C ATOM 494 C ASN D 31 -18.629 -8.150 -13.056 1.00 0.00 C ATOM 495 O ASN D 31 -18.253 -8.221 -11.904 1.00 0.00 O ATOM 496 CB ASN D 31 -20.907 -8.884 -13.773 1.00 0.00 C ATOM 497 CG ASN D 31 -21.441 -9.542 -12.499 1.00 0.00 C ATOM 498 OD1 ASN D 31 -21.834 -8.863 -11.571 1.00 0.00 O ATOM 499 ND2 ASN D 31 -21.475 -10.844 -12.415 1.00 0.00 N ATOM 0 H ASN D 31 -20.175 -7.155 -15.462 1.00 0.00 H new ATOM 0 HA ASN D 31 -20.479 -7.176 -12.540 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -21.736 -8.567 -14.406 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -20.323 -9.602 -14.349 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -21.831 -11.291 -11.571 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -21.145 -11.414 -13.194 1.00 0.00 H new ATOM 506 N LYS D 32 -17.842 -8.469 -14.047 1.00 0.00 N ATOM 507 CA LYS D 32 -16.453 -8.927 -13.776 1.00 0.00 C ATOM 508 C LYS D 32 -15.614 -7.742 -13.294 1.00 0.00 C ATOM 509 O LYS D 32 -14.608 -7.910 -12.633 1.00 0.00 O ATOM 510 CB LYS D 32 -15.846 -9.496 -15.056 1.00 0.00 C ATOM 511 CG LYS D 32 -15.739 -8.384 -16.094 1.00 0.00 C ATOM 512 CD LYS D 32 -15.163 -8.949 -17.394 1.00 0.00 C ATOM 513 CE LYS D 32 -14.230 -7.916 -18.030 1.00 0.00 C ATOM 514 NZ LYS D 32 -12.822 -8.217 -17.646 1.00 0.00 N ATOM 0 H LYS D 32 -18.102 -8.432 -15.032 1.00 0.00 H new ATOM 0 HA LYS D 32 -16.466 -9.700 -13.008 1.00 0.00 H new ATOM 0 HB2 LYS D 32 -14.861 -9.915 -14.851 1.00 0.00 H new ATOM 0 HB3 LYS D 32 -16.465 -10.308 -15.437 1.00 0.00 H new ATOM 0 HG2 LYS D 32 -16.721 -7.949 -16.278 1.00 0.00 H new ATOM 0 HG3 LYS D 32 -15.101 -7.583 -15.720 1.00 0.00 H new ATOM 0 HD2 LYS D 32 -14.618 -9.871 -17.192 1.00 0.00 H new ATOM 0 HD3 LYS D 32 -15.970 -9.199 -18.083 1.00 0.00 H new ATOM 0 HE2 LYS D 32 -14.334 -7.935 -19.115 1.00 0.00 H new ATOM 0 HE3 LYS D 32 -14.502 -6.913 -17.701 1.00 0.00 H new ATOM 0 HZ1 LYS D 32 -12.187 -7.516 -18.078 1.00 0.00 H new ATOM 0 HZ2 LYS D 32 -12.729 -8.178 -16.611 1.00 0.00 H new ATOM 0 HZ3 LYS D 32 -12.566 -9.168 -17.981 1.00 0.00 H new ATOM 528 N ALA D 33 -16.018 -6.542 -13.619 1.00 0.00 N ATOM 529 CA ALA D 33 -15.242 -5.352 -13.175 1.00 0.00 C ATOM 530 C ALA D 33 -15.584 -5.040 -11.718 1.00 0.00 C ATOM 531 O ALA D 33 -14.728 -4.693 -10.927 1.00 0.00 O ATOM 532 CB ALA D 33 -15.598 -4.151 -14.053 1.00 0.00 C ATOM 0 H ALA D 33 -16.850 -6.337 -14.172 1.00 0.00 H new ATOM 0 HA ALA D 33 -14.175 -5.559 -13.263 1.00 0.00 H new ATOM 0 HB1 ALA D 33 -15.029 -3.280 -13.727 1.00 0.00 H new ATOM 0 HB2 ALA D 33 -15.355 -4.375 -15.092 1.00 0.00 H new ATOM 0 HB3 ALA D 33 -16.664 -3.941 -13.967 1.00 0.00 H new ATOM 538 N ILE D 34 -16.830 -5.164 -11.357 1.00 0.00 N ATOM 539 CA ILE D 34 -17.234 -4.882 -9.951 1.00 0.00 C ATOM 540 C ILE D 34 -16.830 -6.062 -9.064 1.00 0.00 C ATOM 541 O ILE D 34 -16.605 -5.917 -7.879 1.00 0.00 O ATOM 542 CB ILE D 34 -18.749 -4.692 -9.887 1.00 0.00 C ATOM 543 CG1 ILE D 34 -19.124 -3.371 -10.563 1.00 0.00 C ATOM 544 CG2 ILE D 34 -19.199 -4.661 -8.424 1.00 0.00 C ATOM 545 CD1 ILE D 34 -18.438 -2.213 -9.838 1.00 0.00 C ATOM 0 H ILE D 34 -17.589 -5.449 -11.976 1.00 0.00 H new ATOM 0 HA ILE D 34 -16.739 -3.976 -9.602 1.00 0.00 H new ATOM 0 HB ILE D 34 -19.241 -5.518 -10.401 1.00 0.00 H new ATOM 0 HG12 ILE D 34 -18.822 -3.388 -11.610 1.00 0.00 H new ATOM 0 HG13 ILE D 34 -20.205 -3.235 -10.545 1.00 0.00 H new ATOM 0 HG21 ILE D 34 -20.280 -4.525 -8.379 1.00 0.00 H new ATOM 0 HG22 ILE D 34 -18.930 -5.600 -7.941 1.00 0.00 H new ATOM 0 HG23 ILE D 34 -18.708 -3.835 -7.910 1.00 0.00 H new ATOM 0 HD11 ILE D 34 -18.705 -1.273 -10.320 1.00 0.00 H new ATOM 0 HD12 ILE D 34 -18.762 -2.192 -8.797 1.00 0.00 H new ATOM 0 HD13 ILE D 34 -17.357 -2.347 -9.879 1.00 0.00 H new ATOM 557 N HIS D 35 -16.736 -7.230 -9.636 1.00 0.00 N ATOM 558 CA HIS D 35 -16.351 -8.429 -8.842 1.00 0.00 C ATOM 559 C HIS D 35 -14.853 -8.380 -8.534 1.00 0.00 C ATOM 560 O HIS D 35 -14.420 -8.731 -7.453 1.00 0.00 O ATOM 561 CB HIS D 35 -16.663 -9.686 -9.656 1.00 0.00 C ATOM 562 CG HIS D 35 -18.103 -10.066 -9.458 1.00 0.00 C ATOM 563 ND1 HIS D 35 -18.630 -10.335 -8.205 1.00 0.00 N ATOM 564 CD2 HIS D 35 -19.138 -10.227 -10.344 1.00 0.00 C ATOM 565 CE1 HIS D 35 -19.929 -10.642 -8.370 1.00 0.00 C ATOM 566 NE2 HIS D 35 -20.291 -10.593 -9.655 1.00 0.00 N ATOM 0 H HIS D 35 -16.911 -7.406 -10.625 1.00 0.00 H new ATOM 0 HA HIS D 35 -16.910 -8.446 -7.906 1.00 0.00 H new ATOM 0 HB2 HIS D 35 -16.465 -9.506 -10.713 1.00 0.00 H new ATOM 0 HB3 HIS D 35 -16.014 -10.504 -9.345 1.00 0.00 H new ATOM 0 HD1 HIS D 35 -18.125 -10.306 -7.319 1.00 0.00 H new ATOM 0 HD2 HIS D 35 -19.069 -10.091 -11.413 1.00 0.00 H new ATOM 0 HE1 HIS D 35 -20.598 -10.897 -7.562 1.00 0.00 H new ATOM 574 N ALA D 36 -14.057 -7.950 -9.473 1.00 0.00 N ATOM 575 CA ALA D 36 -12.588 -7.882 -9.233 1.00 0.00 C ATOM 576 C ALA D 36 -12.280 -6.727 -8.279 1.00 0.00 C ATOM 577 O ALA D 36 -11.225 -6.672 -7.678 1.00 0.00 O ATOM 578 CB ALA D 36 -11.864 -7.655 -10.560 1.00 0.00 C ATOM 0 H ALA D 36 -14.360 -7.642 -10.397 1.00 0.00 H new ATOM 0 HA ALA D 36 -12.249 -8.819 -8.791 1.00 0.00 H new ATOM 0 HB1 ALA D 36 -10.789 -7.605 -10.384 1.00 0.00 H new ATOM 0 HB2 ALA D 36 -12.083 -8.479 -11.239 1.00 0.00 H new ATOM 0 HB3 ALA D 36 -12.203 -6.719 -11.004 1.00 0.00 H new ATOM 584 N GLY D 37 -13.194 -5.806 -8.135 1.00 0.00 N ATOM 585 CA GLY D 37 -12.958 -4.652 -7.220 1.00 0.00 C ATOM 586 C GLY D 37 -11.526 -4.143 -7.396 1.00 0.00 C ATOM 587 O GLY D 37 -10.828 -3.878 -6.437 1.00 0.00 O ATOM 0 H GLY D 37 -14.095 -5.803 -8.612 1.00 0.00 H new ATOM 0 HA2 GLY D 37 -13.668 -3.853 -7.435 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -13.123 -4.955 -6.186 1.00 0.00 H new ATOM 591 N ARG D 38 -11.082 -4.006 -8.615 1.00 0.00 N ATOM 592 CA ARG D 38 -9.694 -3.516 -8.850 1.00 0.00 C ATOM 593 C ARG D 38 -9.687 -1.985 -8.866 1.00 0.00 C ATOM 594 O ARG D 38 -9.235 -1.368 -9.811 1.00 0.00 O ATOM 595 CB ARG D 38 -9.187 -4.047 -10.193 1.00 0.00 C ATOM 596 CG ARG D 38 -10.256 -3.838 -11.265 1.00 0.00 C ATOM 597 CD ARG D 38 -9.583 -3.459 -12.585 1.00 0.00 C ATOM 598 NE ARG D 38 -9.577 -4.636 -13.499 1.00 0.00 N ATOM 599 CZ ARG D 38 -9.054 -4.534 -14.691 1.00 0.00 C ATOM 600 NH1 ARG D 38 -8.837 -3.355 -15.208 1.00 0.00 N ATOM 601 NH2 ARG D 38 -8.751 -5.607 -15.365 1.00 0.00 N ATOM 0 H ARG D 38 -11.619 -4.212 -9.457 1.00 0.00 H new ATOM 0 HA ARG D 38 -9.043 -3.871 -8.051 1.00 0.00 H new ATOM 0 HB2 ARG D 38 -8.269 -3.532 -10.476 1.00 0.00 H new ATOM 0 HB3 ARG D 38 -8.945 -5.106 -10.108 1.00 0.00 H new ATOM 0 HG2 ARG D 38 -10.843 -4.748 -11.391 1.00 0.00 H new ATOM 0 HG3 ARG D 38 -10.947 -3.053 -10.957 1.00 0.00 H new ATOM 0 HD2 ARG D 38 -10.113 -2.628 -13.050 1.00 0.00 H new ATOM 0 HD3 ARG D 38 -8.562 -3.123 -12.401 1.00 0.00 H new ATOM 0 HE ARG D 38 -9.981 -5.521 -13.193 1.00 0.00 H new ATOM 0 HH11 ARG D 38 -9.076 -2.515 -14.681 1.00 0.00 H new ATOM 0 HH12 ARG D 38 -8.428 -3.274 -16.139 1.00 0.00 H new ATOM 0 HH21 ARG D 38 -8.922 -6.528 -14.962 1.00 0.00 H new ATOM 0 HH22 ARG D 38 -8.343 -5.526 -16.296 1.00 0.00 H new ATOM 615 N LYS D 39 -10.174 -1.373 -7.819 1.00 0.00 N ATOM 616 CA LYS D 39 -10.196 0.116 -7.753 1.00 0.00 C ATOM 617 C LYS D 39 -10.555 0.699 -9.113 1.00 0.00 C ATOM 618 O LYS D 39 -9.731 1.265 -9.805 1.00 0.00 O ATOM 619 CB LYS D 39 -8.823 0.615 -7.312 1.00 0.00 C ATOM 620 CG LYS D 39 -8.887 1.036 -5.843 1.00 0.00 C ATOM 621 CD LYS D 39 -7.559 0.710 -5.160 1.00 0.00 C ATOM 622 CE LYS D 39 -7.629 1.118 -3.689 1.00 0.00 C ATOM 623 NZ LYS D 39 -6.347 1.768 -3.295 1.00 0.00 N ATOM 0 H LYS D 39 -10.560 -1.845 -7.001 1.00 0.00 H new ATOM 0 HA LYS D 39 -10.949 0.437 -7.033 1.00 0.00 H new ATOM 0 HB2 LYS D 39 -8.078 -0.169 -7.445 1.00 0.00 H new ATOM 0 HB3 LYS D 39 -8.513 1.457 -7.931 1.00 0.00 H new ATOM 0 HG2 LYS D 39 -9.094 2.104 -5.768 1.00 0.00 H new ATOM 0 HG3 LYS D 39 -9.703 0.517 -5.340 1.00 0.00 H new ATOM 0 HD2 LYS D 39 -7.347 -0.356 -5.243 1.00 0.00 H new ATOM 0 HD3 LYS D 39 -6.744 1.237 -5.656 1.00 0.00 H new ATOM 0 HE2 LYS D 39 -8.461 1.803 -3.529 1.00 0.00 H new ATOM 0 HE3 LYS D 39 -7.813 0.243 -3.066 1.00 0.00 H new ATOM 0 HZ1 LYS D 39 -6.392 2.047 -2.294 1.00 0.00 H new ATOM 0 HZ2 LYS D 39 -5.562 1.100 -3.433 1.00 0.00 H new ATOM 0 HZ3 LYS D 39 -6.191 2.612 -3.882 1.00 0.00 H new ATOM 637 N ILE D 40 -11.797 0.583 -9.481 1.00 0.00 N ATOM 638 CA ILE D 40 -12.252 1.145 -10.780 1.00 0.00 C ATOM 639 C ILE D 40 -13.142 2.348 -10.486 1.00 0.00 C ATOM 640 O ILE D 40 -14.279 2.210 -10.081 1.00 0.00 O ATOM 641 CB ILE D 40 -13.042 0.093 -11.559 1.00 0.00 C ATOM 642 CG1 ILE D 40 -12.228 -1.202 -11.639 1.00 0.00 C ATOM 643 CG2 ILE D 40 -13.316 0.607 -12.974 1.00 0.00 C ATOM 644 CD1 ILE D 40 -13.074 -2.299 -12.286 1.00 0.00 C ATOM 0 H ILE D 40 -12.522 0.120 -8.934 1.00 0.00 H new ATOM 0 HA ILE D 40 -11.394 1.445 -11.382 1.00 0.00 H new ATOM 0 HB ILE D 40 -13.987 -0.101 -11.051 1.00 0.00 H new ATOM 0 HG12 ILE D 40 -11.321 -1.038 -12.220 1.00 0.00 H new ATOM 0 HG13 ILE D 40 -11.916 -1.510 -10.641 1.00 0.00 H new ATOM 0 HG21 ILE D 40 -13.879 -0.142 -13.531 1.00 0.00 H new ATOM 0 HG22 ILE D 40 -13.894 1.530 -12.920 1.00 0.00 H new ATOM 0 HG23 ILE D 40 -12.370 0.800 -13.480 1.00 0.00 H new ATOM 0 HD11 ILE D 40 -12.494 -3.220 -12.343 1.00 0.00 H new ATOM 0 HD12 ILE D 40 -13.968 -2.470 -11.687 1.00 0.00 H new ATOM 0 HD13 ILE D 40 -13.364 -1.990 -13.290 1.00 0.00 H new ATOM 656 N PHE D 41 -12.625 3.526 -10.662 1.00 0.00 N ATOM 657 CA PHE D 41 -13.425 4.742 -10.367 1.00 0.00 C ATOM 658 C PHE D 41 -14.208 5.167 -11.613 1.00 0.00 C ATOM 659 O PHE D 41 -13.926 4.738 -12.714 1.00 0.00 O ATOM 660 CB PHE D 41 -12.471 5.853 -9.928 1.00 0.00 C ATOM 661 CG PHE D 41 -11.470 5.285 -8.945 1.00 0.00 C ATOM 662 CD1 PHE D 41 -11.838 4.236 -8.086 1.00 0.00 C ATOM 663 CD2 PHE D 41 -10.171 5.807 -8.886 1.00 0.00 C ATOM 664 CE1 PHE D 41 -10.910 3.719 -7.174 1.00 0.00 C ATOM 665 CE2 PHE D 41 -9.245 5.288 -7.974 1.00 0.00 C ATOM 666 CZ PHE D 41 -9.614 4.245 -7.118 1.00 0.00 C ATOM 0 H PHE D 41 -11.678 3.701 -10.999 1.00 0.00 H new ATOM 0 HA PHE D 41 -14.141 4.538 -9.571 1.00 0.00 H new ATOM 0 HB2 PHE D 41 -11.954 6.269 -10.793 1.00 0.00 H new ATOM 0 HB3 PHE D 41 -13.029 6.668 -9.468 1.00 0.00 H new ATOM 0 HD1 PHE D 41 -12.837 3.828 -8.129 1.00 0.00 H new ATOM 0 HD2 PHE D 41 -9.884 6.612 -9.546 1.00 0.00 H new ATOM 0 HE1 PHE D 41 -11.194 2.914 -6.513 1.00 0.00 H new ATOM 0 HE2 PHE D 41 -8.245 5.693 -7.931 1.00 0.00 H new ATOM 0 HZ PHE D 41 -8.899 3.846 -6.414 1.00 0.00 H new ATOM 676 N LEU D 42 -15.203 5.996 -11.442 1.00 0.00 N ATOM 677 CA LEU D 42 -16.021 6.436 -12.609 1.00 0.00 C ATOM 678 C LEU D 42 -16.048 7.966 -12.674 1.00 0.00 C ATOM 679 O LEU D 42 -16.700 8.620 -11.888 1.00 0.00 O ATOM 680 CB LEU D 42 -17.450 5.911 -12.447 1.00 0.00 C ATOM 681 CG LEU D 42 -17.923 5.267 -13.752 1.00 0.00 C ATOM 682 CD1 LEU D 42 -17.111 4.002 -14.028 1.00 0.00 C ATOM 683 CD2 LEU D 42 -19.399 4.893 -13.620 1.00 0.00 C ATOM 0 H LEU D 42 -15.485 6.388 -10.543 1.00 0.00 H new ATOM 0 HA LEU D 42 -15.584 6.044 -13.527 1.00 0.00 H new ATOM 0 HB2 LEU D 42 -17.489 5.182 -11.637 1.00 0.00 H new ATOM 0 HB3 LEU D 42 -18.117 6.728 -12.172 1.00 0.00 H new ATOM 0 HG LEU D 42 -17.787 5.972 -14.572 1.00 0.00 H new ATOM 0 HD11 LEU D 42 -17.451 3.547 -14.958 1.00 0.00 H new ATOM 0 HD12 LEU D 42 -16.055 4.259 -14.115 1.00 0.00 H new ATOM 0 HD13 LEU D 42 -17.246 3.297 -13.208 1.00 0.00 H new ATOM 0 HD21 LEU D 42 -19.742 4.434 -14.547 1.00 0.00 H new ATOM 0 HD22 LEU D 42 -19.524 4.188 -12.798 1.00 0.00 H new ATOM 0 HD23 LEU D 42 -19.985 5.790 -13.421 1.00 0.00 H new ATOM 695 N THR D 43 -15.347 8.537 -13.613 1.00 0.00 N ATOM 696 CA THR D 43 -15.332 10.022 -13.740 1.00 0.00 C ATOM 697 C THR D 43 -16.328 10.437 -14.829 1.00 0.00 C ATOM 698 O THR D 43 -16.010 10.453 -16.002 1.00 0.00 O ATOM 699 CB THR D 43 -13.917 10.481 -14.120 1.00 0.00 C ATOM 700 OG1 THR D 43 -13.094 10.470 -12.961 1.00 0.00 O ATOM 701 CG2 THR D 43 -13.960 11.897 -14.698 1.00 0.00 C ATOM 0 H THR D 43 -14.782 8.038 -14.300 1.00 0.00 H new ATOM 0 HA THR D 43 -15.616 10.484 -12.795 1.00 0.00 H new ATOM 0 HB THR D 43 -13.511 9.803 -14.871 1.00 0.00 H new ATOM 0 HG1 THR D 43 -12.189 10.761 -13.200 1.00 0.00 H new ATOM 0 HG21 THR D 43 -12.951 12.212 -14.964 1.00 0.00 H new ATOM 0 HG22 THR D 43 -14.590 11.908 -15.587 1.00 0.00 H new ATOM 0 HG23 THR D 43 -14.370 12.581 -13.955 1.00 0.00 H new ATOM 709 N ILE D 44 -17.536 10.763 -14.450 1.00 0.00 N ATOM 710 CA ILE D 44 -18.554 11.165 -15.463 1.00 0.00 C ATOM 711 C ILE D 44 -18.553 12.688 -15.631 1.00 0.00 C ATOM 712 O ILE D 44 -19.148 13.409 -14.854 1.00 0.00 O ATOM 713 CB ILE D 44 -19.938 10.702 -15.002 1.00 0.00 C ATOM 714 CG1 ILE D 44 -19.863 9.240 -14.551 1.00 0.00 C ATOM 715 CG2 ILE D 44 -20.927 10.823 -16.161 1.00 0.00 C ATOM 716 CD1 ILE D 44 -20.967 8.961 -13.527 1.00 0.00 C ATOM 0 H ILE D 44 -17.861 10.768 -13.483 1.00 0.00 H new ATOM 0 HA ILE D 44 -18.311 10.702 -16.419 1.00 0.00 H new ATOM 0 HB ILE D 44 -20.271 11.324 -14.171 1.00 0.00 H new ATOM 0 HG12 ILE D 44 -19.974 8.578 -15.410 1.00 0.00 H new ATOM 0 HG13 ILE D 44 -18.886 9.034 -14.113 1.00 0.00 H new ATOM 0 HG21 ILE D 44 -21.913 10.493 -15.834 1.00 0.00 H new ATOM 0 HG22 ILE D 44 -20.981 11.862 -16.486 1.00 0.00 H new ATOM 0 HG23 ILE D 44 -20.593 10.200 -16.991 1.00 0.00 H new ATOM 0 HD11 ILE D 44 -20.912 7.920 -13.207 1.00 0.00 H new ATOM 0 HD12 ILE D 44 -20.836 9.613 -12.664 1.00 0.00 H new ATOM 0 HD13 ILE D 44 -21.940 9.150 -13.980 1.00 0.00 H new ATOM 728 N ASN D 45 -17.892 13.183 -16.645 1.00 0.00 N ATOM 729 CA ASN D 45 -17.854 14.655 -16.867 1.00 0.00 C ATOM 730 C ASN D 45 -19.279 15.212 -16.893 1.00 0.00 C ATOM 731 O ASN D 45 -20.203 14.575 -17.368 1.00 0.00 O ATOM 732 CB ASN D 45 -17.168 14.957 -18.199 1.00 0.00 C ATOM 733 CG ASN D 45 -15.674 15.188 -17.967 1.00 0.00 C ATOM 734 OD1 ASN D 45 -15.128 16.185 -18.396 1.00 0.00 O ATOM 735 ND2 ASN D 45 -14.984 14.302 -17.301 1.00 0.00 N ATOM 0 H ASN D 45 -17.377 12.629 -17.329 1.00 0.00 H new ATOM 0 HA ASN D 45 -17.297 15.123 -16.056 1.00 0.00 H new ATOM 0 HB2 ASN D 45 -17.315 14.128 -18.891 1.00 0.00 H new ATOM 0 HB3 ASN D 45 -17.615 15.839 -18.658 1.00 0.00 H new ATOM 0 HD21 ASN D 45 -13.987 14.447 -17.141 1.00 0.00 H new ATOM 0 HD22 ASN D 45 -15.442 13.465 -16.941 1.00 0.00 H new ATOM 742 N ALA D 46 -19.450 16.403 -16.386 1.00 0.00 N ATOM 743 CA ALA D 46 -20.800 17.041 -16.356 1.00 0.00 C ATOM 744 C ALA D 46 -21.493 16.910 -17.716 1.00 0.00 C ATOM 745 O ALA D 46 -22.698 17.019 -17.815 1.00 0.00 O ATOM 746 CB ALA D 46 -20.651 18.524 -16.008 1.00 0.00 C ATOM 0 H ALA D 46 -18.702 16.969 -15.986 1.00 0.00 H new ATOM 0 HA ALA D 46 -21.407 16.537 -15.604 1.00 0.00 H new ATOM 0 HB1 ALA D 46 -21.635 18.993 -15.985 1.00 0.00 H new ATOM 0 HB2 ALA D 46 -20.179 18.623 -15.030 1.00 0.00 H new ATOM 0 HB3 ALA D 46 -20.033 19.014 -16.760 1.00 0.00 H new ATOM 752 N ASP D 47 -20.753 16.674 -18.765 1.00 0.00 N ATOM 753 CA ASP D 47 -21.391 16.538 -20.105 1.00 0.00 C ATOM 754 C ASP D 47 -21.885 15.100 -20.298 1.00 0.00 C ATOM 755 O ASP D 47 -21.902 14.584 -21.398 1.00 0.00 O ATOM 756 CB ASP D 47 -20.372 16.879 -21.194 1.00 0.00 C ATOM 757 CG ASP D 47 -21.056 17.682 -22.301 1.00 0.00 C ATOM 758 OD1 ASP D 47 -21.211 18.880 -22.128 1.00 0.00 O ATOM 759 OD2 ASP D 47 -21.416 17.086 -23.303 1.00 0.00 O ATOM 0 H ASP D 47 -19.738 16.570 -18.752 1.00 0.00 H new ATOM 0 HA ASP D 47 -22.237 17.222 -20.172 1.00 0.00 H new ATOM 0 HB2 ASP D 47 -19.549 17.454 -20.769 1.00 0.00 H new ATOM 0 HB3 ASP D 47 -19.944 15.965 -21.605 1.00 0.00 H new ATOM 764 N GLY D 48 -22.288 14.447 -19.239 1.00 0.00 N ATOM 765 CA GLY D 48 -22.778 13.047 -19.367 1.00 0.00 C ATOM 766 C GLY D 48 -21.691 12.186 -20.006 1.00 0.00 C ATOM 767 O GLY D 48 -21.967 11.172 -20.616 1.00 0.00 O ATOM 0 H GLY D 48 -22.298 14.825 -18.292 1.00 0.00 H new ATOM 0 HA2 GLY D 48 -23.041 12.651 -18.386 1.00 0.00 H new ATOM 0 HA3 GLY D 48 -23.682 13.021 -19.975 1.00 0.00 H new ATOM 771 N SER D 49 -20.454 12.580 -19.870 1.00 0.00 N ATOM 772 CA SER D 49 -19.351 11.779 -20.473 1.00 0.00 C ATOM 773 C SER D 49 -18.843 10.758 -19.456 1.00 0.00 C ATOM 774 O SER D 49 -18.244 11.111 -18.463 1.00 0.00 O ATOM 775 CB SER D 49 -18.205 12.709 -20.875 1.00 0.00 C ATOM 776 OG SER D 49 -18.625 14.059 -20.729 1.00 0.00 O ATOM 0 H SER D 49 -20.160 13.419 -19.369 1.00 0.00 H new ATOM 0 HA SER D 49 -19.724 11.258 -21.355 1.00 0.00 H new ATOM 0 HB2 SER D 49 -17.331 12.518 -20.253 1.00 0.00 H new ATOM 0 HB3 SER D 49 -17.910 12.517 -21.907 1.00 0.00 H new ATOM 0 HG SER D 49 -17.893 14.659 -20.984 1.00 0.00 H new ATOM 782 N VAL D 50 -19.068 9.496 -19.691 1.00 0.00 N ATOM 783 CA VAL D 50 -18.582 8.471 -18.725 1.00 0.00 C ATOM 784 C VAL D 50 -17.092 8.222 -18.960 1.00 0.00 C ATOM 785 O VAL D 50 -16.671 7.899 -20.054 1.00 0.00 O ATOM 786 CB VAL D 50 -19.352 7.165 -18.919 1.00 0.00 C ATOM 787 CG1 VAL D 50 -18.956 6.177 -17.822 1.00 0.00 C ATOM 788 CG2 VAL D 50 -20.855 7.435 -18.832 1.00 0.00 C ATOM 0 H VAL D 50 -19.564 9.131 -20.504 1.00 0.00 H new ATOM 0 HA VAL D 50 -18.740 8.831 -17.709 1.00 0.00 H new ATOM 0 HB VAL D 50 -19.113 6.748 -19.897 1.00 0.00 H new ATOM 0 HG11 VAL D 50 -19.504 5.244 -17.957 1.00 0.00 H new ATOM 0 HG12 VAL D 50 -17.885 5.981 -17.878 1.00 0.00 H new ATOM 0 HG13 VAL D 50 -19.196 6.600 -16.847 1.00 0.00 H new ATOM 0 HG21 VAL D 50 -21.401 6.502 -18.971 1.00 0.00 H new ATOM 0 HG22 VAL D 50 -21.094 7.853 -17.854 1.00 0.00 H new ATOM 0 HG23 VAL D 50 -21.143 8.143 -19.609 1.00 0.00 H new ATOM 798 N TYR D 51 -16.289 8.375 -17.944 1.00 0.00 N ATOM 799 CA TYR D 51 -14.825 8.151 -18.111 1.00 0.00 C ATOM 800 C TYR D 51 -14.295 7.350 -16.921 1.00 0.00 C ATOM 801 O TYR D 51 -13.736 7.897 -15.993 1.00 0.00 O ATOM 802 CB TYR D 51 -14.112 9.503 -18.177 1.00 0.00 C ATOM 803 CG TYR D 51 -12.641 9.283 -18.423 1.00 0.00 C ATOM 804 CD1 TYR D 51 -12.160 9.171 -19.732 1.00 0.00 C ATOM 805 CD2 TYR D 51 -11.758 9.189 -17.341 1.00 0.00 C ATOM 806 CE1 TYR D 51 -10.794 8.965 -19.960 1.00 0.00 C ATOM 807 CE2 TYR D 51 -10.392 8.984 -17.569 1.00 0.00 C ATOM 808 CZ TYR D 51 -9.911 8.871 -18.879 1.00 0.00 C ATOM 809 OH TYR D 51 -8.565 8.668 -19.105 1.00 0.00 O ATOM 0 H TYR D 51 -16.583 8.645 -17.005 1.00 0.00 H new ATOM 0 HA TYR D 51 -14.641 7.597 -19.031 1.00 0.00 H new ATOM 0 HB2 TYR D 51 -14.538 10.112 -18.974 1.00 0.00 H new ATOM 0 HB3 TYR D 51 -14.258 10.049 -17.245 1.00 0.00 H new ATOM 0 HD1 TYR D 51 -12.842 9.243 -20.566 1.00 0.00 H new ATOM 0 HD2 TYR D 51 -12.130 9.275 -16.331 1.00 0.00 H new ATOM 0 HE1 TYR D 51 -10.422 8.879 -20.970 1.00 0.00 H new ATOM 0 HE2 TYR D 51 -9.710 8.913 -16.735 1.00 0.00 H new ATOM 0 HH TYR D 51 -8.092 8.628 -18.248 1.00 0.00 H new ATOM 819 N ALA D 52 -14.467 6.055 -16.943 1.00 0.00 N ATOM 820 CA ALA D 52 -13.982 5.215 -15.811 1.00 0.00 C ATOM 821 C ALA D 52 -12.473 4.993 -15.942 1.00 0.00 C ATOM 822 O ALA D 52 -11.939 4.919 -17.030 1.00 0.00 O ATOM 823 CB ALA D 52 -14.699 3.864 -15.846 1.00 0.00 C ATOM 0 H ALA D 52 -14.923 5.543 -17.698 1.00 0.00 H new ATOM 0 HA ALA D 52 -14.190 5.720 -14.868 1.00 0.00 H new ATOM 0 HB1 ALA D 52 -14.349 3.245 -15.020 1.00 0.00 H new ATOM 0 HB2 ALA D 52 -15.774 4.020 -15.752 1.00 0.00 H new ATOM 0 HB3 ALA D 52 -14.486 3.364 -16.791 1.00 0.00 H new ATOM 829 N GLU D 53 -11.780 4.897 -14.838 1.00 0.00 N ATOM 830 CA GLU D 53 -10.305 4.691 -14.900 1.00 0.00 C ATOM 831 C GLU D 53 -9.867 3.707 -13.816 1.00 0.00 C ATOM 832 O GLU D 53 -10.562 3.475 -12.848 1.00 0.00 O ATOM 833 CB GLU D 53 -9.600 6.031 -14.683 1.00 0.00 C ATOM 834 CG GLU D 53 -8.873 6.439 -15.965 1.00 0.00 C ATOM 835 CD GLU D 53 -7.762 7.433 -15.628 1.00 0.00 C ATOM 836 OE1 GLU D 53 -8.076 8.487 -15.098 1.00 0.00 O ATOM 837 OE2 GLU D 53 -6.614 7.124 -15.904 1.00 0.00 O ATOM 0 H GLU D 53 -12.172 4.952 -13.898 1.00 0.00 H new ATOM 0 HA GLU D 53 -10.040 4.286 -15.877 1.00 0.00 H new ATOM 0 HB2 GLU D 53 -10.326 6.795 -14.405 1.00 0.00 H new ATOM 0 HB3 GLU D 53 -8.890 5.951 -13.860 1.00 0.00 H new ATOM 0 HG2 GLU D 53 -8.453 5.559 -16.453 1.00 0.00 H new ATOM 0 HG3 GLU D 53 -9.576 6.887 -16.667 1.00 0.00 H new ATOM 844 N GLU D 54 -8.704 3.142 -13.973 1.00 0.00 N ATOM 845 CA GLU D 54 -8.187 2.184 -12.957 1.00 0.00 C ATOM 846 C GLU D 54 -7.032 2.853 -12.218 1.00 0.00 C ATOM 847 O GLU D 54 -6.214 3.523 -12.817 1.00 0.00 O ATOM 848 CB GLU D 54 -7.688 0.912 -13.651 1.00 0.00 C ATOM 849 CG GLU D 54 -7.429 -0.175 -12.606 1.00 0.00 C ATOM 850 CD GLU D 54 -6.458 -1.211 -13.179 1.00 0.00 C ATOM 851 OE1 GLU D 54 -5.498 -0.808 -13.815 1.00 0.00 O ATOM 852 OE2 GLU D 54 -6.691 -2.390 -12.970 1.00 0.00 O ATOM 0 H GLU D 54 -8.085 3.304 -14.767 1.00 0.00 H new ATOM 0 HA GLU D 54 -8.978 1.913 -12.257 1.00 0.00 H new ATOM 0 HB2 GLU D 54 -8.427 0.567 -14.374 1.00 0.00 H new ATOM 0 HB3 GLU D 54 -6.774 1.123 -14.205 1.00 0.00 H new ATOM 0 HG2 GLU D 54 -7.013 0.267 -11.701 1.00 0.00 H new ATOM 0 HG3 GLU D 54 -8.366 -0.655 -12.325 1.00 0.00 H new ATOM 859 N VAL D 55 -6.957 2.696 -10.926 1.00 0.00 N ATOM 860 CA VAL D 55 -5.852 3.354 -10.175 1.00 0.00 C ATOM 861 C VAL D 55 -5.474 2.504 -8.961 1.00 0.00 C ATOM 862 O VAL D 55 -6.192 2.441 -7.984 1.00 0.00 O ATOM 863 CB VAL D 55 -6.291 4.752 -9.708 1.00 0.00 C ATOM 864 CG1 VAL D 55 -5.269 5.784 -10.185 1.00 0.00 C ATOM 865 CG2 VAL D 55 -7.663 5.107 -10.295 1.00 0.00 C ATOM 0 H VAL D 55 -7.606 2.147 -10.362 1.00 0.00 H new ATOM 0 HA VAL D 55 -4.988 3.452 -10.832 1.00 0.00 H new ATOM 0 HB VAL D 55 -6.356 4.755 -8.620 1.00 0.00 H new ATOM 0 HG11 VAL D 55 -5.575 6.777 -9.857 1.00 0.00 H new ATOM 0 HG12 VAL D 55 -4.291 5.548 -9.765 1.00 0.00 H new ATOM 0 HG13 VAL D 55 -5.212 5.763 -11.273 1.00 0.00 H new ATOM 0 HG21 VAL D 55 -7.959 6.099 -9.955 1.00 0.00 H new ATOM 0 HG22 VAL D 55 -7.606 5.099 -11.383 1.00 0.00 H new ATOM 0 HG23 VAL D 55 -8.400 4.375 -9.965 1.00 0.00 H new ATOM 875 N LYS D 56 -4.348 1.847 -9.021 1.00 0.00 N ATOM 876 CA LYS D 56 -3.914 0.997 -7.881 1.00 0.00 C ATOM 877 C LYS D 56 -2.381 0.911 -7.878 1.00 0.00 C ATOM 878 O LYS D 56 -1.778 0.701 -8.910 1.00 0.00 O ATOM 879 CB LYS D 56 -4.512 -0.398 -8.055 1.00 0.00 C ATOM 880 CG LYS D 56 -3.796 -1.392 -7.138 1.00 0.00 C ATOM 881 CD LYS D 56 -4.831 -2.153 -6.306 1.00 0.00 C ATOM 882 CE LYS D 56 -5.379 -3.321 -7.125 1.00 0.00 C ATOM 883 NZ LYS D 56 -6.633 -3.825 -6.498 1.00 0.00 N ATOM 0 H LYS D 56 -3.708 1.864 -9.815 1.00 0.00 H new ATOM 0 HA LYS D 56 -4.253 1.424 -6.937 1.00 0.00 H new ATOM 0 HB2 LYS D 56 -5.577 -0.378 -7.823 1.00 0.00 H new ATOM 0 HB3 LYS D 56 -4.418 -0.716 -9.093 1.00 0.00 H new ATOM 0 HG2 LYS D 56 -3.205 -2.090 -7.731 1.00 0.00 H new ATOM 0 HG3 LYS D 56 -3.103 -0.865 -6.483 1.00 0.00 H new ATOM 0 HD2 LYS D 56 -4.376 -2.521 -5.386 1.00 0.00 H new ATOM 0 HD3 LYS D 56 -5.642 -1.486 -6.015 1.00 0.00 H new ATOM 0 HE2 LYS D 56 -5.575 -3.001 -8.148 1.00 0.00 H new ATOM 0 HE3 LYS D 56 -4.640 -4.120 -7.177 1.00 0.00 H new ATOM 0 HZ1 LYS D 56 -7.005 -4.620 -7.056 1.00 0.00 H new ATOM 0 HZ2 LYS D 56 -6.432 -4.146 -5.529 1.00 0.00 H new ATOM 0 HZ3 LYS D 56 -7.338 -3.061 -6.470 1.00 0.00 H new ATOM 897 N PRO D 57 -1.793 1.080 -6.718 1.00 0.00 N ATOM 898 CA PRO D 57 -0.328 1.033 -6.562 1.00 0.00 C ATOM 899 C PRO D 57 0.173 -0.415 -6.576 1.00 0.00 C ATOM 900 O PRO D 57 -0.580 -1.345 -6.365 1.00 0.00 O ATOM 901 CB PRO D 57 -0.091 1.681 -5.196 1.00 0.00 C ATOM 902 CG PRO D 57 -1.419 1.545 -4.413 1.00 0.00 C ATOM 903 CD PRO D 57 -2.528 1.330 -5.461 1.00 0.00 C ATOM 0 HA PRO D 57 0.203 1.540 -7.368 1.00 0.00 H new ATOM 0 HB2 PRO D 57 0.724 1.187 -4.668 1.00 0.00 H new ATOM 0 HB3 PRO D 57 0.190 2.728 -5.306 1.00 0.00 H new ATOM 0 HG2 PRO D 57 -1.375 0.706 -3.718 1.00 0.00 H new ATOM 0 HG3 PRO D 57 -1.613 2.440 -3.821 1.00 0.00 H new ATOM 0 HD2 PRO D 57 -3.167 0.487 -5.198 1.00 0.00 H new ATOM 0 HD3 PRO D 57 -3.173 2.205 -5.544 1.00 0.00 H new ATOM 911 N PHE D 58 1.440 -0.609 -6.824 1.00 0.00 N ATOM 912 CA PHE D 58 1.990 -1.993 -6.853 1.00 0.00 C ATOM 913 C PHE D 58 2.998 -2.161 -5.703 1.00 0.00 C ATOM 914 O PHE D 58 3.420 -1.189 -5.108 1.00 0.00 O ATOM 915 CB PHE D 58 2.654 -2.241 -8.224 1.00 0.00 C ATOM 916 CG PHE D 58 4.160 -2.096 -8.139 1.00 0.00 C ATOM 917 CD1 PHE D 58 4.728 -0.852 -7.836 1.00 0.00 C ATOM 918 CD2 PHE D 58 4.982 -3.206 -8.364 1.00 0.00 C ATOM 919 CE1 PHE D 58 6.119 -0.720 -7.757 1.00 0.00 C ATOM 920 CE2 PHE D 58 6.374 -3.073 -8.285 1.00 0.00 C ATOM 921 CZ PHE D 58 6.942 -1.830 -7.983 1.00 0.00 C ATOM 0 H PHE D 58 2.117 0.131 -7.008 1.00 0.00 H new ATOM 0 HA PHE D 58 1.194 -2.726 -6.718 1.00 0.00 H new ATOM 0 HB2 PHE D 58 2.402 -3.241 -8.577 1.00 0.00 H new ATOM 0 HB3 PHE D 58 2.259 -1.536 -8.955 1.00 0.00 H new ATOM 0 HD1 PHE D 58 4.093 0.004 -7.664 1.00 0.00 H new ATOM 0 HD2 PHE D 58 4.543 -4.165 -8.598 1.00 0.00 H new ATOM 0 HE1 PHE D 58 6.558 0.238 -7.522 1.00 0.00 H new ATOM 0 HE2 PHE D 58 7.009 -3.929 -8.457 1.00 0.00 H new ATOM 0 HZ PHE D 58 8.015 -1.727 -7.924 1.00 0.00 H new ATOM 931 N PRO D 59 3.344 -3.393 -5.423 1.00 0.00 N ATOM 932 CA PRO D 59 2.825 -4.564 -6.152 1.00 0.00 C ATOM 933 C PRO D 59 1.390 -4.873 -5.723 1.00 0.00 C ATOM 934 O PRO D 59 0.962 -4.515 -4.644 1.00 0.00 O ATOM 935 CB PRO D 59 3.780 -5.691 -5.748 1.00 0.00 C ATOM 936 CG PRO D 59 4.429 -5.255 -4.413 1.00 0.00 C ATOM 937 CD PRO D 59 4.287 -3.724 -4.336 1.00 0.00 C ATOM 0 HA PRO D 59 2.786 -4.415 -7.231 1.00 0.00 H new ATOM 0 HB2 PRO D 59 3.243 -6.632 -5.630 1.00 0.00 H new ATOM 0 HB3 PRO D 59 4.538 -5.851 -6.515 1.00 0.00 H new ATOM 0 HG2 PRO D 59 3.935 -5.733 -3.567 1.00 0.00 H new ATOM 0 HG3 PRO D 59 5.478 -5.549 -4.377 1.00 0.00 H new ATOM 0 HD2 PRO D 59 3.903 -3.408 -3.366 1.00 0.00 H new ATOM 0 HD3 PRO D 59 5.247 -3.227 -4.476 1.00 0.00 H new ATOM 1088 N GLN E 3 11.380 14.078 -9.368 1.00 0.00 N ATOM 1089 CA GLN E 3 11.929 12.846 -10.002 1.00 0.00 C ATOM 1090 C GLN E 3 10.779 11.961 -10.488 1.00 0.00 C ATOM 1091 O GLN E 3 10.388 11.018 -9.828 1.00 0.00 O ATOM 1092 CB GLN E 3 12.767 12.078 -8.978 1.00 0.00 C ATOM 1093 CG GLN E 3 14.253 12.343 -9.232 1.00 0.00 C ATOM 1094 CD GLN E 3 14.701 13.558 -8.417 1.00 0.00 C ATOM 1095 OE1 GLN E 3 15.539 13.444 -7.545 1.00 0.00 O ATOM 1096 NE2 GLN E 3 14.175 14.727 -8.667 1.00 0.00 N ATOM 0 HA GLN E 3 12.554 13.123 -10.851 1.00 0.00 H new ATOM 0 HB2 GLN E 3 12.499 12.387 -7.968 1.00 0.00 H new ATOM 0 HB3 GLN E 3 12.560 11.010 -9.050 1.00 0.00 H new ATOM 0 HG2 GLN E 3 14.842 11.469 -8.955 1.00 0.00 H new ATOM 0 HG3 GLN E 3 14.426 12.520 -10.294 1.00 0.00 H new ATOM 0 HE21 GLN E 3 13.471 14.824 -9.399 1.00 0.00 H new ATOM 0 HE22 GLN E 3 14.468 15.543 -8.130 1.00 0.00 H new ATOM 1105 N ARG E 4 10.236 12.255 -11.637 1.00 0.00 N ATOM 1106 CA ARG E 4 9.113 11.429 -12.165 1.00 0.00 C ATOM 1107 C ARG E 4 9.619 10.579 -13.333 1.00 0.00 C ATOM 1108 O ARG E 4 10.157 11.088 -14.295 1.00 0.00 O ATOM 1109 CB ARG E 4 7.991 12.348 -12.653 1.00 0.00 C ATOM 1110 CG ARG E 4 7.843 13.525 -11.688 1.00 0.00 C ATOM 1111 CD ARG E 4 7.488 13.002 -10.295 1.00 0.00 C ATOM 1112 NE ARG E 4 6.337 13.776 -9.752 1.00 0.00 N ATOM 1113 CZ ARG E 4 5.203 13.178 -9.513 1.00 0.00 C ATOM 1114 NH1 ARG E 4 4.745 12.290 -10.352 1.00 0.00 N ATOM 1115 NH2 ARG E 4 4.525 13.468 -8.436 1.00 0.00 N ATOM 0 H ARG E 4 10.521 13.032 -12.234 1.00 0.00 H new ATOM 0 HA ARG E 4 8.733 10.780 -11.376 1.00 0.00 H new ATOM 0 HB2 ARG E 4 8.214 12.712 -13.656 1.00 0.00 H new ATOM 0 HB3 ARG E 4 7.054 11.795 -12.716 1.00 0.00 H new ATOM 0 HG2 ARG E 4 8.771 14.095 -11.648 1.00 0.00 H new ATOM 0 HG3 ARG E 4 7.067 14.204 -12.042 1.00 0.00 H new ATOM 0 HD2 ARG E 4 7.236 11.943 -10.346 1.00 0.00 H new ATOM 0 HD3 ARG E 4 8.347 13.094 -9.631 1.00 0.00 H new ATOM 0 HE ARG E 4 6.436 14.774 -9.567 1.00 0.00 H new ATOM 0 HH11 ARG E 4 5.274 12.064 -11.194 1.00 0.00 H new ATOM 0 HH12 ARG E 4 3.858 11.822 -10.166 1.00 0.00 H new ATOM 0 HH21 ARG E 4 4.882 14.163 -7.780 1.00 0.00 H new ATOM 0 HH22 ARG E 4 3.638 13.000 -8.250 1.00 0.00 H new ATOM 1129 N ILE E 5 9.452 9.288 -13.253 1.00 0.00 N ATOM 1130 CA ILE E 5 9.924 8.400 -14.352 1.00 0.00 C ATOM 1131 C ILE E 5 9.087 7.124 -14.355 1.00 0.00 C ATOM 1132 O ILE E 5 8.517 6.750 -13.353 1.00 0.00 O ATOM 1133 CB ILE E 5 11.390 8.034 -14.120 1.00 0.00 C ATOM 1134 CG1 ILE E 5 12.275 9.254 -14.380 1.00 0.00 C ATOM 1135 CG2 ILE E 5 11.795 6.904 -15.069 1.00 0.00 C ATOM 1136 CD1 ILE E 5 12.601 9.941 -13.053 1.00 0.00 C ATOM 0 H ILE E 5 9.007 8.808 -12.471 1.00 0.00 H new ATOM 0 HA ILE E 5 9.823 8.916 -15.307 1.00 0.00 H new ATOM 0 HB ILE E 5 11.517 7.707 -13.088 1.00 0.00 H new ATOM 0 HG12 ILE E 5 13.195 8.949 -14.879 1.00 0.00 H new ATOM 0 HG13 ILE E 5 11.766 9.950 -15.047 1.00 0.00 H new ATOM 0 HG21 ILE E 5 12.840 6.645 -14.901 1.00 0.00 H new ATOM 0 HG22 ILE E 5 11.170 6.030 -14.882 1.00 0.00 H new ATOM 0 HG23 ILE E 5 11.663 7.230 -16.101 1.00 0.00 H new ATOM 0 HD11 ILE E 5 13.232 10.810 -13.239 1.00 0.00 H new ATOM 0 HD12 ILE E 5 11.676 10.260 -12.571 1.00 0.00 H new ATOM 0 HD13 ILE E 5 13.127 9.243 -12.402 1.00 0.00 H new ATOM 1148 N THR E 6 9.017 6.446 -15.464 1.00 0.00 N ATOM 1149 CA THR E 6 8.223 5.188 -15.507 1.00 0.00 C ATOM 1150 C THR E 6 9.071 4.048 -14.942 1.00 0.00 C ATOM 1151 O THR E 6 10.280 4.060 -15.038 1.00 0.00 O ATOM 1152 CB THR E 6 7.837 4.869 -16.954 1.00 0.00 C ATOM 1153 OG1 THR E 6 7.644 6.083 -17.668 1.00 0.00 O ATOM 1154 CG2 THR E 6 6.544 4.053 -16.967 1.00 0.00 C ATOM 0 H THR E 6 9.472 6.706 -16.339 1.00 0.00 H new ATOM 0 HA THR E 6 7.316 5.306 -14.914 1.00 0.00 H new ATOM 0 HB THR E 6 8.632 4.293 -17.427 1.00 0.00 H new ATOM 0 HG1 THR E 6 7.398 5.882 -18.595 1.00 0.00 H new ATOM 0 HG21 THR E 6 6.268 3.825 -17.997 1.00 0.00 H new ATOM 0 HG22 THR E 6 6.695 3.124 -16.418 1.00 0.00 H new ATOM 0 HG23 THR E 6 5.746 4.628 -16.496 1.00 0.00 H new ATOM 1162 N LEU E 7 8.451 3.067 -14.350 1.00 0.00 N ATOM 1163 CA LEU E 7 9.228 1.931 -13.778 1.00 0.00 C ATOM 1164 C LEU E 7 10.120 1.324 -14.864 1.00 0.00 C ATOM 1165 O LEU E 7 11.058 0.607 -14.579 1.00 0.00 O ATOM 1166 CB LEU E 7 8.258 0.865 -13.256 1.00 0.00 C ATOM 1167 CG LEU E 7 9.008 -0.446 -13.004 1.00 0.00 C ATOM 1168 CD1 LEU E 7 9.972 -0.270 -11.829 1.00 0.00 C ATOM 1169 CD2 LEU E 7 8.004 -1.552 -12.673 1.00 0.00 C ATOM 0 H LEU E 7 7.439 3.002 -14.237 1.00 0.00 H new ATOM 0 HA LEU E 7 9.850 2.290 -12.958 1.00 0.00 H new ATOM 0 HB2 LEU E 7 7.789 1.208 -12.334 1.00 0.00 H new ATOM 0 HB3 LEU E 7 7.459 0.703 -13.979 1.00 0.00 H new ATOM 0 HG LEU E 7 9.570 -0.717 -13.898 1.00 0.00 H new ATOM 0 HD11 LEU E 7 10.504 -1.205 -11.652 1.00 0.00 H new ATOM 0 HD12 LEU E 7 10.689 0.518 -12.061 1.00 0.00 H new ATOM 0 HD13 LEU E 7 9.411 0.003 -10.935 1.00 0.00 H new ATOM 0 HD21 LEU E 7 8.537 -2.486 -12.494 1.00 0.00 H new ATOM 0 HD22 LEU E 7 7.442 -1.278 -11.780 1.00 0.00 H new ATOM 0 HD23 LEU E 7 7.317 -1.682 -13.509 1.00 0.00 H new ATOM 1181 N LYS E 8 9.831 1.595 -16.107 1.00 0.00 N ATOM 1182 CA LYS E 8 10.657 1.021 -17.205 1.00 0.00 C ATOM 1183 C LYS E 8 11.845 1.942 -17.508 1.00 0.00 C ATOM 1184 O LYS E 8 12.919 1.491 -17.853 1.00 0.00 O ATOM 1185 CB LYS E 8 9.784 0.855 -18.457 1.00 0.00 C ATOM 1186 CG LYS E 8 9.670 2.189 -19.203 1.00 0.00 C ATOM 1187 CD LYS E 8 10.881 2.364 -20.121 1.00 0.00 C ATOM 1188 CE LYS E 8 10.406 2.681 -21.539 1.00 0.00 C ATOM 1189 NZ LYS E 8 9.927 4.092 -21.598 1.00 0.00 N ATOM 0 H LYS E 8 9.059 2.189 -16.409 1.00 0.00 H new ATOM 0 HA LYS E 8 11.043 0.048 -16.900 1.00 0.00 H new ATOM 0 HB2 LYS E 8 10.216 0.099 -19.113 1.00 0.00 H new ATOM 0 HB3 LYS E 8 8.792 0.502 -18.174 1.00 0.00 H new ATOM 0 HG2 LYS E 8 8.750 2.214 -19.788 1.00 0.00 H new ATOM 0 HG3 LYS E 8 9.618 3.013 -18.491 1.00 0.00 H new ATOM 0 HD2 LYS E 8 11.517 3.168 -19.751 1.00 0.00 H new ATOM 0 HD3 LYS E 8 11.483 1.456 -20.123 1.00 0.00 H new ATOM 0 HE2 LYS E 8 11.220 2.532 -22.249 1.00 0.00 H new ATOM 0 HE3 LYS E 8 9.604 2.001 -21.826 1.00 0.00 H new ATOM 0 HZ1 LYS E 8 9.018 4.129 -22.102 1.00 0.00 H new ATOM 0 HZ2 LYS E 8 9.803 4.457 -20.632 1.00 0.00 H new ATOM 0 HZ3 LYS E 8 10.626 4.675 -22.101 1.00 0.00 H new ATOM 1203 N ASP E 9 11.661 3.227 -17.385 1.00 0.00 N ATOM 1204 CA ASP E 9 12.779 4.174 -17.670 1.00 0.00 C ATOM 1205 C ASP E 9 13.687 4.282 -16.445 1.00 0.00 C ATOM 1206 O ASP E 9 14.821 4.707 -16.535 1.00 0.00 O ATOM 1207 CB ASP E 9 12.209 5.556 -17.992 1.00 0.00 C ATOM 1208 CG ASP E 9 12.311 5.817 -19.497 1.00 0.00 C ATOM 1209 OD1 ASP E 9 13.142 5.189 -20.133 1.00 0.00 O ATOM 1210 OD2 ASP E 9 11.556 6.640 -19.988 1.00 0.00 O ATOM 0 H ASP E 9 10.785 3.664 -17.099 1.00 0.00 H new ATOM 0 HA ASP E 9 13.353 3.804 -18.520 1.00 0.00 H new ATOM 0 HB2 ASP E 9 11.169 5.615 -17.672 1.00 0.00 H new ATOM 0 HB3 ASP E 9 12.755 6.323 -17.442 1.00 0.00 H new ATOM 1215 N TYR E 10 13.194 3.902 -15.299 1.00 0.00 N ATOM 1216 CA TYR E 10 14.023 3.984 -14.067 1.00 0.00 C ATOM 1217 C TYR E 10 14.825 2.692 -13.913 1.00 0.00 C ATOM 1218 O TYR E 10 15.925 2.688 -13.401 1.00 0.00 O ATOM 1219 CB TYR E 10 13.105 4.168 -12.855 1.00 0.00 C ATOM 1220 CG TYR E 10 13.922 4.123 -11.585 1.00 0.00 C ATOM 1221 CD1 TYR E 10 15.045 4.946 -11.446 1.00 0.00 C ATOM 1222 CD2 TYR E 10 13.553 3.260 -10.546 1.00 0.00 C ATOM 1223 CE1 TYR E 10 15.801 4.905 -10.266 1.00 0.00 C ATOM 1224 CE2 TYR E 10 14.307 3.220 -9.367 1.00 0.00 C ATOM 1225 CZ TYR E 10 15.431 4.043 -9.227 1.00 0.00 C ATOM 1226 OH TYR E 10 16.174 4.004 -8.066 1.00 0.00 O ATOM 0 H TYR E 10 12.251 3.538 -15.164 1.00 0.00 H new ATOM 0 HA TYR E 10 14.708 4.829 -14.136 1.00 0.00 H new ATOM 0 HB2 TYR E 10 12.579 5.120 -12.927 1.00 0.00 H new ATOM 0 HB3 TYR E 10 12.347 3.385 -12.839 1.00 0.00 H new ATOM 0 HD1 TYR E 10 15.329 5.612 -12.247 1.00 0.00 H new ATOM 0 HD2 TYR E 10 12.686 2.625 -10.654 1.00 0.00 H new ATOM 0 HE1 TYR E 10 16.669 5.539 -10.159 1.00 0.00 H new ATOM 0 HE2 TYR E 10 14.022 2.554 -8.566 1.00 0.00 H new ATOM 0 HH TYR E 10 15.780 3.354 -7.447 1.00 0.00 H new ATOM 1236 N ALA E 11 14.280 1.595 -14.357 1.00 0.00 N ATOM 1237 CA ALA E 11 15.005 0.300 -14.241 1.00 0.00 C ATOM 1238 C ALA E 11 15.915 0.112 -15.456 1.00 0.00 C ATOM 1239 O ALA E 11 16.912 -0.579 -15.396 1.00 0.00 O ATOM 1240 CB ALA E 11 13.987 -0.842 -14.185 1.00 0.00 C ATOM 0 H ALA E 11 13.361 1.539 -14.796 1.00 0.00 H new ATOM 0 HA ALA E 11 15.610 0.299 -13.334 1.00 0.00 H new ATOM 0 HB1 ALA E 11 14.512 -1.793 -14.100 1.00 0.00 H new ATOM 0 HB2 ALA E 11 13.337 -0.708 -13.321 1.00 0.00 H new ATOM 0 HB3 ALA E 11 13.386 -0.839 -15.095 1.00 0.00 H new ATOM 1246 N MET E 12 15.575 0.716 -16.562 1.00 0.00 N ATOM 1247 CA MET E 12 16.414 0.566 -17.784 1.00 0.00 C ATOM 1248 C MET E 12 17.475 1.669 -17.834 1.00 0.00 C ATOM 1249 O MET E 12 18.566 1.471 -18.332 1.00 0.00 O ATOM 1250 CB MET E 12 15.523 0.666 -19.025 1.00 0.00 C ATOM 1251 CG MET E 12 14.772 -0.653 -19.228 1.00 0.00 C ATOM 1252 SD MET E 12 14.831 -1.117 -20.977 1.00 0.00 S ATOM 1253 CE MET E 12 15.538 -2.768 -20.749 1.00 0.00 C ATOM 0 H MET E 12 14.751 1.308 -16.672 1.00 0.00 H new ATOM 0 HA MET E 12 16.909 -0.405 -17.759 1.00 0.00 H new ATOM 0 HB2 MET E 12 14.814 1.486 -18.910 1.00 0.00 H new ATOM 0 HB3 MET E 12 16.129 0.889 -19.903 1.00 0.00 H new ATOM 0 HG2 MET E 12 15.220 -1.437 -18.617 1.00 0.00 H new ATOM 0 HG3 MET E 12 13.737 -0.548 -18.903 1.00 0.00 H new ATOM 0 HE1 MET E 12 15.663 -3.247 -21.720 1.00 0.00 H new ATOM 0 HE2 MET E 12 16.507 -2.684 -20.258 1.00 0.00 H new ATOM 0 HE3 MET E 12 14.869 -3.368 -20.132 1.00 0.00 H new ATOM 1263 N ARG E 13 17.160 2.833 -17.338 1.00 0.00 N ATOM 1264 CA ARG E 13 18.148 3.951 -17.375 1.00 0.00 C ATOM 1265 C ARG E 13 19.007 3.950 -16.108 1.00 0.00 C ATOM 1266 O ARG E 13 20.168 4.304 -16.140 1.00 0.00 O ATOM 1267 CB ARG E 13 17.403 5.285 -17.485 1.00 0.00 C ATOM 1268 CG ARG E 13 16.468 5.248 -18.696 1.00 0.00 C ATOM 1269 CD ARG E 13 17.092 6.037 -19.850 1.00 0.00 C ATOM 1270 NE ARG E 13 17.367 5.115 -20.989 1.00 0.00 N ATOM 1271 CZ ARG E 13 17.732 5.598 -22.145 1.00 0.00 C ATOM 1272 NH1 ARG E 13 18.844 6.272 -22.250 1.00 0.00 N ATOM 1273 NH2 ARG E 13 16.986 5.404 -23.199 1.00 0.00 N ATOM 0 H ARG E 13 16.263 3.060 -16.909 1.00 0.00 H new ATOM 0 HA ARG E 13 18.798 3.817 -18.240 1.00 0.00 H new ATOM 0 HB2 ARG E 13 16.831 5.470 -16.576 1.00 0.00 H new ATOM 0 HB3 ARG E 13 18.115 6.104 -17.586 1.00 0.00 H new ATOM 0 HG2 ARG E 13 16.292 4.216 -19.001 1.00 0.00 H new ATOM 0 HG3 ARG E 13 15.499 5.673 -18.433 1.00 0.00 H new ATOM 0 HD2 ARG E 13 16.418 6.833 -20.167 1.00 0.00 H new ATOM 0 HD3 ARG E 13 18.016 6.513 -19.522 1.00 0.00 H new ATOM 0 HE ARG E 13 17.270 4.107 -20.865 1.00 0.00 H new ATOM 0 HH11 ARG E 13 19.429 6.422 -21.428 1.00 0.00 H new ATOM 0 HH12 ARG E 13 19.128 6.649 -23.154 1.00 0.00 H new ATOM 0 HH21 ARG E 13 16.118 4.875 -23.119 1.00 0.00 H new ATOM 0 HH22 ARG E 13 17.272 5.782 -24.102 1.00 0.00 H new ATOM 1287 N PHE E 14 18.454 3.560 -14.992 1.00 0.00 N ATOM 1288 CA PHE E 14 19.260 3.550 -13.736 1.00 0.00 C ATOM 1289 C PHE E 14 19.695 2.123 -13.414 1.00 0.00 C ATOM 1290 O PHE E 14 20.854 1.858 -13.164 1.00 0.00 O ATOM 1291 CB PHE E 14 18.427 4.106 -12.577 1.00 0.00 C ATOM 1292 CG PHE E 14 17.964 5.502 -12.919 1.00 0.00 C ATOM 1293 CD1 PHE E 14 17.029 5.699 -13.941 1.00 0.00 C ATOM 1294 CD2 PHE E 14 18.474 6.599 -12.215 1.00 0.00 C ATOM 1295 CE1 PHE E 14 16.601 6.993 -14.258 1.00 0.00 C ATOM 1296 CE2 PHE E 14 18.047 7.894 -12.533 1.00 0.00 C ATOM 1297 CZ PHE E 14 17.110 8.091 -13.555 1.00 0.00 C ATOM 0 H PHE E 14 17.487 3.250 -14.894 1.00 0.00 H new ATOM 0 HA PHE E 14 20.142 4.174 -13.875 1.00 0.00 H new ATOM 0 HB2 PHE E 14 17.568 3.462 -12.390 1.00 0.00 H new ATOM 0 HB3 PHE E 14 19.020 4.121 -11.662 1.00 0.00 H new ATOM 0 HD1 PHE E 14 16.638 4.852 -14.485 1.00 0.00 H new ATOM 0 HD2 PHE E 14 19.197 6.447 -11.427 1.00 0.00 H new ATOM 0 HE1 PHE E 14 15.878 7.145 -15.045 1.00 0.00 H new ATOM 0 HE2 PHE E 14 18.440 8.741 -11.990 1.00 0.00 H new ATOM 0 HZ PHE E 14 16.780 9.090 -13.801 1.00 0.00 H new ATOM 1307 N GLY E 15 18.779 1.199 -13.418 1.00 0.00 N ATOM 1308 CA GLY E 15 19.148 -0.212 -13.114 1.00 0.00 C ATOM 1309 C GLY E 15 17.955 -0.939 -12.492 1.00 0.00 C ATOM 1310 O GLY E 15 17.184 -0.365 -11.749 1.00 0.00 O ATOM 0 H GLY E 15 17.791 1.357 -13.618 1.00 0.00 H new ATOM 0 HA2 GLY E 15 19.459 -0.720 -14.027 1.00 0.00 H new ATOM 0 HA3 GLY E 15 19.997 -0.236 -12.430 1.00 0.00 H new ATOM 1314 N GLN E 16 17.799 -2.200 -12.789 1.00 0.00 N ATOM 1315 CA GLN E 16 16.659 -2.965 -12.212 1.00 0.00 C ATOM 1316 C GLN E 16 17.048 -3.486 -10.827 1.00 0.00 C ATOM 1317 O GLN E 16 16.205 -3.784 -10.005 1.00 0.00 O ATOM 1318 CB GLN E 16 16.316 -4.144 -13.127 1.00 0.00 C ATOM 1319 CG GLN E 16 16.299 -3.675 -14.583 1.00 0.00 C ATOM 1320 CD GLN E 16 15.028 -4.178 -15.269 1.00 0.00 C ATOM 1321 OE1 GLN E 16 14.259 -3.398 -15.797 1.00 0.00 O ATOM 1322 NE2 GLN E 16 14.772 -5.457 -15.286 1.00 0.00 N ATOM 0 H GLN E 16 18.412 -2.733 -13.406 1.00 0.00 H new ATOM 0 HA GLN E 16 15.790 -2.313 -12.125 1.00 0.00 H new ATOM 0 HB2 GLN E 16 17.048 -4.941 -13.000 1.00 0.00 H new ATOM 0 HB3 GLN E 16 15.344 -4.557 -12.856 1.00 0.00 H new ATOM 0 HG2 GLN E 16 16.341 -2.587 -14.626 1.00 0.00 H new ATOM 0 HG3 GLN E 16 17.179 -4.049 -15.106 1.00 0.00 H new ATOM 0 HE21 GLN E 16 15.417 -6.112 -14.843 1.00 0.00 H new ATOM 0 HE22 GLN E 16 13.927 -5.802 -15.742 1.00 0.00 H new ATOM 1331 N THR E 17 18.323 -3.594 -10.560 1.00 0.00 N ATOM 1332 CA THR E 17 18.766 -4.093 -9.226 1.00 0.00 C ATOM 1333 C THR E 17 18.515 -3.013 -8.172 1.00 0.00 C ATOM 1334 O THR E 17 18.120 -3.298 -7.059 1.00 0.00 O ATOM 1335 CB THR E 17 20.262 -4.421 -9.272 1.00 0.00 C ATOM 1336 OG1 THR E 17 20.681 -4.885 -7.996 1.00 0.00 O ATOM 1337 CG2 THR E 17 21.052 -3.165 -9.643 1.00 0.00 C ATOM 0 H THR E 17 19.075 -3.359 -11.207 1.00 0.00 H new ATOM 0 HA THR E 17 18.205 -4.992 -8.970 1.00 0.00 H new ATOM 0 HB THR E 17 20.442 -5.194 -10.019 1.00 0.00 H new ATOM 0 HG1 THR E 17 21.637 -5.097 -8.023 1.00 0.00 H new ATOM 0 HG21 THR E 17 22.116 -3.401 -9.675 1.00 0.00 H new ATOM 0 HG22 THR E 17 20.730 -2.808 -10.621 1.00 0.00 H new ATOM 0 HG23 THR E 17 20.874 -2.390 -8.897 1.00 0.00 H new ATOM 1345 N LYS E 18 18.739 -1.774 -8.515 1.00 0.00 N ATOM 1346 CA LYS E 18 18.510 -0.675 -7.533 1.00 0.00 C ATOM 1347 C LYS E 18 17.016 -0.359 -7.468 1.00 0.00 C ATOM 1348 O LYS E 18 16.478 -0.058 -6.420 1.00 0.00 O ATOM 1349 CB LYS E 18 19.278 0.572 -7.978 1.00 0.00 C ATOM 1350 CG LYS E 18 18.797 0.995 -9.367 1.00 0.00 C ATOM 1351 CD LYS E 18 19.964 1.593 -10.154 1.00 0.00 C ATOM 1352 CE LYS E 18 20.624 2.699 -9.329 1.00 0.00 C ATOM 1353 NZ LYS E 18 21.945 2.223 -8.825 1.00 0.00 N ATOM 0 H LYS E 18 19.070 -1.475 -9.432 1.00 0.00 H new ATOM 0 HA LYS E 18 18.860 -0.984 -6.548 1.00 0.00 H new ATOM 0 HB2 LYS E 18 19.123 1.382 -7.265 1.00 0.00 H new ATOM 0 HB3 LYS E 18 20.348 0.366 -7.999 1.00 0.00 H new ATOM 0 HG2 LYS E 18 18.389 0.136 -9.899 1.00 0.00 H new ATOM 0 HG3 LYS E 18 17.993 1.726 -9.278 1.00 0.00 H new ATOM 0 HD2 LYS E 18 20.692 0.817 -10.390 1.00 0.00 H new ATOM 0 HD3 LYS E 18 19.608 1.996 -11.102 1.00 0.00 H new ATOM 0 HE2 LYS E 18 20.756 3.593 -9.939 1.00 0.00 H new ATOM 0 HE3 LYS E 18 19.982 2.976 -8.493 1.00 0.00 H new ATOM 0 HZ1 LYS E 18 22.621 3.013 -8.824 1.00 0.00 H new ATOM 0 HZ2 LYS E 18 21.837 1.859 -7.857 1.00 0.00 H new ATOM 0 HZ3 LYS E 18 22.299 1.465 -9.442 1.00 0.00 H new ATOM 1367 N THR E 19 16.341 -0.427 -8.581 1.00 0.00 N ATOM 1368 CA THR E 19 14.880 -0.134 -8.586 1.00 0.00 C ATOM 1369 C THR E 19 14.149 -1.202 -7.773 1.00 0.00 C ATOM 1370 O THR E 19 13.210 -0.917 -7.056 1.00 0.00 O ATOM 1371 CB THR E 19 14.361 -0.139 -10.027 1.00 0.00 C ATOM 1372 OG1 THR E 19 15.122 0.773 -10.807 1.00 0.00 O ATOM 1373 CG2 THR E 19 12.889 0.274 -10.045 1.00 0.00 C ATOM 0 H THR E 19 16.738 -0.673 -9.488 1.00 0.00 H new ATOM 0 HA THR E 19 14.702 0.846 -8.144 1.00 0.00 H new ATOM 0 HB THR E 19 14.458 -1.142 -10.443 1.00 0.00 H new ATOM 0 HG1 THR E 19 14.957 1.687 -10.495 1.00 0.00 H new ATOM 0 HG21 THR E 19 12.522 0.270 -11.071 1.00 0.00 H new ATOM 0 HG22 THR E 19 12.307 -0.428 -9.449 1.00 0.00 H new ATOM 0 HG23 THR E 19 12.787 1.276 -9.628 1.00 0.00 H new ATOM 1381 N ALA E 20 14.575 -2.432 -7.875 1.00 0.00 N ATOM 1382 CA ALA E 20 13.907 -3.516 -7.105 1.00 0.00 C ATOM 1383 C ALA E 20 14.302 -3.408 -5.632 1.00 0.00 C ATOM 1384 O ALA E 20 13.528 -3.714 -4.748 1.00 0.00 O ATOM 1385 CB ALA E 20 14.346 -4.877 -7.652 1.00 0.00 C ATOM 0 H ALA E 20 15.356 -2.731 -8.458 1.00 0.00 H new ATOM 0 HA ALA E 20 12.826 -3.418 -7.202 1.00 0.00 H new ATOM 0 HB1 ALA E 20 13.857 -5.671 -7.088 1.00 0.00 H new ATOM 0 HB2 ALA E 20 14.067 -4.954 -8.703 1.00 0.00 H new ATOM 0 HB3 ALA E 20 15.427 -4.977 -7.555 1.00 0.00 H new ATOM 1391 N LYS E 21 15.503 -2.974 -5.361 1.00 0.00 N ATOM 1392 CA LYS E 21 15.946 -2.846 -3.944 1.00 0.00 C ATOM 1393 C LYS E 21 15.306 -1.604 -3.320 1.00 0.00 C ATOM 1394 O LYS E 21 15.187 -1.494 -2.116 1.00 0.00 O ATOM 1395 CB LYS E 21 17.469 -2.714 -3.894 1.00 0.00 C ATOM 1396 CG LYS E 21 18.094 -4.084 -3.617 1.00 0.00 C ATOM 1397 CD LYS E 21 19.570 -4.062 -4.020 1.00 0.00 C ATOM 1398 CE LYS E 21 20.384 -3.354 -2.937 1.00 0.00 C ATOM 1399 NZ LYS E 21 20.732 -4.326 -1.862 1.00 0.00 N ATOM 0 H LYS E 21 16.196 -2.703 -6.059 1.00 0.00 H new ATOM 0 HA LYS E 21 15.640 -3.732 -3.387 1.00 0.00 H new ATOM 0 HB2 LYS E 21 17.841 -2.318 -4.839 1.00 0.00 H new ATOM 0 HB3 LYS E 21 17.758 -2.007 -3.116 1.00 0.00 H new ATOM 0 HG2 LYS E 21 17.998 -4.332 -2.560 1.00 0.00 H new ATOM 0 HG3 LYS E 21 17.565 -4.857 -4.175 1.00 0.00 H new ATOM 0 HD2 LYS E 21 19.936 -5.080 -4.158 1.00 0.00 H new ATOM 0 HD3 LYS E 21 19.690 -3.548 -4.974 1.00 0.00 H new ATOM 0 HE2 LYS E 21 21.292 -2.931 -3.367 1.00 0.00 H new ATOM 0 HE3 LYS E 21 19.812 -2.525 -2.521 1.00 0.00 H new ATOM 0 HZ1 LYS E 21 21.286 -3.845 -1.125 1.00 0.00 H new ATOM 0 HZ2 LYS E 21 19.860 -4.709 -1.445 1.00 0.00 H new ATOM 0 HZ3 LYS E 21 21.294 -5.103 -2.265 1.00 0.00 H new ATOM 1413 N ASP E 22 14.893 -0.667 -4.129 1.00 0.00 N ATOM 1414 CA ASP E 22 14.262 0.565 -3.577 1.00 0.00 C ATOM 1415 C ASP E 22 12.754 0.347 -3.442 1.00 0.00 C ATOM 1416 O ASP E 22 12.109 0.914 -2.583 1.00 0.00 O ATOM 1417 CB ASP E 22 14.527 1.741 -4.519 1.00 0.00 C ATOM 1418 CG ASP E 22 14.857 2.989 -3.699 1.00 0.00 C ATOM 1419 OD1 ASP E 22 14.599 2.975 -2.506 1.00 0.00 O ATOM 1420 OD2 ASP E 22 15.362 3.936 -4.277 1.00 0.00 O ATOM 0 H ASP E 22 14.965 -0.701 -5.146 1.00 0.00 H new ATOM 0 HA ASP E 22 14.687 0.784 -2.597 1.00 0.00 H new ATOM 0 HB2 ASP E 22 15.354 1.504 -5.189 1.00 0.00 H new ATOM 0 HB3 ASP E 22 13.653 1.924 -5.144 1.00 0.00 H new ATOM 1425 N LEU E 23 12.187 -0.471 -4.287 1.00 0.00 N ATOM 1426 CA LEU E 23 10.721 -0.727 -4.209 1.00 0.00 C ATOM 1427 C LEU E 23 10.460 -1.910 -3.273 1.00 0.00 C ATOM 1428 O LEU E 23 9.359 -2.109 -2.800 1.00 0.00 O ATOM 1429 CB LEU E 23 10.185 -1.055 -5.605 1.00 0.00 C ATOM 1430 CG LEU E 23 10.084 0.228 -6.431 1.00 0.00 C ATOM 1431 CD1 LEU E 23 10.412 -0.081 -7.893 1.00 0.00 C ATOM 1432 CD2 LEU E 23 8.661 0.784 -6.337 1.00 0.00 C ATOM 0 H LEU E 23 12.676 -0.973 -5.028 1.00 0.00 H new ATOM 0 HA LEU E 23 10.217 0.160 -3.825 1.00 0.00 H new ATOM 0 HB2 LEU E 23 10.845 -1.767 -6.101 1.00 0.00 H new ATOM 0 HB3 LEU E 23 9.206 -1.528 -5.528 1.00 0.00 H new ATOM 0 HG LEU E 23 10.789 0.964 -6.046 1.00 0.00 H new ATOM 0 HD11 LEU E 23 10.340 0.833 -8.483 1.00 0.00 H new ATOM 0 HD12 LEU E 23 11.424 -0.479 -7.962 1.00 0.00 H new ATOM 0 HD13 LEU E 23 9.705 -0.817 -8.277 1.00 0.00 H new ATOM 0 HD21 LEU E 23 8.588 1.699 -6.925 1.00 0.00 H new ATOM 0 HD22 LEU E 23 7.956 0.047 -6.723 1.00 0.00 H new ATOM 0 HD23 LEU E 23 8.424 1.003 -5.296 1.00 0.00 H new ATOM 1444 N GLY E 24 11.466 -2.699 -3.007 1.00 0.00 N ATOM 1445 CA GLY E 24 11.277 -3.871 -2.105 1.00 0.00 C ATOM 1446 C GLY E 24 10.774 -5.064 -2.919 1.00 0.00 C ATOM 1447 O GLY E 24 10.275 -6.031 -2.379 1.00 0.00 O ATOM 0 H GLY E 24 12.410 -2.583 -3.375 1.00 0.00 H new ATOM 0 HA2 GLY E 24 12.218 -4.122 -1.615 1.00 0.00 H new ATOM 0 HA3 GLY E 24 10.563 -3.627 -1.318 1.00 0.00 H new ATOM 1451 N VAL E 25 10.900 -5.004 -4.217 1.00 0.00 N ATOM 1452 CA VAL E 25 10.425 -6.135 -5.068 1.00 0.00 C ATOM 1453 C VAL E 25 11.631 -6.915 -5.595 1.00 0.00 C ATOM 1454 O VAL E 25 12.754 -6.698 -5.184 1.00 0.00 O ATOM 1455 CB VAL E 25 9.608 -5.606 -6.257 1.00 0.00 C ATOM 1456 CG1 VAL E 25 8.165 -6.095 -6.141 1.00 0.00 C ATOM 1457 CG2 VAL E 25 9.618 -4.074 -6.273 1.00 0.00 C ATOM 0 H VAL E 25 11.311 -4.221 -4.726 1.00 0.00 H new ATOM 0 HA VAL E 25 9.793 -6.786 -4.465 1.00 0.00 H new ATOM 0 HB VAL E 25 10.055 -5.975 -7.180 1.00 0.00 H new ATOM 0 HG11 VAL E 25 7.585 -5.720 -6.984 1.00 0.00 H new ATOM 0 HG12 VAL E 25 8.149 -7.185 -6.145 1.00 0.00 H new ATOM 0 HG13 VAL E 25 7.731 -5.729 -5.211 1.00 0.00 H new ATOM 0 HG21 VAL E 25 9.035 -3.715 -7.121 1.00 0.00 H new ATOM 0 HG22 VAL E 25 9.182 -3.698 -5.348 1.00 0.00 H new ATOM 0 HG23 VAL E 25 10.644 -3.718 -6.362 1.00 0.00 H new ATOM 1467 N TYR E 26 11.406 -7.825 -6.504 1.00 0.00 N ATOM 1468 CA TYR E 26 12.538 -8.621 -7.059 1.00 0.00 C ATOM 1469 C TYR E 26 12.896 -8.090 -8.449 1.00 0.00 C ATOM 1470 O TYR E 26 12.104 -7.433 -9.095 1.00 0.00 O ATOM 1471 CB TYR E 26 12.135 -10.097 -7.172 1.00 0.00 C ATOM 1472 CG TYR E 26 11.052 -10.415 -6.168 1.00 0.00 C ATOM 1473 CD1 TYR E 26 11.346 -10.419 -4.799 1.00 0.00 C ATOM 1474 CD2 TYR E 26 9.754 -10.705 -6.606 1.00 0.00 C ATOM 1475 CE1 TYR E 26 10.342 -10.714 -3.869 1.00 0.00 C ATOM 1476 CE2 TYR E 26 8.751 -11.001 -5.676 1.00 0.00 C ATOM 1477 CZ TYR E 26 9.046 -11.005 -4.307 1.00 0.00 C ATOM 1478 OH TYR E 26 8.056 -11.297 -3.390 1.00 0.00 O ATOM 0 H TYR E 26 10.488 -8.051 -6.886 1.00 0.00 H new ATOM 0 HA TYR E 26 13.397 -8.532 -6.394 1.00 0.00 H new ATOM 0 HB2 TYR E 26 11.781 -10.310 -8.181 1.00 0.00 H new ATOM 0 HB3 TYR E 26 13.002 -10.734 -6.998 1.00 0.00 H new ATOM 0 HD1 TYR E 26 12.347 -10.195 -4.461 1.00 0.00 H new ATOM 0 HD2 TYR E 26 9.527 -10.700 -7.662 1.00 0.00 H new ATOM 0 HE1 TYR E 26 10.568 -10.717 -2.813 1.00 0.00 H new ATOM 0 HE2 TYR E 26 7.750 -11.226 -6.014 1.00 0.00 H new ATOM 0 HH TYR E 26 7.215 -11.474 -3.861 1.00 0.00 H new ATOM 1488 N GLN E 27 14.081 -8.373 -8.916 1.00 0.00 N ATOM 1489 CA GLN E 27 14.482 -7.885 -10.264 1.00 0.00 C ATOM 1490 C GLN E 27 13.621 -8.569 -11.326 1.00 0.00 C ATOM 1491 O GLN E 27 13.370 -8.022 -12.383 1.00 0.00 O ATOM 1492 CB GLN E 27 15.956 -8.214 -10.508 1.00 0.00 C ATOM 1493 CG GLN E 27 16.831 -7.289 -9.661 1.00 0.00 C ATOM 1494 CD GLN E 27 17.814 -8.124 -8.840 1.00 0.00 C ATOM 1495 OE1 GLN E 27 17.422 -8.813 -7.918 1.00 0.00 O ATOM 1496 NE2 GLN E 27 19.085 -8.093 -9.137 1.00 0.00 N ATOM 0 H GLN E 27 14.787 -8.920 -8.423 1.00 0.00 H new ATOM 0 HA GLN E 27 14.339 -6.806 -10.320 1.00 0.00 H new ATOM 0 HB2 GLN E 27 16.155 -9.255 -10.252 1.00 0.00 H new ATOM 0 HB3 GLN E 27 16.197 -8.094 -11.564 1.00 0.00 H new ATOM 0 HG2 GLN E 27 17.375 -6.597 -10.304 1.00 0.00 H new ATOM 0 HG3 GLN E 27 16.208 -6.687 -8.999 1.00 0.00 H new ATOM 0 HE21 GLN E 27 19.414 -7.515 -9.910 1.00 0.00 H new ATOM 0 HE22 GLN E 27 19.749 -8.647 -8.596 1.00 0.00 H new ATOM 1505 N SER E 28 13.159 -9.759 -11.054 1.00 0.00 N ATOM 1506 CA SER E 28 12.308 -10.474 -12.047 1.00 0.00 C ATOM 1507 C SER E 28 10.890 -9.907 -11.990 1.00 0.00 C ATOM 1508 O SER E 28 10.076 -10.147 -12.862 1.00 0.00 O ATOM 1509 CB SER E 28 12.277 -11.967 -11.717 1.00 0.00 C ATOM 1510 OG SER E 28 12.952 -12.688 -12.739 1.00 0.00 O ATOM 0 H SER E 28 13.334 -10.267 -10.187 1.00 0.00 H new ATOM 0 HA SER E 28 12.718 -10.337 -13.047 1.00 0.00 H new ATOM 0 HB2 SER E 28 12.753 -12.148 -10.753 1.00 0.00 H new ATOM 0 HB3 SER E 28 11.246 -12.311 -11.633 1.00 0.00 H new ATOM 0 HG SER E 28 12.935 -13.645 -12.530 1.00 0.00 H new ATOM 1516 N ALA E 29 10.590 -9.140 -10.977 1.00 0.00 N ATOM 1517 CA ALA E 29 9.230 -8.544 -10.871 1.00 0.00 C ATOM 1518 C ALA E 29 9.202 -7.268 -11.701 1.00 0.00 C ATOM 1519 O ALA E 29 8.213 -6.933 -12.321 1.00 0.00 O ATOM 1520 CB ALA E 29 8.925 -8.214 -9.408 1.00 0.00 C ATOM 0 H ALA E 29 11.229 -8.901 -10.219 1.00 0.00 H new ATOM 0 HA ALA E 29 8.481 -9.247 -11.236 1.00 0.00 H new ATOM 0 HB1 ALA E 29 7.929 -7.778 -9.333 1.00 0.00 H new ATOM 0 HB2 ALA E 29 8.967 -9.126 -8.813 1.00 0.00 H new ATOM 0 HB3 ALA E 29 9.661 -7.503 -9.034 1.00 0.00 H new ATOM 1526 N ILE E 30 10.296 -6.560 -11.728 1.00 0.00 N ATOM 1527 CA ILE E 30 10.360 -5.312 -12.530 1.00 0.00 C ATOM 1528 C ILE E 30 10.456 -5.691 -14.008 1.00 0.00 C ATOM 1529 O ILE E 30 9.899 -5.037 -14.867 1.00 0.00 O ATOM 1530 CB ILE E 30 11.596 -4.510 -12.112 1.00 0.00 C ATOM 1531 CG1 ILE E 30 11.308 -3.786 -10.796 1.00 0.00 C ATOM 1532 CG2 ILE E 30 11.937 -3.483 -13.193 1.00 0.00 C ATOM 1533 CD1 ILE E 30 11.956 -4.552 -9.641 1.00 0.00 C ATOM 0 H ILE E 30 11.152 -6.795 -11.226 1.00 0.00 H new ATOM 0 HA ILE E 30 9.470 -4.704 -12.365 1.00 0.00 H new ATOM 0 HB ILE E 30 12.439 -5.188 -11.982 1.00 0.00 H new ATOM 0 HG12 ILE E 30 11.697 -2.769 -10.835 1.00 0.00 H new ATOM 0 HG13 ILE E 30 10.232 -3.710 -10.638 1.00 0.00 H new ATOM 0 HG21 ILE E 30 12.817 -2.915 -12.891 1.00 0.00 H new ATOM 0 HG22 ILE E 30 12.142 -3.997 -14.132 1.00 0.00 H new ATOM 0 HG23 ILE E 30 11.095 -2.804 -13.328 1.00 0.00 H new ATOM 0 HD11 ILE E 30 11.751 -4.037 -8.703 1.00 0.00 H new ATOM 0 HD12 ILE E 30 11.546 -5.561 -9.598 1.00 0.00 H new ATOM 0 HD13 ILE E 30 13.033 -4.605 -9.798 1.00 0.00 H new ATOM 1545 N ASN E 31 11.153 -6.752 -14.304 1.00 0.00 N ATOM 1546 CA ASN E 31 11.283 -7.189 -15.721 1.00 0.00 C ATOM 1547 C ASN E 31 9.915 -7.640 -16.230 1.00 0.00 C ATOM 1548 O ASN E 31 9.507 -7.305 -17.324 1.00 0.00 O ATOM 1549 CB ASN E 31 12.272 -8.353 -15.807 1.00 0.00 C ATOM 1550 CG ASN E 31 12.611 -8.629 -17.272 1.00 0.00 C ATOM 1551 OD1 ASN E 31 12.224 -7.884 -18.150 1.00 0.00 O ATOM 1552 ND2 ASN E 31 13.325 -9.679 -17.575 1.00 0.00 N ATOM 0 H ASN E 31 11.639 -7.336 -13.624 1.00 0.00 H new ATOM 0 HA ASN E 31 11.648 -6.362 -16.331 1.00 0.00 H new ATOM 0 HB2 ASN E 31 13.179 -8.115 -15.252 1.00 0.00 H new ATOM 0 HB3 ASN E 31 11.842 -9.244 -15.348 1.00 0.00 H new ATOM 0 HD21 ASN E 31 13.558 -9.874 -18.549 1.00 0.00 H new ATOM 0 HD22 ASN E 31 13.650 -10.305 -16.838 1.00 0.00 H new ATOM 1559 N LYS E 32 9.197 -8.397 -15.443 1.00 0.00 N ATOM 1560 CA LYS E 32 7.854 -8.862 -15.884 1.00 0.00 C ATOM 1561 C LYS E 32 6.905 -7.665 -15.943 1.00 0.00 C ATOM 1562 O LYS E 32 6.007 -7.610 -16.759 1.00 0.00 O ATOM 1563 CB LYS E 32 7.317 -9.893 -14.891 1.00 0.00 C ATOM 1564 CG LYS E 32 8.211 -11.135 -14.909 1.00 0.00 C ATOM 1565 CD LYS E 32 8.088 -11.870 -13.573 1.00 0.00 C ATOM 1566 CE LYS E 32 6.837 -12.750 -13.590 1.00 0.00 C ATOM 1567 NZ LYS E 32 6.843 -13.645 -12.399 1.00 0.00 N ATOM 0 H LYS E 32 9.484 -8.712 -14.516 1.00 0.00 H new ATOM 0 HA LYS E 32 7.930 -9.320 -16.870 1.00 0.00 H new ATOM 0 HB2 LYS E 32 7.289 -9.467 -13.888 1.00 0.00 H new ATOM 0 HB3 LYS E 32 6.294 -10.165 -15.151 1.00 0.00 H new ATOM 0 HG2 LYS E 32 7.920 -11.794 -15.727 1.00 0.00 H new ATOM 0 HG3 LYS E 32 9.248 -10.848 -15.084 1.00 0.00 H new ATOM 0 HD2 LYS E 32 8.974 -12.481 -13.399 1.00 0.00 H new ATOM 0 HD3 LYS E 32 8.030 -11.152 -12.755 1.00 0.00 H new ATOM 0 HE2 LYS E 32 5.942 -12.128 -13.586 1.00 0.00 H new ATOM 0 HE3 LYS E 32 6.809 -13.343 -14.504 1.00 0.00 H new ATOM 0 HZ1 LYS E 32 5.993 -14.243 -12.410 1.00 0.00 H new ATOM 0 HZ2 LYS E 32 7.691 -14.247 -12.422 1.00 0.00 H new ATOM 0 HZ3 LYS E 32 6.850 -13.070 -11.533 1.00 0.00 H new ATOM 1581 N ALA E 33 7.099 -6.702 -15.085 1.00 0.00 N ATOM 1582 CA ALA E 33 6.212 -5.505 -15.093 1.00 0.00 C ATOM 1583 C ALA E 33 6.417 -4.737 -16.398 1.00 0.00 C ATOM 1584 O ALA E 33 5.481 -4.249 -17.000 1.00 0.00 O ATOM 1585 CB ALA E 33 6.561 -4.601 -13.910 1.00 0.00 C ATOM 0 H ALA E 33 7.834 -6.692 -14.378 1.00 0.00 H new ATOM 0 HA ALA E 33 5.172 -5.820 -15.011 1.00 0.00 H new ATOM 0 HB1 ALA E 33 5.911 -3.726 -13.917 1.00 0.00 H new ATOM 0 HB2 ALA E 33 6.420 -5.150 -12.979 1.00 0.00 H new ATOM 0 HB3 ALA E 33 7.600 -4.282 -13.990 1.00 0.00 H new ATOM 1591 N ILE E 34 7.638 -4.636 -16.841 1.00 0.00 N ATOM 1592 CA ILE E 34 7.916 -3.910 -18.111 1.00 0.00 C ATOM 1593 C ILE E 34 7.525 -4.805 -19.289 1.00 0.00 C ATOM 1594 O ILE E 34 7.202 -4.334 -20.362 1.00 0.00 O ATOM 1595 CB ILE E 34 9.408 -3.578 -18.188 1.00 0.00 C ATOM 1596 CG1 ILE E 34 9.722 -2.421 -17.237 1.00 0.00 C ATOM 1597 CG2 ILE E 34 9.776 -3.173 -19.617 1.00 0.00 C ATOM 1598 CD1 ILE E 34 11.065 -2.677 -16.551 1.00 0.00 C ATOM 0 H ILE E 34 8.458 -5.026 -16.377 1.00 0.00 H new ATOM 0 HA ILE E 34 7.340 -2.985 -18.146 1.00 0.00 H new ATOM 0 HB ILE E 34 9.986 -4.456 -17.902 1.00 0.00 H new ATOM 0 HG12 ILE E 34 9.756 -1.481 -17.789 1.00 0.00 H new ATOM 0 HG13 ILE E 34 8.933 -2.324 -16.491 1.00 0.00 H new ATOM 0 HG21 ILE E 34 10.839 -2.938 -19.666 1.00 0.00 H new ATOM 0 HG22 ILE E 34 9.555 -3.996 -20.297 1.00 0.00 H new ATOM 0 HG23 ILE E 34 9.197 -2.297 -19.907 1.00 0.00 H new ATOM 0 HD11 ILE E 34 11.290 -1.854 -15.873 1.00 0.00 H new ATOM 0 HD12 ILE E 34 11.014 -3.608 -15.986 1.00 0.00 H new ATOM 0 HD13 ILE E 34 11.850 -2.752 -17.304 1.00 0.00 H new ATOM 1610 N HIS E 35 7.552 -6.094 -19.091 1.00 0.00 N ATOM 1611 CA HIS E 35 7.183 -7.029 -20.189 1.00 0.00 C ATOM 1612 C HIS E 35 5.676 -6.946 -20.441 1.00 0.00 C ATOM 1613 O HIS E 35 5.196 -7.278 -21.507 1.00 0.00 O ATOM 1614 CB HIS E 35 7.555 -8.456 -19.783 1.00 0.00 C ATOM 1615 CG HIS E 35 9.003 -8.706 -20.097 1.00 0.00 C ATOM 1616 ND1 HIS E 35 9.743 -9.861 -20.157 1.00 0.00 N flip ATOM 1617 CD2 HIS E 35 9.883 -7.678 -20.398 1.00 0.00 C flip ATOM 1618 CE1 HIS E 35 11.059 -9.559 -20.491 1.00 0.00 C flip ATOM 1619 NE2 HIS E 35 11.088 -8.230 -20.625 1.00 0.00 N flip ATOM 0 H HIS E 35 7.815 -6.541 -18.213 1.00 0.00 H new ATOM 0 HA HIS E 35 7.719 -6.757 -21.099 1.00 0.00 H new ATOM 0 HB2 HIS E 35 7.373 -8.602 -18.718 1.00 0.00 H new ATOM 0 HB3 HIS E 35 6.928 -9.172 -20.315 1.00 0.00 H new ATOM 0 HD2 HIS E 35 9.644 -6.626 -20.442 1.00 0.00 H new ATOM 0 HE1 HIS E 35 11.880 -10.250 -20.615 1.00 0.00 H new ATOM 0 HE2 HIS E 35 11.923 -7.698 -20.870 1.00 0.00 H new ATOM 1627 N ALA E 36 4.926 -6.507 -19.466 1.00 0.00 N ATOM 1628 CA ALA E 36 3.451 -6.405 -19.651 1.00 0.00 C ATOM 1629 C ALA E 36 3.105 -5.041 -20.248 1.00 0.00 C ATOM 1630 O ALA E 36 1.997 -4.808 -20.690 1.00 0.00 O ATOM 1631 CB ALA E 36 2.755 -6.559 -18.296 1.00 0.00 C ATOM 0 H ALA E 36 5.271 -6.215 -18.551 1.00 0.00 H new ATOM 0 HA ALA E 36 3.114 -7.193 -20.325 1.00 0.00 H new ATOM 0 HB1 ALA E 36 1.676 -6.484 -18.431 1.00 0.00 H new ATOM 0 HB2 ALA E 36 3.001 -7.531 -17.869 1.00 0.00 H new ATOM 0 HB3 ALA E 36 3.092 -5.771 -17.622 1.00 0.00 H new ATOM 1637 N GLY E 37 4.044 -4.134 -20.265 1.00 0.00 N ATOM 1638 CA GLY E 37 3.766 -2.785 -20.835 1.00 0.00 C ATOM 1639 C GLY E 37 2.625 -2.127 -20.058 1.00 0.00 C ATOM 1640 O GLY E 37 1.990 -1.206 -20.531 1.00 0.00 O ATOM 0 H GLY E 37 4.990 -4.269 -19.909 1.00 0.00 H new ATOM 0 HA2 GLY E 37 4.661 -2.165 -20.782 1.00 0.00 H new ATOM 0 HA3 GLY E 37 3.500 -2.872 -21.888 1.00 0.00 H new ATOM 1644 N ARG E 38 2.362 -2.593 -18.868 1.00 0.00 N ATOM 1645 CA ARG E 38 1.264 -1.991 -18.060 1.00 0.00 C ATOM 1646 C ARG E 38 1.610 -0.539 -17.734 1.00 0.00 C ATOM 1647 O ARG E 38 2.738 -0.112 -17.879 1.00 0.00 O ATOM 1648 CB ARG E 38 1.095 -2.780 -16.759 1.00 0.00 C ATOM 1649 CG ARG E 38 0.993 -4.273 -17.079 1.00 0.00 C ATOM 1650 CD ARG E 38 -0.403 -4.778 -16.711 1.00 0.00 C ATOM 1651 NE ARG E 38 -0.536 -6.203 -17.121 1.00 0.00 N ATOM 1652 CZ ARG E 38 -0.755 -7.121 -16.222 1.00 0.00 C ATOM 1653 NH1 ARG E 38 -1.848 -7.088 -15.510 1.00 0.00 N ATOM 1654 NH2 ARG E 38 0.121 -8.070 -16.031 1.00 0.00 N ATOM 0 H ARG E 38 2.859 -3.363 -18.421 1.00 0.00 H new ATOM 0 HA ARG E 38 0.334 -2.025 -18.628 1.00 0.00 H new ATOM 0 HB2 ARG E 38 1.941 -2.596 -16.097 1.00 0.00 H new ATOM 0 HB3 ARG E 38 0.200 -2.448 -16.233 1.00 0.00 H new ATOM 0 HG2 ARG E 38 1.186 -4.443 -18.138 1.00 0.00 H new ATOM 0 HG3 ARG E 38 1.750 -4.827 -16.524 1.00 0.00 H new ATOM 0 HD2 ARG E 38 -0.566 -4.680 -15.638 1.00 0.00 H new ATOM 0 HD3 ARG E 38 -1.163 -4.173 -17.206 1.00 0.00 H new ATOM 0 HE ARG E 38 -0.456 -6.461 -18.105 1.00 0.00 H new ATOM 0 HH11 ARG E 38 -2.530 -6.344 -15.657 1.00 0.00 H new ATOM 0 HH12 ARG E 38 -2.020 -7.806 -14.806 1.00 0.00 H new ATOM 0 HH21 ARG E 38 0.977 -8.093 -16.585 1.00 0.00 H new ATOM 0 HH22 ARG E 38 -0.051 -8.788 -15.327 1.00 0.00 H new ATOM 1668 N LYS E 39 0.650 0.225 -17.292 1.00 0.00 N ATOM 1669 CA LYS E 39 0.930 1.648 -16.957 1.00 0.00 C ATOM 1670 C LYS E 39 1.431 1.747 -15.522 1.00 0.00 C ATOM 1671 O LYS E 39 0.734 2.191 -14.632 1.00 0.00 O ATOM 1672 CB LYS E 39 -0.345 2.476 -17.118 1.00 0.00 C ATOM 1673 CG LYS E 39 -0.406 3.039 -18.539 1.00 0.00 C ATOM 1674 CD LYS E 39 -1.833 2.924 -19.077 1.00 0.00 C ATOM 1675 CE LYS E 39 -1.868 3.404 -20.529 1.00 0.00 C ATOM 1676 NZ LYS E 39 -0.622 2.974 -21.225 1.00 0.00 N ATOM 0 H LYS E 39 -0.314 -0.074 -17.149 1.00 0.00 H new ATOM 0 HA LYS E 39 1.694 2.033 -17.632 1.00 0.00 H new ATOM 0 HB2 LYS E 39 -1.221 1.858 -16.922 1.00 0.00 H new ATOM 0 HB3 LYS E 39 -0.359 3.289 -16.392 1.00 0.00 H new ATOM 0 HG2 LYS E 39 -0.089 4.082 -18.541 1.00 0.00 H new ATOM 0 HG3 LYS E 39 0.282 2.495 -19.186 1.00 0.00 H new ATOM 0 HD2 LYS E 39 -2.175 1.891 -19.016 1.00 0.00 H new ATOM 0 HD3 LYS E 39 -2.512 3.521 -18.468 1.00 0.00 H new ATOM 0 HE2 LYS E 39 -2.741 2.995 -21.037 1.00 0.00 H new ATOM 0 HE3 LYS E 39 -1.960 4.490 -20.562 1.00 0.00 H new ATOM 0 HZ1 LYS E 39 -0.771 3.005 -22.254 1.00 0.00 H new ATOM 0 HZ2 LYS E 39 0.157 3.613 -20.969 1.00 0.00 H new ATOM 0 HZ3 LYS E 39 -0.382 2.003 -20.939 1.00 0.00 H new ATOM 1690 N ILE E 40 2.650 1.351 -15.301 1.00 0.00 N ATOM 1691 CA ILE E 40 3.224 1.432 -13.931 1.00 0.00 C ATOM 1692 C ILE E 40 4.162 2.631 -13.871 1.00 0.00 C ATOM 1693 O ILE E 40 5.327 2.544 -14.206 1.00 0.00 O ATOM 1694 CB ILE E 40 3.999 0.153 -13.609 1.00 0.00 C ATOM 1695 CG1 ILE E 40 3.015 -1.003 -13.407 1.00 0.00 C ATOM 1696 CG2 ILE E 40 4.810 0.358 -12.329 1.00 0.00 C ATOM 1697 CD1 ILE E 40 3.781 -2.326 -13.364 1.00 0.00 C ATOM 0 H ILE E 40 3.276 0.973 -16.012 1.00 0.00 H new ATOM 0 HA ILE E 40 2.423 1.545 -13.201 1.00 0.00 H new ATOM 0 HB ILE E 40 4.672 -0.081 -14.434 1.00 0.00 H new ATOM 0 HG12 ILE E 40 2.459 -0.863 -12.480 1.00 0.00 H new ATOM 0 HG13 ILE E 40 2.286 -1.019 -14.217 1.00 0.00 H new ATOM 0 HG21 ILE E 40 5.363 -0.553 -12.099 1.00 0.00 H new ATOM 0 HG22 ILE E 40 5.510 1.181 -12.470 1.00 0.00 H new ATOM 0 HG23 ILE E 40 4.136 0.592 -11.505 1.00 0.00 H new ATOM 0 HD11 ILE E 40 3.080 -3.148 -13.220 1.00 0.00 H new ATOM 0 HD12 ILE E 40 4.317 -2.467 -14.302 1.00 0.00 H new ATOM 0 HD13 ILE E 40 4.493 -2.308 -12.539 1.00 0.00 H new ATOM 1709 N PHE E 41 3.655 3.755 -13.462 1.00 0.00 N ATOM 1710 CA PHE E 41 4.499 4.974 -13.393 1.00 0.00 C ATOM 1711 C PHE E 41 5.355 4.938 -12.126 1.00 0.00 C ATOM 1712 O PHE E 41 5.117 4.160 -11.224 1.00 0.00 O ATOM 1713 CB PHE E 41 3.587 6.201 -13.384 1.00 0.00 C ATOM 1714 CG PHE E 41 2.456 5.992 -14.373 1.00 0.00 C ATOM 1715 CD1 PHE E 41 2.636 5.152 -15.484 1.00 0.00 C ATOM 1716 CD2 PHE E 41 1.231 6.644 -14.184 1.00 0.00 C ATOM 1717 CE1 PHE E 41 1.591 4.969 -16.398 1.00 0.00 C ATOM 1718 CE2 PHE E 41 0.190 6.461 -15.102 1.00 0.00 C ATOM 1719 CZ PHE E 41 0.370 5.624 -16.208 1.00 0.00 C ATOM 0 H PHE E 41 2.686 3.883 -13.171 1.00 0.00 H new ATOM 0 HA PHE E 41 5.163 5.020 -14.256 1.00 0.00 H new ATOM 0 HB2 PHE E 41 3.185 6.363 -12.384 1.00 0.00 H new ATOM 0 HB3 PHE E 41 4.156 7.093 -13.647 1.00 0.00 H new ATOM 0 HD1 PHE E 41 3.579 4.648 -15.633 1.00 0.00 H new ATOM 0 HD2 PHE E 41 1.089 7.289 -13.329 1.00 0.00 H new ATOM 0 HE1 PHE E 41 1.728 4.321 -17.251 1.00 0.00 H new ATOM 0 HE2 PHE E 41 -0.753 6.967 -14.956 1.00 0.00 H new ATOM 0 HZ PHE E 41 -0.434 5.483 -16.915 1.00 0.00 H new ATOM 1729 N LEU E 42 6.363 5.764 -12.060 1.00 0.00 N ATOM 1730 CA LEU E 42 7.249 5.765 -10.862 1.00 0.00 C ATOM 1731 C LEU E 42 7.366 7.189 -10.308 1.00 0.00 C ATOM 1732 O LEU E 42 7.784 8.098 -10.994 1.00 0.00 O ATOM 1733 CB LEU E 42 8.639 5.265 -11.269 1.00 0.00 C ATOM 1734 CG LEU E 42 9.061 4.094 -10.378 1.00 0.00 C ATOM 1735 CD1 LEU E 42 8.260 2.846 -10.752 1.00 0.00 C ATOM 1736 CD2 LEU E 42 10.550 3.816 -10.586 1.00 0.00 C ATOM 0 H LEU E 42 6.611 6.438 -12.784 1.00 0.00 H new ATOM 0 HA LEU E 42 6.828 5.114 -10.096 1.00 0.00 H new ATOM 0 HB2 LEU E 42 8.630 4.952 -12.313 1.00 0.00 H new ATOM 0 HB3 LEU E 42 9.364 6.075 -11.185 1.00 0.00 H new ATOM 0 HG LEU E 42 8.872 4.346 -9.335 1.00 0.00 H new ATOM 0 HD11 LEU E 42 8.563 2.015 -10.116 1.00 0.00 H new ATOM 0 HD12 LEU E 42 7.197 3.041 -10.612 1.00 0.00 H new ATOM 0 HD13 LEU E 42 8.448 2.592 -11.795 1.00 0.00 H new ATOM 0 HD21 LEU E 42 10.856 2.983 -9.954 1.00 0.00 H new ATOM 0 HD22 LEU E 42 10.731 3.564 -11.631 1.00 0.00 H new ATOM 0 HD23 LEU E 42 11.126 4.703 -10.322 1.00 0.00 H new ATOM 1748 N THR E 43 7.009 7.387 -9.070 1.00 0.00 N ATOM 1749 CA THR E 43 7.113 8.750 -8.470 1.00 0.00 C ATOM 1750 C THR E 43 8.168 8.717 -7.364 1.00 0.00 C ATOM 1751 O THR E 43 7.940 8.192 -6.292 1.00 0.00 O ATOM 1752 CB THR E 43 5.760 9.160 -7.880 1.00 0.00 C ATOM 1753 OG1 THR E 43 4.860 9.470 -8.934 1.00 0.00 O ATOM 1754 CG2 THR E 43 5.941 10.386 -6.984 1.00 0.00 C ATOM 0 H THR E 43 6.649 6.665 -8.446 1.00 0.00 H new ATOM 0 HA THR E 43 7.398 9.472 -9.235 1.00 0.00 H new ATOM 0 HB THR E 43 5.358 8.338 -7.288 1.00 0.00 H new ATOM 0 HG1 THR E 43 3.993 9.731 -8.558 1.00 0.00 H new ATOM 0 HG21 THR E 43 4.977 10.676 -6.565 1.00 0.00 H new ATOM 0 HG22 THR E 43 6.631 10.147 -6.175 1.00 0.00 H new ATOM 0 HG23 THR E 43 6.344 11.210 -7.572 1.00 0.00 H new ATOM 1762 N ILE E 44 9.327 9.258 -7.619 1.00 0.00 N ATOM 1763 CA ILE E 44 10.400 9.235 -6.585 1.00 0.00 C ATOM 1764 C ILE E 44 10.317 10.484 -5.704 1.00 0.00 C ATOM 1765 O ILE E 44 10.223 11.595 -6.189 1.00 0.00 O ATOM 1766 CB ILE E 44 11.770 9.180 -7.267 1.00 0.00 C ATOM 1767 CG1 ILE E 44 11.656 8.419 -8.591 1.00 0.00 C ATOM 1768 CG2 ILE E 44 12.760 8.456 -6.353 1.00 0.00 C ATOM 1769 CD1 ILE E 44 13.045 8.273 -9.215 1.00 0.00 C ATOM 0 H ILE E 44 9.577 9.714 -8.496 1.00 0.00 H new ATOM 0 HA ILE E 44 10.266 8.352 -5.960 1.00 0.00 H new ATOM 0 HB ILE E 44 12.119 10.194 -7.461 1.00 0.00 H new ATOM 0 HG12 ILE E 44 11.216 7.436 -8.421 1.00 0.00 H new ATOM 0 HG13 ILE E 44 10.993 8.951 -9.273 1.00 0.00 H new ATOM 0 HG21 ILE E 44 13.737 8.415 -6.835 1.00 0.00 H new ATOM 0 HG22 ILE E 44 12.844 8.994 -5.409 1.00 0.00 H new ATOM 0 HG23 ILE E 44 12.406 7.443 -6.163 1.00 0.00 H new ATOM 0 HD11 ILE E 44 12.965 7.731 -10.158 1.00 0.00 H new ATOM 0 HD12 ILE E 44 13.467 9.261 -9.399 1.00 0.00 H new ATOM 0 HD13 ILE E 44 13.694 7.722 -8.534 1.00 0.00 H new ATOM 1781 N ASN E 45 10.357 10.308 -4.410 1.00 0.00 N ATOM 1782 CA ASN E 45 10.286 11.478 -3.490 1.00 0.00 C ATOM 1783 C ASN E 45 11.700 11.984 -3.191 1.00 0.00 C ATOM 1784 O ASN E 45 12.652 11.224 -3.167 1.00 0.00 O ATOM 1785 CB ASN E 45 9.604 11.063 -2.184 1.00 0.00 C ATOM 1786 CG ASN E 45 8.102 11.340 -2.284 1.00 0.00 C ATOM 1787 OD1 ASN E 45 7.569 11.473 -3.367 1.00 0.00 O ATOM 1788 ND2 ASN E 45 7.394 11.434 -1.193 1.00 0.00 N ATOM 0 H ASN E 45 10.436 9.401 -3.950 1.00 0.00 H new ATOM 0 HA ASN E 45 9.710 12.274 -3.962 1.00 0.00 H new ATOM 0 HB2 ASN E 45 9.778 10.004 -1.991 1.00 0.00 H new ATOM 0 HB3 ASN E 45 10.032 11.614 -1.347 1.00 0.00 H new ATOM 0 HD21 ASN E 45 6.393 11.619 -1.249 1.00 0.00 H new ATOM 0 HD22 ASN E 45 7.842 11.322 -0.283 1.00 0.00 H new ATOM 1795 N ALA E 46 11.836 13.266 -2.964 1.00 0.00 N ATOM 1796 CA ALA E 46 13.177 13.857 -2.667 1.00 0.00 C ATOM 1797 C ALA E 46 13.983 12.942 -1.738 1.00 0.00 C ATOM 1798 O ALA E 46 15.197 12.983 -1.723 1.00 0.00 O ATOM 1799 CB ALA E 46 12.991 15.220 -1.997 1.00 0.00 C ATOM 0 H ALA E 46 11.067 13.936 -2.972 1.00 0.00 H new ATOM 0 HA ALA E 46 13.723 13.969 -3.604 1.00 0.00 H new ATOM 0 HB1 ALA E 46 13.967 15.654 -1.779 1.00 0.00 H new ATOM 0 HB2 ALA E 46 12.440 15.882 -2.665 1.00 0.00 H new ATOM 0 HB3 ALA E 46 12.433 15.096 -1.069 1.00 0.00 H new ATOM 1805 N ASP E 47 13.332 12.119 -0.965 1.00 0.00 N ATOM 1806 CA ASP E 47 14.079 11.213 -0.048 1.00 0.00 C ATOM 1807 C ASP E 47 14.493 9.947 -0.803 1.00 0.00 C ATOM 1808 O ASP E 47 14.525 8.866 -0.248 1.00 0.00 O ATOM 1809 CB ASP E 47 13.187 10.831 1.134 1.00 0.00 C ATOM 1810 CG ASP E 47 13.127 11.994 2.125 1.00 0.00 C ATOM 1811 OD1 ASP E 47 13.954 12.885 2.014 1.00 0.00 O ATOM 1812 OD2 ASP E 47 12.256 11.975 2.980 1.00 0.00 O ATOM 0 H ASP E 47 12.316 12.034 -0.928 1.00 0.00 H new ATOM 0 HA ASP E 47 14.969 11.725 0.319 1.00 0.00 H new ATOM 0 HB2 ASP E 47 12.185 10.587 0.783 1.00 0.00 H new ATOM 0 HB3 ASP E 47 13.578 9.940 1.626 1.00 0.00 H new ATOM 1817 N GLY E 48 14.805 10.068 -2.064 1.00 0.00 N ATOM 1818 CA GLY E 48 15.209 8.868 -2.848 1.00 0.00 C ATOM 1819 C GLY E 48 14.194 7.755 -2.611 1.00 0.00 C ATOM 1820 O GLY E 48 14.517 6.584 -2.653 1.00 0.00 O ATOM 0 H GLY E 48 14.798 10.945 -2.585 1.00 0.00 H new ATOM 0 HA2 GLY E 48 15.260 9.111 -3.909 1.00 0.00 H new ATOM 0 HA3 GLY E 48 16.204 8.540 -2.548 1.00 0.00 H new ATOM 1824 N SER E 49 12.965 8.113 -2.362 1.00 0.00 N ATOM 1825 CA SER E 49 11.924 7.075 -2.119 1.00 0.00 C ATOM 1826 C SER E 49 11.273 6.694 -3.445 1.00 0.00 C ATOM 1827 O SER E 49 11.245 7.470 -4.376 1.00 0.00 O ATOM 1828 CB SER E 49 10.864 7.628 -1.168 1.00 0.00 C ATOM 1829 OG SER E 49 11.394 8.753 -0.479 1.00 0.00 O ATOM 0 H SER E 49 12.637 9.078 -2.316 1.00 0.00 H new ATOM 0 HA SER E 49 12.384 6.193 -1.672 1.00 0.00 H new ATOM 0 HB2 SER E 49 9.973 7.915 -1.726 1.00 0.00 H new ATOM 0 HB3 SER E 49 10.561 6.860 -0.456 1.00 0.00 H new ATOM 0 HG SER E 49 10.716 9.112 0.131 1.00 0.00 H new ATOM 1835 N VAL E 50 10.748 5.503 -3.540 1.00 0.00 N ATOM 1836 CA VAL E 50 10.097 5.082 -4.811 1.00 0.00 C ATOM 1837 C VAL E 50 8.597 4.901 -4.580 1.00 0.00 C ATOM 1838 O VAL E 50 8.176 4.177 -3.700 1.00 0.00 O ATOM 1839 CB VAL E 50 10.701 3.763 -5.293 1.00 0.00 C ATOM 1840 CG1 VAL E 50 10.422 3.593 -6.788 1.00 0.00 C ATOM 1841 CG2 VAL E 50 12.212 3.776 -5.057 1.00 0.00 C ATOM 0 H VAL E 50 10.742 4.806 -2.795 1.00 0.00 H new ATOM 0 HA VAL E 50 10.261 5.849 -5.568 1.00 0.00 H new ATOM 0 HB VAL E 50 10.254 2.936 -4.741 1.00 0.00 H new ATOM 0 HG11 VAL E 50 10.852 2.653 -7.134 1.00 0.00 H new ATOM 0 HG12 VAL E 50 9.345 3.584 -6.959 1.00 0.00 H new ATOM 0 HG13 VAL E 50 10.870 4.421 -7.338 1.00 0.00 H new ATOM 0 HG21 VAL E 50 12.642 2.835 -5.401 1.00 0.00 H new ATOM 0 HG22 VAL E 50 12.659 4.603 -5.609 1.00 0.00 H new ATOM 0 HG23 VAL E 50 12.413 3.899 -3.993 1.00 0.00 H new ATOM 1851 N TYR E 51 7.789 5.552 -5.369 1.00 0.00 N ATOM 1852 CA TYR E 51 6.314 5.421 -5.206 1.00 0.00 C ATOM 1853 C TYR E 51 5.689 5.113 -6.566 1.00 0.00 C ATOM 1854 O TYR E 51 5.177 5.986 -7.238 1.00 0.00 O ATOM 1855 CB TYR E 51 5.743 6.733 -4.663 1.00 0.00 C ATOM 1856 CG TYR E 51 4.342 6.500 -4.147 1.00 0.00 C ATOM 1857 CD1 TYR E 51 4.072 5.399 -3.326 1.00 0.00 C ATOM 1858 CD2 TYR E 51 3.314 7.387 -4.488 1.00 0.00 C ATOM 1859 CE1 TYR E 51 2.775 5.183 -2.846 1.00 0.00 C ATOM 1860 CE2 TYR E 51 2.016 7.172 -4.008 1.00 0.00 C ATOM 1861 CZ TYR E 51 1.747 6.070 -3.188 1.00 0.00 C ATOM 1862 OH TYR E 51 0.467 5.858 -2.716 1.00 0.00 O ATOM 0 H TYR E 51 8.087 6.171 -6.122 1.00 0.00 H new ATOM 0 HA TYR E 51 6.089 4.615 -4.507 1.00 0.00 H new ATOM 0 HB2 TYR E 51 6.378 7.114 -3.863 1.00 0.00 H new ATOM 0 HB3 TYR E 51 5.731 7.489 -5.448 1.00 0.00 H new ATOM 0 HD1 TYR E 51 4.865 4.715 -3.063 1.00 0.00 H new ATOM 0 HD2 TYR E 51 3.522 8.237 -5.121 1.00 0.00 H new ATOM 0 HE1 TYR E 51 2.567 4.333 -2.213 1.00 0.00 H new ATOM 0 HE2 TYR E 51 1.223 7.856 -4.270 1.00 0.00 H new ATOM 0 HH TYR E 51 -0.125 6.566 -3.046 1.00 0.00 H new ATOM 1872 N ALA E 52 5.734 3.875 -6.983 1.00 0.00 N ATOM 1873 CA ALA E 52 5.152 3.514 -8.306 1.00 0.00 C ATOM 1874 C ALA E 52 3.635 3.394 -8.186 1.00 0.00 C ATOM 1875 O ALA E 52 3.106 3.068 -7.142 1.00 0.00 O ATOM 1876 CB ALA E 52 5.727 2.173 -8.769 1.00 0.00 C ATOM 0 H ALA E 52 6.148 3.100 -6.465 1.00 0.00 H new ATOM 0 HA ALA E 52 5.400 4.290 -9.030 1.00 0.00 H new ATOM 0 HB1 ALA E 52 5.301 1.909 -9.737 1.00 0.00 H new ATOM 0 HB2 ALA E 52 6.810 2.253 -8.859 1.00 0.00 H new ATOM 0 HB3 ALA E 52 5.480 1.400 -8.041 1.00 0.00 H new ATOM 1882 N GLU E 53 2.931 3.656 -9.249 1.00 0.00 N ATOM 1883 CA GLU E 53 1.449 3.559 -9.204 1.00 0.00 C ATOM 1884 C GLU E 53 0.935 2.952 -10.507 1.00 0.00 C ATOM 1885 O GLU E 53 1.588 3.000 -11.531 1.00 0.00 O ATOM 1886 CB GLU E 53 0.854 4.955 -9.017 1.00 0.00 C ATOM 1887 CG GLU E 53 0.428 5.129 -7.558 1.00 0.00 C ATOM 1888 CD GLU E 53 -1.075 5.404 -7.494 1.00 0.00 C ATOM 1889 OE1 GLU E 53 -1.829 4.448 -7.433 1.00 0.00 O ATOM 1890 OE2 GLU E 53 -1.446 6.567 -7.509 1.00 0.00 O ATOM 0 H GLU E 53 3.320 3.934 -10.150 1.00 0.00 H new ATOM 0 HA GLU E 53 1.152 2.923 -8.370 1.00 0.00 H new ATOM 0 HB2 GLU E 53 1.587 5.715 -9.287 1.00 0.00 H new ATOM 0 HB3 GLU E 53 -0.003 5.090 -9.677 1.00 0.00 H new ATOM 0 HG2 GLU E 53 0.669 4.231 -6.988 1.00 0.00 H new ATOM 0 HG3 GLU E 53 0.979 5.952 -7.103 1.00 0.00 H new ATOM 1897 N GLU E 54 -0.239 2.393 -10.476 1.00 0.00 N ATOM 1898 CA GLU E 54 -0.813 1.793 -11.710 1.00 0.00 C ATOM 1899 C GLU E 54 -1.977 2.665 -12.162 1.00 0.00 C ATOM 1900 O GLU E 54 -2.749 3.148 -11.358 1.00 0.00 O ATOM 1901 CB GLU E 54 -1.311 0.375 -11.420 1.00 0.00 C ATOM 1902 CG GLU E 54 -1.456 -0.392 -12.737 1.00 0.00 C ATOM 1903 CD GLU E 54 -1.596 -1.888 -12.447 1.00 0.00 C ATOM 1904 OE1 GLU E 54 -1.310 -2.285 -11.330 1.00 0.00 O ATOM 1905 OE2 GLU E 54 -1.988 -2.611 -13.349 1.00 0.00 O ATOM 0 H GLU E 54 -0.829 2.325 -9.646 1.00 0.00 H new ATOM 0 HA GLU E 54 -0.053 1.740 -12.490 1.00 0.00 H new ATOM 0 HB2 GLU E 54 -0.612 -0.140 -10.761 1.00 0.00 H new ATOM 0 HB3 GLU E 54 -2.269 0.413 -10.901 1.00 0.00 H new ATOM 0 HG2 GLU E 54 -2.328 -0.034 -13.284 1.00 0.00 H new ATOM 0 HG3 GLU E 54 -0.587 -0.214 -13.371 1.00 0.00 H new ATOM 1912 N VAL E 55 -2.110 2.886 -13.435 1.00 0.00 N ATOM 1913 CA VAL E 55 -3.224 3.745 -13.912 1.00 0.00 C ATOM 1914 C VAL E 55 -3.594 3.349 -15.340 1.00 0.00 C ATOM 1915 O VAL E 55 -2.858 3.590 -16.276 1.00 0.00 O ATOM 1916 CB VAL E 55 -2.803 5.222 -13.866 1.00 0.00 C ATOM 1917 CG1 VAL E 55 -3.869 6.022 -13.120 1.00 0.00 C ATOM 1918 CG2 VAL E 55 -1.468 5.372 -13.127 1.00 0.00 C ATOM 0 H VAL E 55 -1.501 2.512 -14.163 1.00 0.00 H new ATOM 0 HA VAL E 55 -4.090 3.608 -13.265 1.00 0.00 H new ATOM 0 HB VAL E 55 -2.693 5.590 -14.886 1.00 0.00 H new ATOM 0 HG11 VAL E 55 -3.577 7.072 -13.083 1.00 0.00 H new ATOM 0 HG12 VAL E 55 -4.823 5.929 -13.639 1.00 0.00 H new ATOM 0 HG13 VAL E 55 -3.969 5.637 -12.105 1.00 0.00 H new ATOM 0 HG21 VAL E 55 -1.182 6.424 -13.102 1.00 0.00 H new ATOM 0 HG22 VAL E 55 -1.573 5.000 -12.108 1.00 0.00 H new ATOM 0 HG23 VAL E 55 -0.699 4.799 -13.645 1.00 0.00 H new ATOM 1928 N LYS E 56 -4.731 2.733 -15.510 1.00 0.00 N ATOM 1929 CA LYS E 56 -5.158 2.304 -16.869 1.00 0.00 C ATOM 1930 C LYS E 56 -6.690 2.342 -16.947 1.00 0.00 C ATOM 1931 O LYS E 56 -7.361 1.910 -16.032 1.00 0.00 O ATOM 1932 CB LYS E 56 -4.653 0.878 -17.115 1.00 0.00 C ATOM 1933 CG LYS E 56 -5.442 0.225 -18.255 1.00 0.00 C ATOM 1934 CD LYS E 56 -4.468 -0.355 -19.283 1.00 0.00 C ATOM 1935 CE LYS E 56 -4.325 -1.862 -19.058 1.00 0.00 C ATOM 1936 NZ LYS E 56 -3.819 -2.505 -20.303 1.00 0.00 N ATOM 0 H LYS E 56 -5.386 2.508 -14.761 1.00 0.00 H new ATOM 0 HA LYS E 56 -4.746 2.970 -17.627 1.00 0.00 H new ATOM 0 HB2 LYS E 56 -3.592 0.898 -17.363 1.00 0.00 H new ATOM 0 HB3 LYS E 56 -4.757 0.286 -16.206 1.00 0.00 H new ATOM 0 HG2 LYS E 56 -6.084 -0.563 -17.862 1.00 0.00 H new ATOM 0 HG3 LYS E 56 -6.093 0.960 -18.729 1.00 0.00 H new ATOM 0 HD2 LYS E 56 -4.830 -0.160 -20.293 1.00 0.00 H new ATOM 0 HD3 LYS E 56 -3.496 0.131 -19.193 1.00 0.00 H new ATOM 0 HE2 LYS E 56 -3.639 -2.054 -18.233 1.00 0.00 H new ATOM 0 HE3 LYS E 56 -5.287 -2.292 -18.779 1.00 0.00 H new ATOM 0 HZ1 LYS E 56 -3.722 -3.529 -20.150 1.00 0.00 H new ATOM 0 HZ2 LYS E 56 -4.489 -2.333 -21.080 1.00 0.00 H new ATOM 0 HZ3 LYS E 56 -2.892 -2.102 -20.550 1.00 0.00 H new ATOM 1950 N PRO E 57 -7.198 2.860 -18.038 1.00 0.00 N ATOM 1951 CA PRO E 57 -8.652 2.969 -18.255 1.00 0.00 C ATOM 1952 C PRO E 57 -9.246 1.606 -18.625 1.00 0.00 C ATOM 1953 O PRO E 57 -8.590 0.771 -19.215 1.00 0.00 O ATOM 1954 CB PRO E 57 -8.769 3.958 -19.417 1.00 0.00 C ATOM 1955 CG PRO E 57 -7.411 3.923 -20.157 1.00 0.00 C ATOM 1956 CD PRO E 57 -6.380 3.376 -19.154 1.00 0.00 C ATOM 0 HA PRO E 57 -9.194 3.298 -17.369 1.00 0.00 H new ATOM 0 HB2 PRO E 57 -9.583 3.678 -20.085 1.00 0.00 H new ATOM 0 HB3 PRO E 57 -8.987 4.962 -19.052 1.00 0.00 H new ATOM 0 HG2 PRO E 57 -7.467 3.287 -21.041 1.00 0.00 H new ATOM 0 HG3 PRO E 57 -7.129 4.919 -20.498 1.00 0.00 H new ATOM 0 HD2 PRO E 57 -5.771 2.589 -19.598 1.00 0.00 H new ATOM 0 HD3 PRO E 57 -5.697 4.157 -18.819 1.00 0.00 H new ATOM 1964 N PHE E 58 -10.482 1.377 -18.276 1.00 0.00 N ATOM 1965 CA PHE E 58 -11.121 0.071 -18.598 1.00 0.00 C ATOM 1966 C PHE E 58 -11.976 0.223 -19.867 1.00 0.00 C ATOM 1967 O PHE E 58 -12.290 1.326 -20.269 1.00 0.00 O ATOM 1968 CB PHE E 58 -11.979 -0.373 -17.396 1.00 0.00 C ATOM 1969 CG PHE E 58 -13.428 0.027 -17.582 1.00 0.00 C ATOM 1970 CD1 PHE E 58 -13.755 1.354 -17.883 1.00 0.00 C ATOM 1971 CD2 PHE E 58 -14.440 -0.932 -17.452 1.00 0.00 C ATOM 1972 CE1 PHE E 58 -15.095 1.722 -18.055 1.00 0.00 C ATOM 1973 CE2 PHE E 58 -15.779 -0.564 -17.623 1.00 0.00 C ATOM 1974 CZ PHE E 58 -16.107 0.762 -17.925 1.00 0.00 C ATOM 0 H PHE E 58 -11.078 2.040 -17.780 1.00 0.00 H new ATOM 0 HA PHE E 58 -10.364 -0.691 -18.787 1.00 0.00 H new ATOM 0 HB2 PHE E 58 -11.910 -1.454 -17.276 1.00 0.00 H new ATOM 0 HB3 PHE E 58 -11.589 0.075 -16.482 1.00 0.00 H new ATOM 0 HD1 PHE E 58 -12.974 2.094 -17.983 1.00 0.00 H new ATOM 0 HD2 PHE E 58 -14.187 -1.956 -17.220 1.00 0.00 H new ATOM 0 HE1 PHE E 58 -15.348 2.746 -18.288 1.00 0.00 H new ATOM 0 HE2 PHE E 58 -16.559 -1.304 -17.522 1.00 0.00 H new ATOM 0 HZ PHE E 58 -17.141 1.046 -18.058 1.00 0.00 H new ATOM 1984 N PRO E 59 -12.322 -0.892 -20.460 1.00 0.00 N ATOM 1985 CA PRO E 59 -11.937 -2.227 -19.965 1.00 0.00 C ATOM 1986 C PRO E 59 -10.484 -2.538 -20.340 1.00 0.00 C ATOM 1987 O PRO E 59 -9.910 -1.915 -21.212 1.00 0.00 O ATOM 1988 CB PRO E 59 -12.901 -3.169 -20.692 1.00 0.00 C ATOM 1989 CG PRO E 59 -13.381 -2.413 -21.955 1.00 0.00 C ATOM 1990 CD PRO E 59 -13.139 -0.916 -21.689 1.00 0.00 C ATOM 0 HA PRO E 59 -11.996 -2.317 -18.880 1.00 0.00 H new ATOM 0 HB2 PRO E 59 -12.404 -4.101 -20.962 1.00 0.00 H new ATOM 0 HB3 PRO E 59 -13.744 -3.431 -20.053 1.00 0.00 H new ATOM 0 HG2 PRO E 59 -12.832 -2.744 -22.837 1.00 0.00 H new ATOM 0 HG3 PRO E 59 -14.437 -2.607 -22.145 1.00 0.00 H new ATOM 0 HD2 PRO E 59 -12.619 -0.443 -22.522 1.00 0.00 H new ATOM 0 HD3 PRO E 59 -14.078 -0.379 -21.553 1.00 0.00 H new