USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 0 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: B 32 SER OG : rot 45:sc= 1.19 USER MOD Set 1.2: B 36 GLN : amide:sc= 1.02 K(o=2.2,f=-1.7) USER MOD Set 2.1: A 43 SER OG : rot -4:sc= 1.32 USER MOD Set 2.2: B 18 LYS NZ :NH3+ -139:sc= 0.46 (180deg=0.0367) USER MOD Set 3.1: B 11 MET CE :methyl -118:sc= -3.15 (180deg=-7.48!) USER MOD Set 3.2: B 30 MET CE :methyl -147:sc= -3.69 (180deg=-7.56!) USER MOD Set 4.1: A 53 ASN : amide:sc= -0.644 X(o=-7.4,f=-7.2) USER MOD Set 4.2: B 53 ASN : amide:sc= -6.74! C(o=-7.4!,f=-8.6!) USER MOD Set 5.1: A 26 ASN : amide:sc= 0.677 K(o=1.9,f=-1.2) USER MOD Set 5.2: B 63 SER OG : rot -165:sc= 1.21 USER MOD Set 6.1: A 11 MET CE :methyl -125:sc= -2.01 (180deg=-8.82!) USER MOD Set 6.2: A 30 MET CE :methyl -130:sc= -3.55 (180deg=-10.6!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= 0.469 K(o=0.47,f=-2.3!) USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 13 MET CE :methyl -114:sc= -1.16 (180deg=-2.18) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 61:sc= 1.08 USER MOD Single : A 31 ASN : amide:sc= -0.36 K(o=-0.36,f=-4.7!) USER MOD Single : A 32 SER OG : rot -33:sc= 2.02 USER MOD Single : A 36 GLN : amide:sc= -2.63! K(o=-2.6!,f=-0.12) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 44 LYS NZ :NH3+ -155:sc= 0.186 (180deg=0.0557) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -70:sc= 1.23 USER MOD Single : A 51 TYR OH : rot 180:sc= -0.241 USER MOD Single : A 62 GLN : amide:sc= -0.534 K(o=-0.53,f=-3.1!) USER MOD Single : A 63 SER OG : rot -46:sc= 0.188 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 8 ASN : amide:sc=-0.00583 X(o=-0.0058,f=-0.42) USER MOD Single : B 13 MET CE :methyl 142:sc= -0.158 (180deg=-0.332) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 ASN : amide:sc= 0.59 K(o=0.59,f=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0.45 K(o=0.45,f=-3.4!) USER MOD Single : B 39 GLN : amide:sc=-0.00749 K(o=-0.0075,f=-1.3) USER MOD Single : B 43 SER OG : rot 90:sc= 1.03 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 62 GLN : amide:sc= -1.46 X(o=-1.5,f=-0.98) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 21.216 -18.193 -8.602 1.00 0.00 N ATOM 2 CA ALA A 1 20.551 -17.861 -7.321 1.00 0.00 C ATOM 3 C ALA A 1 19.146 -17.207 -7.486 1.00 0.00 C ATOM 4 O ALA A 1 18.979 -16.191 -8.169 1.00 0.00 O ATOM 5 CB ALA A 1 21.502 -16.953 -6.524 1.00 0.00 C ATOM 0 H1 ALA A 1 22.143 -18.623 -8.410 1.00 0.00 H new ATOM 0 H2 ALA A 1 20.627 -18.864 -9.135 1.00 0.00 H new ATOM 0 H3 ALA A 1 21.346 -17.326 -9.161 1.00 0.00 H new ATOM 0 HA ALA A 1 20.355 -18.790 -6.786 1.00 0.00 H new ATOM 0 HB1 ALA A 1 21.041 -16.689 -5.572 1.00 0.00 H new ATOM 0 HB2 ALA A 1 22.439 -17.479 -6.340 1.00 0.00 H new ATOM 0 HB3 ALA A 1 21.702 -16.046 -7.094 1.00 0.00 H new ATOM 6 N ARG A 2 18.146 -17.745 -6.767 1.00 0.00 N ATOM 7 CA ARG A 2 16.884 -17.003 -6.503 1.00 0.00 C ATOM 8 C ARG A 2 16.984 -16.173 -5.185 1.00 0.00 C ATOM 9 O ARG A 2 16.835 -16.684 -4.071 1.00 0.00 O ATOM 10 CB ARG A 2 15.632 -17.911 -6.575 1.00 0.00 C ATOM 11 CG ARG A 2 15.476 -19.095 -5.581 1.00 0.00 C ATOM 12 CD ARG A 2 14.114 -19.815 -5.665 1.00 0.00 C ATOM 13 NE ARG A 2 13.014 -18.904 -5.242 1.00 0.00 N ATOM 14 CZ ARG A 2 11.806 -19.268 -4.838 1.00 0.00 C ATOM 15 NH1 ARG A 2 11.403 -20.498 -4.733 1.00 0.00 N ATOM 16 NH2 ARG A 2 10.980 -18.336 -4.531 1.00 0.00 N ATOM 0 H ARG A 2 18.178 -18.679 -6.359 1.00 0.00 H new ATOM 0 HA ARG A 2 16.749 -16.283 -7.310 1.00 0.00 H new ATOM 0 HB2 ARG A 2 14.759 -17.270 -6.456 1.00 0.00 H new ATOM 0 HB3 ARG A 2 15.589 -18.325 -7.582 1.00 0.00 H new ATOM 0 HG2 ARG A 2 16.269 -19.819 -5.768 1.00 0.00 H new ATOM 0 HG3 ARG A 2 15.616 -18.724 -4.566 1.00 0.00 H new ATOM 0 HD2 ARG A 2 13.939 -20.156 -6.685 1.00 0.00 H new ATOM 0 HD3 ARG A 2 14.125 -20.701 -5.030 1.00 0.00 H new ATOM 0 HE ARG A 2 13.210 -17.903 -5.266 1.00 0.00 H new ATOM 0 HH11 ARG A 2 12.034 -21.263 -4.970 1.00 0.00 H new ATOM 0 HH12 ARG A 2 10.455 -20.699 -4.414 1.00 0.00 H new ATOM 0 HH21 ARG A 2 11.264 -17.359 -4.603 1.00 0.00 H new ATOM 0 HH22 ARG A 2 10.039 -18.572 -4.215 1.00 0.00 H new ATOM 17 N ASP A 3 17.192 -14.860 -5.319 1.00 0.00 N ATOM 18 CA ASP A 3 16.897 -13.893 -4.231 1.00 0.00 C ATOM 19 C ASP A 3 15.497 -13.250 -4.502 1.00 0.00 C ATOM 20 O ASP A 3 15.372 -12.066 -4.826 1.00 0.00 O ATOM 21 CB ASP A 3 18.109 -12.923 -4.158 1.00 0.00 C ATOM 22 CG ASP A 3 19.363 -13.517 -3.522 1.00 0.00 C ATOM 23 OD1 ASP A 3 19.280 -13.561 -2.166 1.00 0.00 O ATOM 24 OD2 ASP A 3 20.335 -13.910 -4.156 1.00 0.00 O ATOM 0 H ASP A 3 17.564 -14.431 -6.167 1.00 0.00 H new ATOM 0 HA ASP A 3 16.801 -14.336 -3.240 1.00 0.00 H new ATOM 0 HB2 ASP A 3 18.352 -12.591 -5.167 1.00 0.00 H new ATOM 0 HB3 ASP A 3 17.816 -12.038 -3.593 1.00 0.00 H new ATOM 25 N ASP A 4 14.433 -14.067 -4.372 1.00 0.00 N ATOM 26 CA ASP A 4 13.028 -13.632 -4.584 1.00 0.00 C ATOM 27 C ASP A 4 11.994 -14.572 -3.868 1.00 0.00 C ATOM 28 O ASP A 4 11.364 -15.399 -4.535 1.00 0.00 O ATOM 29 CB ASP A 4 12.723 -13.369 -6.083 1.00 0.00 C ATOM 30 CG ASP A 4 12.893 -14.539 -7.056 1.00 0.00 C ATOM 31 OD1 ASP A 4 13.980 -14.923 -7.475 1.00 0.00 O ATOM 32 OD2 ASP A 4 11.707 -15.104 -7.404 1.00 0.00 O ATOM 0 H ASP A 4 14.518 -15.051 -4.116 1.00 0.00 H new ATOM 0 HA ASP A 4 12.907 -12.666 -4.093 1.00 0.00 H new ATOM 0 HB2 ASP A 4 11.695 -13.015 -6.160 1.00 0.00 H new ATOM 0 HB3 ASP A 4 13.366 -12.556 -6.419 1.00 0.00 H new ATOM 33 N PRO A 5 11.789 -14.525 -2.522 1.00 0.00 N ATOM 34 CA PRO A 5 11.217 -15.674 -1.778 1.00 0.00 C ATOM 35 C PRO A 5 9.702 -15.541 -1.487 1.00 0.00 C ATOM 36 O PRO A 5 9.138 -14.446 -1.375 1.00 0.00 O ATOM 37 CB PRO A 5 12.101 -15.712 -0.509 1.00 0.00 C ATOM 38 CG PRO A 5 13.164 -14.632 -0.723 1.00 0.00 C ATOM 39 CD PRO A 5 12.479 -13.607 -1.600 1.00 0.00 C ATOM 0 HA PRO A 5 11.241 -16.606 -2.343 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.512 -15.512 0.386 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.558 -16.693 -0.378 1.00 0.00 H new ATOM 0 HG2 PRO A 5 13.485 -14.196 0.223 1.00 0.00 H new ATOM 0 HG3 PRO A 5 14.053 -15.038 -1.205 1.00 0.00 H new ATOM 0 HD2 PRO A 5 11.790 -12.970 -1.045 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.183 -12.949 -2.109 1.00 0.00 H new ATOM 40 N HIS A 6 9.083 -16.713 -1.339 1.00 0.00 N ATOM 41 CA HIS A 6 7.651 -16.850 -1.000 1.00 0.00 C ATOM 42 C HIS A 6 7.319 -16.474 0.479 1.00 0.00 C ATOM 43 O HIS A 6 7.895 -17.010 1.432 1.00 0.00 O ATOM 44 CB HIS A 6 7.263 -18.340 -1.253 1.00 0.00 C ATOM 45 CG HIS A 6 7.088 -18.753 -2.710 1.00 0.00 C ATOM 46 ND1 HIS A 6 8.101 -19.230 -3.526 1.00 0.00 N ATOM 47 CD2 HIS A 6 5.879 -18.688 -3.405 1.00 0.00 C ATOM 48 CE1 HIS A 6 7.389 -19.392 -4.690 1.00 0.00 C ATOM 49 NE2 HIS A 6 6.051 -19.110 -4.713 1.00 0.00 N ATOM 0 H HIS A 6 9.560 -17.608 -1.451 1.00 0.00 H new ATOM 0 HA HIS A 6 7.084 -16.156 -1.620 1.00 0.00 H new ATOM 0 HB2 HIS A 6 8.030 -18.974 -0.807 1.00 0.00 H new ATOM 0 HB3 HIS A 6 6.332 -18.546 -0.725 1.00 0.00 H new ATOM 0 HD2 HIS A 6 4.942 -18.356 -2.983 1.00 0.00 H new ATOM 0 HE1 HIS A 6 7.884 -19.741 -5.584 1.00 0.00 H new ATOM 0 HE2 HIS A 6 5.375 -19.188 -5.473 1.00 0.00 H new ATOM 50 N PHE A 7 6.209 -15.764 0.683 1.00 0.00 N ATOM 51 CA PHE A 7 5.085 -16.385 1.426 1.00 0.00 C ATOM 52 C PHE A 7 3.827 -16.517 0.504 1.00 0.00 C ATOM 53 O PHE A 7 3.771 -16.024 -0.629 1.00 0.00 O ATOM 54 CB PHE A 7 4.922 -15.710 2.818 1.00 0.00 C ATOM 55 CG PHE A 7 4.424 -14.258 2.934 1.00 0.00 C ATOM 56 CD1 PHE A 7 5.286 -13.164 2.745 1.00 0.00 C ATOM 57 CD2 PHE A 7 3.130 -14.019 3.416 1.00 0.00 C ATOM 58 CE1 PHE A 7 4.877 -11.883 3.085 1.00 0.00 C ATOM 59 CE2 PHE A 7 2.727 -12.733 3.726 1.00 0.00 C ATOM 60 CZ PHE A 7 3.607 -11.683 3.600 1.00 0.00 C ATOM 0 H PHE A 7 6.055 -14.806 0.367 1.00 0.00 H new ATOM 0 HA PHE A 7 5.289 -17.423 1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 7 4.238 -16.331 3.397 1.00 0.00 H new ATOM 0 HB3 PHE A 7 5.892 -15.757 3.313 1.00 0.00 H new ATOM 0 HD1 PHE A 7 6.272 -13.322 2.333 1.00 0.00 H new ATOM 0 HD2 PHE A 7 2.444 -14.843 3.546 1.00 0.00 H new ATOM 0 HE1 PHE A 7 5.545 -11.046 2.949 1.00 0.00 H new ATOM 0 HE2 PHE A 7 1.719 -12.552 4.068 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.304 -10.692 3.906 1.00 0.00 H new ATOM 61 N ASN A 8 2.793 -17.225 0.972 1.00 0.00 N ATOM 62 CA ASN A 8 1.445 -17.085 0.364 1.00 0.00 C ATOM 63 C ASN A 8 0.711 -15.934 1.110 1.00 0.00 C ATOM 64 O ASN A 8 0.084 -16.169 2.149 1.00 0.00 O ATOM 65 CB ASN A 8 0.688 -18.438 0.370 1.00 0.00 C ATOM 66 CG ASN A 8 1.166 -19.473 -0.655 1.00 0.00 C ATOM 67 OD1 ASN A 8 1.908 -19.211 -1.596 1.00 0.00 O ATOM 68 ND2 ASN A 8 0.721 -20.694 -0.529 1.00 0.00 N ATOM 0 H ASN A 8 2.848 -17.885 1.747 1.00 0.00 H new ATOM 0 HA ASN A 8 1.507 -16.817 -0.691 1.00 0.00 H new ATOM 0 HB2 ASN A 8 0.770 -18.875 1.365 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.370 -18.242 0.195 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.992 -21.408 -1.206 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.103 -20.934 0.246 1.00 0.00 H new ATOM 69 N PHE A 9 0.770 -14.692 0.577 1.00 0.00 N ATOM 70 CA PHE A 9 -0.206 -13.654 0.959 1.00 0.00 C ATOM 71 C PHE A 9 -1.637 -14.012 0.463 1.00 0.00 C ATOM 72 O PHE A 9 -1.919 -15.030 -0.155 1.00 0.00 O ATOM 73 CB PHE A 9 0.344 -12.271 0.525 1.00 0.00 C ATOM 74 CG PHE A 9 -0.317 -11.055 1.201 1.00 0.00 C ATOM 75 CD1 PHE A 9 -0.428 -10.980 2.600 1.00 0.00 C ATOM 76 CD2 PHE A 9 -0.541 -9.894 0.453 1.00 0.00 C ATOM 77 CE1 PHE A 9 -0.719 -9.779 3.220 1.00 0.00 C ATOM 78 CE2 PHE A 9 -0.916 -8.714 1.071 1.00 0.00 C ATOM 79 CZ PHE A 9 -0.895 -8.644 2.448 1.00 0.00 C ATOM 0 H PHE A 9 1.468 -14.391 -0.104 1.00 0.00 H new ATOM 0 HA PHE A 9 -0.328 -13.601 2.041 1.00 0.00 H new ATOM 0 HB2 PHE A 9 1.414 -12.243 0.732 1.00 0.00 H new ATOM 0 HB3 PHE A 9 0.225 -12.174 -0.554 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.285 -11.869 3.196 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -0.420 -9.919 -0.620 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.808 -9.727 4.295 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.221 -7.860 0.484 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.018 -7.687 2.932 1.00 0.00 H new ATOM 80 N ARG A 10 -2.580 -13.334 1.062 1.00 0.00 N ATOM 81 CA ARG A 10 -3.641 -14.005 1.857 1.00 0.00 C ATOM 82 C ARG A 10 -4.422 -12.894 2.590 1.00 0.00 C ATOM 83 O ARG A 10 -3.946 -12.284 3.554 1.00 0.00 O ATOM 84 CB ARG A 10 -3.143 -15.158 2.773 1.00 0.00 C ATOM 85 CG ARG A 10 -4.162 -15.781 3.738 1.00 0.00 C ATOM 86 CD ARG A 10 -5.555 -16.142 3.179 1.00 0.00 C ATOM 87 NE ARG A 10 -6.425 -16.698 4.249 1.00 0.00 N ATOM 88 CZ ARG A 10 -7.069 -15.997 5.175 1.00 0.00 C ATOM 89 NH1 ARG A 10 -6.994 -14.704 5.302 1.00 0.00 N ATOM 90 NH2 ARG A 10 -7.809 -16.648 5.999 1.00 0.00 N ATOM 0 H ARG A 10 -2.658 -12.317 1.030 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.309 -14.548 1.188 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.754 -15.951 2.135 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.306 -14.783 3.362 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -3.721 -16.688 4.151 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -4.303 -15.089 4.568 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -6.021 -15.255 2.750 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.451 -16.869 2.374 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.538 -17.711 4.274 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -6.411 -14.162 4.664 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -7.518 -14.233 6.039 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.884 -17.663 5.926 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.322 -16.150 6.727 1.00 0.00 H new ATOM 91 N MET A 11 -5.607 -12.596 2.064 1.00 0.00 N ATOM 92 CA MET A 11 -6.208 -11.253 2.242 1.00 0.00 C ATOM 93 C MET A 11 -7.739 -11.362 2.525 1.00 0.00 C ATOM 94 O MET A 11 -8.443 -11.871 1.646 1.00 0.00 O ATOM 95 CB MET A 11 -5.932 -10.472 0.930 1.00 0.00 C ATOM 96 CG MET A 11 -4.594 -9.731 0.803 1.00 0.00 C ATOM 97 SD MET A 11 -4.370 -9.280 -0.919 1.00 0.00 S ATOM 98 CE MET A 11 -3.067 -10.409 -1.428 1.00 0.00 C ATOM 0 H MET A 11 -6.172 -13.246 1.518 1.00 0.00 H new ATOM 0 HA MET A 11 -5.774 -10.737 3.098 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.005 -11.175 0.101 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.732 -9.743 0.800 1.00 0.00 H new ATOM 0 HG2 MET A 11 -4.590 -8.842 1.433 1.00 0.00 H new ATOM 0 HG3 MET A 11 -3.774 -10.365 1.141 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.238 -9.841 -1.850 1.00 0.00 H new ATOM 0 HE2 MET A 11 -2.717 -10.974 -0.564 1.00 0.00 H new ATOM 0 HE3 MET A 11 -3.455 -11.097 -2.179 1.00 0.00 H new ATOM 99 N PRO A 12 -8.335 -10.839 3.644 1.00 0.00 N ATOM 100 CA PRO A 12 -9.807 -10.619 3.752 1.00 0.00 C ATOM 101 C PRO A 12 -10.502 -10.004 2.495 1.00 0.00 C ATOM 102 O PRO A 12 -9.904 -9.194 1.779 1.00 0.00 O ATOM 103 CB PRO A 12 -9.912 -9.716 4.997 1.00 0.00 C ATOM 104 CG PRO A 12 -8.681 -10.059 5.838 1.00 0.00 C ATOM 105 CD PRO A 12 -7.589 -10.329 4.807 1.00 0.00 C ATOM 0 HA PRO A 12 -10.345 -11.564 3.831 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -9.920 -8.662 4.721 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -10.833 -9.908 5.548 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -8.409 -9.237 6.500 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -8.859 -10.931 6.468 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -7.034 -9.423 4.563 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -6.865 -11.058 5.171 1.00 0.00 H new ATOM 106 N MET A 13 -11.731 -10.438 2.185 1.00 0.00 N ATOM 107 CA MET A 13 -12.344 -10.198 0.847 1.00 0.00 C ATOM 108 C MET A 13 -12.456 -8.736 0.301 1.00 0.00 C ATOM 109 O MET A 13 -12.337 -8.547 -0.908 1.00 0.00 O ATOM 110 CB MET A 13 -13.660 -11.010 0.835 1.00 0.00 C ATOM 111 CG MET A 13 -14.431 -11.063 -0.500 1.00 0.00 C ATOM 112 SD MET A 13 -13.424 -11.194 -2.007 1.00 0.00 S ATOM 113 CE MET A 13 -12.198 -12.486 -1.720 1.00 0.00 C ATOM 0 H MET A 13 -12.327 -10.956 2.831 1.00 0.00 H new ATOM 0 HA MET A 13 -11.633 -10.543 0.096 1.00 0.00 H new ATOM 0 HB2 MET A 13 -13.431 -12.032 1.136 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.323 -10.595 1.594 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.112 -11.914 -0.468 1.00 0.00 H new ATOM 0 HG3 MET A 13 -15.045 -10.166 -0.576 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.201 -12.045 -1.704 1.00 0.00 H new ATOM 0 HE2 MET A 13 -12.396 -12.970 -0.764 1.00 0.00 H new ATOM 0 HE3 MET A 13 -12.254 -13.225 -2.519 1.00 0.00 H new ATOM 114 N GLU A 14 -12.565 -7.707 1.154 1.00 0.00 N ATOM 115 CA GLU A 14 -12.259 -6.310 0.736 1.00 0.00 C ATOM 116 C GLU A 14 -10.785 -6.023 0.291 1.00 0.00 C ATOM 117 O GLU A 14 -10.626 -5.458 -0.778 1.00 0.00 O ATOM 118 CB GLU A 14 -12.842 -5.284 1.744 1.00 0.00 C ATOM 119 CG GLU A 14 -12.042 -5.070 3.055 1.00 0.00 C ATOM 120 CD GLU A 14 -12.680 -4.081 4.021 1.00 0.00 C ATOM 121 OE1 GLU A 14 -13.559 -4.677 4.869 1.00 0.00 O ATOM 122 OE2 GLU A 14 -12.429 -2.881 4.036 1.00 0.00 O ATOM 0 H GLU A 14 -12.858 -7.802 2.127 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.786 -6.174 -0.209 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.932 -4.323 1.238 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -13.851 -5.601 2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.928 -6.030 3.558 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.041 -4.721 2.803 1.00 0.00 H new ATOM 123 N VAL A 15 -9.713 -6.406 1.008 1.00 0.00 N ATOM 124 CA VAL A 15 -8.297 -6.242 0.526 1.00 0.00 C ATOM 125 C VAL A 15 -8.004 -6.998 -0.793 1.00 0.00 C ATOM 126 O VAL A 15 -7.328 -6.438 -1.641 1.00 0.00 O ATOM 127 CB VAL A 15 -7.224 -6.694 1.580 1.00 0.00 C ATOM 128 CG1 VAL A 15 -5.978 -5.798 1.512 1.00 0.00 C ATOM 129 CG2 VAL A 15 -7.645 -6.795 3.067 1.00 0.00 C ATOM 0 H VAL A 15 -9.784 -6.835 1.931 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.214 -5.168 0.357 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.040 -7.722 1.268 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.250 -6.131 2.251 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.539 -5.860 0.516 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.260 -4.766 1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.793 -7.119 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.984 -5.820 3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.455 -7.518 3.168 1.00 0.00 H new ATOM 130 N ARG A 16 -8.440 -8.250 -0.960 1.00 0.00 N ATOM 131 CA ARG A 16 -8.259 -8.969 -2.240 1.00 0.00 C ATOM 132 C ARG A 16 -9.281 -8.651 -3.369 1.00 0.00 C ATOM 133 O ARG A 16 -8.897 -8.781 -4.523 1.00 0.00 O ATOM 134 CB ARG A 16 -8.032 -10.474 -1.949 1.00 0.00 C ATOM 135 CG ARG A 16 -6.789 -11.042 -2.691 1.00 0.00 C ATOM 136 CD ARG A 16 -7.246 -11.923 -3.848 1.00 0.00 C ATOM 137 NE ARG A 16 -6.105 -12.450 -4.629 1.00 0.00 N ATOM 138 CZ ARG A 16 -6.185 -13.474 -5.480 1.00 0.00 C ATOM 139 NH1 ARG A 16 -7.248 -14.198 -5.669 1.00 0.00 N ATOM 140 NH2 ARG A 16 -5.151 -13.757 -6.186 1.00 0.00 N ATOM 0 H ARG A 16 -8.917 -8.789 -0.237 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.358 -8.569 -2.706 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -7.908 -10.619 -0.876 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -8.917 -11.036 -2.247 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -6.170 -10.226 -3.064 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.173 -11.619 -2.002 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -7.834 -12.754 -3.460 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -7.900 -11.349 -4.504 1.00 0.00 H new ATOM 0 HE ARG A 16 -5.197 -12.001 -4.509 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.101 -13.998 -5.147 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -7.229 -14.966 -6.340 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.299 -13.205 -6.087 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.181 -14.534 -6.846 1.00 0.00 H new ATOM 141 N GLU A 17 -10.496 -8.123 -3.135 1.00 0.00 N ATOM 142 CA GLU A 17 -11.174 -7.284 -4.163 1.00 0.00 C ATOM 143 C GLU A 17 -10.466 -5.921 -4.428 1.00 0.00 C ATOM 144 O GLU A 17 -10.248 -5.601 -5.585 1.00 0.00 O ATOM 145 CB GLU A 17 -12.653 -7.022 -3.796 1.00 0.00 C ATOM 146 CG GLU A 17 -13.626 -8.200 -4.011 1.00 0.00 C ATOM 147 CD GLU A 17 -15.079 -7.864 -3.703 1.00 0.00 C ATOM 148 OE1 GLU A 17 -15.857 -7.385 -4.520 1.00 0.00 O ATOM 149 OE2 GLU A 17 -15.423 -8.154 -2.420 1.00 0.00 O ATOM 0 H GLU A 17 -11.024 -8.252 -2.272 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.117 -7.868 -5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.699 -6.726 -2.748 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.007 -6.174 -4.382 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.552 -8.535 -5.046 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.315 -9.035 -3.383 1.00 0.00 H new ATOM 150 N LYS A 18 -10.078 -5.124 -3.423 1.00 0.00 N ATOM 151 CA LYS A 18 -9.291 -3.881 -3.626 1.00 0.00 C ATOM 152 C LYS A 18 -7.933 -4.093 -4.360 1.00 0.00 C ATOM 153 O LYS A 18 -7.741 -3.520 -5.428 1.00 0.00 O ATOM 154 CB LYS A 18 -9.197 -3.094 -2.303 1.00 0.00 C ATOM 155 CG LYS A 18 -10.495 -2.509 -1.678 1.00 0.00 C ATOM 156 CD LYS A 18 -10.326 -1.772 -0.323 1.00 0.00 C ATOM 157 CE LYS A 18 -9.612 -2.535 0.806 1.00 0.00 C ATOM 158 NZ LYS A 18 -9.558 -1.716 2.033 1.00 0.00 N ATOM 0 H LYS A 18 -10.296 -5.315 -2.445 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.835 -3.255 -4.334 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -8.742 -3.751 -1.561 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.506 -2.266 -2.462 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.938 -1.816 -2.393 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.207 -3.323 -1.540 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.777 -0.848 -0.507 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.316 -1.489 0.034 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.136 -3.469 1.009 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.602 -2.797 0.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.073 -2.247 2.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.038 -0.836 1.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -10.525 -1.487 2.340 1.00 0.00 H new ATOM 159 N LEU A 19 -7.034 -4.943 -3.852 1.00 0.00 N ATOM 160 CA LEU A 19 -5.745 -5.295 -4.494 1.00 0.00 C ATOM 161 C LEU A 19 -5.911 -6.039 -5.858 1.00 0.00 C ATOM 162 O LEU A 19 -5.200 -5.713 -6.805 1.00 0.00 O ATOM 163 CB LEU A 19 -4.889 -5.953 -3.367 1.00 0.00 C ATOM 164 CG LEU A 19 -3.339 -5.918 -3.448 1.00 0.00 C ATOM 165 CD1 LEU A 19 -2.652 -4.538 -3.390 1.00 0.00 C ATOM 166 CD2 LEU A 19 -2.845 -6.783 -2.270 1.00 0.00 C ATOM 0 H LEU A 19 -7.178 -5.421 -2.963 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.188 -4.434 -4.862 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.175 -5.482 -2.426 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.187 -7.000 -3.303 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.068 -6.280 -4.440 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.572 -4.666 -3.457 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.997 -3.925 -4.222 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.901 -4.047 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.755 -6.803 -2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.204 -6.360 -1.332 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.226 -7.798 -2.379 1.00 0.00 H new ATOM 167 N LYS A 20 -6.869 -6.974 -6.016 1.00 0.00 N ATOM 168 CA LYS A 20 -7.119 -7.644 -7.303 1.00 0.00 C ATOM 169 C LYS A 20 -7.975 -6.816 -8.325 1.00 0.00 C ATOM 170 O LYS A 20 -7.832 -7.049 -9.518 1.00 0.00 O ATOM 171 CB LYS A 20 -7.680 -9.062 -7.086 1.00 0.00 C ATOM 172 CG LYS A 20 -7.451 -10.018 -8.274 1.00 0.00 C ATOM 173 CD LYS A 20 -8.013 -11.450 -8.158 1.00 0.00 C ATOM 174 CE LYS A 20 -9.293 -11.580 -7.328 1.00 0.00 C ATOM 175 NZ LYS A 20 -9.919 -12.907 -7.491 1.00 0.00 N ATOM 0 H LYS A 20 -7.484 -7.282 -5.263 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.144 -7.726 -7.783 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.221 -9.490 -6.195 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.750 -8.992 -6.891 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.883 -9.559 -9.163 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.377 -10.092 -8.444 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.209 -11.829 -9.161 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.247 -12.090 -7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.062 -11.414 -6.276 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.000 -10.805 -7.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.783 -12.957 -6.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.162 -13.056 -8.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.254 -13.645 -7.183 1.00 0.00 H new ATOM 176 N PHE A 21 -8.838 -5.862 -7.919 1.00 0.00 N ATOM 177 CA PHE A 21 -9.381 -4.804 -8.814 1.00 0.00 C ATOM 178 C PHE A 21 -8.291 -3.797 -9.187 1.00 0.00 C ATOM 179 O PHE A 21 -7.886 -3.906 -10.321 1.00 0.00 O ATOM 180 CB PHE A 21 -10.606 -4.065 -8.214 1.00 0.00 C ATOM 181 CG PHE A 21 -11.913 -4.831 -8.073 1.00 0.00 C ATOM 182 CD1 PHE A 21 -12.245 -5.940 -8.856 1.00 0.00 C ATOM 183 CD2 PHE A 21 -12.795 -4.395 -7.087 1.00 0.00 C ATOM 184 CE1 PHE A 21 -13.407 -6.649 -8.600 1.00 0.00 C ATOM 185 CE2 PHE A 21 -13.962 -5.096 -6.835 1.00 0.00 C ATOM 186 CZ PHE A 21 -14.272 -6.234 -7.583 1.00 0.00 C ATOM 0 H PHE A 21 -9.182 -5.798 -6.961 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.728 -5.315 -9.712 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -10.324 -3.703 -7.225 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.800 -3.188 -8.831 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -11.594 -6.245 -9.662 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -12.568 -3.506 -6.517 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -13.645 -7.524 -9.187 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -14.634 -4.762 -6.058 1.00 0.00 H new ATOM 0 HZ PHE A 21 -15.175 -6.790 -7.377 1.00 0.00 H new ATOM 187 N ARG A 22 -7.748 -2.886 -8.367 1.00 0.00 N ATOM 188 CA ARG A 22 -6.409 -2.231 -8.615 1.00 0.00 C ATOM 189 C ARG A 22 -5.489 -2.916 -9.723 1.00 0.00 C ATOM 190 O ARG A 22 -5.376 -2.412 -10.844 1.00 0.00 O ATOM 191 CB ARG A 22 -5.833 -2.064 -7.172 1.00 0.00 C ATOM 192 CG ARG A 22 -4.615 -1.138 -6.940 1.00 0.00 C ATOM 193 CD ARG A 22 -4.976 0.240 -6.388 1.00 0.00 C ATOM 194 NE ARG A 22 -3.796 1.088 -6.099 1.00 0.00 N ATOM 195 CZ ARG A 22 -3.863 2.303 -5.550 1.00 0.00 C ATOM 196 NH1 ARG A 22 -4.970 2.910 -5.232 1.00 0.00 N ATOM 197 NH2 ARG A 22 -2.763 2.915 -5.303 1.00 0.00 N ATOM 0 H ARG A 22 -8.204 -2.568 -7.512 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.485 -1.266 -9.116 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.642 -1.704 -6.537 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -5.562 -3.056 -6.812 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.928 -1.626 -6.249 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.083 -1.012 -7.883 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.616 0.754 -7.105 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.557 0.116 -5.474 1.00 0.00 H new ATOM 0 HE ARG A 22 -2.874 0.720 -6.334 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -5.867 2.455 -5.400 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.940 3.840 -4.815 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.872 2.472 -5.526 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -2.780 3.845 -4.884 1.00 0.00 H new ATOM 198 N ALA A 23 -5.191 -4.221 -9.554 1.00 0.00 N ATOM 199 CA ALA A 23 -4.774 -5.122 -10.665 1.00 0.00 C ATOM 200 C ALA A 23 -5.728 -5.259 -11.924 1.00 0.00 C ATOM 201 O ALA A 23 -5.478 -4.642 -12.961 1.00 0.00 O ATOM 202 CB ALA A 23 -4.388 -6.426 -9.936 1.00 0.00 C ATOM 0 H ALA A 23 -5.231 -4.686 -8.647 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.943 -4.692 -11.223 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.062 -7.168 -10.665 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.577 -6.225 -9.236 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -5.252 -6.808 -9.391 1.00 0.00 H new ATOM 203 N GLU A 24 -6.799 -6.056 -11.837 1.00 0.00 N ATOM 204 CA GLU A 24 -7.740 -6.369 -12.958 1.00 0.00 C ATOM 205 C GLU A 24 -8.781 -5.281 -13.418 1.00 0.00 C ATOM 206 O GLU A 24 -9.156 -5.254 -14.590 1.00 0.00 O ATOM 207 CB GLU A 24 -8.469 -7.699 -12.601 1.00 0.00 C ATOM 208 CG GLU A 24 -7.606 -8.970 -12.319 1.00 0.00 C ATOM 209 CD GLU A 24 -6.550 -9.423 -13.334 1.00 0.00 C ATOM 210 OE1 GLU A 24 -6.936 -9.218 -14.624 1.00 0.00 O ATOM 211 OE2 GLU A 24 -5.487 -9.947 -13.006 1.00 0.00 O ATOM 0 H GLU A 24 -7.057 -6.522 -10.967 1.00 0.00 H new ATOM 0 HA GLU A 24 -7.099 -6.429 -13.837 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.084 -7.514 -11.720 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.148 -7.935 -13.420 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -7.095 -8.810 -11.370 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -8.294 -9.803 -12.174 1.00 0.00 H new ATOM 212 N ALA A 25 -9.236 -4.393 -12.522 1.00 0.00 N ATOM 213 CA ALA A 25 -9.708 -3.021 -12.859 1.00 0.00 C ATOM 214 C ALA A 25 -8.827 -2.219 -13.892 1.00 0.00 C ATOM 215 O ALA A 25 -9.372 -1.607 -14.813 1.00 0.00 O ATOM 216 CB ALA A 25 -9.713 -2.147 -11.577 1.00 0.00 C ATOM 0 H ALA A 25 -9.292 -4.601 -11.525 1.00 0.00 H new ATOM 0 HA ALA A 25 -10.688 -3.190 -13.305 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.058 -1.143 -11.823 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.381 -2.589 -10.838 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -8.704 -2.094 -11.169 1.00 0.00 H new ATOM 217 N ASN A 26 -7.489 -2.138 -13.656 1.00 0.00 N ATOM 218 CA ASN A 26 -6.638 -1.073 -14.252 1.00 0.00 C ATOM 219 C ASN A 26 -5.584 -1.578 -15.312 1.00 0.00 C ATOM 220 O ASN A 26 -5.461 -0.962 -16.374 1.00 0.00 O ATOM 221 CB ASN A 26 -6.177 -0.260 -12.995 1.00 0.00 C ATOM 222 CG ASN A 26 -4.755 0.266 -12.961 1.00 0.00 C ATOM 223 OD1 ASN A 26 -4.413 1.330 -13.464 1.00 0.00 O ATOM 224 ND2 ASN A 26 -3.919 -0.514 -12.341 1.00 0.00 N ATOM 0 H ASN A 26 -6.980 -2.793 -13.062 1.00 0.00 H new ATOM 0 HA ASN A 26 -7.146 -0.400 -14.943 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.849 0.591 -12.885 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -6.318 -0.893 -12.119 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.938 -0.248 -12.260 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -4.245 -1.392 -11.936 1.00 0.00 H new ATOM 225 N GLY A 27 -4.822 -2.651 -15.040 1.00 0.00 N ATOM 226 CA GLY A 27 -3.810 -3.203 -16.002 1.00 0.00 C ATOM 227 C GLY A 27 -2.590 -3.996 -15.454 1.00 0.00 C ATOM 228 O GLY A 27 -1.569 -4.095 -16.136 1.00 0.00 O ATOM 0 H GLY A 27 -4.877 -3.166 -14.162 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.340 -3.856 -16.695 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.422 -2.367 -16.584 1.00 0.00 H new ATOM 229 N ARG A 28 -2.669 -4.559 -14.245 1.00 0.00 N ATOM 230 CA ARG A 28 -1.573 -5.305 -13.564 1.00 0.00 C ATOM 231 C ARG A 28 -2.255 -6.622 -13.031 1.00 0.00 C ATOM 232 O ARG A 28 -3.483 -6.764 -13.008 1.00 0.00 O ATOM 233 CB ARG A 28 -0.965 -4.300 -12.544 1.00 0.00 C ATOM 234 CG ARG A 28 -0.339 -2.970 -13.069 1.00 0.00 C ATOM 235 CD ARG A 28 0.100 -1.955 -11.991 1.00 0.00 C ATOM 236 NE ARG A 28 -1.068 -1.409 -11.253 1.00 0.00 N ATOM 237 CZ ARG A 28 -1.040 -0.793 -10.079 1.00 0.00 C ATOM 238 NH1 ARG A 28 0.019 -0.653 -9.353 1.00 0.00 N ATOM 239 NH2 ARG A 28 -2.149 -0.344 -9.614 1.00 0.00 N ATOM 0 H ARG A 28 -3.519 -4.514 -13.684 1.00 0.00 H new ATOM 0 HA ARG A 28 -0.721 -5.646 -14.153 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.750 -4.036 -11.835 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.193 -4.827 -11.983 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.528 -3.217 -13.681 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.063 -2.484 -13.723 1.00 0.00 H new ATOM 0 HD2 ARG A 28 0.782 -2.438 -11.291 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.650 -1.139 -12.460 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.982 -1.519 -11.693 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.911 -1.030 -9.674 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.037 -0.166 -8.459 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -3.011 -0.467 -10.145 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.168 0.136 -8.714 1.00 0.00 H new ATOM 240 N SER A 29 -1.513 -7.668 -12.656 1.00 0.00 N ATOM 241 CA SER A 29 -2.143 -8.991 -12.320 1.00 0.00 C ATOM 242 C SER A 29 -1.433 -9.523 -11.068 1.00 0.00 C ATOM 243 O SER A 29 -0.210 -9.620 -11.084 1.00 0.00 O ATOM 244 CB SER A 29 -2.090 -9.944 -13.532 1.00 0.00 C ATOM 245 OG SER A 29 -2.941 -11.070 -13.305 1.00 0.00 O ATOM 0 H SER A 29 -0.497 -7.648 -12.572 1.00 0.00 H new ATOM 0 HA SER A 29 -3.205 -8.893 -12.096 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.403 -9.417 -14.434 1.00 0.00 H new ATOM 0 HB3 SER A 29 -1.066 -10.279 -13.697 1.00 0.00 H new ATOM 0 HG SER A 29 -3.864 -10.764 -13.186 1.00 0.00 H new ATOM 246 N MET A 30 -2.110 -9.669 -9.920 1.00 0.00 N ATOM 247 CA MET A 30 -1.599 -9.044 -8.666 1.00 0.00 C ATOM 248 C MET A 30 -0.137 -9.340 -8.242 1.00 0.00 C ATOM 249 O MET A 30 0.526 -8.398 -7.867 1.00 0.00 O ATOM 250 CB MET A 30 -2.438 -9.365 -7.433 1.00 0.00 C ATOM 251 CG MET A 30 -3.873 -8.936 -7.380 1.00 0.00 C ATOM 252 SD MET A 30 -4.684 -10.018 -6.189 1.00 0.00 S ATOM 253 CE MET A 30 -4.627 -8.935 -4.768 1.00 0.00 C ATOM 0 H MET A 30 -2.981 -10.191 -9.821 1.00 0.00 H new ATOM 0 HA MET A 30 -1.663 -8.000 -8.973 1.00 0.00 H new ATOM 0 HB2 MET A 30 -2.416 -10.446 -7.296 1.00 0.00 H new ATOM 0 HB3 MET A 30 -1.934 -8.925 -6.573 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.955 -7.893 -7.076 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.340 -9.020 -8.361 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.220 -9.477 -3.914 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.992 -8.077 -4.990 1.00 0.00 H new ATOM 0 HE3 MET A 30 -5.634 -8.590 -4.533 1.00 0.00 H new ATOM 254 N ASN A 31 0.469 -10.526 -8.325 1.00 0.00 N ATOM 255 CA ASN A 31 1.961 -10.621 -8.202 1.00 0.00 C ATOM 256 C ASN A 31 2.775 -9.539 -9.050 1.00 0.00 C ATOM 257 O ASN A 31 3.567 -8.809 -8.460 1.00 0.00 O ATOM 258 CB ASN A 31 2.356 -12.104 -8.426 1.00 0.00 C ATOM 259 CG ASN A 31 3.811 -12.478 -8.163 1.00 0.00 C ATOM 260 OD1 ASN A 31 4.489 -13.021 -9.023 1.00 0.00 O ATOM 261 ND2 ASN A 31 4.331 -12.226 -6.991 1.00 0.00 N ATOM 0 H ASN A 31 -0.011 -11.414 -8.471 1.00 0.00 H new ATOM 0 HA ASN A 31 2.267 -10.335 -7.196 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.726 -12.723 -7.787 1.00 0.00 H new ATOM 0 HB3 ASN A 31 2.120 -12.366 -9.457 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.299 -12.482 -6.797 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.769 -11.773 -6.270 1.00 0.00 H new ATOM 262 N SER A 32 2.391 -9.279 -10.320 1.00 0.00 N ATOM 263 CA SER A 32 2.568 -7.940 -10.980 1.00 0.00 C ATOM 264 C SER A 32 1.948 -6.652 -10.337 1.00 0.00 C ATOM 265 O SER A 32 2.722 -5.735 -10.045 1.00 0.00 O ATOM 266 CB SER A 32 2.433 -8.011 -12.521 1.00 0.00 C ATOM 267 OG SER A 32 1.157 -8.441 -12.964 1.00 0.00 O ATOM 0 H SER A 32 1.952 -9.976 -10.922 1.00 0.00 H new ATOM 0 HA SER A 32 3.609 -7.741 -10.727 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.640 -7.026 -12.940 1.00 0.00 H new ATOM 0 HB3 SER A 32 3.191 -8.690 -12.912 1.00 0.00 H new ATOM 0 HG SER A 32 0.790 -9.088 -12.326 1.00 0.00 H new ATOM 268 N GLU A 33 0.629 -6.513 -10.090 1.00 0.00 N ATOM 269 CA GLU A 33 0.105 -5.278 -9.404 1.00 0.00 C ATOM 270 C GLU A 33 0.543 -5.025 -7.947 1.00 0.00 C ATOM 271 O GLU A 33 1.065 -3.960 -7.650 1.00 0.00 O ATOM 272 CB GLU A 33 -1.423 -5.277 -9.342 1.00 0.00 C ATOM 273 CG GLU A 33 -1.989 -3.885 -8.964 1.00 0.00 C ATOM 274 CD GLU A 33 -2.269 -3.601 -7.493 1.00 0.00 C ATOM 275 OE1 GLU A 33 -2.783 -4.659 -6.822 1.00 0.00 O ATOM 276 OE2 GLU A 33 -1.991 -2.543 -6.957 1.00 0.00 O ATOM 0 H GLU A 33 -0.081 -7.202 -10.338 1.00 0.00 H new ATOM 0 HA GLU A 33 0.541 -4.501 -10.032 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.825 -5.581 -10.308 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.756 -6.014 -8.612 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.288 -3.131 -9.322 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.919 -3.742 -9.514 1.00 0.00 H new ATOM 277 N LEU A 34 0.201 -5.954 -7.032 1.00 0.00 N ATOM 278 CA LEU A 34 0.698 -6.032 -5.657 1.00 0.00 C ATOM 279 C LEU A 34 2.194 -5.646 -5.664 1.00 0.00 C ATOM 280 O LEU A 34 2.496 -4.688 -4.977 1.00 0.00 O ATOM 281 CB LEU A 34 0.399 -7.472 -5.139 1.00 0.00 C ATOM 282 CG LEU A 34 -0.021 -7.726 -3.677 1.00 0.00 C ATOM 283 CD1 LEU A 34 0.344 -9.116 -3.135 1.00 0.00 C ATOM 284 CD2 LEU A 34 0.564 -6.746 -2.650 1.00 0.00 C ATOM 0 H LEU A 34 -0.459 -6.701 -7.248 1.00 0.00 H new ATOM 0 HA LEU A 34 0.209 -5.338 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.389 -7.880 -5.772 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.294 -8.067 -5.321 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.100 -7.602 -3.766 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.010 -9.203 -2.101 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.143 -9.881 -3.739 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.425 -9.252 -3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.210 -7.009 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.652 -6.800 -2.674 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.246 -5.732 -2.892 1.00 0.00 H new ATOM 285 N LEU A 35 3.115 -6.248 -6.475 1.00 0.00 N ATOM 286 CA LEU A 35 4.530 -5.808 -6.446 1.00 0.00 C ATOM 287 C LEU A 35 4.772 -4.375 -6.900 1.00 0.00 C ATOM 288 O LEU A 35 5.340 -3.594 -6.149 1.00 0.00 O ATOM 289 CB LEU A 35 5.494 -6.714 -7.252 1.00 0.00 C ATOM 290 CG LEU A 35 6.073 -7.922 -6.517 1.00 0.00 C ATOM 291 CD1 LEU A 35 7.097 -8.556 -7.439 1.00 0.00 C ATOM 292 CD2 LEU A 35 6.749 -7.459 -5.207 1.00 0.00 C ATOM 0 H LEU A 35 2.909 -7.005 -7.127 1.00 0.00 H new ATOM 0 HA LEU A 35 4.750 -5.884 -5.381 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.965 -7.074 -8.135 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.323 -6.100 -7.605 1.00 0.00 H new ATOM 0 HG LEU A 35 5.292 -8.638 -6.260 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.537 -9.426 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.611 -8.866 -8.364 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.880 -7.832 -7.665 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.161 -8.323 -4.685 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.551 -6.759 -5.439 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.012 -6.968 -4.571 1.00 0.00 H new ATOM 293 N GLN A 36 4.345 -4.038 -8.107 1.00 0.00 N ATOM 294 CA GLN A 36 4.467 -2.665 -8.616 1.00 0.00 C ATOM 295 C GLN A 36 3.748 -1.577 -7.742 1.00 0.00 C ATOM 296 O GLN A 36 4.301 -0.482 -7.661 1.00 0.00 O ATOM 297 CB GLN A 36 4.119 -2.779 -10.125 1.00 0.00 C ATOM 298 CG GLN A 36 4.531 -1.574 -11.009 1.00 0.00 C ATOM 299 CD GLN A 36 3.458 -0.526 -11.273 1.00 0.00 C ATOM 300 OE1 GLN A 36 3.085 -0.227 -12.399 1.00 0.00 O ATOM 301 NE2 GLN A 36 2.925 0.073 -10.252 1.00 0.00 N ATOM 0 H GLN A 36 3.910 -4.691 -8.759 1.00 0.00 H new ATOM 0 HA GLN A 36 5.472 -2.252 -8.526 1.00 0.00 H new ATOM 0 HB2 GLN A 36 4.596 -3.675 -10.521 1.00 0.00 H new ATOM 0 HB3 GLN A 36 3.043 -2.923 -10.220 1.00 0.00 H new ATOM 0 HG2 GLN A 36 5.381 -1.081 -10.538 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.877 -1.958 -11.969 1.00 0.00 H new ATOM 0 HE21 GLN A 36 3.225 -0.165 -9.307 1.00 0.00 H new ATOM 0 HE22 GLN A 36 2.206 0.782 -10.395 1.00 0.00 H new ATOM 302 N ILE A 37 2.628 -1.844 -7.032 1.00 0.00 N ATOM 303 CA ILE A 37 2.125 -0.954 -5.950 1.00 0.00 C ATOM 304 C ILE A 37 2.841 -1.072 -4.561 1.00 0.00 C ATOM 305 O ILE A 37 2.746 -0.133 -3.808 1.00 0.00 O ATOM 306 CB ILE A 37 0.564 -1.029 -5.795 1.00 0.00 C ATOM 307 CG1 ILE A 37 -0.082 0.339 -5.432 1.00 0.00 C ATOM 308 CG2 ILE A 37 0.130 -2.082 -4.748 1.00 0.00 C ATOM 309 CD1 ILE A 37 -0.082 1.373 -6.575 1.00 0.00 C ATOM 0 H ILE A 37 2.051 -2.671 -7.187 1.00 0.00 H new ATOM 0 HA ILE A 37 2.399 0.039 -6.306 1.00 0.00 H new ATOM 0 HB ILE A 37 0.202 -1.328 -6.779 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.111 0.167 -5.115 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.448 0.761 -4.578 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.958 -2.097 -4.676 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.487 -3.066 -5.052 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.554 -1.826 -3.777 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.551 2.295 -6.232 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.944 1.580 -6.879 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.639 0.977 -7.424 1.00 0.00 H new ATOM 310 N VAL A 38 3.358 -2.217 -4.123 1.00 0.00 N ATOM 311 CA VAL A 38 4.081 -2.434 -2.830 1.00 0.00 C ATOM 312 C VAL A 38 5.545 -1.889 -2.910 1.00 0.00 C ATOM 313 O VAL A 38 5.989 -1.141 -2.044 1.00 0.00 O ATOM 314 CB VAL A 38 4.090 -3.972 -2.550 1.00 0.00 C ATOM 315 CG1 VAL A 38 5.167 -4.622 -1.655 1.00 0.00 C ATOM 316 CG2 VAL A 38 2.721 -4.431 -2.012 1.00 0.00 C ATOM 0 H VAL A 38 3.292 -3.074 -4.672 1.00 0.00 H new ATOM 0 HA VAL A 38 3.579 -1.897 -2.025 1.00 0.00 H new ATOM 0 HB VAL A 38 4.352 -4.324 -3.548 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.989 -5.696 -1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.153 -4.442 -2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.120 -4.188 -0.656 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.746 -5.504 -1.823 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.499 -3.904 -1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 38 1.948 -4.210 -2.748 1.00 0.00 H new ATOM 317 N GLN A 39 6.295 -2.241 -3.978 1.00 0.00 N ATOM 318 CA GLN A 39 7.441 -1.439 -4.456 1.00 0.00 C ATOM 319 C GLN A 39 7.088 0.056 -4.668 1.00 0.00 C ATOM 320 O GLN A 39 7.839 0.872 -4.136 1.00 0.00 O ATOM 321 CB GLN A 39 7.937 -2.025 -5.816 1.00 0.00 C ATOM 322 CG GLN A 39 8.650 -3.398 -5.783 1.00 0.00 C ATOM 323 CD GLN A 39 8.941 -4.088 -7.124 1.00 0.00 C ATOM 324 OE1 GLN A 39 8.882 -5.305 -7.244 1.00 0.00 O ATOM 325 NE2 GLN A 39 9.295 -3.382 -8.167 1.00 0.00 N ATOM 0 H GLN A 39 6.124 -3.083 -4.528 1.00 0.00 H new ATOM 0 HA GLN A 39 8.212 -1.491 -3.687 1.00 0.00 H new ATOM 0 HB2 GLN A 39 7.077 -2.108 -6.480 1.00 0.00 H new ATOM 0 HB3 GLN A 39 8.618 -1.303 -6.265 1.00 0.00 H new ATOM 0 HG2 GLN A 39 9.598 -3.270 -5.260 1.00 0.00 H new ATOM 0 HG3 GLN A 39 8.043 -4.076 -5.183 1.00 0.00 H new ATOM 0 HE21 GLN A 39 9.354 -2.366 -8.099 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.512 -3.848 -9.048 1.00 0.00 H new ATOM 326 N ASP A 40 5.953 0.441 -5.324 1.00 0.00 N ATOM 327 CA ASP A 40 5.361 1.808 -5.131 1.00 0.00 C ATOM 328 C ASP A 40 5.306 2.256 -3.655 1.00 0.00 C ATOM 329 O ASP A 40 5.854 3.301 -3.296 1.00 0.00 O ATOM 330 CB ASP A 40 4.035 2.105 -5.865 1.00 0.00 C ATOM 331 CG ASP A 40 3.530 3.545 -5.925 1.00 0.00 C ATOM 332 OD1 ASP A 40 4.223 4.551 -5.820 1.00 0.00 O ATOM 333 OD2 ASP A 40 2.187 3.572 -6.124 1.00 0.00 O ATOM 0 H ASP A 40 5.439 -0.154 -5.974 1.00 0.00 H new ATOM 0 HA ASP A 40 6.091 2.432 -5.646 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.139 1.750 -6.890 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.257 1.502 -5.396 1.00 0.00 H new ATOM 334 N ALA A 41 4.667 1.417 -2.832 1.00 0.00 N ATOM 335 CA ALA A 41 4.173 1.826 -1.518 1.00 0.00 C ATOM 336 C ALA A 41 5.171 1.985 -0.351 1.00 0.00 C ATOM 337 O ALA A 41 4.898 2.705 0.609 1.00 0.00 O ATOM 338 CB ALA A 41 2.914 0.996 -1.224 1.00 0.00 C ATOM 0 H ALA A 41 4.480 0.440 -3.059 1.00 0.00 H new ATOM 0 HA ALA A 41 3.929 2.886 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.515 1.274 -0.248 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.164 1.188 -1.991 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.169 -0.064 -1.224 1.00 0.00 H new ATOM 339 N LEU A 42 6.355 1.399 -0.491 1.00 0.00 N ATOM 340 CA LEU A 42 7.547 1.833 0.274 1.00 0.00 C ATOM 341 C LEU A 42 8.867 2.073 -0.528 1.00 0.00 C ATOM 342 O LEU A 42 9.952 2.066 0.060 1.00 0.00 O ATOM 343 CB LEU A 42 7.657 0.911 1.521 1.00 0.00 C ATOM 344 CG LEU A 42 7.928 -0.595 1.264 1.00 0.00 C ATOM 345 CD1 LEU A 42 8.697 -1.185 2.437 1.00 0.00 C ATOM 346 CD2 LEU A 42 6.659 -1.450 1.091 1.00 0.00 C ATOM 0 H LEU A 42 6.528 0.619 -1.125 1.00 0.00 H new ATOM 0 HA LEU A 42 7.391 2.863 0.594 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.455 1.295 2.156 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.730 0.996 2.088 1.00 0.00 H new ATOM 0 HG LEU A 42 8.488 -0.626 0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.886 -2.243 2.253 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.646 -0.661 2.550 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.111 -1.074 3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.941 -2.488 0.916 1.00 0.00 H new ATOM 0 HD22 LEU A 42 6.052 -1.386 1.994 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.085 -1.081 0.241 1.00 0.00 H new ATOM 347 N SER A 43 8.801 2.407 -1.833 1.00 0.00 N ATOM 348 CA SER A 43 9.949 3.027 -2.556 1.00 0.00 C ATOM 349 C SER A 43 9.581 3.952 -3.764 1.00 0.00 C ATOM 350 O SER A 43 10.144 5.039 -3.900 1.00 0.00 O ATOM 351 CB SER A 43 11.003 1.942 -2.916 1.00 0.00 C ATOM 352 OG SER A 43 10.505 0.975 -3.844 1.00 0.00 O ATOM 0 H SER A 43 7.974 2.262 -2.412 1.00 0.00 H new ATOM 0 HA SER A 43 10.391 3.734 -1.854 1.00 0.00 H new ATOM 0 HB2 SER A 43 11.885 2.424 -3.338 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.322 1.435 -2.005 1.00 0.00 H new ATOM 0 HG SER A 43 9.560 1.156 -4.029 1.00 0.00 H new ATOM 353 N LYS A 44 8.782 3.516 -4.746 1.00 0.00 N ATOM 354 CA LYS A 44 9.411 3.159 -6.091 1.00 0.00 C ATOM 355 C LYS A 44 10.189 4.257 -6.943 1.00 0.00 C ATOM 356 O LYS A 44 9.539 4.921 -7.757 1.00 0.00 O ATOM 357 CB LYS A 44 8.373 2.458 -7.011 1.00 0.00 C ATOM 358 CG LYS A 44 8.896 1.737 -8.279 1.00 0.00 C ATOM 359 CD LYS A 44 7.853 0.759 -8.863 1.00 0.00 C ATOM 360 CE LYS A 44 8.346 -0.050 -10.074 1.00 0.00 C ATOM 361 NZ LYS A 44 8.216 0.719 -11.328 1.00 0.00 N ATOM 0 H LYS A 44 7.771 3.397 -4.680 1.00 0.00 H new ATOM 0 HA LYS A 44 10.221 2.512 -5.754 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.833 1.727 -6.409 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.648 3.207 -7.328 1.00 0.00 H new ATOM 0 HG2 LYS A 44 9.160 2.478 -9.034 1.00 0.00 H new ATOM 0 HG3 LYS A 44 9.807 1.191 -8.035 1.00 0.00 H new ATOM 0 HD2 LYS A 44 7.545 0.066 -8.080 1.00 0.00 H new ATOM 0 HD3 LYS A 44 6.968 1.324 -9.155 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.388 -0.331 -9.925 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.774 -0.975 -10.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 8.141 0.063 -12.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 7.363 1.312 -11.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 9.053 1.324 -11.452 1.00 0.00 H new ATOM 362 N PRO A 45 11.550 4.426 -6.936 1.00 0.00 N ATOM 363 CA PRO A 45 12.255 5.367 -7.865 1.00 0.00 C ATOM 364 C PRO A 45 12.693 4.768 -9.241 1.00 0.00 C ATOM 365 O PRO A 45 13.879 4.661 -9.561 1.00 0.00 O ATOM 366 CB PRO A 45 13.402 5.824 -6.949 1.00 0.00 C ATOM 367 CG PRO A 45 13.784 4.561 -6.167 1.00 0.00 C ATOM 368 CD PRO A 45 12.454 3.840 -5.925 1.00 0.00 C ATOM 0 HA PRO A 45 11.627 6.173 -8.244 1.00 0.00 H new ATOM 0 HB2 PRO A 45 14.245 6.206 -7.526 1.00 0.00 H new ATOM 0 HB3 PRO A 45 13.084 6.625 -6.282 1.00 0.00 H new ATOM 0 HG2 PRO A 45 14.476 3.938 -6.734 1.00 0.00 H new ATOM 0 HG3 PRO A 45 14.277 4.810 -5.227 1.00 0.00 H new ATOM 0 HD2 PRO A 45 12.554 2.762 -6.053 1.00 0.00 H new ATOM 0 HD3 PRO A 45 12.086 4.008 -4.913 1.00 0.00 H new ATOM 369 N SER A 46 11.706 4.376 -10.060 1.00 0.00 N ATOM 370 CA SER A 46 11.967 3.497 -11.242 1.00 0.00 C ATOM 371 C SER A 46 10.972 3.652 -12.452 1.00 0.00 C ATOM 372 O SER A 46 10.143 2.756 -12.656 1.00 0.00 O ATOM 373 CB SER A 46 12.065 2.038 -10.713 1.00 0.00 C ATOM 374 OG SER A 46 12.307 1.109 -11.770 1.00 0.00 O ATOM 0 H SER A 46 10.728 4.642 -9.941 1.00 0.00 H new ATOM 0 HA SER A 46 12.905 3.815 -11.698 1.00 0.00 H new ATOM 0 HB2 SER A 46 12.867 1.970 -9.978 1.00 0.00 H new ATOM 0 HB3 SER A 46 11.140 1.774 -10.201 1.00 0.00 H new ATOM 0 HG SER A 46 12.364 0.203 -11.402 1.00 0.00 H new ATOM 375 N PRO A 47 11.079 4.661 -13.364 1.00 0.00 N ATOM 376 CA PRO A 47 11.749 5.971 -13.119 1.00 0.00 C ATOM 377 C PRO A 47 10.697 7.083 -12.766 1.00 0.00 C ATOM 378 O PRO A 47 10.135 7.739 -13.647 1.00 0.00 O ATOM 379 CB PRO A 47 12.436 6.135 -14.491 1.00 0.00 C ATOM 380 CG PRO A 47 11.455 5.551 -15.522 1.00 0.00 C ATOM 381 CD PRO A 47 10.651 4.484 -14.768 1.00 0.00 C ATOM 0 HA PRO A 47 12.435 6.036 -12.275 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.646 7.184 -14.701 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.390 5.608 -14.516 1.00 0.00 H new ATOM 0 HG2 PRO A 47 10.800 6.325 -15.922 1.00 0.00 H new ATOM 0 HG3 PRO A 47 11.988 5.116 -16.367 1.00 0.00 H new ATOM 0 HD2 PRO A 47 9.578 4.634 -14.883 1.00 0.00 H new ATOM 0 HD3 PRO A 47 10.873 3.481 -15.132 1.00 0.00 H new ATOM 382 N VAL A 48 10.342 7.219 -11.479 1.00 0.00 N ATOM 383 CA VAL A 48 9.033 7.844 -11.074 1.00 0.00 C ATOM 384 C VAL A 48 9.070 8.476 -9.649 1.00 0.00 C ATOM 385 O VAL A 48 8.680 9.632 -9.474 1.00 0.00 O ATOM 386 CB VAL A 48 7.817 6.867 -11.313 1.00 0.00 C ATOM 387 CG1 VAL A 48 7.831 5.542 -10.509 1.00 0.00 C ATOM 388 CG2 VAL A 48 6.447 7.547 -11.086 1.00 0.00 C ATOM 0 H VAL A 48 10.921 6.915 -10.696 1.00 0.00 H new ATOM 0 HA VAL A 48 8.868 8.692 -11.739 1.00 0.00 H new ATOM 0 HB VAL A 48 7.954 6.605 -12.362 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.946 4.956 -10.758 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.726 4.973 -10.761 1.00 0.00 H new ATOM 0 HG13 VAL A 48 7.831 5.764 -9.442 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.649 6.826 -11.265 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.386 7.909 -10.060 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.339 8.386 -11.773 1.00 0.00 H new ATOM 389 N THR A 49 9.519 7.696 -8.654 1.00 0.00 N ATOM 390 CA THR A 49 9.467 8.024 -7.200 1.00 0.00 C ATOM 391 C THR A 49 8.118 7.538 -6.592 1.00 0.00 C ATOM 392 O THR A 49 7.040 7.894 -7.069 1.00 0.00 O ATOM 393 CB THR A 49 9.915 9.444 -6.727 1.00 0.00 C ATOM 394 OG1 THR A 49 8.922 10.419 -7.007 1.00 0.00 O ATOM 395 CG2 THR A 49 11.226 9.922 -7.368 1.00 0.00 C ATOM 0 H THR A 49 9.945 6.787 -8.833 1.00 0.00 H new ATOM 0 HA THR A 49 10.292 7.453 -6.773 1.00 0.00 H new ATOM 0 HB THR A 49 10.070 9.340 -5.653 1.00 0.00 H new ATOM 0 HG1 THR A 49 8.876 10.571 -7.974 1.00 0.00 H new ATOM 0 HG21 THR A 49 11.474 10.915 -6.992 1.00 0.00 H new ATOM 0 HG22 THR A 49 12.028 9.228 -7.117 1.00 0.00 H new ATOM 0 HG23 THR A 49 11.108 9.963 -8.451 1.00 0.00 H new ATOM 396 N GLY A 50 8.187 6.749 -5.512 1.00 0.00 N ATOM 397 CA GLY A 50 7.013 6.426 -4.661 1.00 0.00 C ATOM 398 C GLY A 50 7.138 6.884 -3.190 1.00 0.00 C ATOM 399 O GLY A 50 7.230 6.048 -2.298 1.00 0.00 O ATOM 0 H GLY A 50 9.053 6.312 -5.196 1.00 0.00 H new ATOM 0 HA2 GLY A 50 6.127 6.887 -5.097 1.00 0.00 H new ATOM 0 HA3 GLY A 50 6.853 5.348 -4.680 1.00 0.00 H new ATOM 400 N TYR A 51 7.115 8.149 -2.761 1.00 0.00 N ATOM 401 CA TYR A 51 7.182 9.374 -3.635 1.00 0.00 C ATOM 402 C TYR A 51 8.238 10.458 -3.207 1.00 0.00 C ATOM 403 O TYR A 51 8.017 11.662 -3.353 1.00 0.00 O ATOM 404 CB TYR A 51 5.727 9.946 -3.740 1.00 0.00 C ATOM 405 CG TYR A 51 5.175 9.934 -5.164 1.00 0.00 C ATOM 406 CD1 TYR A 51 4.515 8.801 -5.638 1.00 0.00 C ATOM 407 CD2 TYR A 51 5.152 11.100 -5.935 1.00 0.00 C ATOM 408 CE1 TYR A 51 3.975 8.784 -6.910 1.00 0.00 C ATOM 409 CE2 TYR A 51 4.558 11.095 -7.193 1.00 0.00 C ATOM 410 CZ TYR A 51 4.028 9.926 -7.707 1.00 0.00 C ATOM 411 OH TYR A 51 3.413 9.993 -8.922 1.00 0.00 O ATOM 0 H TYR A 51 7.048 8.380 -1.770 1.00 0.00 H new ATOM 0 HA TYR A 51 7.558 9.074 -4.613 1.00 0.00 H new ATOM 0 HB2 TYR A 51 5.068 9.363 -3.097 1.00 0.00 H new ATOM 0 HB3 TYR A 51 5.718 10.969 -3.363 1.00 0.00 H new ATOM 0 HD1 TYR A 51 4.425 7.930 -5.006 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.597 12.007 -5.553 1.00 0.00 H new ATOM 0 HE1 TYR A 51 3.511 7.884 -7.287 1.00 0.00 H new ATOM 0 HE2 TYR A 51 4.511 12.007 -7.770 1.00 0.00 H new ATOM 0 HH TYR A 51 3.568 10.875 -9.319 1.00 0.00 H new ATOM 412 N ARG A 52 9.289 10.050 -2.479 1.00 0.00 N ATOM 413 CA ARG A 52 9.676 10.735 -1.191 1.00 0.00 C ATOM 414 C ARG A 52 8.563 10.765 -0.062 1.00 0.00 C ATOM 415 O ARG A 52 8.850 10.545 1.117 1.00 0.00 O ATOM 416 CB ARG A 52 10.377 12.114 -1.396 1.00 0.00 C ATOM 417 CG ARG A 52 11.646 12.138 -2.287 1.00 0.00 C ATOM 418 CD ARG A 52 12.855 11.390 -1.699 1.00 0.00 C ATOM 419 NE ARG A 52 13.991 11.519 -2.646 1.00 0.00 N ATOM 420 CZ ARG A 52 15.184 10.957 -2.503 1.00 0.00 C ATOM 421 NH1 ARG A 52 15.529 10.211 -1.496 1.00 0.00 N ATOM 422 NH2 ARG A 52 16.051 11.171 -3.427 1.00 0.00 N ATOM 0 H ARG A 52 9.889 9.266 -2.736 1.00 0.00 H new ATOM 0 HA ARG A 52 10.435 10.066 -0.785 1.00 0.00 H new ATOM 0 HB2 ARG A 52 9.649 12.802 -1.826 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.646 12.506 -0.415 1.00 0.00 H new ATOM 0 HG2 ARG A 52 11.402 11.703 -3.256 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.929 13.175 -2.466 1.00 0.00 H new ATOM 0 HD2 ARG A 52 13.122 11.805 -0.727 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.611 10.340 -1.540 1.00 0.00 H new ATOM 0 HE ARG A 52 13.841 12.089 -3.479 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.862 10.025 -0.747 1.00 0.00 H new ATOM 0 HH12 ARG A 52 16.467 9.812 -1.455 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.809 11.753 -4.229 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.981 10.759 -3.359 1.00 0.00 H new ATOM 423 N ASN A 53 7.284 10.987 -0.422 1.00 0.00 N ATOM 424 CA ASN A 53 6.107 10.595 0.393 1.00 0.00 C ATOM 425 C ASN A 53 5.881 9.025 0.482 1.00 0.00 C ATOM 426 O ASN A 53 6.810 8.225 0.502 1.00 0.00 O ATOM 427 CB ASN A 53 4.840 11.316 -0.197 1.00 0.00 C ATOM 428 CG ASN A 53 4.832 12.834 -0.442 1.00 0.00 C ATOM 429 OD1 ASN A 53 4.210 13.315 -1.376 1.00 0.00 O ATOM 430 ND2 ASN A 53 5.470 13.640 0.373 1.00 0.00 N ATOM 0 H ASN A 53 7.031 11.448 -1.296 1.00 0.00 H new ATOM 0 HA ASN A 53 6.290 10.909 1.420 1.00 0.00 H new ATOM 0 HB2 ASN A 53 4.617 10.838 -1.151 1.00 0.00 H new ATOM 0 HB3 ASN A 53 4.008 11.097 0.472 1.00 0.00 H new ATOM 0 HD21 ASN A 53 5.440 14.648 0.220 1.00 0.00 H new ATOM 0 HD22 ASN A 53 5.996 13.259 1.160 1.00 0.00 H new ATOM 431 N ASP A 54 4.636 8.549 0.675 1.00 0.00 N ATOM 432 CA ASP A 54 4.153 8.136 2.017 1.00 0.00 C ATOM 433 C ASP A 54 3.669 9.436 2.660 1.00 0.00 C ATOM 434 O ASP A 54 2.547 9.832 2.378 1.00 0.00 O ATOM 435 CB ASP A 54 4.987 7.075 2.801 1.00 0.00 C ATOM 436 CG ASP A 54 5.424 5.730 2.202 1.00 0.00 C ATOM 437 OD1 ASP A 54 5.785 5.797 0.893 1.00 0.00 O ATOM 438 OD2 ASP A 54 5.506 4.716 2.883 1.00 0.00 O ATOM 0 H ASP A 54 3.948 8.440 -0.070 1.00 0.00 H new ATOM 0 HA ASP A 54 3.313 7.442 1.987 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.899 7.578 3.123 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.417 6.840 3.700 1.00 0.00 H new ATOM 439 N ALA A 55 4.339 10.241 3.437 1.00 0.00 N ATOM 440 CA ALA A 55 5.761 10.184 3.723 1.00 0.00 C ATOM 441 C ALA A 55 6.123 9.335 4.992 1.00 0.00 C ATOM 442 O ALA A 55 5.810 8.171 5.235 1.00 0.00 O ATOM 443 CB ALA A 55 5.936 11.771 3.611 1.00 0.00 C ATOM 0 H ALA A 55 3.881 11.011 3.925 1.00 0.00 H new ATOM 0 HA ALA A 55 6.479 9.634 3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.978 12.036 3.792 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.646 12.099 2.613 1.00 0.00 H new ATOM 0 HB3 ALA A 55 5.303 12.260 4.352 1.00 0.00 H new ATOM 444 N GLU A 56 6.462 10.048 5.980 1.00 0.00 N ATOM 445 CA GLU A 56 5.511 10.347 7.074 1.00 0.00 C ATOM 446 C GLU A 56 3.947 10.009 7.056 1.00 0.00 C ATOM 447 O GLU A 56 3.281 10.329 8.024 1.00 0.00 O ATOM 448 CB GLU A 56 5.849 11.876 7.126 1.00 0.00 C ATOM 449 CG GLU A 56 7.217 12.281 7.706 1.00 0.00 C ATOM 450 CD GLU A 56 7.329 12.232 9.225 1.00 0.00 C ATOM 451 OE1 GLU A 56 6.865 13.369 9.816 1.00 0.00 O ATOM 452 OE2 GLU A 56 7.771 11.264 9.835 1.00 0.00 O ATOM 0 H GLU A 56 7.388 10.460 6.098 1.00 0.00 H new ATOM 0 HA GLU A 56 5.652 9.680 7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.783 12.270 6.112 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.075 12.372 7.711 1.00 0.00 H new ATOM 0 HG2 GLU A 56 7.979 11.627 7.282 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.446 13.294 7.375 1.00 0.00 H new ATOM 453 N ARG A 57 3.332 9.374 6.037 1.00 0.00 N ATOM 454 CA ARG A 57 1.858 9.352 5.794 1.00 0.00 C ATOM 455 C ARG A 57 1.230 8.109 5.132 1.00 0.00 C ATOM 456 O ARG A 57 0.081 7.791 5.443 1.00 0.00 O ATOM 457 CB ARG A 57 1.302 10.621 5.137 1.00 0.00 C ATOM 458 CG ARG A 57 1.614 11.986 5.755 1.00 0.00 C ATOM 459 CD ARG A 57 2.932 12.645 5.326 1.00 0.00 C ATOM 460 NE ARG A 57 3.155 14.010 5.861 1.00 0.00 N ATOM 461 CZ ARG A 57 3.877 14.980 5.309 1.00 0.00 C ATOM 462 NH1 ARG A 57 4.448 14.912 4.146 1.00 0.00 N ATOM 463 NH2 ARG A 57 4.021 16.068 5.977 1.00 0.00 N ATOM 0 H ARG A 57 3.853 8.846 5.337 1.00 0.00 H new ATOM 0 HA ARG A 57 1.534 9.298 6.833 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.659 10.639 4.107 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.217 10.520 5.097 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.797 12.666 5.512 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.625 11.876 6.839 1.00 0.00 H new ATOM 0 HD2 ARG A 57 3.758 12.008 5.642 1.00 0.00 H new ATOM 0 HD3 ARG A 57 2.961 12.689 4.237 1.00 0.00 H new ATOM 0 HE ARG A 57 2.705 14.228 6.750 1.00 0.00 H new ATOM 0 HH11 ARG A 57 4.359 14.066 3.583 1.00 0.00 H new ATOM 0 HH12 ARG A 57 4.986 15.704 3.795 1.00 0.00 H new ATOM 0 HH21 ARG A 57 3.589 16.163 6.896 1.00 0.00 H new ATOM 0 HH22 ARG A 57 4.568 16.836 5.588 1.00 0.00 H new ATOM 464 N LEU A 58 1.982 7.301 4.390 1.00 0.00 N ATOM 465 CA LEU A 58 1.964 5.838 4.732 1.00 0.00 C ATOM 466 C LEU A 58 2.585 5.470 6.137 1.00 0.00 C ATOM 467 O LEU A 58 2.016 4.598 6.809 1.00 0.00 O ATOM 468 CB LEU A 58 2.435 4.951 3.551 1.00 0.00 C ATOM 469 CG LEU A 58 1.430 3.886 3.062 1.00 0.00 C ATOM 470 CD1 LEU A 58 0.259 4.533 2.306 1.00 0.00 C ATOM 471 CD2 LEU A 58 2.115 2.867 2.150 1.00 0.00 C ATOM 0 H LEU A 58 2.573 7.578 3.607 1.00 0.00 H new ATOM 0 HA LEU A 58 0.913 5.588 4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.683 5.600 2.711 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.355 4.446 3.846 1.00 0.00 H new ATOM 0 HG LEU A 58 1.044 3.377 3.945 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.432 3.758 1.974 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.262 5.225 2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.640 5.075 1.440 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.386 2.127 1.819 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.533 3.378 1.283 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.915 2.368 2.698 1.00 0.00 H new ATOM 472 N ALA A 59 3.610 6.201 6.677 1.00 0.00 N ATOM 473 CA ALA A 59 3.907 6.172 8.137 1.00 0.00 C ATOM 474 C ALA A 59 2.702 6.366 9.080 1.00 0.00 C ATOM 475 O ALA A 59 2.365 5.480 9.862 1.00 0.00 O ATOM 476 CB ALA A 59 4.952 7.286 8.473 1.00 0.00 C ATOM 0 H ALA A 59 4.228 6.803 6.133 1.00 0.00 H new ATOM 0 HA ALA A 59 4.275 5.162 8.318 1.00 0.00 H new ATOM 0 HB1 ALA A 59 5.172 7.268 9.540 1.00 0.00 H new ATOM 0 HB2 ALA A 59 5.868 7.107 7.910 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.545 8.260 8.203 1.00 0.00 H new ATOM 477 N ASP A 60 2.076 7.535 8.994 1.00 0.00 N ATOM 478 CA ASP A 60 1.099 7.979 9.993 1.00 0.00 C ATOM 479 C ASP A 60 -0.370 7.749 9.582 1.00 0.00 C ATOM 480 O ASP A 60 -1.245 7.882 10.433 1.00 0.00 O ATOM 481 CB ASP A 60 1.416 9.478 10.082 1.00 0.00 C ATOM 482 CG ASP A 60 0.716 10.187 11.235 1.00 0.00 C ATOM 483 OD1 ASP A 60 1.066 10.098 12.406 1.00 0.00 O ATOM 484 OD2 ASP A 60 -0.354 10.910 10.815 1.00 0.00 O ATOM 0 H ASP A 60 2.227 8.201 8.236 1.00 0.00 H new ATOM 0 HA ASP A 60 1.182 7.427 10.929 1.00 0.00 H new ATOM 0 HB2 ASP A 60 2.493 9.606 10.189 1.00 0.00 H new ATOM 0 HB3 ASP A 60 1.129 9.957 9.146 1.00 0.00 H new ATOM 485 N GLU A 61 -0.668 7.319 8.346 1.00 0.00 N ATOM 486 CA GLU A 61 -1.874 6.488 8.165 1.00 0.00 C ATOM 487 C GLU A 61 -1.734 5.099 8.841 1.00 0.00 C ATOM 488 O GLU A 61 -2.621 4.821 9.664 1.00 0.00 O ATOM 489 CB GLU A 61 -2.400 6.529 6.713 1.00 0.00 C ATOM 490 CG GLU A 61 -3.826 5.946 6.489 1.00 0.00 C ATOM 491 CD GLU A 61 -5.038 6.605 7.159 1.00 0.00 C ATOM 492 OE1 GLU A 61 -4.806 7.891 7.553 1.00 0.00 O ATOM 493 OE2 GLU A 61 -6.108 6.027 7.301 1.00 0.00 O ATOM 0 H GLU A 61 -0.130 7.515 7.502 1.00 0.00 H new ATOM 0 HA GLU A 61 -2.700 6.933 8.720 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.395 7.565 6.375 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -1.702 5.983 6.079 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -4.011 5.945 5.415 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -3.805 4.905 6.810 1.00 0.00 H new ATOM 494 N GLN A 62 -0.693 4.231 8.640 1.00 0.00 N ATOM 495 CA GLN A 62 -0.709 2.973 9.378 1.00 0.00 C ATOM 496 C GLN A 62 -0.392 3.182 10.874 1.00 0.00 C ATOM 497 O GLN A 62 -1.286 2.942 11.671 1.00 0.00 O ATOM 498 CB GLN A 62 0.062 1.863 8.653 1.00 0.00 C ATOM 499 CG GLN A 62 -0.237 0.479 9.261 1.00 0.00 C ATOM 500 CD GLN A 62 -1.721 0.060 9.459 1.00 0.00 C ATOM 501 OE1 GLN A 62 -2.335 -0.630 8.665 1.00 0.00 O ATOM 502 NE2 GLN A 62 -2.392 0.487 10.501 1.00 0.00 N ATOM 0 H GLN A 62 0.101 4.380 8.018 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.727 2.585 9.391 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -0.206 1.863 7.596 1.00 0.00 H new ATOM 0 HB3 GLN A 62 1.132 2.064 8.711 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.237 -0.271 8.628 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.253 0.431 10.233 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.931 1.069 11.201 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -3.375 0.237 10.612 1.00 0.00 H new ATOM 503 N SER A 63 0.787 3.655 11.263 1.00 0.00 N ATOM 504 CA SER A 63 1.069 4.056 12.659 1.00 0.00 C ATOM 505 C SER A 63 1.006 5.582 12.977 1.00 0.00 C ATOM 506 O SER A 63 1.867 6.140 13.657 1.00 0.00 O ATOM 507 CB SER A 63 2.356 3.306 13.043 1.00 0.00 C ATOM 508 OG SER A 63 2.682 3.467 14.423 1.00 0.00 O ATOM 0 H SER A 63 1.579 3.775 10.631 1.00 0.00 H new ATOM 0 HA SER A 63 0.253 3.760 13.319 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.237 2.246 12.821 1.00 0.00 H new ATOM 0 HB3 SER A 63 3.182 3.669 12.431 1.00 0.00 H new ATOM 0 HG SER A 63 2.600 4.412 14.670 1.00 0.00 H new ATOM 509 N GLU A 64 -0.136 6.231 12.701 1.00 0.00 N ATOM 510 CA GLU A 64 -1.093 6.549 13.783 1.00 0.00 C ATOM 511 C GLU A 64 -2.105 5.379 14.052 1.00 0.00 C ATOM 512 O GLU A 64 -2.291 5.016 15.215 1.00 0.00 O ATOM 513 CB GLU A 64 -1.796 7.870 13.385 1.00 0.00 C ATOM 514 CG GLU A 64 -2.698 8.529 14.455 1.00 0.00 C ATOM 515 CD GLU A 64 -3.892 9.301 13.884 1.00 0.00 C ATOM 516 OE1 GLU A 64 -3.535 10.186 12.911 1.00 0.00 O ATOM 517 OE2 GLU A 64 -5.050 9.104 14.236 1.00 0.00 O ATOM 0 H GLU A 64 -0.418 6.539 11.770 1.00 0.00 H new ATOM 0 HA GLU A 64 -0.569 6.673 14.731 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.030 8.589 13.097 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -2.403 7.679 12.500 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -3.068 7.755 15.128 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -2.093 9.210 15.054 1.00 0.00 H new ATOM 518 N LEU A 65 -2.787 4.792 13.039 1.00 0.00 N ATOM 519 CA LEU A 65 -4.017 3.962 13.288 1.00 0.00 C ATOM 520 C LEU A 65 -3.807 2.415 13.518 1.00 0.00 C ATOM 521 O LEU A 65 -4.701 1.586 13.352 1.00 0.00 O ATOM 522 CB LEU A 65 -5.059 4.416 12.224 1.00 0.00 C ATOM 523 CG LEU A 65 -5.353 5.952 12.284 1.00 0.00 C ATOM 524 CD1 LEU A 65 -4.718 6.730 11.118 1.00 0.00 C ATOM 525 CD2 LEU A 65 -6.835 6.301 12.392 1.00 0.00 C ATOM 0 H LEU A 65 -2.523 4.868 12.057 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.415 4.156 14.284 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.693 4.159 11.230 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.988 3.866 12.374 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.879 6.269 13.213 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.957 7.789 11.214 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.636 6.599 11.139 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -5.111 6.354 10.173 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -6.952 7.384 12.428 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.366 5.908 11.525 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.247 5.861 13.300 1.00 0.00 H new ATOM 526 N VAL A 66 -2.614 2.094 14.027 1.00 0.00 N ATOM 527 CA VAL A 66 -2.255 0.801 14.703 1.00 0.00 C ATOM 528 C VAL A 66 -2.711 0.738 16.215 1.00 0.00 C ATOM 529 O VAL A 66 -3.209 -0.290 16.670 1.00 0.00 O ATOM 530 CB VAL A 66 -0.727 0.431 14.524 1.00 0.00 C ATOM 531 CG1 VAL A 66 -0.237 0.306 13.069 1.00 0.00 C ATOM 532 CG2 VAL A 66 0.300 1.363 15.204 1.00 0.00 C ATOM 0 H VAL A 66 -1.826 2.740 13.988 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.829 0.032 14.187 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.749 -0.537 15.025 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.822 0.050 13.063 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.802 -0.475 12.561 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.384 1.255 12.553 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.308 1.000 15.005 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.193 2.373 14.808 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.124 1.375 16.280 1.00 0.00 H new TER 533 VAL A 66 ATOM 534 N ALA B 1 -19.230 -15.727 -2.679 1.00 0.00 N ATOM 535 CA ALA B 1 -17.916 -16.188 -2.177 1.00 0.00 C ATOM 536 C ALA B 1 -17.100 -17.048 -3.196 1.00 0.00 C ATOM 537 O ALA B 1 -17.636 -17.945 -3.845 1.00 0.00 O ATOM 538 CB ALA B 1 -18.154 -17.010 -0.905 1.00 0.00 C ATOM 0 H1 ALA B 1 -19.705 -15.165 -1.944 1.00 0.00 H new ATOM 0 H2 ALA B 1 -19.092 -15.141 -3.527 1.00 0.00 H new ATOM 0 H3 ALA B 1 -19.818 -16.550 -2.919 1.00 0.00 H new ATOM 0 HA ALA B 1 -17.317 -15.297 -1.991 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -17.199 -17.362 -0.515 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -18.645 -16.388 -0.156 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -18.788 -17.866 -1.138 1.00 0.00 H new ATOM 539 N ARG B 2 -15.769 -17.013 -3.326 1.00 0.00 N ATOM 540 CA ARG B 2 -14.845 -16.013 -2.698 1.00 0.00 C ATOM 541 C ARG B 2 -14.674 -16.180 -1.147 1.00 0.00 C ATOM 542 O ARG B 2 -14.680 -17.304 -0.644 1.00 0.00 O ATOM 543 CB ARG B 2 -14.998 -14.605 -3.374 1.00 0.00 C ATOM 544 CG ARG B 2 -14.643 -14.568 -4.887 1.00 0.00 C ATOM 545 CD ARG B 2 -14.548 -13.162 -5.506 1.00 0.00 C ATOM 546 NE ARG B 2 -13.306 -12.487 -5.044 1.00 0.00 N ATOM 547 CZ ARG B 2 -12.740 -11.427 -5.601 1.00 0.00 C ATOM 548 NH1 ARG B 2 -13.184 -10.826 -6.664 1.00 0.00 N ATOM 549 NH2 ARG B 2 -11.677 -10.974 -5.040 1.00 0.00 N ATOM 0 H ARG B 2 -15.269 -17.700 -3.890 1.00 0.00 H new ATOM 0 HA ARG B 2 -13.803 -16.226 -2.937 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -16.026 -14.266 -3.248 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -14.361 -13.894 -2.848 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -13.690 -15.076 -5.032 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -15.394 -15.138 -5.434 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -14.550 -13.233 -6.594 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -15.420 -12.571 -5.224 1.00 0.00 H new ATOM 0 HE ARG B 2 -12.847 -12.877 -4.221 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -14.025 -11.167 -7.129 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -12.691 -10.013 -7.034 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -11.308 -11.429 -4.205 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -11.202 -10.159 -5.429 1.00 0.00 H new ATOM 550 N ASP B 3 -14.461 -15.085 -0.409 1.00 0.00 N ATOM 551 CA ASP B 3 -14.111 -15.098 1.040 1.00 0.00 C ATOM 552 C ASP B 3 -12.610 -15.471 1.315 1.00 0.00 C ATOM 553 O ASP B 3 -12.216 -16.636 1.301 1.00 0.00 O ATOM 554 CB ASP B 3 -15.138 -15.823 1.958 1.00 0.00 C ATOM 555 CG ASP B 3 -14.935 -15.507 3.439 1.00 0.00 C ATOM 556 OD1 ASP B 3 -15.036 -14.378 3.909 1.00 0.00 O ATOM 557 OD2 ASP B 3 -14.555 -16.597 4.155 1.00 0.00 O ATOM 0 H ASP B 3 -14.525 -14.143 -0.796 1.00 0.00 H new ATOM 0 HA ASP B 3 -14.202 -14.057 1.351 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -16.147 -15.535 1.665 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -15.057 -16.899 1.807 1.00 0.00 H new ATOM 558 N ASP B 4 -11.802 -14.444 1.616 1.00 0.00 N ATOM 559 CA ASP B 4 -10.417 -14.583 2.152 1.00 0.00 C ATOM 560 C ASP B 4 -9.373 -15.524 1.438 1.00 0.00 C ATOM 561 O ASP B 4 -9.111 -16.610 1.962 1.00 0.00 O ATOM 562 CB ASP B 4 -10.442 -14.633 3.704 1.00 0.00 C ATOM 563 CG ASP B 4 -11.115 -15.811 4.414 1.00 0.00 C ATOM 564 OD1 ASP B 4 -10.589 -17.020 4.072 1.00 0.00 O ATOM 565 OD2 ASP B 4 -12.019 -15.656 5.233 1.00 0.00 O ATOM 0 H ASP B 4 -12.086 -13.472 1.496 1.00 0.00 H new ATOM 0 HA ASP B 4 -9.931 -13.662 1.830 1.00 0.00 H new ATOM 0 HB2 ASP B 4 -9.408 -14.593 4.048 1.00 0.00 H new ATOM 0 HB3 ASP B 4 -10.929 -13.722 4.051 1.00 0.00 H new ATOM 566 N PRO B 5 -8.744 -15.155 0.281 1.00 0.00 N ATOM 567 CA PRO B 5 -8.010 -16.127 -0.574 1.00 0.00 C ATOM 568 C PRO B 5 -6.461 -15.975 -0.520 1.00 0.00 C ATOM 569 O PRO B 5 -5.928 -14.868 -0.369 1.00 0.00 O ATOM 570 CB PRO B 5 -8.599 -15.815 -1.976 1.00 0.00 C ATOM 571 CG PRO B 5 -9.634 -14.707 -1.749 1.00 0.00 C ATOM 572 CD PRO B 5 -9.115 -13.979 -0.529 1.00 0.00 C ATOM 0 HA PRO B 5 -8.142 -17.161 -0.255 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -7.820 -15.489 -2.665 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -9.061 -16.700 -2.413 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -9.707 -14.044 -2.611 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -10.629 -15.117 -1.578 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -8.266 -13.332 -0.751 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -9.873 -13.358 -0.052 1.00 0.00 H new ATOM 573 N HIS B 6 -5.775 -17.111 -0.701 1.00 0.00 N ATOM 574 CA HIS B 6 -4.294 -17.176 -0.802 1.00 0.00 C ATOM 575 C HIS B 6 -3.787 -16.921 -2.275 1.00 0.00 C ATOM 576 O HIS B 6 -4.259 -17.566 -3.219 1.00 0.00 O ATOM 577 CB HIS B 6 -3.824 -18.609 -0.404 1.00 0.00 C ATOM 578 CG HIS B 6 -4.040 -19.059 1.037 1.00 0.00 C ATOM 579 ND1 HIS B 6 -5.171 -19.737 1.459 1.00 0.00 N ATOM 580 CD2 HIS B 6 -3.147 -18.866 2.101 1.00 0.00 C ATOM 581 CE1 HIS B 6 -4.868 -19.865 2.790 1.00 0.00 C ATOM 582 NE2 HIS B 6 -3.664 -19.412 3.263 1.00 0.00 N ATOM 0 H HIS B 6 -6.226 -18.022 -0.783 1.00 0.00 H new ATOM 0 HA HIS B 6 -3.890 -16.406 -0.144 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -4.332 -19.320 -1.056 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -2.758 -18.683 -0.621 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -2.194 -18.364 2.025 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -5.577 -20.322 3.465 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -3.265 -19.463 4.200 1.00 0.00 H new ATOM 583 N PHE B 7 -2.743 -16.101 -2.480 1.00 0.00 N ATOM 584 CA PHE B 7 -1.813 -16.255 -3.636 1.00 0.00 C ATOM 585 C PHE B 7 -0.307 -16.099 -3.216 1.00 0.00 C ATOM 586 O PHE B 7 0.044 -15.499 -2.194 1.00 0.00 O ATOM 587 CB PHE B 7 -2.267 -15.358 -4.829 1.00 0.00 C ATOM 588 CG PHE B 7 -1.781 -13.899 -4.872 1.00 0.00 C ATOM 589 CD1 PHE B 7 -0.529 -13.601 -5.432 1.00 0.00 C ATOM 590 CD2 PHE B 7 -2.564 -12.850 -4.374 1.00 0.00 C ATOM 591 CE1 PHE B 7 -0.081 -12.294 -5.481 1.00 0.00 C ATOM 592 CE2 PHE B 7 -2.135 -11.537 -4.508 1.00 0.00 C ATOM 593 CZ PHE B 7 -0.917 -11.266 -5.110 1.00 0.00 C ATOM 0 H PHE B 7 -2.513 -15.320 -1.865 1.00 0.00 H new ATOM 0 HA PHE B 7 -1.871 -17.280 -4.002 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -1.945 -15.843 -5.751 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -3.357 -15.346 -4.839 1.00 0.00 H new ATOM 0 HD1 PHE B 7 0.087 -14.396 -5.826 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -3.503 -13.063 -3.885 1.00 0.00 H new ATOM 0 HE1 PHE B 7 0.925 -12.080 -5.810 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -2.750 -10.727 -4.143 1.00 0.00 H new ATOM 0 HZ PHE B 7 -0.622 -10.243 -5.289 1.00 0.00 H new ATOM 594 N ASN B 8 0.607 -16.583 -4.069 1.00 0.00 N ATOM 595 CA ASN B 8 2.070 -16.360 -3.909 1.00 0.00 C ATOM 596 C ASN B 8 2.551 -14.862 -3.973 1.00 0.00 C ATOM 597 O ASN B 8 2.725 -14.283 -5.049 1.00 0.00 O ATOM 598 CB ASN B 8 2.811 -17.279 -4.924 1.00 0.00 C ATOM 599 CG ASN B 8 2.535 -17.093 -6.424 1.00 0.00 C ATOM 600 OD1 ASN B 8 1.519 -17.534 -6.946 1.00 0.00 O ATOM 601 ND2 ASN B 8 3.407 -16.456 -7.163 1.00 0.00 N ATOM 0 H ASN B 8 0.365 -17.139 -4.889 1.00 0.00 H new ATOM 0 HA ASN B 8 2.328 -16.630 -2.885 1.00 0.00 H new ATOM 0 HB2 ASN B 8 3.882 -17.150 -4.766 1.00 0.00 H new ATOM 0 HB3 ASN B 8 2.573 -18.312 -4.670 1.00 0.00 H new ATOM 0 HD21 ASN B 8 3.236 -16.332 -8.161 1.00 0.00 H new ATOM 0 HD22 ASN B 8 4.258 -16.083 -6.741 1.00 0.00 H new ATOM 602 N PHE B 9 2.847 -14.260 -2.816 1.00 0.00 N ATOM 603 CA PHE B 9 3.691 -13.066 -2.714 1.00 0.00 C ATOM 604 C PHE B 9 4.806 -13.368 -1.698 1.00 0.00 C ATOM 605 O PHE B 9 4.609 -13.271 -0.488 1.00 0.00 O ATOM 606 CB PHE B 9 2.745 -11.895 -2.361 1.00 0.00 C ATOM 607 CG PHE B 9 3.270 -10.575 -2.888 1.00 0.00 C ATOM 608 CD1 PHE B 9 3.262 -10.338 -4.269 1.00 0.00 C ATOM 609 CD2 PHE B 9 3.467 -9.502 -2.018 1.00 0.00 C ATOM 610 CE1 PHE B 9 3.442 -9.059 -4.750 1.00 0.00 C ATOM 611 CE2 PHE B 9 3.722 -8.238 -2.503 1.00 0.00 C ATOM 612 CZ PHE B 9 3.618 -8.013 -3.854 1.00 0.00 C ATOM 0 H PHE B 9 2.503 -14.592 -1.915 1.00 0.00 H new ATOM 0 HA PHE B 9 4.209 -12.782 -3.630 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.756 -12.087 -2.778 1.00 0.00 H new ATOM 0 HB3 PHE B 9 2.628 -11.835 -1.279 1.00 0.00 H new ATOM 0 HD1 PHE B 9 3.115 -11.158 -4.957 1.00 0.00 H new ATOM 0 HD2 PHE B 9 3.419 -9.664 -0.951 1.00 0.00 H new ATOM 0 HE1 PHE B 9 3.446 -8.872 -5.814 1.00 0.00 H new ATOM 0 HE2 PHE B 9 3.999 -7.438 -1.833 1.00 0.00 H new ATOM 0 HZ PHE B 9 3.674 -7.001 -4.227 1.00 0.00 H new ATOM 613 N ARG B 10 6.069 -13.602 -2.025 1.00 0.00 N ATOM 614 CA ARG B 10 6.664 -13.859 -3.367 1.00 0.00 C ATOM 615 C ARG B 10 7.155 -12.515 -3.979 1.00 0.00 C ATOM 616 O ARG B 10 6.408 -11.788 -4.639 1.00 0.00 O ATOM 617 CB ARG B 10 5.998 -14.847 -4.354 1.00 0.00 C ATOM 618 CG ARG B 10 7.008 -15.702 -5.168 1.00 0.00 C ATOM 619 CD ARG B 10 8.064 -14.982 -6.021 1.00 0.00 C ATOM 620 NE ARG B 10 7.445 -14.186 -7.114 1.00 0.00 N ATOM 621 CZ ARG B 10 8.088 -13.316 -7.885 1.00 0.00 C ATOM 622 NH1 ARG B 10 9.358 -13.060 -7.798 1.00 0.00 N ATOM 623 NH2 ARG B 10 7.416 -12.694 -8.787 1.00 0.00 N ATOM 0 H ARG B 10 6.787 -13.623 -1.301 1.00 0.00 H new ATOM 0 HA ARG B 10 7.509 -14.513 -3.152 1.00 0.00 H new ATOM 0 HB2 ARG B 10 5.340 -15.513 -3.797 1.00 0.00 H new ATOM 0 HB3 ARG B 10 5.371 -14.286 -5.047 1.00 0.00 H new ATOM 0 HG2 ARG B 10 7.535 -16.349 -4.466 1.00 0.00 H new ATOM 0 HG3 ARG B 10 6.434 -16.350 -5.830 1.00 0.00 H new ATOM 0 HD2 ARG B 10 8.658 -14.325 -5.385 1.00 0.00 H new ATOM 0 HD3 ARG B 10 8.747 -15.716 -6.448 1.00 0.00 H new ATOM 0 HE ARG B 10 6.448 -14.318 -7.285 1.00 0.00 H new ATOM 0 HH11 ARG B 10 9.929 -13.541 -7.103 1.00 0.00 H new ATOM 0 HH12 ARG B 10 9.785 -12.378 -8.425 1.00 0.00 H new ATOM 0 HH21 ARG B 10 6.418 -12.875 -8.895 1.00 0.00 H new ATOM 0 HH22 ARG B 10 7.881 -12.020 -9.395 1.00 0.00 H new ATOM 624 N MET B 11 8.402 -12.165 -3.644 1.00 0.00 N ATOM 625 CA MET B 11 8.894 -10.771 -3.756 1.00 0.00 C ATOM 626 C MET B 11 10.427 -10.758 -4.074 1.00 0.00 C ATOM 627 O MET B 11 11.175 -11.313 -3.260 1.00 0.00 O ATOM 628 CB MET B 11 8.643 -10.084 -2.383 1.00 0.00 C ATOM 629 CG MET B 11 7.291 -9.401 -2.156 1.00 0.00 C ATOM 630 SD MET B 11 7.164 -9.067 -0.398 1.00 0.00 S ATOM 631 CE MET B 11 5.770 -10.102 0.055 1.00 0.00 C ATOM 0 H MET B 11 9.097 -12.824 -3.291 1.00 0.00 H new ATOM 0 HA MET B 11 8.376 -10.249 -4.560 1.00 0.00 H new ATOM 0 HB2 MET B 11 8.772 -10.836 -1.605 1.00 0.00 H new ATOM 0 HB3 MET B 11 9.423 -9.337 -2.236 1.00 0.00 H new ATOM 0 HG2 MET B 11 7.224 -8.477 -2.730 1.00 0.00 H new ATOM 0 HG3 MET B 11 6.474 -10.042 -2.487 1.00 0.00 H new ATOM 0 HE1 MET B 11 4.961 -9.477 0.433 1.00 0.00 H new ATOM 0 HE2 MET B 11 5.425 -10.652 -0.821 1.00 0.00 H new ATOM 0 HE3 MET B 11 6.076 -10.806 0.828 1.00 0.00 H new ATOM 632 N PRO B 12 10.975 -10.082 -5.133 1.00 0.00 N ATOM 633 CA PRO B 12 12.426 -9.741 -5.224 1.00 0.00 C ATOM 634 C PRO B 12 13.094 -9.216 -3.918 1.00 0.00 C ATOM 635 O PRO B 12 12.463 -8.491 -3.138 1.00 0.00 O ATOM 636 CB PRO B 12 12.454 -8.715 -6.374 1.00 0.00 C ATOM 637 CG PRO B 12 11.241 -9.062 -7.238 1.00 0.00 C ATOM 638 CD PRO B 12 10.184 -9.512 -6.233 1.00 0.00 C ATOM 0 HA PRO B 12 13.030 -10.631 -5.400 1.00 0.00 H new ATOM 0 HB2 PRO B 12 12.391 -7.695 -5.995 1.00 0.00 H new ATOM 0 HB3 PRO B 12 13.380 -8.786 -6.945 1.00 0.00 H new ATOM 0 HG2 PRO B 12 10.902 -8.201 -7.814 1.00 0.00 H new ATOM 0 HG3 PRO B 12 11.473 -9.852 -7.952 1.00 0.00 H new ATOM 0 HD2 PRO B 12 9.571 -8.677 -5.895 1.00 0.00 H new ATOM 0 HD3 PRO B 12 9.508 -10.250 -6.665 1.00 0.00 H new ATOM 639 N MET B 13 14.339 -9.635 -3.645 1.00 0.00 N ATOM 640 CA MET B 13 14.930 -9.489 -2.280 1.00 0.00 C ATOM 641 C MET B 13 14.962 -8.068 -1.612 1.00 0.00 C ATOM 642 O MET B 13 14.834 -7.985 -0.392 1.00 0.00 O ATOM 643 CB MET B 13 16.288 -10.226 -2.301 1.00 0.00 C ATOM 644 CG MET B 13 17.141 -10.243 -1.014 1.00 0.00 C ATOM 645 SD MET B 13 16.242 -10.675 0.499 1.00 0.00 S ATOM 646 CE MET B 13 15.360 -12.191 0.100 1.00 0.00 C ATOM 0 H MET B 13 14.957 -10.072 -4.329 1.00 0.00 H new ATOM 0 HA MET B 13 14.229 -9.948 -1.583 1.00 0.00 H new ATOM 0 HB2 MET B 13 16.098 -11.261 -2.586 1.00 0.00 H new ATOM 0 HB3 MET B 13 16.892 -9.783 -3.093 1.00 0.00 H new ATOM 0 HG2 MET B 13 17.958 -10.952 -1.148 1.00 0.00 H new ATOM 0 HG3 MET B 13 17.591 -9.259 -0.882 1.00 0.00 H new ATOM 0 HE1 MET B 13 15.368 -12.855 0.965 1.00 0.00 H new ATOM 0 HE2 MET B 13 14.330 -11.953 -0.166 1.00 0.00 H new ATOM 0 HE3 MET B 13 15.847 -12.685 -0.741 1.00 0.00 H new ATOM 647 N GLU B 14 15.037 -6.963 -2.371 1.00 0.00 N ATOM 648 CA GLU B 14 14.722 -5.607 -1.833 1.00 0.00 C ATOM 649 C GLU B 14 13.262 -5.368 -1.316 1.00 0.00 C ATOM 650 O GLU B 14 13.125 -4.888 -0.197 1.00 0.00 O ATOM 651 CB GLU B 14 15.232 -4.509 -2.810 1.00 0.00 C ATOM 652 CG GLU B 14 14.445 -4.332 -4.138 1.00 0.00 C ATOM 653 CD GLU B 14 15.020 -3.275 -5.073 1.00 0.00 C ATOM 654 OE1 GLU B 14 14.628 -2.014 -4.730 1.00 0.00 O ATOM 655 OE2 GLU B 14 15.742 -3.543 -6.026 1.00 0.00 O ATOM 0 H GLU B 14 15.310 -6.969 -3.354 1.00 0.00 H new ATOM 0 HA GLU B 14 15.279 -5.536 -0.899 1.00 0.00 H new ATOM 0 HB2 GLU B 14 15.226 -3.555 -2.282 1.00 0.00 H new ATOM 0 HB3 GLU B 14 16.270 -4.730 -3.057 1.00 0.00 H new ATOM 0 HG2 GLU B 14 14.419 -5.288 -4.661 1.00 0.00 H new ATOM 0 HG3 GLU B 14 13.413 -4.070 -3.903 1.00 0.00 H new ATOM 656 N VAL B 15 12.193 -5.728 -2.054 1.00 0.00 N ATOM 657 CA VAL B 15 10.775 -5.689 -1.561 1.00 0.00 C ATOM 658 C VAL B 15 10.547 -6.564 -0.317 1.00 0.00 C ATOM 659 O VAL B 15 9.971 -6.073 0.646 1.00 0.00 O ATOM 660 CB VAL B 15 9.733 -6.123 -2.659 1.00 0.00 C ATOM 661 CG1 VAL B 15 8.432 -5.314 -2.537 1.00 0.00 C ATOM 662 CG2 VAL B 15 10.181 -6.108 -4.140 1.00 0.00 C ATOM 0 H VAL B 15 12.275 -6.058 -3.016 1.00 0.00 H new ATOM 0 HA VAL B 15 10.614 -4.643 -1.301 1.00 0.00 H new ATOM 0 HB VAL B 15 9.597 -7.179 -2.424 1.00 0.00 H new ATOM 0 HG11 VAL B 15 7.731 -5.634 -3.307 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.992 -5.479 -1.554 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.650 -4.253 -2.663 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.355 -6.431 -4.773 1.00 0.00 H new ATOM 0 HG22 VAL B 15 10.479 -5.098 -4.420 1.00 0.00 H new ATOM 0 HG23 VAL B 15 11.025 -6.785 -4.272 1.00 0.00 H new ATOM 663 N ARG B 16 10.958 -7.837 -0.322 1.00 0.00 N ATOM 664 CA ARG B 16 10.831 -8.660 0.889 1.00 0.00 C ATOM 665 C ARG B 16 11.821 -8.363 2.037 1.00 0.00 C ATOM 666 O ARG B 16 11.402 -8.548 3.167 1.00 0.00 O ATOM 667 CB ARG B 16 10.762 -10.161 0.560 1.00 0.00 C ATOM 668 CG ARG B 16 9.644 -10.823 1.404 1.00 0.00 C ATOM 669 CD ARG B 16 10.063 -12.197 1.863 1.00 0.00 C ATOM 670 NE ARG B 16 9.005 -12.801 2.706 1.00 0.00 N ATOM 671 CZ ARG B 16 9.067 -14.030 3.212 1.00 0.00 C ATOM 672 NH1 ARG B 16 9.996 -14.894 2.929 1.00 0.00 N ATOM 673 NH2 ARG B 16 8.156 -14.388 4.041 1.00 0.00 N ATOM 0 H ARG B 16 11.370 -8.311 -1.126 1.00 0.00 H new ATOM 0 HA ARG B 16 9.873 -8.346 1.303 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.563 -10.303 -0.502 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.721 -10.635 0.771 1.00 0.00 H new ATOM 0 HG2 ARG B 16 9.417 -10.199 2.269 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.730 -10.895 0.814 1.00 0.00 H new ATOM 0 HD2 ARG B 16 10.257 -12.833 0.999 1.00 0.00 H new ATOM 0 HD3 ARG B 16 10.994 -12.132 2.426 1.00 0.00 H new ATOM 0 HE ARG B 16 8.178 -12.240 2.911 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.742 -14.646 2.279 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.979 -15.820 3.356 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.413 -13.737 4.294 1.00 0.00 H new ATOM 0 HH22 ARG B 16 8.175 -15.324 4.447 1.00 0.00 H new ATOM 674 N GLU B 17 13.035 -7.820 1.857 1.00 0.00 N ATOM 675 CA GLU B 17 13.694 -7.106 2.987 1.00 0.00 C ATOM 676 C GLU B 17 12.919 -5.832 3.435 1.00 0.00 C ATOM 677 O GLU B 17 12.687 -5.697 4.628 1.00 0.00 O ATOM 678 CB GLU B 17 15.162 -6.749 2.681 1.00 0.00 C ATOM 679 CG GLU B 17 16.151 -7.935 2.710 1.00 0.00 C ATOM 680 CD GLU B 17 17.601 -7.527 2.483 1.00 0.00 C ATOM 681 OE1 GLU B 17 17.919 -7.436 1.165 1.00 0.00 O ATOM 682 OE2 GLU B 17 18.395 -7.300 3.389 1.00 0.00 O ATOM 0 H GLU B 17 13.568 -7.851 0.988 1.00 0.00 H new ATOM 0 HA GLU B 17 13.679 -7.813 3.816 1.00 0.00 H new ATOM 0 HB2 GLU B 17 15.208 -6.284 1.696 1.00 0.00 H new ATOM 0 HB3 GLU B 17 15.495 -6.002 3.402 1.00 0.00 H new ATOM 0 HG2 GLU B 17 16.071 -8.440 3.673 1.00 0.00 H new ATOM 0 HG3 GLU B 17 15.862 -8.657 1.946 1.00 0.00 H new ATOM 683 N LYS B 18 12.485 -4.916 2.554 1.00 0.00 N ATOM 684 CA LYS B 18 11.725 -3.711 2.983 1.00 0.00 C ATOM 685 C LYS B 18 10.295 -3.934 3.570 1.00 0.00 C ATOM 686 O LYS B 18 9.971 -3.348 4.602 1.00 0.00 O ATOM 687 CB LYS B 18 12.096 -2.502 2.091 1.00 0.00 C ATOM 688 CG LYS B 18 11.481 -2.432 0.674 1.00 0.00 C ATOM 689 CD LYS B 18 12.379 -1.728 -0.362 1.00 0.00 C ATOM 690 CE LYS B 18 11.744 -1.724 -1.761 1.00 0.00 C ATOM 691 NZ LYS B 18 12.655 -1.066 -2.716 1.00 0.00 N ATOM 0 H LYS B 18 12.641 -4.977 1.548 1.00 0.00 H new ATOM 0 HA LYS B 18 12.056 -3.367 3.963 1.00 0.00 H new ATOM 0 HB2 LYS B 18 11.813 -1.594 2.624 1.00 0.00 H new ATOM 0 HB3 LYS B 18 13.181 -2.484 1.986 1.00 0.00 H new ATOM 0 HG2 LYS B 18 11.270 -3.444 0.330 1.00 0.00 H new ATOM 0 HG3 LYS B 18 10.526 -1.909 0.728 1.00 0.00 H new ATOM 0 HD2 LYS B 18 12.564 -0.702 -0.044 1.00 0.00 H new ATOM 0 HD3 LYS B 18 13.346 -2.228 -0.404 1.00 0.00 H new ATOM 0 HE2 LYS B 18 11.541 -2.746 -2.082 1.00 0.00 H new ATOM 0 HE3 LYS B 18 10.788 -1.201 -1.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 12.106 -0.460 -3.358 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.343 -0.485 -2.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 13.159 -1.788 -3.269 1.00 0.00 H new ATOM 692 N LEU B 19 9.488 -4.841 3.014 1.00 0.00 N ATOM 693 CA LEU B 19 8.219 -5.323 3.617 1.00 0.00 C ATOM 694 C LEU B 19 8.387 -6.214 4.892 1.00 0.00 C ATOM 695 O LEU B 19 7.580 -6.100 5.818 1.00 0.00 O ATOM 696 CB LEU B 19 7.452 -5.922 2.407 1.00 0.00 C ATOM 697 CG LEU B 19 5.916 -6.013 2.443 1.00 0.00 C ATOM 698 CD1 LEU B 19 5.152 -4.707 2.661 1.00 0.00 C ATOM 699 CD2 LEU B 19 5.520 -6.602 1.080 1.00 0.00 C ATOM 0 H LEU B 19 9.692 -5.276 2.114 1.00 0.00 H new ATOM 0 HA LEU B 19 7.632 -4.531 4.082 1.00 0.00 H new ATOM 0 HB2 LEU B 19 7.722 -5.336 1.529 1.00 0.00 H new ATOM 0 HB3 LEU B 19 7.834 -6.930 2.247 1.00 0.00 H new ATOM 0 HG LEU B 19 5.644 -6.613 3.312 1.00 0.00 H new ATOM 0 HD11 LEU B 19 4.081 -4.909 2.666 1.00 0.00 H new ATOM 0 HD12 LEU B 19 5.443 -4.270 3.616 1.00 0.00 H new ATOM 0 HD13 LEU B 19 5.386 -4.010 1.857 1.00 0.00 H new ATOM 0 HD21 LEU B 19 4.436 -6.699 1.027 1.00 0.00 H new ATOM 0 HD22 LEU B 19 5.865 -5.942 0.284 1.00 0.00 H new ATOM 0 HD23 LEU B 19 5.978 -7.584 0.961 1.00 0.00 H new ATOM 700 N LYS B 20 9.430 -7.067 4.972 1.00 0.00 N ATOM 701 CA LYS B 20 9.701 -7.933 6.131 1.00 0.00 C ATOM 702 C LYS B 20 10.547 -7.262 7.267 1.00 0.00 C ATOM 703 O LYS B 20 10.334 -7.606 8.422 1.00 0.00 O ATOM 704 CB LYS B 20 10.343 -9.248 5.664 1.00 0.00 C ATOM 705 CG LYS B 20 10.231 -10.448 6.618 1.00 0.00 C ATOM 706 CD LYS B 20 10.871 -11.756 6.096 1.00 0.00 C ATOM 707 CE LYS B 20 12.130 -11.604 5.224 1.00 0.00 C ATOM 708 NZ LYS B 20 12.661 -12.934 4.871 1.00 0.00 N ATOM 0 H LYS B 20 10.114 -7.172 4.223 1.00 0.00 H new ATOM 0 HA LYS B 20 8.733 -8.134 6.590 1.00 0.00 H new ATOM 0 HB2 LYS B 20 9.892 -9.527 4.712 1.00 0.00 H new ATOM 0 HB3 LYS B 20 11.400 -9.062 5.474 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.699 -10.185 7.566 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.177 -10.633 6.824 1.00 0.00 H new ATOM 0 HD2 LYS B 20 11.124 -12.378 6.954 1.00 0.00 H new ATOM 0 HD3 LYS B 20 10.120 -12.297 5.520 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.890 -11.047 4.318 1.00 0.00 H new ATOM 0 HE3 LYS B 20 12.887 -11.031 5.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 13.511 -12.823 4.282 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.906 -13.452 5.739 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.941 -13.466 4.342 1.00 0.00 H new ATOM 709 N PHE B 21 11.471 -6.310 6.995 1.00 0.00 N ATOM 710 CA PHE B 21 11.907 -5.285 7.987 1.00 0.00 C ATOM 711 C PHE B 21 10.737 -4.430 8.458 1.00 0.00 C ATOM 712 O PHE B 21 10.366 -4.674 9.585 1.00 0.00 O ATOM 713 CB PHE B 21 13.084 -4.383 7.531 1.00 0.00 C ATOM 714 CG PHE B 21 14.437 -5.032 7.760 1.00 0.00 C ATOM 715 CD1 PHE B 21 14.901 -5.279 9.056 1.00 0.00 C ATOM 716 CD2 PHE B 21 15.187 -5.445 6.665 1.00 0.00 C ATOM 717 CE1 PHE B 21 16.090 -5.969 9.243 1.00 0.00 C ATOM 718 CE2 PHE B 21 16.375 -6.134 6.849 1.00 0.00 C ATOM 719 CZ PHE B 21 16.834 -6.400 8.141 1.00 0.00 C ATOM 0 H PHE B 21 11.935 -6.227 6.090 1.00 0.00 H new ATOM 0 HA PHE B 21 12.294 -5.870 8.821 1.00 0.00 H new ATOM 0 HB2 PHE B 21 12.971 -4.151 6.472 1.00 0.00 H new ATOM 0 HB3 PHE B 21 13.043 -3.437 8.071 1.00 0.00 H new ATOM 0 HD1 PHE B 21 14.335 -4.934 9.909 1.00 0.00 H new ATOM 0 HD2 PHE B 21 14.842 -5.228 5.665 1.00 0.00 H new ATOM 0 HE1 PHE B 21 16.442 -6.174 10.243 1.00 0.00 H new ATOM 0 HE2 PHE B 21 16.946 -6.465 5.994 1.00 0.00 H new ATOM 0 HZ PHE B 21 17.760 -6.936 8.288 1.00 0.00 H new ATOM 720 N ARG B 22 10.070 -3.546 7.711 1.00 0.00 N ATOM 721 CA ARG B 22 8.729 -3.012 8.106 1.00 0.00 C ATOM 722 C ARG B 22 7.835 -3.931 9.059 1.00 0.00 C ATOM 723 O ARG B 22 7.509 -3.525 10.175 1.00 0.00 O ATOM 724 CB ARG B 22 8.108 -2.455 6.809 1.00 0.00 C ATOM 725 CG ARG B 22 7.046 -1.395 7.155 1.00 0.00 C ATOM 726 CD ARG B 22 6.087 -1.042 6.032 1.00 0.00 C ATOM 727 NE ARG B 22 6.554 0.086 5.190 1.00 0.00 N ATOM 728 CZ ARG B 22 6.470 1.381 5.491 1.00 0.00 C ATOM 729 NH1 ARG B 22 6.018 1.852 6.614 1.00 0.00 N ATOM 730 NH2 ARG B 22 6.864 2.217 4.606 1.00 0.00 N ATOM 0 H ARG B 22 10.421 -3.175 6.828 1.00 0.00 H new ATOM 0 HA ARG B 22 8.823 -2.201 8.828 1.00 0.00 H new ATOM 0 HB2 ARG B 22 8.884 -2.015 6.183 1.00 0.00 H new ATOM 0 HB3 ARG B 22 7.655 -3.263 6.235 1.00 0.00 H new ATOM 0 HG2 ARG B 22 6.466 -1.751 8.007 1.00 0.00 H new ATOM 0 HG3 ARG B 22 7.555 -0.486 7.474 1.00 0.00 H new ATOM 0 HD2 ARG B 22 5.939 -1.919 5.402 1.00 0.00 H new ATOM 0 HD3 ARG B 22 5.117 -0.789 6.459 1.00 0.00 H new ATOM 0 HE ARG B 22 6.980 -0.153 4.295 1.00 0.00 H new ATOM 0 HH11 ARG B 22 5.695 1.214 7.342 1.00 0.00 H new ATOM 0 HH12 ARG B 22 5.986 2.860 6.768 1.00 0.00 H new ATOM 0 HH21 ARG B 22 7.224 1.882 3.713 1.00 0.00 H new ATOM 0 HH22 ARG B 22 6.818 3.218 4.794 1.00 0.00 H new ATOM 731 N ALA B 23 7.684 -5.235 8.752 1.00 0.00 N ATOM 732 CA ALA B 23 7.248 -6.258 9.739 1.00 0.00 C ATOM 733 C ALA B 23 8.126 -6.540 11.023 1.00 0.00 C ATOM 734 O ALA B 23 7.641 -6.359 12.138 1.00 0.00 O ATOM 735 CB ALA B 23 6.948 -7.521 8.900 1.00 0.00 C ATOM 0 H ALA B 23 7.858 -5.613 7.821 1.00 0.00 H new ATOM 0 HA ALA B 23 6.382 -5.851 10.261 1.00 0.00 H new ATOM 0 HB1 ALA B 23 6.619 -8.325 9.558 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.163 -7.300 8.177 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.850 -7.830 8.372 1.00 0.00 H new ATOM 736 N GLU B 24 9.379 -6.996 10.900 1.00 0.00 N ATOM 737 CA GLU B 24 10.344 -7.201 12.032 1.00 0.00 C ATOM 738 C GLU B 24 10.867 -5.905 12.762 1.00 0.00 C ATOM 739 O GLU B 24 10.806 -5.806 13.988 1.00 0.00 O ATOM 740 CB GLU B 24 11.532 -8.063 11.505 1.00 0.00 C ATOM 741 CG GLU B 24 11.198 -9.506 11.037 1.00 0.00 C ATOM 742 CD GLU B 24 12.377 -10.247 10.414 1.00 0.00 C ATOM 743 OE1 GLU B 24 12.739 -9.729 9.209 1.00 0.00 O ATOM 744 OE2 GLU B 24 12.933 -11.209 10.932 1.00 0.00 O ATOM 0 H GLU B 24 9.778 -7.244 9.995 1.00 0.00 H new ATOM 0 HA GLU B 24 9.782 -7.707 12.817 1.00 0.00 H new ATOM 0 HB2 GLU B 24 11.992 -7.533 10.671 1.00 0.00 H new ATOM 0 HB3 GLU B 24 12.281 -8.127 12.294 1.00 0.00 H new ATOM 0 HG2 GLU B 24 10.833 -10.078 11.890 1.00 0.00 H new ATOM 0 HG3 GLU B 24 10.386 -9.462 10.312 1.00 0.00 H new ATOM 745 N ALA B 25 11.371 -4.929 11.992 1.00 0.00 N ATOM 746 CA ALA B 25 11.589 -3.515 12.392 1.00 0.00 C ATOM 747 C ALA B 25 10.465 -2.822 13.271 1.00 0.00 C ATOM 748 O ALA B 25 10.797 -2.171 14.263 1.00 0.00 O ATOM 749 CB ALA B 25 11.818 -2.725 11.078 1.00 0.00 C ATOM 0 H ALA B 25 11.653 -5.104 11.028 1.00 0.00 H new ATOM 0 HA ALA B 25 12.442 -3.509 13.070 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.985 -1.673 11.310 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.690 -3.125 10.560 1.00 0.00 H new ATOM 0 HB3 ALA B 25 10.941 -2.821 10.438 1.00 0.00 H new ATOM 750 N ASN B 26 9.156 -2.949 12.921 1.00 0.00 N ATOM 751 CA ASN B 26 8.027 -2.495 13.804 1.00 0.00 C ATOM 752 C ASN B 26 7.513 -3.509 14.891 1.00 0.00 C ATOM 753 O ASN B 26 7.120 -3.089 15.984 1.00 0.00 O ATOM 754 CB ASN B 26 6.802 -2.092 12.939 1.00 0.00 C ATOM 755 CG ASN B 26 6.923 -0.844 12.073 1.00 0.00 C ATOM 756 OD1 ASN B 26 7.249 0.246 12.530 1.00 0.00 O ATOM 757 ND2 ASN B 26 6.572 -0.960 10.818 1.00 0.00 N ATOM 0 H ASN B 26 8.849 -3.359 12.039 1.00 0.00 H new ATOM 0 HA ASN B 26 8.469 -1.663 14.353 1.00 0.00 H new ATOM 0 HB2 ASN B 26 6.563 -2.931 12.286 1.00 0.00 H new ATOM 0 HB3 ASN B 26 5.951 -1.955 13.606 1.00 0.00 H new ATOM 0 HD21 ASN B 26 6.568 -0.140 10.212 1.00 0.00 H new ATOM 0 HD22 ASN B 26 6.302 -1.871 10.446 1.00 0.00 H new ATOM 758 N GLY B 27 7.373 -4.797 14.542 1.00 0.00 N ATOM 759 CA GLY B 27 6.517 -5.770 15.283 1.00 0.00 C ATOM 760 C GLY B 27 5.115 -6.050 14.676 1.00 0.00 C ATOM 761 O GLY B 27 4.106 -5.891 15.364 1.00 0.00 O ATOM 0 H GLY B 27 7.847 -5.206 13.737 1.00 0.00 H new ATOM 0 HA2 GLY B 27 7.055 -6.715 15.354 1.00 0.00 H new ATOM 0 HA3 GLY B 27 6.383 -5.403 16.301 1.00 0.00 H new ATOM 762 N ARG B 28 5.047 -6.497 13.411 1.00 0.00 N ATOM 763 CA ARG B 28 3.775 -6.869 12.724 1.00 0.00 C ATOM 764 C ARG B 28 4.151 -7.851 11.599 1.00 0.00 C ATOM 765 O ARG B 28 4.547 -7.444 10.523 1.00 0.00 O ATOM 766 CB ARG B 28 2.868 -5.666 12.322 1.00 0.00 C ATOM 767 CG ARG B 28 3.506 -4.365 11.790 1.00 0.00 C ATOM 768 CD ARG B 28 2.423 -3.383 11.288 1.00 0.00 C ATOM 769 NE ARG B 28 2.874 -2.000 11.044 1.00 0.00 N ATOM 770 CZ ARG B 28 3.157 -1.085 11.966 1.00 0.00 C ATOM 771 NH1 ARG B 28 3.153 -1.304 13.245 1.00 0.00 N ATOM 772 NH2 ARG B 28 3.454 0.095 11.552 1.00 0.00 N ATOM 0 H ARG B 28 5.872 -6.615 12.823 1.00 0.00 H new ATOM 0 HA ARG B 28 3.100 -7.371 13.417 1.00 0.00 H new ATOM 0 HB2 ARG B 28 2.175 -6.023 11.560 1.00 0.00 H new ATOM 0 HB3 ARG B 28 2.273 -5.402 13.196 1.00 0.00 H new ATOM 0 HG2 ARG B 28 4.092 -3.894 12.579 1.00 0.00 H new ATOM 0 HG3 ARG B 28 4.195 -4.599 10.978 1.00 0.00 H new ATOM 0 HD2 ARG B 28 2.003 -3.777 10.362 1.00 0.00 H new ATOM 0 HD3 ARG B 28 1.615 -3.358 12.019 1.00 0.00 H new ATOM 0 HE ARG B 28 2.979 -1.717 10.070 1.00 0.00 H new ATOM 0 HH11 ARG B 28 2.921 -2.231 13.603 1.00 0.00 H new ATOM 0 HH12 ARG B 28 3.382 -0.550 13.892 1.00 0.00 H new ATOM 0 HH21 ARG B 28 3.465 0.297 10.552 1.00 0.00 H new ATOM 0 HH22 ARG B 28 3.678 0.830 12.223 1.00 0.00 H new ATOM 773 N SER B 29 3.978 -9.163 11.777 1.00 0.00 N ATOM 774 CA SER B 29 4.768 -10.171 10.997 1.00 0.00 C ATOM 775 C SER B 29 4.126 -10.314 9.590 1.00 0.00 C ATOM 776 O SER B 29 2.903 -10.286 9.533 1.00 0.00 O ATOM 777 CB SER B 29 4.783 -11.493 11.790 1.00 0.00 C ATOM 778 OG SER B 29 5.614 -12.455 11.137 1.00 0.00 O ATOM 0 H SER B 29 3.314 -9.566 12.438 1.00 0.00 H new ATOM 0 HA SER B 29 5.804 -9.862 10.854 1.00 0.00 H new ATOM 0 HB2 SER B 29 5.148 -11.314 12.801 1.00 0.00 H new ATOM 0 HB3 SER B 29 3.769 -11.881 11.882 1.00 0.00 H new ATOM 0 HG SER B 29 5.616 -13.289 11.652 1.00 0.00 H new ATOM 779 N MET B 30 4.846 -10.308 8.457 1.00 0.00 N ATOM 780 CA MET B 30 4.324 -9.659 7.208 1.00 0.00 C ATOM 781 C MET B 30 2.871 -9.957 6.754 1.00 0.00 C ATOM 782 O MET B 30 2.199 -9.013 6.395 1.00 0.00 O ATOM 783 CB MET B 30 5.174 -9.957 5.973 1.00 0.00 C ATOM 784 CG MET B 30 6.581 -9.444 5.910 1.00 0.00 C ATOM 785 SD MET B 30 7.445 -10.391 4.648 1.00 0.00 S ATOM 786 CE MET B 30 7.334 -9.182 3.336 1.00 0.00 C ATOM 0 H MET B 30 5.770 -10.729 8.363 1.00 0.00 H new ATOM 0 HA MET B 30 4.366 -8.624 7.547 1.00 0.00 H new ATOM 0 HB2 MET B 30 5.215 -11.040 5.857 1.00 0.00 H new ATOM 0 HB3 MET B 30 4.643 -9.563 5.107 1.00 0.00 H new ATOM 0 HG2 MET B 30 6.591 -8.382 5.666 1.00 0.00 H new ATOM 0 HG3 MET B 30 7.073 -9.554 6.876 1.00 0.00 H new ATOM 0 HE1 MET B 30 7.250 -9.693 2.377 1.00 0.00 H new ATOM 0 HE2 MET B 30 6.456 -8.556 3.492 1.00 0.00 H new ATOM 0 HE3 MET B 30 8.229 -8.559 3.338 1.00 0.00 H new ATOM 787 N ASN B 31 2.281 -11.154 6.791 1.00 0.00 N ATOM 788 CA ASN B 31 0.796 -11.254 6.625 1.00 0.00 C ATOM 789 C ASN B 31 -0.060 -10.247 7.514 1.00 0.00 C ATOM 790 O ASN B 31 -0.908 -9.551 6.962 1.00 0.00 O ATOM 791 CB ASN B 31 0.353 -12.739 6.687 1.00 0.00 C ATOM 792 CG ASN B 31 -0.694 -13.126 5.648 1.00 0.00 C ATOM 793 OD1 ASN B 31 -0.476 -13.995 4.816 1.00 0.00 O ATOM 794 ND2 ASN B 31 -1.810 -12.454 5.595 1.00 0.00 N ATOM 0 H ASN B 31 2.766 -12.041 6.927 1.00 0.00 H new ATOM 0 HA ASN B 31 0.558 -10.890 5.626 1.00 0.00 H new ATOM 0 HB2 ASN B 31 1.230 -13.373 6.556 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -0.044 -12.946 7.681 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -2.492 -12.655 4.864 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -2.001 -11.727 6.285 1.00 0.00 H new ATOM 795 N SER B 32 0.319 -10.026 8.788 1.00 0.00 N ATOM 796 CA SER B 32 0.173 -8.709 9.485 1.00 0.00 C ATOM 797 C SER B 32 0.797 -7.432 8.805 1.00 0.00 C ATOM 798 O SER B 32 -0.005 -6.654 8.294 1.00 0.00 O ATOM 799 CB SER B 32 0.418 -8.926 10.997 1.00 0.00 C ATOM 800 OG SER B 32 0.391 -7.711 11.748 1.00 0.00 O ATOM 0 H SER B 32 0.737 -10.749 9.374 1.00 0.00 H new ATOM 0 HA SER B 32 -0.858 -8.378 9.358 1.00 0.00 H new ATOM 0 HB2 SER B 32 -0.340 -9.605 11.388 1.00 0.00 H new ATOM 0 HB3 SER B 32 1.384 -9.411 11.137 1.00 0.00 H new ATOM 0 HG SER B 32 -0.376 -7.170 11.467 1.00 0.00 H new ATOM 801 N GLU B 33 2.122 -7.153 8.725 1.00 0.00 N ATOM 802 CA GLU B 33 2.609 -5.859 8.088 1.00 0.00 C ATOM 803 C GLU B 33 2.176 -5.591 6.626 1.00 0.00 C ATOM 804 O GLU B 33 1.675 -4.515 6.329 1.00 0.00 O ATOM 805 CB GLU B 33 4.129 -5.650 7.973 1.00 0.00 C ATOM 806 CG GLU B 33 4.619 -4.248 7.491 1.00 0.00 C ATOM 807 CD GLU B 33 4.101 -3.047 8.243 1.00 0.00 C ATOM 808 OE1 GLU B 33 4.796 -2.843 9.381 1.00 0.00 O ATOM 809 OE2 GLU B 33 3.148 -2.363 7.888 1.00 0.00 O ATOM 0 H GLU B 33 2.861 -7.764 9.071 1.00 0.00 H new ATOM 0 HA GLU B 33 2.137 -5.201 8.818 1.00 0.00 H new ATOM 0 HB2 GLU B 33 4.572 -5.846 8.949 1.00 0.00 H new ATOM 0 HB3 GLU B 33 4.523 -6.400 7.287 1.00 0.00 H new ATOM 0 HG2 GLU B 33 5.708 -4.234 7.539 1.00 0.00 H new ATOM 0 HG3 GLU B 33 4.345 -4.135 6.442 1.00 0.00 H new ATOM 810 N LEU B 34 2.501 -6.517 5.701 1.00 0.00 N ATOM 811 CA LEU B 34 1.983 -6.547 4.326 1.00 0.00 C ATOM 812 C LEU B 34 0.480 -6.184 4.363 1.00 0.00 C ATOM 813 O LEU B 34 0.173 -5.147 3.802 1.00 0.00 O ATOM 814 CB LEU B 34 2.285 -7.936 3.698 1.00 0.00 C ATOM 815 CG LEU B 34 2.758 -8.061 2.234 1.00 0.00 C ATOM 816 CD1 LEU B 34 2.498 -9.448 1.641 1.00 0.00 C ATOM 817 CD2 LEU B 34 2.196 -7.070 1.192 1.00 0.00 C ATOM 0 H LEU B 34 3.147 -7.281 5.898 1.00 0.00 H new ATOM 0 HA LEU B 34 2.472 -5.812 3.687 1.00 0.00 H new ATOM 0 HB2 LEU B 34 3.044 -8.409 4.320 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.378 -8.533 3.792 1.00 0.00 H new ATOM 0 HG LEU B 34 3.814 -7.831 2.377 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.852 -9.475 0.610 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.028 -10.199 2.226 1.00 0.00 H new ATOM 0 HD13 LEU B 34 1.429 -9.659 1.663 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.624 -7.289 0.214 1.00 0.00 H new ATOM 0 HD22 LEU B 34 1.112 -7.169 1.144 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.455 -6.052 1.482 1.00 0.00 H new ATOM 818 N LEU B 35 -0.430 -6.863 5.125 1.00 0.00 N ATOM 819 CA LEU B 35 -1.835 -6.388 5.179 1.00 0.00 C ATOM 820 C LEU B 35 -2.047 -4.963 5.708 1.00 0.00 C ATOM 821 O LEU B 35 -2.785 -4.191 5.109 1.00 0.00 O ATOM 822 CB LEU B 35 -2.777 -7.320 5.973 1.00 0.00 C ATOM 823 CG LEU B 35 -3.359 -8.508 5.198 1.00 0.00 C ATOM 824 CD1 LEU B 35 -4.380 -9.179 6.106 1.00 0.00 C ATOM 825 CD2 LEU B 35 -4.071 -8.002 3.925 1.00 0.00 C ATOM 0 H LEU B 35 -0.227 -7.695 5.679 1.00 0.00 H new ATOM 0 HA LEU B 35 -2.091 -6.395 4.120 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -2.232 -7.706 6.834 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -3.604 -6.724 6.360 1.00 0.00 H new ATOM 0 HG LEU B 35 -2.570 -9.202 4.907 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -4.820 -10.033 5.591 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -3.888 -9.519 7.017 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.164 -8.466 6.361 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -4.483 -8.850 3.377 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -4.877 -7.324 4.204 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -3.356 -7.475 3.293 1.00 0.00 H new ATOM 826 N GLN B 36 -1.388 -4.633 6.808 1.00 0.00 N ATOM 827 CA GLN B 36 -1.407 -3.274 7.382 1.00 0.00 C ATOM 828 C GLN B 36 -0.951 -2.183 6.385 1.00 0.00 C ATOM 829 O GLN B 36 -1.771 -1.333 6.062 1.00 0.00 O ATOM 830 CB GLN B 36 -0.599 -3.296 8.719 1.00 0.00 C ATOM 831 CG GLN B 36 -1.388 -3.630 10.012 1.00 0.00 C ATOM 832 CD GLN B 36 -1.826 -5.080 10.194 1.00 0.00 C ATOM 833 OE1 GLN B 36 -1.365 -5.823 11.055 1.00 0.00 O ATOM 834 NE2 GLN B 36 -2.717 -5.537 9.363 1.00 0.00 N ATOM 0 H GLN B 36 -0.820 -5.294 7.338 1.00 0.00 H new ATOM 0 HA GLN B 36 -2.435 -2.988 7.604 1.00 0.00 H new ATOM 0 HB2 GLN B 36 0.207 -4.023 8.616 1.00 0.00 H new ATOM 0 HB3 GLN B 36 -0.133 -2.320 8.849 1.00 0.00 H new ATOM 0 HG2 GLN B 36 -0.773 -3.351 10.867 1.00 0.00 H new ATOM 0 HG3 GLN B 36 -2.277 -3.000 10.040 1.00 0.00 H new ATOM 0 HE21 GLN B 36 -3.105 -4.926 8.644 1.00 0.00 H new ATOM 0 HE22 GLN B 36 -3.027 -6.506 9.430 1.00 0.00 H new ATOM 835 N ILE B 37 0.246 -2.258 5.796 1.00 0.00 N ATOM 836 CA ILE B 37 0.626 -1.368 4.675 1.00 0.00 C ATOM 837 C ILE B 37 -0.190 -1.495 3.348 1.00 0.00 C ATOM 838 O ILE B 37 -0.050 -0.578 2.572 1.00 0.00 O ATOM 839 CB ILE B 37 2.172 -1.514 4.432 1.00 0.00 C ATOM 840 CG1 ILE B 37 2.882 -0.194 4.041 1.00 0.00 C ATOM 841 CG2 ILE B 37 2.460 -2.591 3.355 1.00 0.00 C ATOM 842 CD1 ILE B 37 2.840 0.902 5.125 1.00 0.00 C ATOM 0 H ILE B 37 0.972 -2.920 6.069 1.00 0.00 H new ATOM 0 HA ILE B 37 0.360 -0.361 4.996 1.00 0.00 H new ATOM 0 HB ILE B 37 2.584 -1.818 5.394 1.00 0.00 H new ATOM 0 HG12 ILE B 37 3.923 -0.413 3.804 1.00 0.00 H new ATOM 0 HG13 ILE B 37 2.423 0.195 3.132 1.00 0.00 H new ATOM 0 HG21 ILE B 37 3.536 -2.675 3.203 1.00 0.00 H new ATOM 0 HG22 ILE B 37 2.064 -3.551 3.686 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.983 -2.305 2.418 1.00 0.00 H new ATOM 0 HD11 ILE B 37 3.361 1.790 4.765 1.00 0.00 H new ATOM 0 HD12 ILE B 37 1.803 1.155 5.347 1.00 0.00 H new ATOM 0 HD13 ILE B 37 3.326 0.538 6.030 1.00 0.00 H new ATOM 843 N VAL B 38 -0.824 -2.629 3.015 1.00 0.00 N ATOM 844 CA VAL B 38 -1.586 -2.908 1.753 1.00 0.00 C ATOM 845 C VAL B 38 -3.055 -2.361 1.840 1.00 0.00 C ATOM 846 O VAL B 38 -3.528 -1.658 0.945 1.00 0.00 O ATOM 847 CB VAL B 38 -1.624 -4.454 1.552 1.00 0.00 C ATOM 848 CG1 VAL B 38 -2.709 -5.154 0.715 1.00 0.00 C ATOM 849 CG2 VAL B 38 -0.280 -4.984 1.050 1.00 0.00 C ATOM 0 H VAL B 38 -0.829 -3.432 3.644 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.094 -2.411 0.917 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.896 -4.715 2.575 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -2.533 -6.230 0.717 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -3.690 -4.946 1.143 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -2.675 -4.783 -0.309 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.340 -6.065 0.920 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -0.038 -4.517 0.095 1.00 0.00 H new ATOM 0 HG23 VAL B 38 0.498 -4.749 1.776 1.00 0.00 H new ATOM 850 N GLN B 39 -3.766 -2.691 2.948 1.00 0.00 N ATOM 851 CA GLN B 39 -4.896 -1.882 3.473 1.00 0.00 C ATOM 852 C GLN B 39 -4.527 -0.367 3.607 1.00 0.00 C ATOM 853 O GLN B 39 -5.247 0.460 3.049 1.00 0.00 O ATOM 854 CB GLN B 39 -5.332 -2.521 4.830 1.00 0.00 C ATOM 855 CG GLN B 39 -5.901 -3.968 4.801 1.00 0.00 C ATOM 856 CD GLN B 39 -6.177 -4.697 6.124 1.00 0.00 C ATOM 857 OE1 GLN B 39 -6.169 -5.920 6.190 1.00 0.00 O ATOM 858 NE2 GLN B 39 -6.453 -4.025 7.212 1.00 0.00 N ATOM 0 H GLN B 39 -3.572 -3.525 3.502 1.00 0.00 H new ATOM 0 HA GLN B 39 -5.731 -1.899 2.773 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.469 -2.514 5.496 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -6.086 -1.874 5.278 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -6.836 -3.940 4.242 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -5.205 -4.581 4.229 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -6.468 -3.005 7.192 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -6.653 -4.521 8.081 1.00 0.00 H new ATOM 859 N ASP B 40 -3.349 -0.017 4.171 1.00 0.00 N ATOM 860 CA ASP B 40 -2.703 1.303 3.915 1.00 0.00 C ATOM 861 C ASP B 40 -2.458 1.753 2.441 1.00 0.00 C ATOM 862 O ASP B 40 -2.657 2.922 2.111 1.00 0.00 O ATOM 863 CB ASP B 40 -1.485 1.593 4.826 1.00 0.00 C ATOM 864 CG ASP B 40 -1.578 2.901 5.580 1.00 0.00 C ATOM 865 OD1 ASP B 40 -2.486 2.829 6.588 1.00 0.00 O ATOM 866 OD2 ASP B 40 -0.896 3.886 5.347 1.00 0.00 O ATOM 0 H ASP B 40 -2.824 -0.621 4.803 1.00 0.00 H new ATOM 0 HA ASP B 40 -3.522 1.959 4.211 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -1.379 0.779 5.543 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -0.582 1.601 4.216 1.00 0.00 H new ATOM 867 N ALA B 41 -2.022 0.836 1.575 1.00 0.00 N ATOM 868 CA ALA B 41 -1.456 1.161 0.240 1.00 0.00 C ATOM 869 C ALA B 41 -2.479 1.738 -0.776 1.00 0.00 C ATOM 870 O ALA B 41 -2.250 2.765 -1.420 1.00 0.00 O ATOM 871 CB ALA B 41 -0.702 -0.087 -0.288 1.00 0.00 C ATOM 0 H ALA B 41 -2.047 -0.165 1.771 1.00 0.00 H new ATOM 0 HA ALA B 41 -0.755 1.987 0.362 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -0.279 0.131 -1.268 1.00 0.00 H new ATOM 0 HB2 ALA B 41 0.099 -0.348 0.403 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -1.396 -0.923 -0.371 1.00 0.00 H new ATOM 872 N LEU B 42 -3.616 1.055 -0.845 1.00 0.00 N ATOM 873 CA LEU B 42 -4.811 1.501 -1.603 1.00 0.00 C ATOM 874 C LEU B 42 -5.986 2.154 -0.797 1.00 0.00 C ATOM 875 O LEU B 42 -6.827 2.789 -1.440 1.00 0.00 O ATOM 876 CB LEU B 42 -5.221 0.334 -2.533 1.00 0.00 C ATOM 877 CG LEU B 42 -5.317 -1.104 -1.963 1.00 0.00 C ATOM 878 CD1 LEU B 42 -6.414 -1.269 -0.905 1.00 0.00 C ATOM 879 CD2 LEU B 42 -5.516 -2.064 -3.124 1.00 0.00 C ATOM 0 H LEU B 42 -3.750 0.160 -0.374 1.00 0.00 H new ATOM 0 HA LEU B 42 -4.524 2.377 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -6.194 0.582 -2.957 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -4.510 0.310 -3.359 1.00 0.00 H new ATOM 0 HG LEU B 42 -4.387 -1.327 -1.440 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -6.425 -2.299 -0.550 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -6.216 -0.599 -0.068 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -7.382 -1.026 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -5.586 -3.084 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -6.434 -1.809 -3.653 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -4.670 -1.988 -3.808 1.00 0.00 H new ATOM 880 N SER B 43 -6.058 2.103 0.555 1.00 0.00 N ATOM 881 CA SER B 43 -6.893 3.087 1.323 1.00 0.00 C ATOM 882 C SER B 43 -6.277 4.524 1.437 1.00 0.00 C ATOM 883 O SER B 43 -7.042 5.489 1.384 1.00 0.00 O ATOM 884 CB SER B 43 -7.306 2.573 2.724 1.00 0.00 C ATOM 885 OG SER B 43 -7.808 1.236 2.691 1.00 0.00 O ATOM 0 H SER B 43 -5.569 1.418 1.131 1.00 0.00 H new ATOM 0 HA SER B 43 -7.790 3.180 0.710 1.00 0.00 H new ATOM 0 HB2 SER B 43 -6.446 2.618 3.392 1.00 0.00 H new ATOM 0 HB3 SER B 43 -8.067 3.233 3.140 1.00 0.00 H new ATOM 0 HG SER B 43 -7.069 0.606 2.819 1.00 0.00 H new ATOM 886 N LYS B 44 -4.937 4.681 1.595 1.00 0.00 N ATOM 887 CA LYS B 44 -4.245 6.005 1.564 1.00 0.00 C ATOM 888 C LYS B 44 -4.601 7.043 2.722 1.00 0.00 C ATOM 889 O LYS B 44 -5.579 6.832 3.448 1.00 0.00 O ATOM 890 CB LYS B 44 -4.159 6.494 0.075 1.00 0.00 C ATOM 891 CG LYS B 44 -5.199 7.533 -0.407 1.00 0.00 C ATOM 892 CD LYS B 44 -5.082 7.799 -1.923 1.00 0.00 C ATOM 893 CE LYS B 44 -5.975 8.934 -2.453 1.00 0.00 C ATOM 894 NZ LYS B 44 -7.384 8.501 -2.534 1.00 0.00 N ATOM 0 H LYS B 44 -4.303 3.897 1.748 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.214 5.881 1.894 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -3.167 6.917 -0.081 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -4.237 5.619 -0.570 1.00 0.00 H new ATOM 0 HG2 LYS B 44 -6.203 7.176 -0.177 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -5.060 8.467 0.138 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -4.044 8.034 -2.157 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -5.329 6.882 -2.458 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -5.894 9.802 -1.798 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -5.629 9.245 -3.439 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -7.967 9.283 -2.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -7.461 7.687 -3.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -7.718 8.227 -1.588 1.00 0.00 H new ATOM 895 N PRO B 45 -3.837 8.148 3.001 1.00 0.00 N ATOM 896 CA PRO B 45 -4.103 9.027 4.178 1.00 0.00 C ATOM 897 C PRO B 45 -5.412 9.890 4.184 1.00 0.00 C ATOM 898 O PRO B 45 -5.487 10.944 3.547 1.00 0.00 O ATOM 899 CB PRO B 45 -2.817 9.868 4.276 1.00 0.00 C ATOM 900 CG PRO B 45 -2.133 9.775 2.915 1.00 0.00 C ATOM 901 CD PRO B 45 -2.530 8.407 2.375 1.00 0.00 C ATOM 0 HA PRO B 45 -4.319 8.412 5.051 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -3.049 10.904 4.523 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -2.166 9.490 5.064 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -2.463 10.574 2.251 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -1.051 9.865 3.009 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -2.601 8.412 1.287 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -1.800 7.644 2.643 1.00 0.00 H new ATOM 902 N SER B 46 -6.398 9.471 4.995 1.00 0.00 N ATOM 903 CA SER B 46 -7.566 10.318 5.373 1.00 0.00 C ATOM 904 C SER B 46 -7.459 10.849 6.854 1.00 0.00 C ATOM 905 O SER B 46 -7.178 12.046 6.973 1.00 0.00 O ATOM 906 CB SER B 46 -8.873 9.596 4.994 1.00 0.00 C ATOM 907 OG SER B 46 -9.020 9.504 3.576 1.00 0.00 O ATOM 0 H SER B 46 -6.418 8.540 5.411 1.00 0.00 H new ATOM 0 HA SER B 46 -7.569 11.241 4.793 1.00 0.00 H new ATOM 0 HB2 SER B 46 -8.878 8.596 5.428 1.00 0.00 H new ATOM 0 HB3 SER B 46 -9.723 10.132 5.416 1.00 0.00 H new ATOM 0 HG SER B 46 -9.857 9.040 3.363 1.00 0.00 H new ATOM 908 N PRO B 47 -7.592 10.096 7.998 1.00 0.00 N ATOM 909 CA PRO B 47 -7.294 10.636 9.369 1.00 0.00 C ATOM 910 C PRO B 47 -5.778 10.757 9.774 1.00 0.00 C ATOM 911 O PRO B 47 -5.310 10.286 10.814 1.00 0.00 O ATOM 912 CB PRO B 47 -8.120 9.663 10.238 1.00 0.00 C ATOM 913 CG PRO B 47 -8.049 8.330 9.490 1.00 0.00 C ATOM 914 CD PRO B 47 -8.149 8.730 8.021 1.00 0.00 C ATOM 0 HA PRO B 47 -7.559 11.688 9.475 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -7.705 9.578 11.242 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -9.150 10.003 10.346 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -7.118 7.804 9.699 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -8.863 7.665 9.780 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -7.581 8.054 7.381 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -9.180 8.711 7.669 1.00 0.00 H new ATOM 915 N VAL B 48 -5.044 11.493 8.943 1.00 0.00 N ATOM 916 CA VAL B 48 -3.573 11.735 9.070 1.00 0.00 C ATOM 917 C VAL B 48 -3.189 13.114 9.729 1.00 0.00 C ATOM 918 O VAL B 48 -2.236 13.176 10.509 1.00 0.00 O ATOM 919 CB VAL B 48 -2.931 11.456 7.668 1.00 0.00 C ATOM 920 CG1 VAL B 48 -3.078 12.609 6.647 1.00 0.00 C ATOM 921 CG2 VAL B 48 -1.457 11.044 7.796 1.00 0.00 C ATOM 0 H VAL B 48 -5.450 11.960 8.132 1.00 0.00 H new ATOM 0 HA VAL B 48 -3.146 11.043 9.796 1.00 0.00 H new ATOM 0 HB VAL B 48 -3.509 10.624 7.264 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -2.604 12.326 5.707 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -4.135 12.809 6.474 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -2.598 13.506 7.039 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -1.044 10.858 6.805 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -0.896 11.844 8.279 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -1.384 10.137 8.395 1.00 0.00 H new ATOM 922 N THR B 49 -3.968 14.191 9.480 1.00 0.00 N ATOM 923 CA THR B 49 -4.147 15.336 10.431 1.00 0.00 C ATOM 924 C THR B 49 -2.901 16.269 10.646 1.00 0.00 C ATOM 925 O THR B 49 -2.296 16.316 11.720 1.00 0.00 O ATOM 926 CB THR B 49 -5.009 14.958 11.692 1.00 0.00 C ATOM 927 OG1 THR B 49 -4.951 15.990 12.667 1.00 0.00 O ATOM 928 CG2 THR B 49 -4.681 13.647 12.425 1.00 0.00 C ATOM 0 H THR B 49 -4.496 14.301 8.614 1.00 0.00 H new ATOM 0 HA THR B 49 -4.780 16.049 9.903 1.00 0.00 H new ATOM 0 HB THR B 49 -5.994 14.818 11.248 1.00 0.00 H new ATOM 0 HG1 THR B 49 -5.494 15.738 13.443 1.00 0.00 H new ATOM 0 HG21 THR B 49 -5.358 13.524 13.270 1.00 0.00 H new ATOM 0 HG22 THR B 49 -4.800 12.808 11.740 1.00 0.00 H new ATOM 0 HG23 THR B 49 -3.653 13.679 12.785 1.00 0.00 H new ATOM 929 N GLY B 50 -2.580 17.052 9.604 1.00 0.00 N ATOM 930 CA GLY B 50 -1.412 17.988 9.590 1.00 0.00 C ATOM 931 C GLY B 50 -0.363 17.597 8.533 1.00 0.00 C ATOM 932 O GLY B 50 -0.131 18.292 7.545 1.00 0.00 O ATOM 0 H GLY B 50 -3.117 17.064 8.737 1.00 0.00 H new ATOM 0 HA2 GLY B 50 -1.763 19.001 9.393 1.00 0.00 H new ATOM 0 HA3 GLY B 50 -0.946 17.998 10.575 1.00 0.00 H new ATOM 933 N TYR B 51 0.213 16.420 8.754 1.00 0.00 N ATOM 934 CA TYR B 51 0.715 15.490 7.707 1.00 0.00 C ATOM 935 C TYR B 51 -0.012 15.385 6.290 1.00 0.00 C ATOM 936 O TYR B 51 -0.691 14.393 6.012 1.00 0.00 O ATOM 937 CB TYR B 51 0.608 14.137 8.492 1.00 0.00 C ATOM 938 CG TYR B 51 1.627 13.729 9.575 1.00 0.00 C ATOM 939 CD1 TYR B 51 2.820 13.097 9.219 1.00 0.00 C ATOM 940 CD2 TYR B 51 1.256 13.752 10.922 1.00 0.00 C ATOM 941 CE1 TYR B 51 3.638 12.520 10.183 1.00 0.00 C ATOM 942 CE2 TYR B 51 2.082 13.190 11.891 1.00 0.00 C ATOM 943 CZ TYR B 51 3.282 12.590 11.524 1.00 0.00 C ATOM 944 OH TYR B 51 4.051 11.970 12.471 1.00 0.00 O ATOM 0 H TYR B 51 0.356 16.059 9.697 1.00 0.00 H new ATOM 0 HA TYR B 51 1.686 15.832 7.350 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -0.373 14.128 8.967 1.00 0.00 H new ATOM 0 HB3 TYR B 51 0.609 13.342 7.746 1.00 0.00 H new ATOM 0 HD1 TYR B 51 3.111 13.056 8.180 1.00 0.00 H new ATOM 0 HD2 TYR B 51 0.322 14.209 11.213 1.00 0.00 H new ATOM 0 HE1 TYR B 51 4.548 12.018 9.890 1.00 0.00 H new ATOM 0 HE2 TYR B 51 1.790 13.220 12.930 1.00 0.00 H new ATOM 0 HH TYR B 51 3.661 12.119 13.358 1.00 0.00 H new ATOM 945 N ARG B 52 0.100 16.365 5.367 1.00 0.00 N ATOM 946 CA ARG B 52 -0.747 16.381 4.117 1.00 0.00 C ATOM 947 C ARG B 52 -0.087 17.079 2.861 1.00 0.00 C ATOM 948 O ARG B 52 0.061 18.299 2.850 1.00 0.00 O ATOM 949 CB ARG B 52 -2.128 17.059 4.414 1.00 0.00 C ATOM 950 CG ARG B 52 -3.063 16.354 5.431 1.00 0.00 C ATOM 951 CD ARG B 52 -4.436 17.032 5.575 1.00 0.00 C ATOM 952 NE ARG B 52 -5.240 16.399 6.657 1.00 0.00 N ATOM 953 CZ ARG B 52 -5.986 15.306 6.538 1.00 0.00 C ATOM 954 NH1 ARG B 52 -6.076 14.589 5.459 1.00 0.00 N ATOM 955 NH2 ARG B 52 -6.661 14.932 7.565 1.00 0.00 N ATOM 0 H ARG B 52 0.750 17.148 5.445 1.00 0.00 H new ATOM 0 HA ARG B 52 -0.865 15.332 3.846 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -1.937 18.069 4.776 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -2.666 17.155 3.471 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -3.208 15.319 5.122 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -2.575 16.330 6.405 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -4.300 18.091 5.792 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -4.977 16.967 4.631 1.00 0.00 H new ATOM 0 HE ARG B 52 -5.216 16.846 7.574 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -5.551 14.854 4.625 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -6.672 13.761 5.445 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -6.612 15.469 8.431 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -7.246 14.098 7.515 1.00 0.00 H new ATOM 956 N ASN B 53 0.267 16.497 1.692 1.00 0.00 N ATOM 957 CA ASN B 53 0.437 15.056 1.409 1.00 0.00 C ATOM 958 C ASN B 53 -0.855 14.215 1.125 1.00 0.00 C ATOM 959 O ASN B 53 -1.910 14.410 1.715 1.00 0.00 O ATOM 960 CB ASN B 53 1.671 14.516 2.219 1.00 0.00 C ATOM 961 CG ASN B 53 1.846 13.046 2.208 1.00 0.00 C ATOM 962 OD1 ASN B 53 2.900 12.526 1.895 1.00 0.00 O ATOM 963 ND2 ASN B 53 0.854 12.329 2.632 1.00 0.00 N ATOM 0 H ASN B 53 0.454 17.063 0.864 1.00 0.00 H new ATOM 0 HA ASN B 53 0.739 14.870 0.378 1.00 0.00 H new ATOM 0 HB2 ASN B 53 2.575 14.975 1.819 1.00 0.00 H new ATOM 0 HB3 ASN B 53 1.577 14.846 3.254 1.00 0.00 H new ATOM 0 HD21 ASN B 53 0.952 11.316 2.706 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.025 12.777 2.891 1.00 0.00 H new ATOM 964 N ASP B 54 -0.891 13.184 0.261 1.00 0.00 N ATOM 965 CA ASP B 54 0.204 12.711 -0.679 1.00 0.00 C ATOM 966 C ASP B 54 1.040 11.370 -0.464 1.00 0.00 C ATOM 967 O ASP B 54 1.925 10.935 -1.218 1.00 0.00 O ATOM 968 CB ASP B 54 0.718 13.667 -1.791 1.00 0.00 C ATOM 969 CG ASP B 54 0.052 15.009 -2.105 1.00 0.00 C ATOM 970 OD1 ASP B 54 -1.121 14.864 -2.774 1.00 0.00 O ATOM 971 OD2 ASP B 54 0.528 16.094 -1.801 1.00 0.00 O ATOM 0 H ASP B 54 -1.727 12.607 0.176 1.00 0.00 H new ATOM 0 HA ASP B 54 -0.688 12.139 -0.933 1.00 0.00 H new ATOM 0 HB2 ASP B 54 1.760 13.885 -1.555 1.00 0.00 H new ATOM 0 HB3 ASP B 54 0.714 13.094 -2.718 1.00 0.00 H new ATOM 972 N ALA B 55 0.421 10.443 0.256 1.00 0.00 N ATOM 973 CA ALA B 55 0.092 9.142 -0.387 1.00 0.00 C ATOM 974 C ALA B 55 -1.270 9.002 -1.151 1.00 0.00 C ATOM 975 O ALA B 55 -1.451 8.033 -1.892 1.00 0.00 O ATOM 976 CB ALA B 55 0.740 8.085 0.489 1.00 0.00 C ATOM 0 H ALA B 55 0.142 10.540 1.232 1.00 0.00 H new ATOM 0 HA ALA B 55 0.511 8.973 -1.379 1.00 0.00 H new ATOM 0 HB1 ALA B 55 0.539 7.097 0.076 1.00 0.00 H new ATOM 0 HB2 ALA B 55 1.817 8.252 0.524 1.00 0.00 H new ATOM 0 HB3 ALA B 55 0.330 8.147 1.497 1.00 0.00 H new ATOM 977 N GLU B 56 -2.002 10.137 -1.259 1.00 0.00 N ATOM 978 CA GLU B 56 -2.447 10.695 -2.580 1.00 0.00 C ATOM 979 C GLU B 56 -1.386 10.954 -3.728 1.00 0.00 C ATOM 980 O GLU B 56 -1.746 11.124 -4.901 1.00 0.00 O ATOM 981 CB GLU B 56 -3.130 12.044 -2.173 1.00 0.00 C ATOM 982 CG GLU B 56 -3.721 12.935 -3.280 1.00 0.00 C ATOM 983 CD GLU B 56 -4.864 12.357 -4.115 1.00 0.00 C ATOM 984 OE1 GLU B 56 -4.417 11.611 -5.168 1.00 0.00 O ATOM 985 OE2 GLU B 56 -6.046 12.557 -3.861 1.00 0.00 O ATOM 0 H GLU B 56 -2.301 10.690 -0.456 1.00 0.00 H new ATOM 0 HA GLU B 56 -3.063 9.936 -3.062 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -3.932 11.811 -1.473 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -2.394 12.636 -1.629 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -4.075 13.856 -2.817 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -2.913 13.209 -3.959 1.00 0.00 H new ATOM 986 N ARG B 57 -0.088 10.830 -3.447 1.00 0.00 N ATOM 987 CA ARG B 57 0.965 10.689 -4.470 1.00 0.00 C ATOM 988 C ARG B 57 1.340 9.224 -4.767 1.00 0.00 C ATOM 989 O ARG B 57 1.373 8.898 -5.942 1.00 0.00 O ATOM 990 CB ARG B 57 2.194 11.558 -4.147 1.00 0.00 C ATOM 991 CG ARG B 57 2.383 12.724 -5.165 1.00 0.00 C ATOM 992 CD ARG B 57 1.241 13.764 -5.235 1.00 0.00 C ATOM 993 NE ARG B 57 1.023 14.233 -6.629 1.00 0.00 N ATOM 994 CZ ARG B 57 -0.157 14.466 -7.199 1.00 0.00 C ATOM 995 NH1 ARG B 57 -1.304 14.327 -6.602 1.00 0.00 N ATOM 996 NH2 ARG B 57 -0.160 14.847 -8.425 1.00 0.00 N ATOM 0 H ARG B 57 0.272 10.824 -2.493 1.00 0.00 H new ATOM 0 HA ARG B 57 0.537 11.068 -5.398 1.00 0.00 H new ATOM 0 HB2 ARG B 57 2.091 11.969 -3.143 1.00 0.00 H new ATOM 0 HB3 ARG B 57 3.087 10.933 -4.145 1.00 0.00 H new ATOM 0 HG2 ARG B 57 3.307 13.247 -4.919 1.00 0.00 H new ATOM 0 HG3 ARG B 57 2.515 12.294 -6.158 1.00 0.00 H new ATOM 0 HD2 ARG B 57 0.321 13.324 -4.849 1.00 0.00 H new ATOM 0 HD3 ARG B 57 1.481 14.614 -4.596 1.00 0.00 H new ATOM 0 HE ARG B 57 1.853 14.390 -7.200 1.00 0.00 H new ATOM 0 HH11 ARG B 57 -1.339 14.020 -5.630 1.00 0.00 H new ATOM 0 HH12 ARG B 57 -2.168 14.525 -7.106 1.00 0.00 H new ATOM 0 HH21 ARG B 57 0.721 14.961 -8.926 1.00 0.00 H new ATOM 0 HH22 ARG B 57 -1.044 15.036 -8.898 1.00 0.00 H new ATOM 997 N LEU B 58 1.550 8.311 -3.802 1.00 0.00 N ATOM 998 CA LEU B 58 1.624 6.823 -4.139 1.00 0.00 C ATOM 999 C LEU B 58 0.553 6.250 -5.145 1.00 0.00 C ATOM 1000 O LEU B 58 0.856 5.753 -6.246 1.00 0.00 O ATOM 1001 CB LEU B 58 1.620 5.998 -2.819 1.00 0.00 C ATOM 1002 CG LEU B 58 2.980 5.698 -2.162 1.00 0.00 C ATOM 1003 CD1 LEU B 58 3.852 6.934 -1.982 1.00 0.00 C ATOM 1004 CD2 LEU B 58 2.734 5.066 -0.790 1.00 0.00 C ATOM 0 H LEU B 58 1.671 8.533 -2.814 1.00 0.00 H new ATOM 0 HA LEU B 58 2.559 6.720 -4.690 1.00 0.00 H new ATOM 0 HB2 LEU B 58 1.006 6.530 -2.092 1.00 0.00 H new ATOM 0 HB3 LEU B 58 1.126 5.047 -3.019 1.00 0.00 H new ATOM 0 HG LEU B 58 3.516 5.024 -2.830 1.00 0.00 H new ATOM 0 HD11 LEU B 58 4.794 6.649 -1.514 1.00 0.00 H new ATOM 0 HD12 LEU B 58 4.051 7.383 -2.955 1.00 0.00 H new ATOM 0 HD13 LEU B 58 3.335 7.655 -1.348 1.00 0.00 H new ATOM 0 HD21 LEU B 58 3.690 4.848 -0.313 1.00 0.00 H new ATOM 0 HD22 LEU B 58 2.167 5.758 -0.167 1.00 0.00 H new ATOM 0 HD23 LEU B 58 2.170 4.141 -0.911 1.00 0.00 H new ATOM 1005 N ALA B 59 -0.714 6.501 -4.811 1.00 0.00 N ATOM 1006 CA ALA B 59 -1.684 7.016 -5.802 1.00 0.00 C ATOM 1007 C ALA B 59 -1.260 7.588 -7.184 1.00 0.00 C ATOM 1008 O ALA B 59 -1.244 6.810 -8.114 1.00 0.00 O ATOM 1009 CB ALA B 59 -2.139 8.199 -4.960 1.00 0.00 C ATOM 0 H ALA B 59 -1.097 6.361 -3.876 1.00 0.00 H new ATOM 0 HA ALA B 59 -2.326 6.203 -6.143 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -2.895 8.764 -5.505 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -2.562 7.837 -4.023 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -1.286 8.844 -4.748 1.00 0.00 H new ATOM 1010 N ASP B 60 -0.904 8.872 -7.400 1.00 0.00 N ATOM 1011 CA ASP B 60 -0.614 9.345 -8.770 1.00 0.00 C ATOM 1012 C ASP B 60 0.655 8.831 -9.516 1.00 0.00 C ATOM 1013 O ASP B 60 0.707 8.972 -10.745 1.00 0.00 O ATOM 1014 CB ASP B 60 -0.659 10.897 -8.663 1.00 0.00 C ATOM 1015 CG ASP B 60 -2.067 11.484 -8.614 1.00 0.00 C ATOM 1016 OD1 ASP B 60 -2.750 11.512 -7.594 1.00 0.00 O ATOM 1017 OD2 ASP B 60 -2.479 11.969 -9.816 1.00 0.00 O ATOM 0 H ASP B 60 -0.812 9.579 -6.670 1.00 0.00 H new ATOM 0 HA ASP B 60 -1.363 8.903 -9.428 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -0.119 11.203 -7.767 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -0.130 11.323 -9.515 1.00 0.00 H new ATOM 1018 N GLU B 61 1.491 7.947 -8.906 1.00 0.00 N ATOM 1019 CA GLU B 61 2.054 6.800 -9.685 1.00 0.00 C ATOM 1020 C GLU B 61 0.847 5.975 -10.193 1.00 0.00 C ATOM 1021 O GLU B 61 0.252 6.451 -11.165 1.00 0.00 O ATOM 1022 CB GLU B 61 3.202 6.023 -8.983 1.00 0.00 C ATOM 1023 CG GLU B 61 3.876 4.910 -9.843 1.00 0.00 C ATOM 1024 CD GLU B 61 3.821 3.472 -9.334 1.00 0.00 C ATOM 1025 OE1 GLU B 61 2.559 3.078 -9.004 1.00 0.00 O ATOM 1026 OE2 GLU B 61 4.807 2.750 -9.251 1.00 0.00 O ATOM 0 H GLU B 61 1.781 7.995 -7.929 1.00 0.00 H new ATOM 0 HA GLU B 61 2.614 7.158 -10.549 1.00 0.00 H new ATOM 0 HB2 GLU B 61 3.967 6.736 -8.677 1.00 0.00 H new ATOM 0 HB3 GLU B 61 2.808 5.568 -8.074 1.00 0.00 H new ATOM 0 HG2 GLU B 61 3.418 4.931 -10.832 1.00 0.00 H new ATOM 0 HG3 GLU B 61 4.925 5.178 -9.971 1.00 0.00 H new ATOM 1027 N GLN B 62 0.309 4.932 -9.535 1.00 0.00 N ATOM 1028 CA GLN B 62 -0.829 4.238 -10.196 1.00 0.00 C ATOM 1029 C GLN B 62 -2.182 4.879 -9.839 1.00 0.00 C ATOM 1030 O GLN B 62 -2.777 4.790 -8.791 1.00 0.00 O ATOM 1031 CB GLN B 62 -0.632 2.726 -10.289 1.00 0.00 C ATOM 1032 CG GLN B 62 0.413 2.351 -11.393 1.00 0.00 C ATOM 1033 CD GLN B 62 0.064 2.646 -12.869 1.00 0.00 C ATOM 1034 OE1 GLN B 62 -0.401 1.784 -13.600 1.00 0.00 O ATOM 1035 NE2 GLN B 62 0.227 3.864 -13.355 1.00 0.00 N ATOM 0 H GLN B 62 0.604 4.570 -8.628 1.00 0.00 H new ATOM 0 HA GLN B 62 -0.855 4.424 -11.270 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -0.299 2.341 -9.325 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -1.585 2.247 -10.511 1.00 0.00 H new ATOM 0 HG2 GLN B 62 1.342 2.873 -11.161 1.00 0.00 H new ATOM 0 HG3 GLN B 62 0.617 1.284 -11.308 1.00 0.00 H new ATOM 0 HE21 GLN B 62 0.613 4.601 -12.765 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -0.033 4.067 -14.320 1.00 0.00 H new ATOM 1036 N SER B 63 -2.581 5.866 -10.614 1.00 0.00 N ATOM 1037 CA SER B 63 -3.000 5.642 -12.037 1.00 0.00 C ATOM 1038 C SER B 63 -2.315 6.417 -13.255 1.00 0.00 C ATOM 1039 O SER B 63 -2.923 6.477 -14.319 1.00 0.00 O ATOM 1040 CB SER B 63 -3.325 4.182 -12.379 1.00 0.00 C ATOM 1041 OG SER B 63 -4.129 3.989 -13.541 1.00 0.00 O ATOM 0 H SER B 63 -2.634 6.838 -10.311 1.00 0.00 H new ATOM 0 HA SER B 63 -3.917 6.228 -11.969 1.00 0.00 H new ATOM 0 HB2 SER B 63 -2.388 3.641 -12.512 1.00 0.00 H new ATOM 0 HB3 SER B 63 -3.834 3.732 -11.527 1.00 0.00 H new ATOM 0 HG SER B 63 -4.480 3.074 -13.548 1.00 0.00 H new ATOM 1042 N GLU B 64 -1.205 7.202 -13.152 1.00 0.00 N ATOM 1043 CA GLU B 64 -1.330 8.662 -13.416 1.00 0.00 C ATOM 1044 C GLU B 64 -1.804 9.422 -12.111 1.00 0.00 C ATOM 1045 O GLU B 64 -1.534 10.595 -11.855 1.00 0.00 O ATOM 1046 CB GLU B 64 0.027 9.141 -13.990 1.00 0.00 C ATOM 1047 CG GLU B 64 -0.062 10.501 -14.718 1.00 0.00 C ATOM 1048 CD GLU B 64 1.261 11.015 -15.272 1.00 0.00 C ATOM 1049 OE1 GLU B 64 1.624 10.380 -16.418 1.00 0.00 O ATOM 1050 OE2 GLU B 64 1.924 11.907 -14.755 1.00 0.00 O ATOM 0 H GLU B 64 -0.271 6.875 -12.904 1.00 0.00 H new ATOM 0 HA GLU B 64 -2.101 8.885 -14.153 1.00 0.00 H new ATOM 0 HB2 GLU B 64 0.750 9.218 -13.178 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.406 8.390 -14.683 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.774 10.412 -15.539 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.463 11.242 -14.027 1.00 0.00 H new ATOM 1051 N LEU B 65 -2.657 8.749 -11.325 1.00 0.00 N ATOM 1052 CA LEU B 65 -4.097 9.193 -11.144 1.00 0.00 C ATOM 1053 C LEU B 65 -5.033 8.517 -10.076 1.00 0.00 C ATOM 1054 O LEU B 65 -5.571 9.167 -9.181 1.00 0.00 O ATOM 1055 CB LEU B 65 -4.799 9.156 -12.554 1.00 0.00 C ATOM 1056 CG LEU B 65 -4.643 10.509 -13.268 1.00 0.00 C ATOM 1057 CD1 LEU B 65 -4.664 10.466 -14.793 1.00 0.00 C ATOM 1058 CD2 LEU B 65 -5.580 11.605 -12.752 1.00 0.00 C ATOM 0 H LEU B 65 -2.407 7.909 -10.803 1.00 0.00 H new ATOM 0 HA LEU B 65 -3.975 10.181 -10.700 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -4.363 8.364 -13.163 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -5.857 8.921 -12.434 1.00 0.00 H new ATOM 0 HG LEU B 65 -3.624 10.779 -12.990 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -4.546 11.475 -15.187 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -3.847 9.839 -15.151 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -5.614 10.053 -15.132 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -5.405 12.525 -13.309 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -6.615 11.291 -12.886 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -5.388 11.779 -11.693 1.00 0.00 H new ATOM 1059 N VAL B 66 -5.264 7.224 -10.286 1.00 0.00 N ATOM 1060 CA VAL B 66 -6.358 6.364 -9.751 1.00 0.00 C ATOM 1061 C VAL B 66 -7.834 6.827 -9.778 1.00 0.00 C ATOM 1062 O VAL B 66 -8.172 7.929 -9.362 1.00 0.00 O ATOM 1063 CB VAL B 66 -6.018 5.485 -8.511 1.00 0.00 C ATOM 1064 CG1 VAL B 66 -5.478 4.104 -8.936 1.00 0.00 C ATOM 1065 CG2 VAL B 66 -5.031 6.220 -7.614 1.00 0.00 C ATOM 0 H VAL B 66 -4.642 6.686 -10.889 1.00 0.00 H new ATOM 0 HA VAL B 66 -6.354 5.714 -10.626 1.00 0.00 H new ATOM 0 HB VAL B 66 -6.932 5.307 -7.945 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -5.250 3.514 -8.049 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -6.230 3.587 -9.532 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -4.572 4.234 -9.528 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -4.796 5.601 -6.748 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -4.117 6.426 -8.171 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -5.472 7.159 -7.280 1.00 0.00 H new TER 1066 VAL B 66