USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=25 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 11 MET CE :methyl -126:sc= -2.15 (180deg=-6.86!) USER MOD Set 1.2: B 30 MET CE :methyl 179:sc= -6.19! (180deg=-6.35!) USER MOD Set 2.1: A 39 GLN : amide:sc= 0.419 K(o=2.1,f=0.8) USER MOD Set 2.2: A 43 SER OG : rot -16:sc= 1.63 USER MOD Set 3.1: A 32 SER OG : rot 62:sc= 1.24 USER MOD Set 3.2: A 36 GLN : amide:sc= 1.04 K(o=2.3,f=-1.7) USER MOD Set 4.1: A 18 LYS NZ :NH3+ 142:sc= 0.221 (180deg=0) USER MOD Set 4.2: B 39 GLN : amide:sc= -0.0692 X(o=0.57,f=0.38) USER MOD Set 4.3: B 43 SER OG : rot 80:sc= 0.418 USER MOD Set 5.1: A 11 MET CE :methyl -178:sc= -1.73 (180deg=-1.76) USER MOD Set 5.2: A 30 MET CE :methyl 161:sc= -4.29! (180deg=-4.41!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc=-0.00121 X(o=-0.0012,f=-0.0012) USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 13 MET CE :methyl 177:sc= 0 (180deg=-0.00527) USER MOD Single : A 20 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.00839) USER MOD Single : A 26 ASN : amide:sc= -0.532 K(o=-0.53,f=-0.025) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 44 LYS NZ :NH3+ -153:sc= 0.502 (180deg=0.2) USER MOD Single : A 46 SER OG : rot 11:sc= 0.103 USER MOD Single : A 49 THR OG1 : rot 59:sc= 0.863 USER MOD Single : A 51 TYR OH : rot 180:sc= -0.618 USER MOD Single : A 53 ASN : amide:sc= -0.634 K(o=-0.63,f=-2.7) USER MOD Single : A 62 GLN : amide:sc= -2.97! K(o=-3!,f=-0.47) USER MOD Single : A 63 SER OG : rot -29:sc= 0.53 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 HIS : no HD1:sc=-0.00701 X(o=-0.007,f=-0.31) USER MOD Single : B 8 ASN : amide:sc= -0.0127 X(o=-0.013,f=-0.29) USER MOD Single : B 13 MET CE :methyl -157:sc= -0.473 (180deg=-1.95!) USER MOD Single : B 18 LYS NZ :NH3+ 149:sc= 0.359 (180deg=-0.348) USER MOD Single : B 20 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0101) USER MOD Single : B 26 ASN : amide:sc= -0.0791 K(o=-0.079,f=-2.2!) USER MOD Single : B 29 SER OG : rot 56:sc= 1.25 USER MOD Single : B 31 ASN : amide:sc= -0.339 K(o=-0.34,f=-1.4) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 36 GLN : amide:sc= -1.27 K(o=-1.3,f=-3.3) 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= 0.337 USER MOD Single : B 51 TYR OH : rot -17:sc= 0.824 USER MOD Single : B 53 ASN : amide:sc= -8.47! C(o=-8.5!,f=-5.9!) USER MOD Single : B 62 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.19) USER MOD Single : B 63 SER OG : rot 130:sc= 0.00123 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 13.646 -19.681 -1.346 1.00 0.00 N ATOM 2 CA ALA A 1 15.032 -19.232 -1.613 1.00 0.00 C ATOM 3 C ALA A 1 15.236 -17.695 -1.424 1.00 0.00 C ATOM 4 O ALA A 1 14.424 -16.874 -1.864 1.00 0.00 O ATOM 5 CB ALA A 1 15.384 -19.692 -3.038 1.00 0.00 C ATOM 0 H1 ALA A 1 13.580 -20.709 -1.490 1.00 0.00 H new ATOM 0 H2 ALA A 1 13.390 -19.451 -0.365 1.00 0.00 H new ATOM 0 H3 ALA A 1 12.993 -19.198 -1.996 1.00 0.00 H new ATOM 0 HA ALA A 1 15.706 -19.679 -0.882 1.00 0.00 H new ATOM 0 HB1 ALA A 1 16.401 -19.382 -3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 1 15.312 -20.778 -3.098 1.00 0.00 H new ATOM 0 HB3 ALA A 1 14.689 -19.242 -3.747 1.00 0.00 H new ATOM 6 N ARG A 2 16.359 -17.295 -0.803 1.00 0.00 N ATOM 7 CA ARG A 2 16.664 -15.859 -0.513 1.00 0.00 C ATOM 8 C ARG A 2 17.236 -15.077 -1.752 1.00 0.00 C ATOM 9 O ARG A 2 18.422 -14.747 -1.839 1.00 0.00 O ATOM 10 CB ARG A 2 17.591 -15.805 0.733 1.00 0.00 C ATOM 11 CG ARG A 2 16.935 -16.202 2.084 1.00 0.00 C ATOM 12 CD ARG A 2 17.914 -16.201 3.273 1.00 0.00 C ATOM 13 NE ARG A 2 18.817 -17.381 3.200 1.00 0.00 N ATOM 14 CZ ARG A 2 19.830 -17.627 4.020 1.00 0.00 C ATOM 15 NH1 ARG A 2 20.176 -16.862 5.013 1.00 0.00 N ATOM 16 NH2 ARG A 2 20.512 -18.697 3.813 1.00 0.00 N ATOM 0 H ARG A 2 17.082 -17.940 -0.486 1.00 0.00 H new ATOM 0 HA ARG A 2 15.735 -15.334 -0.292 1.00 0.00 H new ATOM 0 HB2 ARG A 2 18.442 -16.463 0.557 1.00 0.00 H new ATOM 0 HB3 ARG A 2 17.984 -14.793 0.826 1.00 0.00 H new ATOM 0 HG2 ARG A 2 16.118 -15.513 2.297 1.00 0.00 H new ATOM 0 HG3 ARG A 2 16.497 -17.195 1.987 1.00 0.00 H new ATOM 0 HD2 ARG A 2 18.502 -15.283 3.267 1.00 0.00 H new ATOM 0 HD3 ARG A 2 17.358 -16.217 4.210 1.00 0.00 H new ATOM 0 HE ARG A 2 18.642 -18.058 2.457 1.00 0.00 H new ATOM 0 HH11 ARG A 2 19.655 -16.006 5.203 1.00 0.00 H new ATOM 0 HH12 ARG A 2 20.969 -17.118 5.602 1.00 0.00 H new ATOM 0 HH21 ARG A 2 20.265 -19.318 3.042 1.00 0.00 H new ATOM 0 HH22 ARG A 2 21.300 -18.925 4.420 1.00 0.00 H new ATOM 17 N ASP A 3 16.358 -14.754 -2.715 1.00 0.00 N ATOM 18 CA ASP A 3 16.682 -13.920 -3.905 1.00 0.00 C ATOM 19 C ASP A 3 15.421 -13.283 -4.563 1.00 0.00 C ATOM 20 O ASP A 3 15.442 -12.118 -4.956 1.00 0.00 O ATOM 21 CB ASP A 3 17.569 -14.702 -4.917 1.00 0.00 C ATOM 22 CG ASP A 3 18.223 -13.829 -5.980 1.00 0.00 C ATOM 23 OD1 ASP A 3 19.385 -13.269 -5.538 1.00 0.00 O ATOM 24 OD2 ASP A 3 17.741 -13.648 -7.094 1.00 0.00 O ATOM 0 H ASP A 3 15.387 -15.065 -2.697 1.00 0.00 H new ATOM 0 HA ASP A 3 17.273 -13.075 -3.552 1.00 0.00 H new ATOM 0 HB2 ASP A 3 18.348 -15.230 -4.367 1.00 0.00 H new ATOM 0 HB3 ASP A 3 16.958 -15.458 -5.410 1.00 0.00 H new ATOM 25 N ASP A 4 14.320 -14.019 -4.689 1.00 0.00 N ATOM 26 CA ASP A 4 12.986 -13.419 -4.942 1.00 0.00 C ATOM 27 C ASP A 4 11.912 -14.282 -4.190 1.00 0.00 C ATOM 28 O ASP A 4 11.356 -15.201 -4.801 1.00 0.00 O ATOM 29 CB ASP A 4 12.683 -13.243 -6.455 1.00 0.00 C ATOM 30 CG ASP A 4 13.748 -12.728 -7.431 1.00 0.00 C ATOM 31 OD1 ASP A 4 14.673 -13.678 -7.735 1.00 0.00 O ATOM 32 OD2 ASP A 4 13.764 -11.594 -7.896 1.00 0.00 O ATOM 0 H ASP A 4 14.312 -15.037 -4.622 1.00 0.00 H new ATOM 0 HA ASP A 4 12.963 -12.402 -4.549 1.00 0.00 H new ATOM 0 HB2 ASP A 4 12.355 -14.213 -6.827 1.00 0.00 H new ATOM 0 HB3 ASP A 4 11.831 -12.568 -6.531 1.00 0.00 H new ATOM 33 N PRO A 5 11.632 -14.119 -2.863 1.00 0.00 N ATOM 34 CA PRO A 5 11.086 -15.230 -2.041 1.00 0.00 C ATOM 35 C PRO A 5 9.556 -15.154 -1.827 1.00 0.00 C ATOM 36 O PRO A 5 8.973 -14.074 -1.673 1.00 0.00 O ATOM 37 CB PRO A 5 11.888 -15.095 -0.725 1.00 0.00 C ATOM 38 CG PRO A 5 12.884 -13.960 -0.961 1.00 0.00 C ATOM 39 CD PRO A 5 12.215 -13.083 -1.993 1.00 0.00 C ATOM 0 HA PRO A 5 11.200 -16.202 -2.520 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.229 -14.869 0.113 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.404 -16.024 -0.484 1.00 0.00 H new ATOM 0 HG2 PRO A 5 13.085 -13.410 -0.042 1.00 0.00 H new ATOM 0 HG3 PRO A 5 13.840 -14.339 -1.321 1.00 0.00 H new ATOM 0 HD2 PRO A 5 11.459 -12.429 -1.558 1.00 0.00 H new ATOM 0 HD3 PRO A 5 12.923 -12.445 -2.521 1.00 0.00 H new ATOM 40 N HIS A 6 8.950 -16.342 -1.753 1.00 0.00 N ATOM 41 CA HIS A 6 7.523 -16.518 -1.405 1.00 0.00 C ATOM 42 C HIS A 6 7.193 -16.134 0.075 1.00 0.00 C ATOM 43 O HIS A 6 7.786 -16.660 1.024 1.00 0.00 O ATOM 44 CB HIS A 6 7.162 -18.021 -1.616 1.00 0.00 C ATOM 45 CG HIS A 6 7.093 -18.514 -3.056 1.00 0.00 C ATOM 46 ND1 HIS A 6 8.167 -19.057 -3.741 1.00 0.00 N ATOM 47 CD2 HIS A 6 5.968 -18.417 -3.882 1.00 0.00 C ATOM 48 CE1 HIS A 6 7.579 -19.219 -4.972 1.00 0.00 C ATOM 49 NE2 HIS A 6 6.260 -18.891 -5.148 1.00 0.00 N ATOM 0 H HIS A 6 9.434 -17.222 -1.933 1.00 0.00 H new ATOM 0 HA HIS A 6 6.943 -15.853 -2.044 1.00 0.00 H new ATOM 0 HB2 HIS A 6 7.897 -18.625 -1.085 1.00 0.00 H new ATOM 0 HB3 HIS A 6 6.196 -18.208 -1.146 1.00 0.00 H new ATOM 0 HD2 HIS A 6 5.009 -18.028 -3.575 1.00 0.00 H new ATOM 0 HE1 HIS A 6 8.155 -19.604 -5.800 1.00 0.00 H new ATOM 0 HE2 HIS A 6 5.666 -18.973 -5.973 1.00 0.00 H new ATOM 50 N PHE A 7 6.080 -15.434 0.301 1.00 0.00 N ATOM 51 CA PHE A 7 4.988 -16.056 1.092 1.00 0.00 C ATOM 52 C PHE A 7 3.674 -16.129 0.251 1.00 0.00 C ATOM 53 O PHE A 7 3.548 -15.546 -0.831 1.00 0.00 O ATOM 54 CB PHE A 7 4.924 -15.431 2.512 1.00 0.00 C ATOM 55 CG PHE A 7 4.412 -13.993 2.702 1.00 0.00 C ATOM 56 CD1 PHE A 7 5.219 -12.873 2.433 1.00 0.00 C ATOM 57 CD2 PHE A 7 3.167 -13.796 3.310 1.00 0.00 C ATOM 58 CE1 PHE A 7 4.800 -11.602 2.804 1.00 0.00 C ATOM 59 CE2 PHE A 7 2.757 -12.524 3.660 1.00 0.00 C ATOM 60 CZ PHE A 7 3.579 -11.444 3.443 1.00 0.00 C ATOM 0 H PHE A 7 5.903 -14.485 -0.028 1.00 0.00 H new ATOM 0 HA PHE A 7 5.188 -17.106 1.304 1.00 0.00 H new ATOM 0 HB2 PHE A 7 4.297 -16.081 3.123 1.00 0.00 H new ATOM 0 HB3 PHE A 7 5.930 -15.474 2.930 1.00 0.00 H new ATOM 0 HD1 PHE A 7 6.169 -13.002 1.936 1.00 0.00 H new ATOM 0 HD2 PHE A 7 2.524 -14.641 3.506 1.00 0.00 H new ATOM 0 HE1 PHE A 7 5.420 -10.743 2.596 1.00 0.00 H new ATOM 0 HE2 PHE A 7 1.785 -12.377 4.107 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.271 -10.463 3.773 1.00 0.00 H new ATOM 61 N ASN A 8 2.672 -16.881 0.719 1.00 0.00 N ATOM 62 CA ASN A 8 1.304 -16.766 0.147 1.00 0.00 C ATOM 63 C ASN A 8 0.535 -15.679 0.951 1.00 0.00 C ATOM 64 O ASN A 8 -0.093 -15.998 1.966 1.00 0.00 O ATOM 65 CB ASN A 8 0.615 -18.154 0.104 1.00 0.00 C ATOM 66 CG ASN A 8 1.134 -19.123 -0.964 1.00 0.00 C ATOM 67 OD1 ASN A 8 1.777 -18.772 -1.947 1.00 0.00 O ATOM 68 ND2 ASN A 8 0.840 -20.389 -0.827 1.00 0.00 N ATOM 0 H ASN A 8 2.766 -17.562 1.472 1.00 0.00 H new ATOM 0 HA ASN A 8 1.327 -16.440 -0.893 1.00 0.00 H new ATOM 0 HB2 ASN A 8 0.728 -18.625 1.081 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.453 -18.004 -0.056 1.00 0.00 H new ATOM 0 HD21 ASN A 8 1.145 -21.062 -1.530 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.306 -20.704 -0.017 1.00 0.00 H new ATOM 69 N PHE A 9 0.588 -14.397 0.517 1.00 0.00 N ATOM 70 CA PHE A 9 -0.295 -13.356 1.065 1.00 0.00 C ATOM 71 C PHE A 9 -1.797 -13.638 0.769 1.00 0.00 C ATOM 72 O PHE A 9 -2.222 -14.352 -0.131 1.00 0.00 O ATOM 73 CB PHE A 9 0.242 -11.972 0.620 1.00 0.00 C ATOM 74 CG PHE A 9 -0.322 -10.770 1.398 1.00 0.00 C ATOM 75 CD1 PHE A 9 -0.373 -10.761 2.804 1.00 0.00 C ATOM 76 CD2 PHE A 9 -0.579 -9.573 0.721 1.00 0.00 C ATOM 77 CE1 PHE A 9 -0.662 -9.600 3.494 1.00 0.00 C ATOM 78 CE2 PHE A 9 -0.963 -8.437 1.409 1.00 0.00 C ATOM 79 CZ PHE A 9 -0.901 -8.438 2.784 1.00 0.00 C ATOM 0 H PHE A 9 1.229 -14.067 -0.205 1.00 0.00 H new ATOM 0 HA PHE A 9 -0.272 -13.361 2.155 1.00 0.00 H new ATOM 0 HB2 PHE A 9 1.327 -11.972 0.720 1.00 0.00 H new ATOM 0 HB3 PHE A 9 0.019 -11.837 -0.438 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.184 -11.673 3.350 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -0.476 -9.536 -0.353 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.701 -9.600 4.573 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.306 -7.563 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.042 -7.511 3.320 1.00 0.00 H new ATOM 80 N ARG A 10 -2.572 -13.139 1.695 1.00 0.00 N ATOM 81 CA ARG A 10 -3.766 -13.832 2.235 1.00 0.00 C ATOM 82 C ARG A 10 -4.741 -12.752 2.767 1.00 0.00 C ATOM 83 O ARG A 10 -4.582 -12.224 3.876 1.00 0.00 O ATOM 84 CB ARG A 10 -3.272 -14.815 3.331 1.00 0.00 C ATOM 85 CG ARG A 10 -4.223 -15.963 3.682 1.00 0.00 C ATOM 86 CD ARG A 10 -5.473 -15.604 4.493 1.00 0.00 C ATOM 87 NE ARG A 10 -6.055 -16.822 5.124 1.00 0.00 N ATOM 88 CZ ARG A 10 -5.735 -17.321 6.309 1.00 0.00 C ATOM 89 NH1 ARG A 10 -4.826 -16.824 7.091 1.00 0.00 N ATOM 90 NH2 ARG A 10 -6.381 -18.361 6.700 1.00 0.00 N ATOM 0 H ARG A 10 -2.409 -12.225 2.118 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.306 -14.413 1.487 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.323 -15.242 3.007 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.072 -14.245 4.238 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -4.545 -16.433 2.753 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -3.660 -16.712 4.240 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -5.217 -14.876 5.263 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -6.212 -15.135 3.844 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.769 -17.320 4.592 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.305 -15.995 6.805 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -4.633 -17.262 7.992 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.104 -18.766 6.105 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -6.171 -18.782 7.605 1.00 0.00 H new ATOM 91 N MET A 11 -5.688 -12.355 1.920 1.00 0.00 N ATOM 92 CA MET A 11 -6.383 -11.053 2.080 1.00 0.00 C ATOM 93 C MET A 11 -7.899 -11.241 2.397 1.00 0.00 C ATOM 94 O MET A 11 -8.618 -11.666 1.487 1.00 0.00 O ATOM 95 CB MET A 11 -6.182 -10.229 0.780 1.00 0.00 C ATOM 96 CG MET A 11 -4.923 -9.359 0.664 1.00 0.00 C ATOM 97 SD MET A 11 -3.495 -10.432 0.580 1.00 0.00 S ATOM 98 CE MET A 11 -2.962 -10.151 -1.108 1.00 0.00 C ATOM 0 H MET A 11 -5.999 -12.902 1.117 1.00 0.00 H new ATOM 0 HA MET A 11 -5.955 -10.519 2.929 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.186 -10.924 -0.060 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.049 -9.579 0.660 1.00 0.00 H new ATOM 0 HG2 MET A 11 -4.977 -8.731 -0.225 1.00 0.00 H new ATOM 0 HG3 MET A 11 -4.844 -8.691 1.522 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.098 -10.779 -1.326 1.00 0.00 H new ATOM 0 HE2 MET A 11 -3.773 -10.400 -1.792 1.00 0.00 H new ATOM 0 HE3 MET A 11 -2.690 -9.103 -1.234 1.00 0.00 H new ATOM 99 N PRO A 12 -8.471 -10.850 3.579 1.00 0.00 N ATOM 100 CA PRO A 12 -9.944 -10.648 3.738 1.00 0.00 C ATOM 101 C PRO A 12 -10.658 -9.909 2.564 1.00 0.00 C ATOM 102 O PRO A 12 -10.065 -9.030 1.928 1.00 0.00 O ATOM 103 CB PRO A 12 -10.023 -9.919 5.092 1.00 0.00 C ATOM 104 CG PRO A 12 -8.788 -10.399 5.860 1.00 0.00 C ATOM 105 CD PRO A 12 -7.701 -10.526 4.793 1.00 0.00 C ATOM 0 HA PRO A 12 -10.495 -11.588 3.714 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -10.013 -8.837 4.961 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -10.942 -10.167 5.623 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -8.502 -9.689 6.636 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -8.973 -11.353 6.354 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -7.136 -9.601 4.679 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -6.983 -11.309 5.038 1.00 0.00 H new ATOM 106 N MET A 13 -11.872 -10.343 2.194 1.00 0.00 N ATOM 107 CA MET A 13 -12.418 -10.066 0.833 1.00 0.00 C ATOM 108 C MET A 13 -12.502 -8.576 0.353 1.00 0.00 C ATOM 109 O MET A 13 -12.254 -8.318 -0.823 1.00 0.00 O ATOM 110 CB MET A 13 -13.731 -10.870 0.659 1.00 0.00 C ATOM 111 CG MET A 13 -14.385 -10.818 -0.739 1.00 0.00 C ATOM 112 SD MET A 13 -13.209 -10.908 -2.116 1.00 0.00 S ATOM 113 CE MET A 13 -12.397 -12.497 -1.895 1.00 0.00 C ATOM 0 H MET A 13 -12.495 -10.879 2.798 1.00 0.00 H new ATOM 0 HA MET A 13 -11.659 -10.415 0.133 1.00 0.00 H new ATOM 0 HB2 MET A 13 -13.529 -11.913 0.903 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.454 -10.506 1.389 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.093 -11.642 -0.827 1.00 0.00 H new ATOM 0 HG3 MET A 13 -14.958 -9.895 -0.825 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.700 -12.667 -2.716 1.00 0.00 H new ATOM 0 HE2 MET A 13 -11.853 -12.499 -0.951 1.00 0.00 H new ATOM 0 HE3 MET A 13 -13.145 -13.290 -1.884 1.00 0.00 H new ATOM 114 N GLU A 14 -12.731 -7.597 1.243 1.00 0.00 N ATOM 115 CA GLU A 14 -12.440 -6.170 0.933 1.00 0.00 C ATOM 116 C GLU A 14 -10.948 -5.813 0.608 1.00 0.00 C ATOM 117 O GLU A 14 -10.737 -5.138 -0.388 1.00 0.00 O ATOM 118 CB GLU A 14 -13.112 -5.227 1.967 1.00 0.00 C ATOM 119 CG GLU A 14 -12.395 -5.084 3.334 1.00 0.00 C ATOM 120 CD GLU A 14 -13.098 -4.153 4.314 1.00 0.00 C ATOM 121 OE1 GLU A 14 -12.927 -2.939 4.349 1.00 0.00 O ATOM 122 OE2 GLU A 14 -13.941 -4.818 5.147 1.00 0.00 O ATOM 0 H GLU A 14 -13.112 -7.755 2.176 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.909 -5.991 -0.035 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -13.199 -4.236 1.521 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.126 -5.585 2.148 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -12.304 -6.070 3.789 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.383 -4.717 3.164 1.00 0.00 H new ATOM 123 N VAL A 15 -9.911 -6.248 1.353 1.00 0.00 N ATOM 124 CA VAL A 15 -8.474 -6.044 0.960 1.00 0.00 C ATOM 125 C VAL A 15 -8.142 -6.639 -0.424 1.00 0.00 C ATOM 126 O VAL A 15 -7.537 -5.943 -1.226 1.00 0.00 O ATOM 127 CB VAL A 15 -7.444 -6.652 1.980 1.00 0.00 C ATOM 128 CG1 VAL A 15 -6.164 -5.811 2.040 1.00 0.00 C ATOM 129 CG2 VAL A 15 -7.889 -6.892 3.436 1.00 0.00 C ATOM 0 H VAL A 15 -10.028 -6.746 2.235 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.372 -4.959 0.944 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.305 -7.645 1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.470 -6.255 2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.701 -5.782 1.054 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.409 -4.797 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.061 -7.314 4.005 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.192 -5.946 3.884 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.730 -7.586 3.450 1.00 0.00 H new ATOM 130 N ARG A 16 -8.497 -7.899 -0.713 1.00 0.00 N ATOM 131 CA ARG A 16 -8.277 -8.445 -2.062 1.00 0.00 C ATOM 132 C ARG A 16 -9.213 -7.901 -3.156 1.00 0.00 C ATOM 133 O ARG A 16 -8.707 -7.706 -4.244 1.00 0.00 O ATOM 134 CB ARG A 16 -8.187 -9.980 -2.106 1.00 0.00 C ATOM 135 CG ARG A 16 -6.998 -10.404 -3.007 1.00 0.00 C ATOM 136 CD ARG A 16 -7.296 -11.732 -3.673 1.00 0.00 C ATOM 137 NE ARG A 16 -6.190 -12.067 -4.600 1.00 0.00 N ATOM 138 CZ ARG A 16 -6.175 -13.126 -5.403 1.00 0.00 C ATOM 139 NH1 ARG A 16 -7.063 -14.076 -5.383 1.00 0.00 N ATOM 140 NH2 ARG A 16 -5.228 -13.208 -6.268 1.00 0.00 N ATOM 0 H ARG A 16 -8.927 -8.546 -0.051 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.289 -8.059 -2.312 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -8.053 -10.376 -1.099 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.117 -10.398 -2.492 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -6.816 -9.642 -3.764 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.090 -10.484 -2.410 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -7.407 -12.513 -2.921 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.239 -11.677 -4.217 1.00 0.00 H new ATOM 0 HE ARG A 16 -5.384 -11.442 -4.624 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -7.836 -14.037 -4.719 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -6.986 -14.860 -6.031 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.521 -12.475 -6.321 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.184 -14.006 -6.901 1.00 0.00 H new ATOM 141 N GLU A 17 -10.489 -7.559 -2.948 1.00 0.00 N ATOM 142 CA GLU A 17 -11.190 -6.671 -3.912 1.00 0.00 C ATOM 143 C GLU A 17 -10.564 -5.243 -4.054 1.00 0.00 C ATOM 144 O GLU A 17 -10.457 -4.762 -5.170 1.00 0.00 O ATOM 145 CB GLU A 17 -12.694 -6.564 -3.596 1.00 0.00 C ATOM 146 CG GLU A 17 -13.533 -7.821 -3.925 1.00 0.00 C ATOM 147 CD GLU A 17 -15.030 -7.635 -3.713 1.00 0.00 C ATOM 148 OE1 GLU A 17 -15.605 -6.958 -4.747 1.00 0.00 O ATOM 149 OE2 GLU A 17 -15.635 -8.048 -2.730 1.00 0.00 O ATOM 0 H GLU A 17 -11.051 -7.865 -2.153 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.057 -7.157 -4.878 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.810 -6.338 -2.536 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.105 -5.719 -4.149 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.355 -8.104 -4.963 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.188 -8.649 -3.305 1.00 0.00 H new ATOM 150 N LYS A 18 -10.111 -4.569 -2.993 1.00 0.00 N ATOM 151 CA LYS A 18 -9.377 -3.282 -3.103 1.00 0.00 C ATOM 152 C LYS A 18 -7.957 -3.374 -3.751 1.00 0.00 C ATOM 153 O LYS A 18 -7.670 -2.618 -4.679 1.00 0.00 O ATOM 154 CB LYS A 18 -9.468 -2.529 -1.766 1.00 0.00 C ATOM 155 CG LYS A 18 -10.863 -2.132 -1.202 1.00 0.00 C ATOM 156 CD LYS A 18 -10.870 -1.489 0.210 1.00 0.00 C ATOM 157 CE LYS A 18 -10.220 -2.300 1.342 1.00 0.00 C ATOM 158 NZ LYS A 18 -10.419 -1.635 2.642 1.00 0.00 N ATOM 0 H LYS A 18 -10.236 -4.889 -2.033 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.878 -2.667 -3.851 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -8.974 -3.142 -1.012 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.884 -1.614 -1.866 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -11.329 -1.435 -1.899 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.489 -3.024 -1.176 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -10.364 -0.526 0.148 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.905 -1.288 0.487 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.649 -3.301 1.371 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.154 -2.416 1.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.592 -2.352 3.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.569 -1.088 2.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.237 -0.995 2.583 1.00 0.00 H new ATOM 159 N LEU A 19 -7.095 -4.306 -3.327 1.00 0.00 N ATOM 160 CA LEU A 19 -5.788 -4.602 -3.963 1.00 0.00 C ATOM 161 C LEU A 19 -5.946 -5.251 -5.388 1.00 0.00 C ATOM 162 O LEU A 19 -5.207 -4.890 -6.295 1.00 0.00 O ATOM 163 CB LEU A 19 -4.910 -5.247 -2.830 1.00 0.00 C ATOM 164 CG LEU A 19 -3.457 -4.781 -2.500 1.00 0.00 C ATOM 165 CD1 LEU A 19 -2.795 -5.913 -1.691 1.00 0.00 C ATOM 166 CD2 LEU A 19 -2.495 -4.308 -3.614 1.00 0.00 C ATOM 0 H LEU A 19 -7.283 -4.893 -2.514 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.206 -3.744 -4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.481 -5.151 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.848 -6.311 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.614 -3.840 -1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.774 -5.630 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.362 -6.086 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.781 -6.826 -2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.538 -4.029 -3.174 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.343 -5.115 -4.330 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.925 -3.446 -4.124 1.00 0.00 H new ATOM 167 N LYS A 20 -6.929 -6.133 -5.654 1.00 0.00 N ATOM 168 CA LYS A 20 -7.145 -6.774 -6.967 1.00 0.00 C ATOM 169 C LYS A 20 -8.099 -6.003 -7.942 1.00 0.00 C ATOM 170 O LYS A 20 -7.978 -6.203 -9.145 1.00 0.00 O ATOM 171 CB LYS A 20 -7.604 -8.225 -6.771 1.00 0.00 C ATOM 172 CG LYS A 20 -7.467 -9.144 -7.994 1.00 0.00 C ATOM 173 CD LYS A 20 -7.908 -10.587 -7.716 1.00 0.00 C ATOM 174 CE LYS A 20 -9.260 -10.749 -6.999 1.00 0.00 C ATOM 175 NZ LYS A 20 -9.628 -12.176 -6.948 1.00 0.00 N ATOM 0 H LYS A 20 -7.607 -6.425 -4.951 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.177 -6.749 -7.468 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.033 -8.658 -5.950 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.649 -8.216 -6.463 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.062 -8.740 -8.813 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.429 -9.145 -8.325 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.955 -11.121 -8.665 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.139 -11.072 -7.115 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.198 -10.343 -5.989 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.030 -10.183 -7.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.592 -12.273 -6.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.589 -12.579 -7.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.963 -12.684 -6.331 1.00 0.00 H new ATOM 176 N PHE A 21 -9.018 -5.118 -7.498 1.00 0.00 N ATOM 177 CA PHE A 21 -9.486 -3.969 -8.327 1.00 0.00 C ATOM 178 C PHE A 21 -8.337 -3.028 -8.627 1.00 0.00 C ATOM 179 O PHE A 21 -7.944 -3.080 -9.769 1.00 0.00 O ATOM 180 CB PHE A 21 -10.682 -3.162 -7.763 1.00 0.00 C ATOM 181 CG PHE A 21 -12.021 -3.872 -7.791 1.00 0.00 C ATOM 182 CD1 PHE A 21 -12.416 -4.689 -8.853 1.00 0.00 C ATOM 183 CD2 PHE A 21 -12.842 -3.738 -6.679 1.00 0.00 C ATOM 184 CE1 PHE A 21 -13.567 -5.448 -8.748 1.00 0.00 C ATOM 185 CE2 PHE A 21 -14.003 -4.482 -6.577 1.00 0.00 C ATOM 186 CZ PHE A 21 -14.375 -5.348 -7.610 1.00 0.00 C ATOM 0 H PHE A 21 -9.453 -5.170 -6.577 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.864 -4.437 -9.236 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -10.458 -2.887 -6.732 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.771 -2.234 -8.329 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -11.823 -4.728 -9.755 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -12.573 -3.050 -5.891 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -13.843 -6.120 -9.547 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -14.624 -4.394 -5.698 1.00 0.00 H new ATOM 0 HZ PHE A 21 -15.278 -5.935 -7.530 1.00 0.00 H new ATOM 187 N ARG A 22 -7.704 -2.267 -7.737 1.00 0.00 N ATOM 188 CA ARG A 22 -6.407 -1.595 -8.051 1.00 0.00 C ATOM 189 C ARG A 22 -5.464 -2.308 -9.131 1.00 0.00 C ATOM 190 O ARG A 22 -5.195 -1.721 -10.181 1.00 0.00 O ATOM 191 CB ARG A 22 -5.850 -1.173 -6.677 1.00 0.00 C ATOM 192 CG ARG A 22 -4.804 -0.057 -6.838 1.00 0.00 C ATOM 193 CD ARG A 22 -4.570 0.723 -5.550 1.00 0.00 C ATOM 194 NE ARG A 22 -3.503 1.726 -5.778 1.00 0.00 N ATOM 195 CZ ARG A 22 -3.661 2.922 -6.340 1.00 0.00 C ATOM 196 NH1 ARG A 22 -4.792 3.397 -6.764 1.00 0.00 N ATOM 197 NH2 ARG A 22 -2.616 3.646 -6.489 1.00 0.00 N ATOM 0 H ARG A 22 -8.050 -2.090 -6.794 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.525 -0.702 -8.665 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.663 -0.827 -6.039 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -5.399 -2.033 -6.181 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.862 -0.493 -7.169 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -5.129 0.630 -7.619 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.490 1.217 -5.237 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -4.283 0.045 -4.746 1.00 0.00 H new ATOM 0 HE ARG A 22 -2.561 1.477 -5.476 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -5.643 2.842 -6.677 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.830 4.326 -7.184 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.707 3.299 -6.181 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -2.692 4.570 -6.915 1.00 0.00 H new ATOM 198 N ALA A 23 -5.272 -3.647 -9.041 1.00 0.00 N ATOM 199 CA ALA A 23 -4.927 -4.519 -10.207 1.00 0.00 C ATOM 200 C ALA A 23 -5.868 -4.473 -11.475 1.00 0.00 C ATOM 201 O ALA A 23 -5.542 -3.799 -12.452 1.00 0.00 O ATOM 202 CB ALA A 23 -4.589 -5.912 -9.609 1.00 0.00 C ATOM 0 H ALA A 23 -5.350 -4.159 -8.162 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.058 -4.112 -10.723 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.327 -6.599 -10.413 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.747 -5.819 -8.923 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -5.455 -6.297 -9.071 1.00 0.00 H new ATOM 203 N GLU A 24 -7.012 -5.163 -11.477 1.00 0.00 N ATOM 204 CA GLU A 24 -7.968 -5.228 -12.630 1.00 0.00 C ATOM 205 C GLU A 24 -8.736 -3.916 -13.054 1.00 0.00 C ATOM 206 O GLU A 24 -8.943 -3.675 -14.243 1.00 0.00 O ATOM 207 CB GLU A 24 -8.950 -6.412 -12.383 1.00 0.00 C ATOM 208 CG GLU A 24 -8.358 -7.835 -12.141 1.00 0.00 C ATOM 209 CD GLU A 24 -7.315 -8.357 -13.131 1.00 0.00 C ATOM 210 OE1 GLU A 24 -7.748 -8.309 -14.420 1.00 0.00 O ATOM 211 OE2 GLU A 24 -6.215 -8.788 -12.799 1.00 0.00 O ATOM 0 H GLU A 24 -7.322 -5.708 -10.672 1.00 0.00 H new ATOM 0 HA GLU A 24 -7.333 -5.380 -13.503 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.564 -6.158 -11.519 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.618 -6.473 -13.242 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -7.910 -7.846 -11.147 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -9.187 -8.543 -12.125 1.00 0.00 H new ATOM 212 N ALA A 25 -9.136 -3.077 -12.088 1.00 0.00 N ATOM 213 CA ALA A 25 -9.405 -1.624 -12.264 1.00 0.00 C ATOM 214 C ALA A 25 -8.364 -0.815 -13.152 1.00 0.00 C ATOM 215 O ALA A 25 -8.780 -0.106 -14.070 1.00 0.00 O ATOM 216 CB ALA A 25 -9.456 -0.953 -10.872 1.00 0.00 C ATOM 0 H ALA A 25 -9.289 -3.390 -11.129 1.00 0.00 H new ATOM 0 HA ALA A 25 -10.350 -1.585 -12.806 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.653 0.113 -10.989 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.250 -1.406 -10.279 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -8.501 -1.092 -10.366 1.00 0.00 H new ATOM 217 N ASN A 26 -7.028 -0.906 -12.875 1.00 0.00 N ATOM 218 CA ASN A 26 -5.978 -0.284 -13.749 1.00 0.00 C ATOM 219 C ASN A 26 -5.610 -1.073 -15.059 1.00 0.00 C ATOM 220 O ASN A 26 -5.425 -0.463 -16.112 1.00 0.00 O ATOM 221 CB ASN A 26 -4.665 -0.077 -12.936 1.00 0.00 C ATOM 222 CG ASN A 26 -4.662 0.916 -11.775 1.00 0.00 C ATOM 223 OD1 ASN A 26 -5.383 1.902 -11.709 1.00 0.00 O ATOM 224 ND2 ASN A 26 -3.800 0.688 -10.824 1.00 0.00 N ATOM 0 H ASN A 26 -6.654 -1.398 -12.063 1.00 0.00 H new ATOM 0 HA ASN A 26 -6.429 0.653 -14.074 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -4.367 -1.048 -12.540 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -3.890 0.233 -13.636 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.731 1.329 -10.034 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.195 -0.132 -10.870 1.00 0.00 H new ATOM 225 N GLY A 27 -5.381 -2.392 -14.963 1.00 0.00 N ATOM 226 CA GLY A 27 -4.522 -3.159 -15.923 1.00 0.00 C ATOM 227 C GLY A 27 -3.195 -3.758 -15.367 1.00 0.00 C ATOM 228 O GLY A 27 -2.193 -3.818 -16.078 1.00 0.00 O ATOM 0 H GLY A 27 -5.779 -2.971 -14.223 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.117 -3.976 -16.331 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.273 -2.500 -16.755 1.00 0.00 H new ATOM 229 N ARG A 28 -3.183 -4.218 -14.110 1.00 0.00 N ATOM 230 CA ARG A 28 -2.028 -4.865 -13.426 1.00 0.00 C ATOM 231 C ARG A 28 -2.636 -6.171 -12.786 1.00 0.00 C ATOM 232 O ARG A 28 -3.851 -6.290 -12.593 1.00 0.00 O ATOM 233 CB ARG A 28 -1.398 -3.785 -12.491 1.00 0.00 C ATOM 234 CG ARG A 28 -0.929 -2.447 -13.141 1.00 0.00 C ATOM 235 CD ARG A 28 -0.117 -1.478 -12.258 1.00 0.00 C ATOM 236 NE ARG A 28 -0.857 -0.951 -11.080 1.00 0.00 N ATOM 237 CZ ARG A 28 -0.337 -0.142 -10.155 1.00 0.00 C ATOM 238 NH1 ARG A 28 0.875 0.306 -10.182 1.00 0.00 N ATOM 239 NH2 ARG A 28 -1.070 0.214 -9.161 1.00 0.00 N ATOM 0 H ARG A 28 -4.004 -4.153 -13.508 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.186 -5.196 -14.033 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.127 -3.544 -11.718 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.540 -4.234 -11.991 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -0.327 -2.690 -14.017 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.812 -1.918 -13.498 1.00 0.00 H new ATOM 0 HD2 ARG A 28 0.780 -1.989 -11.909 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.213 -0.638 -12.870 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.833 -1.228 -10.972 1.00 0.00 H new ATOM 0 HH11 ARG A 28 1.499 0.043 -10.945 1.00 0.00 H new ATOM 0 HH12 ARG A 28 1.208 0.922 -9.440 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -2.031 -0.121 -9.090 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -0.691 0.832 -8.443 1.00 0.00 H new ATOM 240 N SER A 29 -1.861 -7.231 -12.519 1.00 0.00 N ATOM 241 CA SER A 29 -2.461 -8.544 -12.079 1.00 0.00 C ATOM 242 C SER A 29 -1.778 -8.951 -10.762 1.00 0.00 C ATOM 243 O SER A 29 -0.574 -9.141 -10.799 1.00 0.00 O ATOM 244 CB SER A 29 -2.364 -9.588 -13.219 1.00 0.00 C ATOM 245 OG SER A 29 -1.024 -9.833 -13.650 1.00 0.00 O ATOM 0 H SER A 29 -0.844 -7.230 -12.590 1.00 0.00 H new ATOM 0 HA SER A 29 -3.529 -8.463 -11.876 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.807 -10.525 -12.882 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.954 -9.244 -14.068 1.00 0.00 H new ATOM 0 HG SER A 29 -1.028 -10.500 -14.368 1.00 0.00 H new ATOM 246 N MET A 30 -2.425 -8.934 -9.579 1.00 0.00 N ATOM 247 CA MET A 30 -1.759 -8.412 -8.345 1.00 0.00 C ATOM 248 C MET A 30 -0.298 -8.836 -8.001 1.00 0.00 C ATOM 249 O MET A 30 0.446 -7.988 -7.545 1.00 0.00 O ATOM 250 CB MET A 30 -2.574 -8.615 -7.061 1.00 0.00 C ATOM 251 CG MET A 30 -3.409 -7.461 -6.554 1.00 0.00 C ATOM 252 SD MET A 30 -3.117 -7.281 -4.804 1.00 0.00 S ATOM 253 CE MET A 30 -4.507 -8.203 -4.236 1.00 0.00 C ATOM 0 H MET A 30 -3.381 -9.263 -9.442 1.00 0.00 H new ATOM 0 HA MET A 30 -1.704 -7.372 -8.666 1.00 0.00 H new ATOM 0 HB2 MET A 30 -3.240 -9.463 -7.220 1.00 0.00 H new ATOM 0 HB3 MET A 30 -1.881 -8.898 -6.268 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.145 -6.543 -7.079 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.466 -7.645 -6.745 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.345 -8.505 -3.201 1.00 0.00 H new ATOM 0 HE2 MET A 30 -5.403 -7.586 -4.298 1.00 0.00 H new ATOM 0 HE3 MET A 30 -4.634 -9.090 -4.857 1.00 0.00 H new ATOM 254 N ASN A 31 0.206 -10.055 -8.186 1.00 0.00 N ATOM 255 CA ASN A 31 1.691 -10.252 -8.165 1.00 0.00 C ATOM 256 C ASN A 31 2.509 -9.199 -9.044 1.00 0.00 C ATOM 257 O ASN A 31 3.338 -8.486 -8.483 1.00 0.00 O ATOM 258 CB ASN A 31 2.012 -11.749 -8.407 1.00 0.00 C ATOM 259 CG ASN A 31 3.467 -12.173 -8.211 1.00 0.00 C ATOM 260 OD1 ASN A 31 4.078 -12.805 -9.060 1.00 0.00 O ATOM 261 ND2 ASN A 31 4.067 -11.858 -7.096 1.00 0.00 N ATOM 0 H ASN A 31 -0.345 -10.898 -8.347 1.00 0.00 H new ATOM 0 HA ASN A 31 2.066 -10.011 -7.171 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.390 -12.344 -7.738 1.00 0.00 H new ATOM 0 HB3 ASN A 31 1.717 -12.001 -9.426 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.035 -12.139 -6.941 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.568 -11.331 -6.380 1.00 0.00 H new ATOM 262 N SER A 32 2.084 -8.931 -10.298 1.00 0.00 N ATOM 263 CA SER A 32 2.168 -7.570 -10.923 1.00 0.00 C ATOM 264 C SER A 32 1.639 -6.358 -10.091 1.00 0.00 C ATOM 265 O SER A 32 2.481 -5.624 -9.581 1.00 0.00 O ATOM 266 CB SER A 32 1.703 -7.625 -12.404 1.00 0.00 C ATOM 267 OG SER A 32 1.525 -6.328 -12.983 1.00 0.00 O ATOM 0 H SER A 32 1.675 -9.637 -10.910 1.00 0.00 H new ATOM 0 HA SER A 32 3.228 -7.315 -10.916 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.436 -8.180 -12.989 1.00 0.00 H new ATOM 0 HB3 SER A 32 0.764 -8.176 -12.464 1.00 0.00 H new ATOM 0 HG SER A 32 2.382 -5.852 -12.990 1.00 0.00 H new ATOM 268 N GLU A 33 0.333 -6.083 -9.926 1.00 0.00 N ATOM 269 CA GLU A 33 -0.094 -4.801 -9.261 1.00 0.00 C ATOM 270 C GLU A 33 0.349 -4.536 -7.807 1.00 0.00 C ATOM 271 O GLU A 33 0.842 -3.447 -7.518 1.00 0.00 O ATOM 272 CB GLU A 33 -1.607 -4.637 -9.187 1.00 0.00 C ATOM 273 CG GLU A 33 -2.036 -3.178 -8.837 1.00 0.00 C ATOM 274 CD GLU A 33 -2.308 -2.846 -7.367 1.00 0.00 C ATOM 275 OE1 GLU A 33 -2.881 -3.868 -6.701 1.00 0.00 O ATOM 276 OE2 GLU A 33 -2.001 -1.794 -6.830 1.00 0.00 O ATOM 0 H GLU A 33 -0.430 -6.691 -10.224 1.00 0.00 H new ATOM 0 HA GLU A 33 0.418 -4.107 -9.927 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.047 -4.922 -10.143 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.006 -5.319 -8.437 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.256 -2.505 -9.193 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.938 -2.949 -9.404 1.00 0.00 H new ATOM 277 N LEU A 34 0.073 -5.484 -6.884 1.00 0.00 N ATOM 278 CA LEU A 34 0.650 -5.508 -5.531 1.00 0.00 C ATOM 279 C LEU A 34 2.169 -5.160 -5.696 1.00 0.00 C ATOM 280 O LEU A 34 2.532 -4.121 -5.176 1.00 0.00 O ATOM 281 CB LEU A 34 0.325 -6.871 -4.851 1.00 0.00 C ATOM 282 CG LEU A 34 0.031 -7.000 -3.332 1.00 0.00 C ATOM 283 CD1 LEU A 34 0.148 -8.438 -2.803 1.00 0.00 C ATOM 284 CD2 LEU A 34 0.716 -6.105 -2.300 1.00 0.00 C ATOM 0 H LEU A 34 -0.564 -6.260 -7.064 1.00 0.00 H new ATOM 0 HA LEU A 34 0.224 -4.771 -4.850 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.541 -7.280 -5.371 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.165 -7.532 -5.063 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.988 -6.619 -3.391 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.071 -8.452 -1.735 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.562 -9.077 -3.327 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.160 -8.806 -2.971 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.364 -6.366 -1.302 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.795 -6.248 -2.353 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.478 -5.062 -2.508 1.00 0.00 H new ATOM 285 N LEU A 35 3.026 -5.829 -6.538 1.00 0.00 N ATOM 286 CA LEU A 35 4.446 -5.389 -6.668 1.00 0.00 C ATOM 287 C LEU A 35 4.659 -3.971 -7.236 1.00 0.00 C ATOM 288 O LEU A 35 5.475 -3.222 -6.711 1.00 0.00 O ATOM 289 CB LEU A 35 5.345 -6.365 -7.471 1.00 0.00 C ATOM 290 CG LEU A 35 5.883 -7.589 -6.712 1.00 0.00 C ATOM 291 CD1 LEU A 35 6.763 -8.418 -7.636 1.00 0.00 C ATOM 292 CD2 LEU A 35 6.683 -7.143 -5.466 1.00 0.00 C ATOM 0 H LEU A 35 2.769 -6.635 -7.108 1.00 0.00 H new ATOM 0 HA LEU A 35 4.752 -5.383 -5.622 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.778 -6.720 -8.332 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.195 -5.804 -7.859 1.00 0.00 H new ATOM 0 HG LEU A 35 5.042 -8.198 -6.379 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.143 -9.285 -7.095 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.178 -8.752 -8.493 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.600 -7.811 -7.983 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.057 -8.021 -4.940 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.523 -6.521 -5.776 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.034 -6.572 -4.802 1.00 0.00 H new ATOM 293 N GLN A 36 3.942 -3.611 -8.297 1.00 0.00 N ATOM 294 CA GLN A 36 4.026 -2.263 -8.902 1.00 0.00 C ATOM 295 C GLN A 36 3.610 -1.126 -7.948 1.00 0.00 C ATOM 296 O GLN A 36 4.383 -0.179 -7.884 1.00 0.00 O ATOM 297 CB GLN A 36 3.271 -2.188 -10.257 1.00 0.00 C ATOM 298 CG GLN A 36 4.033 -2.666 -11.515 1.00 0.00 C ATOM 299 CD GLN A 36 4.267 -4.166 -11.662 1.00 0.00 C ATOM 300 OE1 GLN A 36 3.685 -4.857 -12.492 1.00 0.00 O ATOM 301 NE2 GLN A 36 5.113 -4.721 -10.840 1.00 0.00 N ATOM 0 H GLN A 36 3.286 -4.234 -8.768 1.00 0.00 H new ATOM 0 HA GLN A 36 5.085 -2.100 -9.104 1.00 0.00 H new ATOM 0 HB2 GLN A 36 2.359 -2.778 -10.169 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.967 -1.154 -10.418 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.485 -2.322 -12.392 1.00 0.00 H new ATOM 0 HG3 GLN A 36 5.003 -2.170 -11.531 1.00 0.00 H new ATOM 0 HE21 GLN A 36 5.600 -4.152 -10.148 1.00 0.00 H new ATOM 0 HE22 GLN A 36 5.288 -5.725 -10.889 1.00 0.00 H new ATOM 302 N ILE A 37 2.511 -1.227 -7.178 1.00 0.00 N ATOM 303 CA ILE A 37 2.257 -0.300 -6.044 1.00 0.00 C ATOM 304 C ILE A 37 3.212 -0.477 -4.818 1.00 0.00 C ATOM 305 O ILE A 37 3.406 0.498 -4.134 1.00 0.00 O ATOM 306 CB ILE A 37 0.743 -0.394 -5.626 1.00 0.00 C ATOM 307 CG1 ILE A 37 0.041 0.959 -5.325 1.00 0.00 C ATOM 308 CG2 ILE A 37 0.496 -1.437 -4.503 1.00 0.00 C ATOM 309 CD1 ILE A 37 0.578 1.831 -4.175 1.00 0.00 C ATOM 0 H ILE A 37 1.787 -1.932 -7.313 1.00 0.00 H new ATOM 0 HA ILE A 37 2.485 0.703 -6.405 1.00 0.00 H new ATOM 0 HB ILE A 37 0.255 -0.754 -6.532 1.00 0.00 H new ATOM 0 HG12 ILE A 37 0.072 1.557 -6.236 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.008 0.748 -5.118 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.565 -1.460 -4.254 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.809 -2.423 -4.847 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.070 -1.162 -3.618 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.021 2.739 -4.096 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.519 1.275 -3.239 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.616 2.097 -4.374 1.00 0.00 H new ATOM 310 N VAL A 38 3.669 -1.677 -4.445 1.00 0.00 N ATOM 311 CA VAL A 38 4.464 -1.981 -3.215 1.00 0.00 C ATOM 312 C VAL A 38 5.962 -1.536 -3.369 1.00 0.00 C ATOM 313 O VAL A 38 6.528 -0.933 -2.461 1.00 0.00 O ATOM 314 CB VAL A 38 4.423 -3.518 -2.999 1.00 0.00 C ATOM 315 CG1 VAL A 38 5.458 -4.269 -2.153 1.00 0.00 C ATOM 316 CG2 VAL A 38 3.074 -3.980 -2.452 1.00 0.00 C ATOM 0 H VAL A 38 3.496 -2.511 -5.006 1.00 0.00 H new ATOM 0 HA VAL A 38 4.037 -1.438 -2.372 1.00 0.00 H new ATOM 0 HB VAL A 38 4.666 -3.782 -4.028 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.222 -5.333 -2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.451 -4.119 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.438 -3.889 -1.131 1.00 0.00 H new ATOM 0 HG21 VAL A 38 3.088 -5.061 -2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.885 -3.496 -1.494 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.285 -3.713 -3.156 1.00 0.00 H new ATOM 317 N GLN A 39 6.618 -1.861 -4.511 1.00 0.00 N ATOM 318 CA GLN A 39 7.841 -1.184 -4.968 1.00 0.00 C ATOM 319 C GLN A 39 7.620 0.337 -5.273 1.00 0.00 C ATOM 320 O GLN A 39 8.462 1.144 -4.878 1.00 0.00 O ATOM 321 CB GLN A 39 8.204 -2.012 -6.232 1.00 0.00 C ATOM 322 CG GLN A 39 9.510 -1.661 -6.950 1.00 0.00 C ATOM 323 CD GLN A 39 10.780 -2.187 -6.294 1.00 0.00 C ATOM 324 OE1 GLN A 39 11.293 -3.252 -6.612 1.00 0.00 O ATOM 325 NE2 GLN A 39 11.324 -1.467 -5.358 1.00 0.00 N ATOM 0 H GLN A 39 6.306 -2.603 -5.137 1.00 0.00 H new ATOM 0 HA GLN A 39 8.634 -1.160 -4.220 1.00 0.00 H new ATOM 0 HB2 GLN A 39 8.248 -3.063 -5.946 1.00 0.00 H new ATOM 0 HB3 GLN A 39 7.388 -1.911 -6.947 1.00 0.00 H new ATOM 0 HG2 GLN A 39 9.460 -2.048 -7.968 1.00 0.00 H new ATOM 0 HG3 GLN A 39 9.583 -0.576 -7.025 1.00 0.00 H new ATOM 0 HE21 GLN A 39 10.902 -0.579 -5.088 1.00 0.00 H new ATOM 0 HE22 GLN A 39 12.173 -1.791 -4.894 1.00 0.00 H new ATOM 326 N ASP A 40 6.456 0.761 -5.832 1.00 0.00 N ATOM 327 CA ASP A 40 5.905 2.126 -5.532 1.00 0.00 C ATOM 328 C ASP A 40 5.997 2.602 -4.051 1.00 0.00 C ATOM 329 O ASP A 40 6.568 3.650 -3.744 1.00 0.00 O ATOM 330 CB ASP A 40 4.573 2.525 -6.227 1.00 0.00 C ATOM 331 CG ASP A 40 4.513 3.800 -7.062 1.00 0.00 C ATOM 332 OD1 ASP A 40 5.379 4.665 -7.098 1.00 0.00 O ATOM 333 OD2 ASP A 40 3.352 3.880 -7.763 1.00 0.00 O ATOM 0 H ASP A 40 5.891 0.205 -6.473 1.00 0.00 H new ATOM 0 HA ASP A 40 6.650 2.725 -6.057 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.282 1.697 -6.874 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.812 2.607 -5.451 1.00 0.00 H new ATOM 334 N ALA A 41 5.481 1.771 -3.150 1.00 0.00 N ATOM 335 CA ALA A 41 5.173 2.157 -1.763 1.00 0.00 C ATOM 336 C ALA A 41 6.350 2.255 -0.754 1.00 0.00 C ATOM 337 O ALA A 41 6.380 3.118 0.126 1.00 0.00 O ATOM 338 CB ALA A 41 3.987 1.266 -1.344 1.00 0.00 C ATOM 0 H ALA A 41 5.260 0.797 -3.358 1.00 0.00 H new ATOM 0 HA ALA A 41 4.905 3.213 -1.735 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.702 1.499 -0.318 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.141 1.451 -2.006 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.278 0.218 -1.411 1.00 0.00 H new ATOM 339 N LEU A 42 7.340 1.391 -0.937 1.00 0.00 N ATOM 340 CA LEU A 42 8.627 1.418 -0.190 1.00 0.00 C ATOM 341 C LEU A 42 9.915 1.453 -1.073 1.00 0.00 C ATOM 342 O LEU A 42 11.015 1.237 -0.559 1.00 0.00 O ATOM 343 CB LEU A 42 8.602 0.381 0.973 1.00 0.00 C ATOM 344 CG LEU A 42 7.792 -0.936 0.815 1.00 0.00 C ATOM 345 CD1 LEU A 42 8.485 -2.033 0.001 1.00 0.00 C ATOM 346 CD2 LEU A 42 7.416 -1.425 2.217 1.00 0.00 C ATOM 0 H LEU A 42 7.287 0.632 -1.616 1.00 0.00 H new ATOM 0 HA LEU A 42 8.710 2.396 0.285 1.00 0.00 H new ATOM 0 HB2 LEU A 42 9.635 0.104 1.184 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.222 0.893 1.857 1.00 0.00 H new ATOM 0 HG LEU A 42 6.905 -0.707 0.224 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.840 -2.910 -0.051 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.683 -1.668 -1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.426 -2.303 0.481 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.845 -2.350 2.139 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.323 -1.606 2.795 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.812 -0.667 2.717 1.00 0.00 H new ATOM 347 N SER A 43 9.824 1.911 -2.337 1.00 0.00 N ATOM 348 CA SER A 43 10.963 2.624 -2.993 1.00 0.00 C ATOM 349 C SER A 43 10.661 4.018 -3.620 1.00 0.00 C ATOM 350 O SER A 43 11.505 4.909 -3.508 1.00 0.00 O ATOM 351 CB SER A 43 11.709 1.703 -3.989 1.00 0.00 C ATOM 352 OG SER A 43 10.977 1.454 -5.190 1.00 0.00 O ATOM 0 H SER A 43 8.996 1.808 -2.923 1.00 0.00 H new ATOM 0 HA SER A 43 11.616 2.868 -2.155 1.00 0.00 H new ATOM 0 HB2 SER A 43 12.667 2.156 -4.244 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.926 0.753 -3.501 1.00 0.00 H new ATOM 0 HG SER A 43 10.039 1.706 -5.060 1.00 0.00 H new ATOM 353 N LYS A 44 9.626 4.183 -4.462 1.00 0.00 N ATOM 354 CA LYS A 44 9.930 4.616 -5.871 1.00 0.00 C ATOM 355 C LYS A 44 10.463 6.078 -6.160 1.00 0.00 C ATOM 356 O LYS A 44 11.428 6.174 -6.930 1.00 0.00 O ATOM 357 CB LYS A 44 8.789 4.162 -6.815 1.00 0.00 C ATOM 358 CG LYS A 44 9.085 4.240 -8.333 1.00 0.00 C ATOM 359 CD LYS A 44 7.858 3.892 -9.196 1.00 0.00 C ATOM 360 CE LYS A 44 8.213 3.807 -10.686 1.00 0.00 C ATOM 361 NZ LYS A 44 6.988 3.575 -11.473 1.00 0.00 N ATOM 0 H LYS A 44 8.642 4.041 -4.236 1.00 0.00 H new ATOM 0 HA LYS A 44 10.857 4.088 -6.093 1.00 0.00 H new ATOM 0 HB2 LYS A 44 8.530 3.132 -6.569 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.909 4.770 -6.606 1.00 0.00 H new ATOM 0 HG2 LYS A 44 9.426 5.245 -8.581 1.00 0.00 H new ATOM 0 HG3 LYS A 44 9.900 3.558 -8.576 1.00 0.00 H new ATOM 0 HD2 LYS A 44 7.441 2.940 -8.867 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.085 4.646 -9.049 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.695 4.730 -11.009 1.00 0.00 H new ATOM 0 HE3 LYS A 44 8.925 2.999 -10.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.230 3.078 -12.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.325 2.996 -10.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.544 4.487 -11.701 1.00 0.00 H new ATOM 362 N PRO A 45 9.875 7.221 -5.706 1.00 0.00 N ATOM 363 CA PRO A 45 10.069 8.516 -6.404 1.00 0.00 C ATOM 364 C PRO A 45 11.366 9.344 -6.128 1.00 0.00 C ATOM 365 O PRO A 45 11.518 10.019 -5.108 1.00 0.00 O ATOM 366 CB PRO A 45 8.762 9.274 -6.121 1.00 0.00 C ATOM 367 CG PRO A 45 8.265 8.668 -4.808 1.00 0.00 C ATOM 368 CD PRO A 45 8.702 7.209 -4.823 1.00 0.00 C ATOM 0 HA PRO A 45 10.261 8.325 -7.460 1.00 0.00 H new ATOM 0 HB2 PRO A 45 8.934 10.346 -6.027 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.038 9.137 -6.924 1.00 0.00 H new ATOM 0 HG2 PRO A 45 8.689 9.193 -3.952 1.00 0.00 H new ATOM 0 HG3 PRO A 45 7.181 8.749 -4.727 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.953 6.853 -3.824 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.917 6.557 -5.205 1.00 0.00 H new ATOM 369 N SER A 46 12.253 9.384 -7.132 1.00 0.00 N ATOM 370 CA SER A 46 13.223 10.502 -7.314 1.00 0.00 C ATOM 371 C SER A 46 13.064 11.123 -8.748 1.00 0.00 C ATOM 372 O SER A 46 12.322 12.108 -8.810 1.00 0.00 O ATOM 373 CB SER A 46 14.624 10.070 -6.850 1.00 0.00 C ATOM 374 OG SER A 46 14.661 9.935 -5.429 1.00 0.00 O ATOM 0 H SER A 46 12.328 8.655 -7.841 1.00 0.00 H new ATOM 0 HA SER A 46 13.010 11.349 -6.662 1.00 0.00 H new ATOM 0 HB2 SER A 46 14.893 9.123 -7.318 1.00 0.00 H new ATOM 0 HB3 SER A 46 15.362 10.805 -7.171 1.00 0.00 H new ATOM 0 HG SER A 46 13.748 9.969 -5.073 1.00 0.00 H new ATOM 375 N PRO A 47 13.587 10.632 -9.920 1.00 0.00 N ATOM 376 CA PRO A 47 13.186 11.163 -11.266 1.00 0.00 C ATOM 377 C PRO A 47 11.813 10.613 -11.802 1.00 0.00 C ATOM 378 O PRO A 47 11.723 9.881 -12.790 1.00 0.00 O ATOM 379 CB PRO A 47 14.424 10.754 -12.089 1.00 0.00 C ATOM 380 CG PRO A 47 14.850 9.406 -11.497 1.00 0.00 C ATOM 381 CD PRO A 47 14.594 9.555 -9.997 1.00 0.00 C ATOM 0 HA PRO A 47 12.969 12.231 -11.290 1.00 0.00 H new ATOM 0 HB2 PRO A 47 14.184 10.664 -13.149 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.220 11.494 -12.004 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.271 8.585 -11.920 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.899 9.195 -11.703 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.223 8.628 -9.560 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.505 9.819 -9.459 1.00 0.00 H new ATOM 382 N VAL A 48 10.750 10.944 -11.065 1.00 0.00 N ATOM 383 CA VAL A 48 9.459 10.183 -11.076 1.00 0.00 C ATOM 384 C VAL A 48 8.193 11.105 -10.980 1.00 0.00 C ATOM 385 O VAL A 48 7.263 10.936 -11.765 1.00 0.00 O ATOM 386 CB VAL A 48 9.506 9.066 -9.968 1.00 0.00 C ATOM 387 CG1 VAL A 48 8.193 8.289 -9.719 1.00 0.00 C ATOM 388 CG2 VAL A 48 10.590 7.980 -10.190 1.00 0.00 C ATOM 0 H VAL A 48 10.741 11.747 -10.436 1.00 0.00 H new ATOM 0 HA VAL A 48 9.353 9.698 -12.047 1.00 0.00 H new ATOM 0 HB VAL A 48 9.733 9.688 -9.103 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.352 7.548 -8.935 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.412 8.984 -9.409 1.00 0.00 H new ATOM 0 HG13 VAL A 48 7.888 7.786 -10.637 1.00 0.00 H new ATOM 0 HG21 VAL A 48 10.548 7.253 -9.379 1.00 0.00 H new ATOM 0 HG22 VAL A 48 10.410 7.475 -11.139 1.00 0.00 H new ATOM 0 HG23 VAL A 48 11.575 8.447 -10.208 1.00 0.00 H new ATOM 389 N THR A 49 7.940 12.054 -10.077 1.00 0.00 N ATOM 390 CA THR A 49 8.954 12.715 -9.197 1.00 0.00 C ATOM 391 C THR A 49 8.394 13.191 -7.816 1.00 0.00 C ATOM 392 O THR A 49 7.247 13.628 -7.682 1.00 0.00 O ATOM 393 CB THR A 49 9.671 13.875 -9.979 1.00 0.00 C ATOM 394 OG1 THR A 49 10.722 14.431 -9.202 1.00 0.00 O ATOM 395 CG2 THR A 49 8.801 15.053 -10.418 1.00 0.00 C ATOM 0 H THR A 49 6.997 12.408 -9.919 1.00 0.00 H new ATOM 0 HA THR A 49 9.689 11.953 -8.940 1.00 0.00 H new ATOM 0 HB THR A 49 10.011 13.369 -10.883 1.00 0.00 H new ATOM 0 HG1 THR A 49 11.371 13.731 -8.981 1.00 0.00 H new ATOM 0 HG21 THR A 49 9.415 15.782 -10.946 1.00 0.00 H new ATOM 0 HG22 THR A 49 8.012 14.696 -11.080 1.00 0.00 H new ATOM 0 HG23 THR A 49 8.354 15.522 -9.541 1.00 0.00 H new ATOM 396 N GLY A 50 9.263 13.181 -6.792 1.00 0.00 N ATOM 397 CA GLY A 50 9.100 14.087 -5.614 1.00 0.00 C ATOM 398 C GLY A 50 8.407 13.555 -4.345 1.00 0.00 C ATOM 399 O GLY A 50 8.924 13.742 -3.242 1.00 0.00 O ATOM 0 H GLY A 50 10.078 12.570 -6.743 1.00 0.00 H new ATOM 0 HA2 GLY A 50 10.093 14.431 -5.325 1.00 0.00 H new ATOM 0 HA3 GLY A 50 8.544 14.963 -5.948 1.00 0.00 H new ATOM 400 N TYR A 51 7.224 12.945 -4.484 1.00 0.00 N ATOM 401 CA TYR A 51 6.411 12.437 -3.338 1.00 0.00 C ATOM 402 C TYR A 51 6.983 11.172 -2.593 1.00 0.00 C ATOM 403 O TYR A 51 6.416 10.081 -2.679 1.00 0.00 O ATOM 404 CB TYR A 51 4.909 12.325 -3.775 1.00 0.00 C ATOM 405 CG TYR A 51 4.451 11.835 -5.180 1.00 0.00 C ATOM 406 CD1 TYR A 51 5.072 10.788 -5.874 1.00 0.00 C ATOM 407 CD2 TYR A 51 3.358 12.468 -5.785 1.00 0.00 C ATOM 408 CE1 TYR A 51 4.743 10.522 -7.206 1.00 0.00 C ATOM 409 CE2 TYR A 51 3.050 12.211 -7.115 1.00 0.00 C ATOM 410 CZ TYR A 51 3.788 11.304 -7.845 1.00 0.00 C ATOM 411 OH TYR A 51 3.431 11.126 -9.150 1.00 0.00 O ATOM 0 H TYR A 51 6.789 12.782 -5.392 1.00 0.00 H new ATOM 0 HA TYR A 51 6.481 13.179 -2.543 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.428 11.668 -3.050 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.477 13.317 -3.642 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.812 10.181 -5.375 1.00 0.00 H new ATOM 0 HD2 TYR A 51 2.753 13.158 -5.216 1.00 0.00 H new ATOM 0 HE1 TYR A 51 5.227 9.715 -7.735 1.00 0.00 H new ATOM 0 HE2 TYR A 51 2.224 12.727 -7.582 1.00 0.00 H new ATOM 0 HH TYR A 51 2.744 11.781 -9.394 1.00 0.00 H new ATOM 412 N ARG A 52 8.077 11.342 -1.815 1.00 0.00 N ATOM 413 CA ARG A 52 8.848 10.209 -1.209 1.00 0.00 C ATOM 414 C ARG A 52 8.794 10.158 0.376 1.00 0.00 C ATOM 415 O ARG A 52 9.754 10.500 1.067 1.00 0.00 O ATOM 416 CB ARG A 52 10.306 10.263 -1.775 1.00 0.00 C ATOM 417 CG ARG A 52 11.044 8.913 -2.017 1.00 0.00 C ATOM 418 CD ARG A 52 10.957 7.804 -0.947 1.00 0.00 C ATOM 419 NE ARG A 52 9.737 6.977 -1.169 1.00 0.00 N ATOM 420 CZ ARG A 52 9.529 5.755 -0.702 1.00 0.00 C ATOM 421 NH1 ARG A 52 10.340 5.127 0.094 1.00 0.00 N ATOM 422 NH2 ARG A 52 8.451 5.163 -1.073 1.00 0.00 N ATOM 0 H ARG A 52 8.456 12.260 -1.585 1.00 0.00 H new ATOM 0 HA ARG A 52 8.374 9.271 -1.497 1.00 0.00 H new ATOM 0 HB2 ARG A 52 10.278 10.803 -2.721 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.910 10.856 -1.088 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.668 8.497 -2.952 1.00 0.00 H new ATOM 0 HG3 ARG A 52 12.099 9.139 -2.170 1.00 0.00 H new ATOM 0 HD2 ARG A 52 11.846 7.175 -0.990 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.929 8.248 0.048 1.00 0.00 H new ATOM 0 HE ARG A 52 8.994 7.390 -1.732 1.00 0.00 H new ATOM 0 HH11 ARG A 52 11.204 5.575 0.400 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.113 4.185 0.414 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.800 5.635 -1.700 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.246 4.221 -0.740 1.00 0.00 H new ATOM 423 N ASN A 53 7.755 9.736 1.111 1.00 0.00 N ATOM 424 CA ASN A 53 6.365 9.624 0.596 1.00 0.00 C ATOM 425 C ASN A 53 5.225 9.870 1.566 1.00 0.00 C ATOM 426 O ASN A 53 5.412 9.527 2.715 1.00 0.00 O ATOM 427 CB ASN A 53 6.086 8.294 -0.176 1.00 0.00 C ATOM 428 CG ASN A 53 6.078 6.942 0.552 1.00 0.00 C ATOM 429 OD1 ASN A 53 5.327 6.050 0.191 1.00 0.00 O ATOM 430 ND2 ASN A 53 6.883 6.695 1.549 1.00 0.00 N ATOM 0 H ASN A 53 7.847 9.459 2.088 1.00 0.00 H new ATOM 0 HA ASN A 53 6.358 10.474 -0.086 1.00 0.00 H new ATOM 0 HB2 ASN A 53 5.114 8.403 -0.658 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.829 8.224 -0.970 1.00 0.00 H new ATOM 0 HD21 ASN A 53 6.871 5.780 2.000 1.00 0.00 H new ATOM 0 HD22 ASN A 53 7.524 7.417 1.878 1.00 0.00 H new ATOM 431 N ASP A 54 3.991 10.275 1.137 1.00 0.00 N ATOM 432 CA ASP A 54 2.812 10.297 2.071 1.00 0.00 C ATOM 433 C ASP A 54 2.300 8.848 2.389 1.00 0.00 C ATOM 434 O ASP A 54 1.141 8.635 2.716 1.00 0.00 O ATOM 435 CB ASP A 54 3.088 11.283 3.228 1.00 0.00 C ATOM 436 CG ASP A 54 3.637 12.677 2.905 1.00 0.00 C ATOM 437 OD1 ASP A 54 2.979 13.575 2.391 1.00 0.00 O ATOM 438 OD2 ASP A 54 4.943 12.805 3.258 1.00 0.00 O ATOM 0 H ASP A 54 3.786 10.581 0.186 1.00 0.00 H new ATOM 0 HA ASP A 54 1.920 10.717 1.607 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.155 11.416 3.776 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.791 10.803 3.908 1.00 0.00 H new ATOM 439 N ALA A 55 3.129 7.810 2.350 1.00 0.00 N ATOM 440 CA ALA A 55 3.010 6.678 3.276 1.00 0.00 C ATOM 441 C ALA A 55 4.024 6.569 4.447 1.00 0.00 C ATOM 442 O ALA A 55 3.907 5.671 5.275 1.00 0.00 O ATOM 443 CB ALA A 55 2.799 5.475 2.381 1.00 0.00 C ATOM 0 H ALA A 55 3.897 7.725 1.684 1.00 0.00 H new ATOM 0 HA ALA A 55 2.160 6.811 3.945 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.699 4.579 2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 55 1.893 5.614 1.792 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.653 5.365 1.713 1.00 0.00 H new ATOM 444 N GLU A 56 4.825 7.615 4.657 1.00 0.00 N ATOM 445 CA GLU A 56 4.747 8.469 5.877 1.00 0.00 C ATOM 446 C GLU A 56 3.326 9.023 6.343 1.00 0.00 C ATOM 447 O GLU A 56 3.105 9.173 7.548 1.00 0.00 O ATOM 448 CB GLU A 56 5.814 9.600 5.621 1.00 0.00 C ATOM 449 CG GLU A 56 7.288 9.155 5.408 1.00 0.00 C ATOM 450 CD GLU A 56 8.278 10.301 5.231 1.00 0.00 C ATOM 451 OE1 GLU A 56 8.816 10.894 6.159 1.00 0.00 O ATOM 452 OE2 GLU A 56 8.507 10.588 3.921 1.00 0.00 O ATOM 0 H GLU A 56 5.548 7.906 3.999 1.00 0.00 H new ATOM 0 HA GLU A 56 4.951 7.846 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.502 10.165 4.743 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.788 10.286 6.468 1.00 0.00 H new ATOM 0 HG2 GLU A 56 7.599 8.552 6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.336 8.512 4.529 1.00 0.00 H new ATOM 453 N ARG A 57 2.315 9.217 5.468 1.00 0.00 N ATOM 454 CA ARG A 57 0.917 9.535 5.890 1.00 0.00 C ATOM 455 C ARG A 57 0.073 8.306 6.271 1.00 0.00 C ATOM 456 O ARG A 57 -0.408 8.271 7.396 1.00 0.00 O ATOM 457 CB ARG A 57 0.107 10.500 5.006 1.00 0.00 C ATOM 458 CG ARG A 57 -1.265 10.955 5.559 1.00 0.00 C ATOM 459 CD ARG A 57 -2.401 10.065 5.079 1.00 0.00 C ATOM 460 NE ARG A 57 -3.689 10.786 5.192 1.00 0.00 N ATOM 461 CZ ARG A 57 -4.795 10.490 4.526 1.00 0.00 C ATOM 462 NH1 ARG A 57 -4.925 9.485 3.727 1.00 0.00 N ATOM 463 NH2 ARG A 57 -5.800 11.264 4.670 1.00 0.00 N ATOM 0 H ARG A 57 2.434 9.160 4.457 1.00 0.00 H new ATOM 0 HA ARG A 57 1.124 10.106 6.795 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.713 11.387 4.825 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.056 10.023 4.040 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.236 10.948 6.649 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.456 11.983 5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.230 9.769 4.044 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -2.433 9.151 5.671 1.00 0.00 H new ATOM 0 HE ARG A 57 -3.728 11.576 5.836 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.141 8.851 3.573 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.812 9.324 3.250 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.734 12.078 5.282 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -6.669 11.069 4.173 1.00 0.00 H new ATOM 464 N LEU A 58 -0.174 7.336 5.375 1.00 0.00 N ATOM 465 CA LEU A 58 -0.795 6.037 5.790 1.00 0.00 C ATOM 466 C LEU A 58 -0.034 5.243 6.920 1.00 0.00 C ATOM 467 O LEU A 58 -0.705 4.663 7.784 1.00 0.00 O ATOM 468 CB LEU A 58 -1.275 5.238 4.551 1.00 0.00 C ATOM 469 CG LEU A 58 -0.216 4.807 3.512 1.00 0.00 C ATOM 470 CD1 LEU A 58 0.410 3.450 3.779 1.00 0.00 C ATOM 471 CD2 LEU A 58 -0.638 4.915 2.045 1.00 0.00 C ATOM 0 H LEU A 58 0.035 7.408 4.379 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.703 6.272 6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.778 4.339 4.908 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.024 5.839 4.035 1.00 0.00 H new ATOM 0 HG LEU A 58 0.550 5.567 3.666 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.141 3.227 3.002 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.905 3.462 4.750 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.366 2.685 3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.182 4.587 1.406 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.510 4.284 1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.887 5.951 1.813 1.00 0.00 H new ATOM 472 N ALA A 59 1.311 5.393 7.067 1.00 0.00 N ATOM 473 CA ALA A 59 1.960 5.353 8.401 1.00 0.00 C ATOM 474 C ALA A 59 1.278 6.121 9.552 1.00 0.00 C ATOM 475 O ALA A 59 0.856 5.442 10.481 1.00 0.00 O ATOM 476 CB ALA A 59 3.351 5.985 8.229 1.00 0.00 C ATOM 0 H ALA A 59 1.955 5.540 6.290 1.00 0.00 H new ATOM 0 HA ALA A 59 1.932 4.304 8.698 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.873 5.981 9.186 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.924 5.411 7.500 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.243 7.012 7.879 1.00 0.00 H new ATOM 477 N ASP A 60 1.135 7.465 9.550 1.00 0.00 N ATOM 478 CA ASP A 60 0.422 8.115 10.690 1.00 0.00 C ATOM 479 C ASP A 60 -1.107 7.850 10.826 1.00 0.00 C ATOM 480 O ASP A 60 -1.694 8.138 11.868 1.00 0.00 O ATOM 481 CB ASP A 60 0.666 9.629 10.551 1.00 0.00 C ATOM 482 CG ASP A 60 0.762 10.465 11.814 1.00 0.00 C ATOM 483 OD1 ASP A 60 -0.403 10.518 12.499 1.00 0.00 O ATOM 484 OD2 ASP A 60 1.766 11.095 12.122 1.00 0.00 O ATOM 0 H ASP A 60 1.477 8.095 8.824 1.00 0.00 H new ATOM 0 HA ASP A 60 0.831 7.668 11.596 1.00 0.00 H new ATOM 0 HB2 ASP A 60 1.591 9.766 9.992 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -0.139 10.040 9.941 1.00 0.00 H new ATOM 485 N GLU A 61 -1.750 7.260 9.820 1.00 0.00 N ATOM 486 CA GLU A 61 -3.151 6.797 9.968 1.00 0.00 C ATOM 487 C GLU A 61 -3.227 5.510 10.818 1.00 0.00 C ATOM 488 O GLU A 61 -3.837 5.555 11.895 1.00 0.00 O ATOM 489 CB GLU A 61 -3.914 6.734 8.619 1.00 0.00 C ATOM 490 CG GLU A 61 -3.812 7.983 7.708 1.00 0.00 C ATOM 491 CD GLU A 61 -4.172 9.343 8.296 1.00 0.00 C ATOM 492 OE1 GLU A 61 -5.318 9.758 8.399 1.00 0.00 O ATOM 493 OE2 GLU A 61 -3.079 10.053 8.682 1.00 0.00 O ATOM 0 H GLU A 61 -1.341 7.088 8.902 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.695 7.554 10.533 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.548 5.873 8.060 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.967 6.552 8.831 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -2.788 8.042 7.339 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.453 7.816 6.843 1.00 0.00 H new ATOM 494 N GLN A 62 -2.534 4.401 10.463 1.00 0.00 N ATOM 495 CA GLN A 62 -2.448 3.284 11.419 1.00 0.00 C ATOM 496 C GLN A 62 -1.507 3.580 12.610 1.00 0.00 C ATOM 497 O GLN A 62 -1.977 3.683 13.732 1.00 0.00 O ATOM 498 CB GLN A 62 -2.247 1.939 10.692 1.00 0.00 C ATOM 499 CG GLN A 62 -3.555 1.112 10.553 1.00 0.00 C ATOM 500 CD GLN A 62 -4.129 0.483 11.836 1.00 0.00 C ATOM 501 OE1 GLN A 62 -4.377 -0.714 11.905 1.00 0.00 O ATOM 502 NE2 GLN A 62 -4.393 1.240 12.878 1.00 0.00 N ATOM 0 H GLN A 62 -2.054 4.263 9.574 1.00 0.00 H new ATOM 0 HA GLN A 62 -3.412 3.174 11.916 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.838 2.128 9.699 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -1.508 1.348 11.234 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -4.320 1.759 10.122 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -3.374 0.311 9.836 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -4.195 2.240 12.845 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -4.795 0.827 13.719 1.00 0.00 H new ATOM 503 N SER A 63 -0.230 3.801 12.366 1.00 0.00 N ATOM 504 CA SER A 63 0.740 4.254 13.390 1.00 0.00 C ATOM 505 C SER A 63 0.774 5.786 13.780 1.00 0.00 C ATOM 506 O SER A 63 1.806 6.299 14.213 1.00 0.00 O ATOM 507 CB SER A 63 2.045 3.494 13.002 1.00 0.00 C ATOM 508 OG SER A 63 3.151 3.828 13.838 1.00 0.00 O ATOM 0 H SER A 63 0.186 3.674 11.443 1.00 0.00 H new ATOM 0 HA SER A 63 0.441 3.997 14.406 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.865 2.420 13.058 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.297 3.721 11.966 1.00 0.00 H new ATOM 0 HG SER A 63 3.044 4.743 14.172 1.00 0.00 H new ATOM 509 N GLU A 64 -0.380 6.482 13.883 1.00 0.00 N ATOM 510 CA GLU A 64 -0.873 6.973 15.212 1.00 0.00 C ATOM 511 C GLU A 64 -1.962 6.043 15.851 1.00 0.00 C ATOM 512 O GLU A 64 -1.787 5.625 16.998 1.00 0.00 O ATOM 513 CB GLU A 64 -1.354 8.461 15.163 1.00 0.00 C ATOM 514 CG GLU A 64 -0.311 9.515 15.612 1.00 0.00 C ATOM 515 CD GLU A 64 -0.893 10.906 15.859 1.00 0.00 C ATOM 516 OE1 GLU A 64 -1.464 11.230 16.894 1.00 0.00 O ATOM 517 OE2 GLU A 64 -0.714 11.751 14.809 1.00 0.00 O ATOM 0 H GLU A 64 -0.981 6.717 13.093 1.00 0.00 H new ATOM 0 HA GLU A 64 -0.005 6.933 15.870 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.662 8.692 14.143 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -2.238 8.560 15.793 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.170 9.167 16.526 1.00 0.00 H new ATOM 0 HG3 GLU A 64 0.466 9.588 14.851 1.00 0.00 H new ATOM 518 N LEU A 65 -3.103 5.766 15.189 1.00 0.00 N ATOM 519 CA LEU A 65 -4.339 5.268 15.860 1.00 0.00 C ATOM 520 C LEU A 65 -4.277 3.866 16.560 1.00 0.00 C ATOM 521 O LEU A 65 -4.893 3.694 17.606 1.00 0.00 O ATOM 522 CB LEU A 65 -5.420 5.239 14.757 1.00 0.00 C ATOM 523 CG LEU A 65 -5.933 6.545 14.099 1.00 0.00 C ATOM 524 CD1 LEU A 65 -7.203 7.073 14.780 1.00 0.00 C ATOM 525 CD2 LEU A 65 -4.992 7.754 13.890 1.00 0.00 C ATOM 0 H LEU A 65 -3.202 5.878 14.180 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.535 5.941 16.694 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -5.039 4.607 13.955 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -6.289 4.732 15.177 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.087 6.156 13.092 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -7.527 7.989 14.286 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.992 6.324 14.709 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.994 7.281 15.829 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.543 8.566 13.415 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -4.611 8.089 14.855 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -4.158 7.460 13.253 1.00 0.00 H new ATOM 526 N VAL A 66 -3.586 2.898 15.944 1.00 0.00 N ATOM 527 CA VAL A 66 -3.112 1.595 16.545 1.00 0.00 C ATOM 528 C VAL A 66 -3.546 1.195 18.009 1.00 0.00 C ATOM 529 O VAL A 66 -4.488 0.407 18.143 1.00 0.00 O ATOM 530 CB VAL A 66 -1.590 1.307 16.212 1.00 0.00 C ATOM 531 CG1 VAL A 66 -1.320 0.920 14.734 1.00 0.00 C ATOM 532 CG2 VAL A 66 -0.601 2.429 16.598 1.00 0.00 C ATOM 0 H VAL A 66 -3.317 2.984 14.964 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.736 0.879 16.009 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.399 0.448 16.855 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.254 0.740 14.594 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.876 0.015 14.487 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.640 1.732 14.081 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.412 2.130 16.327 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.864 3.344 16.067 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.652 2.605 17.672 1.00 0.00 H new TER 533 VAL A 66 ATOM 534 N ALA B 1 -10.872 -20.025 -2.711 1.00 0.00 N ATOM 535 CA ALA B 1 -11.448 -19.763 -1.364 1.00 0.00 C ATOM 536 C ALA B 1 -12.578 -18.681 -1.292 1.00 0.00 C ATOM 537 O ALA B 1 -13.545 -18.876 -0.557 1.00 0.00 O ATOM 538 CB ALA B 1 -10.263 -19.462 -0.426 1.00 0.00 C ATOM 0 H1 ALA B 1 -10.136 -20.756 -2.638 1.00 0.00 H new ATOM 0 H2 ALA B 1 -11.623 -20.352 -3.352 1.00 0.00 H new ATOM 0 H3 ALA B 1 -10.454 -19.150 -3.086 1.00 0.00 H new ATOM 0 HA ALA B 1 -11.993 -20.653 -1.050 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -10.636 -19.262 0.579 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -9.592 -20.321 -0.400 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -9.722 -18.590 -0.792 1.00 0.00 H new ATOM 539 N ARG B 2 -12.446 -17.544 -2.007 1.00 0.00 N ATOM 540 CA ARG B 2 -13.442 -16.420 -2.013 1.00 0.00 C ATOM 541 C ARG B 2 -14.071 -15.904 -0.667 1.00 0.00 C ATOM 542 O ARG B 2 -15.269 -15.629 -0.569 1.00 0.00 O ATOM 543 CB ARG B 2 -14.458 -16.563 -3.180 1.00 0.00 C ATOM 544 CG ARG B 2 -15.438 -17.762 -3.124 1.00 0.00 C ATOM 545 CD ARG B 2 -16.440 -17.752 -4.288 1.00 0.00 C ATOM 546 NE ARG B 2 -17.292 -18.963 -4.187 1.00 0.00 N ATOM 547 CZ ARG B 2 -18.320 -19.253 -4.972 1.00 0.00 C ATOM 548 NH1 ARG B 2 -18.727 -18.507 -5.956 1.00 0.00 N ATOM 549 NH2 ARG B 2 -18.951 -20.348 -4.736 1.00 0.00 N ATOM 0 H ARG B 2 -11.641 -17.366 -2.607 1.00 0.00 H new ATOM 0 HA ARG B 2 -12.790 -15.565 -2.194 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -15.047 -15.647 -3.229 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -13.895 -16.630 -4.111 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -14.871 -18.693 -3.144 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -15.982 -17.740 -2.180 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -17.055 -16.852 -4.251 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -15.912 -17.739 -5.242 1.00 0.00 H new ATOM 0 HE ARG B 2 -17.067 -19.630 -3.449 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -18.246 -17.633 -6.166 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -19.528 -18.796 -6.518 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -18.654 -20.953 -3.970 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -19.749 -20.612 -5.315 1.00 0.00 H new ATOM 550 N ASP B 3 -13.226 -15.679 0.349 1.00 0.00 N ATOM 551 CA ASP B 3 -13.630 -15.029 1.625 1.00 0.00 C ATOM 552 C ASP B 3 -12.419 -14.347 2.336 1.00 0.00 C ATOM 553 O ASP B 3 -12.460 -13.161 2.669 1.00 0.00 O ATOM 554 CB ASP B 3 -14.441 -16.010 2.520 1.00 0.00 C ATOM 555 CG ASP B 3 -15.137 -15.353 3.704 1.00 0.00 C ATOM 556 OD1 ASP B 3 -16.273 -14.702 3.340 1.00 0.00 O ATOM 557 OD2 ASP B 3 -14.718 -15.396 4.854 1.00 0.00 O ATOM 0 H ASP B 3 -12.240 -15.939 0.319 1.00 0.00 H new ATOM 0 HA ASP B 3 -14.313 -14.210 1.400 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -15.190 -16.509 1.905 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -13.769 -16.783 2.893 1.00 0.00 H new ATOM 558 N ASP B 4 -11.323 -15.085 2.523 1.00 0.00 N ATOM 559 CA ASP B 4 -9.974 -14.497 2.714 1.00 0.00 C ATOM 560 C ASP B 4 -8.873 -15.280 1.908 1.00 0.00 C ATOM 561 O ASP B 4 -8.305 -16.231 2.451 1.00 0.00 O ATOM 562 CB ASP B 4 -9.727 -14.225 4.218 1.00 0.00 C ATOM 563 CG ASP B 4 -9.368 -15.395 5.128 1.00 0.00 C ATOM 564 OD1 ASP B 4 -9.950 -16.475 5.140 1.00 0.00 O ATOM 565 OD2 ASP B 4 -8.299 -15.103 5.913 1.00 0.00 O ATOM 0 H ASP B 4 -11.334 -16.105 2.548 1.00 0.00 H new ATOM 0 HA ASP B 4 -9.906 -13.509 2.259 1.00 0.00 H new ATOM 0 HB2 ASP B 4 -8.925 -13.491 4.293 1.00 0.00 H new ATOM 0 HB3 ASP B 4 -10.626 -13.758 4.621 1.00 0.00 H new ATOM 566 N PRO B 5 -8.566 -14.991 0.604 1.00 0.00 N ATOM 567 CA PRO B 5 -7.848 -15.961 -0.265 1.00 0.00 C ATOM 568 C PRO B 5 -6.309 -15.772 -0.349 1.00 0.00 C ATOM 569 O PRO B 5 -5.780 -14.655 -0.373 1.00 0.00 O ATOM 570 CB PRO B 5 -8.553 -15.773 -1.632 1.00 0.00 C ATOM 571 CG PRO B 5 -9.751 -14.864 -1.347 1.00 0.00 C ATOM 572 CD PRO B 5 -9.262 -13.985 -0.221 1.00 0.00 C ATOM 0 HA PRO B 5 -7.908 -16.974 0.133 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -7.881 -15.321 -2.362 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -8.874 -16.730 -2.044 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -10.028 -14.278 -2.223 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -10.631 -15.438 -1.056 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -8.595 -13.196 -0.568 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -10.078 -13.500 0.314 1.00 0.00 H new ATOM 573 N HIS B 6 -5.627 -16.915 -0.472 1.00 0.00 N ATOM 574 CA HIS B 6 -4.162 -16.985 -0.671 1.00 0.00 C ATOM 575 C HIS B 6 -3.751 -16.711 -2.157 1.00 0.00 C ATOM 576 O HIS B 6 -4.178 -17.433 -3.066 1.00 0.00 O ATOM 577 CB HIS B 6 -3.696 -18.423 -0.286 1.00 0.00 C ATOM 578 CG HIS B 6 -3.823 -18.849 1.174 1.00 0.00 C ATOM 579 ND1 HIS B 6 -4.998 -19.338 1.725 1.00 0.00 N ATOM 580 CD2 HIS B 6 -2.814 -18.769 2.143 1.00 0.00 C ATOM 581 CE1 HIS B 6 -4.589 -19.480 3.026 1.00 0.00 C ATOM 582 NE2 HIS B 6 -3.283 -19.229 3.362 1.00 0.00 N ATOM 0 H HIS B 6 -6.074 -17.831 -0.437 1.00 0.00 H new ATOM 0 HA HIS B 6 -3.694 -16.221 -0.051 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -4.262 -19.131 -0.891 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -2.649 -18.523 -0.574 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -1.814 -18.401 1.965 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -5.293 -19.789 3.784 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -2.798 -19.347 4.252 1.00 0.00 H new ATOM 583 N PHE B 7 -2.843 -15.756 -2.411 1.00 0.00 N ATOM 584 CA PHE B 7 -1.993 -15.784 -3.630 1.00 0.00 C ATOM 585 C PHE B 7 -0.479 -15.612 -3.265 1.00 0.00 C ATOM 586 O PHE B 7 -0.104 -14.982 -2.270 1.00 0.00 O ATOM 587 CB PHE B 7 -2.566 -14.808 -4.704 1.00 0.00 C ATOM 588 CG PHE B 7 -2.043 -13.363 -4.726 1.00 0.00 C ATOM 589 CD1 PHE B 7 -0.816 -13.101 -5.346 1.00 0.00 C ATOM 590 CD2 PHE B 7 -2.743 -12.305 -4.131 1.00 0.00 C ATOM 591 CE1 PHE B 7 -0.293 -11.825 -5.334 1.00 0.00 C ATOM 592 CE2 PHE B 7 -2.247 -11.007 -4.208 1.00 0.00 C ATOM 593 CZ PHE B 7 -1.033 -10.775 -4.847 1.00 0.00 C ATOM 0 H PHE B 7 -2.673 -14.958 -1.799 1.00 0.00 H new ATOM 0 HA PHE B 7 -2.028 -16.765 -4.104 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -2.378 -15.245 -5.685 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -3.648 -14.769 -4.575 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -0.278 -13.900 -5.835 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -3.670 -12.497 -3.611 1.00 0.00 H new ATOM 0 HE1 PHE B 7 0.704 -11.650 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -2.800 -10.186 -3.775 1.00 0.00 H new ATOM 0 HZ PHE B 7 -0.670 -9.764 -4.961 1.00 0.00 H new ATOM 594 N ASN B 8 0.404 -16.106 -4.141 1.00 0.00 N ATOM 595 CA ASN B 8 1.867 -15.861 -4.044 1.00 0.00 C ATOM 596 C ASN B 8 2.311 -14.351 -4.087 1.00 0.00 C ATOM 597 O ASN B 8 2.423 -13.734 -5.150 1.00 0.00 O ATOM 598 CB ASN B 8 2.576 -16.756 -5.104 1.00 0.00 C ATOM 599 CG ASN B 8 2.219 -16.555 -6.585 1.00 0.00 C ATOM 600 OD1 ASN B 8 1.207 -17.044 -7.071 1.00 0.00 O ATOM 601 ND2 ASN B 8 3.010 -15.845 -7.345 1.00 0.00 N ATOM 0 H ASN B 8 0.137 -16.685 -4.937 1.00 0.00 H new ATOM 0 HA ASN B 8 2.187 -16.146 -3.042 1.00 0.00 H new ATOM 0 HB2 ASN B 8 3.651 -16.608 -4.998 1.00 0.00 H new ATOM 0 HB3 ASN B 8 2.371 -17.796 -4.851 1.00 0.00 H new ATOM 0 HD21 ASN B 8 2.781 -15.704 -8.329 1.00 0.00 H new ATOM 0 HD22 ASN B 8 3.857 -15.431 -6.954 1.00 0.00 H new ATOM 602 N PHE B 9 2.657 -13.789 -2.924 1.00 0.00 N ATOM 603 CA PHE B 9 3.501 -12.599 -2.796 1.00 0.00 C ATOM 604 C PHE B 9 4.667 -12.925 -1.843 1.00 0.00 C ATOM 605 O PHE B 9 4.532 -12.826 -0.627 1.00 0.00 O ATOM 606 CB PHE B 9 2.551 -11.457 -2.342 1.00 0.00 C ATOM 607 CG PHE B 9 3.003 -10.134 -2.914 1.00 0.00 C ATOM 608 CD1 PHE B 9 2.935 -9.939 -4.299 1.00 0.00 C ATOM 609 CD2 PHE B 9 3.328 -9.052 -2.092 1.00 0.00 C ATOM 610 CE1 PHE B 9 3.224 -8.709 -4.839 1.00 0.00 C ATOM 611 CE2 PHE B 9 3.696 -7.842 -2.641 1.00 0.00 C ATOM 612 CZ PHE B 9 3.552 -7.660 -3.996 1.00 0.00 C ATOM 0 H PHE B 9 2.350 -14.159 -2.024 1.00 0.00 H new ATOM 0 HA PHE B 9 3.984 -12.275 -3.718 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.533 -11.672 -2.667 1.00 0.00 H new ATOM 0 HB3 PHE B 9 2.533 -11.402 -1.254 1.00 0.00 H new ATOM 0 HD1 PHE B 9 2.655 -10.758 -4.945 1.00 0.00 H new ATOM 0 HD2 PHE B 9 3.291 -9.164 -1.019 1.00 0.00 H new ATOM 0 HE1 PHE B 9 3.196 -8.562 -5.909 1.00 0.00 H new ATOM 0 HE2 PHE B 9 4.090 -7.052 -2.018 1.00 0.00 H new ATOM 0 HZ PHE B 9 3.698 -6.675 -4.414 1.00 0.00 H new ATOM 613 N ARG B 10 5.920 -13.147 -2.226 1.00 0.00 N ATOM 614 CA ARG B 10 6.454 -13.521 -3.571 1.00 0.00 C ATOM 615 C ARG B 10 6.980 -12.276 -4.335 1.00 0.00 C ATOM 616 O ARG B 10 6.259 -11.633 -5.101 1.00 0.00 O ATOM 617 CB ARG B 10 5.712 -14.558 -4.430 1.00 0.00 C ATOM 618 CG ARG B 10 6.471 -15.078 -5.668 1.00 0.00 C ATOM 619 CD ARG B 10 7.922 -15.572 -5.493 1.00 0.00 C ATOM 620 NE ARG B 10 8.443 -16.050 -6.801 1.00 0.00 N ATOM 621 CZ ARG B 10 9.090 -15.309 -7.696 1.00 0.00 C ATOM 622 NH1 ARG B 10 9.335 -14.039 -7.562 1.00 0.00 N ATOM 623 NH2 ARG B 10 9.488 -15.893 -8.769 1.00 0.00 N ATOM 0 H ARG B 10 6.679 -13.067 -1.549 1.00 0.00 H new ATOM 0 HA ARG B 10 7.300 -14.159 -3.316 1.00 0.00 H new ATOM 0 HB2 ARG B 10 5.460 -15.410 -3.799 1.00 0.00 H new ATOM 0 HB3 ARG B 10 4.772 -14.119 -4.763 1.00 0.00 H new ATOM 0 HG2 ARG B 10 5.891 -15.898 -6.091 1.00 0.00 H new ATOM 0 HG3 ARG B 10 6.481 -14.279 -6.410 1.00 0.00 H new ATOM 0 HD2 ARG B 10 8.549 -14.766 -5.112 1.00 0.00 H new ATOM 0 HD3 ARG B 10 7.958 -16.377 -4.759 1.00 0.00 H new ATOM 0 HE ARG B 10 8.291 -17.032 -7.032 1.00 0.00 H new ATOM 0 HH11 ARG B 10 9.024 -13.545 -6.725 1.00 0.00 H new ATOM 0 HH12 ARG B 10 9.838 -13.537 -8.293 1.00 0.00 H new ATOM 0 HH21 ARG B 10 9.304 -16.887 -8.907 1.00 0.00 H new ATOM 0 HH22 ARG B 10 9.988 -15.363 -9.483 1.00 0.00 H new ATOM 624 N MET B 11 8.228 -11.900 -4.037 1.00 0.00 N ATOM 625 CA MET B 11 8.692 -10.503 -4.241 1.00 0.00 C ATOM 626 C MET B 11 10.234 -10.473 -4.519 1.00 0.00 C ATOM 627 O MET B 11 10.967 -11.034 -3.700 1.00 0.00 O ATOM 628 CB MET B 11 8.378 -9.707 -2.940 1.00 0.00 C ATOM 629 CG MET B 11 6.912 -9.411 -2.584 1.00 0.00 C ATOM 630 SD MET B 11 6.874 -8.590 -0.986 1.00 0.00 S ATOM 631 CE MET B 11 5.696 -9.617 -0.095 1.00 0.00 C ATOM 0 H MET B 11 8.936 -12.528 -3.657 1.00 0.00 H new ATOM 0 HA MET B 11 8.185 -10.061 -5.099 1.00 0.00 H new ATOM 0 HB2 MET B 11 8.815 -10.255 -2.105 1.00 0.00 H new ATOM 0 HB3 MET B 11 8.901 -8.753 -3.004 1.00 0.00 H new ATOM 0 HG2 MET B 11 6.456 -8.779 -3.346 1.00 0.00 H new ATOM 0 HG3 MET B 11 6.335 -10.335 -2.550 1.00 0.00 H new ATOM 0 HE1 MET B 11 4.901 -8.991 0.310 1.00 0.00 H new ATOM 0 HE2 MET B 11 5.268 -10.353 -0.775 1.00 0.00 H new ATOM 0 HE3 MET B 11 6.205 -10.130 0.721 1.00 0.00 H new ATOM 632 N PRO B 12 10.809 -9.803 -5.565 1.00 0.00 N ATOM 633 CA PRO B 12 12.281 -9.567 -5.675 1.00 0.00 C ATOM 634 C PRO B 12 13.045 -9.106 -4.397 1.00 0.00 C ATOM 635 O PRO B 12 12.460 -8.433 -3.535 1.00 0.00 O ATOM 636 CB PRO B 12 12.360 -8.559 -6.837 1.00 0.00 C ATOM 637 CG PRO B 12 11.143 -8.881 -7.704 1.00 0.00 C ATOM 638 CD PRO B 12 10.052 -9.246 -6.698 1.00 0.00 C ATOM 0 HA PRO B 12 12.807 -10.507 -5.840 1.00 0.00 H new ATOM 0 HB2 PRO B 12 12.329 -7.532 -6.474 1.00 0.00 H new ATOM 0 HB3 PRO B 12 13.288 -8.671 -7.398 1.00 0.00 H new ATOM 0 HG2 PRO B 12 10.852 -8.026 -8.315 1.00 0.00 H new ATOM 0 HG3 PRO B 12 11.347 -9.706 -8.387 1.00 0.00 H new ATOM 0 HD2 PRO B 12 9.469 -8.374 -6.402 1.00 0.00 H new ATOM 0 HD3 PRO B 12 9.352 -9.973 -7.110 1.00 0.00 H new ATOM 639 N MET B 13 14.328 -9.507 -4.255 1.00 0.00 N ATOM 640 CA MET B 13 15.054 -9.383 -2.956 1.00 0.00 C ATOM 641 C MET B 13 14.963 -8.010 -2.190 1.00 0.00 C ATOM 642 O MET B 13 14.845 -7.992 -0.965 1.00 0.00 O ATOM 643 CB MET B 13 16.557 -9.780 -3.096 1.00 0.00 C ATOM 644 CG MET B 13 17.312 -10.116 -1.782 1.00 0.00 C ATOM 645 SD MET B 13 17.075 -11.806 -1.188 1.00 0.00 S ATOM 646 CE MET B 13 15.463 -11.755 -0.385 1.00 0.00 C ATOM 0 H MET B 13 14.882 -9.915 -5.008 1.00 0.00 H new ATOM 0 HA MET B 13 14.502 -10.087 -2.333 1.00 0.00 H new ATOM 0 HB2 MET B 13 16.621 -10.645 -3.756 1.00 0.00 H new ATOM 0 HB3 MET B 13 17.081 -8.962 -3.590 1.00 0.00 H new ATOM 0 HG2 MET B 13 18.377 -9.946 -1.937 1.00 0.00 H new ATOM 0 HG3 MET B 13 16.988 -9.423 -1.005 1.00 0.00 H new ATOM 0 HE1 MET B 13 15.393 -12.564 0.342 1.00 0.00 H new ATOM 0 HE2 MET B 13 15.340 -10.799 0.124 1.00 0.00 H new ATOM 0 HE3 MET B 13 14.680 -11.871 -1.134 1.00 0.00 H new ATOM 647 N GLU B 14 15.014 -6.872 -2.903 1.00 0.00 N ATOM 648 CA GLU B 14 14.748 -5.531 -2.317 1.00 0.00 C ATOM 649 C GLU B 14 13.308 -5.277 -1.770 1.00 0.00 C ATOM 650 O GLU B 14 13.192 -4.871 -0.619 1.00 0.00 O ATOM 651 CB GLU B 14 15.275 -4.437 -3.288 1.00 0.00 C ATOM 652 CG GLU B 14 14.478 -4.230 -4.608 1.00 0.00 C ATOM 653 CD GLU B 14 15.013 -3.139 -5.527 1.00 0.00 C ATOM 654 OE1 GLU B 14 16.125 -3.530 -6.203 1.00 0.00 O ATOM 655 OE2 GLU B 14 14.492 -2.036 -5.654 1.00 0.00 O ATOM 0 H GLU B 14 15.239 -6.847 -3.898 1.00 0.00 H new ATOM 0 HA GLU B 14 15.312 -5.482 -1.386 1.00 0.00 H new ATOM 0 HB2 GLU B 14 15.297 -3.488 -2.752 1.00 0.00 H new ATOM 0 HB3 GLU B 14 16.305 -4.680 -3.547 1.00 0.00 H new ATOM 0 HG2 GLU B 14 14.466 -5.171 -5.157 1.00 0.00 H new ATOM 0 HG3 GLU B 14 13.444 -3.995 -4.356 1.00 0.00 H new ATOM 656 N VAL B 15 12.223 -5.536 -2.521 1.00 0.00 N ATOM 657 CA VAL B 15 10.818 -5.390 -2.043 1.00 0.00 C ATOM 658 C VAL B 15 10.488 -6.264 -0.823 1.00 0.00 C ATOM 659 O VAL B 15 9.970 -5.736 0.154 1.00 0.00 O ATOM 660 CB VAL B 15 9.772 -5.673 -3.183 1.00 0.00 C ATOM 661 CG1 VAL B 15 8.813 -4.486 -3.323 1.00 0.00 C ATOM 662 CG2 VAL B 15 10.266 -5.985 -4.619 1.00 0.00 C ATOM 0 H VAL B 15 12.287 -5.856 -3.487 1.00 0.00 H new ATOM 0 HA VAL B 15 10.741 -4.348 -1.734 1.00 0.00 H new ATOM 0 HB VAL B 15 9.331 -6.602 -2.822 1.00 0.00 H new ATOM 0 HG11 VAL B 15 8.093 -4.692 -4.115 1.00 0.00 H new ATOM 0 HG12 VAL B 15 8.284 -4.333 -2.382 1.00 0.00 H new ATOM 0 HG13 VAL B 15 9.379 -3.588 -3.572 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.408 -6.153 -5.270 1.00 0.00 H new ATOM 0 HG22 VAL B 15 10.847 -5.143 -4.995 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.890 -6.879 -4.603 1.00 0.00 H new ATOM 663 N ARG B 16 10.770 -7.573 -0.848 1.00 0.00 N ATOM 664 CA ARG B 16 10.645 -8.370 0.382 1.00 0.00 C ATOM 665 C ARG B 16 11.646 -8.042 1.515 1.00 0.00 C ATOM 666 O ARG B 16 11.208 -8.108 2.650 1.00 0.00 O ATOM 667 CB ARG B 16 10.589 -9.879 0.104 1.00 0.00 C ATOM 668 CG ARG B 16 9.465 -10.530 0.952 1.00 0.00 C ATOM 669 CD ARG B 16 9.906 -11.903 1.417 1.00 0.00 C ATOM 670 NE ARG B 16 8.897 -12.458 2.348 1.00 0.00 N ATOM 671 CZ ARG B 16 8.919 -13.696 2.835 1.00 0.00 C ATOM 672 NH1 ARG B 16 9.754 -14.615 2.461 1.00 0.00 N ATOM 673 NH2 ARG B 16 8.067 -14.001 3.744 1.00 0.00 N ATOM 0 H ARG B 16 11.075 -8.089 -1.673 1.00 0.00 H new ATOM 0 HA ARG B 16 9.680 -8.052 0.777 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.406 -10.056 -0.956 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.549 -10.338 0.343 1.00 0.00 H new ATOM 0 HG2 ARG B 16 9.234 -9.901 1.812 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.552 -10.611 0.362 1.00 0.00 H new ATOM 0 HD2 ARG B 16 10.030 -12.566 0.561 1.00 0.00 H new ATOM 0 HD3 ARG B 16 10.875 -11.837 1.912 1.00 0.00 H new ATOM 0 HE ARG B 16 8.132 -11.849 2.636 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.454 -14.409 1.748 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.711 -15.544 2.880 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.400 -13.303 4.072 1.00 0.00 H new ATOM 0 HH22 ARG B 16 8.057 -14.942 4.139 1.00 0.00 H new ATOM 674 N GLU B 17 12.897 -7.604 1.302 1.00 0.00 N ATOM 675 CA GLU B 17 13.636 -6.913 2.398 1.00 0.00 C ATOM 676 C GLU B 17 12.941 -5.610 2.903 1.00 0.00 C ATOM 677 O GLU B 17 12.801 -5.473 4.108 1.00 0.00 O ATOM 678 CB GLU B 17 15.089 -6.605 1.989 1.00 0.00 C ATOM 679 CG GLU B 17 16.054 -7.814 1.944 1.00 0.00 C ATOM 680 CD GLU B 17 17.413 -7.455 1.357 1.00 0.00 C ATOM 681 OE1 GLU B 17 17.327 -7.177 0.025 1.00 0.00 O ATOM 682 OE2 GLU B 17 18.448 -7.413 2.012 1.00 0.00 O ATOM 0 H GLU B 17 13.409 -7.704 0.426 1.00 0.00 H new ATOM 0 HA GLU B 17 13.633 -7.616 3.231 1.00 0.00 H new ATOM 0 HB2 GLU B 17 15.077 -6.139 1.004 1.00 0.00 H new ATOM 0 HB3 GLU B 17 15.493 -5.869 2.685 1.00 0.00 H new ATOM 0 HG2 GLU B 17 16.189 -8.204 2.953 1.00 0.00 H new ATOM 0 HG3 GLU B 17 15.605 -8.611 1.351 1.00 0.00 H new ATOM 683 N LYS B 18 12.479 -4.671 2.064 1.00 0.00 N ATOM 684 CA LYS B 18 11.767 -3.455 2.547 1.00 0.00 C ATOM 685 C LYS B 18 10.311 -3.617 3.105 1.00 0.00 C ATOM 686 O LYS B 18 9.996 -3.018 4.138 1.00 0.00 O ATOM 687 CB LYS B 18 12.240 -2.197 1.780 1.00 0.00 C ATOM 688 CG LYS B 18 11.929 -2.076 0.271 1.00 0.00 C ATOM 689 CD LYS B 18 13.145 -1.666 -0.580 1.00 0.00 C ATOM 690 CE LYS B 18 12.815 -1.605 -2.074 1.00 0.00 C ATOM 691 NZ LYS B 18 13.976 -1.018 -2.775 1.00 0.00 N ATOM 0 H LYS B 18 12.580 -4.720 1.050 1.00 0.00 H new ATOM 0 HA LYS B 18 12.085 -3.221 3.563 1.00 0.00 H new ATOM 0 HB2 LYS B 18 11.807 -1.328 2.275 1.00 0.00 H new ATOM 0 HB3 LYS B 18 13.321 -2.126 1.899 1.00 0.00 H new ATOM 0 HG2 LYS B 18 11.549 -3.032 -0.091 1.00 0.00 H new ATOM 0 HG3 LYS B 18 11.134 -1.343 0.130 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.505 -0.692 -0.250 1.00 0.00 H new ATOM 0 HD3 LYS B 18 13.955 -2.377 -0.418 1.00 0.00 H new ATOM 0 HE2 LYS B 18 12.602 -2.603 -2.458 1.00 0.00 H new ATOM 0 HE3 LYS B 18 11.923 -1.002 -2.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 14.039 -1.415 -3.734 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.861 0.014 -2.834 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 14.846 -1.239 -2.251 1.00 0.00 H new ATOM 692 N LEU B 19 9.483 -4.519 2.555 1.00 0.00 N ATOM 693 CA LEU B 19 8.223 -4.998 3.179 1.00 0.00 C ATOM 694 C LEU B 19 8.452 -5.890 4.471 1.00 0.00 C ATOM 695 O LEU B 19 7.746 -5.719 5.470 1.00 0.00 O ATOM 696 CB LEU B 19 7.326 -5.478 1.983 1.00 0.00 C ATOM 697 CG LEU B 19 5.869 -4.969 1.787 1.00 0.00 C ATOM 698 CD1 LEU B 19 5.194 -5.860 0.738 1.00 0.00 C ATOM 699 CD2 LEU B 19 4.943 -4.842 3.016 1.00 0.00 C ATOM 0 H LEU B 19 9.667 -4.948 1.648 1.00 0.00 H new ATOM 0 HA LEU B 19 7.635 -4.237 3.692 1.00 0.00 H new ATOM 0 HB2 LEU B 19 7.868 -5.238 1.068 1.00 0.00 H new ATOM 0 HB3 LEU B 19 7.273 -6.565 2.047 1.00 0.00 H new ATOM 0 HG LEU B 19 5.999 -3.929 1.488 1.00 0.00 H new ATOM 0 HD11 LEU B 19 4.169 -5.524 0.581 1.00 0.00 H new ATOM 0 HD12 LEU B 19 5.744 -5.797 -0.201 1.00 0.00 H new ATOM 0 HD13 LEU B 19 5.188 -6.893 1.087 1.00 0.00 H new ATOM 0 HD21 LEU B 19 3.967 -4.474 2.700 1.00 0.00 H new ATOM 0 HD22 LEU B 19 4.828 -5.818 3.487 1.00 0.00 H new ATOM 0 HD23 LEU B 19 5.380 -4.144 3.730 1.00 0.00 H new ATOM 700 N LYS B 20 9.459 -6.795 4.497 1.00 0.00 N ATOM 701 CA LYS B 20 9.744 -7.723 5.614 1.00 0.00 C ATOM 702 C LYS B 20 10.699 -7.162 6.713 1.00 0.00 C ATOM 703 O LYS B 20 10.533 -7.547 7.864 1.00 0.00 O ATOM 704 CB LYS B 20 10.244 -9.092 5.106 1.00 0.00 C ATOM 705 CG LYS B 20 10.215 -10.248 6.126 1.00 0.00 C ATOM 706 CD LYS B 20 10.659 -11.614 5.568 1.00 0.00 C ATOM 707 CE LYS B 20 11.945 -11.600 4.725 1.00 0.00 C ATOM 708 NZ LYS B 20 12.296 -12.976 4.330 1.00 0.00 N ATOM 0 H LYS B 20 10.112 -6.902 3.721 1.00 0.00 H new ATOM 0 HA LYS B 20 8.780 -7.852 6.106 1.00 0.00 H new ATOM 0 HB2 LYS B 20 9.640 -9.379 4.245 1.00 0.00 H new ATOM 0 HB3 LYS B 20 11.268 -8.973 4.752 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.858 -9.988 6.967 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.202 -10.343 6.517 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.801 -12.299 6.404 1.00 0.00 H new ATOM 0 HD3 LYS B 20 9.851 -12.018 4.959 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.803 -10.982 3.838 1.00 0.00 H new ATOM 0 HE3 LYS B 20 12.761 -11.156 5.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 13.240 -12.982 3.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.299 -13.588 5.171 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.597 -13.330 3.647 1.00 0.00 H new ATOM 709 N PHE B 21 11.667 -6.263 6.432 1.00 0.00 N ATOM 710 CA PHE B 21 12.193 -5.306 7.445 1.00 0.00 C ATOM 711 C PHE B 21 11.062 -4.433 7.991 1.00 0.00 C ATOM 712 O PHE B 21 10.728 -4.762 9.108 1.00 0.00 O ATOM 713 CB PHE B 21 13.415 -4.453 7.010 1.00 0.00 C ATOM 714 CG PHE B 21 14.738 -5.213 7.028 1.00 0.00 C ATOM 715 CD1 PHE B 21 15.236 -5.749 8.221 1.00 0.00 C ATOM 716 CD2 PHE B 21 15.441 -5.403 5.842 1.00 0.00 C ATOM 717 CE1 PHE B 21 16.391 -6.520 8.207 1.00 0.00 C ATOM 718 CE2 PHE B 21 16.596 -6.173 5.825 1.00 0.00 C ATOM 719 CZ PHE B 21 17.074 -6.736 7.009 1.00 0.00 C ATOM 0 H PHE B 21 12.103 -6.176 5.514 1.00 0.00 H new ATOM 0 HA PHE B 21 12.595 -5.935 8.239 1.00 0.00 H new ATOM 0 HB2 PHE B 21 13.240 -4.072 6.004 1.00 0.00 H new ATOM 0 HB3 PHE B 21 13.495 -3.588 7.669 1.00 0.00 H new ATOM 0 HD1 PHE B 21 14.722 -5.563 9.153 1.00 0.00 H new ATOM 0 HD2 PHE B 21 15.086 -4.948 4.929 1.00 0.00 H new ATOM 0 HE1 PHE B 21 16.761 -6.953 9.124 1.00 0.00 H new ATOM 0 HE2 PHE B 21 17.124 -6.336 4.897 1.00 0.00 H new ATOM 0 HZ PHE B 21 17.971 -7.338 6.998 1.00 0.00 H new ATOM 720 N ARG B 22 10.394 -3.474 7.326 1.00 0.00 N ATOM 721 CA ARG B 22 9.131 -2.843 7.852 1.00 0.00 C ATOM 722 C ARG B 22 8.312 -3.680 8.926 1.00 0.00 C ATOM 723 O ARG B 22 8.356 -3.326 10.107 1.00 0.00 O ATOM 724 CB ARG B 22 8.382 -2.291 6.616 1.00 0.00 C ATOM 725 CG ARG B 22 7.170 -1.395 6.971 1.00 0.00 C ATOM 726 CD ARG B 22 6.961 -0.242 5.989 1.00 0.00 C ATOM 727 NE ARG B 22 5.829 0.577 6.486 1.00 0.00 N ATOM 728 CZ ARG B 22 5.510 1.800 6.068 1.00 0.00 C ATOM 729 NH1 ARG B 22 6.126 2.436 5.116 1.00 0.00 N ATOM 730 NH2 ARG B 22 4.524 2.394 6.643 1.00 0.00 N ATOM 0 H ARG B 22 10.693 -3.107 6.423 1.00 0.00 H new ATOM 0 HA ARG B 22 9.359 -2.011 8.519 1.00 0.00 H new ATOM 0 HB2 ARG B 22 9.080 -1.718 6.006 1.00 0.00 H new ATOM 0 HB3 ARG B 22 8.038 -3.127 6.007 1.00 0.00 H new ATOM 0 HG2 ARG B 22 6.269 -2.008 6.997 1.00 0.00 H new ATOM 0 HG3 ARG B 22 7.309 -0.989 7.973 1.00 0.00 H new ATOM 0 HD2 ARG B 22 7.865 0.362 5.912 1.00 0.00 H new ATOM 0 HD3 ARG B 22 6.747 -0.624 4.991 1.00 0.00 H new ATOM 0 HE ARG B 22 5.243 0.167 7.213 1.00 0.00 H new ATOM 0 HH11 ARG B 22 6.912 1.998 4.635 1.00 0.00 H new ATOM 0 HH12 ARG B 22 5.824 3.373 4.850 1.00 0.00 H new ATOM 0 HH21 ARG B 22 4.015 1.927 7.393 1.00 0.00 H new ATOM 0 HH22 ARG B 22 4.252 3.332 6.348 1.00 0.00 H new ATOM 731 N ALA B 23 7.911 -4.924 8.581 1.00 0.00 N ATOM 732 CA ALA B 23 7.579 -5.999 9.562 1.00 0.00 C ATOM 733 C ALA B 23 8.581 -6.392 10.712 1.00 0.00 C ATOM 734 O ALA B 23 8.290 -6.137 11.875 1.00 0.00 O ATOM 735 CB ALA B 23 7.220 -7.214 8.697 1.00 0.00 C ATOM 0 H ALA B 23 7.806 -5.219 7.610 1.00 0.00 H new ATOM 0 HA ALA B 23 6.785 -5.590 10.186 1.00 0.00 H new ATOM 0 HB1 ALA B 23 6.961 -8.055 9.340 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.370 -6.969 8.061 1.00 0.00 H new ATOM 0 HB3 ALA B 23 8.074 -7.482 8.075 1.00 0.00 H new ATOM 736 N GLU B 24 9.704 -7.059 10.415 1.00 0.00 N ATOM 737 CA GLU B 24 10.718 -7.530 11.411 1.00 0.00 C ATOM 738 C GLU B 24 11.651 -6.456 12.079 1.00 0.00 C ATOM 739 O GLU B 24 12.026 -6.606 13.241 1.00 0.00 O ATOM 740 CB GLU B 24 11.556 -8.676 10.767 1.00 0.00 C ATOM 741 CG GLU B 24 10.805 -9.938 10.239 1.00 0.00 C ATOM 742 CD GLU B 24 9.838 -10.676 11.169 1.00 0.00 C ATOM 743 OE1 GLU B 24 10.336 -10.830 12.427 1.00 0.00 O ATOM 744 OE2 GLU B 24 8.745 -11.100 10.801 1.00 0.00 O ATOM 0 H GLU B 24 9.953 -7.300 9.456 1.00 0.00 H new ATOM 0 HA GLU B 24 10.127 -7.872 12.261 1.00 0.00 H new ATOM 0 HB2 GLU B 24 12.116 -8.250 9.934 1.00 0.00 H new ATOM 0 HB3 GLU B 24 12.286 -9.009 11.505 1.00 0.00 H new ATOM 0 HG2 GLU B 24 10.244 -9.639 9.353 1.00 0.00 H new ATOM 0 HG3 GLU B 24 11.558 -10.655 9.913 1.00 0.00 H new ATOM 745 N ALA B 25 11.995 -5.379 11.361 1.00 0.00 N ATOM 746 CA ALA B 25 12.318 -4.047 11.937 1.00 0.00 C ATOM 747 C ALA B 25 11.400 -3.541 13.116 1.00 0.00 C ATOM 748 O ALA B 25 11.924 -3.076 14.130 1.00 0.00 O ATOM 749 CB ALA B 25 12.220 -3.047 10.754 1.00 0.00 C ATOM 0 H ALA B 25 12.061 -5.399 10.343 1.00 0.00 H new ATOM 0 HA ALA B 25 13.303 -4.126 12.397 1.00 0.00 H new ATOM 0 HB1 ALA B 25 12.447 -2.041 11.108 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.933 -3.329 9.979 1.00 0.00 H new ATOM 0 HB3 ALA B 25 11.211 -3.068 10.343 1.00 0.00 H new ATOM 750 N ASN B 26 10.053 -3.611 12.970 1.00 0.00 N ATOM 751 CA ASN B 26 9.093 -3.146 14.019 1.00 0.00 C ATOM 752 C ASN B 26 8.567 -4.234 15.039 1.00 0.00 C ATOM 753 O ASN B 26 8.411 -3.942 16.226 1.00 0.00 O ATOM 754 CB ASN B 26 8.023 -2.297 13.259 1.00 0.00 C ATOM 755 CG ASN B 26 6.618 -2.842 13.060 1.00 0.00 C ATOM 756 OD1 ASN B 26 5.778 -2.896 13.947 1.00 0.00 O ATOM 757 ND2 ASN B 26 6.315 -3.224 11.864 1.00 0.00 N ATOM 0 H ASN B 26 9.600 -3.985 12.136 1.00 0.00 H new ATOM 0 HA ASN B 26 9.603 -2.527 14.756 1.00 0.00 H new ATOM 0 HB2 ASN B 26 7.930 -1.347 13.785 1.00 0.00 H new ATOM 0 HB3 ASN B 26 8.427 -2.076 12.271 1.00 0.00 H new ATOM 0 HD21 ASN B 26 5.377 -3.570 11.661 1.00 0.00 H new ATOM 0 HD22 ASN B 26 7.014 -3.180 11.122 1.00 0.00 H new ATOM 758 N GLY B 27 8.250 -5.448 14.563 1.00 0.00 N ATOM 759 CA GLY B 27 7.492 -6.489 15.326 1.00 0.00 C ATOM 760 C GLY B 27 6.084 -6.851 14.777 1.00 0.00 C ATOM 761 O GLY B 27 5.115 -6.858 15.536 1.00 0.00 O ATOM 0 H GLY B 27 8.510 -5.752 13.625 1.00 0.00 H new ATOM 0 HA2 GLY B 27 8.093 -7.398 15.355 1.00 0.00 H new ATOM 0 HA3 GLY B 27 7.381 -6.147 16.355 1.00 0.00 H new ATOM 762 N ARG B 28 5.948 -7.147 13.470 1.00 0.00 N ATOM 763 CA ARG B 28 4.623 -7.184 12.777 1.00 0.00 C ATOM 764 C ARG B 28 4.786 -8.099 11.556 1.00 0.00 C ATOM 765 O ARG B 28 5.040 -7.646 10.451 1.00 0.00 O ATOM 766 CB ARG B 28 4.264 -5.707 12.449 1.00 0.00 C ATOM 767 CG ARG B 28 2.793 -5.342 12.212 1.00 0.00 C ATOM 768 CD ARG B 28 2.670 -3.848 11.818 1.00 0.00 C ATOM 769 NE ARG B 28 1.513 -3.207 12.455 1.00 0.00 N ATOM 770 CZ ARG B 28 1.494 -2.739 13.708 1.00 0.00 C ATOM 771 NH1 ARG B 28 2.500 -2.787 14.534 1.00 0.00 N ATOM 772 NH2 ARG B 28 0.410 -2.202 14.136 1.00 0.00 N ATOM 0 H ARG B 28 6.737 -7.366 12.861 1.00 0.00 H new ATOM 0 HA ARG B 28 3.801 -7.593 13.364 1.00 0.00 H new ATOM 0 HB2 ARG B 28 4.630 -5.088 13.268 1.00 0.00 H new ATOM 0 HB3 ARG B 28 4.823 -5.421 11.558 1.00 0.00 H new ATOM 0 HG2 ARG B 28 2.377 -5.969 11.423 1.00 0.00 H new ATOM 0 HG3 ARG B 28 2.212 -5.537 13.114 1.00 0.00 H new ATOM 0 HD2 ARG B 28 3.580 -3.321 12.104 1.00 0.00 H new ATOM 0 HD3 ARG B 28 2.581 -3.764 10.735 1.00 0.00 H new ATOM 0 HE ARG B 28 0.661 -3.112 11.902 1.00 0.00 H new ATOM 0 HH11 ARG B 28 3.383 -3.205 14.239 1.00 0.00 H new ATOM 0 HH12 ARG B 28 2.405 -2.407 15.476 1.00 0.00 H new ATOM 0 HH21 ARG B 28 -0.405 -2.142 13.525 1.00 0.00 H new ATOM 0 HH22 ARG B 28 0.363 -1.836 15.087 1.00 0.00 H new ATOM 773 N SER B 29 4.607 -9.411 11.680 1.00 0.00 N ATOM 774 CA SER B 29 5.347 -10.354 10.779 1.00 0.00 C ATOM 775 C SER B 29 4.573 -10.431 9.437 1.00 0.00 C ATOM 776 O SER B 29 3.349 -10.459 9.497 1.00 0.00 O ATOM 777 CB SER B 29 5.513 -11.715 11.481 1.00 0.00 C ATOM 778 OG SER B 29 6.427 -12.536 10.753 1.00 0.00 O ATOM 0 H SER B 29 3.988 -9.854 12.359 1.00 0.00 H new ATOM 0 HA SER B 29 6.357 -10.007 10.561 1.00 0.00 H new ATOM 0 HB2 SER B 29 5.877 -11.566 12.498 1.00 0.00 H new ATOM 0 HB3 SER B 29 4.547 -12.213 11.558 1.00 0.00 H new ATOM 0 HG SER B 29 7.278 -12.062 10.645 1.00 0.00 H new ATOM 779 N MET B 30 5.183 -10.264 8.253 1.00 0.00 N ATOM 780 CA MET B 30 4.499 -9.556 7.126 1.00 0.00 C ATOM 781 C MET B 30 3.029 -9.919 6.772 1.00 0.00 C ATOM 782 O MET B 30 2.281 -8.995 6.521 1.00 0.00 O ATOM 783 CB MET B 30 5.277 -9.683 5.815 1.00 0.00 C ATOM 784 CG MET B 30 6.366 -8.685 5.532 1.00 0.00 C ATOM 785 SD MET B 30 5.951 -7.797 4.047 1.00 0.00 S ATOM 786 CE MET B 30 7.063 -8.625 2.944 1.00 0.00 C ATOM 0 H MET B 30 6.124 -10.595 8.040 1.00 0.00 H new ATOM 0 HA MET B 30 4.473 -8.551 7.548 1.00 0.00 H new ATOM 0 HB2 MET B 30 5.722 -10.677 5.788 1.00 0.00 H new ATOM 0 HB3 MET B 30 4.559 -9.633 4.996 1.00 0.00 H new ATOM 0 HG2 MET B 30 6.473 -7.994 6.368 1.00 0.00 H new ATOM 0 HG3 MET B 30 7.323 -9.193 5.414 1.00 0.00 H new ATOM 0 HE1 MET B 30 6.946 -8.221 1.938 1.00 0.00 H new ATOM 0 HE2 MET B 30 8.089 -8.472 3.279 1.00 0.00 H new ATOM 0 HE3 MET B 30 6.840 -9.692 2.935 1.00 0.00 H new ATOM 787 N ASN B 31 2.508 -11.149 6.766 1.00 0.00 N ATOM 788 CA ASN B 31 1.017 -11.312 6.707 1.00 0.00 C ATOM 789 C ASN B 31 0.203 -10.424 7.743 1.00 0.00 C ATOM 790 O ASN B 31 -0.732 -9.747 7.325 1.00 0.00 O ATOM 791 CB ASN B 31 0.608 -12.806 6.663 1.00 0.00 C ATOM 792 CG ASN B 31 -0.534 -13.132 5.698 1.00 0.00 C ATOM 793 OD1 ASN B 31 -0.413 -13.992 4.838 1.00 0.00 O ATOM 794 ND2 ASN B 31 -1.636 -12.428 5.735 1.00 0.00 N ATOM 0 H ASN B 31 3.045 -12.016 6.799 1.00 0.00 H new ATOM 0 HA ASN B 31 0.705 -10.885 5.754 1.00 0.00 H new ATOM 0 HB2 ASN B 31 1.480 -13.398 6.385 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.317 -13.118 7.666 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -2.375 -12.601 5.054 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -1.756 -11.706 6.445 1.00 0.00 H new ATOM 795 N SER B 32 0.696 -10.268 8.988 1.00 0.00 N ATOM 796 CA SER B 32 0.516 -9.030 9.802 1.00 0.00 C ATOM 797 C SER B 32 1.002 -7.647 9.224 1.00 0.00 C ATOM 798 O SER B 32 0.114 -6.830 8.974 1.00 0.00 O ATOM 799 CB SER B 32 0.921 -9.336 11.266 1.00 0.00 C ATOM 800 OG SER B 32 0.883 -8.179 12.104 1.00 0.00 O ATOM 0 H SER B 32 1.232 -10.993 9.466 1.00 0.00 H new ATOM 0 HA SER B 32 -0.548 -8.800 9.752 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.253 -10.095 11.672 1.00 0.00 H new ATOM 0 HB3 SER B 32 1.927 -9.756 11.280 1.00 0.00 H new ATOM 0 HG SER B 32 1.145 -8.426 13.015 1.00 0.00 H new ATOM 801 N GLU B 33 2.300 -7.307 9.005 1.00 0.00 N ATOM 802 CA GLU B 33 2.644 -5.923 8.478 1.00 0.00 C ATOM 803 C GLU B 33 2.165 -5.612 7.048 1.00 0.00 C ATOM 804 O GLU B 33 1.554 -4.575 6.844 1.00 0.00 O ATOM 805 CB GLU B 33 4.130 -5.548 8.367 1.00 0.00 C ATOM 806 CG GLU B 33 4.560 -4.116 7.904 1.00 0.00 C ATOM 807 CD GLU B 33 4.034 -2.896 8.660 1.00 0.00 C ATOM 808 OE1 GLU B 33 2.864 -2.531 8.647 1.00 0.00 O ATOM 809 OE2 GLU B 33 5.013 -2.240 9.332 1.00 0.00 O ATOM 0 H GLU B 33 3.098 -7.921 9.168 1.00 0.00 H new ATOM 0 HA GLU B 33 2.129 -5.367 9.262 1.00 0.00 H new ATOM 0 HB2 GLU B 33 4.577 -5.716 9.347 1.00 0.00 H new ATOM 0 HB3 GLU B 33 4.590 -6.259 7.680 1.00 0.00 H new ATOM 0 HG2 GLU B 33 5.649 -4.075 7.934 1.00 0.00 H new ATOM 0 HG3 GLU B 33 4.265 -4.007 6.860 1.00 0.00 H new ATOM 810 N LEU B 34 2.527 -6.443 6.044 1.00 0.00 N ATOM 811 CA LEU B 34 1.929 -6.422 4.697 1.00 0.00 C ATOM 812 C LEU B 34 0.402 -6.183 4.851 1.00 0.00 C ATOM 813 O LEU B 34 -0.014 -5.161 4.338 1.00 0.00 O ATOM 814 CB LEU B 34 2.291 -7.710 3.907 1.00 0.00 C ATOM 815 CG LEU B 34 2.662 -7.658 2.400 1.00 0.00 C ATOM 816 CD1 LEU B 34 2.459 -8.993 1.674 1.00 0.00 C ATOM 817 CD2 LEU B 34 2.010 -6.598 1.496 1.00 0.00 C ATOM 0 H LEU B 34 3.251 -7.153 6.152 1.00 0.00 H new ATOM 0 HA LEU B 34 2.337 -5.606 4.100 1.00 0.00 H new ATOM 0 HB2 LEU B 34 3.131 -8.174 4.425 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.444 -8.389 4.002 1.00 0.00 H new ATOM 0 HG LEU B 34 3.708 -7.375 2.519 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.738 -8.883 0.626 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.083 -9.758 2.137 1.00 0.00 H new ATOM 0 HD13 LEU B 34 1.412 -9.289 1.742 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.384 -6.708 0.478 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.928 -6.731 1.501 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.255 -5.603 1.867 1.00 0.00 H new ATOM 818 N LEU B 35 -0.432 -6.955 5.622 1.00 0.00 N ATOM 819 CA LEU B 35 -1.870 -6.589 5.731 1.00 0.00 C ATOM 820 C LEU B 35 -2.148 -5.230 6.383 1.00 0.00 C ATOM 821 O LEU B 35 -2.830 -4.417 5.779 1.00 0.00 O ATOM 822 CB LEU B 35 -2.784 -7.631 6.418 1.00 0.00 C ATOM 823 CG LEU B 35 -3.354 -8.751 5.537 1.00 0.00 C ATOM 824 CD1 LEU B 35 -4.377 -9.505 6.381 1.00 0.00 C ATOM 825 CD2 LEU B 35 -4.072 -8.166 4.299 1.00 0.00 C ATOM 0 H LEU B 35 -0.149 -7.784 6.145 1.00 0.00 H new ATOM 0 HA LEU B 35 -2.128 -6.545 4.673 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -2.221 -8.092 7.229 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -3.620 -7.100 6.873 1.00 0.00 H new ATOM 0 HG LEU B 35 -2.548 -9.399 5.192 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -4.810 -10.314 5.792 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -3.887 -9.920 7.262 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.166 -8.821 6.693 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -4.468 -8.979 3.690 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -4.891 -7.524 4.623 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -3.364 -7.582 3.710 1.00 0.00 H new ATOM 826 N GLN B 36 -1.639 -4.999 7.583 1.00 0.00 N ATOM 827 CA GLN B 36 -1.806 -3.707 8.283 1.00 0.00 C ATOM 828 C GLN B 36 -1.300 -2.447 7.502 1.00 0.00 C ATOM 829 O GLN B 36 -2.000 -1.434 7.524 1.00 0.00 O ATOM 830 CB GLN B 36 -1.231 -3.932 9.707 1.00 0.00 C ATOM 831 CG GLN B 36 -1.699 -2.924 10.789 1.00 0.00 C ATOM 832 CD GLN B 36 -0.976 -1.592 10.998 1.00 0.00 C ATOM 833 OE1 GLN B 36 -1.210 -0.915 11.988 1.00 0.00 O ATOM 834 NE2 GLN B 36 -0.062 -1.164 10.172 1.00 0.00 N ATOM 0 H GLN B 36 -1.100 -5.688 8.108 1.00 0.00 H new ATOM 0 HA GLN B 36 -2.857 -3.428 8.354 1.00 0.00 H new ATOM 0 HB2 GLN B 36 -1.500 -4.937 10.033 1.00 0.00 H new ATOM 0 HB3 GLN B 36 -0.143 -3.896 9.649 1.00 0.00 H new ATOM 0 HG2 GLN B 36 -2.742 -2.690 10.576 1.00 0.00 H new ATOM 0 HG3 GLN B 36 -1.679 -3.450 11.744 1.00 0.00 H new ATOM 0 HE21 GLN B 36 0.161 -1.702 9.335 1.00 0.00 H new ATOM 0 HE22 GLN B 36 0.430 -0.291 10.363 1.00 0.00 H new ATOM 835 N ILE B 37 -0.175 -2.514 6.763 1.00 0.00 N ATOM 836 CA ILE B 37 0.211 -1.500 5.744 1.00 0.00 C ATOM 837 C ILE B 37 -0.662 -1.469 4.464 1.00 0.00 C ATOM 838 O ILE B 37 -0.779 -0.402 3.918 1.00 0.00 O ATOM 839 CB ILE B 37 1.750 -1.614 5.420 1.00 0.00 C ATOM 840 CG1 ILE B 37 2.521 -0.271 5.401 1.00 0.00 C ATOM 841 CG2 ILE B 37 2.054 -2.439 4.148 1.00 0.00 C ATOM 842 CD1 ILE B 37 2.336 0.651 4.185 1.00 0.00 C ATOM 0 H ILE B 37 0.499 -3.274 6.852 1.00 0.00 H new ATOM 0 HA ILE B 37 0.009 -0.532 6.202 1.00 0.00 H new ATOM 0 HB ILE B 37 2.134 -2.167 6.277 1.00 0.00 H new ATOM 0 HG12 ILE B 37 2.237 0.290 6.291 1.00 0.00 H new ATOM 0 HG13 ILE B 37 3.584 -0.495 5.491 1.00 0.00 H new ATOM 0 HG21 ILE B 37 3.131 -2.475 3.987 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.671 -3.452 4.271 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.574 -1.972 3.288 1.00 0.00 H new ATOM 0 HD11 ILE B 37 2.938 1.551 4.316 1.00 0.00 H new ATOM 0 HD12 ILE B 37 2.654 0.130 3.282 1.00 0.00 H new ATOM 0 HD13 ILE B 37 1.285 0.927 4.094 1.00 0.00 H new ATOM 843 N VAL B 38 -1.126 -2.588 3.913 1.00 0.00 N ATOM 844 CA VAL B 38 -1.953 -2.708 2.675 1.00 0.00 C ATOM 845 C VAL B 38 -3.440 -2.244 2.919 1.00 0.00 C ATOM 846 O VAL B 38 -3.994 -1.451 2.158 1.00 0.00 O ATOM 847 CB VAL B 38 -1.907 -4.214 2.290 1.00 0.00 C ATOM 848 CG1 VAL B 38 -2.997 -4.879 1.453 1.00 0.00 C ATOM 849 CG2 VAL B 38 -0.569 -4.609 1.656 1.00 0.00 C ATOM 0 H VAL B 38 -0.934 -3.499 4.329 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.565 -2.068 1.882 1.00 0.00 H new ATOM 0 HB VAL B 38 -2.089 -4.600 3.293 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -2.754 -5.932 1.310 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -3.954 -4.794 1.968 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -3.062 -4.387 0.483 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.585 -5.669 1.404 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -0.408 -4.023 0.751 1.00 0.00 H new ATOM 0 HG23 VAL B 38 0.239 -4.415 2.361 1.00 0.00 H new ATOM 850 N GLN B 39 -4.070 -2.736 4.015 1.00 0.00 N ATOM 851 CA GLN B 39 -5.177 -2.046 4.720 1.00 0.00 C ATOM 852 C GLN B 39 -4.892 -0.541 4.996 1.00 0.00 C ATOM 853 O GLN B 39 -5.678 0.279 4.532 1.00 0.00 O ATOM 854 CB GLN B 39 -5.493 -2.833 6.035 1.00 0.00 C ATOM 855 CG GLN B 39 -6.422 -4.069 5.870 1.00 0.00 C ATOM 856 CD GLN B 39 -7.943 -3.862 5.805 1.00 0.00 C ATOM 857 OE1 GLN B 39 -8.712 -4.771 6.092 1.00 0.00 O ATOM 858 NE2 GLN B 39 -8.451 -2.717 5.426 1.00 0.00 N ATOM 0 H GLN B 39 -3.821 -3.631 4.437 1.00 0.00 H new ATOM 0 HA GLN B 39 -6.051 -2.044 4.069 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.552 -3.164 6.474 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -5.953 -2.147 6.746 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -6.122 -4.585 4.958 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -6.218 -4.745 6.700 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -7.835 -1.942 5.181 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -9.463 -2.600 5.376 1.00 0.00 H new ATOM 859 N ASP B 40 -3.744 -0.150 5.599 1.00 0.00 N ATOM 860 CA ASP B 40 -3.254 1.259 5.495 1.00 0.00 C ATOM 861 C ASP B 40 -3.116 1.912 4.071 1.00 0.00 C ATOM 862 O ASP B 40 -3.523 3.057 3.843 1.00 0.00 O ATOM 863 CB ASP B 40 -2.496 1.827 6.722 1.00 0.00 C ATOM 864 CG ASP B 40 -1.013 1.609 6.947 1.00 0.00 C ATOM 865 OD1 ASP B 40 -0.139 2.143 6.291 1.00 0.00 O ATOM 866 OD2 ASP B 40 -0.752 0.798 8.003 1.00 0.00 O ATOM 0 H ASP B 40 -3.148 -0.767 6.151 1.00 0.00 H new ATOM 0 HA ASP B 40 -4.160 1.843 5.656 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -2.652 2.906 6.711 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -3.004 1.441 7.606 1.00 0.00 H new ATOM 867 N ALA B 41 -2.691 1.127 3.080 1.00 0.00 N ATOM 868 CA ALA B 41 -2.307 1.605 1.737 1.00 0.00 C ATOM 869 C ALA B 41 -3.465 2.145 0.852 1.00 0.00 C ATOM 870 O ALA B 41 -3.416 3.246 0.290 1.00 0.00 O ATOM 871 CB ALA B 41 -1.436 0.494 1.105 1.00 0.00 C ATOM 0 H ALA B 41 -2.600 0.116 3.184 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.724 2.521 1.827 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.125 0.800 0.106 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -0.555 0.326 1.724 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -2.014 -0.428 1.039 1.00 0.00 H new ATOM 872 N LEU B 42 -4.514 1.335 0.797 1.00 0.00 N ATOM 873 CA LEU B 42 -5.768 1.623 0.053 1.00 0.00 C ATOM 874 C LEU B 42 -7.092 1.736 0.882 1.00 0.00 C ATOM 875 O LEU B 42 -8.119 2.101 0.302 1.00 0.00 O ATOM 876 CB LEU B 42 -5.827 0.639 -1.139 1.00 0.00 C ATOM 877 CG LEU B 42 -5.545 -0.865 -0.895 1.00 0.00 C ATOM 878 CD1 LEU B 42 -6.585 -1.538 0.013 1.00 0.00 C ATOM 879 CD2 LEU B 42 -5.453 -1.538 -2.256 1.00 0.00 C ATOM 0 H LEU B 42 -4.533 0.434 1.274 1.00 0.00 H new ATOM 0 HA LEU B 42 -5.714 2.653 -0.299 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -6.820 0.719 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -5.116 0.988 -1.888 1.00 0.00 H new ATOM 0 HG LEU B 42 -4.605 -0.971 -0.353 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -6.329 -2.589 0.143 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -6.594 -1.044 0.985 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -7.572 -1.459 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -5.254 -2.602 -2.123 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -6.394 -1.408 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -4.644 -1.087 -2.831 1.00 0.00 H new ATOM 880 N SER B 43 -7.090 1.561 2.219 1.00 0.00 N ATOM 881 CA SER B 43 -8.058 2.300 3.090 1.00 0.00 C ATOM 882 C SER B 43 -7.723 3.811 3.318 1.00 0.00 C ATOM 883 O SER B 43 -8.678 4.561 3.528 1.00 0.00 O ATOM 884 CB SER B 43 -8.319 1.601 4.444 1.00 0.00 C ATOM 885 OG SER B 43 -8.571 0.209 4.271 1.00 0.00 O ATOM 0 H SER B 43 -6.455 0.938 2.718 1.00 0.00 H new ATOM 0 HA SER B 43 -8.978 2.273 2.505 1.00 0.00 H new ATOM 0 HB2 SER B 43 -7.458 1.738 5.098 1.00 0.00 H new ATOM 0 HB3 SER B 43 -9.171 2.068 4.938 1.00 0.00 H new ATOM 0 HG SER B 43 -7.722 -0.264 4.146 1.00 0.00 H new ATOM 886 N LYS B 44 -6.451 4.292 3.253 1.00 0.00 N ATOM 887 CA LYS B 44 -6.162 5.754 3.321 1.00 0.00 C ATOM 888 C LYS B 44 -6.464 6.461 4.711 1.00 0.00 C ATOM 889 O LYS B 44 -5.684 6.159 5.622 1.00 0.00 O ATOM 890 CB LYS B 44 -6.332 6.475 1.940 1.00 0.00 C ATOM 891 CG LYS B 44 -7.585 6.260 1.053 1.00 0.00 C ATOM 892 CD LYS B 44 -7.622 7.252 -0.123 1.00 0.00 C ATOM 893 CE LYS B 44 -8.788 6.999 -1.084 1.00 0.00 C ATOM 894 NZ LYS B 44 -8.750 8.018 -2.152 1.00 0.00 N ATOM 0 H LYS B 44 -5.624 3.703 3.156 1.00 0.00 H new ATOM 0 HA LYS B 44 -5.090 5.917 3.434 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -6.263 7.546 2.133 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -5.467 6.204 1.335 1.00 0.00 H new ATOM 0 HG2 LYS B 44 -7.590 5.240 0.670 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -8.484 6.377 1.658 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -7.694 8.267 0.267 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -6.684 7.188 -0.674 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -8.715 5.999 -1.512 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -9.736 7.048 -0.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -9.537 7.858 -2.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -8.838 8.965 -1.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -7.848 7.950 -2.665 1.00 0.00 H new ATOM 895 N PRO B 45 -7.456 7.369 4.987 1.00 0.00 N ATOM 896 CA PRO B 45 -7.535 8.100 6.282 1.00 0.00 C ATOM 897 C PRO B 45 -8.024 7.302 7.532 1.00 0.00 C ATOM 898 O PRO B 45 -8.929 6.463 7.505 1.00 0.00 O ATOM 899 CB PRO B 45 -8.491 9.273 5.984 1.00 0.00 C ATOM 900 CG PRO B 45 -9.360 8.774 4.825 1.00 0.00 C ATOM 901 CD PRO B 45 -8.466 7.823 4.021 1.00 0.00 C ATOM 0 HA PRO B 45 -6.525 8.377 6.583 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -9.097 9.523 6.855 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -7.941 10.173 5.709 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -10.248 8.260 5.193 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -9.705 9.604 4.208 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -9.036 6.986 3.619 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -8.006 8.331 3.174 1.00 0.00 H new ATOM 902 N SER B 46 -7.492 7.717 8.676 1.00 0.00 N ATOM 903 CA SER B 46 -8.287 7.846 9.927 1.00 0.00 C ATOM 904 C SER B 46 -8.353 9.362 10.381 1.00 0.00 C ATOM 905 O SER B 46 -7.760 10.216 9.708 1.00 0.00 O ATOM 906 CB SER B 46 -7.622 6.888 10.938 1.00 0.00 C ATOM 907 OG SER B 46 -7.775 5.529 10.525 1.00 0.00 O ATOM 0 H SER B 46 -6.511 7.975 8.780 1.00 0.00 H new ATOM 0 HA SER B 46 -9.333 7.563 9.813 1.00 0.00 H new ATOM 0 HB2 SER B 46 -6.563 7.128 11.030 1.00 0.00 H new ATOM 0 HB3 SER B 46 -8.067 7.026 11.923 1.00 0.00 H new ATOM 0 HG SER B 46 -7.345 4.938 11.178 1.00 0.00 H new ATOM 908 N PRO B 47 -9.050 9.801 11.473 1.00 0.00 N ATOM 909 CA PRO B 47 -9.072 11.243 11.876 1.00 0.00 C ATOM 910 C PRO B 47 -7.718 11.852 12.390 1.00 0.00 C ATOM 911 O PRO B 47 -7.458 11.894 13.595 1.00 0.00 O ATOM 912 CB PRO B 47 -10.226 11.272 12.904 1.00 0.00 C ATOM 913 CG PRO B 47 -11.085 10.045 12.594 1.00 0.00 C ATOM 914 CD PRO B 47 -10.068 8.988 12.171 1.00 0.00 C ATOM 0 HA PRO B 47 -9.226 11.901 11.021 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -9.843 11.235 13.924 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -10.807 12.190 12.815 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -11.656 9.725 13.466 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -11.804 10.250 11.800 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -9.650 8.459 13.027 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -10.509 8.237 11.516 1.00 0.00 H new ATOM 915 N VAL B 48 -6.863 12.334 11.464 1.00 0.00 N ATOM 916 CA VAL B 48 -5.527 12.927 11.832 1.00 0.00 C ATOM 917 C VAL B 48 -5.547 14.492 11.681 1.00 0.00 C ATOM 918 O VAL B 48 -5.868 15.167 12.656 1.00 0.00 O ATOM 919 CB VAL B 48 -4.334 12.100 11.239 1.00 0.00 C ATOM 920 CG1 VAL B 48 -2.941 12.637 11.647 1.00 0.00 C ATOM 921 CG2 VAL B 48 -4.330 10.612 11.665 1.00 0.00 C ATOM 0 H VAL B 48 -7.056 12.332 10.462 1.00 0.00 H new ATOM 0 HA VAL B 48 -5.322 12.817 12.897 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.500 12.202 10.167 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -2.166 12.015 11.200 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -2.830 13.663 11.297 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -2.845 12.612 12.732 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -3.475 10.107 11.215 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -4.261 10.545 12.751 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.251 10.135 11.330 1.00 0.00 H new ATOM 922 N THR B 49 -5.286 15.270 10.625 1.00 0.00 N ATOM 923 CA THR B 49 -4.653 14.884 9.326 1.00 0.00 C ATOM 924 C THR B 49 -3.851 16.099 8.725 1.00 0.00 C ATOM 925 O THR B 49 -4.317 17.243 8.748 1.00 0.00 O ATOM 926 CB THR B 49 -5.682 14.369 8.270 1.00 0.00 C ATOM 927 OG1 THR B 49 -6.703 13.563 8.838 1.00 0.00 O ATOM 928 CG2 THR B 49 -5.034 13.481 7.203 1.00 0.00 C ATOM 0 H THR B 49 -5.523 16.262 10.641 1.00 0.00 H new ATOM 0 HA THR B 49 -3.977 14.058 9.549 1.00 0.00 H new ATOM 0 HB THR B 49 -6.089 15.286 7.844 1.00 0.00 H new ATOM 0 HG1 THR B 49 -7.319 13.270 8.134 1.00 0.00 H new ATOM 0 HG21 THR B 49 -5.793 13.150 6.494 1.00 0.00 H new ATOM 0 HG22 THR B 49 -4.267 14.048 6.675 1.00 0.00 H new ATOM 0 HG23 THR B 49 -4.580 12.612 7.679 1.00 0.00 H new ATOM 929 N GLY B 50 -2.667 15.844 8.142 1.00 0.00 N ATOM 930 CA GLY B 50 -1.880 16.877 7.406 1.00 0.00 C ATOM 931 C GLY B 50 -0.358 16.723 7.609 1.00 0.00 C ATOM 932 O GLY B 50 0.158 17.262 8.582 1.00 0.00 O ATOM 0 H GLY B 50 -2.222 14.926 8.161 1.00 0.00 H new ATOM 0 HA2 GLY B 50 -2.109 16.812 6.342 1.00 0.00 H new ATOM 0 HA3 GLY B 50 -2.188 17.868 7.739 1.00 0.00 H new ATOM 933 N TYR B 51 0.516 16.054 6.848 1.00 0.00 N ATOM 934 CA TYR B 51 0.299 15.345 5.543 1.00 0.00 C ATOM 935 C TYR B 51 -1.059 14.670 5.106 1.00 0.00 C ATOM 936 O TYR B 51 -1.817 14.140 5.913 1.00 0.00 O ATOM 937 CB TYR B 51 1.492 14.329 5.371 1.00 0.00 C ATOM 938 CG TYR B 51 1.898 13.329 6.492 1.00 0.00 C ATOM 939 CD1 TYR B 51 1.010 12.933 7.502 1.00 0.00 C ATOM 940 CD2 TYR B 51 3.223 12.868 6.557 1.00 0.00 C ATOM 941 CE1 TYR B 51 1.472 12.280 8.632 1.00 0.00 C ATOM 942 CE2 TYR B 51 3.678 12.200 7.685 1.00 0.00 C ATOM 943 CZ TYR B 51 2.824 11.967 8.749 1.00 0.00 C ATOM 944 OH TYR B 51 3.351 11.404 9.878 1.00 0.00 O ATOM 0 H TYR B 51 1.490 15.977 7.141 1.00 0.00 H new ATOM 0 HA TYR B 51 0.241 16.192 4.860 1.00 0.00 H new ATOM 0 HB2 TYR B 51 1.271 13.734 4.485 1.00 0.00 H new ATOM 0 HB3 TYR B 51 2.378 14.922 5.144 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -0.045 13.139 7.398 1.00 0.00 H new ATOM 0 HD2 TYR B 51 3.891 13.034 5.725 1.00 0.00 H new ATOM 0 HE1 TYR B 51 0.785 12.014 9.422 1.00 0.00 H new ATOM 0 HE2 TYR B 51 4.702 11.861 7.733 1.00 0.00 H new ATOM 0 HH TYR B 51 2.726 11.521 10.624 1.00 0.00 H new ATOM 945 N ARG B 52 -1.301 14.652 3.782 1.00 0.00 N ATOM 946 CA ARG B 52 -2.210 13.677 3.089 1.00 0.00 C ATOM 947 C ARG B 52 -1.408 12.437 2.511 1.00 0.00 C ATOM 948 O ARG B 52 -0.169 12.478 2.451 1.00 0.00 O ATOM 949 CB ARG B 52 -2.943 14.558 2.027 1.00 0.00 C ATOM 950 CG ARG B 52 -3.845 13.848 0.991 1.00 0.00 C ATOM 951 CD ARG B 52 -5.048 13.075 1.572 1.00 0.00 C ATOM 952 NE ARG B 52 -5.181 11.763 0.887 1.00 0.00 N ATOM 953 CZ ARG B 52 -5.977 11.479 -0.132 1.00 0.00 C ATOM 954 NH1 ARG B 52 -6.795 12.320 -0.685 1.00 0.00 N ATOM 955 NH2 ARG B 52 -5.920 10.286 -0.604 1.00 0.00 N ATOM 0 H ARG B 52 -0.871 15.318 3.140 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.932 13.192 3.745 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -3.556 15.284 2.561 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -2.186 15.121 1.480 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -4.220 14.594 0.290 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -3.232 13.153 0.418 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -4.912 12.924 2.643 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -5.961 13.656 1.445 1.00 0.00 H new ATOM 0 HE ARG B 52 -4.599 11.003 1.238 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -6.856 13.277 -0.336 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -7.377 12.025 -1.469 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -5.281 9.605 -0.194 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -6.514 10.019 -1.389 1.00 0.00 H new ATOM 956 N ASN B 53 -2.051 11.315 2.072 1.00 0.00 N ATOM 957 CA ASN B 53 -1.333 10.237 1.313 1.00 0.00 C ATOM 958 C ASN B 53 -0.980 10.696 -0.117 1.00 0.00 C ATOM 959 O ASN B 53 -1.613 10.304 -1.093 1.00 0.00 O ATOM 960 CB ASN B 53 -1.536 8.712 1.582 1.00 0.00 C ATOM 961 CG ASN B 53 -2.903 8.121 1.357 1.00 0.00 C ATOM 962 OD1 ASN B 53 -3.889 8.728 0.974 1.00 0.00 O ATOM 963 ND2 ASN B 53 -2.942 6.837 1.493 1.00 0.00 N ATOM 0 H ASN B 53 -3.043 11.132 2.224 1.00 0.00 H new ATOM 0 HA ASN B 53 -0.425 10.143 1.909 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -0.831 8.167 0.954 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -1.256 8.517 2.617 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -3.799 6.327 1.280 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.115 6.333 1.814 1.00 0.00 H new ATOM 964 N ASP B 54 0.183 11.391 -0.230 1.00 0.00 N ATOM 965 CA ASP B 54 1.061 11.283 -1.408 1.00 0.00 C ATOM 966 C ASP B 54 1.963 10.034 -1.568 1.00 0.00 C ATOM 967 O ASP B 54 2.943 10.005 -2.309 1.00 0.00 O ATOM 968 CB ASP B 54 1.669 12.607 -1.894 1.00 0.00 C ATOM 969 CG ASP B 54 2.576 13.298 -0.882 1.00 0.00 C ATOM 970 OD1 ASP B 54 3.775 13.066 -0.770 1.00 0.00 O ATOM 971 OD2 ASP B 54 1.888 14.143 -0.071 1.00 0.00 O ATOM 0 H ASP B 54 0.527 12.031 0.486 1.00 0.00 H new ATOM 0 HA ASP B 54 0.309 11.029 -2.155 1.00 0.00 H new ATOM 0 HB2 ASP B 54 2.239 12.418 -2.803 1.00 0.00 H new ATOM 0 HB3 ASP B 54 0.860 13.287 -2.161 1.00 0.00 H new ATOM 972 N ALA B 55 1.455 8.925 -1.051 1.00 0.00 N ATOM 973 CA ALA B 55 1.610 7.618 -1.706 1.00 0.00 C ATOM 974 C ALA B 55 0.365 6.911 -2.295 1.00 0.00 C ATOM 975 O ALA B 55 0.527 6.052 -3.151 1.00 0.00 O ATOM 976 CB ALA B 55 2.163 6.723 -0.619 1.00 0.00 C ATOM 0 H ALA B 55 0.929 8.896 -0.178 1.00 0.00 H new ATOM 0 HA ALA B 55 2.223 7.798 -2.589 1.00 0.00 H new ATOM 0 HB1 ALA B 55 2.313 5.719 -1.016 1.00 0.00 H new ATOM 0 HB2 ALA B 55 3.116 7.121 -0.269 1.00 0.00 H new ATOM 0 HB3 ALA B 55 1.459 6.683 0.213 1.00 0.00 H new ATOM 977 N GLU B 56 -0.853 7.312 -1.940 1.00 0.00 N ATOM 978 CA GLU B 56 -1.947 7.454 -2.954 1.00 0.00 C ATOM 979 C GLU B 56 -1.806 8.580 -4.047 1.00 0.00 C ATOM 980 O GLU B 56 -2.476 8.593 -5.088 1.00 0.00 O ATOM 981 CB GLU B 56 -3.215 7.605 -2.092 1.00 0.00 C ATOM 982 CG GLU B 56 -3.742 6.240 -1.580 1.00 0.00 C ATOM 983 CD GLU B 56 -4.290 5.245 -2.612 1.00 0.00 C ATOM 984 OE1 GLU B 56 -4.576 5.541 -3.766 1.00 0.00 O ATOM 985 OE2 GLU B 56 -4.400 3.986 -2.100 1.00 0.00 O ATOM 0 H GLU B 56 -1.125 7.545 -0.985 1.00 0.00 H new ATOM 0 HA GLU B 56 -1.943 6.584 -3.611 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -2.999 8.251 -1.241 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -3.993 8.097 -2.676 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -2.931 5.750 -1.042 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -4.532 6.438 -0.855 1.00 0.00 H new ATOM 986 N ARG B 57 -0.714 9.341 -3.948 1.00 0.00 N ATOM 987 CA ARG B 57 -0.177 10.141 -5.064 1.00 0.00 C ATOM 988 C ARG B 57 1.138 9.557 -5.755 1.00 0.00 C ATOM 989 O ARG B 57 1.287 9.746 -6.961 1.00 0.00 O ATOM 990 CB ARG B 57 -0.264 11.604 -4.545 1.00 0.00 C ATOM 991 CG ARG B 57 -1.033 12.609 -5.425 1.00 0.00 C ATOM 992 CD ARG B 57 -0.197 12.967 -6.634 1.00 0.00 C ATOM 993 NE ARG B 57 -1.006 13.700 -7.641 1.00 0.00 N ATOM 994 CZ ARG B 57 -0.676 13.897 -8.915 1.00 0.00 C ATOM 995 NH1 ARG B 57 0.394 13.432 -9.487 1.00 0.00 N ATOM 996 NH2 ARG B 57 -1.487 14.586 -9.636 1.00 0.00 N ATOM 0 H ARG B 57 -0.170 9.424 -3.089 1.00 0.00 H new ATOM 0 HA ARG B 57 -0.747 10.095 -5.992 1.00 0.00 H new ATOM 0 HB2 ARG B 57 -0.731 11.588 -3.560 1.00 0.00 H new ATOM 0 HB3 ARG B 57 0.751 11.978 -4.410 1.00 0.00 H new ATOM 0 HG2 ARG B 57 -1.983 12.178 -5.742 1.00 0.00 H new ATOM 0 HG3 ARG B 57 -1.265 13.507 -4.852 1.00 0.00 H new ATOM 0 HD2 ARG B 57 0.650 13.580 -6.326 1.00 0.00 H new ATOM 0 HD3 ARG B 57 0.211 12.060 -7.080 1.00 0.00 H new ATOM 0 HE ARG B 57 -1.896 14.088 -7.327 1.00 0.00 H new ATOM 0 HH11 ARG B 57 1.055 12.869 -8.952 1.00 0.00 H new ATOM 0 HH12 ARG B 57 0.573 13.630 -10.471 1.00 0.00 H new ATOM 0 HH21 ARG B 57 -2.344 14.957 -9.226 1.00 0.00 H new ATOM 0 HH22 ARG B 57 -1.273 14.761 -10.618 1.00 0.00 H new ATOM 997 N LEU B 58 2.012 8.724 -5.131 1.00 0.00 N ATOM 998 CA LEU B 58 3.010 7.859 -5.884 1.00 0.00 C ATOM 999 C LEU B 58 2.469 6.712 -6.812 1.00 0.00 C ATOM 1000 O LEU B 58 2.804 6.562 -7.999 1.00 0.00 O ATOM 1001 CB LEU B 58 4.270 7.593 -4.996 1.00 0.00 C ATOM 1002 CG LEU B 58 4.644 6.255 -4.283 1.00 0.00 C ATOM 1003 CD1 LEU B 58 5.381 6.574 -2.980 1.00 0.00 C ATOM 1004 CD2 LEU B 58 3.544 5.261 -3.904 1.00 0.00 C ATOM 0 H LEU B 58 2.060 8.621 -4.117 1.00 0.00 H new ATOM 0 HA LEU B 58 3.359 8.451 -6.730 1.00 0.00 H new ATOM 0 HB2 LEU B 58 5.126 7.836 -5.626 1.00 0.00 H new ATOM 0 HB3 LEU B 58 4.232 8.343 -4.206 1.00 0.00 H new ATOM 0 HG LEU B 58 5.220 5.752 -5.060 1.00 0.00 H new ATOM 0 HD11 LEU B 58 5.646 5.645 -2.475 1.00 0.00 H new ATOM 0 HD12 LEU B 58 6.287 7.137 -3.203 1.00 0.00 H new ATOM 0 HD13 LEU B 58 4.735 7.167 -2.333 1.00 0.00 H new ATOM 0 HD21 LEU B 58 3.990 4.393 -3.419 1.00 0.00 H new ATOM 0 HD22 LEU B 58 2.842 5.738 -3.220 1.00 0.00 H new ATOM 0 HD23 LEU B 58 3.015 4.943 -4.803 1.00 0.00 H new ATOM 1005 N ALA B 59 1.483 5.973 -6.319 1.00 0.00 N ATOM 1006 CA ALA B 59 0.168 5.872 -6.984 1.00 0.00 C ATOM 1007 C ALA B 59 -0.244 6.752 -8.186 1.00 0.00 C ATOM 1008 O ALA B 59 -0.023 6.258 -9.275 1.00 0.00 O ATOM 1009 CB ALA B 59 -0.628 6.293 -5.780 1.00 0.00 C ATOM 0 H ALA B 59 1.559 5.429 -5.459 1.00 0.00 H new ATOM 0 HA ALA B 59 0.069 4.907 -7.482 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -1.689 6.298 -6.029 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -0.450 5.593 -4.963 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -0.323 7.293 -5.474 1.00 0.00 H new ATOM 1010 N ASP B 60 -0.751 8.003 -8.070 1.00 0.00 N ATOM 1011 CA ASP B 60 -0.921 8.868 -9.276 1.00 0.00 C ATOM 1012 C ASP B 60 0.296 9.070 -10.251 1.00 0.00 C ATOM 1013 O ASP B 60 0.055 9.489 -11.380 1.00 0.00 O ATOM 1014 CB ASP B 60 -1.371 10.262 -8.772 1.00 0.00 C ATOM 1015 CG ASP B 60 -2.837 10.431 -8.397 1.00 0.00 C ATOM 1016 OD1 ASP B 60 -3.675 9.536 -8.449 1.00 0.00 O ATOM 1017 OD2 ASP B 60 -3.102 11.702 -7.976 1.00 0.00 O ATOM 0 H ASP B 60 -1.042 8.430 -7.190 1.00 0.00 H new ATOM 0 HA ASP B 60 -1.639 8.328 -9.893 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -0.769 10.515 -7.900 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -1.135 10.992 -9.546 1.00 0.00 H new ATOM 1018 N GLU B 61 1.553 8.709 -9.926 1.00 0.00 N ATOM 1019 CA GLU B 61 2.525 8.336 -11.000 1.00 0.00 C ATOM 1020 C GLU B 61 2.144 7.058 -11.801 1.00 0.00 C ATOM 1021 O GLU B 61 1.969 7.162 -13.018 1.00 0.00 O ATOM 1022 CB GLU B 61 4.002 8.274 -10.520 1.00 0.00 C ATOM 1023 CG GLU B 61 5.041 8.533 -11.646 1.00 0.00 C ATOM 1024 CD GLU B 61 5.345 7.348 -12.565 1.00 0.00 C ATOM 1025 OE1 GLU B 61 5.641 6.227 -12.163 1.00 0.00 O ATOM 1026 OE2 GLU B 61 5.239 7.673 -13.881 1.00 0.00 O ATOM 0 H GLU B 61 1.919 8.665 -8.975 1.00 0.00 H new ATOM 0 HA GLU B 61 2.449 9.170 -11.698 1.00 0.00 H new ATOM 0 HB2 GLU B 61 4.148 9.009 -9.728 1.00 0.00 H new ATOM 0 HB3 GLU B 61 4.191 7.293 -10.083 1.00 0.00 H new ATOM 0 HG2 GLU B 61 4.684 9.360 -12.259 1.00 0.00 H new ATOM 0 HG3 GLU B 61 5.974 8.858 -11.185 1.00 0.00 H new ATOM 1027 N GLN B 62 2.008 5.867 -11.186 1.00 0.00 N ATOM 1028 CA GLN B 62 1.508 4.698 -11.937 1.00 0.00 C ATOM 1029 C GLN B 62 -0.004 4.775 -12.305 1.00 0.00 C ATOM 1030 O GLN B 62 -0.349 4.892 -13.472 1.00 0.00 O ATOM 1031 CB GLN B 62 1.963 3.397 -11.222 1.00 0.00 C ATOM 1032 CG GLN B 62 3.049 2.625 -12.009 1.00 0.00 C ATOM 1033 CD GLN B 62 2.549 1.933 -13.283 1.00 0.00 C ATOM 1034 OE1 GLN B 62 2.416 0.716 -13.339 1.00 0.00 O ATOM 1035 NE2 GLN B 62 2.231 2.675 -14.321 1.00 0.00 N ATOM 0 H GLN B 62 2.228 5.690 -10.206 1.00 0.00 H new ATOM 0 HA GLN B 62 1.965 4.694 -12.926 1.00 0.00 H new ATOM 0 HB2 GLN B 62 2.347 3.647 -10.233 1.00 0.00 H new ATOM 0 HB3 GLN B 62 1.099 2.749 -11.074 1.00 0.00 H new ATOM 0 HG2 GLN B 62 3.845 3.319 -12.278 1.00 0.00 H new ATOM 0 HG3 GLN B 62 3.489 1.874 -11.353 1.00 0.00 H new ATOM 0 HE21 GLN B 62 2.341 3.688 -14.277 1.00 0.00 H new ATOM 0 HE22 GLN B 62 1.874 2.237 -15.171 1.00 0.00 H new ATOM 1036 N SER B 63 -0.893 4.796 -11.324 1.00 0.00 N ATOM 1037 CA SER B 63 -2.314 5.173 -11.502 1.00 0.00 C ATOM 1038 C SER B 63 -2.705 6.665 -11.798 1.00 0.00 C ATOM 1039 O SER B 63 -3.837 7.063 -11.521 1.00 0.00 O ATOM 1040 CB SER B 63 -3.082 4.467 -10.357 1.00 0.00 C ATOM 1041 OG SER B 63 -3.118 5.250 -9.158 1.00 0.00 O ATOM 0 H SER B 63 -0.659 4.550 -10.362 1.00 0.00 H new ATOM 0 HA SER B 63 -2.629 4.822 -12.485 1.00 0.00 H new ATOM 0 HB2 SER B 63 -4.101 4.258 -10.682 1.00 0.00 H new ATOM 0 HB3 SER B 63 -2.612 3.507 -10.146 1.00 0.00 H new ATOM 0 HG SER B 63 -4.040 5.307 -8.832 1.00 0.00 H new ATOM 1042 N GLU B 64 -1.870 7.464 -12.487 1.00 0.00 N ATOM 1043 CA GLU B 64 -2.302 8.152 -13.743 1.00 0.00 C ATOM 1044 C GLU B 64 -1.705 7.459 -15.016 1.00 0.00 C ATOM 1045 O GLU B 64 -2.472 7.166 -15.934 1.00 0.00 O ATOM 1046 CB GLU B 64 -2.034 9.681 -13.662 1.00 0.00 C ATOM 1047 CG GLU B 64 -2.906 10.422 -12.607 1.00 0.00 C ATOM 1048 CD GLU B 64 -2.499 11.849 -12.246 1.00 0.00 C ATOM 1049 OE1 GLU B 64 -1.713 12.549 -12.878 1.00 0.00 O ATOM 1050 OE2 GLU B 64 -3.117 12.270 -11.110 1.00 0.00 O ATOM 0 H GLU B 64 -0.907 7.655 -12.211 1.00 0.00 H new ATOM 0 HA GLU B 64 -3.382 8.047 -13.845 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.982 9.843 -13.427 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -2.214 10.123 -14.642 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -3.932 10.445 -12.973 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -2.907 9.829 -11.692 1.00 0.00 H new ATOM 1051 N LEU B 65 -0.393 7.138 -15.101 1.00 0.00 N ATOM 1052 CA LEU B 65 0.244 6.576 -16.340 1.00 0.00 C ATOM 1053 C LEU B 65 0.155 5.016 -16.535 1.00 0.00 C ATOM 1054 O LEU B 65 1.068 4.329 -16.999 1.00 0.00 O ATOM 1055 CB LEU B 65 1.664 7.208 -16.426 1.00 0.00 C ATOM 1056 CG LEU B 65 1.641 8.765 -16.518 1.00 0.00 C ATOM 1057 CD1 LEU B 65 1.954 9.465 -15.179 1.00 0.00 C ATOM 1058 CD2 LEU B 65 2.598 9.306 -17.585 1.00 0.00 C ATOM 0 H LEU B 65 0.259 7.256 -14.325 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.341 6.861 -17.215 1.00 0.00 H new ATOM 0 HB2 LEU B 65 2.240 6.911 -15.550 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.181 6.807 -17.298 1.00 0.00 H new ATOM 0 HG LEU B 65 0.614 8.998 -16.799 1.00 0.00 H new ATOM 0 HD11 LEU B 65 1.921 10.546 -15.317 1.00 0.00 H new ATOM 0 HD12 LEU B 65 1.215 9.171 -14.433 1.00 0.00 H new ATOM 0 HD13 LEU B 65 2.948 9.173 -14.839 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.542 10.394 -17.606 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.617 9.000 -17.349 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.317 8.909 -18.561 1.00 0.00 H new ATOM 1059 N VAL B 66 -1.043 4.520 -16.231 1.00 0.00 N ATOM 1060 CA VAL B 66 -1.510 3.116 -16.450 1.00 0.00 C ATOM 1061 C VAL B 66 -2.294 3.034 -17.808 1.00 0.00 C ATOM 1062 O VAL B 66 -1.764 2.472 -18.770 1.00 0.00 O ATOM 1063 CB VAL B 66 -2.265 2.514 -15.195 1.00 0.00 C ATOM 1064 CG1 VAL B 66 -1.334 2.158 -14.001 1.00 0.00 C ATOM 1065 CG2 VAL B 66 -3.452 3.352 -14.659 1.00 0.00 C ATOM 0 H VAL B 66 -1.764 5.100 -15.803 1.00 0.00 H new ATOM 0 HA VAL B 66 -0.647 2.458 -16.546 1.00 0.00 H new ATOM 0 HB VAL B 66 -2.674 1.597 -15.620 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -1.930 1.752 -13.183 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -0.602 1.416 -14.319 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.817 3.056 -13.662 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -3.895 2.847 -13.801 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -3.095 4.337 -14.357 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -4.202 3.463 -15.442 1.00 0.00 H new TER 1066 VAL B 66