USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1071 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 NoAdj-H: A 19 HIS HE2 : A 19 HIS NE2 : A 93 ZNZN :(H bumps) USER MOD NoAdj-H: A 42 HIS HE2 : A 42 HIS NE2 : A 94 ZNZN :(H bumps) USER MOD NoAdj-H: A 67 HIS HE2 : A 67 HIS NE2 : A 95 ZNZN :(H bumps) USER MOD Set 1.1: A 50 THR OG1 : rot 154:sc= 0.131 USER MOD Set 1.2: B 747 MET CE :methyl 137:sc= -1.35 (180deg=-6.1!) USER MOD Set 2.1: A 83 ASN : amide:sc= 1.09 K(o=3.3,f=-0.51!) USER MOD Set 2.2: A 87 LYS NZ :NH3+ 170:sc= 0.956 (180deg=-0.0039) USER MOD Set 2.3: B 749 THR OG1 : rot 164:sc= 1.29 USER MOD Set 3.1: A 41 GLN : amide:sc= 0.512 K(o=1.3,f=-1.7) USER MOD Set 3.2: A 44 LYS NZ :NH3+ -144:sc= 0.811 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -121:sc= -0.153 (180deg=-1.61!) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 5 SER OG : rot -76:sc= 0.816 USER MOD Single : A 9 SER OG : rot 83:sc= 1.07 USER MOD Single : A 11 GLN : amide:sc= -0.0372 X(o=-0.037,f=-0.52) USER MOD Single : A 13 CYS SG : rot 75:sc= 0.00631 USER MOD Single : A 15 GLN : amide:sc= -0.0604 X(o=-0.06,f=-0.06) USER MOD Single : A 16 SER OG : rot 74:sc= 0.465 USER MOD Single : A 21 CYS SG : rot 77:sc= 0.234 USER MOD Single : A 22 GLN : amide:sc= 0.89 K(o=0.89,f=0) USER MOD Single : A 25 ASN : amide:sc= 1.33 K(o=1.3,f=0) USER MOD Single : A 27 ASN : amide:sc= 0.361 K(o=0.36,f=-3.5!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.21 K(o=1.2,f=-0.4) USER MOD Single : A 35 LYS NZ :NH3+ 152:sc= 0.682 (180deg=0.276) USER MOD Single : A 36 MET CE :methyl 168:sc= -0.308 (180deg=-0.416) USER MOD Single : A 37 LYS NZ :NH3+ 154:sc= 2.79 (180deg=1.96) USER MOD Single : A 43 THR OG1 : rot -76:sc= 1.47 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 151:sc= 0.12 (180deg=-2.5!) USER MOD Single : A 51 ASN : amide:sc= 0.879 K(o=0.88,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 1.07 K(o=1.1,f=-1.6) USER MOD Single : A 64 CYS SG : rot 77:sc= 0.384 USER MOD Single : A 65 CYS SG : rot 150:sc= 0.23 USER MOD Single : A 66 TYR OH : rot 180:sc=-0.00981 USER MOD Single : A 69 LYS NZ :NH3+ -163:sc= -0.013 (180deg=-0.17) USER MOD Single : A 70 HIS : no HE2:sc= 0.582 K(o=0.58,f=-2.4!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 ASN : amide:sc= -0.0421 X(o=-0.042,f=-0.042) USER MOD Single : A 75 LYS NZ :NH3+ 176:sc= 1.17 (180deg=1.08) USER MOD Single : A 85 LYS NZ :NH3+ -170:sc= 2.24 (180deg=1.12!) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= 0.768 K(o=0.77,f=-0.043) USER MOD Single : A 91 GLN : amide:sc= 0.714 K(o=0.71,f=0) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 707 SER OG : rot 180:sc= 0 USER MOD Single : B 708 HIS : no HD1:sc=-0.00874 X(o=-0.0087,f=-0.0087) USER MOD Single : B 709 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 710 SER OG : rot 180:sc= 0 USER MOD Single : B 713 HIS : no HE2:sc= 0.59 K(o=0.59,f=-2.1!) USER MOD Single : B 715 SER OG : rot 180:sc= 0 USER MOD Single : B 718 GLN : amide:sc= 0.586 K(o=0.59,f=0) USER MOD Single : B 719 THR OG1 : rot 180:sc= 0 USER MOD Single : B 720 THR OG1 : rot 180:sc= 0 USER MOD Single : B 722 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.05) USER MOD Single : B 726 MET CE :methyl 172:sc= -0.0347 (180deg=-0.135) USER MOD Single : B 727 SER OG : rot 180:sc= 0 USER MOD Single : B 735 SER OG : rot 180:sc= 0 USER MOD Single : B 740 SER OG : rot 180:sc= 0 USER MOD Single : B 745 SER OG : rot 180:sc= 0 USER MOD Single : B 746 MET CE :methyl 156:sc= -5! (180deg=-5.16!) USER MOD Single : B 748 ASN : amide:sc=-0.00823 X(o=-0.0082,f=-0.0082) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 51.785 -13.696 33.584 1.00 0.00 N ATOM 2 CA SER A 1 51.152 -13.932 32.282 1.00 0.00 C ATOM 3 C SER A 1 50.738 -12.622 31.568 1.00 0.00 C ATOM 4 O SER A 1 49.540 -12.385 31.379 1.00 0.00 O ATOM 5 CB SER A 1 49.965 -14.898 32.447 1.00 0.00 C ATOM 6 OG SER A 1 50.405 -16.137 32.989 1.00 0.00 O ATOM 0 H1 SER A 1 52.742 -14.103 33.584 1.00 0.00 H new ATOM 0 H2 SER A 1 51.844 -12.673 33.761 1.00 0.00 H new ATOM 0 H3 SER A 1 51.218 -14.145 34.332 1.00 0.00 H new ATOM 0 HA SER A 1 51.893 -14.395 31.630 1.00 0.00 H new ATOM 0 HB2 SER A 1 49.215 -14.454 33.101 1.00 0.00 H new ATOM 0 HB3 SER A 1 49.487 -15.065 31.482 1.00 0.00 H new ATOM 0 HG SER A 1 49.639 -16.740 33.090 1.00 0.00 H new ATOM 12 N PRO A 2 51.695 -11.744 31.186 1.00 0.00 N ATOM 13 CA PRO A 2 51.422 -10.450 30.549 1.00 0.00 C ATOM 14 C PRO A 2 50.903 -10.603 29.106 1.00 0.00 C ATOM 15 O PRO A 2 49.692 -10.622 28.881 1.00 0.00 O ATOM 16 CB PRO A 2 52.739 -9.667 30.670 1.00 0.00 C ATOM 17 CG PRO A 2 53.817 -10.753 30.678 1.00 0.00 C ATOM 18 CD PRO A 2 53.130 -11.934 31.364 1.00 0.00 C ATOM 0 HA PRO A 2 50.611 -9.908 31.036 1.00 0.00 H new ATOM 0 HB2 PRO A 2 52.872 -8.979 29.835 1.00 0.00 H new ATOM 0 HB3 PRO A 2 52.766 -9.071 31.582 1.00 0.00 H new ATOM 0 HG2 PRO A 2 54.138 -11.007 29.668 1.00 0.00 H new ATOM 0 HG3 PRO A 2 54.705 -10.433 31.224 1.00 0.00 H new ATOM 0 HD2 PRO A 2 53.453 -12.878 30.925 1.00 0.00 H new ATOM 0 HD3 PRO A 2 53.387 -11.970 32.423 1.00 0.00 H new ATOM 26 N GLN A 3 51.798 -10.758 28.122 1.00 0.00 N ATOM 27 CA GLN A 3 51.435 -10.985 26.713 1.00 0.00 C ATOM 28 C GLN A 3 50.737 -12.343 26.530 1.00 0.00 C ATOM 29 O GLN A 3 49.929 -12.510 25.615 1.00 0.00 O ATOM 30 CB GLN A 3 52.680 -10.876 25.816 1.00 0.00 C ATOM 31 CG GLN A 3 53.136 -9.415 25.676 1.00 0.00 C ATOM 32 CD GLN A 3 54.409 -9.274 24.844 1.00 0.00 C ATOM 33 OE1 GLN A 3 55.496 -9.035 25.356 1.00 0.00 O ATOM 34 NE2 GLN A 3 54.340 -9.424 23.540 1.00 0.00 N ATOM 0 H GLN A 3 52.805 -10.729 28.281 1.00 0.00 H new ATOM 0 HA GLN A 3 50.728 -10.212 26.414 1.00 0.00 H new ATOM 0 HB2 GLN A 3 53.489 -11.474 26.237 1.00 0.00 H new ATOM 0 HB3 GLN A 3 52.459 -11.287 24.831 1.00 0.00 H new ATOM 0 HG2 GLN A 3 52.339 -8.832 25.215 1.00 0.00 H new ATOM 0 HG3 GLN A 3 53.306 -8.995 26.667 1.00 0.00 H new ATOM 0 HE21 GLN A 3 53.443 -9.623 23.096 1.00 0.00 H new ATOM 0 HE22 GLN A 3 55.183 -9.341 22.972 1.00 0.00 H new ATOM 43 N GLU A 4 51.007 -13.297 27.427 1.00 0.00 N ATOM 44 CA GLU A 4 50.392 -14.626 27.479 1.00 0.00 C ATOM 45 C GLU A 4 48.864 -14.573 27.415 1.00 0.00 C ATOM 46 O GLU A 4 48.269 -15.415 26.749 1.00 0.00 O ATOM 47 CB GLU A 4 50.839 -15.349 28.758 1.00 0.00 C ATOM 48 CG GLU A 4 52.165 -16.101 28.606 1.00 0.00 C ATOM 49 CD GLU A 4 53.303 -15.232 28.038 1.00 0.00 C ATOM 50 OE1 GLU A 4 53.597 -14.159 28.615 1.00 0.00 O ATOM 51 OE2 GLU A 4 53.890 -15.612 26.996 1.00 0.00 O ATOM 0 H GLU A 4 51.691 -13.157 28.170 1.00 0.00 H new ATOM 0 HA GLU A 4 50.727 -15.175 26.599 1.00 0.00 H new ATOM 0 HB2 GLU A 4 50.934 -14.620 29.563 1.00 0.00 H new ATOM 0 HB3 GLU A 4 50.063 -16.054 29.057 1.00 0.00 H new ATOM 0 HG2 GLU A 4 52.466 -16.490 29.579 1.00 0.00 H new ATOM 0 HG3 GLU A 4 52.014 -16.960 27.952 1.00 0.00 H new ATOM 58 N SER A 5 48.219 -13.580 28.036 1.00 0.00 N ATOM 59 CA SER A 5 46.758 -13.416 27.971 1.00 0.00 C ATOM 60 C SER A 5 46.242 -13.396 26.523 1.00 0.00 C ATOM 61 O SER A 5 45.281 -14.095 26.186 1.00 0.00 O ATOM 62 CB SER A 5 46.330 -12.142 28.714 1.00 0.00 C ATOM 63 OG SER A 5 46.926 -10.975 28.163 1.00 0.00 O ATOM 0 H SER A 5 48.690 -12.869 28.596 1.00 0.00 H new ATOM 0 HA SER A 5 46.310 -14.281 28.461 1.00 0.00 H new ATOM 0 HB2 SER A 5 45.245 -12.047 28.675 1.00 0.00 H new ATOM 0 HB3 SER A 5 46.605 -12.227 29.765 1.00 0.00 H new ATOM 0 HG SER A 5 47.862 -10.919 28.449 1.00 0.00 H new ATOM 69 N ARG A 6 46.919 -12.642 25.646 1.00 0.00 N ATOM 70 CA ARG A 6 46.628 -12.553 24.208 1.00 0.00 C ATOM 71 C ARG A 6 47.025 -13.838 23.482 1.00 0.00 C ATOM 72 O ARG A 6 46.214 -14.390 22.744 1.00 0.00 O ATOM 73 CB ARG A 6 47.350 -11.338 23.593 1.00 0.00 C ATOM 74 CG ARG A 6 47.125 -10.053 24.408 1.00 0.00 C ATOM 75 CD ARG A 6 47.444 -8.787 23.613 1.00 0.00 C ATOM 76 NE ARG A 6 48.868 -8.660 23.242 1.00 0.00 N ATOM 77 CZ ARG A 6 49.378 -7.695 22.497 1.00 0.00 C ATOM 78 NH1 ARG A 6 48.666 -6.762 21.947 1.00 0.00 N ATOM 79 NH2 ARG A 6 50.641 -7.640 22.223 1.00 0.00 N ATOM 0 H ARG A 6 47.708 -12.060 25.926 1.00 0.00 H new ATOM 0 HA ARG A 6 45.553 -12.422 24.087 1.00 0.00 H new ATOM 0 HB2 ARG A 6 48.418 -11.545 23.532 1.00 0.00 H new ATOM 0 HB3 ARG A 6 46.997 -11.186 22.573 1.00 0.00 H new ATOM 0 HG2 ARG A 6 46.088 -10.016 24.741 1.00 0.00 H new ATOM 0 HG3 ARG A 6 47.747 -10.082 25.303 1.00 0.00 H new ATOM 0 HD2 ARG A 6 46.839 -8.777 22.706 1.00 0.00 H new ATOM 0 HD3 ARG A 6 47.152 -7.917 24.201 1.00 0.00 H new ATOM 0 HE ARG A 6 49.509 -9.374 23.588 1.00 0.00 H new ATOM 0 HH11 ARG A 6 47.655 -6.747 22.080 1.00 0.00 H new ATOM 0 HH12 ARG A 6 49.117 -6.043 21.382 1.00 0.00 H new ATOM 0 HH21 ARG A 6 51.273 -8.354 22.585 1.00 0.00 H new ATOM 0 HH22 ARG A 6 51.005 -6.882 21.645 1.00 0.00 H new ATOM 93 N ARG A 7 48.246 -14.337 23.717 1.00 0.00 N ATOM 94 CA ARG A 7 48.800 -15.566 23.101 1.00 0.00 C ATOM 95 C ARG A 7 47.884 -16.775 23.296 1.00 0.00 C ATOM 96 O ARG A 7 47.520 -17.451 22.336 1.00 0.00 O ATOM 97 CB ARG A 7 50.203 -15.848 23.656 1.00 0.00 C ATOM 98 CG ARG A 7 51.182 -14.715 23.319 1.00 0.00 C ATOM 99 CD ARG A 7 52.528 -14.896 24.007 1.00 0.00 C ATOM 100 NE ARG A 7 53.437 -13.826 23.578 1.00 0.00 N ATOM 101 CZ ARG A 7 54.608 -13.481 24.061 1.00 0.00 C ATOM 102 NH1 ARG A 7 55.159 -14.035 25.101 1.00 0.00 N ATOM 103 NH2 ARG A 7 55.232 -12.516 23.457 1.00 0.00 N ATOM 0 H ARG A 7 48.900 -13.889 24.359 1.00 0.00 H new ATOM 0 HA ARG A 7 48.870 -15.394 22.027 1.00 0.00 H new ATOM 0 HB2 ARG A 7 50.149 -15.973 24.737 1.00 0.00 H new ATOM 0 HB3 ARG A 7 50.576 -16.786 23.245 1.00 0.00 H new ATOM 0 HG2 ARG A 7 51.330 -14.674 22.240 1.00 0.00 H new ATOM 0 HG3 ARG A 7 50.748 -13.761 23.618 1.00 0.00 H new ATOM 0 HD2 ARG A 7 52.403 -14.871 25.090 1.00 0.00 H new ATOM 0 HD3 ARG A 7 52.950 -15.870 23.757 1.00 0.00 H new ATOM 0 HE ARG A 7 53.111 -13.269 22.789 1.00 0.00 H new ATOM 0 HH11 ARG A 7 54.677 -14.787 25.594 1.00 0.00 H new ATOM 0 HH12 ARG A 7 56.073 -13.718 25.424 1.00 0.00 H new ATOM 0 HH21 ARG A 7 54.809 -12.064 22.646 1.00 0.00 H new ATOM 0 HH22 ARG A 7 56.145 -12.210 23.793 1.00 0.00 H new ATOM 117 N LEU A 8 47.475 -17.021 24.539 1.00 0.00 N ATOM 118 CA LEU A 8 46.570 -18.105 24.930 1.00 0.00 C ATOM 119 C LEU A 8 45.180 -17.920 24.295 1.00 0.00 C ATOM 120 O LEU A 8 44.604 -18.890 23.804 1.00 0.00 O ATOM 121 CB LEU A 8 46.507 -18.157 26.469 1.00 0.00 C ATOM 122 CG LEU A 8 47.689 -18.862 27.181 1.00 0.00 C ATOM 123 CD1 LEU A 8 49.090 -18.671 26.585 1.00 0.00 C ATOM 124 CD2 LEU A 8 47.721 -18.424 28.646 1.00 0.00 C ATOM 0 H LEU A 8 47.774 -16.452 25.331 1.00 0.00 H new ATOM 0 HA LEU A 8 46.947 -19.059 24.561 1.00 0.00 H new ATOM 0 HB2 LEU A 8 46.442 -17.135 26.843 1.00 0.00 H new ATOM 0 HB3 LEU A 8 45.584 -18.661 26.757 1.00 0.00 H new ATOM 0 HG LEU A 8 47.479 -19.923 27.046 1.00 0.00 H new ATOM 0 HD11 LEU A 8 49.818 -19.219 27.183 1.00 0.00 H new ATOM 0 HD12 LEU A 8 49.105 -19.047 25.562 1.00 0.00 H new ATOM 0 HD13 LEU A 8 49.344 -17.611 26.586 1.00 0.00 H new ATOM 0 HD21 LEU A 8 48.550 -18.916 29.155 1.00 0.00 H new ATOM 0 HD22 LEU A 8 47.852 -17.343 28.700 1.00 0.00 H new ATOM 0 HD23 LEU A 8 46.784 -18.701 29.129 1.00 0.00 H new ATOM 136 N SER A 9 44.656 -16.689 24.235 1.00 0.00 N ATOM 137 CA SER A 9 43.370 -16.406 23.572 1.00 0.00 C ATOM 138 C SER A 9 43.436 -16.704 22.066 1.00 0.00 C ATOM 139 O SER A 9 42.520 -17.322 21.520 1.00 0.00 O ATOM 140 CB SER A 9 42.925 -14.958 23.797 1.00 0.00 C ATOM 141 OG SER A 9 42.733 -14.692 25.178 1.00 0.00 O ATOM 0 H SER A 9 45.104 -15.867 24.639 1.00 0.00 H new ATOM 0 HA SER A 9 42.632 -17.067 24.025 1.00 0.00 H new ATOM 0 HB2 SER A 9 43.674 -14.277 23.393 1.00 0.00 H new ATOM 0 HB3 SER A 9 41.998 -14.771 23.255 1.00 0.00 H new ATOM 0 HG SER A 9 43.594 -14.476 25.592 1.00 0.00 H new ATOM 147 N ILE A 10 44.538 -16.343 21.397 1.00 0.00 N ATOM 148 CA ILE A 10 44.777 -16.645 19.974 1.00 0.00 C ATOM 149 C ILE A 10 44.779 -18.169 19.751 1.00 0.00 C ATOM 150 O ILE A 10 44.162 -18.645 18.800 1.00 0.00 O ATOM 151 CB ILE A 10 46.075 -15.957 19.489 1.00 0.00 C ATOM 152 CG1 ILE A 10 45.926 -14.417 19.509 1.00 0.00 C ATOM 153 CG2 ILE A 10 46.459 -16.401 18.066 1.00 0.00 C ATOM 154 CD1 ILE A 10 47.268 -13.692 19.651 1.00 0.00 C ATOM 0 H ILE A 10 45.302 -15.825 21.832 1.00 0.00 H new ATOM 0 HA ILE A 10 43.967 -16.239 19.368 1.00 0.00 H new ATOM 0 HB ILE A 10 46.864 -16.259 20.177 1.00 0.00 H new ATOM 0 HG12 ILE A 10 45.438 -14.092 18.590 1.00 0.00 H new ATOM 0 HG13 ILE A 10 45.274 -14.130 20.334 1.00 0.00 H new ATOM 0 HG21 ILE A 10 47.376 -15.896 17.762 1.00 0.00 H new ATOM 0 HG22 ILE A 10 46.617 -17.479 18.052 1.00 0.00 H new ATOM 0 HG23 ILE A 10 45.656 -16.143 17.375 1.00 0.00 H new ATOM 0 HD11 ILE A 10 47.101 -12.615 19.659 1.00 0.00 H new ATOM 0 HD12 ILE A 10 47.747 -13.992 20.583 1.00 0.00 H new ATOM 0 HD13 ILE A 10 47.913 -13.953 18.812 1.00 0.00 H new ATOM 166 N GLN A 11 45.399 -18.955 20.645 1.00 0.00 N ATOM 167 CA GLN A 11 45.371 -20.426 20.576 1.00 0.00 C ATOM 168 C GLN A 11 43.936 -20.988 20.647 1.00 0.00 C ATOM 169 O GLN A 11 43.615 -21.921 19.907 1.00 0.00 O ATOM 170 CB GLN A 11 46.265 -21.054 21.662 1.00 0.00 C ATOM 171 CG GLN A 11 47.767 -20.801 21.463 1.00 0.00 C ATOM 172 CD GLN A 11 48.364 -21.501 20.241 1.00 0.00 C ATOM 173 OE1 GLN A 11 47.781 -22.368 19.604 1.00 0.00 O ATOM 174 NE2 GLN A 11 49.571 -21.145 19.866 1.00 0.00 N ATOM 0 H GLN A 11 45.933 -18.591 21.434 1.00 0.00 H new ATOM 0 HA GLN A 11 45.775 -20.703 19.602 1.00 0.00 H new ATOM 0 HB2 GLN A 11 45.967 -20.661 22.634 1.00 0.00 H new ATOM 0 HB3 GLN A 11 46.089 -22.129 21.685 1.00 0.00 H new ATOM 0 HG2 GLN A 11 47.934 -19.728 21.371 1.00 0.00 H new ATOM 0 HG3 GLN A 11 48.301 -21.131 22.354 1.00 0.00 H new ATOM 0 HE21 GLN A 11 50.074 -20.424 20.384 1.00 0.00 H new ATOM 0 HE22 GLN A 11 50.006 -21.589 19.057 1.00 0.00 H new ATOM 183 N ARG A 12 43.037 -20.407 21.463 1.00 0.00 N ATOM 184 CA ARG A 12 41.614 -20.819 21.506 1.00 0.00 C ATOM 185 C ARG A 12 40.927 -20.556 20.161 1.00 0.00 C ATOM 186 O ARG A 12 40.181 -21.409 19.676 1.00 0.00 O ATOM 187 CB ARG A 12 40.844 -20.119 22.644 1.00 0.00 C ATOM 188 CG ARG A 12 41.378 -20.380 24.064 1.00 0.00 C ATOM 189 CD ARG A 12 41.441 -21.863 24.467 1.00 0.00 C ATOM 190 NE ARG A 12 40.110 -22.505 24.470 1.00 0.00 N ATOM 191 CZ ARG A 12 39.219 -22.497 25.448 1.00 0.00 C ATOM 192 NH1 ARG A 12 39.425 -21.880 26.578 1.00 0.00 N ATOM 193 NH2 ARG A 12 38.084 -23.120 25.307 1.00 0.00 N ATOM 0 H ARG A 12 43.268 -19.648 22.105 1.00 0.00 H new ATOM 0 HA ARG A 12 41.599 -21.890 21.706 1.00 0.00 H new ATOM 0 HB2 ARG A 12 40.858 -19.045 22.461 1.00 0.00 H new ATOM 0 HB3 ARG A 12 39.802 -20.436 22.603 1.00 0.00 H new ATOM 0 HG2 ARG A 12 42.378 -19.953 24.145 1.00 0.00 H new ATOM 0 HG3 ARG A 12 40.746 -19.851 24.777 1.00 0.00 H new ATOM 0 HD2 ARG A 12 42.096 -22.396 23.778 1.00 0.00 H new ATOM 0 HD3 ARG A 12 41.884 -21.948 25.459 1.00 0.00 H new ATOM 0 HE ARG A 12 39.849 -23.011 23.624 1.00 0.00 H new ATOM 0 HH11 ARG A 12 40.300 -21.379 26.733 1.00 0.00 H new ATOM 0 HH12 ARG A 12 38.711 -21.898 27.307 1.00 0.00 H new ATOM 0 HH21 ARG A 12 37.879 -23.617 24.440 1.00 0.00 H new ATOM 0 HH22 ARG A 12 37.400 -23.111 26.064 1.00 0.00 H new ATOM 207 N CYS A 13 41.214 -19.418 19.523 1.00 0.00 N ATOM 208 CA CYS A 13 40.694 -19.098 18.190 1.00 0.00 C ATOM 209 C CYS A 13 41.251 -20.068 17.132 1.00 0.00 C ATOM 210 O CYS A 13 40.499 -20.533 16.279 1.00 0.00 O ATOM 211 CB CYS A 13 41.001 -17.636 17.839 1.00 0.00 C ATOM 212 SG CYS A 13 40.148 -16.533 19.002 1.00 0.00 S ATOM 0 H CYS A 13 41.813 -18.692 19.916 1.00 0.00 H new ATOM 0 HA CYS A 13 39.611 -19.221 18.198 1.00 0.00 H new ATOM 0 HB2 CYS A 13 42.076 -17.461 17.879 1.00 0.00 H new ATOM 0 HB3 CYS A 13 40.681 -17.422 16.819 1.00 0.00 H new ATOM 0 HG CYS A 13 40.765 -16.548 20.146 1.00 0.00 H new ATOM 218 N ILE A 14 42.538 -20.431 17.200 1.00 0.00 N ATOM 219 CA ILE A 14 43.155 -21.421 16.298 1.00 0.00 C ATOM 220 C ILE A 14 42.434 -22.768 16.426 1.00 0.00 C ATOM 221 O ILE A 14 42.026 -23.333 15.411 1.00 0.00 O ATOM 222 CB ILE A 14 44.675 -21.516 16.563 1.00 0.00 C ATOM 223 CG1 ILE A 14 45.358 -20.234 16.038 1.00 0.00 C ATOM 224 CG2 ILE A 14 45.311 -22.756 15.908 1.00 0.00 C ATOM 225 CD1 ILE A 14 46.743 -19.983 16.633 1.00 0.00 C ATOM 0 H ILE A 14 43.187 -20.046 17.886 1.00 0.00 H new ATOM 0 HA ILE A 14 43.042 -21.100 15.262 1.00 0.00 H new ATOM 0 HB ILE A 14 44.822 -21.615 17.638 1.00 0.00 H new ATOM 0 HG12 ILE A 14 45.445 -20.299 14.953 1.00 0.00 H new ATOM 0 HG13 ILE A 14 44.719 -19.378 16.256 1.00 0.00 H new ATOM 0 HG21 ILE A 14 46.379 -22.775 16.125 1.00 0.00 H new ATOM 0 HG22 ILE A 14 44.844 -23.657 16.306 1.00 0.00 H new ATOM 0 HG23 ILE A 14 45.161 -22.715 14.829 1.00 0.00 H new ATOM 0 HD11 ILE A 14 47.157 -19.065 16.216 1.00 0.00 H new ATOM 0 HD12 ILE A 14 46.662 -19.885 17.716 1.00 0.00 H new ATOM 0 HD13 ILE A 14 47.399 -20.820 16.393 1.00 0.00 H new ATOM 237 N GLN A 15 42.200 -23.261 17.648 1.00 0.00 N ATOM 238 CA GLN A 15 41.442 -24.502 17.869 1.00 0.00 C ATOM 239 C GLN A 15 40.011 -24.401 17.313 1.00 0.00 C ATOM 240 O GLN A 15 39.519 -25.354 16.709 1.00 0.00 O ATOM 241 CB GLN A 15 41.404 -24.859 19.364 1.00 0.00 C ATOM 242 CG GLN A 15 42.765 -25.309 19.919 1.00 0.00 C ATOM 243 CD GLN A 15 43.204 -26.656 19.352 1.00 0.00 C ATOM 244 OE1 GLN A 15 44.070 -26.756 18.493 1.00 0.00 O ATOM 245 NE2 GLN A 15 42.611 -27.743 19.800 1.00 0.00 N ATOM 0 H GLN A 15 42.527 -22.817 18.506 1.00 0.00 H new ATOM 0 HA GLN A 15 41.957 -25.296 17.329 1.00 0.00 H new ATOM 0 HB2 GLN A 15 41.058 -23.993 19.928 1.00 0.00 H new ATOM 0 HB3 GLN A 15 40.675 -25.654 19.522 1.00 0.00 H new ATOM 0 HG2 GLN A 15 43.517 -24.556 19.685 1.00 0.00 H new ATOM 0 HG3 GLN A 15 42.708 -25.376 21.005 1.00 0.00 H new ATOM 0 HE21 GLN A 15 41.888 -27.671 20.516 1.00 0.00 H new ATOM 0 HE22 GLN A 15 42.875 -28.657 19.431 1.00 0.00 H new ATOM 254 N SER A 16 39.356 -23.245 17.467 1.00 0.00 N ATOM 255 CA SER A 16 38.010 -22.999 16.929 1.00 0.00 C ATOM 256 C SER A 16 37.986 -23.042 15.394 1.00 0.00 C ATOM 257 O SER A 16 37.089 -23.654 14.813 1.00 0.00 O ATOM 258 CB SER A 16 37.464 -21.651 17.409 1.00 0.00 C ATOM 259 OG SER A 16 37.323 -21.629 18.819 1.00 0.00 O ATOM 0 H SER A 16 39.745 -22.448 17.971 1.00 0.00 H new ATOM 0 HA SER A 16 37.374 -23.801 17.304 1.00 0.00 H new ATOM 0 HB2 SER A 16 38.135 -20.851 17.095 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.498 -21.459 16.941 1.00 0.00 H new ATOM 0 HG SER A 16 38.208 -21.559 19.235 1.00 0.00 H new ATOM 265 N LEU A 17 38.977 -22.441 14.721 1.00 0.00 N ATOM 266 CA LEU A 17 39.088 -22.482 13.259 1.00 0.00 C ATOM 267 C LEU A 17 39.415 -23.908 12.782 1.00 0.00 C ATOM 268 O LEU A 17 38.805 -24.384 11.828 1.00 0.00 O ATOM 269 CB LEU A 17 40.119 -21.442 12.779 1.00 0.00 C ATOM 270 CG LEU A 17 40.258 -21.333 11.243 1.00 0.00 C ATOM 271 CD1 LEU A 17 38.942 -21.031 10.512 1.00 0.00 C ATOM 272 CD2 LEU A 17 41.243 -20.218 10.896 1.00 0.00 C ATOM 0 H LEU A 17 39.723 -21.914 15.175 1.00 0.00 H new ATOM 0 HA LEU A 17 38.130 -22.216 12.813 1.00 0.00 H new ATOM 0 HB2 LEU A 17 39.842 -20.465 13.175 1.00 0.00 H new ATOM 0 HB3 LEU A 17 41.092 -21.693 13.202 1.00 0.00 H new ATOM 0 HG LEU A 17 40.604 -22.312 10.911 1.00 0.00 H new ATOM 0 HD11 LEU A 17 39.127 -20.971 9.440 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.224 -21.826 10.712 1.00 0.00 H new ATOM 0 HD13 LEU A 17 38.540 -20.081 10.865 1.00 0.00 H new ATOM 0 HD21 LEU A 17 41.340 -20.142 9.813 1.00 0.00 H new ATOM 0 HD22 LEU A 17 40.877 -19.272 11.295 1.00 0.00 H new ATOM 0 HD23 LEU A 17 42.216 -20.443 11.333 1.00 0.00 H new ATOM 284 N VAL A 18 40.319 -24.619 13.468 1.00 0.00 N ATOM 285 CA VAL A 18 40.660 -26.027 13.181 1.00 0.00 C ATOM 286 C VAL A 18 39.415 -26.917 13.293 1.00 0.00 C ATOM 287 O VAL A 18 39.176 -27.743 12.409 1.00 0.00 O ATOM 288 CB VAL A 18 41.791 -26.513 14.114 1.00 0.00 C ATOM 289 CG1 VAL A 18 41.932 -28.039 14.127 1.00 0.00 C ATOM 290 CG2 VAL A 18 43.139 -25.927 13.683 1.00 0.00 C ATOM 0 H VAL A 18 40.845 -24.230 14.251 1.00 0.00 H new ATOM 0 HA VAL A 18 41.025 -26.096 12.156 1.00 0.00 H new ATOM 0 HB VAL A 18 41.518 -26.173 15.113 1.00 0.00 H new ATOM 0 HG11 VAL A 18 42.741 -28.324 14.799 1.00 0.00 H new ATOM 0 HG12 VAL A 18 41.000 -28.488 14.471 1.00 0.00 H new ATOM 0 HG13 VAL A 18 42.155 -28.392 13.120 1.00 0.00 H new ATOM 0 HG21 VAL A 18 43.921 -26.282 14.354 1.00 0.00 H new ATOM 0 HG22 VAL A 18 43.364 -26.242 12.664 1.00 0.00 H new ATOM 0 HG23 VAL A 18 43.092 -24.839 13.724 1.00 0.00 H new ATOM 300 N HIS A 19 38.601 -26.737 14.340 1.00 0.00 N ATOM 301 CA HIS A 19 37.329 -27.449 14.512 1.00 0.00 C ATOM 302 C HIS A 19 36.409 -27.145 13.317 1.00 0.00 C ATOM 303 O HIS A 19 35.969 -28.066 12.633 1.00 0.00 O ATOM 304 CB HIS A 19 36.681 -27.054 15.856 1.00 0.00 C ATOM 305 CG HIS A 19 35.297 -27.632 16.092 1.00 0.00 C ATOM 306 ND1 HIS A 19 34.950 -28.608 17.001 1.00 0.00 N ATOM 307 CD2 HIS A 19 34.134 -27.250 15.472 1.00 0.00 C ATOM 308 CE1 HIS A 19 33.619 -28.809 16.917 1.00 0.00 C ATOM 309 NE2 HIS A 19 33.069 -28.003 15.988 1.00 0.00 N ATOM 0 H HIS A 19 38.809 -26.087 15.098 1.00 0.00 H new ATOM 0 HA HIS A 19 37.502 -28.525 14.539 1.00 0.00 H new ATOM 0 HB2 HIS A 19 37.336 -27.374 16.666 1.00 0.00 H new ATOM 0 HB3 HIS A 19 36.619 -25.967 15.907 1.00 0.00 H new ATOM 0 HD1 HIS A 19 35.590 -29.095 17.629 1.00 0.00 H new ATOM 0 HD2 HIS A 19 34.052 -26.491 14.708 1.00 0.00 H new ATOM 0 HE1 HIS A 19 33.068 -29.520 17.514 1.00 0.00 H new ATOM 317 N ALA A 20 36.165 -25.864 13.018 1.00 0.00 N ATOM 318 CA ALA A 20 35.322 -25.426 11.903 1.00 0.00 C ATOM 319 C ALA A 20 35.773 -25.950 10.525 1.00 0.00 C ATOM 320 O ALA A 20 34.926 -26.233 9.675 1.00 0.00 O ATOM 321 CB ALA A 20 35.275 -23.899 11.923 1.00 0.00 C ATOM 0 H ALA A 20 36.556 -25.090 13.555 1.00 0.00 H new ATOM 0 HA ALA A 20 34.329 -25.853 12.045 1.00 0.00 H new ATOM 0 HB1 ALA A 20 34.653 -23.543 11.102 1.00 0.00 H new ATOM 0 HB2 ALA A 20 34.855 -23.560 12.870 1.00 0.00 H new ATOM 0 HB3 ALA A 20 36.284 -23.502 11.812 1.00 0.00 H new ATOM 327 N CYS A 21 37.083 -26.114 10.301 1.00 0.00 N ATOM 328 CA CYS A 21 37.642 -26.669 9.062 1.00 0.00 C ATOM 329 C CYS A 21 37.303 -28.164 8.856 1.00 0.00 C ATOM 330 O CYS A 21 37.458 -28.681 7.749 1.00 0.00 O ATOM 331 CB CYS A 21 39.161 -26.441 9.044 1.00 0.00 C ATOM 332 SG CYS A 21 39.517 -24.676 8.796 1.00 0.00 S ATOM 0 H CYS A 21 37.795 -25.861 10.986 1.00 0.00 H new ATOM 0 HA CYS A 21 37.178 -26.144 8.228 1.00 0.00 H new ATOM 0 HB2 CYS A 21 39.600 -26.781 9.982 1.00 0.00 H new ATOM 0 HB3 CYS A 21 39.617 -27.029 8.247 1.00 0.00 H new ATOM 0 HG CYS A 21 39.320 -24.033 9.909 1.00 0.00 H new ATOM 338 N GLN A 22 36.831 -28.854 9.902 1.00 0.00 N ATOM 339 CA GLN A 22 36.433 -30.271 9.886 1.00 0.00 C ATOM 340 C GLN A 22 34.920 -30.457 10.108 1.00 0.00 C ATOM 341 O GLN A 22 34.321 -31.393 9.569 1.00 0.00 O ATOM 342 CB GLN A 22 37.206 -31.017 10.986 1.00 0.00 C ATOM 343 CG GLN A 22 38.727 -31.011 10.772 1.00 0.00 C ATOM 344 CD GLN A 22 39.458 -31.457 12.033 1.00 0.00 C ATOM 345 OE1 GLN A 22 39.753 -32.625 12.245 1.00 0.00 O ATOM 346 NE2 GLN A 22 39.770 -30.534 12.918 1.00 0.00 N ATOM 0 H GLN A 22 36.710 -28.425 10.820 1.00 0.00 H new ATOM 0 HA GLN A 22 36.669 -30.675 8.901 1.00 0.00 H new ATOM 0 HB2 GLN A 22 36.980 -30.563 11.951 1.00 0.00 H new ATOM 0 HB3 GLN A 22 36.857 -32.049 11.030 1.00 0.00 H new ATOM 0 HG2 GLN A 22 38.984 -31.673 9.945 1.00 0.00 H new ATOM 0 HG3 GLN A 22 39.055 -30.010 10.492 1.00 0.00 H new ATOM 0 HE21 GLN A 22 39.526 -29.559 12.745 1.00 0.00 H new ATOM 0 HE22 GLN A 22 40.256 -30.794 13.776 1.00 0.00 H new ATOM 355 N CYS A 23 34.305 -29.570 10.895 1.00 0.00 N ATOM 356 CA CYS A 23 32.891 -29.561 11.244 1.00 0.00 C ATOM 357 C CYS A 23 31.977 -29.296 10.027 1.00 0.00 C ATOM 358 O CYS A 23 32.380 -28.681 9.032 1.00 0.00 O ATOM 359 CB CYS A 23 32.712 -28.540 12.376 1.00 0.00 C ATOM 360 SG CYS A 23 31.087 -28.714 13.162 1.00 0.00 S ATOM 0 H CYS A 23 34.813 -28.798 11.327 1.00 0.00 H new ATOM 0 HA CYS A 23 32.579 -30.547 11.588 1.00 0.00 H new ATOM 0 HB2 CYS A 23 33.496 -28.677 13.121 1.00 0.00 H new ATOM 0 HB3 CYS A 23 32.822 -27.530 11.980 1.00 0.00 H new ATOM 365 N ARG A 24 30.728 -29.770 10.108 1.00 0.00 N ATOM 366 CA ARG A 24 29.705 -29.681 9.045 1.00 0.00 C ATOM 367 C ARG A 24 28.422 -28.949 9.456 1.00 0.00 C ATOM 368 O ARG A 24 27.625 -28.586 8.590 1.00 0.00 O ATOM 369 CB ARG A 24 29.344 -31.099 8.558 1.00 0.00 C ATOM 370 CG ARG A 24 30.505 -32.051 8.207 1.00 0.00 C ATOM 371 CD ARG A 24 31.586 -31.505 7.262 1.00 0.00 C ATOM 372 NE ARG A 24 31.034 -30.935 6.016 1.00 0.00 N ATOM 373 CZ ARG A 24 31.219 -29.716 5.538 1.00 0.00 C ATOM 374 NH1 ARG A 24 31.858 -28.784 6.191 1.00 0.00 N ATOM 375 NH2 ARG A 24 30.745 -29.400 4.366 1.00 0.00 N ATOM 0 H ARG A 24 30.384 -30.244 10.943 1.00 0.00 H new ATOM 0 HA ARG A 24 30.154 -29.086 8.250 1.00 0.00 H new ATOM 0 HB2 ARG A 24 28.741 -31.576 9.330 1.00 0.00 H new ATOM 0 HB3 ARG A 24 28.712 -31.000 7.675 1.00 0.00 H new ATOM 0 HG2 ARG A 24 30.988 -32.355 9.136 1.00 0.00 H new ATOM 0 HG3 ARG A 24 30.083 -32.950 7.758 1.00 0.00 H new ATOM 0 HD2 ARG A 24 32.160 -30.738 7.782 1.00 0.00 H new ATOM 0 HD3 ARG A 24 32.280 -32.308 7.011 1.00 0.00 H new ATOM 0 HE ARG A 24 30.442 -31.553 5.461 1.00 0.00 H new ATOM 0 HH11 ARG A 24 32.242 -28.981 7.115 1.00 0.00 H new ATOM 0 HH12 ARG A 24 31.973 -27.859 5.777 1.00 0.00 H new ATOM 0 HH21 ARG A 24 30.233 -30.092 3.820 1.00 0.00 H new ATOM 0 HH22 ARG A 24 30.886 -28.460 3.995 1.00 0.00 H new ATOM 389 N ASN A 25 28.210 -28.725 10.753 1.00 0.00 N ATOM 390 CA ASN A 25 27.029 -28.047 11.294 1.00 0.00 C ATOM 391 C ASN A 25 26.966 -26.573 10.844 1.00 0.00 C ATOM 392 O ASN A 25 27.848 -25.791 11.200 1.00 0.00 O ATOM 393 CB ASN A 25 27.083 -28.104 12.831 1.00 0.00 C ATOM 394 CG ASN A 25 27.115 -29.496 13.435 1.00 0.00 C ATOM 395 OD1 ASN A 25 26.419 -30.411 13.010 1.00 0.00 O ATOM 396 ND2 ASN A 25 27.922 -29.694 14.449 1.00 0.00 N ATOM 0 H ASN A 25 28.869 -29.016 11.475 1.00 0.00 H new ATOM 0 HA ASN A 25 26.140 -28.554 10.919 1.00 0.00 H new ATOM 0 HB2 ASN A 25 27.967 -27.562 13.166 1.00 0.00 H new ATOM 0 HB3 ASN A 25 26.216 -27.575 13.227 1.00 0.00 H new ATOM 0 HD21 ASN A 25 27.973 -30.613 14.888 1.00 0.00 H new ATOM 0 HD22 ASN A 25 28.499 -28.929 14.799 1.00 0.00 H new ATOM 403 N ALA A 26 25.926 -26.160 10.113 1.00 0.00 N ATOM 404 CA ALA A 26 25.748 -24.758 9.696 1.00 0.00 C ATOM 405 C ALA A 26 25.627 -23.783 10.891 1.00 0.00 C ATOM 406 O ALA A 26 25.959 -22.597 10.786 1.00 0.00 O ATOM 407 CB ALA A 26 24.517 -24.681 8.787 1.00 0.00 C ATOM 0 H ALA A 26 25.184 -26.782 9.793 1.00 0.00 H new ATOM 0 HA ALA A 26 26.639 -24.441 9.155 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.366 -23.650 8.466 1.00 0.00 H new ATOM 0 HB2 ALA A 26 24.670 -25.315 7.913 1.00 0.00 H new ATOM 0 HB3 ALA A 26 23.639 -25.023 9.334 1.00 0.00 H new ATOM 413 N ASN A 27 25.155 -24.299 12.032 1.00 0.00 N ATOM 414 CA ASN A 27 24.927 -23.575 13.281 1.00 0.00 C ATOM 415 C ASN A 27 25.329 -24.448 14.497 1.00 0.00 C ATOM 416 O ASN A 27 24.501 -24.747 15.362 1.00 0.00 O ATOM 417 CB ASN A 27 23.464 -23.085 13.307 1.00 0.00 C ATOM 418 CG ASN A 27 23.143 -22.172 12.133 1.00 0.00 C ATOM 419 OD1 ASN A 27 23.512 -21.006 12.097 1.00 0.00 O ATOM 420 ND2 ASN A 27 22.490 -22.677 11.110 1.00 0.00 N ATOM 0 H ASN A 27 24.910 -25.286 12.109 1.00 0.00 H new ATOM 0 HA ASN A 27 25.562 -22.691 13.344 1.00 0.00 H new ATOM 0 HB2 ASN A 27 22.794 -23.945 13.290 1.00 0.00 H new ATOM 0 HB3 ASN A 27 23.277 -22.554 14.240 1.00 0.00 H new ATOM 0 HD21 ASN A 27 22.294 -22.098 10.294 1.00 0.00 H new ATOM 0 HD22 ASN A 27 22.179 -23.648 11.133 1.00 0.00 H new ATOM 427 N CYS A 28 26.594 -24.900 14.519 1.00 0.00 N ATOM 428 CA CYS A 28 27.203 -25.754 15.552 1.00 0.00 C ATOM 429 C CYS A 28 26.973 -25.252 16.997 1.00 0.00 C ATOM 430 O CYS A 28 26.740 -24.063 17.233 1.00 0.00 O ATOM 431 CB CYS A 28 28.705 -25.858 15.233 1.00 0.00 C ATOM 432 SG CYS A 28 29.474 -27.338 15.967 1.00 0.00 S ATOM 0 H CYS A 28 27.254 -24.667 13.777 1.00 0.00 H new ATOM 0 HA CYS A 28 26.720 -26.731 15.523 1.00 0.00 H new ATOM 0 HB2 CYS A 28 28.843 -25.879 14.152 1.00 0.00 H new ATOM 0 HB3 CYS A 28 29.214 -24.967 15.602 1.00 0.00 H new ATOM 437 N SER A 29 27.065 -26.144 17.987 1.00 0.00 N ATOM 438 CA SER A 29 26.885 -25.798 19.407 1.00 0.00 C ATOM 439 C SER A 29 27.972 -24.863 19.965 1.00 0.00 C ATOM 440 O SER A 29 27.725 -24.174 20.960 1.00 0.00 O ATOM 441 CB SER A 29 26.773 -27.062 20.268 1.00 0.00 C ATOM 442 OG SER A 29 27.952 -27.849 20.192 1.00 0.00 O ATOM 0 H SER A 29 27.267 -27.131 17.830 1.00 0.00 H new ATOM 0 HA SER A 29 25.950 -25.240 19.457 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.587 -26.782 21.305 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.918 -27.653 19.939 1.00 0.00 H new ATOM 0 HG SER A 29 27.850 -28.646 20.753 1.00 0.00 H new ATOM 448 N LEU A 30 29.144 -24.783 19.324 1.00 0.00 N ATOM 449 CA LEU A 30 30.214 -23.854 19.704 1.00 0.00 C ATOM 450 C LEU A 30 29.940 -22.462 19.100 1.00 0.00 C ATOM 451 O LEU A 30 29.688 -22.363 17.896 1.00 0.00 O ATOM 452 CB LEU A 30 31.579 -24.379 19.222 1.00 0.00 C ATOM 453 CG LEU A 30 32.207 -25.465 20.114 1.00 0.00 C ATOM 454 CD1 LEU A 30 33.524 -25.929 19.490 1.00 0.00 C ATOM 455 CD2 LEU A 30 32.520 -24.954 21.526 1.00 0.00 C ATOM 0 H LEU A 30 29.378 -25.366 18.520 1.00 0.00 H new ATOM 0 HA LEU A 30 30.237 -23.773 20.791 1.00 0.00 H new ATOM 0 HB2 LEU A 30 31.463 -24.779 18.215 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.271 -23.540 19.154 1.00 0.00 H new ATOM 0 HG LEU A 30 31.482 -26.276 20.188 1.00 0.00 H new ATOM 0 HD11 LEU A 30 33.973 -26.698 20.118 1.00 0.00 H new ATOM 0 HD12 LEU A 30 33.333 -26.337 18.497 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.206 -25.083 19.409 1.00 0.00 H new ATOM 0 HD21 LEU A 30 32.961 -25.758 22.115 1.00 0.00 H new ATOM 0 HD22 LEU A 30 33.222 -24.122 21.465 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.600 -24.618 22.004 1.00 0.00 H new ATOM 467 N PRO A 31 30.009 -21.372 19.890 1.00 0.00 N ATOM 468 CA PRO A 31 29.746 -20.018 19.397 1.00 0.00 C ATOM 469 C PRO A 31 30.743 -19.575 18.315 1.00 0.00 C ATOM 470 O PRO A 31 30.351 -18.926 17.343 1.00 0.00 O ATOM 471 CB PRO A 31 29.791 -19.115 20.637 1.00 0.00 C ATOM 472 CG PRO A 31 30.648 -19.895 21.634 1.00 0.00 C ATOM 473 CD PRO A 31 30.324 -21.347 21.311 1.00 0.00 C ATOM 0 HA PRO A 31 28.778 -19.964 18.900 1.00 0.00 H new ATOM 0 HB2 PRO A 31 30.230 -18.144 20.408 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.792 -18.928 21.031 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.709 -19.681 21.506 1.00 0.00 H new ATOM 0 HG3 PRO A 31 30.394 -19.646 22.664 1.00 0.00 H new ATOM 0 HD2 PRO A 31 31.170 -21.997 21.536 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.482 -21.702 21.905 1.00 0.00 H new ATOM 481 N SER A 32 32.024 -19.932 18.458 1.00 0.00 N ATOM 482 CA SER A 32 33.066 -19.572 17.487 1.00 0.00 C ATOM 483 C SER A 32 32.934 -20.352 16.173 1.00 0.00 C ATOM 484 O SER A 32 33.033 -19.745 15.117 1.00 0.00 O ATOM 485 CB SER A 32 34.465 -19.775 18.075 1.00 0.00 C ATOM 486 OG SER A 32 34.576 -19.144 19.341 1.00 0.00 O ATOM 0 H SER A 32 32.368 -20.478 19.248 1.00 0.00 H new ATOM 0 HA SER A 32 32.925 -18.515 17.262 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.671 -20.841 18.176 1.00 0.00 H new ATOM 0 HB3 SER A 32 35.213 -19.369 17.394 1.00 0.00 H new ATOM 0 HG SER A 32 35.477 -19.287 19.700 1.00 0.00 H new ATOM 492 N CYS A 33 32.675 -21.664 16.207 1.00 0.00 N ATOM 493 CA CYS A 33 32.488 -22.529 15.029 1.00 0.00 C ATOM 494 C CYS A 33 31.475 -21.941 14.018 1.00 0.00 C ATOM 495 O CYS A 33 31.763 -21.831 12.819 1.00 0.00 O ATOM 496 CB CYS A 33 32.078 -23.917 15.555 1.00 0.00 C ATOM 497 SG CYS A 33 31.868 -25.143 14.227 1.00 0.00 S ATOM 0 H CYS A 33 32.586 -22.174 17.086 1.00 0.00 H new ATOM 0 HA CYS A 33 33.415 -22.606 14.460 1.00 0.00 H new ATOM 0 HB2 CYS A 33 32.834 -24.273 16.255 1.00 0.00 H new ATOM 0 HB3 CYS A 33 31.145 -23.828 16.112 1.00 0.00 H new ATOM 502 N GLN A 34 30.323 -21.464 14.516 1.00 0.00 N ATOM 503 CA GLN A 34 29.285 -20.793 13.714 1.00 0.00 C ATOM 504 C GLN A 34 29.845 -19.613 12.897 1.00 0.00 C ATOM 505 O GLN A 34 29.473 -19.416 11.736 1.00 0.00 O ATOM 506 CB GLN A 34 28.179 -20.236 14.631 1.00 0.00 C ATOM 507 CG GLN A 34 27.414 -21.282 15.453 1.00 0.00 C ATOM 508 CD GLN A 34 26.387 -20.660 16.407 1.00 0.00 C ATOM 509 OE1 GLN A 34 25.990 -19.506 16.303 1.00 0.00 O ATOM 510 NE2 GLN A 34 25.904 -21.403 17.378 1.00 0.00 N ATOM 0 H GLN A 34 30.082 -21.535 15.505 1.00 0.00 H new ATOM 0 HA GLN A 34 28.892 -21.546 13.031 1.00 0.00 H new ATOM 0 HB2 GLN A 34 28.628 -19.517 15.317 1.00 0.00 H new ATOM 0 HB3 GLN A 34 27.464 -19.688 14.017 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.904 -21.967 14.775 1.00 0.00 H new ATOM 0 HG3 GLN A 34 28.125 -21.874 16.029 1.00 0.00 H new ATOM 0 HE21 GLN A 34 26.218 -22.367 17.487 1.00 0.00 H new ATOM 0 HE22 GLN A 34 25.215 -21.015 18.023 1.00 0.00 H new ATOM 519 N LYS A 35 30.748 -18.835 13.505 1.00 0.00 N ATOM 520 CA LYS A 35 31.395 -17.653 12.931 1.00 0.00 C ATOM 521 C LYS A 35 32.565 -18.038 12.029 1.00 0.00 C ATOM 522 O LYS A 35 32.668 -17.528 10.921 1.00 0.00 O ATOM 523 CB LYS A 35 31.820 -16.772 14.121 1.00 0.00 C ATOM 524 CG LYS A 35 32.494 -15.445 13.762 1.00 0.00 C ATOM 525 CD LYS A 35 32.861 -14.722 15.070 1.00 0.00 C ATOM 526 CE LYS A 35 33.542 -13.391 14.752 1.00 0.00 C ATOM 527 NZ LYS A 35 33.903 -12.633 15.977 1.00 0.00 N ATOM 0 H LYS A 35 31.062 -19.023 14.457 1.00 0.00 H new ATOM 0 HA LYS A 35 30.715 -17.101 12.282 1.00 0.00 H new ATOM 0 HB2 LYS A 35 30.937 -16.558 14.723 1.00 0.00 H new ATOM 0 HB3 LYS A 35 32.502 -17.346 14.748 1.00 0.00 H new ATOM 0 HG2 LYS A 35 33.387 -15.622 13.162 1.00 0.00 H new ATOM 0 HG3 LYS A 35 31.824 -14.829 13.162 1.00 0.00 H new ATOM 0 HD2 LYS A 35 31.964 -14.549 15.665 1.00 0.00 H new ATOM 0 HD3 LYS A 35 33.524 -15.347 15.668 1.00 0.00 H new ATOM 0 HE2 LYS A 35 34.441 -13.577 14.165 1.00 0.00 H new ATOM 0 HE3 LYS A 35 32.879 -12.785 14.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 34.728 -12.031 15.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 33.101 -12.038 16.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 34.133 -13.299 16.742 1.00 0.00 H new ATOM 541 N MET A 36 33.410 -18.974 12.456 1.00 0.00 N ATOM 542 CA MET A 36 34.566 -19.473 11.702 1.00 0.00 C ATOM 543 C MET A 36 34.183 -20.018 10.323 1.00 0.00 C ATOM 544 O MET A 36 34.875 -19.749 9.338 1.00 0.00 O ATOM 545 CB MET A 36 35.293 -20.537 12.534 1.00 0.00 C ATOM 546 CG MET A 36 36.005 -19.951 13.756 1.00 0.00 C ATOM 547 SD MET A 36 37.340 -18.803 13.308 1.00 0.00 S ATOM 548 CE MET A 36 38.250 -18.728 14.867 1.00 0.00 C ATOM 0 H MET A 36 33.308 -19.423 13.366 1.00 0.00 H new ATOM 0 HA MET A 36 35.234 -18.632 11.517 1.00 0.00 H new ATOM 0 HB2 MET A 36 34.574 -21.288 12.863 1.00 0.00 H new ATOM 0 HB3 MET A 36 36.022 -21.048 11.905 1.00 0.00 H new ATOM 0 HG2 MET A 36 35.278 -19.431 14.380 1.00 0.00 H new ATOM 0 HG3 MET A 36 36.416 -20.763 14.356 1.00 0.00 H new ATOM 0 HE1 MET A 36 39.211 -18.239 14.704 1.00 0.00 H new ATOM 0 HE2 MET A 36 37.674 -18.161 15.598 1.00 0.00 H new ATOM 0 HE3 MET A 36 38.416 -19.738 15.241 1.00 0.00 H new ATOM 558 N LYS A 37 33.051 -20.725 10.220 1.00 0.00 N ATOM 559 CA LYS A 37 32.523 -21.196 8.929 1.00 0.00 C ATOM 560 C LYS A 37 32.140 -20.012 8.037 1.00 0.00 C ATOM 561 O LYS A 37 32.559 -19.956 6.884 1.00 0.00 O ATOM 562 CB LYS A 37 31.330 -22.134 9.163 1.00 0.00 C ATOM 563 CG LYS A 37 31.821 -23.497 9.669 1.00 0.00 C ATOM 564 CD LYS A 37 30.668 -24.347 10.196 1.00 0.00 C ATOM 565 CE LYS A 37 31.224 -25.697 10.653 1.00 0.00 C ATOM 566 NZ LYS A 37 30.520 -26.162 11.856 1.00 0.00 N ATOM 0 H LYS A 37 32.477 -20.986 11.022 1.00 0.00 H new ATOM 0 HA LYS A 37 33.300 -21.757 8.410 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.647 -21.692 9.889 1.00 0.00 H new ATOM 0 HB3 LYS A 37 30.771 -22.262 8.236 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.325 -24.027 8.860 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.556 -23.349 10.460 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.174 -23.841 11.026 1.00 0.00 H new ATOM 0 HD3 LYS A 37 29.918 -24.491 9.418 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.116 -26.431 9.854 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.290 -25.607 10.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.565 -27.200 11.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.970 -25.755 12.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.526 -25.860 11.815 1.00 0.00 H new ATOM 580 N ARG A 38 31.417 -19.021 8.571 1.00 0.00 N ATOM 581 CA ARG A 38 31.026 -17.803 7.828 1.00 0.00 C ATOM 582 C ARG A 38 32.258 -17.005 7.373 1.00 0.00 C ATOM 583 O ARG A 38 32.291 -16.501 6.251 1.00 0.00 O ATOM 584 CB ARG A 38 30.045 -16.981 8.687 1.00 0.00 C ATOM 585 CG ARG A 38 28.687 -17.702 8.829 1.00 0.00 C ATOM 586 CD ARG A 38 27.829 -17.101 9.951 1.00 0.00 C ATOM 587 NE ARG A 38 26.451 -17.640 9.961 1.00 0.00 N ATOM 588 CZ ARG A 38 26.025 -18.824 10.376 1.00 0.00 C ATOM 589 NH1 ARG A 38 26.816 -19.760 10.815 1.00 0.00 N ATOM 590 NH2 ARG A 38 24.754 -19.099 10.362 1.00 0.00 N ATOM 0 H ARG A 38 31.082 -19.035 9.534 1.00 0.00 H new ATOM 0 HA ARG A 38 30.509 -18.079 6.909 1.00 0.00 H new ATOM 0 HB2 ARG A 38 30.475 -16.813 9.674 1.00 0.00 H new ATOM 0 HB3 ARG A 38 29.894 -16.001 8.234 1.00 0.00 H new ATOM 0 HG2 ARG A 38 28.144 -17.641 7.886 1.00 0.00 H new ATOM 0 HG3 ARG A 38 28.858 -18.760 9.031 1.00 0.00 H new ATOM 0 HD2 ARG A 38 28.301 -17.302 10.913 1.00 0.00 H new ATOM 0 HD3 ARG A 38 27.791 -16.018 9.835 1.00 0.00 H new ATOM 0 HE ARG A 38 25.731 -17.015 9.599 1.00 0.00 H new ATOM 0 HH11 ARG A 38 27.823 -19.601 10.853 1.00 0.00 H new ATOM 0 HH12 ARG A 38 26.429 -20.653 11.121 1.00 0.00 H new ATOM 0 HH21 ARG A 38 24.085 -18.403 10.032 1.00 0.00 H new ATOM 0 HH22 ARG A 38 24.426 -20.010 10.681 1.00 0.00 H new ATOM 604 N VAL A 39 33.293 -16.950 8.212 1.00 0.00 N ATOM 605 CA VAL A 39 34.592 -16.308 7.946 1.00 0.00 C ATOM 606 C VAL A 39 35.343 -16.987 6.791 1.00 0.00 C ATOM 607 O VAL A 39 35.714 -16.299 5.838 1.00 0.00 O ATOM 608 CB VAL A 39 35.431 -16.297 9.239 1.00 0.00 C ATOM 609 CG1 VAL A 39 36.879 -15.883 9.033 1.00 0.00 C ATOM 610 CG2 VAL A 39 34.895 -15.281 10.239 1.00 0.00 C ATOM 0 H VAL A 39 33.252 -17.370 9.141 1.00 0.00 H new ATOM 0 HA VAL A 39 34.413 -15.280 7.630 1.00 0.00 H new ATOM 0 HB VAL A 39 35.369 -17.327 9.590 1.00 0.00 H new ATOM 0 HG11 VAL A 39 37.402 -15.900 9.989 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.361 -16.576 8.343 1.00 0.00 H new ATOM 0 HG13 VAL A 39 36.914 -14.875 8.619 1.00 0.00 H new ATOM 0 HG21 VAL A 39 35.509 -15.298 11.140 1.00 0.00 H new ATOM 0 HG22 VAL A 39 34.926 -14.285 9.798 1.00 0.00 H new ATOM 0 HG23 VAL A 39 33.866 -15.532 10.496 1.00 0.00 H new ATOM 620 N VAL A 40 35.558 -18.314 6.818 1.00 0.00 N ATOM 621 CA VAL A 40 36.252 -19.000 5.705 1.00 0.00 C ATOM 622 C VAL A 40 35.440 -18.891 4.407 1.00 0.00 C ATOM 623 O VAL A 40 36.014 -18.613 3.357 1.00 0.00 O ATOM 624 CB VAL A 40 36.673 -20.448 6.037 1.00 0.00 C ATOM 625 CG1 VAL A 40 35.540 -21.474 5.966 1.00 0.00 C ATOM 626 CG2 VAL A 40 37.792 -20.907 5.090 1.00 0.00 C ATOM 0 H VAL A 40 35.269 -18.926 7.581 1.00 0.00 H new ATOM 0 HA VAL A 40 37.195 -18.476 5.547 1.00 0.00 H new ATOM 0 HB VAL A 40 37.009 -20.411 7.073 1.00 0.00 H new ATOM 0 HG11 VAL A 40 35.928 -22.462 6.214 1.00 0.00 H new ATOM 0 HG12 VAL A 40 34.758 -21.202 6.675 1.00 0.00 H new ATOM 0 HG13 VAL A 40 35.126 -21.489 4.958 1.00 0.00 H new ATOM 0 HG21 VAL A 40 38.079 -21.929 5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 40 37.437 -20.867 4.060 1.00 0.00 H new ATOM 0 HG23 VAL A 40 38.655 -20.251 5.202 1.00 0.00 H new ATOM 636 N GLN A 41 34.109 -19.039 4.467 1.00 0.00 N ATOM 637 CA GLN A 41 33.210 -18.879 3.314 1.00 0.00 C ATOM 638 C GLN A 41 33.330 -17.488 2.675 1.00 0.00 C ATOM 639 O GLN A 41 33.369 -17.393 1.447 1.00 0.00 O ATOM 640 CB GLN A 41 31.758 -19.144 3.723 1.00 0.00 C ATOM 641 CG GLN A 41 31.449 -20.637 3.977 1.00 0.00 C ATOM 642 CD GLN A 41 31.722 -21.545 2.780 1.00 0.00 C ATOM 643 OE1 GLN A 41 32.671 -22.323 2.762 1.00 0.00 O ATOM 644 NE2 GLN A 41 30.924 -21.486 1.735 1.00 0.00 N ATOM 0 H GLN A 41 33.619 -19.277 5.330 1.00 0.00 H new ATOM 0 HA GLN A 41 33.514 -19.613 2.568 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.535 -18.577 4.626 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.096 -18.772 2.941 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.044 -20.981 4.823 1.00 0.00 H new ATOM 0 HG3 GLN A 41 30.402 -20.736 4.263 1.00 0.00 H new ATOM 0 HE21 GLN A 41 30.131 -20.845 1.735 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.099 -22.082 0.926 1.00 0.00 H new ATOM 653 N HIS A 42 33.438 -16.421 3.480 1.00 0.00 N ATOM 654 CA HIS A 42 33.690 -15.073 2.952 1.00 0.00 C ATOM 655 C HIS A 42 34.995 -15.071 2.137 1.00 0.00 C ATOM 656 O HIS A 42 34.987 -14.741 0.950 1.00 0.00 O ATOM 657 CB HIS A 42 33.738 -14.010 4.079 1.00 0.00 C ATOM 658 CG HIS A 42 34.463 -12.744 3.655 1.00 0.00 C ATOM 659 ND1 HIS A 42 33.946 -11.718 2.894 1.00 0.00 N ATOM 660 CD2 HIS A 42 35.827 -12.580 3.660 1.00 0.00 C ATOM 661 CE1 HIS A 42 34.976 -10.994 2.416 1.00 0.00 C ATOM 662 NE2 HIS A 42 36.149 -11.506 2.825 1.00 0.00 N ATOM 0 H HIS A 42 33.355 -16.465 4.496 1.00 0.00 H new ATOM 0 HA HIS A 42 32.860 -14.803 2.299 1.00 0.00 H new ATOM 0 HB2 HIS A 42 32.721 -13.759 4.380 1.00 0.00 H new ATOM 0 HB3 HIS A 42 34.234 -14.433 4.952 1.00 0.00 H new ATOM 0 HD1 HIS A 42 32.957 -11.538 2.723 1.00 0.00 H new ATOM 0 HD2 HIS A 42 36.532 -13.180 4.216 1.00 0.00 H new ATOM 0 HE1 HIS A 42 34.873 -10.121 1.789 1.00 0.00 H new ATOM 670 N THR A 43 36.113 -15.467 2.755 1.00 0.00 N ATOM 671 CA THR A 43 37.435 -15.447 2.113 1.00 0.00 C ATOM 672 C THR A 43 37.491 -16.293 0.844 1.00 0.00 C ATOM 673 O THR A 43 38.081 -15.858 -0.151 1.00 0.00 O ATOM 674 CB THR A 43 38.518 -15.863 3.116 1.00 0.00 C ATOM 675 OG1 THR A 43 38.712 -14.822 4.038 1.00 0.00 O ATOM 676 CG2 THR A 43 39.859 -16.174 2.458 1.00 0.00 C ATOM 0 H THR A 43 36.128 -15.811 3.715 1.00 0.00 H new ATOM 0 HA THR A 43 37.626 -14.422 1.796 1.00 0.00 H new ATOM 0 HB THR A 43 38.167 -16.775 3.599 1.00 0.00 H new ATOM 0 HG1 THR A 43 39.234 -14.106 3.618 1.00 0.00 H new ATOM 0 HG21 THR A 43 40.581 -16.462 3.222 1.00 0.00 H new ATOM 0 HG22 THR A 43 39.735 -16.993 1.749 1.00 0.00 H new ATOM 0 HG23 THR A 43 40.220 -15.290 1.932 1.00 0.00 H new ATOM 684 N LYS A 44 36.834 -17.460 0.857 1.00 0.00 N ATOM 685 CA LYS A 44 36.703 -18.410 -0.261 1.00 0.00 C ATOM 686 C LYS A 44 36.079 -17.797 -1.529 1.00 0.00 C ATOM 687 O LYS A 44 36.272 -18.346 -2.615 1.00 0.00 O ATOM 688 CB LYS A 44 35.858 -19.607 0.215 1.00 0.00 C ATOM 689 CG LYS A 44 36.639 -20.732 0.911 1.00 0.00 C ATOM 690 CD LYS A 44 35.605 -21.717 1.480 1.00 0.00 C ATOM 691 CE LYS A 44 36.209 -22.965 2.126 1.00 0.00 C ATOM 692 NZ LYS A 44 35.129 -23.920 2.493 1.00 0.00 N ATOM 0 H LYS A 44 36.352 -17.787 1.694 1.00 0.00 H new ATOM 0 HA LYS A 44 37.709 -18.719 -0.546 1.00 0.00 H new ATOM 0 HB2 LYS A 44 35.094 -19.240 0.901 1.00 0.00 H new ATOM 0 HB3 LYS A 44 35.338 -20.028 -0.646 1.00 0.00 H new ATOM 0 HG2 LYS A 44 37.301 -21.234 0.206 1.00 0.00 H new ATOM 0 HG3 LYS A 44 37.266 -20.330 1.707 1.00 0.00 H new ATOM 0 HD2 LYS A 44 34.996 -21.198 2.220 1.00 0.00 H new ATOM 0 HD3 LYS A 44 34.936 -22.026 0.677 1.00 0.00 H new ATOM 0 HE2 LYS A 44 36.907 -23.440 1.437 1.00 0.00 H new ATOM 0 HE3 LYS A 44 36.777 -22.687 3.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 35.376 -24.399 3.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 34.235 -23.403 2.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 35.020 -24.627 1.738 1.00 0.00 H new ATOM 706 N GLY A 45 35.351 -16.681 -1.406 1.00 0.00 N ATOM 707 CA GLY A 45 34.691 -15.977 -2.515 1.00 0.00 C ATOM 708 C GLY A 45 35.068 -14.494 -2.663 1.00 0.00 C ATOM 709 O GLY A 45 34.670 -13.873 -3.653 1.00 0.00 O ATOM 0 H GLY A 45 35.199 -16.228 -0.505 1.00 0.00 H new ATOM 0 HA2 GLY A 45 34.931 -16.491 -3.445 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.612 -16.050 -2.380 1.00 0.00 H new ATOM 713 N CYS A 46 35.825 -13.920 -1.720 1.00 0.00 N ATOM 714 CA CYS A 46 36.264 -12.526 -1.751 1.00 0.00 C ATOM 715 C CYS A 46 37.257 -12.259 -2.899 1.00 0.00 C ATOM 716 O CYS A 46 37.945 -13.161 -3.391 1.00 0.00 O ATOM 717 CB CYS A 46 36.753 -12.183 -0.335 1.00 0.00 C ATOM 718 SG CYS A 46 37.903 -10.776 -0.219 1.00 0.00 S ATOM 0 H CYS A 46 36.155 -14.426 -0.898 1.00 0.00 H new ATOM 0 HA CYS A 46 35.451 -11.842 -1.994 1.00 0.00 H new ATOM 0 HB2 CYS A 46 35.884 -11.972 0.289 1.00 0.00 H new ATOM 0 HB3 CYS A 46 37.240 -13.063 0.085 1.00 0.00 H new ATOM 723 N LYS A 47 37.313 -10.992 -3.319 1.00 0.00 N ATOM 724 CA LYS A 47 38.157 -10.462 -4.404 1.00 0.00 C ATOM 725 C LYS A 47 39.075 -9.326 -3.921 1.00 0.00 C ATOM 726 O LYS A 47 39.751 -8.699 -4.741 1.00 0.00 O ATOM 727 CB LYS A 47 37.260 -10.011 -5.579 1.00 0.00 C ATOM 728 CG LYS A 47 36.282 -11.073 -6.121 1.00 0.00 C ATOM 729 CD LYS A 47 36.980 -12.301 -6.731 1.00 0.00 C ATOM 730 CE LYS A 47 35.982 -13.396 -7.131 1.00 0.00 C ATOM 731 NZ LYS A 47 35.130 -13.002 -8.285 1.00 0.00 N ATOM 0 H LYS A 47 36.741 -10.265 -2.890 1.00 0.00 H new ATOM 0 HA LYS A 47 38.817 -11.258 -4.748 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.684 -9.143 -5.259 1.00 0.00 H new ATOM 0 HB3 LYS A 47 37.902 -9.684 -6.397 1.00 0.00 H new ATOM 0 HG2 LYS A 47 35.630 -11.401 -5.311 1.00 0.00 H new ATOM 0 HG3 LYS A 47 35.645 -10.615 -6.877 1.00 0.00 H new ATOM 0 HD2 LYS A 47 37.551 -11.994 -7.607 1.00 0.00 H new ATOM 0 HD3 LYS A 47 37.692 -12.706 -6.012 1.00 0.00 H new ATOM 0 HE2 LYS A 47 36.528 -14.306 -7.381 1.00 0.00 H new ATOM 0 HE3 LYS A 47 35.345 -13.631 -6.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 34.475 -13.777 -8.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 34.586 -12.150 -8.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 35.732 -12.804 -9.109 1.00 0.00 H new ATOM 745 N ARG A 48 39.122 -9.065 -2.606 1.00 0.00 N ATOM 746 CA ARG A 48 39.951 -8.028 -1.975 1.00 0.00 C ATOM 747 C ARG A 48 41.242 -8.635 -1.409 1.00 0.00 C ATOM 748 O ARG A 48 42.321 -8.267 -1.872 1.00 0.00 O ATOM 749 CB ARG A 48 39.138 -7.360 -0.856 1.00 0.00 C ATOM 750 CG ARG A 48 37.832 -6.683 -1.265 1.00 0.00 C ATOM 751 CD ARG A 48 37.148 -6.002 -0.068 1.00 0.00 C ATOM 752 NE ARG A 48 36.888 -6.928 1.057 1.00 0.00 N ATOM 753 CZ ARG A 48 36.091 -6.719 2.086 1.00 0.00 C ATOM 754 NH1 ARG A 48 35.352 -5.658 2.230 1.00 0.00 N ATOM 755 NH2 ARG A 48 36.028 -7.576 3.047 1.00 0.00 N ATOM 0 H ARG A 48 38.565 -9.588 -1.930 1.00 0.00 H new ATOM 0 HA ARG A 48 40.232 -7.284 -2.721 1.00 0.00 H new ATOM 0 HB2 ARG A 48 38.908 -8.116 -0.105 1.00 0.00 H new ATOM 0 HB3 ARG A 48 39.771 -6.615 -0.375 1.00 0.00 H new ATOM 0 HG2 ARG A 48 38.032 -5.943 -2.040 1.00 0.00 H new ATOM 0 HG3 ARG A 48 37.158 -7.423 -1.697 1.00 0.00 H new ATOM 0 HD2 ARG A 48 37.774 -5.182 0.282 1.00 0.00 H new ATOM 0 HD3 ARG A 48 36.205 -5.565 -0.396 1.00 0.00 H new ATOM 0 HE ARG A 48 37.377 -7.823 1.034 1.00 0.00 H new ATOM 0 HH11 ARG A 48 35.368 -4.925 1.521 1.00 0.00 H new ATOM 0 HH12 ARG A 48 34.757 -5.559 3.052 1.00 0.00 H new ATOM 0 HH21 ARG A 48 36.597 -8.422 3.014 1.00 0.00 H new ATOM 0 HH22 ARG A 48 35.409 -7.408 3.840 1.00 0.00 H new ATOM 769 N LYS A 49 41.125 -9.570 -0.450 1.00 0.00 N ATOM 770 CA LYS A 49 42.206 -10.282 0.270 1.00 0.00 C ATOM 771 C LYS A 49 43.417 -9.458 0.767 1.00 0.00 C ATOM 772 O LYS A 49 43.428 -8.228 0.697 1.00 0.00 O ATOM 773 CB LYS A 49 42.542 -11.648 -0.381 1.00 0.00 C ATOM 774 CG LYS A 49 42.350 -11.844 -1.893 1.00 0.00 C ATOM 775 CD LYS A 49 40.924 -12.261 -2.295 1.00 0.00 C ATOM 776 CE LYS A 49 40.430 -13.552 -1.621 1.00 0.00 C ATOM 777 NZ LYS A 49 39.587 -13.295 -0.432 1.00 0.00 N ATOM 0 H LYS A 49 40.205 -9.874 -0.131 1.00 0.00 H new ATOM 0 HA LYS A 49 41.759 -10.501 1.239 1.00 0.00 H new ATOM 0 HB2 LYS A 49 43.586 -11.867 -0.155 1.00 0.00 H new ATOM 0 HB3 LYS A 49 41.941 -12.405 0.123 1.00 0.00 H new ATOM 0 HG2 LYS A 49 42.603 -10.915 -2.404 1.00 0.00 H new ATOM 0 HG3 LYS A 49 43.051 -12.602 -2.242 1.00 0.00 H new ATOM 0 HD2 LYS A 49 40.238 -11.451 -2.049 1.00 0.00 H new ATOM 0 HD3 LYS A 49 40.887 -12.392 -3.376 1.00 0.00 H new ATOM 0 HE2 LYS A 49 39.862 -14.138 -2.343 1.00 0.00 H new ATOM 0 HE3 LYS A 49 41.290 -14.154 -1.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 38.909 -14.075 -0.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 40.190 -13.227 0.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 39.069 -12.403 -0.560 1.00 0.00 H new ATOM 791 N THR A 50 44.450 -10.128 1.297 1.00 0.00 N ATOM 792 CA THR A 50 45.708 -9.522 1.790 1.00 0.00 C ATOM 793 C THR A 50 46.421 -8.696 0.714 1.00 0.00 C ATOM 794 O THR A 50 47.058 -7.689 1.021 1.00 0.00 O ATOM 795 CB THR A 50 46.704 -10.596 2.275 1.00 0.00 C ATOM 796 OG1 THR A 50 46.901 -11.553 1.258 1.00 0.00 O ATOM 797 CG2 THR A 50 46.284 -11.369 3.523 1.00 0.00 C ATOM 0 H THR A 50 44.438 -11.143 1.401 1.00 0.00 H new ATOM 0 HA THR A 50 45.409 -8.874 2.614 1.00 0.00 H new ATOM 0 HB THR A 50 47.603 -10.033 2.526 1.00 0.00 H new ATOM 0 HG1 THR A 50 47.784 -11.965 1.363 1.00 0.00 H new ATOM 0 HG21 THR A 50 47.055 -12.097 3.776 1.00 0.00 H new ATOM 0 HG22 THR A 50 46.153 -10.675 4.354 1.00 0.00 H new ATOM 0 HG23 THR A 50 45.344 -11.887 3.331 1.00 0.00 H new ATOM 805 N ASN A 51 46.303 -9.113 -0.552 1.00 0.00 N ATOM 806 CA ASN A 51 46.903 -8.459 -1.714 1.00 0.00 C ATOM 807 C ASN A 51 46.280 -7.083 -2.050 1.00 0.00 C ATOM 808 O ASN A 51 46.936 -6.263 -2.696 1.00 0.00 O ATOM 809 CB ASN A 51 46.802 -9.441 -2.895 1.00 0.00 C ATOM 810 CG ASN A 51 47.718 -9.057 -4.044 1.00 0.00 C ATOM 811 OD1 ASN A 51 47.305 -8.483 -5.043 1.00 0.00 O ATOM 812 ND2 ASN A 51 48.988 -9.376 -3.943 1.00 0.00 N ATOM 0 H ASN A 51 45.768 -9.945 -0.801 1.00 0.00 H new ATOM 0 HA ASN A 51 47.944 -8.227 -1.489 1.00 0.00 H new ATOM 0 HB2 ASN A 51 47.054 -10.445 -2.553 1.00 0.00 H new ATOM 0 HB3 ASN A 51 45.772 -9.474 -3.250 1.00 0.00 H new ATOM 0 HD21 ASN A 51 49.633 -9.145 -4.698 1.00 0.00 H new ATOM 0 HD22 ASN A 51 49.329 -9.854 -3.109 1.00 0.00 H new ATOM 819 N GLY A 52 45.038 -6.818 -1.615 1.00 0.00 N ATOM 820 CA GLY A 52 44.306 -5.568 -1.874 1.00 0.00 C ATOM 821 C GLY A 52 43.976 -4.738 -0.626 1.00 0.00 C ATOM 822 O GLY A 52 44.039 -3.507 -0.694 1.00 0.00 O ATOM 0 H GLY A 52 44.501 -7.484 -1.059 1.00 0.00 H new ATOM 0 HA2 GLY A 52 44.896 -4.954 -2.555 1.00 0.00 H new ATOM 0 HA3 GLY A 52 43.375 -5.809 -2.388 1.00 0.00 H new ATOM 826 N GLY A 53 43.663 -5.372 0.513 1.00 0.00 N ATOM 827 CA GLY A 53 43.388 -4.685 1.788 1.00 0.00 C ATOM 828 C GLY A 53 42.204 -5.196 2.627 1.00 0.00 C ATOM 829 O GLY A 53 41.839 -4.521 3.593 1.00 0.00 O ATOM 0 H GLY A 53 43.592 -6.387 0.578 1.00 0.00 H new ATOM 0 HA2 GLY A 53 44.286 -4.743 2.403 1.00 0.00 H new ATOM 0 HA3 GLY A 53 43.217 -3.630 1.572 1.00 0.00 H new ATOM 833 N CYS A 54 41.589 -6.335 2.287 1.00 0.00 N ATOM 834 CA CYS A 54 40.444 -6.904 3.006 1.00 0.00 C ATOM 835 C CYS A 54 40.686 -7.083 4.522 1.00 0.00 C ATOM 836 O CYS A 54 41.682 -7.716 4.902 1.00 0.00 O ATOM 837 CB CYS A 54 40.175 -8.262 2.374 1.00 0.00 C ATOM 838 SG CYS A 54 38.641 -9.007 2.974 1.00 0.00 S ATOM 0 H CYS A 54 41.880 -6.898 1.488 1.00 0.00 H new ATOM 0 HA CYS A 54 39.602 -6.217 2.922 1.00 0.00 H new ATOM 0 HB2 CYS A 54 40.123 -8.152 1.291 1.00 0.00 H new ATOM 0 HB3 CYS A 54 41.009 -8.931 2.587 1.00 0.00 H new ATOM 843 N PRO A 55 39.812 -6.564 5.408 1.00 0.00 N ATOM 844 CA PRO A 55 39.993 -6.726 6.843 1.00 0.00 C ATOM 845 C PRO A 55 39.653 -8.144 7.318 1.00 0.00 C ATOM 846 O PRO A 55 40.220 -8.576 8.319 1.00 0.00 O ATOM 847 CB PRO A 55 39.063 -5.690 7.482 1.00 0.00 C ATOM 848 CG PRO A 55 37.903 -5.623 6.491 1.00 0.00 C ATOM 849 CD PRO A 55 38.602 -5.801 5.138 1.00 0.00 C ATOM 0 HA PRO A 55 41.035 -6.576 7.126 1.00 0.00 H new ATOM 0 HB2 PRO A 55 38.731 -6.000 8.473 1.00 0.00 H new ATOM 0 HB3 PRO A 55 39.553 -4.723 7.598 1.00 0.00 H new ATOM 0 HG2 PRO A 55 37.169 -6.408 6.674 1.00 0.00 H new ATOM 0 HG3 PRO A 55 37.374 -4.672 6.551 1.00 0.00 H new ATOM 0 HD2 PRO A 55 37.958 -6.327 4.433 1.00 0.00 H new ATOM 0 HD3 PRO A 55 38.841 -4.835 4.692 1.00 0.00 H new ATOM 857 N VAL A 56 38.771 -8.881 6.623 1.00 0.00 N ATOM 858 CA VAL A 56 38.403 -10.251 7.010 1.00 0.00 C ATOM 859 C VAL A 56 39.513 -11.218 6.618 1.00 0.00 C ATOM 860 O VAL A 56 40.083 -11.846 7.509 1.00 0.00 O ATOM 861 CB VAL A 56 37.064 -10.725 6.414 1.00 0.00 C ATOM 862 CG1 VAL A 56 36.689 -12.091 7.014 1.00 0.00 C ATOM 863 CG2 VAL A 56 35.894 -9.776 6.697 1.00 0.00 C ATOM 0 H VAL A 56 38.297 -8.547 5.784 1.00 0.00 H new ATOM 0 HA VAL A 56 38.272 -10.238 8.092 1.00 0.00 H new ATOM 0 HB VAL A 56 37.218 -10.769 5.336 1.00 0.00 H new ATOM 0 HG11 VAL A 56 35.741 -12.426 6.592 1.00 0.00 H new ATOM 0 HG12 VAL A 56 37.467 -12.817 6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 56 36.592 -11.999 8.096 1.00 0.00 H new ATOM 0 HG21 VAL A 56 34.985 -10.175 6.247 1.00 0.00 H new ATOM 0 HG22 VAL A 56 35.754 -9.682 7.774 1.00 0.00 H new ATOM 0 HG23 VAL A 56 36.109 -8.796 6.272 1.00 0.00 H new ATOM 873 N CYS A 57 39.859 -11.317 5.332 1.00 0.00 N ATOM 874 CA CYS A 57 40.910 -12.195 4.833 1.00 0.00 C ATOM 875 C CYS A 57 42.233 -12.032 5.593 1.00 0.00 C ATOM 876 O CYS A 57 42.794 -13.023 6.071 1.00 0.00 O ATOM 877 CB CYS A 57 41.078 -11.913 3.348 1.00 0.00 C ATOM 878 SG CYS A 57 39.629 -12.470 2.401 1.00 0.00 S ATOM 0 H CYS A 57 39.404 -10.776 4.597 1.00 0.00 H new ATOM 0 HA CYS A 57 40.618 -13.233 4.994 1.00 0.00 H new ATOM 0 HB2 CYS A 57 41.227 -10.844 3.193 1.00 0.00 H new ATOM 0 HB3 CYS A 57 41.972 -12.416 2.979 1.00 0.00 H new ATOM 883 N LYS A 58 42.720 -10.792 5.771 1.00 0.00 N ATOM 884 CA LYS A 58 43.949 -10.529 6.545 1.00 0.00 C ATOM 885 C LYS A 58 43.863 -11.101 7.971 1.00 0.00 C ATOM 886 O LYS A 58 44.870 -11.561 8.508 1.00 0.00 O ATOM 887 CB LYS A 58 44.262 -9.018 6.593 1.00 0.00 C ATOM 888 CG LYS A 58 44.796 -8.488 5.250 1.00 0.00 C ATOM 889 CD LYS A 58 45.037 -6.973 5.185 1.00 0.00 C ATOM 890 CE LYS A 58 46.146 -6.529 6.149 1.00 0.00 C ATOM 891 NZ LYS A 58 46.382 -5.061 6.076 1.00 0.00 N ATOM 0 H LYS A 58 42.282 -9.954 5.389 1.00 0.00 H new ATOM 0 HA LYS A 58 44.764 -11.038 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 58 43.359 -8.471 6.864 1.00 0.00 H new ATOM 0 HB3 LYS A 58 44.997 -8.826 7.375 1.00 0.00 H new ATOM 0 HG2 LYS A 58 45.733 -8.997 5.025 1.00 0.00 H new ATOM 0 HG3 LYS A 58 44.090 -8.760 4.466 1.00 0.00 H new ATOM 0 HD2 LYS A 58 45.306 -6.691 4.167 1.00 0.00 H new ATOM 0 HD3 LYS A 58 44.113 -6.448 5.427 1.00 0.00 H new ATOM 0 HE2 LYS A 58 45.874 -6.804 7.168 1.00 0.00 H new ATOM 0 HE3 LYS A 58 47.069 -7.058 5.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 47.137 -4.797 6.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 46.665 -4.803 5.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 45.508 -4.556 6.327 1.00 0.00 H new ATOM 905 N GLN A 59 42.672 -11.128 8.571 1.00 0.00 N ATOM 906 CA GLN A 59 42.445 -11.688 9.905 1.00 0.00 C ATOM 907 C GLN A 59 42.670 -13.206 9.936 1.00 0.00 C ATOM 908 O GLN A 59 43.392 -13.686 10.813 1.00 0.00 O ATOM 909 CB GLN A 59 41.034 -11.318 10.410 1.00 0.00 C ATOM 910 CG GLN A 59 41.052 -10.832 11.866 1.00 0.00 C ATOM 911 CD GLN A 59 41.648 -9.426 12.048 1.00 0.00 C ATOM 912 OE1 GLN A 59 42.402 -8.908 11.238 1.00 0.00 O ATOM 913 NE2 GLN A 59 41.341 -8.746 13.129 1.00 0.00 N ATOM 0 H GLN A 59 41.826 -10.757 8.139 1.00 0.00 H new ATOM 0 HA GLN A 59 43.179 -11.248 10.580 1.00 0.00 H new ATOM 0 HB2 GLN A 59 40.614 -10.539 9.773 1.00 0.00 H new ATOM 0 HB3 GLN A 59 40.380 -12.186 10.326 1.00 0.00 H new ATOM 0 HG2 GLN A 59 40.033 -10.836 12.252 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.624 -11.539 12.467 1.00 0.00 H new ATOM 0 HE21 GLN A 59 40.714 -9.150 13.825 1.00 0.00 H new ATOM 0 HE22 GLN A 59 41.729 -7.814 13.273 1.00 0.00 H new ATOM 922 N LEU A 60 42.114 -13.959 8.972 1.00 0.00 N ATOM 923 CA LEU A 60 42.338 -15.412 8.874 1.00 0.00 C ATOM 924 C LEU A 60 43.820 -15.703 8.682 1.00 0.00 C ATOM 925 O LEU A 60 44.373 -16.547 9.378 1.00 0.00 O ATOM 926 CB LEU A 60 41.653 -16.085 7.667 1.00 0.00 C ATOM 927 CG LEU A 60 40.130 -16.196 7.661 1.00 0.00 C ATOM 928 CD1 LEU A 60 39.505 -14.832 7.409 1.00 0.00 C ATOM 929 CD2 LEU A 60 39.723 -17.146 6.535 1.00 0.00 C ATOM 0 H LEU A 60 41.503 -13.584 8.246 1.00 0.00 H new ATOM 0 HA LEU A 60 41.923 -15.807 9.801 1.00 0.00 H new ATOM 0 HB2 LEU A 60 41.949 -15.539 6.771 1.00 0.00 H new ATOM 0 HB3 LEU A 60 42.059 -17.092 7.575 1.00 0.00 H new ATOM 0 HG LEU A 60 39.786 -16.569 8.626 1.00 0.00 H new ATOM 0 HD11 LEU A 60 38.419 -14.924 7.407 1.00 0.00 H new ATOM 0 HD12 LEU A 60 39.809 -14.141 8.196 1.00 0.00 H new ATOM 0 HD13 LEU A 60 39.839 -14.452 6.444 1.00 0.00 H new ATOM 0 HD21 LEU A 60 38.637 -17.240 6.513 1.00 0.00 H new ATOM 0 HD22 LEU A 60 40.073 -16.751 5.581 1.00 0.00 H new ATOM 0 HD23 LEU A 60 40.168 -18.126 6.707 1.00 0.00 H new ATOM 941 N ILE A 61 44.453 -15.033 7.715 1.00 0.00 N ATOM 942 CA ILE A 61 45.858 -15.280 7.377 1.00 0.00 C ATOM 943 C ILE A 61 46.764 -15.022 8.576 1.00 0.00 C ATOM 944 O ILE A 61 47.630 -15.848 8.822 1.00 0.00 O ATOM 945 CB ILE A 61 46.308 -14.501 6.127 1.00 0.00 C ATOM 946 CG1 ILE A 61 45.364 -14.732 4.931 1.00 0.00 C ATOM 947 CG2 ILE A 61 47.732 -14.898 5.677 1.00 0.00 C ATOM 948 CD1 ILE A 61 45.535 -16.092 4.271 1.00 0.00 C ATOM 0 H ILE A 61 44.011 -14.310 7.148 1.00 0.00 H new ATOM 0 HA ILE A 61 45.948 -16.335 7.120 1.00 0.00 H new ATOM 0 HB ILE A 61 46.289 -13.452 6.421 1.00 0.00 H new ATOM 0 HG12 ILE A 61 44.333 -14.629 5.268 1.00 0.00 H new ATOM 0 HG13 ILE A 61 45.536 -13.953 4.188 1.00 0.00 H new ATOM 0 HG21 ILE A 61 48.007 -14.324 4.792 1.00 0.00 H new ATOM 0 HG22 ILE A 61 48.439 -14.689 6.480 1.00 0.00 H new ATOM 0 HG23 ILE A 61 47.756 -15.962 5.441 1.00 0.00 H new ATOM 0 HD11 ILE A 61 44.838 -16.182 3.438 1.00 0.00 H new ATOM 0 HD12 ILE A 61 46.556 -16.192 3.902 1.00 0.00 H new ATOM 0 HD13 ILE A 61 45.334 -16.878 4.999 1.00 0.00 H new ATOM 960 N ALA A 62 46.561 -13.959 9.365 1.00 0.00 N ATOM 961 CA ALA A 62 47.359 -13.731 10.576 1.00 0.00 C ATOM 962 C ALA A 62 47.229 -14.939 11.526 1.00 0.00 C ATOM 963 O ALA A 62 48.223 -15.532 11.952 1.00 0.00 O ATOM 964 CB ALA A 62 46.905 -12.417 11.241 1.00 0.00 C ATOM 0 H ALA A 62 45.854 -13.246 9.187 1.00 0.00 H new ATOM 0 HA ALA A 62 48.414 -13.633 10.321 1.00 0.00 H new ATOM 0 HB1 ALA A 62 47.494 -12.242 12.141 1.00 0.00 H new ATOM 0 HB2 ALA A 62 47.049 -11.589 10.547 1.00 0.00 H new ATOM 0 HB3 ALA A 62 45.850 -12.489 11.506 1.00 0.00 H new ATOM 970 N LEU A 63 45.984 -15.339 11.798 1.00 0.00 N ATOM 971 CA LEU A 63 45.625 -16.476 12.650 1.00 0.00 C ATOM 972 C LEU A 63 46.242 -17.801 12.145 1.00 0.00 C ATOM 973 O LEU A 63 46.744 -18.602 12.935 1.00 0.00 O ATOM 974 CB LEU A 63 44.084 -16.489 12.725 1.00 0.00 C ATOM 975 CG LEU A 63 43.503 -17.022 14.045 1.00 0.00 C ATOM 976 CD1 LEU A 63 42.309 -16.159 14.461 1.00 0.00 C ATOM 977 CD2 LEU A 63 43.024 -18.463 13.904 1.00 0.00 C ATOM 0 H LEU A 63 45.167 -14.862 11.416 1.00 0.00 H new ATOM 0 HA LEU A 63 46.039 -16.372 13.653 1.00 0.00 H new ATOM 0 HB2 LEU A 63 43.719 -15.474 12.568 1.00 0.00 H new ATOM 0 HB3 LEU A 63 43.700 -17.096 11.905 1.00 0.00 H new ATOM 0 HG LEU A 63 44.293 -16.984 14.795 1.00 0.00 H new ATOM 0 HD11 LEU A 63 41.896 -16.536 15.397 1.00 0.00 H new ATOM 0 HD12 LEU A 63 42.635 -15.128 14.598 1.00 0.00 H new ATOM 0 HD13 LEU A 63 41.544 -16.198 13.685 1.00 0.00 H new ATOM 0 HD21 LEU A 63 42.620 -18.807 14.856 1.00 0.00 H new ATOM 0 HD22 LEU A 63 42.248 -18.515 13.140 1.00 0.00 H new ATOM 0 HD23 LEU A 63 43.861 -19.098 13.615 1.00 0.00 H new ATOM 989 N CYS A 64 46.258 -18.007 10.824 1.00 0.00 N ATOM 990 CA CYS A 64 46.857 -19.164 10.159 1.00 0.00 C ATOM 991 C CYS A 64 48.394 -19.101 10.161 1.00 0.00 C ATOM 992 O CYS A 64 49.014 -20.125 10.413 1.00 0.00 O ATOM 993 CB CYS A 64 46.322 -19.284 8.726 1.00 0.00 C ATOM 994 SG CYS A 64 44.536 -19.615 8.737 1.00 0.00 S ATOM 0 H CYS A 64 45.839 -17.348 10.167 1.00 0.00 H new ATOM 0 HA CYS A 64 46.573 -20.053 10.723 1.00 0.00 H new ATOM 0 HB2 CYS A 64 46.523 -18.363 8.178 1.00 0.00 H new ATOM 0 HB3 CYS A 64 46.843 -20.086 8.203 1.00 0.00 H new ATOM 0 HG CYS A 64 43.892 -18.515 8.995 1.00 0.00 H new ATOM 1000 N CYS A 65 49.027 -17.940 9.941 1.00 0.00 N ATOM 1001 CA CYS A 65 50.485 -17.754 10.001 1.00 0.00 C ATOM 1002 C CYS A 65 51.019 -18.154 11.384 1.00 0.00 C ATOM 1003 O CYS A 65 52.007 -18.879 11.489 1.00 0.00 O ATOM 1004 CB CYS A 65 50.842 -16.279 9.748 1.00 0.00 C ATOM 1005 SG CYS A 65 50.745 -15.788 8.005 1.00 0.00 S ATOM 0 H CYS A 65 48.527 -17.082 9.710 1.00 0.00 H new ATOM 0 HA CYS A 65 50.938 -18.384 9.235 1.00 0.00 H new ATOM 0 HB2 CYS A 65 50.171 -15.648 10.331 1.00 0.00 H new ATOM 0 HB3 CYS A 65 51.852 -16.092 10.112 1.00 0.00 H new ATOM 0 HG CYS A 65 50.419 -14.532 7.925 1.00 0.00 H new ATOM 1011 N TYR A 66 50.337 -17.702 12.442 1.00 0.00 N ATOM 1012 CA TYR A 66 50.663 -17.992 13.840 1.00 0.00 C ATOM 1013 C TYR A 66 50.716 -19.506 14.117 1.00 0.00 C ATOM 1014 O TYR A 66 51.625 -19.990 14.795 1.00 0.00 O ATOM 1015 CB TYR A 66 49.604 -17.303 14.711 1.00 0.00 C ATOM 1016 CG TYR A 66 50.016 -16.990 16.132 1.00 0.00 C ATOM 1017 CD1 TYR A 66 50.646 -15.762 16.406 1.00 0.00 C ATOM 1018 CD2 TYR A 66 49.676 -17.858 17.186 1.00 0.00 C ATOM 1019 CE1 TYR A 66 50.835 -15.348 17.735 1.00 0.00 C ATOM 1020 CE2 TYR A 66 49.897 -17.464 18.520 1.00 0.00 C ATOM 1021 CZ TYR A 66 50.459 -16.201 18.795 1.00 0.00 C ATOM 1022 OH TYR A 66 50.645 -15.812 20.079 1.00 0.00 O ATOM 0 H TYR A 66 49.516 -17.105 12.344 1.00 0.00 H new ATOM 0 HA TYR A 66 51.657 -17.612 14.074 1.00 0.00 H new ATOM 0 HB2 TYR A 66 49.312 -16.372 14.225 1.00 0.00 H new ATOM 0 HB3 TYR A 66 48.718 -17.938 14.742 1.00 0.00 H new ATOM 0 HD1 TYR A 66 50.985 -15.137 15.593 1.00 0.00 H new ATOM 0 HD2 TYR A 66 49.246 -18.825 16.972 1.00 0.00 H new ATOM 0 HE1 TYR A 66 51.266 -14.380 17.945 1.00 0.00 H new ATOM 0 HE2 TYR A 66 49.636 -18.128 19.331 1.00 0.00 H new ATOM 0 HH TYR A 66 50.331 -16.517 20.683 1.00 0.00 H new ATOM 1032 N HIS A 67 49.769 -20.260 13.546 1.00 0.00 N ATOM 1033 CA HIS A 67 49.713 -21.719 13.635 1.00 0.00 C ATOM 1034 C HIS A 67 50.752 -22.381 12.702 1.00 0.00 C ATOM 1035 O HIS A 67 51.580 -23.170 13.161 1.00 0.00 O ATOM 1036 CB HIS A 67 48.278 -22.175 13.313 1.00 0.00 C ATOM 1037 CG HIS A 67 48.156 -23.673 13.211 1.00 0.00 C ATOM 1038 ND1 HIS A 67 48.087 -24.578 14.248 1.00 0.00 N ATOM 1039 CD2 HIS A 67 48.294 -24.395 12.056 1.00 0.00 C ATOM 1040 CE1 HIS A 67 48.218 -25.813 13.730 1.00 0.00 C ATOM 1041 NE2 HIS A 67 48.362 -25.752 12.395 1.00 0.00 N ATOM 0 H HIS A 67 49.006 -19.862 12.999 1.00 0.00 H new ATOM 0 HA HIS A 67 49.969 -22.035 14.646 1.00 0.00 H new ATOM 0 HB2 HIS A 67 47.603 -21.811 14.087 1.00 0.00 H new ATOM 0 HB3 HIS A 67 47.959 -21.723 12.374 1.00 0.00 H new ATOM 0 HD1 HIS A 67 47.959 -24.352 15.234 1.00 0.00 H new ATOM 0 HD2 HIS A 67 48.342 -23.988 11.057 1.00 0.00 H new ATOM 0 HE1 HIS A 67 48.209 -26.726 14.307 1.00 0.00 H new ATOM 1049 N ALA A 68 50.749 -22.043 11.406 1.00 0.00 N ATOM 1050 CA ALA A 68 51.637 -22.584 10.376 1.00 0.00 C ATOM 1051 C ALA A 68 53.139 -22.443 10.690 1.00 0.00 C ATOM 1052 O ALA A 68 53.925 -23.311 10.303 1.00 0.00 O ATOM 1053 CB ALA A 68 51.264 -21.921 9.049 1.00 0.00 C ATOM 0 H ALA A 68 50.097 -21.353 11.033 1.00 0.00 H new ATOM 0 HA ALA A 68 51.487 -23.663 10.328 1.00 0.00 H new ATOM 0 HB1 ALA A 68 51.909 -22.303 8.258 1.00 0.00 H new ATOM 0 HB2 ALA A 68 50.224 -22.145 8.810 1.00 0.00 H new ATOM 0 HB3 ALA A 68 51.393 -20.842 9.133 1.00 0.00 H new ATOM 1059 N LYS A 69 53.546 -21.391 11.419 1.00 0.00 N ATOM 1060 CA LYS A 69 54.932 -21.192 11.883 1.00 0.00 C ATOM 1061 C LYS A 69 55.413 -22.347 12.776 1.00 0.00 C ATOM 1062 O LYS A 69 56.578 -22.742 12.693 1.00 0.00 O ATOM 1063 CB LYS A 69 55.032 -19.864 12.659 1.00 0.00 C ATOM 1064 CG LYS A 69 55.437 -18.678 11.774 1.00 0.00 C ATOM 1065 CD LYS A 69 55.609 -17.380 12.591 1.00 0.00 C ATOM 1066 CE LYS A 69 56.551 -16.391 11.884 1.00 0.00 C ATOM 1067 NZ LYS A 69 57.969 -16.847 11.887 1.00 0.00 N ATOM 0 H LYS A 69 52.914 -20.644 11.707 1.00 0.00 H new ATOM 0 HA LYS A 69 55.574 -21.164 11.003 1.00 0.00 H new ATOM 0 HB2 LYS A 69 54.071 -19.650 13.126 1.00 0.00 H new ATOM 0 HB3 LYS A 69 55.759 -19.974 13.463 1.00 0.00 H new ATOM 0 HG2 LYS A 69 56.370 -18.910 11.261 1.00 0.00 H new ATOM 0 HG3 LYS A 69 54.680 -18.525 11.005 1.00 0.00 H new ATOM 0 HD2 LYS A 69 54.636 -16.913 12.743 1.00 0.00 H new ATOM 0 HD3 LYS A 69 56.005 -17.620 13.578 1.00 0.00 H new ATOM 0 HE2 LYS A 69 56.220 -16.253 10.855 1.00 0.00 H new ATOM 0 HE3 LYS A 69 56.485 -15.419 12.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 58.592 -16.044 11.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 58.210 -17.227 12.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 58.096 -17.589 11.170 1.00 0.00 H new ATOM 1081 N HIS A 70 54.524 -22.883 13.618 1.00 0.00 N ATOM 1082 CA HIS A 70 54.791 -24.008 14.522 1.00 0.00 C ATOM 1083 C HIS A 70 54.483 -25.373 13.868 1.00 0.00 C ATOM 1084 O HIS A 70 55.160 -26.364 14.165 1.00 0.00 O ATOM 1085 CB HIS A 70 53.963 -23.800 15.804 1.00 0.00 C ATOM 1086 CG HIS A 70 54.364 -24.656 16.988 1.00 0.00 C ATOM 1087 ND1 HIS A 70 54.914 -25.919 16.957 1.00 0.00 N ATOM 1088 CD2 HIS A 70 54.230 -24.317 18.309 1.00 0.00 C ATOM 1089 CE1 HIS A 70 55.110 -26.331 18.221 1.00 0.00 C ATOM 1090 NE2 HIS A 70 54.707 -25.384 19.086 1.00 0.00 N ATOM 0 H HIS A 70 53.568 -22.535 13.692 1.00 0.00 H new ATOM 0 HA HIS A 70 55.854 -24.029 14.762 1.00 0.00 H new ATOM 0 HB2 HIS A 70 54.034 -22.752 16.095 1.00 0.00 H new ATOM 0 HB3 HIS A 70 52.916 -23.996 15.575 1.00 0.00 H new ATOM 0 HD1 HIS A 70 55.135 -26.452 16.116 1.00 0.00 H new ATOM 0 HD2 HIS A 70 53.827 -23.389 18.687 1.00 0.00 H new ATOM 0 HE1 HIS A 70 55.531 -27.285 18.502 1.00 0.00 H new ATOM 1098 N CYS A 71 53.465 -25.437 13.002 1.00 0.00 N ATOM 1099 CA CYS A 71 53.024 -26.663 12.330 1.00 0.00 C ATOM 1100 C CYS A 71 54.094 -27.274 11.397 1.00 0.00 C ATOM 1101 O CYS A 71 54.947 -26.576 10.837 1.00 0.00 O ATOM 1102 CB CYS A 71 51.717 -26.370 11.578 1.00 0.00 C ATOM 1103 SG CYS A 71 50.821 -27.910 11.190 1.00 0.00 S ATOM 0 H CYS A 71 52.913 -24.619 12.744 1.00 0.00 H new ATOM 0 HA CYS A 71 52.853 -27.422 13.093 1.00 0.00 H new ATOM 0 HB2 CYS A 71 51.084 -25.720 12.183 1.00 0.00 H new ATOM 0 HB3 CYS A 71 51.937 -25.832 10.656 1.00 0.00 H new ATOM 1108 N GLN A 72 54.016 -28.593 11.211 1.00 0.00 N ATOM 1109 CA GLN A 72 54.903 -29.399 10.359 1.00 0.00 C ATOM 1110 C GLN A 72 54.147 -30.478 9.548 1.00 0.00 C ATOM 1111 O GLN A 72 54.761 -31.202 8.762 1.00 0.00 O ATOM 1112 CB GLN A 72 56.004 -30.053 11.220 1.00 0.00 C ATOM 1113 CG GLN A 72 56.917 -29.046 11.939 1.00 0.00 C ATOM 1114 CD GLN A 72 58.043 -29.747 12.696 1.00 0.00 C ATOM 1115 OE1 GLN A 72 57.837 -30.413 13.704 1.00 0.00 O ATOM 1116 NE2 GLN A 72 59.277 -29.637 12.249 1.00 0.00 N ATOM 0 H GLN A 72 53.301 -29.158 11.670 1.00 0.00 H new ATOM 0 HA GLN A 72 55.351 -28.720 9.633 1.00 0.00 H new ATOM 0 HB2 GLN A 72 55.535 -30.697 11.963 1.00 0.00 H new ATOM 0 HB3 GLN A 72 56.616 -30.693 10.584 1.00 0.00 H new ATOM 0 HG2 GLN A 72 57.343 -28.356 11.211 1.00 0.00 H new ATOM 0 HG3 GLN A 72 56.326 -28.451 12.635 1.00 0.00 H new ATOM 0 HE21 GLN A 72 59.469 -29.087 11.412 1.00 0.00 H new ATOM 0 HE22 GLN A 72 60.041 -30.102 12.740 1.00 0.00 H new ATOM 1125 N GLU A 73 52.825 -30.602 9.713 1.00 0.00 N ATOM 1126 CA GLU A 73 51.989 -31.572 8.995 1.00 0.00 C ATOM 1127 C GLU A 73 51.728 -31.132 7.541 1.00 0.00 C ATOM 1128 O GLU A 73 51.751 -29.940 7.223 1.00 0.00 O ATOM 1129 CB GLU A 73 50.676 -31.746 9.784 1.00 0.00 C ATOM 1130 CG GLU A 73 49.740 -32.878 9.346 1.00 0.00 C ATOM 1131 CD GLU A 73 50.447 -34.238 9.263 1.00 0.00 C ATOM 1132 OE1 GLU A 73 51.083 -34.498 8.214 1.00 0.00 O ATOM 1133 OE2 GLU A 73 50.349 -35.062 10.200 1.00 0.00 O ATOM 0 H GLU A 73 52.296 -30.020 10.362 1.00 0.00 H new ATOM 0 HA GLU A 73 52.507 -32.529 8.929 1.00 0.00 H new ATOM 0 HB2 GLU A 73 50.930 -31.904 10.832 1.00 0.00 H new ATOM 0 HB3 GLU A 73 50.122 -30.809 9.728 1.00 0.00 H new ATOM 0 HG2 GLU A 73 48.909 -32.948 10.048 1.00 0.00 H new ATOM 0 HG3 GLU A 73 49.315 -32.635 8.372 1.00 0.00 H new ATOM 1140 N ASN A 74 51.452 -32.096 6.659 1.00 0.00 N ATOM 1141 CA ASN A 74 51.200 -31.891 5.225 1.00 0.00 C ATOM 1142 C ASN A 74 49.718 -32.106 4.832 1.00 0.00 C ATOM 1143 O ASN A 74 49.306 -31.819 3.708 1.00 0.00 O ATOM 1144 CB ASN A 74 52.183 -32.817 4.486 1.00 0.00 C ATOM 1145 CG ASN A 74 52.016 -32.813 2.977 1.00 0.00 C ATOM 1146 OD1 ASN A 74 52.299 -31.843 2.287 1.00 0.00 O ATOM 1147 ND2 ASN A 74 51.561 -33.915 2.422 1.00 0.00 N ATOM 0 H ASN A 74 51.395 -33.077 6.931 1.00 0.00 H new ATOM 0 HA ASN A 74 51.374 -30.853 4.940 1.00 0.00 H new ATOM 0 HB2 ASN A 74 53.202 -32.517 4.730 1.00 0.00 H new ATOM 0 HB3 ASN A 74 52.054 -33.835 4.853 1.00 0.00 H new ATOM 0 HD21 ASN A 74 51.442 -33.965 1.410 1.00 0.00 H new ATOM 0 HD22 ASN A 74 51.327 -34.720 3.003 1.00 0.00 H new ATOM 1154 N LYS A 75 48.919 -32.607 5.781 1.00 0.00 N ATOM 1155 CA LYS A 75 47.490 -32.951 5.676 1.00 0.00 C ATOM 1156 C LYS A 75 46.595 -32.193 6.680 1.00 0.00 C ATOM 1157 O LYS A 75 45.470 -32.619 6.953 1.00 0.00 O ATOM 1158 CB LYS A 75 47.348 -34.481 5.834 1.00 0.00 C ATOM 1159 CG LYS A 75 48.283 -35.297 4.918 1.00 0.00 C ATOM 1160 CD LYS A 75 49.548 -35.865 5.581 1.00 0.00 C ATOM 1161 CE LYS A 75 49.267 -36.852 6.723 1.00 0.00 C ATOM 1162 NZ LYS A 75 50.506 -37.136 7.490 1.00 0.00 N ATOM 0 H LYS A 75 49.279 -32.799 6.716 1.00 0.00 H new ATOM 0 HA LYS A 75 47.135 -32.634 4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 75 47.549 -34.749 6.871 1.00 0.00 H new ATOM 0 HB3 LYS A 75 46.316 -34.763 5.626 1.00 0.00 H new ATOM 0 HG2 LYS A 75 47.714 -36.126 4.497 1.00 0.00 H new ATOM 0 HG3 LYS A 75 48.587 -34.663 4.085 1.00 0.00 H new ATOM 0 HD2 LYS A 75 50.150 -36.365 4.822 1.00 0.00 H new ATOM 0 HD3 LYS A 75 50.145 -35.039 5.967 1.00 0.00 H new ATOM 0 HE2 LYS A 75 48.508 -36.439 7.388 1.00 0.00 H new ATOM 0 HE3 LYS A 75 48.864 -37.780 6.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 50.281 -37.752 8.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 51.195 -37.612 6.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 50.911 -36.244 7.837 1.00 0.00 H new ATOM 1176 N CYS A 76 47.103 -31.092 7.243 1.00 0.00 N ATOM 1177 CA CYS A 76 46.428 -30.232 8.222 1.00 0.00 C ATOM 1178 C CYS A 76 45.044 -29.760 7.677 1.00 0.00 C ATOM 1179 O CYS A 76 44.940 -29.452 6.481 1.00 0.00 O ATOM 1180 CB CYS A 76 47.414 -29.084 8.535 1.00 0.00 C ATOM 1181 SG CYS A 76 47.244 -28.428 10.225 1.00 0.00 S ATOM 0 H CYS A 76 48.041 -30.760 7.018 1.00 0.00 H new ATOM 0 HA CYS A 76 46.188 -30.755 9.148 1.00 0.00 H new ATOM 0 HB2 CYS A 76 48.434 -29.441 8.393 1.00 0.00 H new ATOM 0 HB3 CYS A 76 47.257 -28.275 7.821 1.00 0.00 H new ATOM 1186 N PRO A 77 43.956 -29.726 8.478 1.00 0.00 N ATOM 1187 CA PRO A 77 42.613 -29.394 7.986 1.00 0.00 C ATOM 1188 C PRO A 77 42.416 -27.939 7.524 1.00 0.00 C ATOM 1189 O PRO A 77 41.562 -27.683 6.672 1.00 0.00 O ATOM 1190 CB PRO A 77 41.660 -29.746 9.133 1.00 0.00 C ATOM 1191 CG PRO A 77 42.533 -29.619 10.380 1.00 0.00 C ATOM 1192 CD PRO A 77 43.902 -30.082 9.887 1.00 0.00 C ATOM 0 HA PRO A 77 42.422 -29.963 7.076 1.00 0.00 H new ATOM 0 HB2 PRO A 77 40.809 -29.066 9.169 1.00 0.00 H new ATOM 0 HB3 PRO A 77 41.259 -30.754 9.026 1.00 0.00 H new ATOM 0 HG2 PRO A 77 42.562 -28.594 10.750 1.00 0.00 H new ATOM 0 HG3 PRO A 77 42.165 -30.242 11.196 1.00 0.00 H new ATOM 0 HD2 PRO A 77 44.703 -29.596 10.444 1.00 0.00 H new ATOM 0 HD3 PRO A 77 44.024 -31.156 10.024 1.00 0.00 H new ATOM 1200 N VAL A 78 43.183 -26.982 8.058 1.00 0.00 N ATOM 1201 CA VAL A 78 43.104 -25.556 7.688 1.00 0.00 C ATOM 1202 C VAL A 78 43.605 -25.369 6.243 1.00 0.00 C ATOM 1203 O VAL A 78 44.706 -25.836 5.932 1.00 0.00 O ATOM 1204 CB VAL A 78 43.936 -24.711 8.672 1.00 0.00 C ATOM 1205 CG1 VAL A 78 43.861 -23.212 8.364 1.00 0.00 C ATOM 1206 CG2 VAL A 78 43.446 -24.896 10.117 1.00 0.00 C ATOM 0 H VAL A 78 43.888 -27.174 8.770 1.00 0.00 H new ATOM 0 HA VAL A 78 42.068 -25.221 7.743 1.00 0.00 H new ATOM 0 HB VAL A 78 44.962 -25.061 8.558 1.00 0.00 H new ATOM 0 HG11 VAL A 78 44.464 -22.662 9.086 1.00 0.00 H new ATOM 0 HG12 VAL A 78 44.240 -23.028 7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 78 42.825 -22.879 8.428 1.00 0.00 H new ATOM 0 HG21 VAL A 78 44.052 -24.287 10.788 1.00 0.00 H new ATOM 0 HG22 VAL A 78 42.403 -24.587 10.190 1.00 0.00 H new ATOM 0 HG23 VAL A 78 43.534 -25.945 10.400 1.00 0.00 H new ATOM 1216 N PRO A 79 42.859 -24.697 5.337 1.00 0.00 N ATOM 1217 CA PRO A 79 43.284 -24.550 3.940 1.00 0.00 C ATOM 1218 C PRO A 79 44.547 -23.691 3.758 1.00 0.00 C ATOM 1219 O PRO A 79 45.307 -23.891 2.807 1.00 0.00 O ATOM 1220 CB PRO A 79 42.077 -23.953 3.206 1.00 0.00 C ATOM 1221 CG PRO A 79 41.321 -23.200 4.299 1.00 0.00 C ATOM 1222 CD PRO A 79 41.558 -24.063 5.540 1.00 0.00 C ATOM 0 HA PRO A 79 43.576 -25.519 3.534 1.00 0.00 H new ATOM 0 HB2 PRO A 79 42.388 -23.286 2.402 1.00 0.00 H new ATOM 0 HB3 PRO A 79 41.459 -24.729 2.755 1.00 0.00 H new ATOM 0 HG2 PRO A 79 41.705 -22.189 4.432 1.00 0.00 H new ATOM 0 HG3 PRO A 79 40.260 -23.110 4.067 1.00 0.00 H new ATOM 0 HD2 PRO A 79 41.555 -23.456 6.445 1.00 0.00 H new ATOM 0 HD3 PRO A 79 40.772 -24.810 5.654 1.00 0.00 H new ATOM 1230 N PHE A 80 44.784 -22.734 4.660 1.00 0.00 N ATOM 1231 CA PHE A 80 45.931 -21.828 4.588 1.00 0.00 C ATOM 1232 C PHE A 80 47.200 -22.296 5.295 1.00 0.00 C ATOM 1233 O PHE A 80 48.280 -21.871 4.894 1.00 0.00 O ATOM 1234 CB PHE A 80 45.515 -20.441 5.081 1.00 0.00 C ATOM 1235 CG PHE A 80 45.046 -19.612 3.917 1.00 0.00 C ATOM 1236 CD1 PHE A 80 45.997 -19.133 2.998 1.00 0.00 C ATOM 1237 CD2 PHE A 80 43.672 -19.438 3.680 1.00 0.00 C ATOM 1238 CE1 PHE A 80 45.568 -18.495 1.826 1.00 0.00 C ATOM 1239 CE2 PHE A 80 43.244 -18.777 2.516 1.00 0.00 C ATOM 1240 CZ PHE A 80 44.191 -18.313 1.584 1.00 0.00 C ATOM 0 H PHE A 80 44.181 -22.566 5.465 1.00 0.00 H new ATOM 0 HA PHE A 80 46.214 -21.804 3.536 1.00 0.00 H new ATOM 0 HB2 PHE A 80 44.720 -20.530 5.821 1.00 0.00 H new ATOM 0 HB3 PHE A 80 46.355 -19.952 5.574 1.00 0.00 H new ATOM 0 HD1 PHE A 80 47.052 -19.256 3.194 1.00 0.00 H new ATOM 0 HD2 PHE A 80 42.948 -19.811 4.389 1.00 0.00 H new ATOM 0 HE1 PHE A 80 46.293 -18.142 1.107 1.00 0.00 H new ATOM 0 HE2 PHE A 80 42.190 -18.625 2.337 1.00 0.00 H new ATOM 0 HZ PHE A 80 43.863 -17.817 0.683 1.00 0.00 H new ATOM 1250 N CYS A 81 47.102 -23.160 6.305 1.00 0.00 N ATOM 1251 CA CYS A 81 48.255 -23.664 7.051 1.00 0.00 C ATOM 1252 C CYS A 81 49.361 -24.218 6.123 1.00 0.00 C ATOM 1253 O CYS A 81 50.514 -23.773 6.174 1.00 0.00 O ATOM 1254 CB CYS A 81 47.719 -24.689 8.056 1.00 0.00 C ATOM 1255 SG CYS A 81 49.040 -25.503 8.985 1.00 0.00 S ATOM 0 H CYS A 81 46.211 -23.534 6.632 1.00 0.00 H new ATOM 0 HA CYS A 81 48.755 -22.857 7.588 1.00 0.00 H new ATOM 0 HB2 CYS A 81 47.043 -24.192 8.752 1.00 0.00 H new ATOM 0 HB3 CYS A 81 47.135 -25.441 7.526 1.00 0.00 H new ATOM 1260 N LEU A 82 48.994 -25.130 5.210 1.00 0.00 N ATOM 1261 CA LEU A 82 49.923 -25.700 4.222 1.00 0.00 C ATOM 1262 C LEU A 82 50.476 -24.620 3.279 1.00 0.00 C ATOM 1263 O LEU A 82 51.690 -24.513 3.095 1.00 0.00 O ATOM 1264 CB LEU A 82 49.258 -26.822 3.394 1.00 0.00 C ATOM 1265 CG LEU A 82 48.746 -28.077 4.130 1.00 0.00 C ATOM 1266 CD1 LEU A 82 49.632 -28.506 5.296 1.00 0.00 C ATOM 1267 CD2 LEU A 82 47.318 -27.919 4.647 1.00 0.00 C ATOM 0 H LEU A 82 48.044 -25.493 5.136 1.00 0.00 H new ATOM 0 HA LEU A 82 50.751 -26.129 4.786 1.00 0.00 H new ATOM 0 HB2 LEU A 82 48.415 -26.384 2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 82 49.976 -27.149 2.642 1.00 0.00 H new ATOM 0 HG LEU A 82 48.774 -28.854 3.366 1.00 0.00 H new ATOM 0 HD11 LEU A 82 49.210 -29.394 5.766 1.00 0.00 H new ATOM 0 HD12 LEU A 82 50.633 -28.731 4.929 1.00 0.00 H new ATOM 0 HD13 LEU A 82 49.686 -27.700 6.028 1.00 0.00 H new ATOM 0 HD21 LEU A 82 47.012 -28.833 5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 82 47.274 -27.083 5.345 1.00 0.00 H new ATOM 0 HD23 LEU A 82 46.647 -27.728 3.810 1.00 0.00 H new ATOM 1279 N ASN A 83 49.587 -23.799 2.707 1.00 0.00 N ATOM 1280 CA ASN A 83 49.947 -22.708 1.798 1.00 0.00 C ATOM 1281 C ASN A 83 50.945 -21.722 2.426 1.00 0.00 C ATOM 1282 O ASN A 83 51.851 -21.256 1.738 1.00 0.00 O ATOM 1283 CB ASN A 83 48.668 -21.995 1.321 1.00 0.00 C ATOM 1284 CG ASN A 83 47.993 -22.745 0.189 1.00 0.00 C ATOM 1285 OD1 ASN A 83 48.472 -22.747 -0.936 1.00 0.00 O ATOM 1286 ND2 ASN A 83 46.881 -23.407 0.421 1.00 0.00 N ATOM 0 H ASN A 83 48.582 -23.877 2.866 1.00 0.00 H new ATOM 0 HA ASN A 83 50.458 -23.139 0.937 1.00 0.00 H new ATOM 0 HB2 ASN A 83 47.974 -21.896 2.156 1.00 0.00 H new ATOM 0 HB3 ASN A 83 48.916 -20.986 0.991 1.00 0.00 H new ATOM 0 HD21 ASN A 83 46.424 -23.917 -0.335 1.00 0.00 H new ATOM 0 HD22 ASN A 83 46.475 -23.410 1.357 1.00 0.00 H new ATOM 1293 N ILE A 84 50.803 -21.407 3.718 1.00 0.00 N ATOM 1294 CA ILE A 84 51.697 -20.493 4.424 1.00 0.00 C ATOM 1295 C ILE A 84 53.011 -21.179 4.804 1.00 0.00 C ATOM 1296 O ILE A 84 54.064 -20.665 4.425 1.00 0.00 O ATOM 1297 CB ILE A 84 50.974 -19.867 5.637 1.00 0.00 C ATOM 1298 CG1 ILE A 84 49.787 -19.003 5.159 1.00 0.00 C ATOM 1299 CG2 ILE A 84 51.924 -19.018 6.506 1.00 0.00 C ATOM 1300 CD1 ILE A 84 48.780 -18.769 6.279 1.00 0.00 C ATOM 0 H ILE A 84 50.058 -21.784 4.304 1.00 0.00 H new ATOM 0 HA ILE A 84 51.967 -19.677 3.753 1.00 0.00 H new ATOM 0 HB ILE A 84 50.607 -20.687 6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 84 50.157 -18.045 4.795 1.00 0.00 H new ATOM 0 HG13 ILE A 84 49.293 -19.494 4.321 1.00 0.00 H new ATOM 0 HG21 ILE A 84 51.371 -18.598 7.346 1.00 0.00 H new ATOM 0 HG22 ILE A 84 52.733 -19.645 6.881 1.00 0.00 H new ATOM 0 HG23 ILE A 84 52.341 -18.209 5.906 1.00 0.00 H new ATOM 0 HD11 ILE A 84 47.958 -18.157 5.907 1.00 0.00 H new ATOM 0 HD12 ILE A 84 48.392 -19.727 6.625 1.00 0.00 H new ATOM 0 HD13 ILE A 84 49.269 -18.255 7.107 1.00 0.00 H new ATOM 1312 N LYS A 85 53.004 -22.333 5.493 1.00 0.00 N ATOM 1313 CA LYS A 85 54.257 -23.001 5.913 1.00 0.00 C ATOM 1314 C LYS A 85 55.197 -23.307 4.744 1.00 0.00 C ATOM 1315 O LYS A 85 56.405 -23.149 4.882 1.00 0.00 O ATOM 1316 CB LYS A 85 53.994 -24.219 6.826 1.00 0.00 C ATOM 1317 CG LYS A 85 53.683 -25.540 6.100 1.00 0.00 C ATOM 1318 CD LYS A 85 53.211 -26.658 7.044 1.00 0.00 C ATOM 1319 CE LYS A 85 51.828 -26.309 7.592 1.00 0.00 C ATOM 1320 NZ LYS A 85 51.193 -27.400 8.347 1.00 0.00 N ATOM 0 H LYS A 85 52.154 -22.823 5.771 1.00 0.00 H new ATOM 0 HA LYS A 85 54.797 -22.279 6.526 1.00 0.00 H new ATOM 0 HB2 LYS A 85 54.868 -24.371 7.460 1.00 0.00 H new ATOM 0 HB3 LYS A 85 53.159 -23.982 7.485 1.00 0.00 H new ATOM 0 HG2 LYS A 85 52.915 -25.361 5.348 1.00 0.00 H new ATOM 0 HG3 LYS A 85 54.575 -25.874 5.571 1.00 0.00 H new ATOM 0 HD2 LYS A 85 53.174 -27.608 6.511 1.00 0.00 H new ATOM 0 HD3 LYS A 85 53.919 -26.780 7.864 1.00 0.00 H new ATOM 0 HE2 LYS A 85 51.914 -25.435 8.238 1.00 0.00 H new ATOM 0 HE3 LYS A 85 51.179 -26.029 6.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 50.201 -27.156 8.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 51.232 -28.277 7.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 51.697 -27.539 9.246 1.00 0.00 H new ATOM 1334 N HIS A 86 54.664 -23.667 3.574 1.00 0.00 N ATOM 1335 CA HIS A 86 55.460 -23.919 2.366 1.00 0.00 C ATOM 1336 C HIS A 86 56.147 -22.657 1.799 1.00 0.00 C ATOM 1337 O HIS A 86 57.172 -22.771 1.121 1.00 0.00 O ATOM 1338 CB HIS A 86 54.552 -24.543 1.297 1.00 0.00 C ATOM 1339 CG HIS A 86 54.062 -25.948 1.581 1.00 0.00 C ATOM 1340 ND1 HIS A 86 53.199 -26.669 0.784 1.00 0.00 N ATOM 1341 CD2 HIS A 86 54.388 -26.757 2.638 1.00 0.00 C ATOM 1342 CE1 HIS A 86 53.010 -27.876 1.346 1.00 0.00 C ATOM 1343 NE2 HIS A 86 53.723 -27.979 2.481 1.00 0.00 N ATOM 0 H HIS A 86 53.661 -23.793 3.435 1.00 0.00 H new ATOM 0 HA HIS A 86 56.264 -24.599 2.647 1.00 0.00 H new ATOM 0 HB2 HIS A 86 53.684 -23.897 1.163 1.00 0.00 H new ATOM 0 HB3 HIS A 86 55.092 -24.552 0.350 1.00 0.00 H new ATOM 0 HD2 HIS A 86 55.046 -26.496 3.454 1.00 0.00 H new ATOM 0 HE1 HIS A 86 52.376 -28.652 0.943 1.00 0.00 H new ATOM 0 HE2 HIS A 86 53.770 -28.786 3.103 1.00 0.00 H new ATOM 1351 N LYS A 87 55.633 -21.457 2.101 1.00 0.00 N ATOM 1352 CA LYS A 87 56.262 -20.171 1.742 1.00 0.00 C ATOM 1353 C LYS A 87 57.208 -19.709 2.856 1.00 0.00 C ATOM 1354 O LYS A 87 58.255 -19.134 2.565 1.00 0.00 O ATOM 1355 CB LYS A 87 55.197 -19.102 1.452 1.00 0.00 C ATOM 1356 CG LYS A 87 54.341 -19.463 0.228 1.00 0.00 C ATOM 1357 CD LYS A 87 53.333 -18.351 -0.114 1.00 0.00 C ATOM 1358 CE LYS A 87 52.072 -18.883 -0.811 1.00 0.00 C ATOM 1359 NZ LYS A 87 52.371 -19.648 -2.050 1.00 0.00 N ATOM 0 H LYS A 87 54.755 -21.347 2.609 1.00 0.00 H new ATOM 0 HA LYS A 87 56.846 -20.317 0.833 1.00 0.00 H new ATOM 0 HB2 LYS A 87 54.553 -18.985 2.324 1.00 0.00 H new ATOM 0 HB3 LYS A 87 55.683 -18.141 1.284 1.00 0.00 H new ATOM 0 HG2 LYS A 87 54.990 -19.641 -0.629 1.00 0.00 H new ATOM 0 HG3 LYS A 87 53.805 -20.392 0.421 1.00 0.00 H new ATOM 0 HD2 LYS A 87 53.046 -17.834 0.801 1.00 0.00 H new ATOM 0 HD3 LYS A 87 53.815 -17.615 -0.758 1.00 0.00 H new ATOM 0 HE2 LYS A 87 51.524 -19.523 -0.119 1.00 0.00 H new ATOM 0 HE3 LYS A 87 51.419 -18.046 -1.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 51.507 -20.122 -2.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 52.714 -18.997 -2.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 53.102 -20.360 -1.850 1.00 0.00 H new ATOM 1373 N LEU A 88 56.870 -19.978 4.123 1.00 0.00 N ATOM 1374 CA LEU A 88 57.709 -19.603 5.273 1.00 0.00 C ATOM 1375 C LEU A 88 58.990 -20.451 5.356 1.00 0.00 C ATOM 1376 O LEU A 88 60.061 -19.921 5.647 1.00 0.00 O ATOM 1377 CB LEU A 88 56.936 -19.695 6.604 1.00 0.00 C ATOM 1378 CG LEU A 88 55.606 -18.919 6.739 1.00 0.00 C ATOM 1379 CD1 LEU A 88 55.385 -18.521 8.199 1.00 0.00 C ATOM 1380 CD2 LEU A 88 55.467 -17.678 5.844 1.00 0.00 C ATOM 0 H LEU A 88 56.010 -20.461 4.382 1.00 0.00 H new ATOM 0 HA LEU A 88 57.995 -18.564 5.110 1.00 0.00 H new ATOM 0 HB2 LEU A 88 56.726 -20.748 6.794 1.00 0.00 H new ATOM 0 HB3 LEU A 88 57.601 -19.354 7.398 1.00 0.00 H new ATOM 0 HG LEU A 88 54.840 -19.612 6.390 1.00 0.00 H new ATOM 0 HD11 LEU A 88 54.446 -17.974 8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 88 55.344 -19.417 8.818 1.00 0.00 H new ATOM 0 HD13 LEU A 88 56.207 -17.887 8.532 1.00 0.00 H new ATOM 0 HD21 LEU A 88 54.498 -17.210 6.019 1.00 0.00 H new ATOM 0 HD22 LEU A 88 56.260 -16.969 6.080 1.00 0.00 H new ATOM 0 HD23 LEU A 88 55.544 -17.974 4.798 1.00 0.00 H new ATOM 1392 N ARG A 89 58.903 -21.761 5.070 1.00 0.00 N ATOM 1393 CA ARG A 89 60.033 -22.718 5.079 1.00 0.00 C ATOM 1394 C ARG A 89 61.256 -22.266 4.275 1.00 0.00 C ATOM 1395 O ARG A 89 62.388 -22.566 4.649 1.00 0.00 O ATOM 1396 CB ARG A 89 59.568 -24.112 4.735 1.00 0.00 C ATOM 1397 CG ARG A 89 59.286 -24.391 3.268 1.00 0.00 C ATOM 1398 CD ARG A 89 58.835 -25.839 3.317 1.00 0.00 C ATOM 1399 NE ARG A 89 58.380 -26.338 2.004 1.00 0.00 N ATOM 1400 CZ ARG A 89 57.681 -27.437 1.779 1.00 0.00 C ATOM 1401 NH1 ARG A 89 57.366 -28.265 2.734 1.00 0.00 N ATOM 1402 NH2 ARG A 89 57.269 -27.725 0.579 1.00 0.00 N ATOM 0 H ARG A 89 58.018 -22.201 4.818 1.00 0.00 H new ATOM 0 HA ARG A 89 60.402 -22.742 6.104 1.00 0.00 H new ATOM 0 HB2 ARG A 89 60.325 -24.818 5.077 1.00 0.00 H new ATOM 0 HB3 ARG A 89 58.660 -24.318 5.302 1.00 0.00 H new ATOM 0 HG2 ARG A 89 58.514 -23.734 2.866 1.00 0.00 H new ATOM 0 HG3 ARG A 89 60.172 -24.258 2.647 1.00 0.00 H new ATOM 0 HD2 ARG A 89 59.658 -26.460 3.672 1.00 0.00 H new ATOM 0 HD3 ARG A 89 58.025 -25.939 4.040 1.00 0.00 H new ATOM 0 HE ARG A 89 58.630 -25.778 1.189 1.00 0.00 H new ATOM 0 HH11 ARG A 89 57.660 -28.074 3.692 1.00 0.00 H new ATOM 0 HH12 ARG A 89 56.825 -29.104 2.524 1.00 0.00 H new ATOM 0 HH21 ARG A 89 57.485 -27.100 -0.198 1.00 0.00 H new ATOM 0 HH22 ARG A 89 56.730 -28.575 0.415 1.00 0.00 H new ATOM 1416 N GLN A 90 61.012 -21.478 3.227 1.00 0.00 N ATOM 1417 CA GLN A 90 62.013 -20.843 2.354 1.00 0.00 C ATOM 1418 C GLN A 90 62.954 -19.866 3.101 1.00 0.00 C ATOM 1419 O GLN A 90 63.968 -19.438 2.547 1.00 0.00 O ATOM 1420 CB GLN A 90 61.303 -20.088 1.208 1.00 0.00 C ATOM 1421 CG GLN A 90 60.186 -20.855 0.471 1.00 0.00 C ATOM 1422 CD GLN A 90 60.618 -22.169 -0.174 1.00 0.00 C ATOM 1423 OE1 GLN A 90 61.741 -22.351 -0.625 1.00 0.00 O ATOM 1424 NE2 GLN A 90 59.734 -23.144 -0.242 1.00 0.00 N ATOM 0 H GLN A 90 60.059 -21.250 2.945 1.00 0.00 H new ATOM 0 HA GLN A 90 62.635 -21.648 1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 90 60.877 -19.171 1.615 1.00 0.00 H new ATOM 0 HB3 GLN A 90 62.055 -19.792 0.476 1.00 0.00 H new ATOM 0 HG2 GLN A 90 59.382 -21.062 1.177 1.00 0.00 H new ATOM 0 HG3 GLN A 90 59.772 -20.208 -0.302 1.00 0.00 H new ATOM 0 HE21 GLN A 90 58.794 -23.007 0.130 1.00 0.00 H new ATOM 0 HE22 GLN A 90 59.990 -24.036 -0.666 1.00 0.00 H new ATOM 1433 N GLN A 91 62.623 -19.485 4.341 1.00 0.00 N ATOM 1434 CA GLN A 91 63.377 -18.561 5.207 1.00 0.00 C ATOM 1435 C GLN A 91 63.757 -19.177 6.574 1.00 0.00 C ATOM 1436 O GLN A 91 64.508 -18.567 7.338 1.00 0.00 O ATOM 1437 CB GLN A 91 62.539 -17.288 5.419 1.00 0.00 C ATOM 1438 CG GLN A 91 62.154 -16.516 4.146 1.00 0.00 C ATOM 1439 CD GLN A 91 63.350 -15.816 3.498 1.00 0.00 C ATOM 1440 OE1 GLN A 91 63.567 -14.621 3.654 1.00 0.00 O ATOM 1441 NE2 GLN A 91 64.186 -16.522 2.766 1.00 0.00 N ATOM 0 H GLN A 91 61.777 -19.830 4.794 1.00 0.00 H new ATOM 0 HA GLN A 91 64.316 -18.332 4.704 1.00 0.00 H new ATOM 0 HB2 GLN A 91 61.624 -17.562 5.945 1.00 0.00 H new ATOM 0 HB3 GLN A 91 63.094 -16.616 6.074 1.00 0.00 H new ATOM 0 HG2 GLN A 91 61.709 -17.205 3.428 1.00 0.00 H new ATOM 0 HG3 GLN A 91 61.393 -15.775 4.391 1.00 0.00 H new ATOM 0 HE21 GLN A 91 64.023 -17.519 2.624 1.00 0.00 H new ATOM 0 HE22 GLN A 91 64.997 -16.072 2.341 1.00 0.00 H new ATOM 1450 N GLN A 92 63.265 -20.384 6.879 1.00 0.00 N ATOM 1451 CA GLN A 92 63.538 -21.137 8.114 1.00 0.00 C ATOM 1452 C GLN A 92 63.675 -22.642 7.825 1.00 0.00 C ATOM 1453 O GLN A 92 63.777 -23.469 8.741 1.00 0.00 O ATOM 1454 CB GLN A 92 62.473 -20.824 9.187 1.00 0.00 C ATOM 1455 CG GLN A 92 61.040 -21.249 8.819 1.00 0.00 C ATOM 1456 CD GLN A 92 60.065 -21.028 9.975 1.00 0.00 C ATOM 1457 OE1 GLN A 92 59.359 -20.031 10.060 1.00 0.00 O ATOM 1458 NE2 GLN A 92 59.997 -21.946 10.916 1.00 0.00 N ATOM 0 H GLN A 92 62.640 -20.885 6.248 1.00 0.00 H new ATOM 0 HA GLN A 92 64.497 -20.815 8.519 1.00 0.00 H new ATOM 0 HB2 GLN A 92 62.757 -21.320 10.115 1.00 0.00 H new ATOM 0 HB3 GLN A 92 62.480 -19.752 9.383 1.00 0.00 H new ATOM 0 HG2 GLN A 92 60.706 -20.684 7.949 1.00 0.00 H new ATOM 0 HG3 GLN A 92 61.035 -22.302 8.536 1.00 0.00 H new ATOM 0 HE21 GLN A 92 60.580 -22.781 10.857 1.00 0.00 H new ATOM 0 HE22 GLN A 92 59.362 -21.822 11.704 1.00 0.00 H new TER 1467 GLN A 92 ATOM 1468 N GLY B 706 15.339 -1.281 28.520 1.00 0.00 N ATOM 1469 CA GLY B 706 16.470 -0.667 29.215 1.00 0.00 C ATOM 1470 C GLY B 706 17.317 0.259 28.328 1.00 0.00 C ATOM 1471 O GLY B 706 17.078 0.385 27.126 1.00 0.00 O ATOM 0 HA2 GLY B 706 16.095 -0.097 30.065 1.00 0.00 H new ATOM 0 HA3 GLY B 706 17.109 -1.454 29.616 1.00 0.00 H new ATOM 1475 N SER B 707 18.319 0.910 28.925 1.00 0.00 N ATOM 1476 CA SER B 707 19.229 1.881 28.280 1.00 0.00 C ATOM 1477 C SER B 707 19.999 1.384 27.040 1.00 0.00 C ATOM 1478 O SER B 707 20.547 2.203 26.299 1.00 0.00 O ATOM 1479 CB SER B 707 20.248 2.394 29.309 1.00 0.00 C ATOM 1480 OG SER B 707 19.591 2.885 30.471 1.00 0.00 O ATOM 0 H SER B 707 18.534 0.774 29.913 1.00 0.00 H new ATOM 0 HA SER B 707 18.565 2.664 27.914 1.00 0.00 H new ATOM 0 HB2 SER B 707 20.930 1.589 29.584 1.00 0.00 H new ATOM 0 HB3 SER B 707 20.852 3.186 28.866 1.00 0.00 H new ATOM 0 HG SER B 707 20.258 3.205 31.114 1.00 0.00 H new ATOM 1486 N HIS B 708 20.049 0.066 26.804 1.00 0.00 N ATOM 1487 CA HIS B 708 20.767 -0.571 25.688 1.00 0.00 C ATOM 1488 C HIS B 708 19.912 -1.599 24.910 1.00 0.00 C ATOM 1489 O HIS B 708 20.454 -2.423 24.167 1.00 0.00 O ATOM 1490 CB HIS B 708 22.066 -1.197 26.233 1.00 0.00 C ATOM 1491 CG HIS B 708 22.941 -0.235 27.004 1.00 0.00 C ATOM 1492 ND1 HIS B 708 23.658 0.820 26.481 1.00 0.00 N ATOM 1493 CD2 HIS B 708 23.143 -0.225 28.358 1.00 0.00 C ATOM 1494 CE1 HIS B 708 24.274 1.453 27.494 1.00 0.00 C ATOM 1495 NE2 HIS B 708 23.991 0.850 28.664 1.00 0.00 N ATOM 0 H HIS B 708 19.576 -0.610 27.404 1.00 0.00 H new ATOM 0 HA HIS B 708 21.006 0.198 24.954 1.00 0.00 H new ATOM 0 HB2 HIS B 708 21.808 -2.035 26.880 1.00 0.00 H new ATOM 0 HB3 HIS B 708 22.638 -1.603 25.399 1.00 0.00 H new ATOM 0 HD2 HIS B 708 22.723 -0.923 29.067 1.00 0.00 H new ATOM 0 HE1 HIS B 708 24.906 2.322 27.385 1.00 0.00 H new ATOM 0 HE2 HIS B 708 24.326 1.121 29.589 1.00 0.00 H new ATOM 1503 N MET B 709 18.580 -1.577 25.072 1.00 0.00 N ATOM 1504 CA MET B 709 17.655 -2.494 24.381 1.00 0.00 C ATOM 1505 C MET B 709 17.689 -2.340 22.848 1.00 0.00 C ATOM 1506 O MET B 709 17.927 -1.250 22.326 1.00 0.00 O ATOM 1507 CB MET B 709 16.225 -2.304 24.921 1.00 0.00 C ATOM 1508 CG MET B 709 15.582 -0.970 24.513 1.00 0.00 C ATOM 1509 SD MET B 709 13.978 -0.644 25.292 1.00 0.00 S ATOM 1510 CE MET B 709 13.614 0.963 24.534 1.00 0.00 C ATOM 0 H MET B 709 18.109 -0.917 25.691 1.00 0.00 H new ATOM 0 HA MET B 709 17.990 -3.510 24.592 1.00 0.00 H new ATOM 0 HB2 MET B 709 15.600 -3.122 24.564 1.00 0.00 H new ATOM 0 HB3 MET B 709 16.245 -2.369 26.009 1.00 0.00 H new ATOM 0 HG2 MET B 709 16.266 -0.159 24.764 1.00 0.00 H new ATOM 0 HG3 MET B 709 15.456 -0.957 23.430 1.00 0.00 H new ATOM 0 HE1 MET B 709 12.653 1.327 24.897 1.00 0.00 H new ATOM 0 HE2 MET B 709 14.396 1.675 24.798 1.00 0.00 H new ATOM 0 HE3 MET B 709 13.574 0.853 23.450 1.00 0.00 H new ATOM 1520 N SER B 710 17.400 -3.416 22.111 1.00 0.00 N ATOM 1521 CA SER B 710 17.349 -3.413 20.634 1.00 0.00 C ATOM 1522 C SER B 710 16.125 -2.698 20.044 1.00 0.00 C ATOM 1523 O SER B 710 16.093 -2.383 18.851 1.00 0.00 O ATOM 1524 CB SER B 710 17.413 -4.854 20.112 1.00 0.00 C ATOM 1525 OG SER B 710 16.363 -5.634 20.670 1.00 0.00 O ATOM 0 H SER B 710 17.192 -4.327 22.521 1.00 0.00 H new ATOM 0 HA SER B 710 18.216 -2.841 20.303 1.00 0.00 H new ATOM 0 HB2 SER B 710 17.337 -4.857 19.025 1.00 0.00 H new ATOM 0 HB3 SER B 710 18.376 -5.296 20.366 1.00 0.00 H new ATOM 0 HG SER B 710 16.417 -6.550 20.325 1.00 0.00 H new ATOM 1531 N GLU B 711 15.114 -2.419 20.869 1.00 0.00 N ATOM 1532 CA GLU B 711 13.852 -1.761 20.484 1.00 0.00 C ATOM 1533 C GLU B 711 13.966 -0.269 20.133 1.00 0.00 C ATOM 1534 O GLU B 711 13.020 0.341 19.632 1.00 0.00 O ATOM 1535 CB GLU B 711 12.771 -2.002 21.553 1.00 0.00 C ATOM 1536 CG GLU B 711 12.423 -3.489 21.705 1.00 0.00 C ATOM 1537 CD GLU B 711 11.242 -3.693 22.676 1.00 0.00 C ATOM 1538 OE1 GLU B 711 10.070 -3.517 22.261 1.00 0.00 O ATOM 1539 OE2 GLU B 711 11.473 -4.052 23.857 1.00 0.00 O ATOM 0 H GLU B 711 15.147 -2.651 21.862 1.00 0.00 H new ATOM 0 HA GLU B 711 13.559 -2.235 19.547 1.00 0.00 H new ATOM 0 HB2 GLU B 711 13.117 -1.612 22.510 1.00 0.00 H new ATOM 0 HB3 GLU B 711 11.872 -1.446 21.289 1.00 0.00 H new ATOM 0 HG2 GLU B 711 12.171 -3.907 20.730 1.00 0.00 H new ATOM 0 HG3 GLU B 711 13.294 -4.033 22.070 1.00 0.00 H new ATOM 1546 N VAL B 712 15.154 0.301 20.316 1.00 0.00 N ATOM 1547 CA VAL B 712 15.492 1.695 19.947 1.00 0.00 C ATOM 1548 C VAL B 712 15.701 1.872 18.431 1.00 0.00 C ATOM 1549 O VAL B 712 15.938 2.987 17.965 1.00 0.00 O ATOM 1550 CB VAL B 712 16.712 2.233 20.728 1.00 0.00 C ATOM 1551 CG1 VAL B 712 16.501 2.110 22.243 1.00 0.00 C ATOM 1552 CG2 VAL B 712 18.035 1.559 20.340 1.00 0.00 C ATOM 0 H VAL B 712 15.938 -0.198 20.736 1.00 0.00 H new ATOM 0 HA VAL B 712 14.625 2.290 20.233 1.00 0.00 H new ATOM 0 HB VAL B 712 16.791 3.284 20.451 1.00 0.00 H new ATOM 0 HG11 VAL B 712 17.376 2.497 22.765 1.00 0.00 H new ATOM 0 HG12 VAL B 712 15.621 2.683 22.536 1.00 0.00 H new ATOM 0 HG13 VAL B 712 16.355 1.062 22.506 1.00 0.00 H new ATOM 0 HG21 VAL B 712 18.847 1.986 20.928 1.00 0.00 H new ATOM 0 HG22 VAL B 712 17.969 0.489 20.536 1.00 0.00 H new ATOM 0 HG23 VAL B 712 18.229 1.722 19.280 1.00 0.00 H new ATOM 1562 N HIS B 713 15.615 0.777 17.663 1.00 0.00 N ATOM 1563 CA HIS B 713 15.800 0.706 16.208 1.00 0.00 C ATOM 1564 C HIS B 713 17.109 1.366 15.706 1.00 0.00 C ATOM 1565 O HIS B 713 17.070 2.343 14.948 1.00 0.00 O ATOM 1566 CB HIS B 713 14.515 1.154 15.493 1.00 0.00 C ATOM 1567 CG HIS B 713 13.391 0.156 15.647 1.00 0.00 C ATOM 1568 ND1 HIS B 713 12.658 -0.104 16.786 1.00 0.00 N ATOM 1569 CD2 HIS B 713 12.975 -0.733 14.693 1.00 0.00 C ATOM 1570 CE1 HIS B 713 11.825 -1.127 16.527 1.00 0.00 C ATOM 1571 NE2 HIS B 713 12.000 -1.563 15.266 1.00 0.00 N ATOM 0 H HIS B 713 15.402 -0.136 18.065 1.00 0.00 H new ATOM 0 HA HIS B 713 15.959 -0.337 15.933 1.00 0.00 H new ATOM 0 HB2 HIS B 713 14.198 2.118 15.891 1.00 0.00 H new ATOM 0 HB3 HIS B 713 14.724 1.300 14.433 1.00 0.00 H new ATOM 0 HD1 HIS B 713 12.735 0.394 17.673 1.00 0.00 H new ATOM 0 HD2 HIS B 713 13.335 -0.786 13.676 1.00 0.00 H new ATOM 0 HE1 HIS B 713 11.117 -1.540 17.230 1.00 0.00 H new ATOM 1579 N PRO B 714 18.281 0.837 16.127 1.00 0.00 N ATOM 1580 CA PRO B 714 19.600 1.313 15.703 1.00 0.00 C ATOM 1581 C PRO B 714 19.921 0.853 14.261 1.00 0.00 C ATOM 1582 O PRO B 714 19.065 0.315 13.554 1.00 0.00 O ATOM 1583 CB PRO B 714 20.563 0.730 16.749 1.00 0.00 C ATOM 1584 CG PRO B 714 19.929 -0.615 17.094 1.00 0.00 C ATOM 1585 CD PRO B 714 18.433 -0.316 17.011 1.00 0.00 C ATOM 0 HA PRO B 714 19.672 2.400 15.662 1.00 0.00 H new ATOM 0 HB2 PRO B 714 21.569 0.610 16.347 1.00 0.00 H new ATOM 0 HB3 PRO B 714 20.644 1.374 17.625 1.00 0.00 H new ATOM 0 HG2 PRO B 714 20.225 -1.394 16.391 1.00 0.00 H new ATOM 0 HG3 PRO B 714 20.219 -0.956 18.088 1.00 0.00 H new ATOM 0 HD2 PRO B 714 17.888 -1.176 16.622 1.00 0.00 H new ATOM 0 HD3 PRO B 714 18.026 -0.102 17.999 1.00 0.00 H new ATOM 1593 N SER B 715 21.166 1.038 13.812 1.00 0.00 N ATOM 1594 CA SER B 715 21.635 0.631 12.473 1.00 0.00 C ATOM 1595 C SER B 715 21.504 -0.874 12.172 1.00 0.00 C ATOM 1596 O SER B 715 21.375 -1.245 11.002 1.00 0.00 O ATOM 1597 CB SER B 715 23.098 1.052 12.288 1.00 0.00 C ATOM 1598 OG SER B 715 23.919 0.422 13.261 1.00 0.00 O ATOM 0 H SER B 715 21.893 1.482 14.374 1.00 0.00 H new ATOM 0 HA SER B 715 20.978 1.140 11.768 1.00 0.00 H new ATOM 0 HB2 SER B 715 23.437 0.784 11.287 1.00 0.00 H new ATOM 0 HB3 SER B 715 23.186 2.135 12.374 1.00 0.00 H new ATOM 0 HG SER B 715 24.850 0.698 13.131 1.00 0.00 H new ATOM 1604 N ARG B 716 21.528 -1.735 13.209 1.00 0.00 N ATOM 1605 CA ARG B 716 21.436 -3.215 13.134 1.00 0.00 C ATOM 1606 C ARG B 716 22.356 -3.827 12.057 1.00 0.00 C ATOM 1607 O ARG B 716 21.983 -4.767 11.348 1.00 0.00 O ATOM 1608 CB ARG B 716 19.959 -3.650 12.996 1.00 0.00 C ATOM 1609 CG ARG B 716 19.101 -3.292 14.224 1.00 0.00 C ATOM 1610 CD ARG B 716 17.649 -3.748 14.035 1.00 0.00 C ATOM 1611 NE ARG B 716 16.817 -3.439 15.218 1.00 0.00 N ATOM 1612 CZ ARG B 716 15.502 -3.297 15.243 1.00 0.00 C ATOM 1613 NH1 ARG B 716 14.760 -3.458 14.185 1.00 0.00 N ATOM 1614 NH2 ARG B 716 14.888 -2.977 16.344 1.00 0.00 N ATOM 0 H ARG B 716 21.616 -1.406 14.170 1.00 0.00 H new ATOM 0 HA ARG B 716 21.814 -3.621 14.072 1.00 0.00 H new ATOM 0 HB2 ARG B 716 19.530 -3.179 12.112 1.00 0.00 H new ATOM 0 HB3 ARG B 716 19.918 -4.727 12.835 1.00 0.00 H new ATOM 0 HG2 ARG B 716 19.520 -3.762 15.114 1.00 0.00 H new ATOM 0 HG3 ARG B 716 19.129 -2.215 14.389 1.00 0.00 H new ATOM 0 HD2 ARG B 716 17.227 -3.260 13.156 1.00 0.00 H new ATOM 0 HD3 ARG B 716 17.627 -4.821 13.846 1.00 0.00 H new ATOM 0 HE ARG B 716 17.307 -3.324 16.105 1.00 0.00 H new ATOM 0 HH11 ARG B 716 15.190 -3.703 13.293 1.00 0.00 H new ATOM 0 HH12 ARG B 716 13.749 -3.339 14.248 1.00 0.00 H new ATOM 0 HH21 ARG B 716 15.421 -2.832 17.202 1.00 0.00 H new ATOM 0 HH22 ARG B 716 13.874 -2.871 16.350 1.00 0.00 H new ATOM 1628 N LEU B 717 23.559 -3.265 11.902 1.00 0.00 N ATOM 1629 CA LEU B 717 24.538 -3.683 10.894 1.00 0.00 C ATOM 1630 C LEU B 717 24.961 -5.161 11.051 1.00 0.00 C ATOM 1631 O LEU B 717 25.086 -5.674 12.166 1.00 0.00 O ATOM 1632 CB LEU B 717 25.742 -2.724 10.936 1.00 0.00 C ATOM 1633 CG LEU B 717 26.542 -2.727 9.621 1.00 0.00 C ATOM 1634 CD1 LEU B 717 25.813 -1.961 8.513 1.00 0.00 C ATOM 1635 CD2 LEU B 717 27.906 -2.073 9.832 1.00 0.00 C ATOM 0 H LEU B 717 23.885 -2.493 12.484 1.00 0.00 H new ATOM 0 HA LEU B 717 24.071 -3.625 9.911 1.00 0.00 H new ATOM 0 HB2 LEU B 717 25.390 -1.713 11.142 1.00 0.00 H new ATOM 0 HB3 LEU B 717 26.399 -3.006 11.758 1.00 0.00 H new ATOM 0 HG LEU B 717 26.657 -3.768 9.320 1.00 0.00 H new ATOM 0 HD11 LEU B 717 26.409 -1.986 7.601 1.00 0.00 H new ATOM 0 HD12 LEU B 717 24.845 -2.425 8.326 1.00 0.00 H new ATOM 0 HD13 LEU B 717 25.666 -0.926 8.822 1.00 0.00 H new ATOM 0 HD21 LEU B 717 28.462 -2.081 8.895 1.00 0.00 H new ATOM 0 HD22 LEU B 717 27.769 -1.044 10.163 1.00 0.00 H new ATOM 0 HD23 LEU B 717 28.462 -2.627 10.589 1.00 0.00 H new ATOM 1647 N GLN B 718 25.164 -5.842 9.918 1.00 0.00 N ATOM 1648 CA GLN B 718 25.485 -7.280 9.831 1.00 0.00 C ATOM 1649 C GLN B 718 26.390 -7.661 8.640 1.00 0.00 C ATOM 1650 O GLN B 718 26.393 -8.798 8.162 1.00 0.00 O ATOM 1651 CB GLN B 718 24.154 -8.039 9.805 1.00 0.00 C ATOM 1652 CG GLN B 718 23.270 -7.736 8.577 1.00 0.00 C ATOM 1653 CD GLN B 718 21.786 -7.894 8.892 1.00 0.00 C ATOM 1654 OE1 GLN B 718 21.124 -8.836 8.472 1.00 0.00 O ATOM 1655 NE2 GLN B 718 21.209 -6.982 9.647 1.00 0.00 N ATOM 0 H GLN B 718 25.109 -5.396 9.002 1.00 0.00 H new ATOM 0 HA GLN B 718 26.081 -7.557 10.701 1.00 0.00 H new ATOM 0 HB2 GLN B 718 24.360 -9.109 9.834 1.00 0.00 H new ATOM 0 HB3 GLN B 718 23.594 -7.797 10.709 1.00 0.00 H new ATOM 0 HG2 GLN B 718 23.462 -6.720 8.233 1.00 0.00 H new ATOM 0 HG3 GLN B 718 23.541 -8.405 7.760 1.00 0.00 H new ATOM 0 HE21 GLN B 718 21.752 -6.195 10.001 1.00 0.00 H new ATOM 0 HE22 GLN B 718 20.219 -7.063 9.878 1.00 0.00 H new ATOM 1664 N THR B 719 27.143 -6.684 8.145 1.00 0.00 N ATOM 1665 CA THR B 719 28.075 -6.795 7.005 1.00 0.00 C ATOM 1666 C THR B 719 29.208 -7.809 7.230 1.00 0.00 C ATOM 1667 O THR B 719 29.591 -8.120 8.362 1.00 0.00 O ATOM 1668 CB THR B 719 28.682 -5.424 6.654 1.00 0.00 C ATOM 1669 OG1 THR B 719 29.212 -4.806 7.807 1.00 0.00 O ATOM 1670 CG2 THR B 719 27.638 -4.479 6.059 1.00 0.00 C ATOM 0 H THR B 719 27.126 -5.744 8.540 1.00 0.00 H new ATOM 0 HA THR B 719 27.473 -7.163 6.174 1.00 0.00 H new ATOM 0 HB THR B 719 29.467 -5.609 5.921 1.00 0.00 H new ATOM 0 HG1 THR B 719 29.595 -3.937 7.566 1.00 0.00 H new ATOM 0 HG21 THR B 719 28.105 -3.522 5.825 1.00 0.00 H new ATOM 0 HG22 THR B 719 27.229 -4.916 5.148 1.00 0.00 H new ATOM 0 HG23 THR B 719 26.835 -4.324 6.780 1.00 0.00 H new ATOM 1678 N THR B 720 29.777 -8.320 6.131 1.00 0.00 N ATOM 1679 CA THR B 720 30.880 -9.303 6.143 1.00 0.00 C ATOM 1680 C THR B 720 32.143 -8.823 6.853 1.00 0.00 C ATOM 1681 O THR B 720 32.859 -9.604 7.471 1.00 0.00 O ATOM 1682 CB THR B 720 31.246 -9.758 4.722 1.00 0.00 C ATOM 1683 OG1 THR B 720 31.390 -8.632 3.879 1.00 0.00 O ATOM 1684 CG2 THR B 720 30.159 -10.650 4.119 1.00 0.00 C ATOM 0 H THR B 720 29.482 -8.061 5.190 1.00 0.00 H new ATOM 0 HA THR B 720 30.488 -10.142 6.717 1.00 0.00 H new ATOM 0 HB THR B 720 32.178 -10.319 4.794 1.00 0.00 H new ATOM 0 HG1 THR B 720 31.625 -8.928 2.975 1.00 0.00 H new ATOM 0 HG21 THR B 720 30.453 -10.952 3.114 1.00 0.00 H new ATOM 0 HG22 THR B 720 30.029 -11.536 4.741 1.00 0.00 H new ATOM 0 HG23 THR B 720 29.220 -10.098 4.072 1.00 0.00 H new ATOM 1692 N ASP B 721 32.376 -7.518 6.830 1.00 0.00 N ATOM 1693 CA ASP B 721 33.507 -6.825 7.469 1.00 0.00 C ATOM 1694 C ASP B 721 33.517 -6.894 9.008 1.00 0.00 C ATOM 1695 O ASP B 721 34.451 -6.396 9.639 1.00 0.00 O ATOM 1696 CB ASP B 721 33.569 -5.375 6.963 1.00 0.00 C ATOM 1697 CG ASP B 721 33.804 -5.300 5.446 1.00 0.00 C ATOM 1698 OD1 ASP B 721 34.699 -6.009 4.930 1.00 0.00 O ATOM 1699 OD2 ASP B 721 33.110 -4.515 4.757 1.00 0.00 O ATOM 0 H ASP B 721 31.754 -6.873 6.342 1.00 0.00 H new ATOM 0 HA ASP B 721 34.409 -7.360 7.174 1.00 0.00 H new ATOM 0 HB2 ASP B 721 32.638 -4.865 7.210 1.00 0.00 H new ATOM 0 HB3 ASP B 721 34.369 -4.845 7.480 1.00 0.00 H new ATOM 1704 N ASN B 722 32.516 -7.539 9.622 1.00 0.00 N ATOM 1705 CA ASN B 722 32.421 -7.758 11.065 1.00 0.00 C ATOM 1706 C ASN B 722 32.524 -9.245 11.460 1.00 0.00 C ATOM 1707 O ASN B 722 32.546 -9.565 12.649 1.00 0.00 O ATOM 1708 CB ASN B 722 31.144 -7.091 11.578 1.00 0.00 C ATOM 1709 CG ASN B 722 31.111 -6.945 13.092 1.00 0.00 C ATOM 1710 OD1 ASN B 722 30.195 -7.393 13.767 1.00 0.00 O ATOM 1711 ND2 ASN B 722 32.104 -6.306 13.676 1.00 0.00 N ATOM 0 H ASN B 722 31.728 -7.934 9.109 1.00 0.00 H new ATOM 0 HA ASN B 722 33.281 -7.295 11.548 1.00 0.00 H new ATOM 0 HB2 ASN B 722 31.048 -6.106 11.122 1.00 0.00 H new ATOM 0 HB3 ASN B 722 30.282 -7.676 11.257 1.00 0.00 H new ATOM 0 HD21 ASN B 722 32.108 -6.186 14.689 1.00 0.00 H new ATOM 0 HD22 ASN B 722 32.869 -5.931 13.115 1.00 0.00 H new ATOM 1718 N LEU B 723 32.660 -10.158 10.486 1.00 0.00 N ATOM 1719 CA LEU B 723 32.906 -11.585 10.720 1.00 0.00 C ATOM 1720 C LEU B 723 34.233 -11.850 11.458 1.00 0.00 C ATOM 1721 O LEU B 723 34.448 -12.956 11.936 1.00 0.00 O ATOM 1722 CB LEU B 723 32.871 -12.316 9.365 1.00 0.00 C ATOM 1723 CG LEU B 723 31.521 -12.260 8.629 1.00 0.00 C ATOM 1724 CD1 LEU B 723 31.678 -12.899 7.251 1.00 0.00 C ATOM 1725 CD2 LEU B 723 30.423 -12.987 9.399 1.00 0.00 C ATOM 0 H LEU B 723 32.601 -9.918 9.496 1.00 0.00 H new ATOM 0 HA LEU B 723 32.123 -11.966 11.375 1.00 0.00 H new ATOM 0 HB2 LEU B 723 33.638 -11.888 8.719 1.00 0.00 H new ATOM 0 HB3 LEU B 723 33.136 -13.361 9.526 1.00 0.00 H new ATOM 0 HG LEU B 723 31.228 -11.214 8.538 1.00 0.00 H new ATOM 0 HD11 LEU B 723 30.725 -12.863 6.723 1.00 0.00 H new ATOM 0 HD12 LEU B 723 32.430 -12.354 6.681 1.00 0.00 H new ATOM 0 HD13 LEU B 723 31.991 -13.937 7.365 1.00 0.00 H new ATOM 0 HD21 LEU B 723 29.487 -12.923 8.845 1.00 0.00 H new ATOM 0 HD22 LEU B 723 30.699 -14.034 9.526 1.00 0.00 H new ATOM 0 HD23 LEU B 723 30.297 -12.524 10.378 1.00 0.00 H new ATOM 1737 N LEU B 724 35.100 -10.837 11.566 1.00 0.00 N ATOM 1738 CA LEU B 724 36.446 -10.860 12.169 1.00 0.00 C ATOM 1739 C LEU B 724 36.580 -11.813 13.388 1.00 0.00 C ATOM 1740 O LEU B 724 36.044 -11.506 14.458 1.00 0.00 O ATOM 1741 CB LEU B 724 36.893 -9.418 12.500 1.00 0.00 C ATOM 1742 CG LEU B 724 36.664 -8.366 11.387 1.00 0.00 C ATOM 1743 CD1 LEU B 724 37.308 -7.040 11.785 1.00 0.00 C ATOM 1744 CD2 LEU B 724 37.263 -8.806 10.052 1.00 0.00 C ATOM 0 H LEU B 724 34.866 -9.910 11.210 1.00 0.00 H new ATOM 0 HA LEU B 724 37.122 -11.282 11.426 1.00 0.00 H new ATOM 0 HB2 LEU B 724 36.365 -9.091 13.396 1.00 0.00 H new ATOM 0 HB3 LEU B 724 37.955 -9.435 12.744 1.00 0.00 H new ATOM 0 HG LEU B 724 35.586 -8.255 11.269 1.00 0.00 H new ATOM 0 HD11 LEU B 724 37.143 -6.305 10.998 1.00 0.00 H new ATOM 0 HD12 LEU B 724 36.862 -6.683 12.714 1.00 0.00 H new ATOM 0 HD13 LEU B 724 38.379 -7.184 11.928 1.00 0.00 H new ATOM 0 HD21 LEU B 724 37.079 -8.039 9.300 1.00 0.00 H new ATOM 0 HD22 LEU B 724 38.337 -8.953 10.166 1.00 0.00 H new ATOM 0 HD23 LEU B 724 36.801 -9.741 9.736 1.00 0.00 H new ATOM 1756 N PRO B 725 37.266 -12.974 13.261 1.00 0.00 N ATOM 1757 CA PRO B 725 37.392 -13.978 14.330 1.00 0.00 C ATOM 1758 C PRO B 725 38.359 -13.599 15.468 1.00 0.00 C ATOM 1759 O PRO B 725 38.388 -14.265 16.502 1.00 0.00 O ATOM 1760 CB PRO B 725 37.879 -15.243 13.617 1.00 0.00 C ATOM 1761 CG PRO B 725 38.731 -14.690 12.479 1.00 0.00 C ATOM 1762 CD PRO B 725 37.938 -13.456 12.057 1.00 0.00 C ATOM 0 HA PRO B 725 36.433 -14.092 14.835 1.00 0.00 H new ATOM 0 HB2 PRO B 725 38.460 -15.883 14.282 1.00 0.00 H new ATOM 0 HB3 PRO B 725 37.048 -15.842 13.245 1.00 0.00 H new ATOM 0 HG2 PRO B 725 39.737 -14.434 12.810 1.00 0.00 H new ATOM 0 HG3 PRO B 725 38.836 -15.406 11.664 1.00 0.00 H new ATOM 0 HD2 PRO B 725 38.597 -12.691 11.646 1.00 0.00 H new ATOM 0 HD3 PRO B 725 37.215 -13.705 11.280 1.00 0.00 H new ATOM 1770 N MET B 726 39.151 -12.543 15.276 1.00 0.00 N ATOM 1771 CA MET B 726 40.168 -12.038 16.204 1.00 0.00 C ATOM 1772 C MET B 726 40.138 -10.503 16.221 1.00 0.00 C ATOM 1773 O MET B 726 39.798 -9.880 15.209 1.00 0.00 O ATOM 1774 CB MET B 726 41.505 -12.607 15.721 1.00 0.00 C ATOM 1775 CG MET B 726 42.739 -12.169 16.503 1.00 0.00 C ATOM 1776 SD MET B 726 44.271 -13.039 16.064 1.00 0.00 S ATOM 1777 CE MET B 726 44.399 -12.682 14.290 1.00 0.00 C ATOM 0 H MET B 726 39.098 -11.986 14.423 1.00 0.00 H new ATOM 0 HA MET B 726 39.992 -12.350 17.234 1.00 0.00 H new ATOM 0 HB2 MET B 726 41.447 -13.695 15.752 1.00 0.00 H new ATOM 0 HB3 MET B 726 41.642 -12.325 14.677 1.00 0.00 H new ATOM 0 HG2 MET B 726 42.888 -11.100 16.349 1.00 0.00 H new ATOM 0 HG3 MET B 726 42.548 -12.314 17.566 1.00 0.00 H new ATOM 0 HE1 MET B 726 45.362 -13.031 13.917 1.00 0.00 H new ATOM 0 HE2 MET B 726 43.597 -13.192 13.757 1.00 0.00 H new ATOM 0 HE3 MET B 726 44.316 -11.607 14.128 1.00 0.00 H new ATOM 1787 N SER B 727 40.479 -9.891 17.354 1.00 0.00 N ATOM 1788 CA SER B 727 40.437 -8.429 17.541 1.00 0.00 C ATOM 1789 C SER B 727 41.758 -7.728 17.178 1.00 0.00 C ATOM 1790 O SER B 727 42.799 -8.390 17.121 1.00 0.00 O ATOM 1791 CB SER B 727 40.065 -8.109 18.998 1.00 0.00 C ATOM 1792 OG SER B 727 41.196 -8.171 19.853 1.00 0.00 O ATOM 0 H SER B 727 40.797 -10.396 18.181 1.00 0.00 H new ATOM 0 HA SER B 727 39.681 -8.045 16.856 1.00 0.00 H new ATOM 0 HB2 SER B 727 39.623 -7.114 19.051 1.00 0.00 H new ATOM 0 HB3 SER B 727 39.308 -8.813 19.344 1.00 0.00 H new ATOM 0 HG SER B 727 40.924 -7.961 20.771 1.00 0.00 H new ATOM 1798 N PRO B 728 41.769 -6.394 16.961 1.00 0.00 N ATOM 1799 CA PRO B 728 42.999 -5.637 16.703 1.00 0.00 C ATOM 1800 C PRO B 728 44.054 -5.792 17.816 1.00 0.00 C ATOM 1801 O PRO B 728 45.255 -5.783 17.544 1.00 0.00 O ATOM 1802 CB PRO B 728 42.567 -4.170 16.572 1.00 0.00 C ATOM 1803 CG PRO B 728 41.085 -4.250 16.216 1.00 0.00 C ATOM 1804 CD PRO B 728 40.622 -5.495 16.967 1.00 0.00 C ATOM 0 HA PRO B 728 43.482 -6.013 15.801 1.00 0.00 H new ATOM 0 HB2 PRO B 728 42.725 -3.623 17.502 1.00 0.00 H new ATOM 0 HB3 PRO B 728 43.136 -3.654 15.798 1.00 0.00 H new ATOM 0 HG2 PRO B 728 40.544 -3.360 16.537 1.00 0.00 H new ATOM 0 HG3 PRO B 728 40.932 -4.346 15.141 1.00 0.00 H new ATOM 0 HD2 PRO B 728 40.319 -5.251 17.985 1.00 0.00 H new ATOM 0 HD3 PRO B 728 39.761 -5.952 16.479 1.00 0.00 H new ATOM 1812 N GLU B 729 43.617 -5.957 19.071 1.00 0.00 N ATOM 1813 CA GLU B 729 44.501 -6.141 20.231 1.00 0.00 C ATOM 1814 C GLU B 729 45.211 -7.504 20.207 1.00 0.00 C ATOM 1815 O GLU B 729 46.366 -7.601 20.615 1.00 0.00 O ATOM 1816 CB GLU B 729 43.716 -5.979 21.542 1.00 0.00 C ATOM 1817 CG GLU B 729 43.137 -4.567 21.709 1.00 0.00 C ATOM 1818 CD GLU B 729 42.440 -4.408 23.074 1.00 0.00 C ATOM 1819 OE1 GLU B 729 43.123 -4.073 24.074 1.00 0.00 O ATOM 1820 OE2 GLU B 729 41.202 -4.603 23.159 1.00 0.00 O ATOM 0 H GLU B 729 42.626 -5.967 19.313 1.00 0.00 H new ATOM 0 HA GLU B 729 45.267 -5.368 20.174 1.00 0.00 H new ATOM 0 HB2 GLU B 729 42.905 -6.706 21.568 1.00 0.00 H new ATOM 0 HB3 GLU B 729 44.371 -6.202 22.384 1.00 0.00 H new ATOM 0 HG2 GLU B 729 43.935 -3.831 21.618 1.00 0.00 H new ATOM 0 HG3 GLU B 729 42.425 -4.366 20.909 1.00 0.00 H new ATOM 1827 N GLU B 730 44.558 -8.550 19.699 1.00 0.00 N ATOM 1828 CA GLU B 730 45.142 -9.886 19.519 1.00 0.00 C ATOM 1829 C GLU B 730 45.995 -9.919 18.244 1.00 0.00 C ATOM 1830 O GLU B 730 47.108 -10.444 18.247 1.00 0.00 O ATOM 1831 CB GLU B 730 44.008 -10.909 19.401 1.00 0.00 C ATOM 1832 CG GLU B 730 43.179 -11.049 20.679 1.00 0.00 C ATOM 1833 CD GLU B 730 41.970 -11.979 20.453 1.00 0.00 C ATOM 1834 OE1 GLU B 730 41.087 -11.644 19.624 1.00 0.00 O ATOM 1835 OE2 GLU B 730 41.894 -13.039 21.117 1.00 0.00 O ATOM 0 H GLU B 730 43.586 -8.494 19.393 1.00 0.00 H new ATOM 0 HA GLU B 730 45.775 -10.125 20.373 1.00 0.00 H new ATOM 0 HB2 GLU B 730 43.351 -10.619 18.581 1.00 0.00 H new ATOM 0 HB3 GLU B 730 44.430 -11.880 19.143 1.00 0.00 H new ATOM 0 HG2 GLU B 730 43.803 -11.446 21.480 1.00 0.00 H new ATOM 0 HG3 GLU B 730 42.832 -10.067 21.001 1.00 0.00 H new ATOM 1842 N PHE B 731 45.499 -9.301 17.167 1.00 0.00 N ATOM 1843 CA PHE B 731 46.209 -9.157 15.892 1.00 0.00 C ATOM 1844 C PHE B 731 47.599 -8.520 16.086 1.00 0.00 C ATOM 1845 O PHE B 731 48.550 -8.919 15.420 1.00 0.00 O ATOM 1846 CB PHE B 731 45.343 -8.352 14.912 1.00 0.00 C ATOM 1847 CG PHE B 731 45.920 -8.218 13.512 1.00 0.00 C ATOM 1848 CD1 PHE B 731 46.874 -7.220 13.231 1.00 0.00 C ATOM 1849 CD2 PHE B 731 45.494 -9.080 12.482 1.00 0.00 C ATOM 1850 CE1 PHE B 731 47.410 -7.096 11.937 1.00 0.00 C ATOM 1851 CE2 PHE B 731 46.019 -8.946 11.183 1.00 0.00 C ATOM 1852 CZ PHE B 731 46.982 -7.960 10.912 1.00 0.00 C ATOM 0 H PHE B 731 44.571 -8.877 17.158 1.00 0.00 H new ATOM 0 HA PHE B 731 46.382 -10.147 15.471 1.00 0.00 H new ATOM 0 HB2 PHE B 731 44.363 -8.825 14.842 1.00 0.00 H new ATOM 0 HB3 PHE B 731 45.187 -7.354 15.322 1.00 0.00 H new ATOM 0 HD1 PHE B 731 47.195 -6.547 14.013 1.00 0.00 H new ATOM 0 HD2 PHE B 731 44.762 -9.846 12.690 1.00 0.00 H new ATOM 0 HE1 PHE B 731 48.150 -6.337 11.730 1.00 0.00 H new ATOM 0 HE2 PHE B 731 45.681 -9.602 10.394 1.00 0.00 H new ATOM 0 HZ PHE B 731 47.394 -7.865 9.918 1.00 0.00 H new ATOM 1862 N ASP B 732 47.751 -7.574 17.022 1.00 0.00 N ATOM 1863 CA ASP B 732 49.044 -6.967 17.370 1.00 0.00 C ATOM 1864 C ASP B 732 50.067 -8.017 17.858 1.00 0.00 C ATOM 1865 O ASP B 732 51.213 -8.012 17.414 1.00 0.00 O ATOM 1866 CB ASP B 732 48.816 -5.878 18.429 1.00 0.00 C ATOM 1867 CG ASP B 732 50.129 -5.320 18.993 1.00 0.00 C ATOM 1868 OD1 ASP B 732 50.777 -4.476 18.338 1.00 0.00 O ATOM 1869 OD2 ASP B 732 50.515 -5.724 20.120 1.00 0.00 O ATOM 0 H ASP B 732 46.971 -7.204 17.565 1.00 0.00 H new ATOM 0 HA ASP B 732 49.471 -6.519 16.473 1.00 0.00 H new ATOM 0 HB2 ASP B 732 48.239 -5.064 17.990 1.00 0.00 H new ATOM 0 HB3 ASP B 732 48.220 -6.288 19.244 1.00 0.00 H new ATOM 1874 N GLU B 733 49.664 -8.961 18.715 1.00 0.00 N ATOM 1875 CA GLU B 733 50.536 -10.055 19.177 1.00 0.00 C ATOM 1876 C GLU B 733 50.876 -11.022 18.035 1.00 0.00 C ATOM 1877 O GLU B 733 51.999 -11.522 17.971 1.00 0.00 O ATOM 1878 CB GLU B 733 49.862 -10.797 20.343 1.00 0.00 C ATOM 1879 CG GLU B 733 50.762 -11.796 21.089 1.00 0.00 C ATOM 1880 CD GLU B 733 51.988 -11.154 21.764 1.00 0.00 C ATOM 1881 OE1 GLU B 733 51.860 -10.063 22.369 1.00 0.00 O ATOM 1882 OE2 GLU B 733 53.086 -11.756 21.743 1.00 0.00 O ATOM 0 H GLU B 733 48.724 -8.991 19.110 1.00 0.00 H new ATOM 0 HA GLU B 733 51.475 -9.625 19.525 1.00 0.00 H new ATOM 0 HB2 GLU B 733 49.494 -10.061 21.057 1.00 0.00 H new ATOM 0 HB3 GLU B 733 48.993 -11.331 19.959 1.00 0.00 H new ATOM 0 HG2 GLU B 733 50.169 -12.307 21.847 1.00 0.00 H new ATOM 0 HG3 GLU B 733 51.104 -12.556 20.386 1.00 0.00 H new ATOM 1889 N VAL B 734 49.950 -11.242 17.095 1.00 0.00 N ATOM 1890 CA VAL B 734 50.221 -12.066 15.915 1.00 0.00 C ATOM 1891 C VAL B 734 51.229 -11.349 15.012 1.00 0.00 C ATOM 1892 O VAL B 734 52.218 -11.950 14.597 1.00 0.00 O ATOM 1893 CB VAL B 734 48.924 -12.408 15.166 1.00 0.00 C ATOM 1894 CG1 VAL B 734 49.227 -13.207 13.904 1.00 0.00 C ATOM 1895 CG2 VAL B 734 47.956 -13.232 16.025 1.00 0.00 C ATOM 0 H VAL B 734 49.005 -10.859 17.130 1.00 0.00 H new ATOM 0 HA VAL B 734 50.656 -13.013 16.233 1.00 0.00 H new ATOM 0 HB VAL B 734 48.456 -11.456 14.917 1.00 0.00 H new ATOM 0 HG11 VAL B 734 48.295 -13.439 13.388 1.00 0.00 H new ATOM 0 HG12 VAL B 734 49.869 -12.620 13.247 1.00 0.00 H new ATOM 0 HG13 VAL B 734 49.734 -14.134 14.173 1.00 0.00 H new ATOM 0 HG21 VAL B 734 47.055 -13.448 15.452 1.00 0.00 H new ATOM 0 HG22 VAL B 734 48.434 -14.167 16.316 1.00 0.00 H new ATOM 0 HG23 VAL B 734 47.691 -12.667 16.918 1.00 0.00 H new ATOM 1905 N SER B 735 51.027 -10.055 14.756 1.00 0.00 N ATOM 1906 CA SER B 735 51.913 -9.205 13.953 1.00 0.00 C ATOM 1907 C SER B 735 53.350 -9.188 14.489 1.00 0.00 C ATOM 1908 O SER B 735 54.296 -9.266 13.701 1.00 0.00 O ATOM 1909 CB SER B 735 51.334 -7.785 13.894 1.00 0.00 C ATOM 1910 OG SER B 735 52.082 -6.975 13.003 1.00 0.00 O ATOM 0 H SER B 735 50.215 -9.552 15.113 1.00 0.00 H new ATOM 0 HA SER B 735 51.965 -9.623 12.948 1.00 0.00 H new ATOM 0 HB2 SER B 735 50.294 -7.824 13.571 1.00 0.00 H new ATOM 0 HB3 SER B 735 51.342 -7.342 14.890 1.00 0.00 H new ATOM 0 HG SER B 735 51.697 -6.074 12.978 1.00 0.00 H new ATOM 1916 N ARG B 736 53.539 -9.156 15.820 1.00 0.00 N ATOM 1917 CA ARG B 736 54.878 -9.191 16.456 1.00 0.00 C ATOM 1918 C ARG B 736 55.681 -10.438 16.076 1.00 0.00 C ATOM 1919 O ARG B 736 56.882 -10.338 15.824 1.00 0.00 O ATOM 1920 CB ARG B 736 54.752 -9.119 17.987 1.00 0.00 C ATOM 1921 CG ARG B 736 54.371 -7.719 18.477 1.00 0.00 C ATOM 1922 CD ARG B 736 53.959 -7.759 19.951 1.00 0.00 C ATOM 1923 NE ARG B 736 53.230 -6.529 20.311 1.00 0.00 N ATOM 1924 CZ ARG B 736 53.655 -5.481 20.989 1.00 0.00 C ATOM 1925 NH1 ARG B 736 54.854 -5.390 21.491 1.00 0.00 N ATOM 1926 NH2 ARG B 736 52.833 -4.491 21.163 1.00 0.00 N ATOM 0 H ARG B 736 52.771 -9.105 16.489 1.00 0.00 H new ATOM 0 HA ARG B 736 55.417 -8.320 16.083 1.00 0.00 H new ATOM 0 HB2 ARG B 736 54.001 -9.835 18.321 1.00 0.00 H new ATOM 0 HB3 ARG B 736 55.698 -9.415 18.441 1.00 0.00 H new ATOM 0 HG2 ARG B 736 55.214 -7.040 18.347 1.00 0.00 H new ATOM 0 HG3 ARG B 736 53.551 -7.327 17.875 1.00 0.00 H new ATOM 0 HD2 ARG B 736 53.331 -8.630 20.137 1.00 0.00 H new ATOM 0 HD3 ARG B 736 54.843 -7.864 20.580 1.00 0.00 H new ATOM 0 HE ARG B 736 52.263 -6.482 19.991 1.00 0.00 H new ATOM 0 HH11 ARG B 736 55.518 -6.155 21.368 1.00 0.00 H new ATOM 0 HH12 ARG B 736 55.129 -4.554 22.007 1.00 0.00 H new ATOM 0 HH21 ARG B 736 51.889 -4.539 20.780 1.00 0.00 H new ATOM 0 HH22 ARG B 736 53.131 -3.666 21.683 1.00 0.00 H new ATOM 1940 N ILE B 737 55.026 -11.600 16.041 1.00 0.00 N ATOM 1941 CA ILE B 737 55.668 -12.887 15.713 1.00 0.00 C ATOM 1942 C ILE B 737 55.751 -13.128 14.199 1.00 0.00 C ATOM 1943 O ILE B 737 56.807 -13.504 13.687 1.00 0.00 O ATOM 1944 CB ILE B 737 54.917 -14.052 16.400 1.00 0.00 C ATOM 1945 CG1 ILE B 737 54.866 -13.812 17.928 1.00 0.00 C ATOM 1946 CG2 ILE B 737 55.580 -15.407 16.073 1.00 0.00 C ATOM 1947 CD1 ILE B 737 54.292 -14.980 18.731 1.00 0.00 C ATOM 0 H ILE B 737 54.029 -11.682 16.240 1.00 0.00 H new ATOM 0 HA ILE B 737 56.690 -12.843 16.090 1.00 0.00 H new ATOM 0 HB ILE B 737 53.897 -14.087 16.017 1.00 0.00 H new ATOM 0 HG12 ILE B 737 55.874 -13.602 18.285 1.00 0.00 H new ATOM 0 HG13 ILE B 737 54.267 -12.923 18.124 1.00 0.00 H new ATOM 0 HG21 ILE B 737 55.033 -16.209 16.568 1.00 0.00 H new ATOM 0 HG22 ILE B 737 55.565 -15.569 14.995 1.00 0.00 H new ATOM 0 HG23 ILE B 737 56.612 -15.401 16.424 1.00 0.00 H new ATOM 0 HD11 ILE B 737 54.293 -14.728 19.791 1.00 0.00 H new ATOM 0 HD12 ILE B 737 53.271 -15.178 18.406 1.00 0.00 H new ATOM 0 HD13 ILE B 737 54.903 -15.868 18.569 1.00 0.00 H new ATOM 1959 N VAL B 738 54.643 -12.938 13.477 1.00 0.00 N ATOM 1960 CA VAL B 738 54.543 -13.184 12.027 1.00 0.00 C ATOM 1961 C VAL B 738 55.375 -12.194 11.206 1.00 0.00 C ATOM 1962 O VAL B 738 55.926 -12.564 10.170 1.00 0.00 O ATOM 1963 CB VAL B 738 53.067 -13.196 11.579 1.00 0.00 C ATOM 1964 CG1 VAL B 738 52.919 -13.467 10.079 1.00 0.00 C ATOM 1965 CG2 VAL B 738 52.305 -14.315 12.305 1.00 0.00 C ATOM 0 H VAL B 738 53.771 -12.603 13.887 1.00 0.00 H new ATOM 0 HA VAL B 738 54.966 -14.170 11.835 1.00 0.00 H new ATOM 0 HB VAL B 738 52.667 -12.210 11.817 1.00 0.00 H new ATOM 0 HG11 VAL B 738 51.862 -13.466 9.812 1.00 0.00 H new ATOM 0 HG12 VAL B 738 53.437 -12.690 9.516 1.00 0.00 H new ATOM 0 HG13 VAL B 738 53.353 -14.438 9.840 1.00 0.00 H new ATOM 0 HG21 VAL B 738 51.264 -14.315 11.982 1.00 0.00 H new ATOM 0 HG22 VAL B 738 52.759 -15.277 12.068 1.00 0.00 H new ATOM 0 HG23 VAL B 738 52.351 -14.148 13.381 1.00 0.00 H new ATOM 1975 N GLY B 739 55.490 -10.943 11.659 1.00 0.00 N ATOM 1976 CA GLY B 739 56.270 -9.876 11.010 1.00 0.00 C ATOM 1977 C GLY B 739 55.966 -9.636 9.521 1.00 0.00 C ATOM 1978 O GLY B 739 56.838 -9.168 8.786 1.00 0.00 O ATOM 0 H GLY B 739 55.030 -10.631 12.514 1.00 0.00 H new ATOM 0 HA2 GLY B 739 56.098 -8.946 11.551 1.00 0.00 H new ATOM 0 HA3 GLY B 739 57.329 -10.113 11.112 1.00 0.00 H new ATOM 1982 N SER B 740 54.750 -9.969 9.068 1.00 0.00 N ATOM 1983 CA SER B 740 54.264 -9.845 7.679 1.00 0.00 C ATOM 1984 C SER B 740 55.158 -10.492 6.596 1.00 0.00 C ATOM 1985 O SER B 740 55.139 -10.053 5.446 1.00 0.00 O ATOM 1986 CB SER B 740 53.941 -8.374 7.354 1.00 0.00 C ATOM 1987 OG SER B 740 53.015 -7.844 8.293 1.00 0.00 O ATOM 0 H SER B 740 54.038 -10.353 9.690 1.00 0.00 H new ATOM 0 HA SER B 740 53.350 -10.438 7.641 1.00 0.00 H new ATOM 0 HB2 SER B 740 54.857 -7.784 7.367 1.00 0.00 H new ATOM 0 HB3 SER B 740 53.528 -8.301 6.348 1.00 0.00 H new ATOM 0 HG SER B 740 52.823 -6.909 8.071 1.00 0.00 H new ATOM 1993 N VAL B 741 55.928 -11.534 6.956 1.00 0.00 N ATOM 1994 CA VAL B 741 56.890 -12.315 6.132 1.00 0.00 C ATOM 1995 C VAL B 741 56.715 -12.246 4.602 1.00 0.00 C ATOM 1996 O VAL B 741 57.586 -11.721 3.909 1.00 0.00 O ATOM 1997 CB VAL B 741 56.967 -13.790 6.605 1.00 0.00 C ATOM 1998 CG1 VAL B 741 58.000 -13.938 7.725 1.00 0.00 C ATOM 1999 CG2 VAL B 741 55.627 -14.378 7.091 1.00 0.00 C ATOM 0 H VAL B 741 55.896 -11.888 7.912 1.00 0.00 H new ATOM 0 HA VAL B 741 57.837 -11.806 6.310 1.00 0.00 H new ATOM 0 HB VAL B 741 57.258 -14.355 5.719 1.00 0.00 H new ATOM 0 HG11 VAL B 741 58.042 -14.979 8.046 1.00 0.00 H new ATOM 0 HG12 VAL B 741 58.980 -13.631 7.359 1.00 0.00 H new ATOM 0 HG13 VAL B 741 57.715 -13.309 8.569 1.00 0.00 H new ATOM 0 HG21 VAL B 741 55.775 -15.412 7.402 1.00 0.00 H new ATOM 0 HG22 VAL B 741 55.258 -13.794 7.935 1.00 0.00 H new ATOM 0 HG23 VAL B 741 54.899 -14.344 6.280 1.00 0.00 H new ATOM 2009 N GLU B 742 55.595 -12.743 4.071 1.00 0.00 N ATOM 2010 CA GLU B 742 55.221 -12.731 2.637 1.00 0.00 C ATOM 2011 C GLU B 742 53.694 -12.521 2.496 1.00 0.00 C ATOM 2012 O GLU B 742 53.074 -12.885 1.497 1.00 0.00 O ATOM 2013 CB GLU B 742 55.636 -14.068 1.978 1.00 0.00 C ATOM 2014 CG GLU B 742 57.141 -14.387 1.963 1.00 0.00 C ATOM 2015 CD GLU B 742 58.002 -13.407 1.132 1.00 0.00 C ATOM 2016 OE1 GLU B 742 57.470 -12.670 0.264 1.00 0.00 O ATOM 2017 OE2 GLU B 742 59.246 -13.412 1.301 1.00 0.00 O ATOM 0 H GLU B 742 54.883 -13.189 4.650 1.00 0.00 H new ATOM 0 HA GLU B 742 55.739 -11.913 2.136 1.00 0.00 H new ATOM 0 HB2 GLU B 742 55.121 -14.878 2.495 1.00 0.00 H new ATOM 0 HB3 GLU B 742 55.277 -14.067 0.949 1.00 0.00 H new ATOM 0 HG2 GLU B 742 57.508 -14.391 2.989 1.00 0.00 H new ATOM 0 HG3 GLU B 742 57.281 -15.394 1.571 1.00 0.00 H new ATOM 2024 N PHE B 743 53.083 -11.991 3.560 1.00 0.00 N ATOM 2025 CA PHE B 743 51.650 -11.856 3.823 1.00 0.00 C ATOM 2026 C PHE B 743 50.716 -11.491 2.656 1.00 0.00 C ATOM 2027 O PHE B 743 49.687 -12.140 2.459 1.00 0.00 O ATOM 2028 CB PHE B 743 51.498 -10.917 5.018 1.00 0.00 C ATOM 2029 CG PHE B 743 50.259 -11.148 5.851 1.00 0.00 C ATOM 2030 CD1 PHE B 743 50.050 -12.392 6.486 1.00 0.00 C ATOM 2031 CD2 PHE B 743 49.360 -10.085 6.060 1.00 0.00 C ATOM 2032 CE1 PHE B 743 48.982 -12.529 7.384 1.00 0.00 C ATOM 2033 CE2 PHE B 743 48.271 -10.247 6.931 1.00 0.00 C ATOM 2034 CZ PHE B 743 48.099 -11.462 7.608 1.00 0.00 C ATOM 0 H PHE B 743 53.633 -11.610 4.330 1.00 0.00 H new ATOM 0 HA PHE B 743 51.288 -12.863 4.030 1.00 0.00 H new ATOM 0 HB2 PHE B 743 52.374 -11.022 5.658 1.00 0.00 H new ATOM 0 HB3 PHE B 743 51.489 -9.889 4.656 1.00 0.00 H new ATOM 0 HD1 PHE B 743 50.704 -13.227 6.283 1.00 0.00 H new ATOM 0 HD2 PHE B 743 49.508 -9.145 5.550 1.00 0.00 H new ATOM 0 HE1 PHE B 743 48.838 -13.463 7.907 1.00 0.00 H new ATOM 0 HE2 PHE B 743 47.569 -9.439 7.079 1.00 0.00 H new ATOM 0 HZ PHE B 743 47.283 -11.578 8.306 1.00 0.00 H new ATOM 2044 N ASP B 744 51.067 -10.493 1.844 1.00 0.00 N ATOM 2045 CA ASP B 744 50.281 -10.075 0.671 1.00 0.00 C ATOM 2046 C ASP B 744 50.314 -11.081 -0.509 1.00 0.00 C ATOM 2047 O ASP B 744 49.698 -10.836 -1.550 1.00 0.00 O ATOM 2048 CB ASP B 744 50.700 -8.657 0.261 1.00 0.00 C ATOM 2049 CG ASP B 744 52.161 -8.592 -0.217 1.00 0.00 C ATOM 2050 OD1 ASP B 744 53.068 -8.486 0.643 1.00 0.00 O ATOM 2051 OD2 ASP B 744 52.404 -8.645 -1.444 1.00 0.00 O ATOM 0 H ASP B 744 51.915 -9.942 1.980 1.00 0.00 H new ATOM 0 HA ASP B 744 49.231 -10.064 0.964 1.00 0.00 H new ATOM 0 HB2 ASP B 744 50.044 -8.303 -0.535 1.00 0.00 H new ATOM 0 HB3 ASP B 744 50.567 -7.983 1.107 1.00 0.00 H new ATOM 2056 N SER B 745 51.009 -12.215 -0.344 1.00 0.00 N ATOM 2057 CA SER B 745 51.169 -13.311 -1.313 1.00 0.00 C ATOM 2058 C SER B 745 50.873 -14.710 -0.734 1.00 0.00 C ATOM 2059 O SER B 745 51.080 -15.702 -1.435 1.00 0.00 O ATOM 2060 CB SER B 745 52.582 -13.283 -1.919 1.00 0.00 C ATOM 2061 OG SER B 745 52.781 -12.124 -2.714 1.00 0.00 O ATOM 0 H SER B 745 51.507 -12.405 0.526 1.00 0.00 H new ATOM 0 HA SER B 745 50.421 -13.137 -2.087 1.00 0.00 H new ATOM 0 HB2 SER B 745 53.323 -13.310 -1.120 1.00 0.00 H new ATOM 0 HB3 SER B 745 52.737 -14.174 -2.527 1.00 0.00 H new ATOM 0 HG SER B 745 53.688 -12.133 -3.084 1.00 0.00 H new ATOM 2067 N MET B 746 50.351 -14.843 0.498 1.00 0.00 N ATOM 2068 CA MET B 746 49.987 -16.155 1.095 1.00 0.00 C ATOM 2069 C MET B 746 49.003 -16.964 0.226 1.00 0.00 C ATOM 2070 O MET B 746 48.967 -18.191 0.306 1.00 0.00 O ATOM 2071 CB MET B 746 49.370 -15.990 2.492 1.00 0.00 C ATOM 2072 CG MET B 746 50.279 -15.347 3.545 1.00 0.00 C ATOM 2073 SD MET B 746 52.074 -15.353 3.265 1.00 0.00 S ATOM 2074 CE MET B 746 52.433 -17.093 3.515 1.00 0.00 C ATOM 0 H MET B 746 50.167 -14.050 1.113 1.00 0.00 H new ATOM 0 HA MET B 746 50.926 -16.705 1.161 1.00 0.00 H new ATOM 0 HB2 MET B 746 48.466 -15.388 2.402 1.00 0.00 H new ATOM 0 HB3 MET B 746 49.064 -16.972 2.853 1.00 0.00 H new ATOM 0 HG2 MET B 746 49.966 -14.310 3.663 1.00 0.00 H new ATOM 0 HG3 MET B 746 50.091 -15.847 4.495 1.00 0.00 H new ATOM 0 HE1 MET B 746 53.351 -17.355 2.988 1.00 0.00 H new ATOM 0 HE2 MET B 746 52.558 -17.289 4.580 1.00 0.00 H new ATOM 0 HE3 MET B 746 51.609 -17.694 3.129 1.00 0.00 H new ATOM 2084 N MET B 747 48.209 -16.271 -0.602 1.00 0.00 N ATOM 2085 CA MET B 747 47.176 -16.833 -1.488 1.00 0.00 C ATOM 2086 C MET B 747 47.617 -16.961 -2.962 1.00 0.00 C ATOM 2087 O MET B 747 46.843 -17.436 -3.794 1.00 0.00 O ATOM 2088 CB MET B 747 45.902 -15.963 -1.407 1.00 0.00 C ATOM 2089 CG MET B 747 45.621 -15.357 -0.024 1.00 0.00 C ATOM 2090 SD MET B 747 43.978 -14.627 0.157 1.00 0.00 S ATOM 2091 CE MET B 747 44.177 -13.900 1.806 1.00 0.00 C ATOM 0 H MET B 747 48.271 -15.256 -0.677 1.00 0.00 H new ATOM 0 HA MET B 747 46.985 -17.846 -1.135 1.00 0.00 H new ATOM 0 HB2 MET B 747 45.985 -15.154 -2.132 1.00 0.00 H new ATOM 0 HB3 MET B 747 45.046 -16.569 -1.703 1.00 0.00 H new ATOM 0 HG2 MET B 747 45.744 -16.134 0.731 1.00 0.00 H new ATOM 0 HG3 MET B 747 46.369 -14.591 0.182 1.00 0.00 H new ATOM 0 HE1 MET B 747 43.745 -12.899 1.817 1.00 0.00 H new ATOM 0 HE2 MET B 747 43.669 -14.523 2.542 1.00 0.00 H new ATOM 0 HE3 MET B 747 45.237 -13.840 2.052 1.00 0.00 H new ATOM 2101 N ASN B 748 48.843 -16.541 -3.308 1.00 0.00 N ATOM 2102 CA ASN B 748 49.378 -16.539 -4.681 1.00 0.00 C ATOM 2103 C ASN B 748 49.442 -17.927 -5.364 1.00 0.00 C ATOM 2104 O ASN B 748 49.586 -18.009 -6.585 1.00 0.00 O ATOM 2105 CB ASN B 748 50.752 -15.839 -4.658 1.00 0.00 C ATOM 2106 CG ASN B 748 51.278 -15.518 -6.052 1.00 0.00 C ATOM 2107 OD1 ASN B 748 50.612 -14.893 -6.866 1.00 0.00 O ATOM 2108 ND2 ASN B 748 52.491 -15.913 -6.370 1.00 0.00 N ATOM 0 H ASN B 748 49.509 -16.183 -2.623 1.00 0.00 H new ATOM 0 HA ASN B 748 48.674 -15.990 -5.306 1.00 0.00 H new ATOM 0 HB2 ASN B 748 50.674 -14.916 -4.083 1.00 0.00 H new ATOM 0 HB3 ASN B 748 51.470 -16.476 -4.142 1.00 0.00 H new ATOM 0 HD21 ASN B 748 52.872 -15.698 -7.291 1.00 0.00 H new ATOM 0 HD22 ASN B 748 53.051 -16.434 -5.695 1.00 0.00 H new ATOM 2115 N THR B 749 49.315 -19.018 -4.601 1.00 0.00 N ATOM 2116 CA THR B 749 49.309 -20.409 -5.098 1.00 0.00 C ATOM 2117 C THR B 749 48.197 -20.674 -6.130 1.00 0.00 C ATOM 2118 O THR B 749 48.362 -21.506 -7.023 1.00 0.00 O ATOM 2119 CB THR B 749 49.135 -21.386 -3.921 1.00 0.00 C ATOM 2120 OG1 THR B 749 49.972 -21.018 -2.841 1.00 0.00 O ATOM 2121 CG2 THR B 749 49.491 -22.823 -4.288 1.00 0.00 C ATOM 0 H THR B 749 49.210 -18.962 -3.588 1.00 0.00 H new ATOM 0 HA THR B 749 50.267 -20.565 -5.595 1.00 0.00 H new ATOM 0 HB THR B 749 48.081 -21.333 -3.649 1.00 0.00 H new ATOM 0 HG1 THR B 749 49.677 -21.478 -2.027 1.00 0.00 H new ATOM 0 HG21 THR B 749 49.349 -23.466 -3.419 1.00 0.00 H new ATOM 0 HG22 THR B 749 48.847 -23.162 -5.099 1.00 0.00 H new ATOM 0 HG23 THR B 749 50.532 -22.870 -4.608 1.00 0.00 H new ATOM 2129 N VAL B 750 47.072 -19.954 -6.024 1.00 0.00 N ATOM 2130 CA VAL B 750 45.894 -20.034 -6.911 1.00 0.00 C ATOM 2131 C VAL B 750 46.263 -19.979 -8.399 1.00 0.00 C ATOM 2132 O VAL B 750 45.751 -20.763 -9.209 1.00 0.00 O ATOM 2133 CB VAL B 750 44.875 -18.936 -6.540 1.00 0.00 C ATOM 2134 CG1 VAL B 750 45.353 -17.523 -6.906 1.00 0.00 C ATOM 2135 CG2 VAL B 750 43.508 -19.181 -7.189 1.00 0.00 C ATOM 0 H VAL B 750 46.948 -19.265 -5.282 1.00 0.00 H new ATOM 0 HA VAL B 750 45.434 -21.010 -6.754 1.00 0.00 H new ATOM 0 HB VAL B 750 44.779 -18.994 -5.456 1.00 0.00 H new ATOM 0 HG11 VAL B 750 44.593 -16.796 -6.620 1.00 0.00 H new ATOM 0 HG12 VAL B 750 46.281 -17.305 -6.377 1.00 0.00 H new ATOM 0 HG13 VAL B 750 45.525 -17.464 -7.981 1.00 0.00 H new ATOM 0 HG21 VAL B 750 42.821 -18.385 -6.902 1.00 0.00 H new ATOM 0 HG22 VAL B 750 43.617 -19.192 -8.273 1.00 0.00 H new ATOM 0 HG23 VAL B 750 43.113 -20.140 -6.854 1.00 0.00 H new TER 2145 VAL B 750 HETATM 2146 ZN ZN A 93 31.461 -27.285 14.881 1.00 0.00 ZN HETATM 2147 ZN ZN A 94 37.989 -10.954 2.043 1.00 0.00 ZN HETATM 2148 ZN ZN A 95 48.835 -26.902 10.745 1.00 0.00 ZN