USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=37 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 180:sc= 0 USER MOD Set 1.2: B 747 MET CE :methyl 165:sc= -1.17 (180deg=-2.15) USER MOD Set 2.1: A 87 LYS NZ :NH3+ 157:sc= 2.01 (180deg=0.886) USER MOD Set 2.2: B 745 SER OG : rot 180:sc= 0.826 USER MOD Set 3.1: A 74 ASN : amide:sc= 0.0911 K(o=0.098,f=-2!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ -146:sc= 0.00673 (180deg=0) USER MOD Set 4.1: A 16 SER OG : rot 77:sc= 1.13 USER MOD Set 4.2: A 32 SER OG : rot 162:sc= 0.662 USER MOD Single : A 1 SER N :NH3+ -95:sc= -0.0217 (180deg=-1.04) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00582 USER MOD Single : A 3 GLN : amide:sc= 1.26 K(o=1.3,f=-6.5!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 78:sc= 1.18 USER MOD Single : A 11 GLN : amide:sc= 0.709 K(o=0.71,f=-0.009) USER MOD Single : A 13 CYS SG : rot 180:sc= 0.00934 USER MOD Single : A 15 GLN : amide:sc= -0.0916 X(o=-0.092,f=-0.092) USER MOD Single : A 21 CYS SG : rot 79:sc= 0.0172 USER MOD Single : A 22 GLN : amide:sc= 0.902 K(o=0.9,f=0) USER MOD Single : A 25 ASN : amide:sc= 1.24 K(o=1.2,f=0) USER MOD Single : A 27 ASN : amide:sc= 0.319 K(o=0.32,f=-3.6!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.2 K(o=1.2,f=-0.36) USER MOD Single : A 35 LYS NZ :NH3+ 151:sc= 0.67 (180deg=0.205) USER MOD Single : A 36 MET CE :methyl 174:sc= -0.407 (180deg=-0.495) USER MOD Single : A 37 LYS NZ :NH3+ 164:sc= 2.69 (180deg=1.86) USER MOD Single : A 41 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 43 THR OG1 : rot -37:sc= 1.38 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 150:sc= 1.85 (180deg=-0.0789) USER MOD Single : A 51 ASN : amide:sc= 0.684 K(o=0.68,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 1 K(o=1,f=-1.4) USER MOD Single : A 64 CYS SG : rot 80:sc= 0.263 USER MOD Single : A 65 CYS SG : rot 71:sc= -0.423 USER MOD Single : A 66 TYR OH : rot -15:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 179:sc= 0.955 (180deg=0.955) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= 0.669 K(o=0.67,f=0) USER MOD Single : A 83 ASN : amide:sc= 0.532 K(o=0.53,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -176:sc= 2.71 (180deg=2.43) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= -0.0576 K(o=-0.058,f=-1.5!) USER MOD Single : A 91 GLN : amide:sc= 0.503 K(o=0.5,f=0) USER MOD Single : A 92 GLN : amide:sc= 0.906 K(o=0.91,f=0) USER MOD Single : B 707 SER OG : rot 180:sc= 0 USER MOD Single : B 708 HIS : no HE2:sc= 0.535 K(o=0.53,f=-2.1!) 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= 0.561 K(o=0.56,f=-2.7!) USER MOD Single : B 715 SER OG : rot 180:sc= 0 USER MOD Single : B 718 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 719 THR OG1 : rot 180:sc= 0 USER MOD Single : B 720 THR OG1 : rot 180:sc= 0.0206 USER MOD Single : B 722 ASN : amide:sc= -0.035 X(o=-0.035,f=-0.014) USER MOD Single : B 726 MET CE :methyl 172:sc= -0.0213 (180deg=-0.126) USER MOD Single : B 727 SER OG : rot 180:sc= 0.107 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 746 MET CE :methyl -120:sc= -3.66 (180deg=-7.24!) USER MOD Single : B 748 ASN : amide:sc= 0.832 K(o=0.83,f=-3.1) USER MOD Single : B 749 THR OG1 : rot -45:sc= 0.324 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 51.133 -14.228 33.691 1.00 0.00 N ATOM 2 CA SER A 1 50.855 -14.124 32.254 1.00 0.00 C ATOM 3 C SER A 1 50.846 -12.658 31.763 1.00 0.00 C ATOM 4 O SER A 1 49.786 -12.144 31.388 1.00 0.00 O ATOM 5 CB SER A 1 49.537 -14.848 31.921 1.00 0.00 C ATOM 6 OG SER A 1 49.577 -16.208 32.339 1.00 0.00 O ATOM 0 H1 SER A 1 52.149 -14.395 33.837 1.00 0.00 H new ATOM 0 H2 SER A 1 50.856 -13.344 34.163 1.00 0.00 H new ATOM 0 H3 SER A 1 50.591 -15.019 34.093 1.00 0.00 H new ATOM 0 HA SER A 1 51.666 -14.615 31.716 1.00 0.00 H new ATOM 0 HB2 SER A 1 48.706 -14.339 32.409 1.00 0.00 H new ATOM 0 HB3 SER A 1 49.354 -14.800 30.848 1.00 0.00 H new ATOM 0 HG SER A 1 48.728 -16.644 32.117 1.00 0.00 H new ATOM 12 N PRO A 2 51.996 -11.947 31.781 1.00 0.00 N ATOM 13 CA PRO A 2 52.084 -10.527 31.419 1.00 0.00 C ATOM 14 C PRO A 2 51.830 -10.262 29.927 1.00 0.00 C ATOM 15 O PRO A 2 50.887 -9.556 29.566 1.00 0.00 O ATOM 16 CB PRO A 2 53.483 -10.085 31.873 1.00 0.00 C ATOM 17 CG PRO A 2 54.312 -11.369 31.829 1.00 0.00 C ATOM 18 CD PRO A 2 53.301 -12.456 32.188 1.00 0.00 C ATOM 0 HA PRO A 2 51.301 -9.948 31.909 1.00 0.00 H new ATOM 0 HB2 PRO A 2 53.894 -9.322 31.212 1.00 0.00 H new ATOM 0 HB3 PRO A 2 53.461 -9.659 32.876 1.00 0.00 H new ATOM 0 HG2 PRO A 2 54.746 -11.534 30.843 1.00 0.00 H new ATOM 0 HG3 PRO A 2 55.138 -11.338 32.539 1.00 0.00 H new ATOM 0 HD2 PRO A 2 53.533 -13.389 31.674 1.00 0.00 H new ATOM 0 HD3 PRO A 2 53.320 -12.668 33.257 1.00 0.00 H new ATOM 26 N GLN A 3 52.656 -10.846 29.058 1.00 0.00 N ATOM 27 CA GLN A 3 52.522 -10.786 27.592 1.00 0.00 C ATOM 28 C GLN A 3 51.658 -11.954 27.081 1.00 0.00 C ATOM 29 O GLN A 3 50.979 -11.865 26.058 1.00 0.00 O ATOM 30 CB GLN A 3 53.920 -10.853 26.947 1.00 0.00 C ATOM 31 CG GLN A 3 54.892 -9.750 27.407 1.00 0.00 C ATOM 32 CD GLN A 3 54.453 -8.356 26.976 1.00 0.00 C ATOM 33 OE1 GLN A 3 54.608 -7.963 25.827 1.00 0.00 O ATOM 34 NE2 GLN A 3 53.892 -7.552 27.854 1.00 0.00 N ATOM 0 H GLN A 3 53.463 -11.392 29.359 1.00 0.00 H new ATOM 0 HA GLN A 3 52.036 -9.849 27.320 1.00 0.00 H new ATOM 0 HB2 GLN A 3 54.362 -11.824 27.169 1.00 0.00 H new ATOM 0 HB3 GLN A 3 53.809 -10.793 25.864 1.00 0.00 H new ATOM 0 HG2 GLN A 3 54.978 -9.779 28.493 1.00 0.00 H new ATOM 0 HG3 GLN A 3 55.883 -9.955 27.003 1.00 0.00 H new ATOM 0 HE21 GLN A 3 53.755 -7.863 28.816 1.00 0.00 H new ATOM 0 HE22 GLN A 3 53.594 -6.618 27.573 1.00 0.00 H new ATOM 43 N GLU A 4 51.715 -13.071 27.810 1.00 0.00 N ATOM 44 CA GLU A 4 51.056 -14.348 27.533 1.00 0.00 C ATOM 45 C GLU A 4 49.530 -14.282 27.428 1.00 0.00 C ATOM 46 O GLU A 4 48.960 -15.104 26.718 1.00 0.00 O ATOM 47 CB GLU A 4 51.465 -15.359 28.618 1.00 0.00 C ATOM 48 CG GLU A 4 52.870 -15.955 28.454 1.00 0.00 C ATOM 49 CD GLU A 4 53.974 -14.906 28.245 1.00 0.00 C ATOM 50 OE1 GLU A 4 54.122 -14.001 29.104 1.00 0.00 O ATOM 51 OE2 GLU A 4 54.657 -14.962 27.195 1.00 0.00 O ATOM 0 H GLU A 4 52.262 -13.109 28.670 1.00 0.00 H new ATOM 0 HA GLU A 4 51.392 -14.658 26.543 1.00 0.00 H new ATOM 0 HB2 GLU A 4 51.406 -14.870 29.590 1.00 0.00 H new ATOM 0 HB3 GLU A 4 50.740 -16.173 28.626 1.00 0.00 H new ATOM 0 HG2 GLU A 4 53.108 -16.547 29.338 1.00 0.00 H new ATOM 0 HG3 GLU A 4 52.867 -16.638 27.605 1.00 0.00 H new ATOM 58 N SER A 5 48.849 -13.329 28.072 1.00 0.00 N ATOM 59 CA SER A 5 47.381 -13.210 28.002 1.00 0.00 C ATOM 60 C SER A 5 46.852 -13.203 26.560 1.00 0.00 C ATOM 61 O SER A 5 45.937 -13.964 26.231 1.00 0.00 O ATOM 62 CB SER A 5 46.918 -11.962 28.762 1.00 0.00 C ATOM 63 OG SER A 5 47.544 -10.795 28.246 1.00 0.00 O ATOM 0 H SER A 5 49.293 -12.619 28.655 1.00 0.00 H new ATOM 0 HA SER A 5 46.962 -14.097 28.477 1.00 0.00 H new ATOM 0 HB2 SER A 5 45.835 -11.864 28.684 1.00 0.00 H new ATOM 0 HB3 SER A 5 47.153 -12.068 29.821 1.00 0.00 H new ATOM 0 HG SER A 5 47.233 -10.010 28.744 1.00 0.00 H new ATOM 69 N ARG A 6 47.458 -12.398 25.675 1.00 0.00 N ATOM 70 CA ARG A 6 47.109 -12.331 24.245 1.00 0.00 C ATOM 71 C ARG A 6 47.457 -13.638 23.523 1.00 0.00 C ATOM 72 O ARG A 6 46.617 -14.208 22.830 1.00 0.00 O ATOM 73 CB ARG A 6 47.804 -11.122 23.581 1.00 0.00 C ATOM 74 CG ARG A 6 47.585 -9.816 24.366 1.00 0.00 C ATOM 75 CD ARG A 6 47.775 -8.549 23.526 1.00 0.00 C ATOM 76 NE ARG A 6 49.137 -8.379 22.981 1.00 0.00 N ATOM 77 CZ ARG A 6 49.519 -7.415 22.158 1.00 0.00 C ATOM 78 NH1 ARG A 6 48.757 -6.424 21.807 1.00 0.00 N ATOM 79 NH2 ARG A 6 50.697 -7.406 21.623 1.00 0.00 N ATOM 0 H ARG A 6 48.215 -11.766 25.934 1.00 0.00 H new ATOM 0 HA ARG A 6 46.031 -12.195 24.163 1.00 0.00 H new ATOM 0 HB2 ARG A 6 48.873 -11.320 23.501 1.00 0.00 H new ATOM 0 HB3 ARG A 6 47.425 -11.001 22.566 1.00 0.00 H new ATOM 0 HG2 ARG A 6 46.577 -9.817 24.781 1.00 0.00 H new ATOM 0 HG3 ARG A 6 48.276 -9.789 25.208 1.00 0.00 H new ATOM 0 HD2 ARG A 6 47.065 -8.566 22.699 1.00 0.00 H new ATOM 0 HD3 ARG A 6 47.531 -7.681 24.139 1.00 0.00 H new ATOM 0 HE ARG A 6 49.842 -9.061 23.262 1.00 0.00 H new ATOM 0 HH11 ARG A 6 47.806 -6.358 22.170 1.00 0.00 H new ATOM 0 HH12 ARG A 6 49.109 -5.711 21.168 1.00 0.00 H new ATOM 0 HH21 ARG A 6 51.358 -8.154 21.832 1.00 0.00 H new ATOM 0 HH22 ARG A 6 50.965 -6.651 20.992 1.00 0.00 H new ATOM 93 N ARG A 7 48.684 -14.136 23.733 1.00 0.00 N ATOM 94 CA ARG A 7 49.242 -15.376 23.146 1.00 0.00 C ATOM 95 C ARG A 7 48.362 -16.598 23.393 1.00 0.00 C ATOM 96 O ARG A 7 48.063 -17.357 22.471 1.00 0.00 O ATOM 97 CB ARG A 7 50.654 -15.632 23.699 1.00 0.00 C ATOM 98 CG ARG A 7 51.586 -14.449 23.421 1.00 0.00 C ATOM 99 CD ARG A 7 52.981 -14.660 23.999 1.00 0.00 C ATOM 100 NE ARG A 7 53.817 -13.535 23.559 1.00 0.00 N ATOM 101 CZ ARG A 7 54.965 -13.074 24.000 1.00 0.00 C ATOM 102 NH1 ARG A 7 55.607 -13.547 25.027 1.00 0.00 N ATOM 103 NH2 ARG A 7 55.469 -12.063 23.356 1.00 0.00 N ATOM 0 H ARG A 7 49.351 -13.667 24.345 1.00 0.00 H new ATOM 0 HA ARG A 7 49.283 -15.223 22.068 1.00 0.00 H new ATOM 0 HB2 ARG A 7 50.599 -15.809 24.773 1.00 0.00 H new ATOM 0 HB3 ARG A 7 51.065 -16.535 23.247 1.00 0.00 H new ATOM 0 HG2 ARG A 7 51.661 -14.294 22.345 1.00 0.00 H new ATOM 0 HG3 ARG A 7 51.154 -13.542 23.844 1.00 0.00 H new ATOM 0 HD2 ARG A 7 52.942 -14.706 25.087 1.00 0.00 H new ATOM 0 HD3 ARG A 7 53.399 -15.606 23.655 1.00 0.00 H new ATOM 0 HE ARG A 7 53.437 -13.018 22.767 1.00 0.00 H new ATOM 0 HH11 ARG A 7 55.222 -14.332 25.552 1.00 0.00 H new ATOM 0 HH12 ARG A 7 56.496 -13.133 25.308 1.00 0.00 H new ATOM 0 HH21 ARG A 7 54.975 -11.671 22.555 1.00 0.00 H new ATOM 0 HH22 ARG A 7 56.359 -11.662 23.652 1.00 0.00 H new ATOM 117 N LEU A 8 47.946 -16.765 24.646 1.00 0.00 N ATOM 118 CA LEU A 8 47.089 -17.849 25.125 1.00 0.00 C ATOM 119 C LEU A 8 45.640 -17.704 24.631 1.00 0.00 C ATOM 120 O LEU A 8 45.010 -18.708 24.299 1.00 0.00 O ATOM 121 CB LEU A 8 47.172 -17.894 26.662 1.00 0.00 C ATOM 122 CG LEU A 8 48.576 -18.244 27.209 1.00 0.00 C ATOM 123 CD1 LEU A 8 48.576 -18.134 28.732 1.00 0.00 C ATOM 124 CD2 LEU A 8 49.049 -19.643 26.814 1.00 0.00 C ATOM 0 H LEU A 8 48.209 -16.119 25.390 1.00 0.00 H new ATOM 0 HA LEU A 8 47.444 -18.795 24.715 1.00 0.00 H new ATOM 0 HB2 LEU A 8 46.870 -16.925 27.060 1.00 0.00 H new ATOM 0 HB3 LEU A 8 46.456 -18.628 27.032 1.00 0.00 H new ATOM 0 HG LEU A 8 49.268 -17.530 26.763 1.00 0.00 H new ATOM 0 HD11 LEU A 8 49.566 -18.381 29.115 1.00 0.00 H new ATOM 0 HD12 LEU A 8 48.318 -17.116 29.023 1.00 0.00 H new ATOM 0 HD13 LEU A 8 47.844 -18.827 29.147 1.00 0.00 H new ATOM 0 HD21 LEU A 8 50.040 -19.823 27.230 1.00 0.00 H new ATOM 0 HD22 LEU A 8 48.352 -20.386 27.202 1.00 0.00 H new ATOM 0 HD23 LEU A 8 49.093 -19.719 25.728 1.00 0.00 H new ATOM 136 N SER A 9 45.118 -16.476 24.520 1.00 0.00 N ATOM 137 CA SER A 9 43.765 -16.235 23.989 1.00 0.00 C ATOM 138 C SER A 9 43.655 -16.637 22.510 1.00 0.00 C ATOM 139 O SER A 9 42.672 -17.265 22.117 1.00 0.00 O ATOM 140 CB SER A 9 43.345 -14.772 24.155 1.00 0.00 C ATOM 141 OG SER A 9 43.291 -14.413 25.526 1.00 0.00 O ATOM 0 H SER A 9 45.614 -15.627 24.792 1.00 0.00 H new ATOM 0 HA SER A 9 43.089 -16.861 24.572 1.00 0.00 H new ATOM 0 HB2 SER A 9 44.051 -14.126 23.633 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.369 -14.615 23.695 1.00 0.00 H new ATOM 0 HG SER A 9 44.199 -14.253 25.858 1.00 0.00 H new ATOM 147 N ILE A 10 44.680 -16.342 21.697 1.00 0.00 N ATOM 148 CA ILE A 10 44.735 -16.710 20.267 1.00 0.00 C ATOM 149 C ILE A 10 44.629 -18.233 20.069 1.00 0.00 C ATOM 150 O ILE A 10 43.989 -18.687 19.118 1.00 0.00 O ATOM 151 CB ILE A 10 46.015 -16.130 19.622 1.00 0.00 C ATOM 152 CG1 ILE A 10 45.992 -14.583 19.633 1.00 0.00 C ATOM 153 CG2 ILE A 10 46.180 -16.589 18.162 1.00 0.00 C ATOM 154 CD1 ILE A 10 47.393 -13.962 19.607 1.00 0.00 C ATOM 0 H ILE A 10 45.506 -15.835 22.014 1.00 0.00 H new ATOM 0 HA ILE A 10 43.873 -16.274 19.763 1.00 0.00 H new ATOM 0 HB ILE A 10 46.850 -16.501 20.217 1.00 0.00 H new ATOM 0 HG12 ILE A 10 45.427 -14.228 18.771 1.00 0.00 H new ATOM 0 HG13 ILE A 10 45.465 -14.239 20.523 1.00 0.00 H new ATOM 0 HG21 ILE A 10 47.091 -16.159 17.746 1.00 0.00 H new ATOM 0 HG22 ILE A 10 46.243 -17.677 18.127 1.00 0.00 H new ATOM 0 HG23 ILE A 10 45.322 -16.257 17.577 1.00 0.00 H new ATOM 0 HD11 ILE A 10 47.310 -12.875 19.616 1.00 0.00 H new ATOM 0 HD12 ILE A 10 47.953 -14.290 20.483 1.00 0.00 H new ATOM 0 HD13 ILE A 10 47.914 -14.278 18.704 1.00 0.00 H new ATOM 166 N GLN A 11 45.195 -19.042 20.977 1.00 0.00 N ATOM 167 CA GLN A 11 45.092 -20.511 20.920 1.00 0.00 C ATOM 168 C GLN A 11 43.628 -20.998 20.884 1.00 0.00 C ATOM 169 O GLN A 11 43.314 -21.964 20.186 1.00 0.00 O ATOM 170 CB GLN A 11 45.803 -21.196 22.103 1.00 0.00 C ATOM 171 CG GLN A 11 47.236 -20.724 22.381 1.00 0.00 C ATOM 172 CD GLN A 11 48.153 -20.774 21.163 1.00 0.00 C ATOM 173 OE1 GLN A 11 48.296 -21.783 20.486 1.00 0.00 O ATOM 174 NE2 GLN A 11 48.802 -19.679 20.833 1.00 0.00 N ATOM 0 H GLN A 11 45.736 -18.699 21.771 1.00 0.00 H new ATOM 0 HA GLN A 11 45.587 -20.792 19.991 1.00 0.00 H new ATOM 0 HB2 GLN A 11 45.207 -21.038 23.002 1.00 0.00 H new ATOM 0 HB3 GLN A 11 45.823 -22.270 21.918 1.00 0.00 H new ATOM 0 HG2 GLN A 11 47.204 -19.702 22.757 1.00 0.00 H new ATOM 0 HG3 GLN A 11 47.664 -21.341 23.171 1.00 0.00 H new ATOM 0 HE21 GLN A 11 48.690 -18.832 21.390 1.00 0.00 H new ATOM 0 HE22 GLN A 11 49.417 -19.676 20.020 1.00 0.00 H new ATOM 183 N ARG A 12 42.714 -20.312 21.592 1.00 0.00 N ATOM 184 CA ARG A 12 41.271 -20.631 21.604 1.00 0.00 C ATOM 185 C ARG A 12 40.657 -20.425 20.217 1.00 0.00 C ATOM 186 O ARG A 12 39.887 -21.262 19.744 1.00 0.00 O ATOM 187 CB ARG A 12 40.525 -19.785 22.655 1.00 0.00 C ATOM 188 CG ARG A 12 41.130 -19.888 24.068 1.00 0.00 C ATOM 189 CD ARG A 12 40.318 -19.102 25.108 1.00 0.00 C ATOM 190 NE ARG A 12 38.997 -19.713 25.365 1.00 0.00 N ATOM 191 CZ ARG A 12 38.039 -19.223 26.135 1.00 0.00 C ATOM 192 NH1 ARG A 12 38.169 -18.094 26.773 1.00 0.00 N ATOM 193 NH2 ARG A 12 36.917 -19.870 26.282 1.00 0.00 N ATOM 0 H ARG A 12 42.956 -19.513 22.178 1.00 0.00 H new ATOM 0 HA ARG A 12 41.164 -21.681 21.876 1.00 0.00 H new ATOM 0 HB2 ARG A 12 40.531 -18.741 22.341 1.00 0.00 H new ATOM 0 HB3 ARG A 12 39.482 -20.101 22.691 1.00 0.00 H new ATOM 0 HG2 ARG A 12 41.179 -20.936 24.365 1.00 0.00 H new ATOM 0 HG3 ARG A 12 42.154 -19.514 24.051 1.00 0.00 H new ATOM 0 HD2 ARG A 12 40.880 -19.050 26.041 1.00 0.00 H new ATOM 0 HD3 ARG A 12 40.181 -18.078 24.761 1.00 0.00 H new ATOM 0 HE ARG A 12 38.805 -20.601 24.902 1.00 0.00 H new ATOM 0 HH11 ARG A 12 39.032 -17.556 26.688 1.00 0.00 H new ATOM 0 HH12 ARG A 12 37.408 -17.748 27.358 1.00 0.00 H new ATOM 0 HH21 ARG A 12 36.774 -20.759 25.802 1.00 0.00 H new ATOM 0 HH22 ARG A 12 36.182 -19.488 26.877 1.00 0.00 H new ATOM 207 N CYS A 13 41.046 -19.343 19.540 1.00 0.00 N ATOM 208 CA CYS A 13 40.625 -19.041 18.172 1.00 0.00 C ATOM 209 C CYS A 13 41.178 -20.092 17.193 1.00 0.00 C ATOM 210 O CYS A 13 40.450 -20.558 16.321 1.00 0.00 O ATOM 211 CB CYS A 13 41.081 -17.625 17.790 1.00 0.00 C ATOM 212 SG CYS A 13 40.505 -16.401 19.004 1.00 0.00 S ATOM 0 H CYS A 13 41.673 -18.641 19.934 1.00 0.00 H new ATOM 0 HA CYS A 13 39.537 -19.079 18.114 1.00 0.00 H new ATOM 0 HB2 CYS A 13 42.169 -17.595 17.727 1.00 0.00 H new ATOM 0 HB3 CYS A 13 40.697 -17.370 16.802 1.00 0.00 H new ATOM 0 HG CYS A 13 40.910 -15.217 18.652 1.00 0.00 H new ATOM 218 N ILE A 14 42.439 -20.514 17.360 1.00 0.00 N ATOM 219 CA ILE A 14 43.059 -21.569 16.540 1.00 0.00 C ATOM 220 C ILE A 14 42.276 -22.879 16.679 1.00 0.00 C ATOM 221 O ILE A 14 41.883 -23.455 15.666 1.00 0.00 O ATOM 222 CB ILE A 14 44.554 -21.722 16.901 1.00 0.00 C ATOM 223 CG1 ILE A 14 45.302 -20.478 16.384 1.00 0.00 C ATOM 224 CG2 ILE A 14 45.180 -22.995 16.300 1.00 0.00 C ATOM 225 CD1 ILE A 14 46.675 -20.243 17.002 1.00 0.00 C ATOM 0 H ILE A 14 43.063 -20.132 18.071 1.00 0.00 H new ATOM 0 HA ILE A 14 43.017 -21.285 15.488 1.00 0.00 H new ATOM 0 HB ILE A 14 44.639 -21.812 17.984 1.00 0.00 H new ATOM 0 HG12 ILE A 14 45.418 -20.566 15.304 1.00 0.00 H new ATOM 0 HG13 ILE A 14 44.683 -19.599 16.568 1.00 0.00 H new ATOM 0 HG21 ILE A 14 46.231 -23.053 16.584 1.00 0.00 H new ATOM 0 HG22 ILE A 14 44.653 -23.872 16.676 1.00 0.00 H new ATOM 0 HG23 ILE A 14 45.100 -22.962 15.213 1.00 0.00 H new ATOM 0 HD11 ILE A 14 47.118 -19.345 16.572 1.00 0.00 H new ATOM 0 HD12 ILE A 14 46.572 -20.117 18.080 1.00 0.00 H new ATOM 0 HD13 ILE A 14 47.318 -21.099 16.796 1.00 0.00 H new ATOM 237 N GLN A 15 41.981 -23.327 17.906 1.00 0.00 N ATOM 238 CA GLN A 15 41.173 -24.535 18.135 1.00 0.00 C ATOM 239 C GLN A 15 39.775 -24.411 17.509 1.00 0.00 C ATOM 240 O GLN A 15 39.286 -25.367 16.905 1.00 0.00 O ATOM 241 CB GLN A 15 41.056 -24.833 19.638 1.00 0.00 C ATOM 242 CG GLN A 15 42.370 -25.322 20.268 1.00 0.00 C ATOM 243 CD GLN A 15 42.766 -26.712 19.778 1.00 0.00 C ATOM 244 OE1 GLN A 15 43.661 -26.890 18.963 1.00 0.00 O ATOM 245 NE2 GLN A 15 42.101 -27.750 20.241 1.00 0.00 N ATOM 0 H GLN A 15 42.292 -22.868 18.762 1.00 0.00 H new ATOM 0 HA GLN A 15 41.685 -25.365 17.648 1.00 0.00 H new ATOM 0 HB2 GLN A 15 40.727 -23.931 20.155 1.00 0.00 H new ATOM 0 HB3 GLN A 15 40.285 -25.588 19.792 1.00 0.00 H new ATOM 0 HG2 GLN A 15 43.167 -24.616 20.034 1.00 0.00 H new ATOM 0 HG3 GLN A 15 42.266 -25.338 21.353 1.00 0.00 H new ATOM 0 HE21 GLN A 15 41.353 -27.614 20.921 1.00 0.00 H new ATOM 0 HE22 GLN A 15 42.334 -28.690 19.920 1.00 0.00 H new ATOM 254 N SER A 16 39.144 -23.236 17.608 1.00 0.00 N ATOM 255 CA SER A 16 37.828 -22.970 17.011 1.00 0.00 C ATOM 256 C SER A 16 37.857 -23.063 15.478 1.00 0.00 C ATOM 257 O SER A 16 36.978 -23.690 14.886 1.00 0.00 O ATOM 258 CB SER A 16 37.316 -21.591 17.428 1.00 0.00 C ATOM 259 OG SER A 16 37.089 -21.535 18.827 1.00 0.00 O ATOM 0 H SER A 16 39.534 -22.437 18.108 1.00 0.00 H new ATOM 0 HA SER A 16 37.152 -23.740 17.383 1.00 0.00 H new ATOM 0 HB2 SER A 16 38.041 -20.828 17.143 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.391 -21.366 16.897 1.00 0.00 H new ATOM 0 HG SER A 16 37.946 -21.443 19.294 1.00 0.00 H new ATOM 265 N LEU A 17 38.872 -22.484 14.821 1.00 0.00 N ATOM 266 CA LEU A 17 39.028 -22.561 13.364 1.00 0.00 C ATOM 267 C LEU A 17 39.354 -23.999 12.926 1.00 0.00 C ATOM 268 O LEU A 17 38.759 -24.496 11.973 1.00 0.00 O ATOM 269 CB LEU A 17 40.093 -21.549 12.899 1.00 0.00 C ATOM 270 CG LEU A 17 40.303 -21.493 11.370 1.00 0.00 C ATOM 271 CD1 LEU A 17 39.025 -21.199 10.571 1.00 0.00 C ATOM 272 CD2 LEU A 17 41.326 -20.409 11.032 1.00 0.00 C ATOM 0 H LEU A 17 39.607 -21.950 15.285 1.00 0.00 H new ATOM 0 HA LEU A 17 38.087 -22.294 12.884 1.00 0.00 H new ATOM 0 HB2 LEU A 17 39.810 -20.557 13.250 1.00 0.00 H new ATOM 0 HB3 LEU A 17 41.042 -21.797 13.374 1.00 0.00 H new ATOM 0 HG LEU A 17 40.647 -22.487 11.084 1.00 0.00 H new ATOM 0 HD11 LEU A 17 39.258 -21.177 9.507 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.288 -21.978 10.764 1.00 0.00 H new ATOM 0 HD13 LEU A 17 38.620 -20.233 10.874 1.00 0.00 H new ATOM 0 HD21 LEU A 17 41.473 -20.371 9.953 1.00 0.00 H new ATOM 0 HD22 LEU A 17 40.962 -19.443 11.383 1.00 0.00 H new ATOM 0 HD23 LEU A 17 42.274 -20.638 11.519 1.00 0.00 H new ATOM 284 N VAL A 18 40.245 -24.693 13.644 1.00 0.00 N ATOM 285 CA VAL A 18 40.595 -26.103 13.392 1.00 0.00 C ATOM 286 C VAL A 18 39.349 -26.992 13.489 1.00 0.00 C ATOM 287 O VAL A 18 39.131 -27.830 12.610 1.00 0.00 O ATOM 288 CB VAL A 18 41.710 -26.563 14.355 1.00 0.00 C ATOM 289 CG1 VAL A 18 41.862 -28.087 14.396 1.00 0.00 C ATOM 290 CG2 VAL A 18 43.062 -25.976 13.932 1.00 0.00 C ATOM 0 H VAL A 18 40.753 -24.287 14.430 1.00 0.00 H new ATOM 0 HA VAL A 18 40.982 -26.196 12.377 1.00 0.00 H new ATOM 0 HB VAL A 18 41.417 -26.208 15.343 1.00 0.00 H new ATOM 0 HG11 VAL A 18 42.660 -28.355 15.089 1.00 0.00 H new ATOM 0 HG12 VAL A 18 40.927 -28.537 14.728 1.00 0.00 H new ATOM 0 HG13 VAL A 18 42.108 -28.455 13.400 1.00 0.00 H new ATOM 0 HG21 VAL A 18 43.836 -26.311 14.622 1.00 0.00 H new ATOM 0 HG22 VAL A 18 43.305 -26.312 12.924 1.00 0.00 H new ATOM 0 HG23 VAL A 18 43.007 -24.888 13.949 1.00 0.00 H new ATOM 300 N HIS A 19 38.505 -26.797 14.510 1.00 0.00 N ATOM 301 CA HIS A 19 37.226 -27.501 14.644 1.00 0.00 C ATOM 302 C HIS A 19 36.351 -27.204 13.415 1.00 0.00 C ATOM 303 O HIS A 19 35.948 -28.133 12.718 1.00 0.00 O ATOM 304 CB HIS A 19 36.518 -27.101 15.954 1.00 0.00 C ATOM 305 CG HIS A 19 35.119 -27.673 16.109 1.00 0.00 C ATOM 306 ND1 HIS A 19 34.725 -28.688 16.954 1.00 0.00 N ATOM 307 CD2 HIS A 19 33.993 -27.271 15.435 1.00 0.00 C ATOM 308 CE1 HIS A 19 33.403 -28.892 16.778 1.00 0.00 C ATOM 309 NE2 HIS A 19 32.905 -28.055 15.849 1.00 0.00 N ATOM 0 H HIS A 19 38.692 -26.143 15.270 1.00 0.00 H new ATOM 0 HA HIS A 19 37.405 -28.575 14.691 1.00 0.00 H new ATOM 0 HB2 HIS A 19 37.127 -27.428 16.797 1.00 0.00 H new ATOM 0 HB3 HIS A 19 36.461 -26.014 16.005 1.00 0.00 H new ATOM 0 HD1 HIS A 19 35.328 -29.197 17.600 1.00 0.00 H new ATOM 0 HD2 HIS A 19 33.951 -26.478 14.703 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.821 -29.629 17.312 1.00 0.00 H new ATOM 317 N ALA A 20 36.100 -25.925 13.110 1.00 0.00 N ATOM 318 CA ALA A 20 35.281 -25.492 11.975 1.00 0.00 C ATOM 319 C ALA A 20 35.737 -26.044 10.611 1.00 0.00 C ATOM 320 O ALA A 20 34.901 -26.311 9.748 1.00 0.00 O ATOM 321 CB ALA A 20 35.251 -23.965 11.967 1.00 0.00 C ATOM 0 H ALA A 20 36.469 -25.148 13.658 1.00 0.00 H new ATOM 0 HA ALA A 20 34.282 -25.906 12.114 1.00 0.00 H new ATOM 0 HB1 ALA A 20 34.646 -23.617 11.129 1.00 0.00 H new ATOM 0 HB2 ALA A 20 34.819 -23.605 12.901 1.00 0.00 H new ATOM 0 HB3 ALA A 20 36.266 -23.582 11.865 1.00 0.00 H new ATOM 327 N CYS A 21 37.045 -26.238 10.412 1.00 0.00 N ATOM 328 CA CYS A 21 37.612 -26.804 9.184 1.00 0.00 C ATOM 329 C CYS A 21 37.254 -28.293 8.987 1.00 0.00 C ATOM 330 O CYS A 21 37.193 -28.772 7.851 1.00 0.00 O ATOM 331 CB CYS A 21 39.133 -26.600 9.216 1.00 0.00 C ATOM 332 SG CYS A 21 39.513 -24.840 8.963 1.00 0.00 S ATOM 0 H CYS A 21 37.750 -26.002 11.110 1.00 0.00 H new ATOM 0 HA CYS A 21 37.177 -26.284 8.331 1.00 0.00 H new ATOM 0 HB2 CYS A 21 39.536 -26.936 10.171 1.00 0.00 H new ATOM 0 HB3 CYS A 21 39.608 -27.201 8.440 1.00 0.00 H new ATOM 0 HG CYS A 21 39.325 -24.191 10.074 1.00 0.00 H new ATOM 338 N GLN A 22 36.971 -29.022 10.072 1.00 0.00 N ATOM 339 CA GLN A 22 36.577 -30.438 10.065 1.00 0.00 C ATOM 340 C GLN A 22 35.052 -30.588 10.187 1.00 0.00 C ATOM 341 O GLN A 22 34.467 -31.520 9.628 1.00 0.00 O ATOM 342 CB GLN A 22 37.261 -31.149 11.243 1.00 0.00 C ATOM 343 CG GLN A 22 38.792 -31.174 11.115 1.00 0.00 C ATOM 344 CD GLN A 22 39.446 -31.551 12.438 1.00 0.00 C ATOM 345 OE1 GLN A 22 39.725 -32.707 12.730 1.00 0.00 O ATOM 346 NE2 GLN A 22 39.707 -30.583 13.289 1.00 0.00 N ATOM 0 H GLN A 22 37.011 -28.630 11.013 1.00 0.00 H new ATOM 0 HA GLN A 22 36.887 -30.885 9.121 1.00 0.00 H new ATOM 0 HB2 GLN A 22 36.987 -30.649 12.172 1.00 0.00 H new ATOM 0 HB3 GLN A 22 36.890 -32.172 11.309 1.00 0.00 H new ATOM 0 HG2 GLN A 22 39.084 -31.888 10.345 1.00 0.00 H new ATOM 0 HG3 GLN A 22 39.149 -30.195 10.795 1.00 0.00 H new ATOM 0 HE21 GLN A 22 39.477 -29.618 13.051 1.00 0.00 H new ATOM 0 HE22 GLN A 22 40.140 -30.797 14.187 1.00 0.00 H new ATOM 355 N CYS A 23 34.418 -29.658 10.903 1.00 0.00 N ATOM 356 CA CYS A 23 32.986 -29.579 11.127 1.00 0.00 C ATOM 357 C CYS A 23 32.227 -29.217 9.836 1.00 0.00 C ATOM 358 O CYS A 23 32.780 -28.641 8.892 1.00 0.00 O ATOM 359 CB CYS A 23 32.751 -28.572 12.260 1.00 0.00 C ATOM 360 SG CYS A 23 31.054 -28.683 12.890 1.00 0.00 S ATOM 0 H CYS A 23 34.923 -28.902 11.364 1.00 0.00 H new ATOM 0 HA CYS A 23 32.590 -30.551 11.422 1.00 0.00 H new ATOM 0 HB2 CYS A 23 33.456 -28.760 13.070 1.00 0.00 H new ATOM 0 HB3 CYS A 23 32.943 -27.562 11.898 1.00 0.00 H new ATOM 365 N ARG A 24 30.938 -29.558 9.795 1.00 0.00 N ATOM 366 CA ARG A 24 30.034 -29.359 8.644 1.00 0.00 C ATOM 367 C ARG A 24 28.676 -28.756 9.018 1.00 0.00 C ATOM 368 O ARG A 24 27.924 -28.349 8.132 1.00 0.00 O ATOM 369 CB ARG A 24 29.851 -30.713 7.937 1.00 0.00 C ATOM 370 CG ARG A 24 31.151 -31.351 7.398 1.00 0.00 C ATOM 371 CD ARG A 24 31.847 -30.507 6.317 1.00 0.00 C ATOM 372 NE ARG A 24 33.150 -31.085 5.920 1.00 0.00 N ATOM 373 CZ ARG A 24 34.360 -30.616 6.190 1.00 0.00 C ATOM 374 NH1 ARG A 24 34.575 -29.583 6.950 1.00 0.00 N ATOM 375 NH2 ARG A 24 35.415 -31.187 5.681 1.00 0.00 N ATOM 0 H ARG A 24 30.471 -29.997 10.588 1.00 0.00 H new ATOM 0 HA ARG A 24 30.497 -28.628 7.981 1.00 0.00 H new ATOM 0 HB2 ARG A 24 29.385 -31.409 8.634 1.00 0.00 H new ATOM 0 HB3 ARG A 24 29.158 -30.581 7.106 1.00 0.00 H new ATOM 0 HG2 ARG A 24 31.841 -31.506 8.227 1.00 0.00 H new ATOM 0 HG3 ARG A 24 30.921 -32.334 6.988 1.00 0.00 H new ATOM 0 HD2 ARG A 24 31.201 -30.433 5.442 1.00 0.00 H new ATOM 0 HD3 ARG A 24 31.998 -29.493 6.689 1.00 0.00 H new ATOM 0 HE ARG A 24 33.113 -31.946 5.374 1.00 0.00 H new ATOM 0 HH11 ARG A 24 33.789 -29.089 7.373 1.00 0.00 H new ATOM 0 HH12 ARG A 24 35.529 -29.267 7.123 1.00 0.00 H new ATOM 0 HH21 ARG A 24 35.312 -31.999 5.072 1.00 0.00 H new ATOM 0 HH22 ARG A 24 36.344 -30.822 5.892 1.00 0.00 H new ATOM 389 N ASN A 25 28.374 -28.663 10.313 1.00 0.00 N ATOM 390 CA ASN A 25 27.151 -28.055 10.840 1.00 0.00 C ATOM 391 C ASN A 25 27.087 -26.563 10.457 1.00 0.00 C ATOM 392 O ASN A 25 27.932 -25.783 10.903 1.00 0.00 O ATOM 393 CB ASN A 25 27.142 -28.175 12.376 1.00 0.00 C ATOM 394 CG ASN A 25 27.177 -29.586 12.932 1.00 0.00 C ATOM 395 OD1 ASN A 25 26.537 -30.504 12.433 1.00 0.00 O ATOM 396 ND2 ASN A 25 27.925 -29.793 13.989 1.00 0.00 N ATOM 0 H ASN A 25 28.990 -29.018 11.045 1.00 0.00 H new ATOM 0 HA ASN A 25 26.291 -28.573 10.416 1.00 0.00 H new ATOM 0 HB2 ASN A 25 28.000 -27.629 12.768 1.00 0.00 H new ATOM 0 HB3 ASN A 25 26.248 -27.678 12.754 1.00 0.00 H new ATOM 0 HD21 ASN A 25 27.977 -30.724 14.402 1.00 0.00 H new ATOM 0 HD22 ASN A 25 28.454 -29.023 14.398 1.00 0.00 H new ATOM 403 N ALA A 26 26.092 -26.145 9.670 1.00 0.00 N ATOM 404 CA ALA A 26 25.914 -24.736 9.282 1.00 0.00 C ATOM 405 C ALA A 26 25.711 -23.797 10.492 1.00 0.00 C ATOM 406 O ALA A 26 26.021 -22.604 10.429 1.00 0.00 O ATOM 407 CB ALA A 26 24.736 -24.654 8.304 1.00 0.00 C ATOM 0 H ALA A 26 25.386 -26.770 9.282 1.00 0.00 H new ATOM 0 HA ALA A 26 26.829 -24.389 8.802 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.585 -23.618 8.002 1.00 0.00 H new ATOM 0 HB2 ALA A 26 24.951 -25.261 7.424 1.00 0.00 H new ATOM 0 HB3 ALA A 26 23.834 -25.026 8.789 1.00 0.00 H new ATOM 413 N ASN A 27 25.193 -24.346 11.597 1.00 0.00 N ATOM 414 CA ASN A 27 24.890 -23.646 12.844 1.00 0.00 C ATOM 415 C ASN A 27 25.249 -24.526 14.068 1.00 0.00 C ATOM 416 O ASN A 27 24.389 -24.829 14.902 1.00 0.00 O ATOM 417 CB ASN A 27 23.418 -23.184 12.803 1.00 0.00 C ATOM 418 CG ASN A 27 23.137 -22.264 11.623 1.00 0.00 C ATOM 419 OD1 ASN A 27 23.490 -21.093 11.613 1.00 0.00 O ATOM 420 ND2 ASN A 27 22.543 -22.771 10.566 1.00 0.00 N ATOM 0 H ASN A 27 24.964 -25.339 11.645 1.00 0.00 H new ATOM 0 HA ASN A 27 25.505 -22.753 12.951 1.00 0.00 H new ATOM 0 HB2 ASN A 27 22.767 -24.056 12.745 1.00 0.00 H new ATOM 0 HB3 ASN A 27 23.175 -22.666 13.731 1.00 0.00 H new ATOM 0 HD21 ASN A 27 22.379 -22.189 9.745 1.00 0.00 H new ATOM 0 HD22 ASN A 27 22.246 -23.747 10.567 1.00 0.00 H new ATOM 427 N CYS A 28 26.512 -24.978 14.137 1.00 0.00 N ATOM 428 CA CYS A 28 27.080 -25.831 15.191 1.00 0.00 C ATOM 429 C CYS A 28 26.806 -25.321 16.627 1.00 0.00 C ATOM 430 O CYS A 28 26.548 -24.133 16.846 1.00 0.00 O ATOM 431 CB CYS A 28 28.591 -25.940 14.922 1.00 0.00 C ATOM 432 SG CYS A 28 29.326 -27.426 15.675 1.00 0.00 S ATOM 0 H CYS A 28 27.200 -24.745 13.421 1.00 0.00 H new ATOM 0 HA CYS A 28 26.594 -26.806 15.150 1.00 0.00 H new ATOM 0 HB2 CYS A 28 28.765 -25.957 13.846 1.00 0.00 H new ATOM 0 HB3 CYS A 28 29.091 -25.053 15.312 1.00 0.00 H new ATOM 437 N SER A 29 26.887 -26.203 17.627 1.00 0.00 N ATOM 438 CA SER A 29 26.661 -25.853 19.038 1.00 0.00 C ATOM 439 C SER A 29 27.709 -24.892 19.625 1.00 0.00 C ATOM 440 O SER A 29 27.414 -24.202 20.607 1.00 0.00 O ATOM 441 CB SER A 29 26.552 -27.116 19.902 1.00 0.00 C ATOM 442 OG SER A 29 27.751 -27.876 19.867 1.00 0.00 O ATOM 0 H SER A 29 27.113 -27.187 17.483 1.00 0.00 H new ATOM 0 HA SER A 29 25.715 -25.312 19.056 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.328 -26.836 20.931 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.722 -27.728 19.550 1.00 0.00 H new ATOM 0 HG SER A 29 27.650 -28.673 20.429 1.00 0.00 H new ATOM 448 N LEU A 30 28.903 -24.789 19.026 1.00 0.00 N ATOM 449 CA LEU A 30 29.940 -23.840 19.443 1.00 0.00 C ATOM 450 C LEU A 30 29.667 -22.452 18.827 1.00 0.00 C ATOM 451 O LEU A 30 29.466 -22.354 17.613 1.00 0.00 O ATOM 452 CB LEU A 30 31.333 -24.345 19.023 1.00 0.00 C ATOM 453 CG LEU A 30 31.942 -25.408 19.956 1.00 0.00 C ATOM 454 CD1 LEU A 30 33.273 -25.888 19.373 1.00 0.00 C ATOM 455 CD2 LEU A 30 32.224 -24.858 21.360 1.00 0.00 C ATOM 0 H LEU A 30 29.177 -25.368 18.232 1.00 0.00 H new ATOM 0 HA LEU A 30 29.917 -23.754 20.529 1.00 0.00 H new ATOM 0 HB2 LEU A 30 31.266 -24.760 18.017 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.012 -23.494 18.972 1.00 0.00 H new ATOM 0 HG LEU A 30 31.217 -26.218 20.035 1.00 0.00 H new ATOM 0 HD11 LEU A 30 33.708 -26.641 20.030 1.00 0.00 H new ATOM 0 HD12 LEU A 30 33.103 -26.321 18.387 1.00 0.00 H new ATOM 0 HD13 LEU A 30 33.957 -25.044 19.285 1.00 0.00 H new ATOM 0 HD21 LEU A 30 32.653 -25.645 21.980 1.00 0.00 H new ATOM 0 HD22 LEU A 30 32.927 -24.028 21.291 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.293 -24.510 21.808 1.00 0.00 H new ATOM 467 N PRO A 31 29.678 -21.363 19.622 1.00 0.00 N ATOM 468 CA PRO A 31 29.416 -20.011 19.122 1.00 0.00 C ATOM 469 C PRO A 31 30.476 -19.525 18.121 1.00 0.00 C ATOM 470 O PRO A 31 30.157 -18.781 17.191 1.00 0.00 O ATOM 471 CB PRO A 31 29.350 -19.122 20.371 1.00 0.00 C ATOM 472 CG PRO A 31 30.185 -19.879 21.404 1.00 0.00 C ATOM 473 CD PRO A 31 29.928 -21.339 21.055 1.00 0.00 C ATOM 0 HA PRO A 31 28.486 -19.980 18.554 1.00 0.00 H new ATOM 0 HB2 PRO A 31 29.757 -18.130 20.177 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.323 -18.985 20.710 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.243 -19.627 21.330 1.00 0.00 H new ATOM 0 HG3 PRO A 31 29.873 -19.647 22.422 1.00 0.00 H new ATOM 0 HD2 PRO A 31 30.786 -21.960 21.313 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.074 -21.729 21.608 1.00 0.00 H new ATOM 481 N SER A 32 31.731 -19.957 18.279 1.00 0.00 N ATOM 482 CA SER A 32 32.837 -19.612 17.380 1.00 0.00 C ATOM 483 C SER A 32 32.769 -20.378 16.054 1.00 0.00 C ATOM 484 O SER A 32 32.898 -19.757 15.005 1.00 0.00 O ATOM 485 CB SER A 32 34.172 -19.861 18.081 1.00 0.00 C ATOM 486 OG SER A 32 34.219 -21.177 18.610 1.00 0.00 O ATOM 0 H SER A 32 32.012 -20.566 19.048 1.00 0.00 H new ATOM 0 HA SER A 32 32.749 -18.553 17.136 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.991 -19.717 17.377 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.309 -19.136 18.883 1.00 0.00 H new ATOM 0 HG SER A 32 35.149 -21.421 18.799 1.00 0.00 H new ATOM 492 N CYS A 33 32.527 -21.694 16.068 1.00 0.00 N ATOM 493 CA CYS A 33 32.389 -22.557 14.885 1.00 0.00 C ATOM 494 C CYS A 33 31.419 -21.967 13.834 1.00 0.00 C ATOM 495 O CYS A 33 31.752 -21.858 12.646 1.00 0.00 O ATOM 496 CB CYS A 33 31.954 -23.943 15.395 1.00 0.00 C ATOM 497 SG CYS A 33 31.791 -25.167 14.062 1.00 0.00 S ATOM 0 H CYS A 33 32.417 -22.210 16.941 1.00 0.00 H new ATOM 0 HA CYS A 33 33.338 -22.636 14.354 1.00 0.00 H new ATOM 0 HB2 CYS A 33 32.681 -24.301 16.124 1.00 0.00 H new ATOM 0 HB3 CYS A 33 31.001 -23.851 15.915 1.00 0.00 H new ATOM 502 N GLN A 34 30.249 -21.491 14.289 1.00 0.00 N ATOM 503 CA GLN A 34 29.238 -20.816 13.461 1.00 0.00 C ATOM 504 C GLN A 34 29.822 -19.644 12.649 1.00 0.00 C ATOM 505 O GLN A 34 29.481 -19.455 11.478 1.00 0.00 O ATOM 506 CB GLN A 34 28.126 -20.249 14.365 1.00 0.00 C ATOM 507 CG GLN A 34 27.301 -21.297 15.127 1.00 0.00 C ATOM 508 CD GLN A 34 26.344 -20.671 16.149 1.00 0.00 C ATOM 509 OE1 GLN A 34 26.000 -19.495 16.111 1.00 0.00 O ATOM 510 NE2 GLN A 34 25.861 -21.433 17.106 1.00 0.00 N ATOM 0 H GLN A 34 29.973 -21.567 15.268 1.00 0.00 H new ATOM 0 HA GLN A 34 28.853 -21.563 12.767 1.00 0.00 H new ATOM 0 HB2 GLN A 34 28.579 -19.571 15.088 1.00 0.00 H new ATOM 0 HB3 GLN A 34 27.449 -19.654 13.751 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.727 -21.890 14.414 1.00 0.00 H new ATOM 0 HG3 GLN A 34 27.976 -21.982 15.640 1.00 0.00 H new ATOM 0 HE21 GLN A 34 26.131 -22.415 17.161 1.00 0.00 H new ATOM 0 HE22 GLN A 34 25.217 -21.042 17.793 1.00 0.00 H new ATOM 519 N LYS A 35 30.710 -18.861 13.273 1.00 0.00 N ATOM 520 CA LYS A 35 31.375 -17.684 12.703 1.00 0.00 C ATOM 521 C LYS A 35 32.588 -18.077 11.865 1.00 0.00 C ATOM 522 O LYS A 35 32.755 -17.566 10.763 1.00 0.00 O ATOM 523 CB LYS A 35 31.734 -16.780 13.898 1.00 0.00 C ATOM 524 CG LYS A 35 32.447 -15.466 13.564 1.00 0.00 C ATOM 525 CD LYS A 35 32.714 -14.713 14.879 1.00 0.00 C ATOM 526 CE LYS A 35 33.481 -13.422 14.597 1.00 0.00 C ATOM 527 NZ LYS A 35 33.768 -12.647 15.831 1.00 0.00 N ATOM 0 H LYS A 35 30.998 -19.040 14.235 1.00 0.00 H new ATOM 0 HA LYS A 35 30.726 -17.150 12.009 1.00 0.00 H new ATOM 0 HB2 LYS A 35 30.816 -16.544 14.437 1.00 0.00 H new ATOM 0 HB3 LYS A 35 32.366 -17.349 14.580 1.00 0.00 H new ATOM 0 HG2 LYS A 35 33.384 -15.664 13.043 1.00 0.00 H new ATOM 0 HG3 LYS A 35 31.834 -14.860 12.897 1.00 0.00 H new ATOM 0 HD2 LYS A 35 31.770 -14.484 15.374 1.00 0.00 H new ATOM 0 HD3 LYS A 35 33.286 -15.344 15.559 1.00 0.00 H new ATOM 0 HE2 LYS A 35 34.419 -13.663 14.097 1.00 0.00 H new ATOM 0 HE3 LYS A 35 32.904 -12.803 13.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 34.643 -12.101 15.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 32.979 -11.997 16.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 33.882 -13.300 16.632 1.00 0.00 H new ATOM 541 N MET A 36 33.398 -19.024 12.336 1.00 0.00 N ATOM 542 CA MET A 36 34.580 -19.537 11.638 1.00 0.00 C ATOM 543 C MET A 36 34.246 -20.072 10.241 1.00 0.00 C ATOM 544 O MET A 36 34.939 -19.731 9.279 1.00 0.00 O ATOM 545 CB MET A 36 35.255 -20.612 12.499 1.00 0.00 C ATOM 546 CG MET A 36 35.945 -20.022 13.730 1.00 0.00 C ATOM 547 SD MET A 36 37.324 -18.922 13.298 1.00 0.00 S ATOM 548 CE MET A 36 38.178 -18.813 14.885 1.00 0.00 C ATOM 0 H MET A 36 33.247 -19.470 13.241 1.00 0.00 H new ATOM 0 HA MET A 36 35.272 -18.708 11.489 1.00 0.00 H new ATOM 0 HB2 MET A 36 34.509 -21.340 12.818 1.00 0.00 H new ATOM 0 HB3 MET A 36 35.988 -21.149 11.897 1.00 0.00 H new ATOM 0 HG2 MET A 36 35.215 -19.469 14.321 1.00 0.00 H new ATOM 0 HG3 MET A 36 36.315 -20.833 14.358 1.00 0.00 H new ATOM 0 HE1 MET A 36 39.108 -18.258 14.760 1.00 0.00 H new ATOM 0 HE2 MET A 36 37.542 -18.299 15.606 1.00 0.00 H new ATOM 0 HE3 MET A 36 38.400 -19.816 15.248 1.00 0.00 H new ATOM 558 N LYS A 37 33.162 -20.849 10.086 1.00 0.00 N ATOM 559 CA LYS A 37 32.722 -21.310 8.760 1.00 0.00 C ATOM 560 C LYS A 37 32.347 -20.139 7.847 1.00 0.00 C ATOM 561 O LYS A 37 32.768 -20.120 6.693 1.00 0.00 O ATOM 562 CB LYS A 37 31.548 -22.285 8.900 1.00 0.00 C ATOM 563 CG LYS A 37 31.998 -23.606 9.534 1.00 0.00 C ATOM 564 CD LYS A 37 30.813 -24.565 9.607 1.00 0.00 C ATOM 565 CE LYS A 37 31.246 -25.895 10.228 1.00 0.00 C ATOM 566 NZ LYS A 37 30.652 -26.080 11.562 1.00 0.00 N ATOM 0 H LYS A 37 32.577 -21.170 10.858 1.00 0.00 H new ATOM 0 HA LYS A 37 33.559 -21.829 8.294 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.767 -21.833 9.511 1.00 0.00 H new ATOM 0 HB3 LYS A 37 31.113 -22.479 7.919 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.802 -24.049 8.946 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.396 -23.426 10.533 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.013 -24.122 10.200 1.00 0.00 H new ATOM 0 HD3 LYS A 37 30.412 -24.735 8.608 1.00 0.00 H new ATOM 0 HE2 LYS A 37 30.948 -26.717 9.577 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.333 -25.927 10.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.732 -27.078 11.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 31.155 -25.485 12.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.649 -25.808 11.536 1.00 0.00 H new ATOM 580 N ARG A 38 31.619 -19.135 8.357 1.00 0.00 N ATOM 581 CA ARG A 38 31.224 -17.930 7.601 1.00 0.00 C ATOM 582 C ARG A 38 32.441 -17.084 7.199 1.00 0.00 C ATOM 583 O ARG A 38 32.461 -16.535 6.102 1.00 0.00 O ATOM 584 CB ARG A 38 30.193 -17.128 8.420 1.00 0.00 C ATOM 585 CG ARG A 38 28.841 -17.867 8.501 1.00 0.00 C ATOM 586 CD ARG A 38 27.906 -17.229 9.539 1.00 0.00 C ATOM 587 NE ARG A 38 26.536 -17.785 9.484 1.00 0.00 N ATOM 588 CZ ARG A 38 26.099 -18.952 9.933 1.00 0.00 C ATOM 589 NH1 ARG A 38 26.875 -19.846 10.471 1.00 0.00 N ATOM 590 NH2 ARG A 38 24.837 -19.254 9.854 1.00 0.00 N ATOM 0 H ARG A 38 31.282 -19.134 9.320 1.00 0.00 H new ATOM 0 HA ARG A 38 30.756 -18.235 6.665 1.00 0.00 H new ATOM 0 HB2 ARG A 38 30.578 -16.958 9.426 1.00 0.00 H new ATOM 0 HB3 ARG A 38 30.047 -16.148 7.965 1.00 0.00 H new ATOM 0 HG2 ARG A 38 28.361 -17.855 7.523 1.00 0.00 H new ATOM 0 HG3 ARG A 38 29.012 -18.912 8.759 1.00 0.00 H new ATOM 0 HD2 ARG A 38 28.317 -17.382 10.537 1.00 0.00 H new ATOM 0 HD3 ARG A 38 27.865 -16.152 9.373 1.00 0.00 H new ATOM 0 HE ARG A 38 25.835 -17.191 9.042 1.00 0.00 H new ATOM 0 HH11 ARG A 38 27.874 -19.664 10.564 1.00 0.00 H new ATOM 0 HH12 ARG A 38 26.484 -20.729 10.800 1.00 0.00 H new ATOM 0 HH21 ARG A 38 24.179 -18.591 9.445 1.00 0.00 H new ATOM 0 HH22 ARG A 38 24.505 -20.154 10.201 1.00 0.00 H new ATOM 604 N VAL A 39 33.474 -17.030 8.043 1.00 0.00 N ATOM 605 CA VAL A 39 34.747 -16.331 7.796 1.00 0.00 C ATOM 606 C VAL A 39 35.513 -17.011 6.655 1.00 0.00 C ATOM 607 O VAL A 39 35.913 -16.347 5.698 1.00 0.00 O ATOM 608 CB VAL A 39 35.568 -16.304 9.100 1.00 0.00 C ATOM 609 CG1 VAL A 39 37.016 -15.883 8.912 1.00 0.00 C ATOM 610 CG2 VAL A 39 35.006 -15.295 10.093 1.00 0.00 C ATOM 0 H VAL A 39 33.450 -17.488 8.954 1.00 0.00 H new ATOM 0 HA VAL A 39 34.555 -15.303 7.488 1.00 0.00 H new ATOM 0 HB VAL A 39 35.511 -17.333 9.455 1.00 0.00 H new ATOM 0 HG11 VAL A 39 37.525 -15.890 9.876 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.512 -16.578 8.235 1.00 0.00 H new ATOM 0 HG13 VAL A 39 37.051 -14.879 8.490 1.00 0.00 H new ATOM 0 HG21 VAL A 39 35.609 -15.303 11.001 1.00 0.00 H new ATOM 0 HG22 VAL A 39 35.028 -14.299 9.651 1.00 0.00 H new ATOM 0 HG23 VAL A 39 33.978 -15.560 10.339 1.00 0.00 H new ATOM 620 N VAL A 40 35.662 -18.340 6.717 1.00 0.00 N ATOM 621 CA VAL A 40 36.279 -19.162 5.660 1.00 0.00 C ATOM 622 C VAL A 40 35.524 -18.944 4.340 1.00 0.00 C ATOM 623 O VAL A 40 36.115 -18.504 3.356 1.00 0.00 O ATOM 624 CB VAL A 40 36.288 -20.639 6.116 1.00 0.00 C ATOM 625 CG1 VAL A 40 36.243 -21.628 4.954 1.00 0.00 C ATOM 626 CG2 VAL A 40 37.518 -20.914 6.986 1.00 0.00 C ATOM 0 H VAL A 40 35.352 -18.889 7.519 1.00 0.00 H new ATOM 0 HA VAL A 40 37.314 -18.869 5.485 1.00 0.00 H new ATOM 0 HB VAL A 40 35.377 -20.791 6.695 1.00 0.00 H new ATOM 0 HG11 VAL A 40 36.252 -22.646 5.342 1.00 0.00 H new ATOM 0 HG12 VAL A 40 35.333 -21.468 4.375 1.00 0.00 H new ATOM 0 HG13 VAL A 40 37.112 -21.477 4.313 1.00 0.00 H new ATOM 0 HG21 VAL A 40 37.514 -21.957 7.302 1.00 0.00 H new ATOM 0 HG22 VAL A 40 38.422 -20.712 6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 40 37.494 -20.269 7.864 1.00 0.00 H new ATOM 636 N GLN A 41 34.214 -19.220 4.323 1.00 0.00 N ATOM 637 CA GLN A 41 33.305 -19.014 3.183 1.00 0.00 C ATOM 638 C GLN A 41 33.409 -17.607 2.571 1.00 0.00 C ATOM 639 O GLN A 41 33.458 -17.491 1.345 1.00 0.00 O ATOM 640 CB GLN A 41 31.856 -19.273 3.618 1.00 0.00 C ATOM 641 CG GLN A 41 31.532 -20.767 3.800 1.00 0.00 C ATOM 642 CD GLN A 41 31.616 -21.547 2.490 1.00 0.00 C ATOM 643 OE1 GLN A 41 32.591 -22.227 2.198 1.00 0.00 O ATOM 644 NE2 GLN A 41 30.615 -21.470 1.638 1.00 0.00 N ATOM 0 H GLN A 41 33.736 -19.609 5.136 1.00 0.00 H new ATOM 0 HA GLN A 41 33.608 -19.723 2.412 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.667 -18.751 4.556 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.180 -18.850 2.875 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.224 -21.200 4.522 1.00 0.00 H new ATOM 0 HG3 GLN A 41 30.530 -20.870 4.217 1.00 0.00 H new ATOM 0 HE21 GLN A 41 29.794 -20.908 1.865 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.660 -21.972 0.751 1.00 0.00 H new ATOM 653 N HIS A 42 33.475 -16.550 3.394 1.00 0.00 N ATOM 654 CA HIS A 42 33.673 -15.181 2.904 1.00 0.00 C ATOM 655 C HIS A 42 34.973 -15.106 2.087 1.00 0.00 C ATOM 656 O HIS A 42 34.950 -14.756 0.906 1.00 0.00 O ATOM 657 CB HIS A 42 33.687 -14.163 4.071 1.00 0.00 C ATOM 658 CG HIS A 42 34.361 -12.856 3.704 1.00 0.00 C ATOM 659 ND1 HIS A 42 33.812 -11.838 2.955 1.00 0.00 N ATOM 660 CD2 HIS A 42 35.715 -12.631 3.745 1.00 0.00 C ATOM 661 CE1 HIS A 42 34.819 -11.067 2.504 1.00 0.00 C ATOM 662 NE2 HIS A 42 36.003 -11.523 2.944 1.00 0.00 N ATOM 0 H HIS A 42 33.393 -16.620 4.408 1.00 0.00 H new ATOM 0 HA HIS A 42 32.836 -14.917 2.257 1.00 0.00 H new ATOM 0 HB2 HIS A 42 32.662 -13.962 4.384 1.00 0.00 H new ATOM 0 HB3 HIS A 42 34.201 -14.604 4.925 1.00 0.00 H new ATOM 0 HD1 HIS A 42 32.818 -11.694 2.774 1.00 0.00 H new ATOM 0 HD2 HIS A 42 36.435 -13.212 4.302 1.00 0.00 H new ATOM 0 HE1 HIS A 42 34.692 -10.199 1.874 1.00 0.00 H new ATOM 670 N THR A 43 36.102 -15.475 2.699 1.00 0.00 N ATOM 671 CA THR A 43 37.421 -15.416 2.061 1.00 0.00 C ATOM 672 C THR A 43 37.502 -16.262 0.794 1.00 0.00 C ATOM 673 O THR A 43 38.090 -15.819 -0.198 1.00 0.00 O ATOM 674 CB THR A 43 38.504 -15.800 3.077 1.00 0.00 C ATOM 675 OG1 THR A 43 38.719 -14.717 3.944 1.00 0.00 O ATOM 676 CG2 THR A 43 39.835 -16.179 2.438 1.00 0.00 C ATOM 0 H THR A 43 36.127 -15.825 3.657 1.00 0.00 H new ATOM 0 HA THR A 43 37.591 -14.389 1.737 1.00 0.00 H new ATOM 0 HB THR A 43 38.139 -16.681 3.606 1.00 0.00 H new ATOM 0 HG1 THR A 43 38.653 -13.878 3.442 1.00 0.00 H new ATOM 0 HG21 THR A 43 40.552 -16.438 3.217 1.00 0.00 H new ATOM 0 HG22 THR A 43 39.691 -17.034 1.778 1.00 0.00 H new ATOM 0 HG23 THR A 43 40.215 -15.336 1.862 1.00 0.00 H new ATOM 684 N LYS A 44 36.866 -17.441 0.797 1.00 0.00 N ATOM 685 CA LYS A 44 36.767 -18.385 -0.331 1.00 0.00 C ATOM 686 C LYS A 44 36.137 -17.788 -1.603 1.00 0.00 C ATOM 687 O LYS A 44 36.285 -18.378 -2.676 1.00 0.00 O ATOM 688 CB LYS A 44 35.999 -19.637 0.138 1.00 0.00 C ATOM 689 CG LYS A 44 36.917 -20.692 0.771 1.00 0.00 C ATOM 690 CD LYS A 44 36.080 -21.873 1.288 1.00 0.00 C ATOM 691 CE LYS A 44 36.943 -23.041 1.790 1.00 0.00 C ATOM 692 NZ LYS A 44 37.588 -23.787 0.675 1.00 0.00 N ATOM 0 H LYS A 44 36.381 -17.782 1.627 1.00 0.00 H new ATOM 0 HA LYS A 44 37.783 -18.646 -0.625 1.00 0.00 H new ATOM 0 HB2 LYS A 44 35.238 -19.342 0.861 1.00 0.00 H new ATOM 0 HB3 LYS A 44 35.477 -20.078 -0.712 1.00 0.00 H new ATOM 0 HG2 LYS A 44 37.642 -21.043 0.037 1.00 0.00 H new ATOM 0 HG3 LYS A 44 37.482 -20.249 1.591 1.00 0.00 H new ATOM 0 HD2 LYS A 44 35.436 -21.529 2.097 1.00 0.00 H new ATOM 0 HD3 LYS A 44 35.427 -22.227 0.490 1.00 0.00 H new ATOM 0 HE2 LYS A 44 37.712 -22.659 2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 44 36.323 -23.724 2.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 38.159 -24.565 1.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 36.855 -24.175 0.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 38.201 -23.143 0.135 1.00 0.00 H new ATOM 706 N GLY A 45 35.469 -16.634 -1.508 1.00 0.00 N ATOM 707 CA GLY A 45 34.846 -15.925 -2.633 1.00 0.00 C ATOM 708 C GLY A 45 35.141 -14.417 -2.698 1.00 0.00 C ATOM 709 O GLY A 45 34.738 -13.774 -3.671 1.00 0.00 O ATOM 0 H GLY A 45 35.342 -16.151 -0.618 1.00 0.00 H new ATOM 0 HA2 GLY A 45 35.181 -16.385 -3.563 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.767 -16.066 -2.578 1.00 0.00 H new ATOM 713 N CYS A 46 35.829 -13.841 -1.703 1.00 0.00 N ATOM 714 CA CYS A 46 36.147 -12.416 -1.647 1.00 0.00 C ATOM 715 C CYS A 46 37.135 -11.988 -2.745 1.00 0.00 C ATOM 716 O CYS A 46 38.071 -12.720 -3.091 1.00 0.00 O ATOM 717 CB CYS A 46 36.640 -12.115 -0.227 1.00 0.00 C ATOM 718 SG CYS A 46 37.523 -10.528 -0.078 1.00 0.00 S ATOM 0 H CYS A 46 36.184 -14.365 -0.903 1.00 0.00 H new ATOM 0 HA CYS A 46 35.258 -11.820 -1.854 1.00 0.00 H new ATOM 0 HB2 CYS A 46 35.786 -12.111 0.451 1.00 0.00 H new ATOM 0 HB3 CYS A 46 37.300 -12.920 0.097 1.00 0.00 H new ATOM 723 N LYS A 47 36.924 -10.773 -3.261 1.00 0.00 N ATOM 724 CA LYS A 47 37.722 -10.122 -4.310 1.00 0.00 C ATOM 725 C LYS A 47 38.492 -8.898 -3.787 1.00 0.00 C ATOM 726 O LYS A 47 39.121 -8.194 -4.582 1.00 0.00 O ATOM 727 CB LYS A 47 36.808 -9.757 -5.500 1.00 0.00 C ATOM 728 CG LYS A 47 35.947 -10.908 -6.057 1.00 0.00 C ATOM 729 CD LYS A 47 36.766 -12.098 -6.577 1.00 0.00 C ATOM 730 CE LYS A 47 35.820 -13.186 -7.100 1.00 0.00 C ATOM 731 NZ LYS A 47 36.568 -14.351 -7.640 1.00 0.00 N ATOM 0 H LYS A 47 36.153 -10.185 -2.943 1.00 0.00 H new ATOM 0 HA LYS A 47 38.481 -10.827 -4.649 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.146 -8.948 -5.191 1.00 0.00 H new ATOM 0 HB3 LYS A 47 37.430 -9.369 -6.307 1.00 0.00 H new ATOM 0 HG2 LYS A 47 35.273 -11.257 -5.275 1.00 0.00 H new ATOM 0 HG3 LYS A 47 35.325 -10.525 -6.866 1.00 0.00 H new ATOM 0 HD2 LYS A 47 37.436 -11.771 -7.373 1.00 0.00 H new ATOM 0 HD3 LYS A 47 37.391 -12.499 -5.779 1.00 0.00 H new ATOM 0 HE2 LYS A 47 35.164 -13.516 -6.294 1.00 0.00 H new ATOM 0 HE3 LYS A 47 35.182 -12.770 -7.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 35.896 -15.066 -7.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 37.175 -14.040 -8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 37.158 -14.763 -6.889 1.00 0.00 H new ATOM 745 N ARG A 48 38.474 -8.641 -2.469 1.00 0.00 N ATOM 746 CA ARG A 48 39.191 -7.539 -1.816 1.00 0.00 C ATOM 747 C ARG A 48 40.575 -8.043 -1.390 1.00 0.00 C ATOM 748 O ARG A 48 41.578 -7.584 -1.935 1.00 0.00 O ATOM 749 CB ARG A 48 38.395 -7.056 -0.589 1.00 0.00 C ATOM 750 CG ARG A 48 36.966 -6.566 -0.818 1.00 0.00 C ATOM 751 CD ARG A 48 36.308 -6.094 0.493 1.00 0.00 C ATOM 752 NE ARG A 48 36.279 -7.135 1.545 1.00 0.00 N ATOM 753 CZ ARG A 48 35.479 -7.203 2.590 1.00 0.00 C ATOM 754 NH1 ARG A 48 34.529 -6.346 2.836 1.00 0.00 N ATOM 755 NH2 ARG A 48 35.625 -8.155 3.450 1.00 0.00 N ATOM 0 H ARG A 48 37.944 -9.212 -1.811 1.00 0.00 H new ATOM 0 HA ARG A 48 39.303 -6.701 -2.505 1.00 0.00 H new ATOM 0 HB2 ARG A 48 38.358 -7.874 0.130 1.00 0.00 H new ATOM 0 HB3 ARG A 48 38.956 -6.247 -0.122 1.00 0.00 H new ATOM 0 HG2 ARG A 48 36.973 -5.747 -1.537 1.00 0.00 H new ATOM 0 HG3 ARG A 48 36.372 -7.369 -1.255 1.00 0.00 H new ATOM 0 HD2 ARG A 48 36.847 -5.224 0.868 1.00 0.00 H new ATOM 0 HD3 ARG A 48 35.288 -5.772 0.283 1.00 0.00 H new ATOM 0 HE ARG A 48 36.959 -7.889 1.450 1.00 0.00 H new ATOM 0 HH11 ARG A 48 34.370 -5.564 2.200 1.00 0.00 H new ATOM 0 HH12 ARG A 48 33.944 -6.457 3.664 1.00 0.00 H new ATOM 0 HH21 ARG A 48 36.358 -8.852 3.320 1.00 0.00 H new ATOM 0 HH22 ARG A 48 35.007 -8.210 4.260 1.00 0.00 H new ATOM 769 N LYS A 49 40.602 -9.011 -0.462 1.00 0.00 N ATOM 770 CA LYS A 49 41.767 -9.696 0.133 1.00 0.00 C ATOM 771 C LYS A 49 43.016 -8.872 0.498 1.00 0.00 C ATOM 772 O LYS A 49 43.003 -7.640 0.485 1.00 0.00 O ATOM 773 CB LYS A 49 41.953 -11.113 -0.450 1.00 0.00 C ATOM 774 CG LYS A 49 41.485 -11.355 -1.897 1.00 0.00 C ATOM 775 CD LYS A 49 41.484 -12.848 -2.275 1.00 0.00 C ATOM 776 CE LYS A 49 40.868 -13.812 -1.238 1.00 0.00 C ATOM 777 NZ LYS A 49 39.548 -13.372 -0.723 1.00 0.00 N ATOM 0 H LYS A 49 39.731 -9.369 -0.071 1.00 0.00 H new ATOM 0 HA LYS A 49 41.493 -9.851 1.177 1.00 0.00 H new ATOM 0 HB2 LYS A 49 43.012 -11.363 -0.393 1.00 0.00 H new ATOM 0 HB3 LYS A 49 41.425 -11.814 0.196 1.00 0.00 H new ATOM 0 HG2 LYS A 49 40.480 -10.951 -2.023 1.00 0.00 H new ATOM 0 HG3 LYS A 49 42.135 -10.811 -2.582 1.00 0.00 H new ATOM 0 HD2 LYS A 49 40.943 -12.964 -3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 49 42.513 -13.156 -2.460 1.00 0.00 H new ATOM 0 HE2 LYS A 49 40.761 -14.798 -1.691 1.00 0.00 H new ATOM 0 HE3 LYS A 49 41.557 -13.919 -0.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 38.979 -14.205 -0.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 39.685 -12.777 0.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 39.054 -12.825 -1.457 1.00 0.00 H new ATOM 791 N THR A 50 44.098 -9.547 0.898 1.00 0.00 N ATOM 792 CA THR A 50 45.378 -8.949 1.336 1.00 0.00 C ATOM 793 C THR A 50 45.999 -8.008 0.296 1.00 0.00 C ATOM 794 O THR A 50 46.679 -7.048 0.664 1.00 0.00 O ATOM 795 CB THR A 50 46.402 -10.045 1.683 1.00 0.00 C ATOM 796 OG1 THR A 50 46.497 -10.938 0.597 1.00 0.00 O ATOM 797 CG2 THR A 50 46.059 -10.872 2.930 1.00 0.00 C ATOM 0 H THR A 50 44.114 -10.566 0.929 1.00 0.00 H new ATOM 0 HA THR A 50 45.137 -8.356 2.219 1.00 0.00 H new ATOM 0 HB THR A 50 47.335 -9.522 1.892 1.00 0.00 H new ATOM 0 HG1 THR A 50 47.148 -11.640 0.807 1.00 0.00 H new ATOM 0 HG21 THR A 50 46.836 -11.619 3.096 1.00 0.00 H new ATOM 0 HG22 THR A 50 45.996 -10.214 3.797 1.00 0.00 H new ATOM 0 HG23 THR A 50 45.101 -11.371 2.783 1.00 0.00 H new ATOM 805 N ASN A 51 45.756 -8.253 -0.997 1.00 0.00 N ATOM 806 CA ASN A 51 46.261 -7.444 -2.113 1.00 0.00 C ATOM 807 C ASN A 51 45.453 -6.152 -2.379 1.00 0.00 C ATOM 808 O ASN A 51 45.900 -5.317 -3.170 1.00 0.00 O ATOM 809 CB ASN A 51 46.314 -8.327 -3.375 1.00 0.00 C ATOM 810 CG ASN A 51 47.169 -9.569 -3.179 1.00 0.00 C ATOM 811 OD1 ASN A 51 46.677 -10.687 -3.131 1.00 0.00 O ATOM 812 ND2 ASN A 51 48.467 -9.413 -3.062 1.00 0.00 N ATOM 0 H ASN A 51 45.187 -9.042 -1.305 1.00 0.00 H new ATOM 0 HA ASN A 51 47.257 -7.098 -1.837 1.00 0.00 H new ATOM 0 HB2 ASN A 51 45.302 -8.626 -3.649 1.00 0.00 H new ATOM 0 HB3 ASN A 51 46.710 -7.744 -4.206 1.00 0.00 H new ATOM 0 HD21 ASN A 51 49.069 -10.226 -2.931 1.00 0.00 H new ATOM 0 HD22 ASN A 51 48.874 -8.479 -3.103 1.00 0.00 H new ATOM 819 N GLY A 52 44.285 -5.973 -1.744 1.00 0.00 N ATOM 820 CA GLY A 52 43.407 -4.805 -1.924 1.00 0.00 C ATOM 821 C GLY A 52 43.071 -4.049 -0.633 1.00 0.00 C ATOM 822 O GLY A 52 42.978 -2.819 -0.669 1.00 0.00 O ATOM 0 H GLY A 52 43.916 -6.650 -1.077 1.00 0.00 H new ATOM 0 HA2 GLY A 52 43.883 -4.114 -2.620 1.00 0.00 H new ATOM 0 HA3 GLY A 52 42.477 -5.135 -2.388 1.00 0.00 H new ATOM 826 N GLY A 53 42.927 -4.742 0.505 1.00 0.00 N ATOM 827 CA GLY A 53 42.674 -4.119 1.816 1.00 0.00 C ATOM 828 C GLY A 53 41.609 -4.774 2.710 1.00 0.00 C ATOM 829 O GLY A 53 41.262 -4.181 3.735 1.00 0.00 O ATOM 0 H GLY A 53 42.983 -5.760 0.544 1.00 0.00 H new ATOM 0 HA2 GLY A 53 43.614 -4.100 2.368 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.382 -3.082 1.647 1.00 0.00 H new ATOM 833 N CYS A 54 41.072 -5.947 2.351 1.00 0.00 N ATOM 834 CA CYS A 54 40.039 -6.647 3.121 1.00 0.00 C ATOM 835 C CYS A 54 40.398 -6.853 4.606 1.00 0.00 C ATOM 836 O CYS A 54 41.457 -7.425 4.903 1.00 0.00 O ATOM 837 CB CYS A 54 39.850 -8.003 2.465 1.00 0.00 C ATOM 838 SG CYS A 54 38.459 -8.936 3.146 1.00 0.00 S ATOM 0 H CYS A 54 41.348 -6.443 1.504 1.00 0.00 H new ATOM 0 HA CYS A 54 39.136 -6.037 3.114 1.00 0.00 H new ATOM 0 HB2 CYS A 54 39.696 -7.863 1.395 1.00 0.00 H new ATOM 0 HB3 CYS A 54 40.763 -8.587 2.583 1.00 0.00 H new ATOM 843 N PRO A 55 39.542 -6.424 5.553 1.00 0.00 N ATOM 844 CA PRO A 55 39.804 -6.634 6.965 1.00 0.00 C ATOM 845 C PRO A 55 39.517 -8.077 7.392 1.00 0.00 C ATOM 846 O PRO A 55 40.118 -8.527 8.364 1.00 0.00 O ATOM 847 CB PRO A 55 38.884 -5.644 7.686 1.00 0.00 C ATOM 848 CG PRO A 55 37.665 -5.581 6.765 1.00 0.00 C ATOM 849 CD PRO A 55 38.273 -5.731 5.368 1.00 0.00 C ATOM 0 HA PRO A 55 40.854 -6.470 7.207 1.00 0.00 H new ATOM 0 HB2 PRO A 55 38.619 -5.992 8.684 1.00 0.00 H new ATOM 0 HB3 PRO A 55 39.353 -4.667 7.803 1.00 0.00 H new ATOM 0 HG2 PRO A 55 36.955 -6.378 6.983 1.00 0.00 H new ATOM 0 HG3 PRO A 55 37.128 -4.638 6.871 1.00 0.00 H new ATOM 0 HD2 PRO A 55 37.611 -6.298 4.713 1.00 0.00 H new ATOM 0 HD3 PRO A 55 38.425 -4.757 4.902 1.00 0.00 H new ATOM 857 N VAL A 56 38.644 -8.814 6.687 1.00 0.00 N ATOM 858 CA VAL A 56 38.325 -10.210 7.022 1.00 0.00 C ATOM 859 C VAL A 56 39.436 -11.135 6.529 1.00 0.00 C ATOM 860 O VAL A 56 40.049 -11.798 7.365 1.00 0.00 O ATOM 861 CB VAL A 56 36.961 -10.681 6.480 1.00 0.00 C ATOM 862 CG1 VAL A 56 36.632 -12.067 7.058 1.00 0.00 C ATOM 863 CG2 VAL A 56 35.801 -9.748 6.857 1.00 0.00 C ATOM 0 H VAL A 56 38.142 -8.461 5.873 1.00 0.00 H new ATOM 0 HA VAL A 56 38.253 -10.256 8.109 1.00 0.00 H new ATOM 0 HB VAL A 56 37.055 -10.694 5.394 1.00 0.00 H new ATOM 0 HG11 VAL A 56 35.668 -12.401 6.675 1.00 0.00 H new ATOM 0 HG12 VAL A 56 37.405 -12.777 6.763 1.00 0.00 H new ATOM 0 HG13 VAL A 56 36.590 -12.007 8.146 1.00 0.00 H new ATOM 0 HG21 VAL A 56 34.871 -10.138 6.444 1.00 0.00 H new ATOM 0 HG22 VAL A 56 35.719 -9.689 7.942 1.00 0.00 H new ATOM 0 HG23 VAL A 56 35.988 -8.753 6.453 1.00 0.00 H new ATOM 873 N CYS A 57 39.738 -11.162 5.226 1.00 0.00 N ATOM 874 CA CYS A 57 40.782 -12.007 4.654 1.00 0.00 C ATOM 875 C CYS A 57 42.132 -11.858 5.377 1.00 0.00 C ATOM 876 O CYS A 57 42.707 -12.864 5.803 1.00 0.00 O ATOM 877 CB CYS A 57 40.892 -11.699 3.160 1.00 0.00 C ATOM 878 SG CYS A 57 39.472 -12.368 2.228 1.00 0.00 S ATOM 0 H CYS A 57 39.256 -10.589 4.534 1.00 0.00 H new ATOM 0 HA CYS A 57 40.503 -13.052 4.791 1.00 0.00 H new ATOM 0 HB2 CYS A 57 40.948 -10.620 3.014 1.00 0.00 H new ATOM 0 HB3 CYS A 57 41.817 -12.122 2.768 1.00 0.00 H new ATOM 883 N LYS A 58 42.625 -10.626 5.590 1.00 0.00 N ATOM 884 CA LYS A 58 43.888 -10.386 6.327 1.00 0.00 C ATOM 885 C LYS A 58 43.871 -10.986 7.744 1.00 0.00 C ATOM 886 O LYS A 58 44.917 -11.382 8.258 1.00 0.00 O ATOM 887 CB LYS A 58 44.202 -8.876 6.386 1.00 0.00 C ATOM 888 CG LYS A 58 44.693 -8.346 5.027 1.00 0.00 C ATOM 889 CD LYS A 58 45.003 -6.844 4.962 1.00 0.00 C ATOM 890 CE LYS A 58 46.135 -6.448 5.919 1.00 0.00 C ATOM 891 NZ LYS A 58 46.436 -4.993 5.841 1.00 0.00 N ATOM 0 H LYS A 58 42.169 -9.774 5.262 1.00 0.00 H new ATOM 0 HA LYS A 58 44.677 -10.896 5.775 1.00 0.00 H new ATOM 0 HB2 LYS A 58 43.309 -8.330 6.689 1.00 0.00 H new ATOM 0 HB3 LYS A 58 44.962 -8.691 7.145 1.00 0.00 H new ATOM 0 HG2 LYS A 58 45.593 -8.895 4.749 1.00 0.00 H new ATOM 0 HG3 LYS A 58 43.936 -8.573 4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 58 45.279 -6.575 3.943 1.00 0.00 H new ATOM 0 HD3 LYS A 58 44.105 -6.278 5.209 1.00 0.00 H new ATOM 0 HE2 LYS A 58 45.856 -6.708 6.940 1.00 0.00 H new ATOM 0 HE3 LYS A 58 47.032 -7.019 5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 47.206 -4.762 6.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 46.726 -4.750 4.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 45.587 -4.449 6.095 1.00 0.00 H new ATOM 905 N GLN A 59 42.695 -11.097 8.360 1.00 0.00 N ATOM 906 CA GLN A 59 42.517 -11.672 9.698 1.00 0.00 C ATOM 907 C GLN A 59 42.767 -13.187 9.719 1.00 0.00 C ATOM 908 O GLN A 59 43.503 -13.658 10.588 1.00 0.00 O ATOM 909 CB GLN A 59 41.119 -11.336 10.262 1.00 0.00 C ATOM 910 CG GLN A 59 41.154 -10.955 11.752 1.00 0.00 C ATOM 911 CD GLN A 59 41.738 -9.561 12.027 1.00 0.00 C ATOM 912 OE1 GLN A 59 42.446 -8.962 11.230 1.00 0.00 O ATOM 913 NE2 GLN A 59 41.465 -8.975 13.173 1.00 0.00 N ATOM 0 H GLN A 59 41.821 -10.785 7.937 1.00 0.00 H new ATOM 0 HA GLN A 59 43.268 -11.216 10.343 1.00 0.00 H new ATOM 0 HB2 GLN A 59 40.690 -10.513 9.691 1.00 0.00 H new ATOM 0 HB3 GLN A 59 40.461 -12.195 10.126 1.00 0.00 H new ATOM 0 HG2 GLN A 59 40.141 -10.998 12.151 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.742 -11.697 12.292 1.00 0.00 H new ATOM 0 HE21 GLN A 59 40.877 -9.447 13.860 1.00 0.00 H new ATOM 0 HE22 GLN A 59 41.841 -8.048 13.374 1.00 0.00 H new ATOM 922 N LEU A 60 42.208 -13.948 8.761 1.00 0.00 N ATOM 923 CA LEU A 60 42.437 -15.401 8.671 1.00 0.00 C ATOM 924 C LEU A 60 43.919 -15.691 8.473 1.00 0.00 C ATOM 925 O LEU A 60 44.477 -16.530 9.172 1.00 0.00 O ATOM 926 CB LEU A 60 41.739 -16.082 7.475 1.00 0.00 C ATOM 927 CG LEU A 60 40.213 -16.182 7.494 1.00 0.00 C ATOM 928 CD1 LEU A 60 39.595 -14.821 7.214 1.00 0.00 C ATOM 929 CD2 LEU A 60 39.776 -17.167 6.407 1.00 0.00 C ATOM 0 H LEU A 60 41.593 -13.579 8.036 1.00 0.00 H new ATOM 0 HA LEU A 60 42.033 -15.793 9.604 1.00 0.00 H new ATOM 0 HB2 LEU A 60 42.027 -15.545 6.571 1.00 0.00 H new ATOM 0 HB3 LEU A 60 42.138 -17.092 7.387 1.00 0.00 H new ATOM 0 HG LEU A 60 39.882 -16.525 8.474 1.00 0.00 H new ATOM 0 HD11 LEU A 60 38.508 -14.905 7.230 1.00 0.00 H new ATOM 0 HD12 LEU A 60 39.916 -14.112 7.977 1.00 0.00 H new ATOM 0 HD13 LEU A 60 39.917 -14.470 6.234 1.00 0.00 H new ATOM 0 HD21 LEU A 60 38.689 -17.250 6.407 1.00 0.00 H new ATOM 0 HD22 LEU A 60 40.113 -16.808 5.434 1.00 0.00 H new ATOM 0 HD23 LEU A 60 40.215 -18.145 6.605 1.00 0.00 H new ATOM 941 N ILE A 61 44.540 -15.014 7.503 1.00 0.00 N ATOM 942 CA ILE A 61 45.944 -15.234 7.141 1.00 0.00 C ATOM 943 C ILE A 61 46.854 -15.047 8.356 1.00 0.00 C ATOM 944 O ILE A 61 47.701 -15.901 8.588 1.00 0.00 O ATOM 945 CB ILE A 61 46.386 -14.340 5.963 1.00 0.00 C ATOM 946 CG1 ILE A 61 45.414 -14.371 4.766 1.00 0.00 C ATOM 947 CG2 ILE A 61 47.785 -14.745 5.453 1.00 0.00 C ATOM 948 CD1 ILE A 61 45.588 -15.588 3.870 1.00 0.00 C ATOM 0 H ILE A 61 44.081 -14.295 6.944 1.00 0.00 H new ATOM 0 HA ILE A 61 46.036 -16.266 6.804 1.00 0.00 H new ATOM 0 HB ILE A 61 46.398 -13.327 6.366 1.00 0.00 H new ATOM 0 HG12 ILE A 61 44.390 -14.349 5.140 1.00 0.00 H new ATOM 0 HG13 ILE A 61 45.555 -13.469 4.171 1.00 0.00 H new ATOM 0 HG21 ILE A 61 48.071 -14.099 4.623 1.00 0.00 H new ATOM 0 HG22 ILE A 61 48.510 -14.642 6.260 1.00 0.00 H new ATOM 0 HG23 ILE A 61 47.763 -15.781 5.115 1.00 0.00 H new ATOM 0 HD11 ILE A 61 44.871 -15.542 3.050 1.00 0.00 H new ATOM 0 HD12 ILE A 61 46.600 -15.601 3.467 1.00 0.00 H new ATOM 0 HD13 ILE A 61 45.417 -16.495 4.450 1.00 0.00 H new ATOM 960 N ALA A 62 46.667 -13.996 9.168 1.00 0.00 N ATOM 961 CA ALA A 62 47.471 -13.793 10.378 1.00 0.00 C ATOM 962 C ALA A 62 47.292 -14.971 11.349 1.00 0.00 C ATOM 963 O ALA A 62 48.267 -15.599 11.764 1.00 0.00 O ATOM 964 CB ALA A 62 47.090 -12.457 11.037 1.00 0.00 C ATOM 0 H ALA A 62 45.965 -13.274 9.007 1.00 0.00 H new ATOM 0 HA ALA A 62 48.526 -13.751 10.106 1.00 0.00 H new ATOM 0 HB1 ALA A 62 47.690 -12.310 11.935 1.00 0.00 H new ATOM 0 HB2 ALA A 62 47.276 -11.641 10.339 1.00 0.00 H new ATOM 0 HB3 ALA A 62 46.033 -12.471 11.304 1.00 0.00 H new ATOM 970 N LEU A 63 46.039 -15.299 11.672 1.00 0.00 N ATOM 971 CA LEU A 63 45.670 -16.400 12.566 1.00 0.00 C ATOM 972 C LEU A 63 46.285 -17.737 12.091 1.00 0.00 C ATOM 973 O LEU A 63 46.857 -18.490 12.881 1.00 0.00 O ATOM 974 CB LEU A 63 44.130 -16.406 12.648 1.00 0.00 C ATOM 975 CG LEU A 63 43.546 -16.843 13.999 1.00 0.00 C ATOM 976 CD1 LEU A 63 42.062 -16.472 14.039 1.00 0.00 C ATOM 977 CD2 LEU A 63 43.680 -18.339 14.228 1.00 0.00 C ATOM 0 H LEU A 63 45.231 -14.793 11.309 1.00 0.00 H new ATOM 0 HA LEU A 63 46.075 -16.264 13.569 1.00 0.00 H new ATOM 0 HB2 LEU A 63 43.767 -15.404 12.421 1.00 0.00 H new ATOM 0 HB3 LEU A 63 43.744 -17.068 11.873 1.00 0.00 H new ATOM 0 HG LEU A 63 44.105 -16.333 14.783 1.00 0.00 H new ATOM 0 HD11 LEU A 63 41.636 -16.778 14.995 1.00 0.00 H new ATOM 0 HD12 LEU A 63 41.953 -15.394 13.922 1.00 0.00 H new ATOM 0 HD13 LEU A 63 41.538 -16.980 13.229 1.00 0.00 H new ATOM 0 HD21 LEU A 63 43.253 -18.599 15.197 1.00 0.00 H new ATOM 0 HD22 LEU A 63 43.150 -18.876 13.442 1.00 0.00 H new ATOM 0 HD23 LEU A 63 44.734 -18.617 14.210 1.00 0.00 H new ATOM 989 N CYS A 64 46.235 -17.995 10.781 1.00 0.00 N ATOM 990 CA CYS A 64 46.834 -19.165 10.146 1.00 0.00 C ATOM 991 C CYS A 64 48.371 -19.109 10.175 1.00 0.00 C ATOM 992 O CYS A 64 48.982 -20.132 10.458 1.00 0.00 O ATOM 993 CB CYS A 64 46.300 -19.317 8.717 1.00 0.00 C ATOM 994 SG CYS A 64 44.511 -19.635 8.754 1.00 0.00 S ATOM 0 H CYS A 64 45.764 -17.378 10.119 1.00 0.00 H new ATOM 0 HA CYS A 64 46.547 -20.048 10.717 1.00 0.00 H new ATOM 0 HB2 CYS A 64 46.505 -18.412 8.145 1.00 0.00 H new ATOM 0 HB3 CYS A 64 46.813 -20.136 8.213 1.00 0.00 H new ATOM 0 HG CYS A 64 43.875 -18.516 8.935 1.00 0.00 H new ATOM 1000 N CYS A 65 49.014 -17.954 9.952 1.00 0.00 N ATOM 1001 CA CYS A 65 50.472 -17.787 10.060 1.00 0.00 C ATOM 1002 C CYS A 65 50.954 -18.128 11.478 1.00 0.00 C ATOM 1003 O CYS A 65 51.923 -18.870 11.635 1.00 0.00 O ATOM 1004 CB CYS A 65 50.885 -16.349 9.702 1.00 0.00 C ATOM 1005 SG CYS A 65 50.874 -16.038 7.914 1.00 0.00 S ATOM 0 H CYS A 65 48.529 -17.096 9.688 1.00 0.00 H new ATOM 0 HA CYS A 65 50.940 -18.473 9.354 1.00 0.00 H new ATOM 0 HB2 CYS A 65 50.208 -15.649 10.192 1.00 0.00 H new ATOM 0 HB3 CYS A 65 51.883 -16.154 10.094 1.00 0.00 H new ATOM 0 HG CYS A 65 49.646 -15.999 7.488 1.00 0.00 H new ATOM 1011 N TYR A 66 50.262 -17.627 12.508 1.00 0.00 N ATOM 1012 CA TYR A 66 50.574 -17.884 13.919 1.00 0.00 C ATOM 1013 C TYR A 66 50.663 -19.389 14.225 1.00 0.00 C ATOM 1014 O TYR A 66 51.574 -19.842 14.919 1.00 0.00 O ATOM 1015 CB TYR A 66 49.501 -17.215 14.789 1.00 0.00 C ATOM 1016 CG TYR A 66 49.960 -16.819 16.178 1.00 0.00 C ATOM 1017 CD1 TYR A 66 50.802 -15.704 16.331 1.00 0.00 C ATOM 1018 CD2 TYR A 66 49.460 -17.482 17.315 1.00 0.00 C ATOM 1019 CE1 TYR A 66 51.083 -15.206 17.617 1.00 0.00 C ATOM 1020 CE2 TYR A 66 49.751 -16.997 18.603 1.00 0.00 C ATOM 1021 CZ TYR A 66 50.562 -15.854 18.757 1.00 0.00 C ATOM 1022 OH TYR A 66 50.831 -15.376 19.999 1.00 0.00 O ATOM 0 H TYR A 66 49.453 -17.019 12.381 1.00 0.00 H new ATOM 0 HA TYR A 66 51.554 -17.462 14.143 1.00 0.00 H new ATOM 0 HB2 TYR A 66 49.140 -16.325 14.274 1.00 0.00 H new ATOM 0 HB3 TYR A 66 48.654 -17.895 14.882 1.00 0.00 H new ATOM 0 HD1 TYR A 66 51.233 -15.230 15.462 1.00 0.00 H new ATOM 0 HD2 TYR A 66 48.851 -18.366 17.198 1.00 0.00 H new ATOM 0 HE1 TYR A 66 51.699 -14.326 17.732 1.00 0.00 H new ATOM 0 HE2 TYR A 66 49.354 -17.499 19.473 1.00 0.00 H new ATOM 0 HH TYR A 66 51.576 -14.742 19.951 1.00 0.00 H new ATOM 1032 N HIS A 67 49.738 -20.167 13.654 1.00 0.00 N ATOM 1033 CA HIS A 67 49.704 -21.623 13.757 1.00 0.00 C ATOM 1034 C HIS A 67 50.767 -22.282 12.846 1.00 0.00 C ATOM 1035 O HIS A 67 51.596 -23.062 13.322 1.00 0.00 O ATOM 1036 CB HIS A 67 48.274 -22.078 13.412 1.00 0.00 C ATOM 1037 CG HIS A 67 48.148 -23.570 13.271 1.00 0.00 C ATOM 1038 ND1 HIS A 67 48.006 -24.490 14.288 1.00 0.00 N ATOM 1039 CD2 HIS A 67 48.332 -24.271 12.110 1.00 0.00 C ATOM 1040 CE1 HIS A 67 48.137 -25.717 13.752 1.00 0.00 C ATOM 1041 NE2 HIS A 67 48.334 -25.631 12.426 1.00 0.00 N ATOM 0 H HIS A 67 48.974 -19.788 13.094 1.00 0.00 H new ATOM 0 HA HIS A 67 49.954 -21.939 14.770 1.00 0.00 H new ATOM 0 HB2 HIS A 67 47.592 -21.734 14.189 1.00 0.00 H new ATOM 0 HB3 HIS A 67 47.963 -21.603 12.481 1.00 0.00 H new ATOM 0 HD1 HIS A 67 47.833 -24.278 15.271 1.00 0.00 H new ATOM 0 HD2 HIS A 67 48.454 -23.847 11.124 1.00 0.00 H new ATOM 0 HE1 HIS A 67 48.090 -26.641 14.309 1.00 0.00 H new ATOM 1049 N ALA A 68 50.775 -21.955 11.547 1.00 0.00 N ATOM 1050 CA ALA A 68 51.668 -22.508 10.528 1.00 0.00 C ATOM 1051 C ALA A 68 53.173 -22.351 10.821 1.00 0.00 C ATOM 1052 O ALA A 68 53.956 -23.202 10.391 1.00 0.00 O ATOM 1053 CB ALA A 68 51.285 -21.909 9.171 1.00 0.00 C ATOM 0 H ALA A 68 50.128 -21.266 11.163 1.00 0.00 H new ATOM 0 HA ALA A 68 51.524 -23.588 10.527 1.00 0.00 H new ATOM 0 HB1 ALA A 68 51.941 -22.310 8.398 1.00 0.00 H new ATOM 0 HB2 ALA A 68 50.251 -22.165 8.939 1.00 0.00 H new ATOM 0 HB3 ALA A 68 51.390 -20.825 9.209 1.00 0.00 H new ATOM 1059 N LYS A 69 53.596 -21.315 11.568 1.00 0.00 N ATOM 1060 CA LYS A 69 55.006 -21.146 11.982 1.00 0.00 C ATOM 1061 C LYS A 69 55.494 -22.338 12.821 1.00 0.00 C ATOM 1062 O LYS A 69 56.627 -22.789 12.646 1.00 0.00 O ATOM 1063 CB LYS A 69 55.199 -19.842 12.783 1.00 0.00 C ATOM 1064 CG LYS A 69 55.292 -18.577 11.912 1.00 0.00 C ATOM 1065 CD LYS A 69 55.637 -17.300 12.702 1.00 0.00 C ATOM 1066 CE LYS A 69 57.109 -17.314 13.154 1.00 0.00 C ATOM 1067 NZ LYS A 69 57.834 -16.050 12.844 1.00 0.00 N ATOM 0 H LYS A 69 52.978 -20.575 11.901 1.00 0.00 H new ATOM 0 HA LYS A 69 55.600 -21.094 11.069 1.00 0.00 H new ATOM 0 HB2 LYS A 69 54.368 -19.730 13.480 1.00 0.00 H new ATOM 0 HB3 LYS A 69 56.107 -19.926 13.380 1.00 0.00 H new ATOM 0 HG2 LYS A 69 56.048 -18.732 11.143 1.00 0.00 H new ATOM 0 HG3 LYS A 69 54.341 -18.430 11.399 1.00 0.00 H new ATOM 0 HD2 LYS A 69 55.451 -16.423 12.082 1.00 0.00 H new ATOM 0 HD3 LYS A 69 54.986 -17.219 13.572 1.00 0.00 H new ATOM 0 HE2 LYS A 69 57.150 -17.494 14.228 1.00 0.00 H new ATOM 0 HE3 LYS A 69 57.622 -18.146 12.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 58.813 -16.118 13.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 57.839 -15.896 11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 57.357 -15.253 13.311 1.00 0.00 H new ATOM 1081 N HIS A 70 54.645 -22.842 13.721 1.00 0.00 N ATOM 1082 CA HIS A 70 54.933 -23.994 14.586 1.00 0.00 C ATOM 1083 C HIS A 70 54.528 -25.347 13.971 1.00 0.00 C ATOM 1084 O HIS A 70 55.183 -26.361 14.242 1.00 0.00 O ATOM 1085 CB HIS A 70 54.239 -23.789 15.940 1.00 0.00 C ATOM 1086 CG HIS A 70 54.748 -22.583 16.691 1.00 0.00 C ATOM 1087 ND1 HIS A 70 55.968 -22.471 17.322 1.00 0.00 N ATOM 1088 CD2 HIS A 70 54.096 -21.391 16.864 1.00 0.00 C ATOM 1089 CE1 HIS A 70 56.051 -21.242 17.861 1.00 0.00 C ATOM 1090 NE2 HIS A 70 54.930 -20.544 17.608 1.00 0.00 N ATOM 0 H HIS A 70 53.715 -22.452 13.874 1.00 0.00 H new ATOM 0 HA HIS A 70 56.015 -24.041 14.712 1.00 0.00 H new ATOM 0 HB2 HIS A 70 53.166 -23.683 15.779 1.00 0.00 H new ATOM 0 HB3 HIS A 70 54.383 -24.679 16.553 1.00 0.00 H new ATOM 0 HD2 HIS A 70 53.112 -21.146 16.492 1.00 0.00 H new ATOM 0 HE1 HIS A 70 56.898 -20.869 18.418 1.00 0.00 H new ATOM 0 HE2 HIS A 70 54.727 -19.588 17.899 1.00 0.00 H new ATOM 1098 N CYS A 71 53.456 -25.380 13.167 1.00 0.00 N ATOM 1099 CA CYS A 71 52.943 -26.608 12.547 1.00 0.00 C ATOM 1100 C CYS A 71 53.951 -27.238 11.568 1.00 0.00 C ATOM 1101 O CYS A 71 54.686 -26.539 10.862 1.00 0.00 O ATOM 1102 CB CYS A 71 51.613 -26.327 11.846 1.00 0.00 C ATOM 1103 SG CYS A 71 50.709 -27.890 11.568 1.00 0.00 S ATOM 0 H CYS A 71 52.917 -24.548 12.927 1.00 0.00 H new ATOM 0 HA CYS A 71 52.783 -27.334 13.345 1.00 0.00 H new ATOM 0 HB2 CYS A 71 51.009 -25.651 12.452 1.00 0.00 H new ATOM 0 HB3 CYS A 71 51.793 -25.827 10.894 1.00 0.00 H new ATOM 1108 N GLN A 72 53.968 -28.572 11.520 1.00 0.00 N ATOM 1109 CA GLN A 72 54.881 -29.374 10.695 1.00 0.00 C ATOM 1110 C GLN A 72 54.184 -30.509 9.913 1.00 0.00 C ATOM 1111 O GLN A 72 54.837 -31.203 9.131 1.00 0.00 O ATOM 1112 CB GLN A 72 55.991 -29.926 11.615 1.00 0.00 C ATOM 1113 CG GLN A 72 56.967 -28.844 12.119 1.00 0.00 C ATOM 1114 CD GLN A 72 57.581 -29.204 13.469 1.00 0.00 C ATOM 1115 OE1 GLN A 72 58.413 -30.094 13.594 1.00 0.00 O ATOM 1116 NE2 GLN A 72 57.194 -28.529 14.533 1.00 0.00 N ATOM 0 H GLN A 72 53.328 -29.144 12.071 1.00 0.00 H new ATOM 0 HA GLN A 72 55.300 -28.727 9.924 1.00 0.00 H new ATOM 0 HB2 GLN A 72 55.531 -30.417 12.473 1.00 0.00 H new ATOM 0 HB3 GLN A 72 56.553 -30.688 11.076 1.00 0.00 H new ATOM 0 HG2 GLN A 72 57.762 -28.704 11.386 1.00 0.00 H new ATOM 0 HG3 GLN A 72 56.441 -27.893 12.203 1.00 0.00 H new ATOM 0 HE21 GLN A 72 56.502 -27.786 14.441 1.00 0.00 H new ATOM 0 HE22 GLN A 72 57.587 -28.750 15.448 1.00 0.00 H new ATOM 1125 N GLU A 73 52.871 -30.707 10.081 1.00 0.00 N ATOM 1126 CA GLU A 73 52.100 -31.733 9.361 1.00 0.00 C ATOM 1127 C GLU A 73 51.752 -31.278 7.926 1.00 0.00 C ATOM 1128 O GLU A 73 51.710 -30.081 7.628 1.00 0.00 O ATOM 1129 CB GLU A 73 50.854 -32.092 10.195 1.00 0.00 C ATOM 1130 CG GLU A 73 50.036 -33.299 9.707 1.00 0.00 C ATOM 1131 CD GLU A 73 50.899 -34.556 9.488 1.00 0.00 C ATOM 1132 OE1 GLU A 73 51.479 -34.680 8.381 1.00 0.00 O ATOM 1133 OE2 GLU A 73 51.006 -35.404 10.405 1.00 0.00 O ATOM 0 H GLU A 73 52.306 -30.155 10.727 1.00 0.00 H new ATOM 0 HA GLU A 73 52.704 -32.632 9.241 1.00 0.00 H new ATOM 0 HB2 GLU A 73 51.171 -32.285 11.220 1.00 0.00 H new ATOM 0 HB3 GLU A 73 50.198 -31.222 10.223 1.00 0.00 H new ATOM 0 HG2 GLU A 73 49.256 -33.522 10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 73 49.536 -33.040 8.774 1.00 0.00 H new ATOM 1140 N ASN A 74 51.484 -32.234 7.032 1.00 0.00 N ATOM 1141 CA ASN A 74 51.187 -32.014 5.609 1.00 0.00 C ATOM 1142 C ASN A 74 49.716 -32.266 5.223 1.00 0.00 C ATOM 1143 O ASN A 74 49.318 -32.036 4.081 1.00 0.00 O ATOM 1144 CB ASN A 74 52.198 -32.813 4.766 1.00 0.00 C ATOM 1145 CG ASN A 74 51.935 -34.298 4.579 1.00 0.00 C ATOM 1146 OD1 ASN A 74 51.682 -34.758 3.474 1.00 0.00 O ATOM 1147 ND2 ASN A 74 51.978 -35.112 5.610 1.00 0.00 N ATOM 0 H ASN A 74 51.467 -33.221 7.287 1.00 0.00 H new ATOM 0 HA ASN A 74 51.309 -30.953 5.392 1.00 0.00 H new ATOM 0 HB2 ASN A 74 52.251 -32.354 3.779 1.00 0.00 H new ATOM 0 HB3 ASN A 74 53.181 -32.700 5.223 1.00 0.00 H new ATOM 0 HD21 ASN A 74 51.802 -36.108 5.481 1.00 0.00 H new ATOM 0 HD22 ASN A 74 52.187 -34.747 6.539 1.00 0.00 H new ATOM 1154 N LYS A 75 48.919 -32.735 6.191 1.00 0.00 N ATOM 1155 CA LYS A 75 47.492 -33.090 6.096 1.00 0.00 C ATOM 1156 C LYS A 75 46.581 -32.258 7.024 1.00 0.00 C ATOM 1157 O LYS A 75 45.431 -32.638 7.263 1.00 0.00 O ATOM 1158 CB LYS A 75 47.357 -34.592 6.427 1.00 0.00 C ATOM 1159 CG LYS A 75 48.350 -35.524 5.716 1.00 0.00 C ATOM 1160 CD LYS A 75 48.244 -35.474 4.191 1.00 0.00 C ATOM 1161 CE LYS A 75 49.182 -36.540 3.633 1.00 0.00 C ATOM 1162 NZ LYS A 75 49.369 -36.405 2.166 1.00 0.00 N ATOM 0 H LYS A 75 49.279 -32.889 7.133 1.00 0.00 H new ATOM 0 HA LYS A 75 47.157 -32.868 5.083 1.00 0.00 H new ATOM 0 HB2 LYS A 75 47.474 -34.720 7.503 1.00 0.00 H new ATOM 0 HB3 LYS A 75 46.345 -34.911 6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 75 49.364 -35.256 6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 75 48.181 -36.547 6.051 1.00 0.00 H new ATOM 0 HD2 LYS A 75 47.219 -35.660 3.871 1.00 0.00 H new ATOM 0 HD3 LYS A 75 48.520 -34.487 3.819 1.00 0.00 H new ATOM 0 HE2 LYS A 75 50.149 -36.467 4.130 1.00 0.00 H new ATOM 0 HE3 LYS A 75 48.782 -37.529 3.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 49.482 -37.348 1.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 48.538 -35.937 1.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 50.218 -35.835 1.975 1.00 0.00 H new ATOM 1176 N CYS A 76 47.099 -31.153 7.562 1.00 0.00 N ATOM 1177 CA CYS A 76 46.420 -30.234 8.483 1.00 0.00 C ATOM 1178 C CYS A 76 45.035 -29.783 7.926 1.00 0.00 C ATOM 1179 O CYS A 76 44.929 -29.510 6.724 1.00 0.00 O ATOM 1180 CB CYS A 76 47.408 -29.074 8.729 1.00 0.00 C ATOM 1181 SG CYS A 76 47.220 -28.326 10.377 1.00 0.00 S ATOM 0 H CYS A 76 48.054 -30.857 7.358 1.00 0.00 H new ATOM 0 HA CYS A 76 46.173 -30.711 9.432 1.00 0.00 H new ATOM 0 HB2 CYS A 76 48.428 -29.441 8.616 1.00 0.00 H new ATOM 0 HB3 CYS A 76 47.259 -28.308 7.968 1.00 0.00 H new ATOM 1186 N PRO A 77 43.950 -29.725 8.729 1.00 0.00 N ATOM 1187 CA PRO A 77 42.613 -29.394 8.228 1.00 0.00 C ATOM 1188 C PRO A 77 42.425 -27.933 7.779 1.00 0.00 C ATOM 1189 O PRO A 77 41.572 -27.668 6.929 1.00 0.00 O ATOM 1190 CB PRO A 77 41.655 -29.756 9.367 1.00 0.00 C ATOM 1191 CG PRO A 77 42.510 -29.598 10.621 1.00 0.00 C ATOM 1192 CD PRO A 77 43.894 -30.042 10.149 1.00 0.00 C ATOM 0 HA PRO A 77 42.423 -29.955 7.313 1.00 0.00 H new ATOM 0 HB2 PRO A 77 40.788 -29.095 9.387 1.00 0.00 H new ATOM 0 HB3 PRO A 77 41.278 -30.773 9.265 1.00 0.00 H new ATOM 0 HG2 PRO A 77 42.516 -28.568 10.979 1.00 0.00 H new ATOM 0 HG3 PRO A 77 42.144 -30.218 11.440 1.00 0.00 H new ATOM 0 HD2 PRO A 77 44.679 -29.522 10.697 1.00 0.00 H new ATOM 0 HD3 PRO A 77 44.041 -31.109 10.318 1.00 0.00 H new ATOM 1200 N VAL A 78 43.196 -26.985 8.323 1.00 0.00 N ATOM 1201 CA VAL A 78 43.117 -25.554 7.972 1.00 0.00 C ATOM 1202 C VAL A 78 43.538 -25.347 6.504 1.00 0.00 C ATOM 1203 O VAL A 78 44.615 -25.819 6.124 1.00 0.00 O ATOM 1204 CB VAL A 78 43.998 -24.718 8.922 1.00 0.00 C ATOM 1205 CG1 VAL A 78 43.872 -23.216 8.646 1.00 0.00 C ATOM 1206 CG2 VAL A 78 43.596 -24.938 10.390 1.00 0.00 C ATOM 0 H VAL A 78 43.903 -27.188 9.029 1.00 0.00 H new ATOM 0 HA VAL A 78 42.086 -25.217 8.085 1.00 0.00 H new ATOM 0 HB VAL A 78 45.022 -25.048 8.745 1.00 0.00 H new ATOM 0 HG11 VAL A 78 44.509 -22.664 9.337 1.00 0.00 H new ATOM 0 HG12 VAL A 78 44.182 -23.007 7.622 1.00 0.00 H new ATOM 0 HG13 VAL A 78 42.836 -22.907 8.782 1.00 0.00 H new ATOM 0 HG21 VAL A 78 44.235 -24.336 11.036 1.00 0.00 H new ATOM 0 HG22 VAL A 78 42.556 -24.643 10.531 1.00 0.00 H new ATOM 0 HG23 VAL A 78 43.712 -25.991 10.645 1.00 0.00 H new ATOM 1216 N PRO A 79 42.747 -24.654 5.654 1.00 0.00 N ATOM 1217 CA PRO A 79 43.086 -24.495 4.233 1.00 0.00 C ATOM 1218 C PRO A 79 44.364 -23.677 3.977 1.00 0.00 C ATOM 1219 O PRO A 79 45.062 -23.901 2.985 1.00 0.00 O ATOM 1220 CB PRO A 79 41.853 -23.851 3.588 1.00 0.00 C ATOM 1221 CG PRO A 79 41.162 -23.122 4.741 1.00 0.00 C ATOM 1222 CD PRO A 79 41.463 -24.017 5.943 1.00 0.00 C ATOM 0 HA PRO A 79 43.321 -25.465 3.796 1.00 0.00 H new ATOM 0 HB2 PRO A 79 42.135 -23.161 2.793 1.00 0.00 H new ATOM 0 HB3 PRO A 79 41.199 -24.601 3.143 1.00 0.00 H new ATOM 0 HG2 PRO A 79 41.558 -22.116 4.878 1.00 0.00 H new ATOM 0 HG3 PRO A 79 40.090 -23.022 4.571 1.00 0.00 H new ATOM 0 HD2 PRO A 79 41.514 -23.433 6.862 1.00 0.00 H new ATOM 0 HD3 PRO A 79 40.679 -24.762 6.082 1.00 0.00 H new ATOM 1230 N PHE A 80 44.683 -22.725 4.858 1.00 0.00 N ATOM 1231 CA PHE A 80 45.854 -21.856 4.717 1.00 0.00 C ATOM 1232 C PHE A 80 47.148 -22.361 5.356 1.00 0.00 C ATOM 1233 O PHE A 80 48.211 -21.976 4.875 1.00 0.00 O ATOM 1234 CB PHE A 80 45.503 -20.456 5.221 1.00 0.00 C ATOM 1235 CG PHE A 80 44.980 -19.601 4.097 1.00 0.00 C ATOM 1236 CD1 PHE A 80 45.891 -19.001 3.207 1.00 0.00 C ATOM 1237 CD2 PHE A 80 43.597 -19.495 3.877 1.00 0.00 C ATOM 1238 CE1 PHE A 80 45.412 -18.287 2.096 1.00 0.00 C ATOM 1239 CE2 PHE A 80 43.118 -18.780 2.765 1.00 0.00 C ATOM 1240 CZ PHE A 80 44.025 -18.179 1.873 1.00 0.00 C ATOM 0 H PHE A 80 44.132 -22.534 5.695 1.00 0.00 H new ATOM 0 HA PHE A 80 46.085 -21.846 3.652 1.00 0.00 H new ATOM 0 HB2 PHE A 80 44.755 -20.525 6.010 1.00 0.00 H new ATOM 0 HB3 PHE A 80 46.386 -19.990 5.659 1.00 0.00 H new ATOM 0 HD1 PHE A 80 46.954 -19.089 3.378 1.00 0.00 H new ATOM 0 HD2 PHE A 80 42.903 -19.962 4.560 1.00 0.00 H new ATOM 0 HE1 PHE A 80 46.107 -17.821 1.413 1.00 0.00 H new ATOM 0 HE2 PHE A 80 42.055 -18.692 2.596 1.00 0.00 H new ATOM 0 HZ PHE A 80 43.657 -17.634 1.016 1.00 0.00 H new ATOM 1250 N CYS A 81 47.093 -23.208 6.390 1.00 0.00 N ATOM 1251 CA CYS A 81 48.291 -23.731 7.066 1.00 0.00 C ATOM 1252 C CYS A 81 49.313 -24.296 6.057 1.00 0.00 C ATOM 1253 O CYS A 81 50.462 -23.841 6.012 1.00 0.00 O ATOM 1254 CB CYS A 81 47.852 -24.747 8.136 1.00 0.00 C ATOM 1255 SG CYS A 81 49.249 -25.544 8.996 1.00 0.00 S ATOM 0 H CYS A 81 46.217 -23.552 6.784 1.00 0.00 H new ATOM 0 HA CYS A 81 48.818 -22.922 7.571 1.00 0.00 H new ATOM 0 HB2 CYS A 81 47.224 -24.242 8.870 1.00 0.00 H new ATOM 0 HB3 CYS A 81 47.238 -25.516 7.666 1.00 0.00 H new ATOM 1260 N LEU A 82 48.876 -25.215 5.184 1.00 0.00 N ATOM 1261 CA LEU A 82 49.718 -25.808 4.133 1.00 0.00 C ATOM 1262 C LEU A 82 50.275 -24.752 3.164 1.00 0.00 C ATOM 1263 O LEU A 82 51.474 -24.742 2.881 1.00 0.00 O ATOM 1264 CB LEU A 82 48.958 -26.893 3.341 1.00 0.00 C ATOM 1265 CG LEU A 82 48.478 -28.153 4.090 1.00 0.00 C ATOM 1266 CD1 LEU A 82 49.475 -28.686 5.120 1.00 0.00 C ATOM 1267 CD2 LEU A 82 47.136 -27.959 4.787 1.00 0.00 C ATOM 0 H LEU A 82 47.920 -25.571 5.187 1.00 0.00 H new ATOM 0 HA LEU A 82 50.560 -26.272 4.647 1.00 0.00 H new ATOM 0 HB2 LEU A 82 48.084 -26.423 2.890 1.00 0.00 H new ATOM 0 HB3 LEU A 82 49.602 -27.219 2.524 1.00 0.00 H new ATOM 0 HG LEU A 82 48.376 -28.889 3.293 1.00 0.00 H new ATOM 0 HD11 LEU A 82 49.062 -29.572 5.602 1.00 0.00 H new ATOM 0 HD12 LEU A 82 50.409 -28.946 4.622 1.00 0.00 H new ATOM 0 HD13 LEU A 82 49.666 -27.920 5.872 1.00 0.00 H new ATOM 0 HD21 LEU A 82 46.854 -28.881 5.296 1.00 0.00 H new ATOM 0 HD22 LEU A 82 47.218 -27.153 5.516 1.00 0.00 H new ATOM 0 HD23 LEU A 82 46.376 -27.704 4.048 1.00 0.00 H new ATOM 1279 N ASN A 83 49.422 -23.850 2.672 1.00 0.00 N ATOM 1280 CA ASN A 83 49.818 -22.785 1.747 1.00 0.00 C ATOM 1281 C ASN A 83 50.878 -21.843 2.353 1.00 0.00 C ATOM 1282 O ASN A 83 51.814 -21.443 1.659 1.00 0.00 O ATOM 1283 CB ASN A 83 48.561 -22.019 1.294 1.00 0.00 C ATOM 1284 CG ASN A 83 47.777 -22.790 0.243 1.00 0.00 C ATOM 1285 OD1 ASN A 83 48.178 -22.878 -0.910 1.00 0.00 O ATOM 1286 ND2 ASN A 83 46.652 -23.383 0.578 1.00 0.00 N ATOM 0 H ASN A 83 48.429 -23.838 2.906 1.00 0.00 H new ATOM 0 HA ASN A 83 50.293 -23.239 0.877 1.00 0.00 H new ATOM 0 HB2 ASN A 83 47.922 -21.827 2.156 1.00 0.00 H new ATOM 0 HB3 ASN A 83 48.852 -21.049 0.891 1.00 0.00 H new ATOM 0 HD21 ASN A 83 46.125 -23.908 -0.120 1.00 0.00 H new ATOM 0 HD22 ASN A 83 46.306 -23.318 1.535 1.00 0.00 H new ATOM 1293 N ILE A 84 50.753 -21.497 3.639 1.00 0.00 N ATOM 1294 CA ILE A 84 51.686 -20.613 4.339 1.00 0.00 C ATOM 1295 C ILE A 84 52.984 -21.346 4.705 1.00 0.00 C ATOM 1296 O ILE A 84 54.060 -20.885 4.324 1.00 0.00 O ATOM 1297 CB ILE A 84 50.983 -19.993 5.570 1.00 0.00 C ATOM 1298 CG1 ILE A 84 49.747 -19.160 5.157 1.00 0.00 C ATOM 1299 CG2 ILE A 84 51.904 -19.080 6.400 1.00 0.00 C ATOM 1300 CD1 ILE A 84 48.814 -18.901 6.334 1.00 0.00 C ATOM 0 H ILE A 84 49.990 -21.829 4.229 1.00 0.00 H new ATOM 0 HA ILE A 84 51.980 -19.800 3.675 1.00 0.00 H new ATOM 0 HB ILE A 84 50.687 -20.846 6.181 1.00 0.00 H new ATOM 0 HG12 ILE A 84 50.075 -18.209 4.738 1.00 0.00 H new ATOM 0 HG13 ILE A 84 49.203 -19.684 4.371 1.00 0.00 H new ATOM 0 HG21 ILE A 84 51.350 -18.678 7.248 1.00 0.00 H new ATOM 0 HG22 ILE A 84 52.755 -19.656 6.763 1.00 0.00 H new ATOM 0 HG23 ILE A 84 52.260 -18.259 5.777 1.00 0.00 H new ATOM 0 HD11 ILE A 84 47.960 -18.313 5.999 1.00 0.00 H new ATOM 0 HD12 ILE A 84 48.464 -19.851 6.737 1.00 0.00 H new ATOM 0 HD13 ILE A 84 49.350 -18.353 7.109 1.00 0.00 H new ATOM 1312 N LYS A 85 52.925 -22.485 5.409 1.00 0.00 N ATOM 1313 CA LYS A 85 54.123 -23.236 5.844 1.00 0.00 C ATOM 1314 C LYS A 85 55.079 -23.592 4.695 1.00 0.00 C ATOM 1315 O LYS A 85 56.292 -23.510 4.869 1.00 0.00 O ATOM 1316 CB LYS A 85 53.723 -24.434 6.732 1.00 0.00 C ATOM 1317 CG LYS A 85 53.330 -25.706 5.966 1.00 0.00 C ATOM 1318 CD LYS A 85 52.338 -26.610 6.708 1.00 0.00 C ATOM 1319 CE LYS A 85 52.636 -26.874 8.183 1.00 0.00 C ATOM 1320 NZ LYS A 85 51.461 -27.527 8.784 1.00 0.00 N ATOM 0 H LYS A 85 52.046 -22.917 5.696 1.00 0.00 H new ATOM 0 HA LYS A 85 54.719 -22.569 6.467 1.00 0.00 H new ATOM 0 HB2 LYS A 85 54.555 -24.670 7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 85 52.887 -24.135 7.364 1.00 0.00 H new ATOM 0 HG2 LYS A 85 52.896 -25.419 5.008 1.00 0.00 H new ATOM 0 HG3 LYS A 85 54.232 -26.278 5.749 1.00 0.00 H new ATOM 0 HD2 LYS A 85 51.346 -26.163 6.634 1.00 0.00 H new ATOM 0 HD3 LYS A 85 52.295 -27.568 6.191 1.00 0.00 H new ATOM 0 HE2 LYS A 85 53.516 -27.509 8.285 1.00 0.00 H new ATOM 0 HE3 LYS A 85 52.856 -25.939 8.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 51.618 -27.654 9.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 50.620 -26.934 8.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 51.314 -28.455 8.339 1.00 0.00 H new ATOM 1334 N HIS A 86 54.559 -23.905 3.504 1.00 0.00 N ATOM 1335 CA HIS A 86 55.367 -24.191 2.307 1.00 0.00 C ATOM 1336 C HIS A 86 56.131 -22.972 1.755 1.00 0.00 C ATOM 1337 O HIS A 86 57.130 -23.147 1.052 1.00 0.00 O ATOM 1338 CB HIS A 86 54.458 -24.738 1.202 1.00 0.00 C ATOM 1339 CG HIS A 86 54.238 -26.234 1.254 1.00 0.00 C ATOM 1340 ND1 HIS A 86 54.627 -27.138 0.289 1.00 0.00 N ATOM 1341 CD2 HIS A 86 53.637 -26.955 2.251 1.00 0.00 C ATOM 1342 CE1 HIS A 86 54.270 -28.369 0.692 1.00 0.00 C ATOM 1343 NE2 HIS A 86 53.661 -28.309 1.890 1.00 0.00 N ATOM 0 H HIS A 86 53.554 -23.968 3.339 1.00 0.00 H new ATOM 0 HA HIS A 86 56.117 -24.920 2.616 1.00 0.00 H new ATOM 0 HB2 HIS A 86 53.491 -24.239 1.264 1.00 0.00 H new ATOM 0 HB3 HIS A 86 54.888 -24.480 0.234 1.00 0.00 H new ATOM 0 HD2 HIS A 86 53.217 -26.550 3.160 1.00 0.00 H new ATOM 0 HE1 HIS A 86 54.447 -29.277 0.134 1.00 0.00 H new ATOM 0 HE2 HIS A 86 53.291 -29.092 2.428 1.00 0.00 H new ATOM 1351 N LYS A 87 55.702 -21.748 2.081 1.00 0.00 N ATOM 1352 CA LYS A 87 56.419 -20.509 1.735 1.00 0.00 C ATOM 1353 C LYS A 87 57.396 -20.151 2.865 1.00 0.00 C ATOM 1354 O LYS A 87 58.552 -19.825 2.606 1.00 0.00 O ATOM 1355 CB LYS A 87 55.406 -19.386 1.456 1.00 0.00 C ATOM 1356 CG LYS A 87 56.023 -18.264 0.600 1.00 0.00 C ATOM 1357 CD LYS A 87 55.105 -17.040 0.436 1.00 0.00 C ATOM 1358 CE LYS A 87 53.744 -17.350 -0.207 1.00 0.00 C ATOM 1359 NZ LYS A 87 53.799 -17.394 -1.689 1.00 0.00 N ATOM 0 H LYS A 87 54.838 -21.585 2.598 1.00 0.00 H new ATOM 0 HA LYS A 87 57.005 -20.649 0.827 1.00 0.00 H new ATOM 0 HB2 LYS A 87 54.537 -19.799 0.944 1.00 0.00 H new ATOM 0 HB3 LYS A 87 55.053 -18.971 2.400 1.00 0.00 H new ATOM 0 HG2 LYS A 87 56.961 -17.946 1.054 1.00 0.00 H new ATOM 0 HG3 LYS A 87 56.265 -18.661 -0.386 1.00 0.00 H new ATOM 0 HD2 LYS A 87 54.937 -16.593 1.416 1.00 0.00 H new ATOM 0 HD3 LYS A 87 55.619 -16.294 -0.171 1.00 0.00 H new ATOM 0 HE2 LYS A 87 53.382 -18.308 0.166 1.00 0.00 H new ATOM 0 HE3 LYS A 87 53.022 -16.594 0.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 53.008 -17.965 -2.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 53.729 -16.428 -2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 54.699 -17.820 -1.991 1.00 0.00 H new ATOM 1373 N LEU A 88 56.951 -20.277 4.122 1.00 0.00 N ATOM 1374 CA LEU A 88 57.758 -20.005 5.329 1.00 0.00 C ATOM 1375 C LEU A 88 58.970 -20.940 5.489 1.00 0.00 C ATOM 1376 O LEU A 88 60.000 -20.489 5.990 1.00 0.00 O ATOM 1377 CB LEU A 88 56.857 -20.060 6.582 1.00 0.00 C ATOM 1378 CG LEU A 88 56.209 -18.723 6.987 1.00 0.00 C ATOM 1379 CD1 LEU A 88 55.388 -18.072 5.871 1.00 0.00 C ATOM 1380 CD2 LEU A 88 55.326 -18.960 8.215 1.00 0.00 C ATOM 0 H LEU A 88 56.000 -20.577 4.338 1.00 0.00 H new ATOM 0 HA LEU A 88 58.172 -19.004 5.210 1.00 0.00 H new ATOM 0 HB2 LEU A 88 56.066 -20.790 6.409 1.00 0.00 H new ATOM 0 HB3 LEU A 88 57.450 -20.426 7.420 1.00 0.00 H new ATOM 0 HG LEU A 88 57.017 -18.026 7.209 1.00 0.00 H new ATOM 0 HD11 LEU A 88 54.963 -17.135 6.231 1.00 0.00 H new ATOM 0 HD12 LEU A 88 56.032 -17.873 5.014 1.00 0.00 H new ATOM 0 HD13 LEU A 88 54.583 -18.744 5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 88 54.860 -18.021 8.514 1.00 0.00 H new ATOM 0 HD22 LEU A 88 54.552 -19.688 7.972 1.00 0.00 H new ATOM 0 HD23 LEU A 88 55.937 -19.339 9.034 1.00 0.00 H new ATOM 1392 N ARG A 89 58.885 -22.207 5.058 1.00 0.00 N ATOM 1393 CA ARG A 89 59.975 -23.208 5.114 1.00 0.00 C ATOM 1394 C ARG A 89 61.276 -22.761 4.440 1.00 0.00 C ATOM 1395 O ARG A 89 62.362 -23.172 4.846 1.00 0.00 O ATOM 1396 CB ARG A 89 59.440 -24.576 4.653 1.00 0.00 C ATOM 1397 CG ARG A 89 58.953 -24.656 3.211 1.00 0.00 C ATOM 1398 CD ARG A 89 60.079 -24.866 2.211 1.00 0.00 C ATOM 1399 NE ARG A 89 59.566 -24.707 0.837 1.00 0.00 N ATOM 1400 CZ ARG A 89 60.044 -25.238 -0.273 1.00 0.00 C ATOM 1401 NH1 ARG A 89 61.112 -25.983 -0.289 1.00 0.00 N ATOM 1402 NH2 ARG A 89 59.435 -25.026 -1.405 1.00 0.00 N ATOM 0 H ARG A 89 58.030 -22.581 4.646 1.00 0.00 H new ATOM 0 HA ARG A 89 60.288 -23.314 6.153 1.00 0.00 H new ATOM 0 HB2 ARG A 89 60.228 -25.316 4.790 1.00 0.00 H new ATOM 0 HB3 ARG A 89 58.617 -24.861 5.309 1.00 0.00 H new ATOM 0 HG2 ARG A 89 58.238 -25.473 3.120 1.00 0.00 H new ATOM 0 HG3 ARG A 89 58.421 -23.738 2.962 1.00 0.00 H new ATOM 0 HD2 ARG A 89 60.879 -24.149 2.395 1.00 0.00 H new ATOM 0 HD3 ARG A 89 60.507 -25.861 2.336 1.00 0.00 H new ATOM 0 HE ARG A 89 58.742 -24.115 0.732 1.00 0.00 H new ATOM 0 HH11 ARG A 89 61.613 -26.175 0.579 1.00 0.00 H new ATOM 0 HH12 ARG A 89 61.448 -26.374 -1.169 1.00 0.00 H new ATOM 0 HH21 ARG A 89 58.592 -24.452 -1.431 1.00 0.00 H new ATOM 0 HH22 ARG A 89 59.801 -25.434 -2.265 1.00 0.00 H new ATOM 1416 N GLN A 90 61.164 -21.880 3.446 1.00 0.00 N ATOM 1417 CA GLN A 90 62.290 -21.288 2.702 1.00 0.00 C ATOM 1418 C GLN A 90 63.250 -20.477 3.597 1.00 0.00 C ATOM 1419 O GLN A 90 64.415 -20.288 3.245 1.00 0.00 O ATOM 1420 CB GLN A 90 61.760 -20.400 1.560 1.00 0.00 C ATOM 1421 CG GLN A 90 60.918 -21.131 0.496 1.00 0.00 C ATOM 1422 CD GLN A 90 61.747 -22.027 -0.426 1.00 0.00 C ATOM 1423 OE1 GLN A 90 62.421 -22.958 -0.007 1.00 0.00 O ATOM 1424 NE2 GLN A 90 61.731 -21.795 -1.722 1.00 0.00 N ATOM 0 H GLN A 90 60.258 -21.543 3.121 1.00 0.00 H new ATOM 0 HA GLN A 90 62.866 -22.119 2.294 1.00 0.00 H new ATOM 0 HB2 GLN A 90 61.156 -19.602 1.992 1.00 0.00 H new ATOM 0 HB3 GLN A 90 62.608 -19.926 1.066 1.00 0.00 H new ATOM 0 HG2 GLN A 90 60.162 -21.737 0.995 1.00 0.00 H new ATOM 0 HG3 GLN A 90 60.388 -20.393 -0.107 1.00 0.00 H new ATOM 0 HE21 GLN A 90 61.177 -21.025 -2.095 1.00 0.00 H new ATOM 0 HE22 GLN A 90 62.273 -22.386 -2.353 1.00 0.00 H new ATOM 1433 N GLN A 91 62.783 -20.027 4.769 1.00 0.00 N ATOM 1434 CA GLN A 91 63.581 -19.304 5.770 1.00 0.00 C ATOM 1435 C GLN A 91 64.600 -20.210 6.497 1.00 0.00 C ATOM 1436 O GLN A 91 65.501 -19.702 7.170 1.00 0.00 O ATOM 1437 CB GLN A 91 62.626 -18.677 6.799 1.00 0.00 C ATOM 1438 CG GLN A 91 61.718 -17.585 6.209 1.00 0.00 C ATOM 1439 CD GLN A 91 60.691 -17.124 7.239 1.00 0.00 C ATOM 1440 OE1 GLN A 91 60.709 -16.002 7.728 1.00 0.00 O ATOM 1441 NE2 GLN A 91 59.774 -17.985 7.623 1.00 0.00 N ATOM 0 H GLN A 91 61.813 -20.159 5.056 1.00 0.00 H new ATOM 0 HA GLN A 91 64.156 -18.540 5.247 1.00 0.00 H new ATOM 0 HB2 GLN A 91 62.004 -19.461 7.230 1.00 0.00 H new ATOM 0 HB3 GLN A 91 63.212 -18.250 7.613 1.00 0.00 H new ATOM 0 HG2 GLN A 91 62.323 -16.737 5.886 1.00 0.00 H new ATOM 0 HG3 GLN A 91 61.208 -17.968 5.325 1.00 0.00 H new ATOM 0 HE21 GLN A 91 59.753 -18.922 7.220 1.00 0.00 H new ATOM 0 HE22 GLN A 91 59.084 -17.716 8.324 1.00 0.00 H new ATOM 1450 N GLN A 92 64.468 -21.538 6.380 1.00 0.00 N ATOM 1451 CA GLN A 92 65.327 -22.559 7.002 1.00 0.00 C ATOM 1452 C GLN A 92 65.558 -23.736 6.042 1.00 0.00 C ATOM 1453 O GLN A 92 66.146 -23.572 4.963 1.00 0.00 O ATOM 1454 CB GLN A 92 64.675 -23.078 8.300 1.00 0.00 C ATOM 1455 CG GLN A 92 64.600 -22.061 9.454 1.00 0.00 C ATOM 1456 CD GLN A 92 65.968 -21.739 10.061 1.00 0.00 C ATOM 1457 OE1 GLN A 92 66.434 -22.387 10.989 1.00 0.00 O ATOM 1458 NE2 GLN A 92 66.668 -20.741 9.566 1.00 0.00 N ATOM 0 H GLN A 92 63.722 -21.952 5.821 1.00 0.00 H new ATOM 0 HA GLN A 92 66.288 -22.100 7.233 1.00 0.00 H new ATOM 0 HB2 GLN A 92 63.664 -23.415 8.069 1.00 0.00 H new ATOM 0 HB3 GLN A 92 65.232 -23.950 8.643 1.00 0.00 H new ATOM 0 HG2 GLN A 92 64.145 -21.140 9.090 1.00 0.00 H new ATOM 0 HG3 GLN A 92 63.946 -22.453 10.233 1.00 0.00 H new ATOM 0 HE21 GLN A 92 66.295 -20.191 8.793 1.00 0.00 H new ATOM 0 HE22 GLN A 92 67.584 -20.518 9.956 1.00 0.00 H new TER 1467 GLN A 92 ATOM 1468 N GLY B 706 14.014 6.375 8.528 1.00 0.00 N ATOM 1469 CA GLY B 706 13.944 4.943 8.824 1.00 0.00 C ATOM 1470 C GLY B 706 15.301 4.307 9.164 1.00 0.00 C ATOM 1471 O GLY B 706 16.334 4.984 9.168 1.00 0.00 O ATOM 0 HA2 GLY B 706 13.262 4.788 9.660 1.00 0.00 H new ATOM 0 HA3 GLY B 706 13.517 4.425 7.965 1.00 0.00 H new ATOM 1475 N SER B 707 15.288 2.996 9.436 1.00 0.00 N ATOM 1476 CA SER B 707 16.454 2.167 9.820 1.00 0.00 C ATOM 1477 C SER B 707 17.139 2.611 11.133 1.00 0.00 C ATOM 1478 O SER B 707 16.693 3.543 11.809 1.00 0.00 O ATOM 1479 CB SER B 707 17.455 2.055 8.653 1.00 0.00 C ATOM 1480 OG SER B 707 16.830 1.515 7.497 1.00 0.00 O ATOM 0 H SER B 707 14.426 2.452 9.394 1.00 0.00 H new ATOM 0 HA SER B 707 16.062 1.173 10.034 1.00 0.00 H new ATOM 0 HB2 SER B 707 17.864 3.039 8.424 1.00 0.00 H new ATOM 0 HB3 SER B 707 18.293 1.423 8.947 1.00 0.00 H new ATOM 0 HG SER B 707 17.484 1.455 6.769 1.00 0.00 H new ATOM 1486 N HIS B 708 18.217 1.923 11.531 1.00 0.00 N ATOM 1487 CA HIS B 708 18.983 2.235 12.747 1.00 0.00 C ATOM 1488 C HIS B 708 19.710 3.593 12.634 1.00 0.00 C ATOM 1489 O HIS B 708 20.125 4.005 11.547 1.00 0.00 O ATOM 1490 CB HIS B 708 19.967 1.090 13.051 1.00 0.00 C ATOM 1491 CG HIS B 708 19.305 -0.094 13.719 1.00 0.00 C ATOM 1492 ND1 HIS B 708 19.572 -0.553 14.989 1.00 0.00 N ATOM 1493 CD2 HIS B 708 18.298 -0.876 13.217 1.00 0.00 C ATOM 1494 CE1 HIS B 708 18.739 -1.572 15.256 1.00 0.00 C ATOM 1495 NE2 HIS B 708 17.943 -1.814 14.199 1.00 0.00 N ATOM 0 H HIS B 708 18.587 1.126 11.013 1.00 0.00 H new ATOM 0 HA HIS B 708 18.285 2.326 13.580 1.00 0.00 H new ATOM 0 HB2 HIS B 708 20.433 0.762 12.122 1.00 0.00 H new ATOM 0 HB3 HIS B 708 20.764 1.464 13.693 1.00 0.00 H new ATOM 0 HD1 HIS B 708 20.282 -0.182 15.620 1.00 0.00 H new ATOM 0 HD2 HIS B 708 17.855 -0.786 12.236 1.00 0.00 H new ATOM 0 HE1 HIS B 708 18.712 -2.119 16.187 1.00 0.00 H new ATOM 1503 N MET B 709 19.864 4.284 13.771 1.00 0.00 N ATOM 1504 CA MET B 709 20.484 5.621 13.881 1.00 0.00 C ATOM 1505 C MET B 709 21.478 5.723 15.062 1.00 0.00 C ATOM 1506 O MET B 709 21.734 6.812 15.583 1.00 0.00 O ATOM 1507 CB MET B 709 19.379 6.695 13.982 1.00 0.00 C ATOM 1508 CG MET B 709 18.411 6.696 12.791 1.00 0.00 C ATOM 1509 SD MET B 709 17.189 8.035 12.834 1.00 0.00 S ATOM 1510 CE MET B 709 16.221 7.592 11.367 1.00 0.00 C ATOM 0 H MET B 709 19.552 3.920 14.672 1.00 0.00 H new ATOM 0 HA MET B 709 21.073 5.792 12.980 1.00 0.00 H new ATOM 0 HB2 MET B 709 18.812 6.536 14.900 1.00 0.00 H new ATOM 0 HB3 MET B 709 19.845 7.677 14.061 1.00 0.00 H new ATOM 0 HG2 MET B 709 18.986 6.773 11.868 1.00 0.00 H new ATOM 0 HG3 MET B 709 17.887 5.741 12.761 1.00 0.00 H new ATOM 0 HE1 MET B 709 15.414 8.312 11.232 1.00 0.00 H new ATOM 0 HE2 MET B 709 16.866 7.601 10.489 1.00 0.00 H new ATOM 0 HE3 MET B 709 15.799 6.595 11.497 1.00 0.00 H new ATOM 1520 N SER B 710 22.032 4.590 15.503 1.00 0.00 N ATOM 1521 CA SER B 710 22.976 4.482 16.628 1.00 0.00 C ATOM 1522 C SER B 710 24.051 3.408 16.394 1.00 0.00 C ATOM 1523 O SER B 710 24.022 2.668 15.409 1.00 0.00 O ATOM 1524 CB SER B 710 22.200 4.191 17.923 1.00 0.00 C ATOM 1525 OG SER B 710 21.557 2.926 17.855 1.00 0.00 O ATOM 0 H SER B 710 21.830 3.687 15.073 1.00 0.00 H new ATOM 0 HA SER B 710 23.498 5.435 16.714 1.00 0.00 H new ATOM 0 HB2 SER B 710 22.882 4.212 18.773 1.00 0.00 H new ATOM 0 HB3 SER B 710 21.458 4.972 18.091 1.00 0.00 H new ATOM 0 HG SER B 710 21.071 2.761 18.690 1.00 0.00 H new ATOM 1531 N GLU B 711 25.020 3.320 17.307 1.00 0.00 N ATOM 1532 CA GLU B 711 26.163 2.391 17.290 1.00 0.00 C ATOM 1533 C GLU B 711 25.802 0.918 17.606 1.00 0.00 C ATOM 1534 O GLU B 711 26.677 0.108 17.928 1.00 0.00 O ATOM 1535 CB GLU B 711 27.250 2.910 18.261 1.00 0.00 C ATOM 1536 CG GLU B 711 27.817 4.307 17.936 1.00 0.00 C ATOM 1537 CD GLU B 711 26.875 5.498 18.231 1.00 0.00 C ATOM 1538 OE1 GLU B 711 25.940 5.374 19.061 1.00 0.00 O ATOM 1539 OE2 GLU B 711 27.070 6.581 17.628 1.00 0.00 O ATOM 0 H GLU B 711 25.033 3.927 18.126 1.00 0.00 H new ATOM 0 HA GLU B 711 26.535 2.372 16.266 1.00 0.00 H new ATOM 0 HB2 GLU B 711 26.833 2.931 19.268 1.00 0.00 H new ATOM 0 HB3 GLU B 711 28.074 2.196 18.272 1.00 0.00 H new ATOM 0 HG2 GLU B 711 28.737 4.446 18.503 1.00 0.00 H new ATOM 0 HG3 GLU B 711 28.086 4.333 16.880 1.00 0.00 H new ATOM 1546 N VAL B 712 24.518 0.554 17.518 1.00 0.00 N ATOM 1547 CA VAL B 712 23.977 -0.790 17.798 1.00 0.00 C ATOM 1548 C VAL B 712 22.973 -1.190 16.711 1.00 0.00 C ATOM 1549 O VAL B 712 22.054 -0.433 16.389 1.00 0.00 O ATOM 1550 CB VAL B 712 23.304 -0.840 19.189 1.00 0.00 C ATOM 1551 CG1 VAL B 712 22.804 -2.253 19.526 1.00 0.00 C ATOM 1552 CG2 VAL B 712 24.260 -0.420 20.317 1.00 0.00 C ATOM 0 H VAL B 712 23.792 1.213 17.238 1.00 0.00 H new ATOM 0 HA VAL B 712 24.806 -1.498 17.797 1.00 0.00 H new ATOM 0 HB VAL B 712 22.470 -0.140 19.128 1.00 0.00 H new ATOM 0 HG11 VAL B 712 22.337 -2.248 20.511 1.00 0.00 H new ATOM 0 HG12 VAL B 712 22.074 -2.568 18.780 1.00 0.00 H new ATOM 0 HG13 VAL B 712 23.645 -2.946 19.526 1.00 0.00 H new ATOM 0 HG21 VAL B 712 23.740 -0.472 21.273 1.00 0.00 H new ATOM 0 HG22 VAL B 712 25.119 -1.091 20.334 1.00 0.00 H new ATOM 0 HG23 VAL B 712 24.600 0.601 20.144 1.00 0.00 H new ATOM 1562 N HIS B 713 23.134 -2.396 16.162 1.00 0.00 N ATOM 1563 CA HIS B 713 22.289 -3.007 15.135 1.00 0.00 C ATOM 1564 C HIS B 713 22.492 -4.538 15.132 1.00 0.00 C ATOM 1565 O HIS B 713 23.540 -5.013 15.590 1.00 0.00 O ATOM 1566 CB HIS B 713 22.635 -2.424 13.750 1.00 0.00 C ATOM 1567 CG HIS B 713 24.073 -2.627 13.327 1.00 0.00 C ATOM 1568 ND1 HIS B 713 24.667 -3.813 12.949 1.00 0.00 N ATOM 1569 CD2 HIS B 713 25.043 -1.660 13.276 1.00 0.00 C ATOM 1570 CE1 HIS B 713 25.961 -3.569 12.688 1.00 0.00 C ATOM 1571 NE2 HIS B 713 26.239 -2.265 12.869 1.00 0.00 N ATOM 0 H HIS B 713 23.902 -3.007 16.439 1.00 0.00 H new ATOM 0 HA HIS B 713 21.245 -2.788 15.357 1.00 0.00 H new ATOM 0 HB2 HIS B 713 21.982 -2.879 13.005 1.00 0.00 H new ATOM 0 HB3 HIS B 713 22.418 -1.356 13.755 1.00 0.00 H new ATOM 0 HD1 HIS B 713 24.203 -4.719 12.880 1.00 0.00 H new ATOM 0 HD2 HIS B 713 24.909 -0.614 13.509 1.00 0.00 H new ATOM 0 HE1 HIS B 713 26.678 -4.314 12.377 1.00 0.00 H new ATOM 1579 N PRO B 714 21.531 -5.333 14.623 1.00 0.00 N ATOM 1580 CA PRO B 714 21.650 -6.788 14.542 1.00 0.00 C ATOM 1581 C PRO B 714 22.752 -7.292 13.600 1.00 0.00 C ATOM 1582 O PRO B 714 23.437 -6.534 12.906 1.00 0.00 O ATOM 1583 CB PRO B 714 20.291 -7.299 14.052 1.00 0.00 C ATOM 1584 CG PRO B 714 19.348 -6.142 14.374 1.00 0.00 C ATOM 1585 CD PRO B 714 20.231 -4.930 14.110 1.00 0.00 C ATOM 0 HA PRO B 714 21.931 -7.162 15.527 1.00 0.00 H new ATOM 0 HB2 PRO B 714 20.305 -7.522 12.985 1.00 0.00 H new ATOM 0 HB3 PRO B 714 19.996 -8.214 14.565 1.00 0.00 H new ATOM 0 HG2 PRO B 714 18.463 -6.148 13.738 1.00 0.00 H new ATOM 0 HG3 PRO B 714 18.999 -6.175 15.406 1.00 0.00 H new ATOM 0 HD2 PRO B 714 20.276 -4.691 13.047 1.00 0.00 H new ATOM 0 HD3 PRO B 714 19.856 -4.043 14.620 1.00 0.00 H new ATOM 1593 N SER B 715 22.847 -8.620 13.528 1.00 0.00 N ATOM 1594 CA SER B 715 23.779 -9.400 12.686 1.00 0.00 C ATOM 1595 C SER B 715 23.399 -9.423 11.189 1.00 0.00 C ATOM 1596 O SER B 715 23.669 -10.401 10.487 1.00 0.00 O ATOM 1597 CB SER B 715 23.878 -10.836 13.229 1.00 0.00 C ATOM 1598 OG SER B 715 24.205 -10.835 14.613 1.00 0.00 O ATOM 0 H SER B 715 22.243 -9.224 14.086 1.00 0.00 H new ATOM 0 HA SER B 715 24.746 -8.899 12.742 1.00 0.00 H new ATOM 0 HB2 SER B 715 22.931 -11.353 13.076 1.00 0.00 H new ATOM 0 HB3 SER B 715 24.636 -11.388 12.673 1.00 0.00 H new ATOM 0 HG SER B 715 24.261 -11.758 14.937 1.00 0.00 H new ATOM 1604 N ARG B 716 22.734 -8.370 10.691 1.00 0.00 N ATOM 1605 CA ARG B 716 22.227 -8.206 9.308 1.00 0.00 C ATOM 1606 C ARG B 716 22.747 -6.933 8.612 1.00 0.00 C ATOM 1607 O ARG B 716 22.286 -6.586 7.525 1.00 0.00 O ATOM 1608 CB ARG B 716 20.679 -8.236 9.322 1.00 0.00 C ATOM 1609 CG ARG B 716 20.005 -9.518 9.853 1.00 0.00 C ATOM 1610 CD ARG B 716 20.128 -10.739 8.927 1.00 0.00 C ATOM 1611 NE ARG B 716 21.480 -11.321 8.965 1.00 0.00 N ATOM 1612 CZ ARG B 716 21.990 -12.257 8.189 1.00 0.00 C ATOM 1613 NH1 ARG B 716 21.298 -12.858 7.264 1.00 0.00 N ATOM 1614 NH2 ARG B 716 23.236 -12.592 8.351 1.00 0.00 N ATOM 0 H ARG B 716 22.520 -7.559 11.272 1.00 0.00 H new ATOM 0 HA ARG B 716 22.611 -9.040 8.720 1.00 0.00 H new ATOM 0 HB2 ARG B 716 20.330 -7.397 9.923 1.00 0.00 H new ATOM 0 HB3 ARG B 716 20.328 -8.066 8.304 1.00 0.00 H new ATOM 0 HG2 ARG B 716 20.441 -9.767 10.820 1.00 0.00 H new ATOM 0 HG3 ARG B 716 18.948 -9.313 10.023 1.00 0.00 H new ATOM 0 HD2 ARG B 716 19.399 -11.494 9.222 1.00 0.00 H new ATOM 0 HD3 ARG B 716 19.887 -10.446 7.905 1.00 0.00 H new ATOM 0 HE ARG B 716 22.102 -10.953 9.684 1.00 0.00 H new ATOM 0 HH11 ARG B 716 20.320 -12.610 7.117 1.00 0.00 H new ATOM 0 HH12 ARG B 716 21.734 -13.577 6.687 1.00 0.00 H new ATOM 0 HH21 ARG B 716 23.798 -12.133 9.068 1.00 0.00 H new ATOM 0 HH22 ARG B 716 23.651 -13.314 7.762 1.00 0.00 H new ATOM 1628 N LEU B 717 23.715 -6.250 9.227 1.00 0.00 N ATOM 1629 CA LEU B 717 24.357 -5.025 8.732 1.00 0.00 C ATOM 1630 C LEU B 717 25.843 -5.017 9.147 1.00 0.00 C ATOM 1631 O LEU B 717 26.193 -5.561 10.195 1.00 0.00 O ATOM 1632 CB LEU B 717 23.575 -3.820 9.299 1.00 0.00 C ATOM 1633 CG LEU B 717 23.893 -2.458 8.656 1.00 0.00 C ATOM 1634 CD1 LEU B 717 23.407 -2.373 7.207 1.00 0.00 C ATOM 1635 CD2 LEU B 717 23.220 -1.341 9.454 1.00 0.00 C ATOM 0 H LEU B 717 24.092 -6.548 10.127 1.00 0.00 H new ATOM 0 HA LEU B 717 24.335 -4.971 7.644 1.00 0.00 H new ATOM 0 HB2 LEU B 717 22.509 -4.015 9.185 1.00 0.00 H new ATOM 0 HB3 LEU B 717 23.774 -3.752 10.369 1.00 0.00 H new ATOM 0 HG LEU B 717 24.977 -2.347 8.664 1.00 0.00 H new ATOM 0 HD11 LEU B 717 23.654 -1.394 6.797 1.00 0.00 H new ATOM 0 HD12 LEU B 717 23.893 -3.148 6.614 1.00 0.00 H new ATOM 0 HD13 LEU B 717 22.327 -2.517 7.176 1.00 0.00 H new ATOM 0 HD21 LEU B 717 23.447 -0.379 8.996 1.00 0.00 H new ATOM 0 HD22 LEU B 717 22.141 -1.495 9.457 1.00 0.00 H new ATOM 0 HD23 LEU B 717 23.591 -1.352 10.479 1.00 0.00 H new ATOM 1647 N GLN B 718 26.718 -4.426 8.321 1.00 0.00 N ATOM 1648 CA GLN B 718 28.186 -4.369 8.509 1.00 0.00 C ATOM 1649 C GLN B 718 28.863 -5.751 8.714 1.00 0.00 C ATOM 1650 O GLN B 718 29.966 -5.849 9.258 1.00 0.00 O ATOM 1651 CB GLN B 718 28.574 -3.375 9.630 1.00 0.00 C ATOM 1652 CG GLN B 718 27.812 -2.037 9.701 1.00 0.00 C ATOM 1653 CD GLN B 718 27.834 -1.179 8.435 1.00 0.00 C ATOM 1654 OE1 GLN B 718 28.532 -1.424 7.459 1.00 0.00 O ATOM 1655 NE2 GLN B 718 27.055 -0.116 8.398 1.00 0.00 N ATOM 0 H GLN B 718 26.417 -3.954 7.468 1.00 0.00 H new ATOM 0 HA GLN B 718 28.581 -3.998 7.563 1.00 0.00 H new ATOM 0 HB2 GLN B 718 28.448 -3.883 10.586 1.00 0.00 H new ATOM 0 HB3 GLN B 718 29.636 -3.151 9.526 1.00 0.00 H new ATOM 0 HG2 GLN B 718 26.773 -2.248 9.954 1.00 0.00 H new ATOM 0 HG3 GLN B 718 28.227 -1.450 10.520 1.00 0.00 H new ATOM 0 HE21 GLN B 718 26.464 0.111 9.197 1.00 0.00 H new ATOM 0 HE22 GLN B 718 27.044 0.479 7.570 1.00 0.00 H new ATOM 1664 N THR B 719 28.206 -6.843 8.308 1.00 0.00 N ATOM 1665 CA THR B 719 28.676 -8.228 8.498 1.00 0.00 C ATOM 1666 C THR B 719 30.026 -8.514 7.844 1.00 0.00 C ATOM 1667 O THR B 719 30.935 -8.989 8.522 1.00 0.00 O ATOM 1668 CB THR B 719 27.633 -9.239 7.994 1.00 0.00 C ATOM 1669 OG1 THR B 719 27.205 -8.893 6.692 1.00 0.00 O ATOM 1670 CG2 THR B 719 26.393 -9.265 8.889 1.00 0.00 C ATOM 0 H THR B 719 27.309 -6.791 7.825 1.00 0.00 H new ATOM 0 HA THR B 719 28.813 -8.343 9.573 1.00 0.00 H new ATOM 0 HB THR B 719 28.114 -10.217 8.003 1.00 0.00 H new ATOM 0 HG1 THR B 719 26.542 -9.545 6.381 1.00 0.00 H new ATOM 0 HG21 THR B 719 25.679 -9.991 8.501 1.00 0.00 H new ATOM 0 HG22 THR B 719 26.681 -9.546 9.902 1.00 0.00 H new ATOM 0 HG23 THR B 719 25.934 -8.277 8.903 1.00 0.00 H new ATOM 1678 N THR B 720 30.202 -8.199 6.557 1.00 0.00 N ATOM 1679 CA THR B 720 31.435 -8.430 5.764 1.00 0.00 C ATOM 1680 C THR B 720 32.683 -7.630 6.173 1.00 0.00 C ATOM 1681 O THR B 720 33.691 -7.635 5.466 1.00 0.00 O ATOM 1682 CB THR B 720 31.148 -8.326 4.255 1.00 0.00 C ATOM 1683 OG1 THR B 720 30.334 -7.207 3.951 1.00 0.00 O ATOM 1684 CG2 THR B 720 30.406 -9.584 3.801 1.00 0.00 C ATOM 0 H THR B 720 29.465 -7.757 6.008 1.00 0.00 H new ATOM 0 HA THR B 720 31.718 -9.453 6.011 1.00 0.00 H new ATOM 0 HB THR B 720 32.104 -8.216 3.742 1.00 0.00 H new ATOM 0 HG1 THR B 720 30.174 -7.172 2.985 1.00 0.00 H new ATOM 0 HG21 THR B 720 30.199 -9.519 2.733 1.00 0.00 H new ATOM 0 HG22 THR B 720 31.023 -10.461 3.998 1.00 0.00 H new ATOM 0 HG23 THR B 720 29.467 -9.670 4.348 1.00 0.00 H new ATOM 1692 N ASP B 721 32.648 -6.987 7.339 1.00 0.00 N ATOM 1693 CA ASP B 721 33.772 -6.313 8.003 1.00 0.00 C ATOM 1694 C ASP B 721 33.739 -6.532 9.535 1.00 0.00 C ATOM 1695 O ASP B 721 34.524 -5.936 10.275 1.00 0.00 O ATOM 1696 CB ASP B 721 33.866 -4.835 7.602 1.00 0.00 C ATOM 1697 CG ASP B 721 32.634 -3.998 7.987 1.00 0.00 C ATOM 1698 OD1 ASP B 721 31.697 -3.892 7.160 1.00 0.00 O ATOM 1699 OD2 ASP B 721 32.630 -3.397 9.089 1.00 0.00 O ATOM 0 H ASP B 721 31.786 -6.916 7.880 1.00 0.00 H new ATOM 0 HA ASP B 721 34.695 -6.775 7.651 1.00 0.00 H new ATOM 0 HB2 ASP B 721 34.749 -4.399 8.070 1.00 0.00 H new ATOM 0 HB3 ASP B 721 34.012 -4.771 6.524 1.00 0.00 H new ATOM 1704 N ASN B 722 32.857 -7.425 10.011 1.00 0.00 N ATOM 1705 CA ASN B 722 32.683 -7.800 11.417 1.00 0.00 C ATOM 1706 C ASN B 722 32.712 -9.322 11.664 1.00 0.00 C ATOM 1707 O ASN B 722 32.762 -9.752 12.817 1.00 0.00 O ATOM 1708 CB ASN B 722 31.417 -7.126 11.958 1.00 0.00 C ATOM 1709 CG ASN B 722 31.334 -7.154 13.475 1.00 0.00 C ATOM 1710 OD1 ASN B 722 30.397 -7.674 14.065 1.00 0.00 O ATOM 1711 ND2 ASN B 722 32.310 -6.593 14.157 1.00 0.00 N ATOM 0 H ASN B 722 32.218 -7.927 9.395 1.00 0.00 H new ATOM 0 HA ASN B 722 33.545 -7.435 11.976 1.00 0.00 H new ATOM 0 HB2 ASN B 722 31.388 -6.091 11.617 1.00 0.00 H new ATOM 0 HB3 ASN B 722 30.541 -7.623 11.542 1.00 0.00 H new ATOM 0 HD21 ASN B 722 32.285 -6.592 15.177 1.00 0.00 H new ATOM 0 HD22 ASN B 722 33.092 -6.159 13.666 1.00 0.00 H new ATOM 1718 N LEU B 723 32.781 -10.142 10.603 1.00 0.00 N ATOM 1719 CA LEU B 723 33.025 -11.590 10.688 1.00 0.00 C ATOM 1720 C LEU B 723 34.344 -11.908 11.433 1.00 0.00 C ATOM 1721 O LEU B 723 34.536 -13.034 11.872 1.00 0.00 O ATOM 1722 CB LEU B 723 33.057 -12.206 9.269 1.00 0.00 C ATOM 1723 CG LEU B 723 31.750 -12.271 8.460 1.00 0.00 C ATOM 1724 CD1 LEU B 723 31.943 -13.220 7.278 1.00 0.00 C ATOM 1725 CD2 LEU B 723 30.560 -12.751 9.286 1.00 0.00 C ATOM 0 H LEU B 723 32.667 -9.811 9.645 1.00 0.00 H new ATOM 0 HA LEU B 723 32.208 -12.030 11.259 1.00 0.00 H new ATOM 0 HB2 LEU B 723 33.782 -11.643 8.681 1.00 0.00 H new ATOM 0 HB3 LEU B 723 33.440 -13.222 9.359 1.00 0.00 H new ATOM 0 HG LEU B 723 31.528 -11.257 8.127 1.00 0.00 H new ATOM 0 HD11 LEU B 723 31.021 -13.272 6.699 1.00 0.00 H new ATOM 0 HD12 LEU B 723 32.750 -12.852 6.644 1.00 0.00 H new ATOM 0 HD13 LEU B 723 32.196 -14.214 7.647 1.00 0.00 H new ATOM 0 HD21 LEU B 723 29.668 -12.775 8.660 1.00 0.00 H new ATOM 0 HD22 LEU B 723 30.762 -13.752 9.668 1.00 0.00 H new ATOM 0 HD23 LEU B 723 30.398 -12.069 10.121 1.00 0.00 H new ATOM 1737 N LEU B 724 35.226 -10.913 11.595 1.00 0.00 N ATOM 1738 CA LEU B 724 36.551 -10.953 12.238 1.00 0.00 C ATOM 1739 C LEU B 724 36.661 -11.964 13.410 1.00 0.00 C ATOM 1740 O LEU B 724 36.112 -11.704 14.485 1.00 0.00 O ATOM 1741 CB LEU B 724 36.957 -9.524 12.668 1.00 0.00 C ATOM 1742 CG LEU B 724 36.805 -8.416 11.601 1.00 0.00 C ATOM 1743 CD1 LEU B 724 37.506 -7.143 12.071 1.00 0.00 C ATOM 1744 CD2 LEU B 724 37.401 -8.825 10.255 1.00 0.00 C ATOM 0 H LEU B 724 35.014 -9.977 11.250 1.00 0.00 H new ATOM 0 HA LEU B 724 37.256 -11.326 11.495 1.00 0.00 H new ATOM 0 HB2 LEU B 724 36.360 -9.246 13.537 1.00 0.00 H new ATOM 0 HB3 LEU B 724 37.998 -9.547 12.991 1.00 0.00 H new ATOM 0 HG LEU B 724 35.737 -8.246 11.469 1.00 0.00 H new ATOM 0 HD11 LEU B 724 37.395 -6.366 11.315 1.00 0.00 H new ATOM 0 HD12 LEU B 724 37.059 -6.805 13.006 1.00 0.00 H new ATOM 0 HD13 LEU B 724 38.565 -7.348 12.228 1.00 0.00 H new ATOM 0 HD21 LEU B 724 37.270 -8.015 9.538 1.00 0.00 H new ATOM 0 HD22 LEU B 724 38.464 -9.034 10.376 1.00 0.00 H new ATOM 0 HD23 LEU B 724 36.895 -9.718 9.889 1.00 0.00 H new ATOM 1756 N PRO B 725 37.348 -13.115 13.236 1.00 0.00 N ATOM 1757 CA PRO B 725 37.467 -14.162 14.264 1.00 0.00 C ATOM 1758 C PRO B 725 38.465 -13.846 15.395 1.00 0.00 C ATOM 1759 O PRO B 725 38.568 -14.607 16.356 1.00 0.00 O ATOM 1760 CB PRO B 725 37.927 -15.401 13.487 1.00 0.00 C ATOM 1761 CG PRO B 725 38.805 -14.807 12.392 1.00 0.00 C ATOM 1762 CD PRO B 725 38.033 -13.544 12.018 1.00 0.00 C ATOM 0 HA PRO B 725 36.515 -14.281 14.782 1.00 0.00 H new ATOM 0 HB2 PRO B 725 38.483 -16.092 14.120 1.00 0.00 H new ATOM 0 HB3 PRO B 725 37.084 -15.955 13.074 1.00 0.00 H new ATOM 0 HG2 PRO B 725 39.809 -14.580 12.752 1.00 0.00 H new ATOM 0 HG3 PRO B 725 38.915 -15.484 11.545 1.00 0.00 H new ATOM 0 HD2 PRO B 725 38.707 -12.768 11.655 1.00 0.00 H new ATOM 0 HD3 PRO B 725 37.319 -13.745 11.219 1.00 0.00 H new ATOM 1770 N MET B 726 39.211 -12.746 15.273 1.00 0.00 N ATOM 1771 CA MET B 726 40.256 -12.298 16.198 1.00 0.00 C ATOM 1772 C MET B 726 40.244 -10.767 16.294 1.00 0.00 C ATOM 1773 O MET B 726 39.940 -10.086 15.310 1.00 0.00 O ATOM 1774 CB MET B 726 41.579 -12.844 15.653 1.00 0.00 C ATOM 1775 CG MET B 726 42.824 -12.483 16.454 1.00 0.00 C ATOM 1776 SD MET B 726 44.333 -13.349 15.938 1.00 0.00 S ATOM 1777 CE MET B 726 44.478 -12.815 14.210 1.00 0.00 C ATOM 0 H MET B 726 39.097 -12.109 14.484 1.00 0.00 H new ATOM 0 HA MET B 726 40.099 -12.666 17.212 1.00 0.00 H new ATOM 0 HB2 MET B 726 41.507 -13.930 15.598 1.00 0.00 H new ATOM 0 HB3 MET B 726 41.708 -12.481 14.633 1.00 0.00 H new ATOM 0 HG2 MET B 726 42.992 -11.409 16.374 1.00 0.00 H new ATOM 0 HG3 MET B 726 42.638 -12.700 17.506 1.00 0.00 H new ATOM 0 HE1 MET B 726 45.432 -13.151 13.804 1.00 0.00 H new ATOM 0 HE2 MET B 726 43.664 -13.245 13.627 1.00 0.00 H new ATOM 0 HE3 MET B 726 44.425 -11.727 14.160 1.00 0.00 H new ATOM 1787 N SER B 727 40.558 -10.229 17.471 1.00 0.00 N ATOM 1788 CA SER B 727 40.529 -8.781 17.752 1.00 0.00 C ATOM 1789 C SER B 727 41.785 -8.031 17.275 1.00 0.00 C ATOM 1790 O SER B 727 42.816 -8.666 17.038 1.00 0.00 O ATOM 1791 CB SER B 727 40.324 -8.546 19.258 1.00 0.00 C ATOM 1792 OG SER B 727 41.554 -8.516 19.966 1.00 0.00 O ATOM 0 H SER B 727 40.845 -10.789 18.274 1.00 0.00 H new ATOM 0 HA SER B 727 39.693 -8.375 17.182 1.00 0.00 H new ATOM 0 HB2 SER B 727 39.796 -7.604 19.409 1.00 0.00 H new ATOM 0 HB3 SER B 727 39.691 -9.335 19.665 1.00 0.00 H new ATOM 0 HG SER B 727 41.380 -8.363 20.918 1.00 0.00 H new ATOM 1798 N PRO B 728 41.755 -6.684 17.160 1.00 0.00 N ATOM 1799 CA PRO B 728 42.934 -5.888 16.805 1.00 0.00 C ATOM 1800 C PRO B 728 44.111 -6.076 17.783 1.00 0.00 C ATOM 1801 O PRO B 728 45.269 -6.056 17.369 1.00 0.00 O ATOM 1802 CB PRO B 728 42.469 -4.425 16.806 1.00 0.00 C ATOM 1803 CG PRO B 728 40.953 -4.515 16.648 1.00 0.00 C ATOM 1804 CD PRO B 728 40.611 -5.810 17.378 1.00 0.00 C ATOM 0 HA PRO B 728 43.314 -6.207 15.835 1.00 0.00 H new ATOM 0 HB2 PRO B 728 42.744 -3.920 17.732 1.00 0.00 H new ATOM 0 HB3 PRO B 728 42.922 -3.862 15.990 1.00 0.00 H new ATOM 0 HG2 PRO B 728 40.449 -3.656 17.091 1.00 0.00 H new ATOM 0 HG3 PRO B 728 40.658 -4.552 15.599 1.00 0.00 H new ATOM 0 HD2 PRO B 728 40.448 -5.632 18.441 1.00 0.00 H new ATOM 0 HD3 PRO B 728 39.696 -6.254 16.986 1.00 0.00 H new ATOM 1812 N GLU B 729 43.831 -6.280 19.076 1.00 0.00 N ATOM 1813 CA GLU B 729 44.855 -6.496 20.112 1.00 0.00 C ATOM 1814 C GLU B 729 45.495 -7.888 19.997 1.00 0.00 C ATOM 1815 O GLU B 729 46.701 -8.040 20.189 1.00 0.00 O ATOM 1816 CB GLU B 729 44.253 -6.311 21.513 1.00 0.00 C ATOM 1817 CG GLU B 729 43.774 -4.873 21.758 1.00 0.00 C ATOM 1818 CD GLU B 729 43.279 -4.691 23.205 1.00 0.00 C ATOM 1819 OE1 GLU B 729 44.109 -4.408 24.105 1.00 0.00 O ATOM 1820 OE2 GLU B 729 42.054 -4.817 23.457 1.00 0.00 O ATOM 0 H GLU B 729 42.878 -6.300 19.439 1.00 0.00 H new ATOM 0 HA GLU B 729 45.636 -5.752 19.956 1.00 0.00 H new ATOM 0 HB2 GLU B 729 43.415 -6.997 21.639 1.00 0.00 H new ATOM 0 HB3 GLU B 729 44.998 -6.576 22.264 1.00 0.00 H new ATOM 0 HG2 GLU B 729 44.588 -4.176 21.559 1.00 0.00 H new ATOM 0 HG3 GLU B 729 42.970 -4.631 21.063 1.00 0.00 H new ATOM 1827 N GLU B 730 44.713 -8.908 19.642 1.00 0.00 N ATOM 1828 CA GLU B 730 45.217 -10.264 19.397 1.00 0.00 C ATOM 1829 C GLU B 730 46.019 -10.286 18.086 1.00 0.00 C ATOM 1830 O GLU B 730 47.136 -10.798 18.038 1.00 0.00 O ATOM 1831 CB GLU B 730 44.031 -11.228 19.315 1.00 0.00 C ATOM 1832 CG GLU B 730 43.329 -11.404 20.663 1.00 0.00 C ATOM 1833 CD GLU B 730 42.065 -12.280 20.546 1.00 0.00 C ATOM 1834 OE1 GLU B 730 41.209 -12.015 19.665 1.00 0.00 O ATOM 1835 OE2 GLU B 730 41.914 -13.219 21.363 1.00 0.00 O ATOM 0 H GLU B 730 43.705 -8.818 19.515 1.00 0.00 H new ATOM 0 HA GLU B 730 45.873 -10.572 20.211 1.00 0.00 H new ATOM 0 HB2 GLU B 730 43.315 -10.858 18.581 1.00 0.00 H new ATOM 0 HB3 GLU B 730 44.379 -12.198 18.960 1.00 0.00 H new ATOM 0 HG2 GLU B 730 44.019 -11.857 21.375 1.00 0.00 H new ATOM 0 HG3 GLU B 730 43.057 -10.426 21.061 1.00 0.00 H new ATOM 1842 N PHE B 731 45.477 -9.658 17.038 1.00 0.00 N ATOM 1843 CA PHE B 731 46.133 -9.486 15.737 1.00 0.00 C ATOM 1844 C PHE B 731 47.499 -8.784 15.878 1.00 0.00 C ATOM 1845 O PHE B 731 48.451 -9.159 15.196 1.00 0.00 O ATOM 1846 CB PHE B 731 45.199 -8.714 14.792 1.00 0.00 C ATOM 1847 CG PHE B 731 45.771 -8.439 13.411 1.00 0.00 C ATOM 1848 CD1 PHE B 731 46.550 -7.285 13.187 1.00 0.00 C ATOM 1849 CD2 PHE B 731 45.520 -9.323 12.344 1.00 0.00 C ATOM 1850 CE1 PHE B 731 47.084 -7.026 11.912 1.00 0.00 C ATOM 1851 CE2 PHE B 731 46.042 -9.056 11.065 1.00 0.00 C ATOM 1852 CZ PHE B 731 46.830 -7.912 10.849 1.00 0.00 C ATOM 0 H PHE B 731 44.545 -9.244 17.071 1.00 0.00 H new ATOM 0 HA PHE B 731 46.331 -10.470 15.312 1.00 0.00 H new ATOM 0 HB2 PHE B 731 44.273 -9.277 14.680 1.00 0.00 H new ATOM 0 HB3 PHE B 731 44.940 -7.763 15.258 1.00 0.00 H new ATOM 0 HD1 PHE B 731 46.737 -6.597 13.998 1.00 0.00 H new ATOM 0 HD2 PHE B 731 44.925 -10.209 12.508 1.00 0.00 H new ATOM 0 HE1 PHE B 731 47.689 -6.147 11.749 1.00 0.00 H new ATOM 0 HE2 PHE B 731 45.837 -9.731 10.248 1.00 0.00 H new ATOM 0 HZ PHE B 731 47.239 -7.714 9.869 1.00 0.00 H new ATOM 1862 N ASP B 732 47.629 -7.806 16.781 1.00 0.00 N ATOM 1863 CA ASP B 732 48.901 -7.126 17.064 1.00 0.00 C ATOM 1864 C ASP B 732 49.961 -8.111 17.600 1.00 0.00 C ATOM 1865 O ASP B 732 51.098 -8.097 17.132 1.00 0.00 O ATOM 1866 CB ASP B 732 48.651 -5.966 18.037 1.00 0.00 C ATOM 1867 CG ASP B 732 49.949 -5.280 18.484 1.00 0.00 C ATOM 1868 OD1 ASP B 732 50.573 -4.562 17.668 1.00 0.00 O ATOM 1869 OD2 ASP B 732 50.321 -5.438 19.673 1.00 0.00 O ATOM 0 H ASP B 732 46.850 -7.460 17.341 1.00 0.00 H new ATOM 0 HA ASP B 732 49.303 -6.720 16.136 1.00 0.00 H new ATOM 0 HB2 ASP B 732 48.001 -5.231 17.561 1.00 0.00 H new ATOM 0 HB3 ASP B 732 48.121 -6.340 18.913 1.00 0.00 H new ATOM 1874 N GLU B 733 49.597 -9.021 18.514 1.00 0.00 N ATOM 1875 CA GLU B 733 50.508 -10.069 19.005 1.00 0.00 C ATOM 1876 C GLU B 733 50.845 -11.086 17.903 1.00 0.00 C ATOM 1877 O GLU B 733 51.969 -11.588 17.862 1.00 0.00 O ATOM 1878 CB GLU B 733 49.914 -10.765 20.240 1.00 0.00 C ATOM 1879 CG GLU B 733 50.900 -11.672 20.999 1.00 0.00 C ATOM 1880 CD GLU B 733 52.155 -10.951 21.532 1.00 0.00 C ATOM 1881 OE1 GLU B 733 52.091 -9.740 21.848 1.00 0.00 O ATOM 1882 OE2 GLU B 733 53.218 -11.594 21.677 1.00 0.00 O ATOM 0 H GLU B 733 48.668 -9.053 18.933 1.00 0.00 H new ATOM 0 HA GLU B 733 51.442 -9.590 19.298 1.00 0.00 H new ATOM 0 HB2 GLU B 733 49.539 -10.004 20.925 1.00 0.00 H new ATOM 0 HB3 GLU B 733 49.057 -11.362 19.928 1.00 0.00 H new ATOM 0 HG2 GLU B 733 50.378 -12.133 21.838 1.00 0.00 H new ATOM 0 HG3 GLU B 733 51.214 -12.479 20.337 1.00 0.00 H new ATOM 1889 N VAL B 734 49.925 -11.359 16.968 1.00 0.00 N ATOM 1890 CA VAL B 734 50.223 -12.221 15.820 1.00 0.00 C ATOM 1891 C VAL B 734 51.236 -11.523 14.905 1.00 0.00 C ATOM 1892 O VAL B 734 52.268 -12.105 14.570 1.00 0.00 O ATOM 1893 CB VAL B 734 48.944 -12.618 15.062 1.00 0.00 C ATOM 1894 CG1 VAL B 734 49.295 -13.369 13.784 1.00 0.00 C ATOM 1895 CG2 VAL B 734 47.995 -13.505 15.884 1.00 0.00 C ATOM 0 H VAL B 734 48.972 -10.996 16.985 1.00 0.00 H new ATOM 0 HA VAL B 734 50.665 -13.149 16.182 1.00 0.00 H new ATOM 0 HB VAL B 734 48.431 -11.681 14.845 1.00 0.00 H new ATOM 0 HG11 VAL B 734 48.379 -13.643 13.260 1.00 0.00 H new ATOM 0 HG12 VAL B 734 49.904 -12.731 13.143 1.00 0.00 H new ATOM 0 HG13 VAL B 734 49.853 -14.271 14.034 1.00 0.00 H new ATOM 0 HG21 VAL B 734 47.115 -13.746 15.288 1.00 0.00 H new ATOM 0 HG22 VAL B 734 48.508 -14.425 16.163 1.00 0.00 H new ATOM 0 HG23 VAL B 734 47.689 -12.973 16.785 1.00 0.00 H new ATOM 1905 N SER B 735 50.987 -10.260 14.547 1.00 0.00 N ATOM 1906 CA SER B 735 51.876 -9.432 13.722 1.00 0.00 C ATOM 1907 C SER B 735 53.287 -9.328 14.320 1.00 0.00 C ATOM 1908 O SER B 735 54.279 -9.433 13.596 1.00 0.00 O ATOM 1909 CB SER B 735 51.249 -8.044 13.545 1.00 0.00 C ATOM 1910 OG SER B 735 52.011 -7.264 12.640 1.00 0.00 O ATOM 0 H SER B 735 50.138 -9.770 14.830 1.00 0.00 H new ATOM 0 HA SER B 735 51.988 -9.909 12.748 1.00 0.00 H new ATOM 0 HB2 SER B 735 50.228 -8.145 13.177 1.00 0.00 H new ATOM 0 HB3 SER B 735 51.192 -7.539 14.509 1.00 0.00 H new ATOM 0 HG SER B 735 51.596 -6.382 12.538 1.00 0.00 H new ATOM 1916 N ARG B 736 53.393 -9.192 15.650 1.00 0.00 N ATOM 1917 CA ARG B 736 54.653 -9.136 16.414 1.00 0.00 C ATOM 1918 C ARG B 736 55.572 -10.340 16.152 1.00 0.00 C ATOM 1919 O ARG B 736 56.787 -10.167 16.052 1.00 0.00 O ATOM 1920 CB ARG B 736 54.276 -9.029 17.901 1.00 0.00 C ATOM 1921 CG ARG B 736 55.416 -8.702 18.873 1.00 0.00 C ATOM 1922 CD ARG B 736 54.828 -8.787 20.287 1.00 0.00 C ATOM 1923 NE ARG B 736 55.747 -8.305 21.330 1.00 0.00 N ATOM 1924 CZ ARG B 736 55.446 -8.215 22.613 1.00 0.00 C ATOM 1925 NH1 ARG B 736 54.317 -8.634 23.106 1.00 0.00 N ATOM 1926 NH2 ARG B 736 56.276 -7.693 23.467 1.00 0.00 N ATOM 0 H ARG B 736 52.571 -9.115 16.249 1.00 0.00 H new ATOM 0 HA ARG B 736 55.231 -8.270 16.093 1.00 0.00 H new ATOM 0 HB2 ARG B 736 53.509 -8.262 18.004 1.00 0.00 H new ATOM 0 HB3 ARG B 736 53.826 -9.973 18.208 1.00 0.00 H new ATOM 0 HG2 ARG B 736 56.240 -9.405 18.754 1.00 0.00 H new ATOM 0 HG3 ARG B 736 55.816 -7.707 18.679 1.00 0.00 H new ATOM 0 HD2 ARG B 736 53.908 -8.204 20.326 1.00 0.00 H new ATOM 0 HD3 ARG B 736 54.559 -9.822 20.499 1.00 0.00 H new ATOM 0 HE ARG B 736 56.683 -8.020 21.042 1.00 0.00 H new ATOM 0 HH11 ARG B 736 53.618 -9.054 22.494 1.00 0.00 H new ATOM 0 HH12 ARG B 736 54.131 -8.542 24.105 1.00 0.00 H new ATOM 0 HH21 ARG B 736 57.180 -7.343 23.151 1.00 0.00 H new ATOM 0 HH22 ARG B 736 56.023 -7.634 24.453 1.00 0.00 H new ATOM 1940 N ILE B 737 55.003 -11.546 16.032 1.00 0.00 N ATOM 1941 CA ILE B 737 55.747 -12.797 15.774 1.00 0.00 C ATOM 1942 C ILE B 737 55.904 -13.094 14.275 1.00 0.00 C ATOM 1943 O ILE B 737 56.977 -13.508 13.832 1.00 0.00 O ATOM 1944 CB ILE B 737 55.060 -13.992 16.478 1.00 0.00 C ATOM 1945 CG1 ILE B 737 54.925 -13.720 17.994 1.00 0.00 C ATOM 1946 CG2 ILE B 737 55.837 -15.304 16.226 1.00 0.00 C ATOM 1947 CD1 ILE B 737 54.385 -14.910 18.792 1.00 0.00 C ATOM 0 H ILE B 737 53.996 -11.688 16.112 1.00 0.00 H new ATOM 0 HA ILE B 737 56.747 -12.656 16.184 1.00 0.00 H new ATOM 0 HB ILE B 737 54.061 -14.107 16.057 1.00 0.00 H new ATOM 0 HG12 ILE B 737 55.901 -13.441 18.392 1.00 0.00 H new ATOM 0 HG13 ILE B 737 54.265 -12.866 18.143 1.00 0.00 H new ATOM 0 HG21 ILE B 737 55.333 -16.128 16.731 1.00 0.00 H new ATOM 0 HG22 ILE B 737 55.875 -15.504 15.155 1.00 0.00 H new ATOM 0 HG23 ILE B 737 56.851 -15.206 16.613 1.00 0.00 H new ATOM 0 HD11 ILE B 737 54.319 -14.641 19.846 1.00 0.00 H new ATOM 0 HD12 ILE B 737 53.395 -15.176 18.423 1.00 0.00 H new ATOM 0 HD13 ILE B 737 55.056 -15.761 18.676 1.00 0.00 H new ATOM 1959 N VAL B 738 54.840 -12.931 13.483 1.00 0.00 N ATOM 1960 CA VAL B 738 54.836 -13.228 12.034 1.00 0.00 C ATOM 1961 C VAL B 738 55.664 -12.216 11.229 1.00 0.00 C ATOM 1962 O VAL B 738 56.244 -12.561 10.198 1.00 0.00 O ATOM 1963 CB VAL B 738 53.385 -13.316 11.511 1.00 0.00 C ATOM 1964 CG1 VAL B 738 53.313 -13.631 10.011 1.00 0.00 C ATOM 1965 CG2 VAL B 738 52.618 -14.436 12.230 1.00 0.00 C ATOM 0 H VAL B 738 53.944 -12.586 13.827 1.00 0.00 H new ATOM 0 HA VAL B 738 55.315 -14.197 11.893 1.00 0.00 H new ATOM 0 HB VAL B 738 52.946 -12.337 11.702 1.00 0.00 H new ATOM 0 HG11 VAL B 738 52.270 -13.681 9.699 1.00 0.00 H new ATOM 0 HG12 VAL B 738 53.822 -12.848 9.450 1.00 0.00 H new ATOM 0 HG13 VAL B 738 53.796 -14.589 9.817 1.00 0.00 H new ATOM 0 HG21 VAL B 738 51.598 -14.482 11.848 1.00 0.00 H new ATOM 0 HG22 VAL B 738 53.115 -15.390 12.053 1.00 0.00 H new ATOM 0 HG23 VAL B 738 52.595 -14.232 13.301 1.00 0.00 H new ATOM 1975 N GLY B 739 55.738 -10.969 11.700 1.00 0.00 N ATOM 1976 CA GLY B 739 56.483 -9.864 11.075 1.00 0.00 C ATOM 1977 C GLY B 739 56.129 -9.606 9.601 1.00 0.00 C ATOM 1978 O GLY B 739 56.976 -9.139 8.837 1.00 0.00 O ATOM 0 H GLY B 739 55.265 -10.687 12.558 1.00 0.00 H new ATOM 0 HA2 GLY B 739 56.300 -8.952 11.644 1.00 0.00 H new ATOM 0 HA3 GLY B 739 57.550 -10.076 11.147 1.00 0.00 H new ATOM 1982 N SER B 740 54.897 -9.942 9.194 1.00 0.00 N ATOM 1983 CA SER B 740 54.365 -9.842 7.820 1.00 0.00 C ATOM 1984 C SER B 740 55.187 -10.577 6.738 1.00 0.00 C ATOM 1985 O SER B 740 55.016 -10.281 5.555 1.00 0.00 O ATOM 1986 CB SER B 740 54.123 -8.371 7.433 1.00 0.00 C ATOM 1987 OG SER B 740 53.329 -7.695 8.399 1.00 0.00 O ATOM 0 H SER B 740 54.205 -10.311 9.846 1.00 0.00 H new ATOM 0 HA SER B 740 53.414 -10.374 7.847 1.00 0.00 H new ATOM 0 HB2 SER B 740 55.080 -7.861 7.328 1.00 0.00 H new ATOM 0 HB3 SER B 740 53.630 -8.327 6.462 1.00 0.00 H new ATOM 0 HG SER B 740 53.198 -6.764 8.121 1.00 0.00 H new ATOM 1993 N VAL B 741 56.053 -11.528 7.137 1.00 0.00 N ATOM 1994 CA VAL B 741 56.975 -12.376 6.339 1.00 0.00 C ATOM 1995 C VAL B 741 56.925 -12.180 4.808 1.00 0.00 C ATOM 1996 O VAL B 741 57.802 -11.525 4.245 1.00 0.00 O ATOM 1997 CB VAL B 741 56.861 -13.850 6.808 1.00 0.00 C ATOM 1998 CG1 VAL B 741 55.443 -14.451 6.799 1.00 0.00 C ATOM 1999 CG2 VAL B 741 57.799 -14.791 6.043 1.00 0.00 C ATOM 0 H VAL B 741 56.137 -11.748 8.129 1.00 0.00 H new ATOM 0 HA VAL B 741 57.985 -12.025 6.550 1.00 0.00 H new ATOM 0 HB VAL B 741 57.166 -13.781 7.852 1.00 0.00 H new ATOM 0 HG11 VAL B 741 55.483 -15.484 7.145 1.00 0.00 H new ATOM 0 HG12 VAL B 741 54.798 -13.872 7.460 1.00 0.00 H new ATOM 0 HG13 VAL B 741 55.043 -14.423 5.786 1.00 0.00 H new ATOM 0 HG21 VAL B 741 57.676 -15.808 6.414 1.00 0.00 H new ATOM 0 HG22 VAL B 741 57.558 -14.760 4.980 1.00 0.00 H new ATOM 0 HG23 VAL B 741 58.832 -14.474 6.190 1.00 0.00 H new ATOM 2009 N GLU B 742 55.882 -12.687 4.149 1.00 0.00 N ATOM 2010 CA GLU B 742 55.568 -12.548 2.709 1.00 0.00 C ATOM 2011 C GLU B 742 54.030 -12.510 2.531 1.00 0.00 C ATOM 2012 O GLU B 742 53.458 -13.010 1.563 1.00 0.00 O ATOM 2013 CB GLU B 742 56.196 -13.705 1.910 1.00 0.00 C ATOM 2014 CG GLU B 742 57.729 -13.642 1.843 1.00 0.00 C ATOM 2015 CD GLU B 742 58.298 -14.666 0.843 1.00 0.00 C ATOM 2016 OE1 GLU B 742 58.241 -14.415 -0.386 1.00 0.00 O ATOM 2017 OE2 GLU B 742 58.829 -15.714 1.279 1.00 0.00 O ATOM 0 H GLU B 742 55.180 -13.246 4.633 1.00 0.00 H new ATOM 0 HA GLU B 742 55.990 -11.619 2.325 1.00 0.00 H new ATOM 0 HB2 GLU B 742 55.899 -14.651 2.362 1.00 0.00 H new ATOM 0 HB3 GLU B 742 55.795 -13.696 0.896 1.00 0.00 H new ATOM 0 HG2 GLU B 742 58.040 -12.638 1.553 1.00 0.00 H new ATOM 0 HG3 GLU B 742 58.145 -13.830 2.833 1.00 0.00 H new ATOM 2024 N PHE B 743 53.358 -11.977 3.550 1.00 0.00 N ATOM 2025 CA PHE B 743 51.915 -11.958 3.790 1.00 0.00 C ATOM 2026 C PHE B 743 50.971 -11.717 2.598 1.00 0.00 C ATOM 2027 O PHE B 743 49.982 -12.433 2.445 1.00 0.00 O ATOM 2028 CB PHE B 743 51.666 -10.965 4.923 1.00 0.00 C ATOM 2029 CG PHE B 743 50.410 -11.219 5.716 1.00 0.00 C ATOM 2030 CD1 PHE B 743 50.266 -12.427 6.427 1.00 0.00 C ATOM 2031 CD2 PHE B 743 49.418 -10.224 5.797 1.00 0.00 C ATOM 2032 CE1 PHE B 743 49.174 -12.588 7.290 1.00 0.00 C ATOM 2033 CE2 PHE B 743 48.304 -10.412 6.629 1.00 0.00 C ATOM 2034 CZ PHE B 743 48.203 -11.579 7.399 1.00 0.00 C ATOM 0 H PHE B 743 53.858 -11.502 4.301 1.00 0.00 H new ATOM 0 HA PHE B 743 51.644 -12.983 4.043 1.00 0.00 H new ATOM 0 HB2 PHE B 743 52.519 -10.987 5.601 1.00 0.00 H new ATOM 0 HB3 PHE B 743 51.618 -9.960 4.504 1.00 0.00 H new ATOM 0 HD1 PHE B 743 50.989 -13.220 6.308 1.00 0.00 H new ATOM 0 HD2 PHE B 743 49.514 -9.317 5.219 1.00 0.00 H new ATOM 0 HE1 PHE B 743 49.079 -13.492 7.874 1.00 0.00 H new ATOM 0 HE2 PHE B 743 47.529 -9.662 6.676 1.00 0.00 H new ATOM 0 HZ PHE B 743 47.374 -11.703 8.080 1.00 0.00 H new ATOM 2044 N ASP B 744 51.259 -10.757 1.717 1.00 0.00 N ATOM 2045 CA ASP B 744 50.428 -10.480 0.530 1.00 0.00 C ATOM 2046 C ASP B 744 50.595 -11.522 -0.608 1.00 0.00 C ATOM 2047 O ASP B 744 50.022 -11.373 -1.689 1.00 0.00 O ATOM 2048 CB ASP B 744 50.619 -9.024 0.079 1.00 0.00 C ATOM 2049 CG ASP B 744 51.970 -8.776 -0.615 1.00 0.00 C ATOM 2050 OD1 ASP B 744 53.025 -8.886 0.055 1.00 0.00 O ATOM 2051 OD2 ASP B 744 51.979 -8.446 -1.826 1.00 0.00 O ATOM 0 H ASP B 744 52.072 -10.147 1.801 1.00 0.00 H new ATOM 0 HA ASP B 744 49.384 -10.596 0.822 1.00 0.00 H new ATOM 0 HB2 ASP B 744 49.813 -8.753 -0.603 1.00 0.00 H new ATOM 0 HB3 ASP B 744 50.538 -8.368 0.946 1.00 0.00 H new ATOM 2056 N SER B 745 51.358 -12.595 -0.364 1.00 0.00 N ATOM 2057 CA SER B 745 51.615 -13.721 -1.275 1.00 0.00 C ATOM 2058 C SER B 745 51.098 -15.064 -0.715 1.00 0.00 C ATOM 2059 O SER B 745 51.125 -16.072 -1.420 1.00 0.00 O ATOM 2060 CB SER B 745 53.124 -13.784 -1.568 1.00 0.00 C ATOM 2061 OG SER B 745 53.438 -14.675 -2.629 1.00 0.00 O ATOM 0 H SER B 745 51.842 -12.708 0.527 1.00 0.00 H new ATOM 0 HA SER B 745 51.064 -13.551 -2.200 1.00 0.00 H new ATOM 0 HB2 SER B 745 53.484 -12.786 -1.818 1.00 0.00 H new ATOM 0 HB3 SER B 745 53.652 -14.097 -0.667 1.00 0.00 H new ATOM 0 HG SER B 745 54.407 -14.679 -2.777 1.00 0.00 H new ATOM 2067 N MET B 746 50.596 -15.120 0.531 1.00 0.00 N ATOM 2068 CA MET B 746 50.081 -16.351 1.177 1.00 0.00 C ATOM 2069 C MET B 746 48.981 -17.084 0.386 1.00 0.00 C ATOM 2070 O MET B 746 48.769 -18.281 0.579 1.00 0.00 O ATOM 2071 CB MET B 746 49.537 -16.036 2.582 1.00 0.00 C ATOM 2072 CG MET B 746 50.533 -15.489 3.620 1.00 0.00 C ATOM 2073 SD MET B 746 52.317 -15.556 3.266 1.00 0.00 S ATOM 2074 CE MET B 746 52.589 -17.338 3.298 1.00 0.00 C ATOM 0 H MET B 746 50.533 -14.299 1.132 1.00 0.00 H new ATOM 0 HA MET B 746 50.941 -17.019 1.221 1.00 0.00 H new ATOM 0 HB2 MET B 746 48.729 -15.312 2.476 1.00 0.00 H new ATOM 0 HB3 MET B 746 49.097 -16.948 2.985 1.00 0.00 H new ATOM 0 HG2 MET B 746 50.275 -14.446 3.804 1.00 0.00 H new ATOM 0 HG3 MET B 746 50.364 -16.028 4.552 1.00 0.00 H new ATOM 0 HE1 MET B 746 53.316 -17.581 4.073 1.00 0.00 H new ATOM 0 HE2 MET B 746 51.648 -17.846 3.511 1.00 0.00 H new ATOM 0 HE3 MET B 746 52.967 -17.666 2.330 1.00 0.00 H new ATOM 2084 N MET B 747 48.283 -16.371 -0.503 1.00 0.00 N ATOM 2085 CA MET B 747 47.186 -16.877 -1.340 1.00 0.00 C ATOM 2086 C MET B 747 47.655 -17.481 -2.683 1.00 0.00 C ATOM 2087 O MET B 747 46.819 -17.875 -3.499 1.00 0.00 O ATOM 2088 CB MET B 747 46.175 -15.733 -1.552 1.00 0.00 C ATOM 2089 CG MET B 747 45.609 -15.232 -0.214 1.00 0.00 C ATOM 2090 SD MET B 747 44.488 -13.819 -0.332 1.00 0.00 S ATOM 2091 CE MET B 747 44.212 -13.536 1.438 1.00 0.00 C ATOM 0 H MET B 747 48.474 -15.383 -0.668 1.00 0.00 H new ATOM 0 HA MET B 747 46.715 -17.709 -0.817 1.00 0.00 H new ATOM 0 HB2 MET B 747 46.660 -14.909 -2.075 1.00 0.00 H new ATOM 0 HB3 MET B 747 45.360 -16.079 -2.187 1.00 0.00 H new ATOM 0 HG2 MET B 747 45.081 -16.054 0.269 1.00 0.00 H new ATOM 0 HG3 MET B 747 46.441 -14.961 0.436 1.00 0.00 H new ATOM 0 HE1 MET B 747 43.765 -12.553 1.584 1.00 0.00 H new ATOM 0 HE2 MET B 747 43.541 -14.301 1.828 1.00 0.00 H new ATOM 0 HE3 MET B 747 45.164 -13.584 1.967 1.00 0.00 H new ATOM 2101 N ASN B 748 48.970 -17.571 -2.930 1.00 0.00 N ATOM 2102 CA ASN B 748 49.556 -18.122 -4.160 1.00 0.00 C ATOM 2103 C ASN B 748 50.857 -18.918 -3.896 1.00 0.00 C ATOM 2104 O ASN B 748 51.568 -18.681 -2.917 1.00 0.00 O ATOM 2105 CB ASN B 748 49.788 -16.947 -5.137 1.00 0.00 C ATOM 2106 CG ASN B 748 50.339 -17.394 -6.483 1.00 0.00 C ATOM 2107 OD1 ASN B 748 50.023 -18.460 -6.992 1.00 0.00 O ATOM 2108 ND2 ASN B 748 51.211 -16.625 -7.089 1.00 0.00 N ATOM 0 H ASN B 748 49.673 -17.254 -2.262 1.00 0.00 H new ATOM 0 HA ASN B 748 48.867 -18.845 -4.597 1.00 0.00 H new ATOM 0 HB2 ASN B 748 48.847 -16.420 -5.293 1.00 0.00 H new ATOM 0 HB3 ASN B 748 50.480 -16.237 -4.685 1.00 0.00 H new ATOM 0 HD21 ASN B 748 51.619 -16.918 -7.977 1.00 0.00 H new ATOM 0 HD22 ASN B 748 51.481 -15.734 -6.673 1.00 0.00 H new ATOM 2115 N THR B 749 51.182 -19.851 -4.795 1.00 0.00 N ATOM 2116 CA THR B 749 52.382 -20.712 -4.745 1.00 0.00 C ATOM 2117 C THR B 749 52.959 -21.050 -6.139 1.00 0.00 C ATOM 2118 O THR B 749 53.817 -21.928 -6.260 1.00 0.00 O ATOM 2119 CB THR B 749 52.065 -21.973 -3.910 1.00 0.00 C ATOM 2120 OG1 THR B 749 53.239 -22.672 -3.555 1.00 0.00 O ATOM 2121 CG2 THR B 749 51.102 -22.951 -4.590 1.00 0.00 C ATOM 0 H THR B 749 50.599 -20.040 -5.611 1.00 0.00 H new ATOM 0 HA THR B 749 53.179 -20.152 -4.256 1.00 0.00 H new ATOM 0 HB THR B 749 51.569 -21.587 -3.019 1.00 0.00 H new ATOM 0 HG1 THR B 749 53.829 -22.738 -4.335 1.00 0.00 H new ATOM 0 HG21 THR B 749 50.933 -23.808 -3.938 1.00 0.00 H new ATOM 0 HG22 THR B 749 50.154 -22.451 -4.786 1.00 0.00 H new ATOM 0 HG23 THR B 749 51.534 -23.291 -5.531 1.00 0.00 H new ATOM 2129 N VAL B 750 52.510 -20.373 -7.208 1.00 0.00 N ATOM 2130 CA VAL B 750 52.956 -20.606 -8.601 1.00 0.00 C ATOM 2131 C VAL B 750 53.012 -19.328 -9.451 1.00 0.00 C ATOM 2132 O VAL B 750 52.498 -18.266 -9.075 1.00 0.00 O ATOM 2133 CB VAL B 750 52.076 -21.681 -9.274 1.00 0.00 C ATOM 2134 CG1 VAL B 750 50.607 -21.262 -9.431 1.00 0.00 C ATOM 2135 CG2 VAL B 750 52.628 -22.090 -10.645 1.00 0.00 C ATOM 0 H VAL B 750 51.813 -19.632 -7.132 1.00 0.00 H new ATOM 0 HA VAL B 750 53.983 -20.966 -8.541 1.00 0.00 H new ATOM 0 HB VAL B 750 52.108 -22.533 -8.595 1.00 0.00 H new ATOM 0 HG11 VAL B 750 50.049 -22.066 -9.911 1.00 0.00 H new ATOM 0 HG12 VAL B 750 50.179 -21.059 -8.449 1.00 0.00 H new ATOM 0 HG13 VAL B 750 50.549 -20.363 -10.044 1.00 0.00 H new ATOM 0 HG21 VAL B 750 51.981 -22.848 -11.086 1.00 0.00 H new ATOM 0 HG22 VAL B 750 52.663 -21.218 -11.298 1.00 0.00 H new ATOM 0 HG23 VAL B 750 53.633 -22.495 -10.526 1.00 0.00 H new TER 2145 VAL B 750 HETATM 2146 ZN ZN A 93 31.355 -27.316 14.673 1.00 0.00 ZN HETATM 2147 ZN ZN A 94 37.794 -10.848 2.147 1.00 0.00 ZN HETATM 2148 ZN ZN A 95 48.850 -26.824 10.829 1.00 0.00 ZN