USER MOD reduce.3.24.130724 H: found=0, std=0, add=1358, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1361 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 : A 60 ASNHD21 : A 60 ASN OD1 : A 192 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 192 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD21 : A 97 ASN OD1 : A 221 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD22 : A 97 ASN OD1 : A 221 CACA :(metal ligand) USER MOD Set 1.1: A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 26 SER OG : rot -102:sc= 0.769 USER MOD Single : A 1 ALA N :NH3+ 165:sc= -0.0272 (180deg=-0.265) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -1.77 K(o=-1.8,f=-8.7!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 161:sc= -0.751 (180deg=-1.56) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 70:sc= 0.848 USER MOD Single : A 34 THR OG1 : rot 84:sc= 1.18 USER MOD Single : A 38 SER OG : rot -20:sc= 0.511 USER MOD Single : A 41 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.47) USER MOD Single : A 42 ASN : amide:sc= -0.43 K(o=-0.43,f=-2.2!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 51 MET CE :methyl 151:sc= -0.395 (180deg=-3.53!) USER MOD Single : A 53 SER OG : rot -105:sc= 0.41 USER MOD Single : A 62 THR OG1 : rot -81:sc= -2.12! USER MOD Single : A 70 SER OG : rot 85:sc= 0.188 USER MOD Single : A 72 MET CE :methyl -174:sc= -0.475 (180deg=-0.494) USER MOD Single : A 74 LYS NZ :NH3+ 163:sc= -0.0339 (180deg=-0.387) USER MOD Single : A 75 LYS NZ :NH3+ -156:sc= -0.106 (180deg=-0.855) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 10:sc= -0.248! USER MOD Single : A 86 LYS NZ :NH3+ -121:sc= -0.0118 (180deg=-0.277) USER MOD Single : A 90 LYS NZ :NH3+ 158:sc= -0.044 (180deg=-0.684) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 166:sc= 0.0772 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 111 ASN :FLIP amide:sc= -4.36! C(o=-5.1!,f=-4.4!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.347 K(o=-0.35,f=-3.8!) USER MOD Single : A 124 MET CE :methyl 150:sc= -7.42! (180deg=-12.6!) USER MOD Single : A 126 LYS NZ :NH3+ -154:sc= -0.367 (180deg=-1.47!) USER MOD Single : A 135 GLN :FLIP amide:sc= -1 F(o=-2,f=-1) USER MOD Single : A 137 ASN : amide:sc= -2.38! X(o=-2.4!,f=-2.3) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 MET CE :methyl -170:sc= -0.42 (180deg=-0.548) USER MOD Single : A 145 MET CE :methyl -160:sc= -1.09 (180deg=-1.77!) USER MOD Single : A 146 MET CE :methyl -175:sc= 0 (180deg=-0.0169) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00575 USER MOD Single : B 21 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : B 25 SER OG : rot 180:sc= 0 USER MOD Single : B 28 SER OG : rot 95:sc= 1.29 USER MOD Single : B 31 LYS NZ :NH3+ 166:sc= -6.39! (180deg=-6.97!) USER MOD Single : B 32 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot -49:sc= -1.78 USER MOD Single : B 42 ASN : amide:sc= -3.4! C(o=-3.4!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -6.634 -17.389 0.078 1.00 0.00 N ATOM 2 CA ALA A 1 -6.268 -17.583 1.508 1.00 0.00 C ATOM 3 C ALA A 1 -4.932 -16.904 1.784 1.00 0.00 C ATOM 4 O ALA A 1 -4.133 -17.386 2.589 1.00 0.00 O ATOM 5 CB ALA A 1 -6.165 -19.081 1.807 1.00 0.00 C ATOM 0 H1 ALA A 1 -7.396 -18.049 -0.178 1.00 0.00 H new ATOM 0 H2 ALA A 1 -6.959 -16.412 -0.068 1.00 0.00 H new ATOM 0 H3 ALA A 1 -5.803 -17.571 -0.521 1.00 0.00 H new ATOM 0 HA ALA A 1 -7.033 -17.142 2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -5.897 -19.226 2.854 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.125 -19.558 1.609 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -5.400 -19.527 1.172 1.00 0.00 H new ATOM 13 N ASP A 2 -4.693 -15.782 1.114 1.00 0.00 N ATOM 14 CA ASP A 2 -3.447 -15.048 1.296 1.00 0.00 C ATOM 15 C ASP A 2 -3.218 -14.742 2.772 1.00 0.00 C ATOM 16 O ASP A 2 -4.153 -14.413 3.499 1.00 0.00 O ATOM 17 CB ASP A 2 -3.497 -13.737 0.507 1.00 0.00 C ATOM 18 CG ASP A 2 -4.746 -12.946 0.885 1.00 0.00 C ATOM 19 OD1 ASP A 2 -5.795 -13.556 1.010 1.00 0.00 O ATOM 20 OD2 ASP A 2 -4.634 -11.742 1.049 1.00 0.00 O ATOM 0 H ASP A 2 -5.340 -15.364 0.445 1.00 0.00 H new ATOM 0 HA ASP A 2 -2.626 -15.665 0.931 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -2.605 -13.145 0.713 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -3.500 -13.947 -0.563 1.00 0.00 H new ATOM 25 N ILE A 3 -1.969 -14.856 3.206 1.00 0.00 N ATOM 26 CA ILE A 3 -1.623 -14.600 4.594 1.00 0.00 C ATOM 27 C ILE A 3 -2.375 -15.543 5.524 1.00 0.00 C ATOM 28 O ILE A 3 -3.197 -16.339 5.079 1.00 0.00 O ATOM 29 CB ILE A 3 -1.959 -13.148 4.948 1.00 0.00 C ATOM 30 CG1 ILE A 3 -1.421 -12.216 3.856 1.00 0.00 C ATOM 31 CG2 ILE A 3 -1.328 -12.773 6.301 1.00 0.00 C ATOM 32 CD1 ILE A 3 0.068 -12.497 3.628 1.00 0.00 C ATOM 0 H ILE A 3 -1.181 -15.124 2.616 1.00 0.00 H new ATOM 0 HA ILE A 3 -0.554 -14.771 4.721 1.00 0.00 H new ATOM 0 HB ILE A 3 -3.041 -13.042 5.019 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.976 -12.366 2.930 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.565 -11.176 4.148 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.573 -11.739 6.543 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.718 -13.430 7.079 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -0.245 -12.885 6.241 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.449 -11.834 2.851 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.617 -12.324 4.554 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.199 -13.533 3.316 1.00 0.00 H new ATOM 44 N LEU A 4 -2.089 -15.447 6.818 1.00 0.00 N ATOM 45 CA LEU A 4 -2.746 -16.296 7.804 1.00 0.00 C ATOM 46 C LEU A 4 -2.357 -15.872 9.218 1.00 0.00 C ATOM 47 O LEU A 4 -2.762 -16.501 10.196 1.00 0.00 O ATOM 48 CB LEU A 4 -2.337 -17.750 7.574 1.00 0.00 C ATOM 49 CG LEU A 4 -0.804 -17.898 7.756 1.00 0.00 C ATOM 50 CD1 LEU A 4 -0.503 -18.538 9.114 1.00 0.00 C ATOM 51 CD2 LEU A 4 -0.238 -18.786 6.642 1.00 0.00 C ATOM 0 H LEU A 4 -1.410 -14.793 7.207 1.00 0.00 H new ATOM 0 HA LEU A 4 -3.826 -16.195 7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -2.860 -18.400 8.275 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -2.626 -18.065 6.571 1.00 0.00 H new ATOM 0 HG LEU A 4 -0.342 -16.912 7.709 1.00 0.00 H new ATOM 0 HD11 LEU A 4 0.575 -18.640 9.237 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -0.901 -17.908 9.909 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -0.968 -19.522 9.163 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.839 -18.889 6.771 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -0.705 -19.770 6.688 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.445 -18.331 5.673 1.00 0.00 H new ATOM 63 N SER A 5 -1.560 -14.810 9.319 1.00 0.00 N ATOM 64 CA SER A 5 -1.113 -14.323 10.622 1.00 0.00 C ATOM 65 C SER A 5 -2.156 -13.397 11.232 1.00 0.00 C ATOM 66 O SER A 5 -2.802 -12.634 10.526 1.00 0.00 O ATOM 67 CB SER A 5 0.213 -13.581 10.470 1.00 0.00 C ATOM 68 OG SER A 5 1.062 -14.309 9.594 1.00 0.00 O ATOM 0 H SER A 5 -1.213 -14.275 8.523 1.00 0.00 H new ATOM 0 HA SER A 5 -0.975 -15.177 11.285 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.039 -12.579 10.077 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.690 -13.463 11.443 1.00 0.00 H new ATOM 0 HG SER A 5 1.913 -13.834 9.493 1.00 0.00 H new ATOM 74 N GLU A 6 -2.311 -13.470 12.549 1.00 0.00 N ATOM 75 CA GLU A 6 -3.281 -12.629 13.243 1.00 0.00 C ATOM 76 C GLU A 6 -3.082 -11.162 12.875 1.00 0.00 C ATOM 77 O GLU A 6 -3.897 -10.311 13.224 1.00 0.00 O ATOM 78 CB GLU A 6 -3.133 -12.803 14.757 1.00 0.00 C ATOM 79 CG GLU A 6 -3.549 -14.221 15.152 1.00 0.00 C ATOM 80 CD GLU A 6 -3.349 -14.425 16.649 1.00 0.00 C ATOM 81 OE1 GLU A 6 -2.980 -13.471 17.314 1.00 0.00 O ATOM 82 OE2 GLU A 6 -3.565 -15.534 17.110 1.00 0.00 O ATOM 0 H GLU A 6 -1.782 -14.098 13.155 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.282 -12.934 12.938 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.101 -12.619 15.055 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.751 -12.073 15.280 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.594 -14.389 14.890 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.960 -14.950 14.595 1.00 0.00 H new ATOM 89 N GLU A 7 -1.994 -10.874 12.169 1.00 0.00 N ATOM 90 CA GLU A 7 -1.705 -9.504 11.759 1.00 0.00 C ATOM 91 C GLU A 7 -2.725 -9.025 10.731 1.00 0.00 C ATOM 92 O GLU A 7 -3.225 -7.906 10.819 1.00 0.00 O ATOM 93 CB GLU A 7 -0.288 -9.431 11.165 1.00 0.00 C ATOM 94 CG GLU A 7 0.740 -9.315 12.293 1.00 0.00 C ATOM 95 CD GLU A 7 0.694 -10.557 13.174 1.00 0.00 C ATOM 96 OE1 GLU A 7 0.237 -11.580 12.698 1.00 0.00 O ATOM 97 OE2 GLU A 7 1.107 -10.465 14.316 1.00 0.00 O ATOM 0 H GLU A 7 -1.304 -11.563 11.871 1.00 0.00 H new ATOM 0 HA GLU A 7 -1.766 -8.856 12.633 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.088 -10.320 10.568 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.207 -8.574 10.497 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.739 -9.194 11.874 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.536 -8.427 12.892 1.00 0.00 H new ATOM 104 N GLN A 8 -3.017 -9.873 9.752 1.00 0.00 N ATOM 105 CA GLN A 8 -3.971 -9.512 8.710 1.00 0.00 C ATOM 106 C GLN A 8 -5.284 -9.056 9.347 1.00 0.00 C ATOM 107 O GLN A 8 -5.835 -8.009 8.991 1.00 0.00 O ATOM 108 CB GLN A 8 -4.211 -10.719 7.791 1.00 0.00 C ATOM 109 CG GLN A 8 -5.073 -11.759 8.509 1.00 0.00 C ATOM 110 CD GLN A 8 -5.007 -13.090 7.786 1.00 0.00 C ATOM 111 OE1 GLN A 8 -4.039 -13.832 7.940 1.00 0.00 O ATOM 112 NE2 GLN A 8 -5.987 -13.441 7.003 1.00 0.00 N ATOM 0 H GLN A 8 -2.613 -10.805 9.658 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.569 -8.692 8.116 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -4.704 -10.396 6.874 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.258 -11.162 7.502 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -4.729 -11.879 9.537 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.106 -11.414 8.556 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -6.788 -12.821 6.879 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -5.954 -14.335 6.514 1.00 0.00 H new ATOM 121 N ILE A 9 -5.791 -9.856 10.286 1.00 0.00 N ATOM 122 CA ILE A 9 -7.035 -9.537 10.957 1.00 0.00 C ATOM 123 C ILE A 9 -6.887 -8.239 11.722 1.00 0.00 C ATOM 124 O ILE A 9 -7.790 -7.401 11.719 1.00 0.00 O ATOM 125 CB ILE A 9 -7.419 -10.671 11.917 1.00 0.00 C ATOM 126 CG1 ILE A 9 -7.715 -11.947 11.117 1.00 0.00 C ATOM 127 CG2 ILE A 9 -8.665 -10.272 12.709 1.00 0.00 C ATOM 128 CD1 ILE A 9 -8.864 -11.701 10.121 1.00 0.00 C ATOM 0 H ILE A 9 -5.355 -10.725 10.593 1.00 0.00 H new ATOM 0 HA ILE A 9 -7.823 -9.424 10.212 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.592 -10.855 12.603 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -6.821 -12.263 10.580 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -7.981 -12.757 11.797 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.937 -11.078 13.390 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.458 -9.368 13.281 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.489 -10.085 12.021 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -9.062 -12.615 9.561 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.761 -11.407 10.666 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.583 -10.906 9.430 1.00 0.00 H new ATOM 140 N VAL A 10 -5.747 -8.076 12.385 1.00 0.00 N ATOM 141 CA VAL A 10 -5.503 -6.865 13.158 1.00 0.00 C ATOM 142 C VAL A 10 -5.595 -5.638 12.253 1.00 0.00 C ATOM 143 O VAL A 10 -6.259 -4.661 12.595 1.00 0.00 O ATOM 144 CB VAL A 10 -4.107 -6.936 13.798 1.00 0.00 C ATOM 145 CG1 VAL A 10 -3.674 -5.542 14.262 1.00 0.00 C ATOM 146 CG2 VAL A 10 -4.141 -7.888 14.998 1.00 0.00 C ATOM 0 H VAL A 10 -4.988 -8.757 12.403 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.257 -6.783 13.941 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.394 -7.305 13.061 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.684 -5.600 14.714 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -3.643 -4.867 13.407 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.387 -5.165 14.996 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.151 -7.938 15.451 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.858 -7.522 15.733 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -4.438 -8.883 14.665 1.00 0.00 H new ATOM 156 N ASP A 11 -4.920 -5.693 11.109 1.00 0.00 N ATOM 157 CA ASP A 11 -4.933 -4.567 10.179 1.00 0.00 C ATOM 158 C ASP A 11 -6.372 -4.156 9.875 1.00 0.00 C ATOM 159 O ASP A 11 -6.755 -2.985 10.038 1.00 0.00 O ATOM 160 CB ASP A 11 -4.234 -4.973 8.880 1.00 0.00 C ATOM 161 CG ASP A 11 -2.756 -5.231 9.142 1.00 0.00 C ATOM 162 OD1 ASP A 11 -2.252 -4.721 10.127 1.00 0.00 O ATOM 163 OD2 ASP A 11 -2.150 -5.940 8.355 1.00 0.00 O ATOM 0 H ASP A 11 -4.364 -6.493 10.806 1.00 0.00 H new ATOM 0 HA ASP A 11 -4.410 -3.724 10.631 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.701 -5.869 8.471 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -4.348 -4.186 8.135 1.00 0.00 H new ATOM 168 N PHE A 12 -7.183 -5.133 9.464 1.00 0.00 N ATOM 169 CA PHE A 12 -8.587 -4.860 9.166 1.00 0.00 C ATOM 170 C PHE A 12 -9.312 -4.380 10.421 1.00 0.00 C ATOM 171 O PHE A 12 -10.153 -3.481 10.359 1.00 0.00 O ATOM 172 CB PHE A 12 -9.265 -6.123 8.630 1.00 0.00 C ATOM 173 CG PHE A 12 -8.819 -6.366 7.206 1.00 0.00 C ATOM 174 CD1 PHE A 12 -9.190 -5.467 6.199 1.00 0.00 C ATOM 175 CD2 PHE A 12 -8.043 -7.488 6.893 1.00 0.00 C ATOM 176 CE1 PHE A 12 -8.782 -5.689 4.879 1.00 0.00 C ATOM 177 CE2 PHE A 12 -7.633 -7.709 5.575 1.00 0.00 C ATOM 178 CZ PHE A 12 -8.003 -6.810 4.567 1.00 0.00 C ATOM 0 H PHE A 12 -6.897 -6.103 9.332 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.635 -4.078 8.408 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.009 -6.979 9.254 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.349 -6.012 8.670 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -9.791 -4.603 6.441 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -7.761 -8.183 7.670 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -9.068 -4.996 4.101 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -7.031 -8.573 5.334 1.00 0.00 H new ATOM 0 HZ PHE A 12 -7.687 -6.981 3.548 1.00 0.00 H new ATOM 188 N LYS A 13 -8.987 -4.989 11.557 1.00 0.00 N ATOM 189 CA LYS A 13 -9.621 -4.619 12.815 1.00 0.00 C ATOM 190 C LYS A 13 -9.377 -3.143 13.112 1.00 0.00 C ATOM 191 O LYS A 13 -10.285 -2.427 13.538 1.00 0.00 O ATOM 192 CB LYS A 13 -9.049 -5.465 13.953 1.00 0.00 C ATOM 193 CG LYS A 13 -9.828 -5.190 15.242 1.00 0.00 C ATOM 194 CD LYS A 13 -9.173 -5.932 16.408 1.00 0.00 C ATOM 195 CE LYS A 13 -9.365 -7.442 16.238 1.00 0.00 C ATOM 196 NZ LYS A 13 -9.095 -8.125 17.531 1.00 0.00 N ATOM 0 H LYS A 13 -8.295 -5.734 11.632 1.00 0.00 H new ATOM 0 HA LYS A 13 -10.693 -4.796 12.732 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -9.110 -6.523 13.699 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -7.994 -5.232 14.097 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.848 -4.119 15.445 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -10.863 -5.512 15.129 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.110 -5.694 16.451 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -9.611 -5.605 17.351 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.382 -7.655 15.907 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -8.693 -7.820 15.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -9.225 -9.150 17.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.117 -7.931 17.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.753 -7.772 18.254 1.00 0.00 H new ATOM 210 N GLU A 14 -8.146 -2.687 12.882 1.00 0.00 N ATOM 211 CA GLU A 14 -7.804 -1.290 13.128 1.00 0.00 C ATOM 212 C GLU A 14 -8.713 -0.370 12.318 1.00 0.00 C ATOM 213 O GLU A 14 -9.331 0.546 12.866 1.00 0.00 O ATOM 214 CB GLU A 14 -6.345 -1.040 12.739 1.00 0.00 C ATOM 215 CG GLU A 14 -5.421 -1.723 13.746 1.00 0.00 C ATOM 216 CD GLU A 14 -5.503 -1.014 15.093 1.00 0.00 C ATOM 217 OE1 GLU A 14 -5.899 0.139 15.107 1.00 0.00 O ATOM 218 OE2 GLU A 14 -5.160 -1.630 16.088 1.00 0.00 O ATOM 0 H GLU A 14 -7.378 -3.258 12.530 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.941 -1.077 14.188 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.154 -1.424 11.737 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.143 0.031 12.714 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.703 -2.770 13.859 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -4.395 -1.707 13.379 1.00 0.00 H new ATOM 225 N ALA A 15 -8.801 -0.631 11.013 1.00 0.00 N ATOM 226 CA ALA A 15 -9.649 0.188 10.142 1.00 0.00 C ATOM 227 C ALA A 15 -11.075 0.251 10.692 1.00 0.00 C ATOM 228 O ALA A 15 -11.704 1.322 10.739 1.00 0.00 O ATOM 229 CB ALA A 15 -9.664 -0.405 8.735 1.00 0.00 C ATOM 0 H ALA A 15 -8.306 -1.388 10.541 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.243 1.199 10.106 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.295 0.206 8.089 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.649 -0.424 8.337 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -10.058 -1.420 8.772 1.00 0.00 H new ATOM 235 N PHE A 16 -11.580 -0.894 11.130 1.00 0.00 N ATOM 236 CA PHE A 16 -12.926 -0.954 11.694 1.00 0.00 C ATOM 237 C PHE A 16 -13.025 -0.051 12.921 1.00 0.00 C ATOM 238 O PHE A 16 -13.993 0.692 13.080 1.00 0.00 O ATOM 239 CB PHE A 16 -13.268 -2.399 12.081 1.00 0.00 C ATOM 240 CG PHE A 16 -14.525 -2.419 12.920 1.00 0.00 C ATOM 241 CD1 PHE A 16 -14.431 -2.267 14.310 1.00 0.00 C ATOM 242 CD2 PHE A 16 -15.773 -2.572 12.314 1.00 0.00 C ATOM 243 CE1 PHE A 16 -15.587 -2.275 15.093 1.00 0.00 C ATOM 244 CE2 PHE A 16 -16.931 -2.580 13.097 1.00 0.00 C ATOM 245 CZ PHE A 16 -16.838 -2.432 14.486 1.00 0.00 C ATOM 0 H PHE A 16 -11.086 -1.786 11.108 1.00 0.00 H new ATOM 0 HA PHE A 16 -13.636 -0.608 10.943 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -13.409 -3.002 11.184 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.441 -2.842 12.637 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -13.464 -2.144 14.776 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -15.844 -2.684 11.242 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -15.516 -2.160 16.165 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -17.898 -2.700 12.630 1.00 0.00 H new ATOM 0 HZ PHE A 16 -17.733 -2.439 15.090 1.00 0.00 H new ATOM 255 N GLY A 17 -12.024 -0.132 13.790 1.00 0.00 N ATOM 256 CA GLY A 17 -12.013 0.676 15.005 1.00 0.00 C ATOM 257 C GLY A 17 -12.207 2.150 14.666 1.00 0.00 C ATOM 258 O GLY A 17 -12.913 2.871 15.370 1.00 0.00 O ATOM 0 H GLY A 17 -11.215 -0.744 13.678 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.804 0.344 15.677 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -11.069 0.539 15.532 1.00 0.00 H new ATOM 262 N LEU A 18 -11.576 2.592 13.583 1.00 0.00 N ATOM 263 CA LEU A 18 -11.695 3.988 13.165 1.00 0.00 C ATOM 264 C LEU A 18 -13.137 4.319 12.817 1.00 0.00 C ATOM 265 O LEU A 18 -13.648 5.377 13.198 1.00 0.00 O ATOM 266 CB LEU A 18 -10.791 4.248 11.945 1.00 0.00 C ATOM 267 CG LEU A 18 -9.386 4.640 12.407 1.00 0.00 C ATOM 268 CD1 LEU A 18 -8.695 3.432 13.037 1.00 0.00 C ATOM 269 CD2 LEU A 18 -8.579 5.127 11.208 1.00 0.00 C ATOM 0 H LEU A 18 -10.985 2.015 12.985 1.00 0.00 H new ATOM 0 HA LEU A 18 -11.380 4.626 13.991 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.742 3.355 11.322 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.215 5.042 11.331 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.455 5.437 13.147 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.695 3.715 13.365 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -9.274 3.088 13.894 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.623 2.630 12.302 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.577 5.407 11.533 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.510 4.330 10.468 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.072 5.992 10.765 1.00 0.00 H new ATOM 281 N PHE A 19 -13.791 3.414 12.103 1.00 0.00 N ATOM 282 CA PHE A 19 -15.186 3.625 11.730 1.00 0.00 C ATOM 283 C PHE A 19 -16.084 3.599 12.962 1.00 0.00 C ATOM 284 O PHE A 19 -17.014 4.399 13.081 1.00 0.00 O ATOM 285 CB PHE A 19 -15.635 2.536 10.748 1.00 0.00 C ATOM 286 CG PHE A 19 -15.247 2.924 9.341 1.00 0.00 C ATOM 287 CD1 PHE A 19 -15.901 3.997 8.718 1.00 0.00 C ATOM 288 CD2 PHE A 19 -14.246 2.226 8.664 1.00 0.00 C ATOM 289 CE1 PHE A 19 -15.550 4.367 7.418 1.00 0.00 C ATOM 290 CE2 PHE A 19 -13.897 2.595 7.364 1.00 0.00 C ATOM 291 CZ PHE A 19 -14.549 3.667 6.741 1.00 0.00 C ATOM 0 H PHE A 19 -13.387 2.537 11.773 1.00 0.00 H new ATOM 0 HA PHE A 19 -15.269 4.603 11.255 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.176 1.584 11.012 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -16.714 2.398 10.812 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -16.675 4.537 9.243 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -13.742 1.401 9.146 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.052 5.193 6.937 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -13.124 2.054 6.838 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.277 3.953 5.736 1.00 0.00 H new ATOM 301 N ASP A 20 -15.805 2.677 13.874 1.00 0.00 N ATOM 302 CA ASP A 20 -16.599 2.556 15.091 1.00 0.00 C ATOM 303 C ASP A 20 -16.028 3.430 16.202 1.00 0.00 C ATOM 304 O ASP A 20 -15.424 2.928 17.149 1.00 0.00 O ATOM 305 CB ASP A 20 -16.627 1.085 15.544 1.00 0.00 C ATOM 306 CG ASP A 20 -17.792 0.348 14.895 1.00 0.00 C ATOM 307 OD1 ASP A 20 -17.787 0.220 13.683 1.00 0.00 O ATOM 308 OD2 ASP A 20 -18.680 -0.060 15.627 1.00 0.00 O ATOM 0 H ASP A 20 -15.041 2.006 13.796 1.00 0.00 H new ATOM 0 HA ASP A 20 -17.614 2.893 14.879 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -15.688 0.599 15.278 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -16.716 1.034 16.629 1.00 0.00 H new ATOM 313 N LYS A 21 -16.237 4.731 16.083 1.00 0.00 N ATOM 314 CA LYS A 21 -15.750 5.663 17.086 1.00 0.00 C ATOM 315 C LYS A 21 -16.333 5.326 18.453 1.00 0.00 C ATOM 316 O LYS A 21 -15.642 5.393 19.469 1.00 0.00 O ATOM 317 CB LYS A 21 -16.133 7.096 16.701 1.00 0.00 C ATOM 318 CG LYS A 21 -17.545 7.104 16.112 1.00 0.00 C ATOM 319 CD LYS A 21 -17.990 8.546 15.872 1.00 0.00 C ATOM 320 CE LYS A 21 -19.297 8.553 15.078 1.00 0.00 C ATOM 321 NZ LYS A 21 -20.353 7.844 15.852 1.00 0.00 N ATOM 0 H LYS A 21 -16.738 5.164 15.307 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.664 5.582 17.136 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.089 7.744 17.577 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -15.422 7.492 15.976 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -17.563 6.546 15.176 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -18.237 6.607 16.792 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -18.128 9.058 16.824 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -17.218 9.090 15.327 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -19.606 9.578 14.876 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -19.151 8.068 14.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -21.290 8.115 15.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -20.227 6.817 15.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -20.281 8.105 16.856 1.00 0.00 H new ATOM 335 N ASP A 22 -17.613 4.969 18.472 1.00 0.00 N ATOM 336 CA ASP A 22 -18.284 4.629 19.722 1.00 0.00 C ATOM 337 C ASP A 22 -18.208 3.141 19.976 1.00 0.00 C ATOM 338 O ASP A 22 -19.130 2.572 20.552 1.00 0.00 O ATOM 339 CB ASP A 22 -19.751 5.068 19.666 1.00 0.00 C ATOM 340 CG ASP A 22 -20.317 4.799 18.276 1.00 0.00 C ATOM 341 OD1 ASP A 22 -19.767 3.955 17.580 1.00 0.00 O ATOM 342 OD2 ASP A 22 -21.300 5.432 17.932 1.00 0.00 O ATOM 0 H ASP A 22 -18.203 4.908 17.642 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.782 5.151 20.536 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -20.330 4.529 20.415 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -19.832 6.129 19.903 1.00 0.00 H new ATOM 347 N GLY A 23 -17.109 2.514 19.554 1.00 0.00 N ATOM 348 CA GLY A 23 -16.915 1.075 19.751 1.00 0.00 C ATOM 349 C GLY A 23 -18.216 0.358 20.070 1.00 0.00 C ATOM 350 O GLY A 23 -18.418 -0.114 21.190 1.00 0.00 O ATOM 0 H GLY A 23 -16.339 2.979 19.073 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.475 0.643 18.852 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -16.205 0.914 20.562 1.00 0.00 H new ATOM 354 N ASP A 24 -19.122 0.322 19.094 1.00 0.00 N ATOM 355 CA ASP A 24 -20.419 -0.322 19.302 1.00 0.00 C ATOM 356 C ASP A 24 -20.342 -1.773 18.862 1.00 0.00 C ATOM 357 O ASP A 24 -21.025 -2.635 19.406 1.00 0.00 O ATOM 358 CB ASP A 24 -21.499 0.394 18.490 1.00 0.00 C ATOM 359 CG ASP A 24 -21.532 1.870 18.844 1.00 0.00 C ATOM 360 OD1 ASP A 24 -21.378 2.182 20.013 1.00 0.00 O ATOM 361 OD2 ASP A 24 -21.715 2.662 17.938 1.00 0.00 O ATOM 0 H ASP A 24 -18.987 0.724 18.166 1.00 0.00 H new ATOM 0 HA ASP A 24 -20.673 -0.270 20.361 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -21.303 0.273 17.425 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -22.472 -0.056 18.688 1.00 0.00 H new ATOM 366 N GLY A 25 -19.481 -2.049 17.874 1.00 0.00 N ATOM 367 CA GLY A 25 -19.316 -3.416 17.368 1.00 0.00 C ATOM 368 C GLY A 25 -19.871 -3.549 15.954 1.00 0.00 C ATOM 369 O GLY A 25 -20.008 -4.656 15.434 1.00 0.00 O ATOM 0 H GLY A 25 -18.895 -1.352 17.414 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -18.260 -3.684 17.374 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -19.826 -4.116 18.030 1.00 0.00 H new ATOM 373 N CYS A 26 -20.185 -2.416 15.334 1.00 0.00 N ATOM 374 CA CYS A 26 -20.719 -2.423 13.977 1.00 0.00 C ATOM 375 C CYS A 26 -20.695 -1.021 13.387 1.00 0.00 C ATOM 376 O CYS A 26 -20.410 -0.042 14.087 1.00 0.00 O ATOM 377 CB CYS A 26 -22.151 -2.951 13.980 1.00 0.00 C ATOM 378 SG CYS A 26 -23.157 -1.954 15.107 1.00 0.00 S ATOM 0 H CYS A 26 -20.080 -1.489 15.745 1.00 0.00 H new ATOM 0 HA CYS A 26 -20.095 -3.075 13.366 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -22.567 -2.912 12.973 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -22.164 -3.996 14.291 1.00 0.00 H new ATOM 0 HG CYS A 26 -24.378 -2.401 15.109 1.00 0.00 H new ATOM 384 N ILE A 27 -21.002 -0.920 12.093 1.00 0.00 N ATOM 385 CA ILE A 27 -21.016 0.384 11.420 1.00 0.00 C ATOM 386 C ILE A 27 -22.418 0.697 10.924 1.00 0.00 C ATOM 387 O ILE A 27 -22.994 -0.066 10.162 1.00 0.00 O ATOM 388 CB ILE A 27 -20.046 0.368 10.242 1.00 0.00 C ATOM 389 CG1 ILE A 27 -18.657 -0.042 10.737 1.00 0.00 C ATOM 390 CG2 ILE A 27 -19.971 1.767 9.631 1.00 0.00 C ATOM 391 CD1 ILE A 27 -17.731 -0.256 9.538 1.00 0.00 C ATOM 0 H ILE A 27 -21.241 -1.711 11.496 1.00 0.00 H new ATOM 0 HA ILE A 27 -20.708 1.152 12.129 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.392 -0.342 9.491 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -18.250 0.729 11.391 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -18.724 -0.957 11.326 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.279 1.760 8.789 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.960 2.066 9.285 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -19.620 2.474 10.383 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -16.742 -0.548 9.890 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.136 -1.042 8.901 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -17.655 0.670 8.968 1.00 0.00 H new ATOM 403 N THR A 28 -22.961 1.830 11.360 1.00 0.00 N ATOM 404 CA THR A 28 -24.302 2.238 10.949 1.00 0.00 C ATOM 405 C THR A 28 -24.235 3.247 9.810 1.00 0.00 C ATOM 406 O THR A 28 -23.186 3.452 9.208 1.00 0.00 O ATOM 407 CB THR A 28 -25.049 2.853 12.149 1.00 0.00 C ATOM 408 OG1 THR A 28 -24.445 2.404 13.355 1.00 0.00 O ATOM 409 CG2 THR A 28 -26.521 2.426 12.121 1.00 0.00 C ATOM 0 H THR A 28 -22.496 2.479 11.995 1.00 0.00 H new ATOM 0 HA THR A 28 -24.840 1.357 10.598 1.00 0.00 H new ATOM 0 HB THR A 28 -24.993 3.940 12.092 1.00 0.00 H new ATOM 0 HG1 THR A 28 -23.562 2.817 13.452 1.00 0.00 H new ATOM 0 HG21 THR A 28 -27.043 2.864 12.972 1.00 0.00 H new ATOM 0 HG22 THR A 28 -26.982 2.771 11.195 1.00 0.00 H new ATOM 0 HG23 THR A 28 -26.586 1.339 12.176 1.00 0.00 H new ATOM 417 N VAL A 29 -25.373 3.880 9.525 1.00 0.00 N ATOM 418 CA VAL A 29 -25.439 4.879 8.466 1.00 0.00 C ATOM 419 C VAL A 29 -24.990 6.241 8.985 1.00 0.00 C ATOM 420 O VAL A 29 -24.212 6.940 8.333 1.00 0.00 O ATOM 421 CB VAL A 29 -26.863 4.972 7.920 1.00 0.00 C ATOM 422 CG1 VAL A 29 -26.900 5.969 6.761 1.00 0.00 C ATOM 423 CG2 VAL A 29 -27.307 3.595 7.420 1.00 0.00 C ATOM 0 H VAL A 29 -26.255 3.718 10.011 1.00 0.00 H new ATOM 0 HA VAL A 29 -24.768 4.575 7.662 1.00 0.00 H new ATOM 0 HB VAL A 29 -27.534 5.307 8.710 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -27.916 6.036 6.371 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -26.582 6.950 7.114 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -26.229 5.633 5.970 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -28.323 3.660 7.030 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -26.635 3.261 6.629 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -27.279 2.882 8.244 1.00 0.00 H new ATOM 433 N GLU A 30 -25.489 6.614 10.160 1.00 0.00 N ATOM 434 CA GLU A 30 -25.136 7.898 10.754 1.00 0.00 C ATOM 435 C GLU A 30 -23.648 7.934 11.086 1.00 0.00 C ATOM 436 O GLU A 30 -22.978 8.943 10.868 1.00 0.00 O ATOM 437 CB GLU A 30 -25.953 8.125 12.030 1.00 0.00 C ATOM 438 CG GLU A 30 -25.752 9.563 12.518 1.00 0.00 C ATOM 439 CD GLU A 30 -26.436 10.534 11.563 1.00 0.00 C ATOM 440 OE1 GLU A 30 -27.131 10.074 10.672 1.00 0.00 O ATOM 441 OE2 GLU A 30 -26.259 11.728 11.737 1.00 0.00 O ATOM 0 H GLU A 30 -26.133 6.051 10.715 1.00 0.00 H new ATOM 0 HA GLU A 30 -25.359 8.688 10.037 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -27.009 7.940 11.835 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -25.643 7.421 12.803 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -26.162 9.677 13.522 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -24.688 9.790 12.581 1.00 0.00 H new ATOM 448 N GLU A 31 -23.133 6.823 11.612 1.00 0.00 N ATOM 449 CA GLU A 31 -21.719 6.742 11.966 1.00 0.00 C ATOM 450 C GLU A 31 -20.856 6.830 10.712 1.00 0.00 C ATOM 451 O GLU A 31 -19.904 7.612 10.648 1.00 0.00 O ATOM 452 CB GLU A 31 -21.440 5.428 12.696 1.00 0.00 C ATOM 453 CG GLU A 31 -22.155 5.436 14.049 1.00 0.00 C ATOM 454 CD GLU A 31 -21.910 4.117 14.773 1.00 0.00 C ATOM 455 OE1 GLU A 31 -21.888 3.092 14.109 1.00 0.00 O ATOM 456 OE2 GLU A 31 -21.752 4.149 15.981 1.00 0.00 O ATOM 0 H GLU A 31 -23.668 5.976 11.800 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.473 7.576 12.623 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.784 4.586 12.096 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -20.367 5.300 12.840 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -21.794 6.266 14.656 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.225 5.588 13.904 1.00 0.00 H new ATOM 463 N LEU A 32 -21.197 6.025 9.711 1.00 0.00 N ATOM 464 CA LEU A 32 -20.448 6.021 8.463 1.00 0.00 C ATOM 465 C LEU A 32 -20.513 7.399 7.812 1.00 0.00 C ATOM 466 O LEU A 32 -19.531 7.873 7.241 1.00 0.00 O ATOM 467 CB LEU A 32 -21.027 4.973 7.511 1.00 0.00 C ATOM 468 CG LEU A 32 -20.082 4.792 6.301 1.00 0.00 C ATOM 469 CD1 LEU A 32 -19.050 3.705 6.616 1.00 0.00 C ATOM 470 CD2 LEU A 32 -20.899 4.384 5.070 1.00 0.00 C ATOM 0 H LEU A 32 -21.981 5.373 9.740 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.408 5.775 8.676 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -21.153 4.024 8.032 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -22.015 5.283 7.170 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.567 5.731 6.098 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -18.384 3.578 5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -18.468 3.998 7.490 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -19.562 2.765 6.820 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -20.233 4.256 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -21.415 3.445 5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -21.631 5.160 4.846 1.00 0.00 H new ATOM 482 N ALA A 33 -21.677 8.035 7.894 1.00 0.00 N ATOM 483 CA ALA A 33 -21.854 9.360 7.310 1.00 0.00 C ATOM 484 C ALA A 33 -20.923 10.362 7.989 1.00 0.00 C ATOM 485 O ALA A 33 -20.271 11.159 7.329 1.00 0.00 O ATOM 486 CB ALA A 33 -23.305 9.813 7.476 1.00 0.00 C ATOM 0 H ALA A 33 -22.505 7.659 8.355 1.00 0.00 H new ATOM 0 HA ALA A 33 -21.611 9.311 6.248 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -23.429 10.803 7.038 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -23.966 9.108 6.973 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -23.555 9.852 8.536 1.00 0.00 H new ATOM 492 N THR A 34 -20.865 10.311 9.316 1.00 0.00 N ATOM 493 CA THR A 34 -20.014 11.230 10.066 1.00 0.00 C ATOM 494 C THR A 34 -18.569 11.112 9.600 1.00 0.00 C ATOM 495 O THR A 34 -17.918 12.115 9.306 1.00 0.00 O ATOM 496 CB THR A 34 -20.091 10.900 11.559 1.00 0.00 C ATOM 497 OG1 THR A 34 -21.452 10.777 11.948 1.00 0.00 O ATOM 498 CG2 THR A 34 -19.425 12.013 12.367 1.00 0.00 C ATOM 0 H THR A 34 -21.390 9.651 9.890 1.00 0.00 H new ATOM 0 HA THR A 34 -20.362 12.248 9.894 1.00 0.00 H new ATOM 0 HB THR A 34 -19.573 9.960 11.748 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.767 9.870 11.753 1.00 0.00 H new ATOM 0 HG21 THR A 34 -19.481 11.775 13.429 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.380 12.103 12.070 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.938 12.956 12.179 1.00 0.00 H new ATOM 506 N VAL A 35 -18.074 9.881 9.516 1.00 0.00 N ATOM 507 CA VAL A 35 -16.702 9.651 9.073 1.00 0.00 C ATOM 508 C VAL A 35 -16.511 10.155 7.644 1.00 0.00 C ATOM 509 O VAL A 35 -15.527 10.825 7.337 1.00 0.00 O ATOM 510 CB VAL A 35 -16.381 8.156 9.132 1.00 0.00 C ATOM 511 CG1 VAL A 35 -14.969 7.914 8.597 1.00 0.00 C ATOM 512 CG2 VAL A 35 -16.467 7.673 10.581 1.00 0.00 C ATOM 0 H VAL A 35 -18.595 9.035 9.746 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.028 10.196 9.734 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.098 7.607 8.522 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.741 6.849 8.640 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.907 8.257 7.564 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.250 8.463 9.205 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.238 6.608 10.624 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -15.750 8.223 11.191 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.474 7.844 10.962 1.00 0.00 H new ATOM 522 N ILE A 36 -17.460 9.828 6.773 1.00 0.00 N ATOM 523 CA ILE A 36 -17.385 10.260 5.382 1.00 0.00 C ATOM 524 C ILE A 36 -17.466 11.782 5.283 1.00 0.00 C ATOM 525 O ILE A 36 -16.712 12.404 4.536 1.00 0.00 O ATOM 526 CB ILE A 36 -18.526 9.631 4.578 1.00 0.00 C ATOM 527 CG1 ILE A 36 -18.291 8.123 4.457 1.00 0.00 C ATOM 528 CG2 ILE A 36 -18.576 10.255 3.180 1.00 0.00 C ATOM 529 CD1 ILE A 36 -19.555 7.451 3.914 1.00 0.00 C ATOM 0 H ILE A 36 -18.283 9.271 7.002 1.00 0.00 H new ATOM 0 HA ILE A 36 -16.429 9.934 4.973 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.472 9.813 5.088 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.449 7.928 3.793 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.034 7.705 5.430 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.389 9.806 2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -18.744 11.329 3.267 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -17.631 10.076 2.667 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -19.388 6.377 3.828 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -20.386 7.635 4.595 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -19.792 7.861 2.932 1.00 0.00 H new ATOM 541 N ARG A 37 -18.390 12.369 6.035 1.00 0.00 N ATOM 542 CA ARG A 37 -18.567 13.811 6.023 1.00 0.00 C ATOM 543 C ARG A 37 -17.309 14.514 6.519 1.00 0.00 C ATOM 544 O ARG A 37 -16.929 15.567 6.006 1.00 0.00 O ATOM 545 CB ARG A 37 -19.763 14.206 6.887 1.00 0.00 C ATOM 546 CG ARG A 37 -21.063 13.819 6.182 1.00 0.00 C ATOM 547 CD ARG A 37 -22.247 14.082 7.114 1.00 0.00 C ATOM 548 NE ARG A 37 -22.355 15.508 7.402 1.00 0.00 N ATOM 549 CZ ARG A 37 -23.205 15.961 8.318 1.00 0.00 C ATOM 550 NH1 ARG A 37 -23.957 15.126 8.982 1.00 0.00 N ATOM 551 NH2 ARG A 37 -23.285 17.241 8.558 1.00 0.00 N ATOM 0 H ARG A 37 -19.024 11.869 6.657 1.00 0.00 H new ATOM 0 HA ARG A 37 -18.755 14.122 4.995 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -19.703 13.710 7.856 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -19.747 15.279 7.077 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -21.176 14.394 5.263 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -21.036 12.767 5.899 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -23.168 13.726 6.653 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -22.119 13.525 8.042 1.00 0.00 H new ATOM 0 HE ARG A 37 -21.768 16.168 6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -23.893 14.125 8.798 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -24.609 15.475 9.685 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -22.695 17.894 8.043 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -23.937 17.588 9.261 1.00 0.00 H new ATOM 565 N SER A 38 -16.670 13.918 7.516 1.00 0.00 N ATOM 566 CA SER A 38 -15.450 14.487 8.080 1.00 0.00 C ATOM 567 C SER A 38 -14.326 14.454 7.053 1.00 0.00 C ATOM 568 O SER A 38 -13.448 15.320 7.046 1.00 0.00 O ATOM 569 CB SER A 38 -15.027 13.707 9.320 1.00 0.00 C ATOM 570 OG SER A 38 -14.804 12.350 8.966 1.00 0.00 O ATOM 0 H SER A 38 -16.972 13.046 7.950 1.00 0.00 H new ATOM 0 HA SER A 38 -15.651 15.522 8.357 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.120 14.138 9.743 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.799 13.773 10.086 1.00 0.00 H new ATOM 0 HG SER A 38 -15.267 12.151 8.126 1.00 0.00 H new ATOM 576 N LEU A 39 -14.360 13.458 6.174 1.00 0.00 N ATOM 577 CA LEU A 39 -13.339 13.331 5.145 1.00 0.00 C ATOM 578 C LEU A 39 -13.343 14.550 4.223 1.00 0.00 C ATOM 579 O LEU A 39 -12.757 14.515 3.139 1.00 0.00 O ATOM 580 CB LEU A 39 -13.591 12.061 4.313 1.00 0.00 C ATOM 581 CG LEU A 39 -12.252 11.525 3.765 1.00 0.00 C ATOM 582 CD1 LEU A 39 -11.628 10.573 4.790 1.00 0.00 C ATOM 583 CD2 LEU A 39 -12.497 10.772 2.460 1.00 0.00 C ATOM 0 H LEU A 39 -15.078 12.733 6.154 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.367 13.264 5.634 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -14.074 11.301 4.928 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -14.270 12.283 3.489 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.576 12.360 3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.682 10.193 4.405 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.451 11.108 5.723 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -12.306 9.740 4.973 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.550 10.394 2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -13.173 9.937 2.643 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -12.943 11.446 1.729 1.00 0.00 H new ATOM 595 N ASP A 40 -14.006 15.614 4.656 1.00 0.00 N ATOM 596 CA ASP A 40 -14.082 16.832 3.872 1.00 0.00 C ATOM 597 C ASP A 40 -14.963 16.633 2.646 1.00 0.00 C ATOM 598 O ASP A 40 -14.610 17.053 1.544 1.00 0.00 O ATOM 599 CB ASP A 40 -12.678 17.249 3.430 1.00 0.00 C ATOM 600 CG ASP A 40 -11.665 16.919 4.526 1.00 0.00 C ATOM 601 OD1 ASP A 40 -11.961 17.184 5.681 1.00 0.00 O ATOM 602 OD2 ASP A 40 -10.609 16.403 4.195 1.00 0.00 O ATOM 0 H ASP A 40 -14.499 15.655 5.548 1.00 0.00 H new ATOM 0 HA ASP A 40 -14.521 17.614 4.492 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -12.410 16.733 2.508 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -12.658 18.317 3.215 1.00 0.00 H new ATOM 607 N GLN A 41 -16.102 15.987 2.843 1.00 0.00 N ATOM 608 CA GLN A 41 -17.028 15.740 1.741 1.00 0.00 C ATOM 609 C GLN A 41 -18.469 15.767 2.232 1.00 0.00 C ATOM 610 O GLN A 41 -18.731 15.575 3.402 1.00 0.00 O ATOM 611 CB GLN A 41 -16.720 14.370 1.104 1.00 0.00 C ATOM 612 CG GLN A 41 -16.951 14.443 -0.406 1.00 0.00 C ATOM 613 CD GLN A 41 -15.826 15.229 -1.065 1.00 0.00 C ATOM 614 OE1 GLN A 41 -14.653 14.944 -0.833 1.00 0.00 O ATOM 615 NE2 GLN A 41 -16.114 16.211 -1.877 1.00 0.00 N ATOM 0 H GLN A 41 -16.408 15.626 3.746 1.00 0.00 H new ATOM 0 HA GLN A 41 -16.902 16.526 0.997 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -15.688 14.085 1.311 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -17.357 13.602 1.543 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -16.998 13.438 -0.825 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -17.909 14.919 -0.613 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -17.088 16.446 -2.068 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -15.365 16.743 -2.320 1.00 0.00 H new ATOM 624 N ASN A 42 -19.400 16.004 1.320 1.00 0.00 N ATOM 625 CA ASN A 42 -20.822 16.041 1.676 1.00 0.00 C ATOM 626 C ASN A 42 -21.643 15.289 0.631 1.00 0.00 C ATOM 627 O ASN A 42 -22.364 15.894 -0.161 1.00 0.00 O ATOM 628 CB ASN A 42 -21.298 17.487 1.761 1.00 0.00 C ATOM 629 CG ASN A 42 -22.776 17.520 2.132 1.00 0.00 C ATOM 630 OD1 ASN A 42 -23.322 16.520 2.601 1.00 0.00 O ATOM 631 ND2 ASN A 42 -23.459 18.615 1.952 1.00 0.00 N ATOM 0 H ASN A 42 -19.205 16.173 0.333 1.00 0.00 H new ATOM 0 HA ASN A 42 -20.955 15.562 2.646 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -20.714 18.029 2.505 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -21.142 17.988 0.806 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -24.448 18.646 2.200 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -23.005 19.441 1.564 1.00 0.00 H new ATOM 638 N PRO A 43 -21.535 13.984 0.609 1.00 0.00 N ATOM 639 CA PRO A 43 -22.267 13.131 -0.368 1.00 0.00 C ATOM 640 C PRO A 43 -23.729 12.923 0.018 1.00 0.00 C ATOM 641 O PRO A 43 -24.083 12.983 1.194 1.00 0.00 O ATOM 642 CB PRO A 43 -21.487 11.810 -0.338 1.00 0.00 C ATOM 643 CG PRO A 43 -20.893 11.734 1.039 1.00 0.00 C ATOM 644 CD PRO A 43 -20.713 13.179 1.531 1.00 0.00 C ATOM 0 HA PRO A 43 -22.312 13.584 -1.358 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -22.143 10.961 -0.531 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -20.711 11.794 -1.103 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -21.546 11.177 1.710 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.937 11.212 1.018 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -21.046 13.292 2.563 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.667 13.483 1.499 1.00 0.00 H new ATOM 652 N THR A 44 -24.565 12.661 -0.981 1.00 0.00 N ATOM 653 CA THR A 44 -25.979 12.426 -0.738 1.00 0.00 C ATOM 654 C THR A 44 -26.182 11.111 0.010 1.00 0.00 C ATOM 655 O THR A 44 -25.575 10.097 -0.328 1.00 0.00 O ATOM 656 CB THR A 44 -26.740 12.390 -2.063 1.00 0.00 C ATOM 657 OG1 THR A 44 -26.564 13.625 -2.739 1.00 0.00 O ATOM 658 CG2 THR A 44 -28.221 12.157 -1.792 1.00 0.00 C ATOM 0 H THR A 44 -24.288 12.607 -1.961 1.00 0.00 H new ATOM 0 HA THR A 44 -26.364 13.241 -0.125 1.00 0.00 H new ATOM 0 HB THR A 44 -26.357 11.580 -2.684 1.00 0.00 H new ATOM 0 HG1 THR A 44 -27.050 13.604 -3.590 1.00 0.00 H new ATOM 0 HG21 THR A 44 -28.764 12.131 -2.737 1.00 0.00 H new ATOM 0 HG22 THR A 44 -28.351 11.207 -1.273 1.00 0.00 H new ATOM 0 HG23 THR A 44 -28.609 12.965 -1.172 1.00 0.00 H new ATOM 666 N GLU A 45 -27.044 11.134 1.022 1.00 0.00 N ATOM 667 CA GLU A 45 -27.320 9.936 1.808 1.00 0.00 C ATOM 668 C GLU A 45 -27.762 8.791 0.900 1.00 0.00 C ATOM 669 O GLU A 45 -27.382 7.642 1.107 1.00 0.00 O ATOM 670 CB GLU A 45 -28.417 10.234 2.835 1.00 0.00 C ATOM 671 CG GLU A 45 -29.717 10.592 2.110 1.00 0.00 C ATOM 672 CD GLU A 45 -30.750 11.093 3.110 1.00 0.00 C ATOM 673 OE1 GLU A 45 -30.374 11.843 3.995 1.00 0.00 O ATOM 674 OE2 GLU A 45 -31.905 10.722 2.974 1.00 0.00 O ATOM 0 H GLU A 45 -27.560 11.963 1.316 1.00 0.00 H new ATOM 0 HA GLU A 45 -26.408 9.639 2.325 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -28.574 9.367 3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -28.111 11.057 3.481 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -29.525 11.358 1.359 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -30.102 9.719 1.584 1.00 0.00 H new ATOM 681 N GLU A 46 -28.568 9.110 -0.103 1.00 0.00 N ATOM 682 CA GLU A 46 -29.054 8.096 -1.031 1.00 0.00 C ATOM 683 C GLU A 46 -27.897 7.239 -1.533 1.00 0.00 C ATOM 684 O GLU A 46 -28.016 6.020 -1.640 1.00 0.00 O ATOM 685 CB GLU A 46 -29.744 8.770 -2.221 1.00 0.00 C ATOM 686 CG GLU A 46 -30.962 9.555 -1.730 1.00 0.00 C ATOM 687 CD GLU A 46 -32.008 8.599 -1.167 1.00 0.00 C ATOM 688 OE1 GLU A 46 -32.356 7.659 -1.862 1.00 0.00 O ATOM 689 OE2 GLU A 46 -32.442 8.818 -0.048 1.00 0.00 O ATOM 0 H GLU A 46 -28.898 10.056 -0.295 1.00 0.00 H new ATOM 0 HA GLU A 46 -29.767 7.458 -0.509 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -29.048 9.439 -2.727 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -30.052 8.019 -2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -30.660 10.269 -0.963 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -31.389 10.131 -2.551 1.00 0.00 H new ATOM 696 N GLU A 47 -26.773 7.884 -1.830 1.00 0.00 N ATOM 697 CA GLU A 47 -25.596 7.168 -2.310 1.00 0.00 C ATOM 698 C GLU A 47 -25.038 6.260 -1.216 1.00 0.00 C ATOM 699 O GLU A 47 -24.501 5.187 -1.497 1.00 0.00 O ATOM 700 CB GLU A 47 -24.522 8.163 -2.749 1.00 0.00 C ATOM 701 CG GLU A 47 -24.991 8.898 -4.005 1.00 0.00 C ATOM 702 CD GLU A 47 -23.980 9.974 -4.386 1.00 0.00 C ATOM 703 OE1 GLU A 47 -22.966 10.073 -3.714 1.00 0.00 O ATOM 704 OE2 GLU A 47 -24.233 10.684 -5.345 1.00 0.00 O ATOM 0 H GLU A 47 -26.652 8.893 -1.748 1.00 0.00 H new ATOM 0 HA GLU A 47 -25.889 6.554 -3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -24.324 8.877 -1.950 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -23.587 7.640 -2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -25.110 8.192 -4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -25.967 9.350 -3.829 1.00 0.00 H new ATOM 711 N LEU A 48 -25.177 6.695 0.034 1.00 0.00 N ATOM 712 CA LEU A 48 -24.696 5.906 1.165 1.00 0.00 C ATOM 713 C LEU A 48 -25.589 4.693 1.397 1.00 0.00 C ATOM 714 O LEU A 48 -25.106 3.589 1.621 1.00 0.00 O ATOM 715 CB LEU A 48 -24.654 6.779 2.427 1.00 0.00 C ATOM 716 CG LEU A 48 -23.342 7.564 2.468 1.00 0.00 C ATOM 717 CD1 LEU A 48 -23.195 8.387 1.190 1.00 0.00 C ATOM 718 CD2 LEU A 48 -23.346 8.494 3.681 1.00 0.00 C ATOM 0 H LEU A 48 -25.614 7.581 0.288 1.00 0.00 H new ATOM 0 HA LEU A 48 -23.690 5.552 0.939 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -25.500 7.466 2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -24.743 6.155 3.316 1.00 0.00 H new ATOM 0 HG LEU A 48 -22.505 6.870 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -22.259 8.945 1.222 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -23.191 7.721 0.327 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -24.030 9.083 1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -22.412 9.055 3.713 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -24.183 9.188 3.605 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -23.446 7.904 4.592 1.00 0.00 H new ATOM 730 N GLN A 49 -26.898 4.911 1.347 1.00 0.00 N ATOM 731 CA GLN A 49 -27.850 3.829 1.557 1.00 0.00 C ATOM 732 C GLN A 49 -27.748 2.806 0.433 1.00 0.00 C ATOM 733 O GLN A 49 -27.886 1.603 0.660 1.00 0.00 O ATOM 734 CB GLN A 49 -29.272 4.388 1.620 1.00 0.00 C ATOM 735 CG GLN A 49 -29.444 5.210 2.899 1.00 0.00 C ATOM 736 CD GLN A 49 -30.842 5.816 2.946 1.00 0.00 C ATOM 737 OE1 GLN A 49 -31.671 5.533 2.080 1.00 0.00 O ATOM 738 NE2 GLN A 49 -31.155 6.637 3.912 1.00 0.00 N ATOM 0 H GLN A 49 -27.321 5.821 1.164 1.00 0.00 H new ATOM 0 HA GLN A 49 -27.615 3.338 2.501 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -29.468 5.010 0.747 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -29.995 3.573 1.600 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -29.284 4.577 3.772 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -28.695 6.001 2.936 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -30.466 6.869 4.627 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -32.089 7.046 3.951 1.00 0.00 H new ATOM 747 N ASP A 50 -27.506 3.292 -0.782 1.00 0.00 N ATOM 748 CA ASP A 50 -27.387 2.407 -1.938 1.00 0.00 C ATOM 749 C ASP A 50 -26.149 1.524 -1.814 1.00 0.00 C ATOM 750 O ASP A 50 -26.225 0.305 -1.975 1.00 0.00 O ATOM 751 CB ASP A 50 -27.298 3.234 -3.220 1.00 0.00 C ATOM 752 CG ASP A 50 -27.432 2.326 -4.436 1.00 0.00 C ATOM 753 OD1 ASP A 50 -28.338 1.508 -4.444 1.00 0.00 O ATOM 754 OD2 ASP A 50 -26.625 2.459 -5.342 1.00 0.00 O ATOM 0 H ASP A 50 -27.389 4.284 -0.991 1.00 0.00 H new ATOM 0 HA ASP A 50 -28.271 1.770 -1.976 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -28.084 3.989 -3.231 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -26.346 3.765 -3.255 1.00 0.00 H new ATOM 759 N MET A 51 -25.012 2.146 -1.519 1.00 0.00 N ATOM 760 CA MET A 51 -23.762 1.406 -1.369 1.00 0.00 C ATOM 761 C MET A 51 -23.827 0.481 -0.160 1.00 0.00 C ATOM 762 O MET A 51 -23.399 -0.672 -0.224 1.00 0.00 O ATOM 763 CB MET A 51 -22.597 2.379 -1.214 1.00 0.00 C ATOM 764 CG MET A 51 -21.291 1.594 -1.071 1.00 0.00 C ATOM 765 SD MET A 51 -19.886 2.715 -1.281 1.00 0.00 S ATOM 766 CE MET A 51 -20.329 3.893 0.018 1.00 0.00 C ATOM 0 H MET A 51 -24.929 3.153 -1.380 1.00 0.00 H new ATOM 0 HA MET A 51 -23.610 0.800 -2.262 1.00 0.00 H new ATOM 0 HB2 MET A 51 -22.544 3.040 -2.079 1.00 0.00 H new ATOM 0 HB3 MET A 51 -22.751 3.011 -0.339 1.00 0.00 H new ATOM 0 HG2 MET A 51 -21.246 1.117 -0.092 1.00 0.00 H new ATOM 0 HG3 MET A 51 -21.249 0.798 -1.815 1.00 0.00 H new ATOM 0 HE1 MET A 51 -19.424 4.349 0.420 1.00 0.00 H new ATOM 0 HE2 MET A 51 -20.972 4.669 -0.398 1.00 0.00 H new ATOM 0 HE3 MET A 51 -20.858 3.372 0.816 1.00 0.00 H new ATOM 776 N ILE A 52 -24.366 0.992 0.936 1.00 0.00 N ATOM 777 CA ILE A 52 -24.491 0.202 2.149 1.00 0.00 C ATOM 778 C ILE A 52 -25.466 -0.951 1.962 1.00 0.00 C ATOM 779 O ILE A 52 -25.199 -2.068 2.394 1.00 0.00 O ATOM 780 CB ILE A 52 -24.970 1.088 3.309 1.00 0.00 C ATOM 781 CG1 ILE A 52 -23.859 2.086 3.679 1.00 0.00 C ATOM 782 CG2 ILE A 52 -25.298 0.216 4.534 1.00 0.00 C ATOM 783 CD1 ILE A 52 -22.754 1.383 4.489 1.00 0.00 C ATOM 0 H ILE A 52 -24.722 1.945 1.010 1.00 0.00 H new ATOM 0 HA ILE A 52 -23.508 -0.209 2.379 1.00 0.00 H new ATOM 0 HB ILE A 52 -25.866 1.628 3.002 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -23.435 2.520 2.774 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -24.278 2.907 4.260 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -25.637 0.851 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -26.084 -0.493 4.276 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -24.405 -0.328 4.843 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -21.975 2.102 4.743 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -23.180 0.971 5.404 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -22.323 0.577 3.894 1.00 0.00 H new ATOM 795 N SER A 53 -26.586 -0.663 1.320 1.00 0.00 N ATOM 796 CA SER A 53 -27.604 -1.676 1.086 1.00 0.00 C ATOM 797 C SER A 53 -27.106 -2.730 0.103 1.00 0.00 C ATOM 798 O SER A 53 -27.443 -3.909 0.214 1.00 0.00 O ATOM 799 CB SER A 53 -28.874 -1.029 0.538 1.00 0.00 C ATOM 800 OG SER A 53 -28.571 -0.356 -0.677 1.00 0.00 O ATOM 0 H SER A 53 -26.814 0.261 0.952 1.00 0.00 H new ATOM 0 HA SER A 53 -27.824 -2.160 2.038 1.00 0.00 H new ATOM 0 HB2 SER A 53 -29.638 -1.788 0.366 1.00 0.00 H new ATOM 0 HB3 SER A 53 -29.281 -0.326 1.265 1.00 0.00 H new ATOM 0 HG SER A 53 -28.551 0.611 -0.519 1.00 0.00 H new ATOM 806 N GLU A 54 -26.318 -2.293 -0.868 1.00 0.00 N ATOM 807 CA GLU A 54 -25.796 -3.204 -1.881 1.00 0.00 C ATOM 808 C GLU A 54 -25.019 -4.343 -1.239 1.00 0.00 C ATOM 809 O GLU A 54 -25.118 -5.494 -1.671 1.00 0.00 O ATOM 810 CB GLU A 54 -24.871 -2.444 -2.839 1.00 0.00 C ATOM 811 CG GLU A 54 -24.468 -3.362 -3.997 1.00 0.00 C ATOM 812 CD GLU A 54 -23.574 -2.606 -4.978 1.00 0.00 C ATOM 813 OE1 GLU A 54 -22.618 -1.997 -4.529 1.00 0.00 O ATOM 814 OE2 GLU A 54 -23.866 -2.644 -6.162 1.00 0.00 O ATOM 0 H GLU A 54 -26.027 -1.322 -0.978 1.00 0.00 H new ATOM 0 HA GLU A 54 -26.641 -3.619 -2.430 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.376 -1.558 -3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -23.983 -2.100 -2.308 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -23.942 -4.236 -3.613 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -25.358 -3.726 -4.510 1.00 0.00 H new ATOM 821 N VAL A 55 -24.244 -4.022 -0.209 1.00 0.00 N ATOM 822 CA VAL A 55 -23.449 -5.030 0.485 1.00 0.00 C ATOM 823 C VAL A 55 -24.197 -5.588 1.693 1.00 0.00 C ATOM 824 O VAL A 55 -23.731 -6.528 2.338 1.00 0.00 O ATOM 825 CB VAL A 55 -22.117 -4.419 0.932 1.00 0.00 C ATOM 826 CG1 VAL A 55 -21.270 -5.487 1.627 1.00 0.00 C ATOM 827 CG2 VAL A 55 -21.367 -3.886 -0.294 1.00 0.00 C ATOM 0 H VAL A 55 -24.149 -3.077 0.163 1.00 0.00 H new ATOM 0 HA VAL A 55 -23.261 -5.852 -0.205 1.00 0.00 H new ATOM 0 HB VAL A 55 -22.306 -3.601 1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -20.323 -5.051 1.944 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -21.805 -5.866 2.498 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -21.078 -6.307 0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -20.419 -3.450 0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -21.178 -4.704 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -21.971 -3.124 -0.787 1.00 0.00 H new ATOM 837 N ASP A 56 -25.351 -5.006 1.989 1.00 0.00 N ATOM 838 CA ASP A 56 -26.151 -5.454 3.125 1.00 0.00 C ATOM 839 C ASP A 56 -26.896 -6.731 2.759 1.00 0.00 C ATOM 840 O ASP A 56 -27.952 -6.691 2.126 1.00 0.00 O ATOM 841 CB ASP A 56 -27.153 -4.371 3.517 1.00 0.00 C ATOM 842 CG ASP A 56 -27.736 -4.671 4.886 1.00 0.00 C ATOM 843 OD1 ASP A 56 -27.389 -5.701 5.434 1.00 0.00 O ATOM 844 OD2 ASP A 56 -28.510 -3.864 5.372 1.00 0.00 O ATOM 0 H ASP A 56 -25.753 -4.229 1.465 1.00 0.00 H new ATOM 0 HA ASP A 56 -25.489 -5.651 3.968 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -26.663 -3.398 3.527 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -27.951 -4.318 2.777 1.00 0.00 H new ATOM 849 N ALA A 57 -26.340 -7.869 3.160 1.00 0.00 N ATOM 850 CA ALA A 57 -26.958 -9.163 2.875 1.00 0.00 C ATOM 851 C ALA A 57 -27.919 -9.566 3.981 1.00 0.00 C ATOM 852 O ALA A 57 -28.498 -10.653 3.946 1.00 0.00 O ATOM 853 CB ALA A 57 -25.876 -10.231 2.720 1.00 0.00 C ATOM 0 H ALA A 57 -25.465 -7.924 3.682 1.00 0.00 H new ATOM 0 HA ALA A 57 -27.521 -9.074 1.946 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -26.342 -11.193 2.508 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -25.213 -9.960 1.899 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -25.300 -10.302 3.643 1.00 0.00 H new ATOM 859 N ASP A 58 -28.078 -8.697 4.975 1.00 0.00 N ATOM 860 CA ASP A 58 -28.973 -8.976 6.101 1.00 0.00 C ATOM 861 C ASP A 58 -29.929 -7.814 6.332 1.00 0.00 C ATOM 862 O ASP A 58 -30.592 -7.743 7.367 1.00 0.00 O ATOM 863 CB ASP A 58 -28.145 -9.229 7.363 1.00 0.00 C ATOM 864 CG ASP A 58 -27.320 -7.997 7.706 1.00 0.00 C ATOM 865 OD1 ASP A 58 -27.757 -6.913 7.382 1.00 0.00 O ATOM 866 OD2 ASP A 58 -26.255 -8.157 8.274 1.00 0.00 O ATOM 0 H ASP A 58 -27.602 -7.796 5.027 1.00 0.00 H new ATOM 0 HA ASP A 58 -29.562 -9.863 5.867 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -28.804 -9.478 8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -27.488 -10.085 7.210 1.00 0.00 H new ATOM 871 N GLY A 59 -29.992 -6.900 5.369 1.00 0.00 N ATOM 872 CA GLY A 59 -30.866 -5.739 5.487 1.00 0.00 C ATOM 873 C GLY A 59 -30.830 -5.163 6.896 1.00 0.00 C ATOM 874 O GLY A 59 -31.872 -4.897 7.495 1.00 0.00 O ATOM 0 H GLY A 59 -29.452 -6.940 4.504 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -30.560 -4.976 4.772 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -31.887 -6.022 5.233 1.00 0.00 H new ATOM 878 N ASN A 60 -29.624 -4.983 7.430 1.00 0.00 N ATOM 879 CA ASN A 60 -29.465 -4.441 8.782 1.00 0.00 C ATOM 880 C ASN A 60 -28.915 -3.020 8.719 1.00 0.00 C ATOM 881 O ASN A 60 -28.491 -2.467 9.732 1.00 0.00 O ATOM 882 CB ASN A 60 -28.509 -5.325 9.590 1.00 0.00 C ATOM 883 CG ASN A 60 -27.076 -5.134 9.107 1.00 0.00 C ATOM 884 OD1 ASN A 60 -26.854 -4.499 8.079 1.00 0.00 O ATOM 885 ND2 ASN A 60 -26.090 -5.647 9.790 1.00 0.00 N ATOM 0 H ASN A 60 -28.749 -5.201 6.954 1.00 0.00 H new ATOM 0 HA ASN A 60 -30.440 -4.424 9.268 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -28.579 -5.075 10.649 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -28.798 -6.371 9.489 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.129 -5.522 9.471 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.280 -6.173 10.643 1.00 0.00 H new ATOM 892 N GLY A 61 -28.924 -2.436 7.523 1.00 0.00 N ATOM 893 CA GLY A 61 -28.425 -1.074 7.346 1.00 0.00 C ATOM 894 C GLY A 61 -27.123 -0.875 8.103 1.00 0.00 C ATOM 895 O GLY A 61 -26.709 0.256 8.354 1.00 0.00 O ATOM 0 H GLY A 61 -29.267 -2.878 6.670 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -28.269 -0.874 6.286 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -29.169 -0.360 7.699 1.00 0.00 H new ATOM 899 N THR A 62 -26.477 -1.982 8.469 1.00 0.00 N ATOM 900 CA THR A 62 -25.219 -1.919 9.204 1.00 0.00 C ATOM 901 C THR A 62 -24.223 -2.930 8.669 1.00 0.00 C ATOM 902 O THR A 62 -24.576 -4.071 8.368 1.00 0.00 O ATOM 903 CB THR A 62 -25.480 -2.194 10.693 1.00 0.00 C ATOM 904 OG1 THR A 62 -26.361 -3.301 10.823 1.00 0.00 O ATOM 905 CG2 THR A 62 -26.111 -0.958 11.358 1.00 0.00 C ATOM 0 H THR A 62 -26.804 -2.927 8.269 1.00 0.00 H new ATOM 0 HA THR A 62 -24.797 -0.922 9.078 1.00 0.00 H new ATOM 0 HB THR A 62 -24.533 -2.418 11.184 1.00 0.00 H new ATOM 0 HG1 THR A 62 -27.284 -3.003 10.683 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.291 -1.165 12.413 1.00 0.00 H new ATOM 0 HG22 THR A 62 -25.433 -0.109 11.265 1.00 0.00 H new ATOM 0 HG23 THR A 62 -27.056 -0.723 10.868 1.00 0.00 H new ATOM 913 N ILE A 63 -22.965 -2.512 8.558 1.00 0.00 N ATOM 914 CA ILE A 63 -21.925 -3.400 8.065 1.00 0.00 C ATOM 915 C ILE A 63 -21.161 -4.027 9.224 1.00 0.00 C ATOM 916 O ILE A 63 -20.615 -3.320 10.080 1.00 0.00 O ATOM 917 CB ILE A 63 -20.946 -2.615 7.190 1.00 0.00 C ATOM 918 CG1 ILE A 63 -21.700 -1.986 6.013 1.00 0.00 C ATOM 919 CG2 ILE A 63 -19.863 -3.550 6.644 1.00 0.00 C ATOM 920 CD1 ILE A 63 -20.774 -1.023 5.256 1.00 0.00 C ATOM 0 H ILE A 63 -22.647 -1.574 8.801 1.00 0.00 H new ATOM 0 HA ILE A 63 -22.397 -4.189 7.480 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.482 -1.835 7.794 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -22.057 -2.765 5.340 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -22.578 -1.451 6.376 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -19.171 -2.982 6.022 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.319 -4.000 7.474 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -20.327 -4.334 6.046 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -21.315 -0.579 4.421 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -20.438 -0.235 5.931 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -19.910 -1.570 4.879 1.00 0.00 H new ATOM 932 N GLU A 64 -21.123 -5.357 9.243 1.00 0.00 N ATOM 933 CA GLU A 64 -20.413 -6.082 10.293 1.00 0.00 C ATOM 934 C GLU A 64 -18.945 -6.248 9.922 1.00 0.00 C ATOM 935 O GLU A 64 -18.553 -5.993 8.785 1.00 0.00 O ATOM 936 CB GLU A 64 -21.047 -7.456 10.507 1.00 0.00 C ATOM 937 CG GLU A 64 -22.442 -7.286 11.105 1.00 0.00 C ATOM 938 CD GLU A 64 -23.125 -8.643 11.229 1.00 0.00 C ATOM 939 OE1 GLU A 64 -22.474 -9.638 10.956 1.00 0.00 O ATOM 940 OE2 GLU A 64 -24.287 -8.668 11.598 1.00 0.00 O ATOM 0 H GLU A 64 -21.573 -5.952 8.547 1.00 0.00 H new ATOM 0 HA GLU A 64 -20.483 -5.508 11.217 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -21.109 -7.991 9.560 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -20.425 -8.056 11.172 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -22.371 -6.814 12.085 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -23.038 -6.626 10.476 1.00 0.00 H new ATOM 947 N PHE A 65 -18.136 -6.669 10.886 1.00 0.00 N ATOM 948 CA PHE A 65 -16.708 -6.854 10.645 1.00 0.00 C ATOM 949 C PHE A 65 -16.483 -7.757 9.435 1.00 0.00 C ATOM 950 O PHE A 65 -15.680 -7.440 8.557 1.00 0.00 O ATOM 951 CB PHE A 65 -16.053 -7.483 11.878 1.00 0.00 C ATOM 952 CG PHE A 65 -14.599 -7.779 11.584 1.00 0.00 C ATOM 953 CD1 PHE A 65 -13.679 -6.729 11.480 1.00 0.00 C ATOM 954 CD2 PHE A 65 -14.173 -9.102 11.410 1.00 0.00 C ATOM 955 CE1 PHE A 65 -12.336 -7.001 11.202 1.00 0.00 C ATOM 956 CE2 PHE A 65 -12.831 -9.375 11.133 1.00 0.00 C ATOM 957 CZ PHE A 65 -11.912 -8.324 11.030 1.00 0.00 C ATOM 0 H PHE A 65 -18.439 -6.888 11.835 1.00 0.00 H new ATOM 0 HA PHE A 65 -16.260 -5.880 10.448 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -16.132 -6.807 12.729 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -16.574 -8.401 12.151 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -14.007 -5.709 11.615 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -14.883 -9.912 11.490 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -11.626 -6.191 11.120 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -12.503 -10.395 10.999 1.00 0.00 H new ATOM 0 HZ PHE A 65 -10.874 -8.534 10.817 1.00 0.00 H new ATOM 967 N ASP A 66 -17.196 -8.875 9.393 1.00 0.00 N ATOM 968 CA ASP A 66 -17.059 -9.810 8.284 1.00 0.00 C ATOM 969 C ASP A 66 -17.403 -9.124 6.964 1.00 0.00 C ATOM 970 O ASP A 66 -16.749 -9.354 5.937 1.00 0.00 O ATOM 971 CB ASP A 66 -17.987 -11.010 8.499 1.00 0.00 C ATOM 972 CG ASP A 66 -17.620 -12.134 7.535 1.00 0.00 C ATOM 973 OD1 ASP A 66 -16.534 -12.086 6.987 1.00 0.00 O ATOM 974 OD2 ASP A 66 -18.433 -13.027 7.363 1.00 0.00 O ATOM 0 H ASP A 66 -17.869 -9.155 10.107 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.025 -10.154 8.243 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.907 -11.362 9.528 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -19.024 -10.711 8.344 1.00 0.00 H new ATOM 979 N GLU A 67 -18.431 -8.277 6.993 1.00 0.00 N ATOM 980 CA GLU A 67 -18.850 -7.560 5.795 1.00 0.00 C ATOM 981 C GLU A 67 -17.851 -6.454 5.454 1.00 0.00 C ATOM 982 O GLU A 67 -17.427 -6.319 4.308 1.00 0.00 O ATOM 983 CB GLU A 67 -20.236 -6.959 6.005 1.00 0.00 C ATOM 984 CG GLU A 67 -21.265 -8.079 6.150 1.00 0.00 C ATOM 985 CD GLU A 67 -22.650 -7.483 6.390 1.00 0.00 C ATOM 986 OE1 GLU A 67 -22.765 -6.272 6.326 1.00 0.00 O ATOM 987 OE2 GLU A 67 -23.572 -8.242 6.640 1.00 0.00 O ATOM 0 H GLU A 67 -18.983 -8.073 7.826 1.00 0.00 H new ATOM 0 HA GLU A 67 -18.886 -8.265 4.965 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -20.240 -6.331 6.896 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -20.497 -6.319 5.162 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -21.275 -8.694 5.250 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.991 -8.731 6.979 1.00 0.00 H new ATOM 994 N PHE A 68 -17.474 -5.672 6.463 1.00 0.00 N ATOM 995 CA PHE A 68 -16.524 -4.588 6.263 1.00 0.00 C ATOM 996 C PHE A 68 -15.222 -5.135 5.689 1.00 0.00 C ATOM 997 O PHE A 68 -14.653 -4.561 4.759 1.00 0.00 O ATOM 998 CB PHE A 68 -16.246 -3.883 7.595 1.00 0.00 C ATOM 999 CG PHE A 68 -15.171 -2.841 7.400 1.00 0.00 C ATOM 1000 CD1 PHE A 68 -15.485 -1.613 6.806 1.00 0.00 C ATOM 1001 CD2 PHE A 68 -13.860 -3.106 7.812 1.00 0.00 C ATOM 1002 CE1 PHE A 68 -14.486 -0.650 6.624 1.00 0.00 C ATOM 1003 CE2 PHE A 68 -12.862 -2.143 7.630 1.00 0.00 C ATOM 1004 CZ PHE A 68 -13.175 -0.914 7.037 1.00 0.00 C ATOM 0 H PHE A 68 -17.811 -5.770 7.421 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.950 -3.871 5.561 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -17.157 -3.415 7.968 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -15.931 -4.609 8.344 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.497 -1.409 6.489 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -13.619 -4.054 8.270 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -14.727 0.297 6.165 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -11.850 -2.348 7.947 1.00 0.00 H new ATOM 0 HZ PHE A 68 -12.405 -0.170 6.898 1.00 0.00 H new ATOM 1014 N LEU A 69 -14.749 -6.245 6.251 1.00 0.00 N ATOM 1015 CA LEU A 69 -13.504 -6.844 5.783 1.00 0.00 C ATOM 1016 C LEU A 69 -13.613 -7.182 4.295 1.00 0.00 C ATOM 1017 O LEU A 69 -12.824 -6.707 3.481 1.00 0.00 O ATOM 1018 CB LEU A 69 -13.222 -8.127 6.585 1.00 0.00 C ATOM 1019 CG LEU A 69 -11.714 -8.384 6.628 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -11.437 -9.664 7.410 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -11.176 -8.524 5.199 1.00 0.00 C ATOM 0 H LEU A 69 -15.201 -6.741 7.019 1.00 0.00 H new ATOM 0 HA LEU A 69 -12.688 -6.136 5.927 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -13.613 -8.028 7.598 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.733 -8.974 6.127 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.217 -7.547 7.119 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.363 -9.847 7.440 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.816 -9.559 8.427 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.934 -10.503 6.923 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.102 -8.707 5.231 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.672 -9.359 4.704 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.371 -7.606 4.645 1.00 0.00 H new ATOM 1033 N SER A 70 -14.608 -8.001 3.949 1.00 0.00 N ATOM 1034 CA SER A 70 -14.810 -8.384 2.557 1.00 0.00 C ATOM 1035 C SER A 70 -15.072 -7.150 1.705 1.00 0.00 C ATOM 1036 O SER A 70 -14.566 -7.029 0.591 1.00 0.00 O ATOM 1037 CB SER A 70 -15.993 -9.343 2.446 1.00 0.00 C ATOM 1038 OG SER A 70 -15.733 -10.497 3.233 1.00 0.00 O ATOM 0 H SER A 70 -15.276 -8.405 4.605 1.00 0.00 H new ATOM 0 HA SER A 70 -13.909 -8.881 2.197 1.00 0.00 H new ATOM 0 HB2 SER A 70 -16.906 -8.854 2.786 1.00 0.00 H new ATOM 0 HB3 SER A 70 -16.151 -9.626 1.405 1.00 0.00 H new ATOM 0 HG SER A 70 -15.997 -10.326 4.161 1.00 0.00 H new ATOM 1044 N LEU A 71 -15.874 -6.234 2.229 1.00 0.00 N ATOM 1045 CA LEU A 71 -16.201 -5.026 1.496 1.00 0.00 C ATOM 1046 C LEU A 71 -14.938 -4.370 0.951 1.00 0.00 C ATOM 1047 O LEU A 71 -14.811 -4.151 -0.252 1.00 0.00 O ATOM 1048 CB LEU A 71 -16.918 -4.043 2.430 1.00 0.00 C ATOM 1049 CG LEU A 71 -17.324 -2.769 1.638 1.00 0.00 C ATOM 1050 CD1 LEU A 71 -18.667 -2.248 2.156 1.00 0.00 C ATOM 1051 CD2 LEU A 71 -16.258 -1.676 1.816 1.00 0.00 C ATOM 0 H LEU A 71 -16.305 -6.305 3.151 1.00 0.00 H new ATOM 0 HA LEU A 71 -16.849 -5.289 0.660 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -17.803 -4.514 2.859 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -16.266 -3.774 3.261 1.00 0.00 H new ATOM 0 HG LEU A 71 -17.409 -3.023 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -18.950 -1.355 1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -19.430 -3.015 2.024 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -18.578 -2.003 3.214 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -16.551 -0.787 1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -16.166 -1.426 2.873 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -15.300 -2.038 1.444 1.00 0.00 H new ATOM 1063 N MET A 72 -14.013 -4.036 1.842 1.00 0.00 N ATOM 1064 CA MET A 72 -12.769 -3.392 1.432 1.00 0.00 C ATOM 1065 C MET A 72 -11.877 -4.357 0.667 1.00 0.00 C ATOM 1066 O MET A 72 -11.270 -3.987 -0.337 1.00 0.00 O ATOM 1067 CB MET A 72 -12.025 -2.866 2.672 1.00 0.00 C ATOM 1068 CG MET A 72 -12.615 -1.511 3.103 1.00 0.00 C ATOM 1069 SD MET A 72 -11.690 -0.169 2.301 1.00 0.00 S ATOM 1070 CE MET A 72 -13.069 0.543 1.372 1.00 0.00 C ATOM 0 H MET A 72 -14.098 -4.198 2.845 1.00 0.00 H new ATOM 0 HA MET A 72 -13.016 -2.561 0.771 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.107 -3.584 3.488 1.00 0.00 H new ATOM 0 HB3 MET A 72 -10.963 -2.756 2.450 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.668 -1.456 2.828 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.562 -1.407 4.187 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.698 1.330 0.716 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.544 -0.234 0.774 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.797 0.963 2.066 1.00 0.00 H new ATOM 1080 N ALA A 73 -11.789 -5.581 1.162 1.00 0.00 N ATOM 1081 CA ALA A 73 -10.948 -6.585 0.530 1.00 0.00 C ATOM 1082 C ALA A 73 -11.386 -6.825 -0.909 1.00 0.00 C ATOM 1083 O ALA A 73 -10.552 -6.948 -1.807 1.00 0.00 O ATOM 1084 CB ALA A 73 -11.022 -7.898 1.314 1.00 0.00 C ATOM 0 H ALA A 73 -12.285 -5.902 1.993 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.921 -6.220 0.528 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.389 -8.645 0.834 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.677 -7.732 2.335 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -12.052 -8.253 1.332 1.00 0.00 H new ATOM 1090 N LYS A 74 -12.693 -6.889 -1.124 1.00 0.00 N ATOM 1091 CA LYS A 74 -13.224 -7.114 -2.456 1.00 0.00 C ATOM 1092 C LYS A 74 -13.106 -5.860 -3.310 1.00 0.00 C ATOM 1093 O LYS A 74 -12.438 -5.862 -4.344 1.00 0.00 O ATOM 1094 CB LYS A 74 -14.700 -7.532 -2.364 1.00 0.00 C ATOM 1095 CG LYS A 74 -15.105 -8.274 -3.635 1.00 0.00 C ATOM 1096 CD LYS A 74 -16.540 -8.785 -3.498 1.00 0.00 C ATOM 1097 CE LYS A 74 -16.982 -9.426 -4.813 1.00 0.00 C ATOM 1098 NZ LYS A 74 -16.134 -10.618 -5.097 1.00 0.00 N ATOM 0 H LYS A 74 -13.400 -6.789 -0.395 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.643 -7.909 -2.924 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -14.854 -8.171 -1.494 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -15.329 -6.652 -2.229 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -15.026 -7.610 -4.496 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -14.427 -9.109 -3.812 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -16.602 -9.512 -2.688 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -17.207 -7.962 -3.240 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -18.030 -9.719 -4.752 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -16.899 -8.706 -5.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -16.599 -11.212 -5.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -15.207 -10.308 -5.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -16.003 -11.167 -4.223 1.00 0.00 H new ATOM 1112 N LYS A 75 -13.760 -4.792 -2.876 1.00 0.00 N ATOM 1113 CA LYS A 75 -13.720 -3.541 -3.616 1.00 0.00 C ATOM 1114 C LYS A 75 -12.409 -2.812 -3.374 1.00 0.00 C ATOM 1115 O LYS A 75 -12.049 -2.516 -2.236 1.00 0.00 O ATOM 1116 CB LYS A 75 -14.894 -2.643 -3.185 1.00 0.00 C ATOM 1117 CG LYS A 75 -16.143 -2.986 -4.002 1.00 0.00 C ATOM 1118 CD LYS A 75 -16.562 -4.427 -3.710 1.00 0.00 C ATOM 1119 CE LYS A 75 -17.892 -4.720 -4.401 1.00 0.00 C ATOM 1120 NZ LYS A 75 -18.948 -3.832 -3.839 1.00 0.00 N ATOM 0 H LYS A 75 -14.319 -4.767 -2.023 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.802 -3.768 -4.679 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -15.096 -2.779 -2.122 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -14.632 -1.595 -3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -16.954 -2.302 -3.751 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.940 -2.863 -5.066 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -15.797 -5.118 -4.063 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -16.657 -4.579 -2.635 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -17.800 -4.559 -5.475 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -18.166 -5.765 -4.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -19.881 -4.270 -3.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -18.780 -3.694 -2.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -18.921 -2.912 -4.323 1.00 0.00 H new ATOM 1134 N VAL A 76 -11.707 -2.506 -4.454 1.00 0.00 N ATOM 1135 CA VAL A 76 -10.440 -1.789 -4.354 1.00 0.00 C ATOM 1136 C VAL A 76 -10.307 -0.788 -5.495 1.00 0.00 C ATOM 1137 O VAL A 76 -11.159 0.086 -5.655 1.00 0.00 O ATOM 1138 CB VAL A 76 -9.274 -2.775 -4.398 1.00 0.00 C ATOM 1139 CG1 VAL A 76 -7.975 -2.055 -3.990 1.00 0.00 C ATOM 1140 CG2 VAL A 76 -9.545 -3.923 -3.427 1.00 0.00 C ATOM 0 H VAL A 76 -11.989 -2.740 -5.406 1.00 0.00 H new ATOM 0 HA VAL A 76 -10.420 -1.251 -3.406 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.168 -3.168 -5.409 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.143 -2.759 -4.022 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.782 -1.234 -4.680 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.079 -1.662 -2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.714 -4.628 -3.456 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.650 -3.528 -2.417 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.464 -4.433 -3.714 1.00 0.00 H new ATOM 1150 N LYS A 77 -9.230 -0.914 -6.280 1.00 0.00 N ATOM 1151 CA LYS A 77 -8.988 -0.012 -7.399 1.00 0.00 C ATOM 1152 C LYS A 77 -10.304 0.422 -8.031 1.00 0.00 C ATOM 1153 O LYS A 77 -11.272 -0.341 -8.040 1.00 0.00 O ATOM 1154 CB LYS A 77 -8.123 -0.713 -8.447 1.00 0.00 C ATOM 1155 CG LYS A 77 -7.501 0.328 -9.378 1.00 0.00 C ATOM 1156 CD LYS A 77 -6.489 -0.348 -10.301 1.00 0.00 C ATOM 1157 CE LYS A 77 -7.216 -1.280 -11.274 1.00 0.00 C ATOM 1158 NZ LYS A 77 -6.316 -1.611 -12.410 1.00 0.00 N ATOM 0 H LYS A 77 -8.517 -1.633 -6.156 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.470 0.872 -7.028 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -7.340 -1.293 -7.958 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -8.727 -1.415 -9.022 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -8.278 0.813 -9.968 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -7.011 1.107 -8.793 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -5.928 0.405 -10.855 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.767 -0.914 -9.712 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.522 -2.192 -10.761 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -8.124 -0.802 -11.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.810 -2.244 -13.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.045 -0.737 -12.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.462 -2.084 -12.050 1.00 0.00 H new ATOM 1172 N ASP A 78 -10.341 1.649 -8.532 1.00 0.00 N ATOM 1173 CA ASP A 78 -11.556 2.181 -9.145 1.00 0.00 C ATOM 1174 C ASP A 78 -11.246 2.778 -10.506 1.00 0.00 C ATOM 1175 O ASP A 78 -11.995 3.613 -10.999 1.00 0.00 O ATOM 1176 CB ASP A 78 -12.167 3.249 -8.239 1.00 0.00 C ATOM 1177 CG ASP A 78 -12.776 2.598 -7.000 1.00 0.00 C ATOM 1178 OD1 ASP A 78 -13.044 1.409 -7.049 1.00 0.00 O ATOM 1179 OD2 ASP A 78 -12.969 3.301 -6.022 1.00 0.00 O ATOM 0 H ASP A 78 -9.550 2.293 -8.528 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.268 1.366 -9.275 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -11.402 3.967 -7.944 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.933 3.803 -8.782 1.00 0.00 H new ATOM 1184 N THR A 79 -10.140 2.346 -11.103 1.00 0.00 N ATOM 1185 CA THR A 79 -9.740 2.845 -12.414 1.00 0.00 C ATOM 1186 C THR A 79 -9.522 4.351 -12.374 1.00 0.00 C ATOM 1187 O THR A 79 -10.263 5.111 -12.995 1.00 0.00 O ATOM 1188 CB THR A 79 -10.819 2.510 -13.448 1.00 0.00 C ATOM 1189 OG1 THR A 79 -11.933 3.372 -13.277 1.00 0.00 O ATOM 1190 CG2 THR A 79 -11.266 1.058 -13.274 1.00 0.00 C ATOM 0 H THR A 79 -9.507 1.654 -10.702 1.00 0.00 H new ATOM 0 HA THR A 79 -8.803 2.364 -12.694 1.00 0.00 H new ATOM 0 HB THR A 79 -10.409 2.646 -14.449 1.00 0.00 H new ATOM 0 HG1 THR A 79 -11.702 4.083 -12.643 1.00 0.00 H new ATOM 0 HG21 THR A 79 -12.034 0.823 -14.011 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.412 0.395 -13.415 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.671 0.920 -12.272 1.00 0.00 H new ATOM 1198 N ASP A 80 -8.500 4.777 -11.639 1.00 0.00 N ATOM 1199 CA ASP A 80 -8.187 6.200 -11.525 1.00 0.00 C ATOM 1200 C ASP A 80 -6.697 6.401 -11.270 1.00 0.00 C ATOM 1201 O ASP A 80 -6.199 6.122 -10.176 1.00 0.00 O ATOM 1202 CB ASP A 80 -8.995 6.820 -10.389 1.00 0.00 C ATOM 1203 CG ASP A 80 -10.470 6.879 -10.767 1.00 0.00 C ATOM 1204 OD1 ASP A 80 -10.756 7.198 -11.909 1.00 0.00 O ATOM 1205 OD2 ASP A 80 -11.293 6.611 -9.906 1.00 0.00 O ATOM 0 H ASP A 80 -7.877 4.162 -11.115 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.449 6.690 -12.463 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -8.868 6.233 -9.479 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.626 7.823 -10.175 1.00 0.00 H new ATOM 1210 N ALA A 81 -5.988 6.882 -12.285 1.00 0.00 N ATOM 1211 CA ALA A 81 -4.555 7.112 -12.159 1.00 0.00 C ATOM 1212 C ALA A 81 -4.274 8.323 -11.278 1.00 0.00 C ATOM 1213 O ALA A 81 -3.546 8.233 -10.295 1.00 0.00 O ATOM 1214 CB ALA A 81 -3.940 7.337 -13.541 1.00 0.00 C ATOM 0 H ALA A 81 -6.379 7.118 -13.197 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.109 6.232 -11.696 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.868 7.508 -13.439 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.109 6.457 -14.162 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.403 8.206 -14.008 1.00 0.00 H new ATOM 1220 N GLU A 82 -4.853 9.456 -11.638 1.00 0.00 N ATOM 1221 CA GLU A 82 -4.650 10.680 -10.877 1.00 0.00 C ATOM 1222 C GLU A 82 -4.966 10.461 -9.399 1.00 0.00 C ATOM 1223 O GLU A 82 -4.467 11.188 -8.529 1.00 0.00 O ATOM 1224 CB GLU A 82 -5.551 11.792 -11.430 1.00 0.00 C ATOM 1225 CG GLU A 82 -5.343 13.079 -10.615 1.00 0.00 C ATOM 1226 CD GLU A 82 -6.196 13.046 -9.347 1.00 0.00 C ATOM 1227 OE1 GLU A 82 -7.299 12.531 -9.412 1.00 0.00 O ATOM 1228 OE2 GLU A 82 -5.730 13.527 -8.331 1.00 0.00 O ATOM 0 H GLU A 82 -5.465 9.555 -12.448 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.604 10.971 -10.972 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.319 11.973 -12.480 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.596 11.485 -11.383 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.291 13.185 -10.351 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.609 13.947 -11.218 1.00 0.00 H new ATOM 1235 N GLU A 83 -5.783 9.454 -9.120 1.00 0.00 N ATOM 1236 CA GLU A 83 -6.161 9.149 -7.745 1.00 0.00 C ATOM 1237 C GLU A 83 -5.080 8.335 -7.048 1.00 0.00 C ATOM 1238 O GLU A 83 -4.612 8.702 -5.970 1.00 0.00 O ATOM 1239 CB GLU A 83 -7.481 8.379 -7.729 1.00 0.00 C ATOM 1240 CG GLU A 83 -7.920 8.138 -6.285 1.00 0.00 C ATOM 1241 CD GLU A 83 -9.273 7.435 -6.259 1.00 0.00 C ATOM 1242 OE1 GLU A 83 -9.436 6.480 -7.000 1.00 0.00 O ATOM 1243 OE2 GLU A 83 -10.127 7.865 -5.502 1.00 0.00 O ATOM 0 H GLU A 83 -6.195 8.838 -9.821 1.00 0.00 H new ATOM 0 HA GLU A 83 -6.281 10.089 -7.207 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.247 8.941 -8.263 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.364 7.427 -8.247 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.177 7.532 -5.767 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.984 9.087 -5.753 1.00 0.00 H new ATOM 1250 N GLU A 84 -4.693 7.226 -7.666 1.00 0.00 N ATOM 1251 CA GLU A 84 -3.669 6.364 -7.093 1.00 0.00 C ATOM 1252 C GLU A 84 -2.303 7.029 -7.186 1.00 0.00 C ATOM 1253 O GLU A 84 -1.461 6.867 -6.311 1.00 0.00 O ATOM 1254 CB GLU A 84 -3.641 5.024 -7.830 1.00 0.00 C ATOM 1255 CG GLU A 84 -2.642 4.084 -7.149 1.00 0.00 C ATOM 1256 CD GLU A 84 -2.628 2.735 -7.858 1.00 0.00 C ATOM 1257 OE1 GLU A 84 -3.232 2.636 -8.913 1.00 0.00 O ATOM 1258 OE2 GLU A 84 -2.021 1.817 -7.330 1.00 0.00 O ATOM 0 H GLU A 84 -5.070 6.905 -8.558 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.907 6.193 -6.043 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.635 4.577 -7.830 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.360 5.176 -8.872 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.645 4.524 -7.168 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.912 3.951 -6.101 1.00 0.00 H new ATOM 1265 N LEU A 85 -2.081 7.768 -8.259 1.00 0.00 N ATOM 1266 CA LEU A 85 -0.811 8.446 -8.458 1.00 0.00 C ATOM 1267 C LEU A 85 -0.597 9.537 -7.426 1.00 0.00 C ATOM 1268 O LEU A 85 0.519 9.703 -6.893 1.00 0.00 O ATOM 1269 CB LEU A 85 -0.760 9.060 -9.867 1.00 0.00 C ATOM 1270 CG LEU A 85 -0.667 7.945 -10.917 1.00 0.00 C ATOM 1271 CD1 LEU A 85 -0.770 8.551 -12.320 1.00 0.00 C ATOM 1272 CD2 LEU A 85 0.676 7.200 -10.774 1.00 0.00 C ATOM 0 H LEU A 85 -2.762 7.914 -9.005 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.018 7.707 -8.346 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.650 9.664 -10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.099 9.725 -9.953 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.485 7.241 -10.764 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.704 7.758 -13.065 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.724 9.068 -12.424 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.045 9.259 -12.471 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.735 6.410 -11.522 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.498 7.901 -10.920 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.745 6.762 -9.778 1.00 0.00 H new ATOM 1284 N LYS A 86 -1.661 10.279 -7.133 1.00 0.00 N ATOM 1285 CA LYS A 86 -1.570 11.358 -6.155 1.00 0.00 C ATOM 1286 C LYS A 86 -1.743 10.832 -4.736 1.00 0.00 C ATOM 1287 O LYS A 86 -0.977 11.181 -3.842 1.00 0.00 O ATOM 1288 CB LYS A 86 -2.649 12.400 -6.456 1.00 0.00 C ATOM 1289 CG LYS A 86 -2.476 12.922 -7.889 1.00 0.00 C ATOM 1290 CD LYS A 86 -1.351 13.961 -7.937 1.00 0.00 C ATOM 1291 CE LYS A 86 -1.287 14.585 -9.327 1.00 0.00 C ATOM 1292 NZ LYS A 86 -2.458 15.486 -9.519 1.00 0.00 N ATOM 0 H LYS A 86 -2.583 10.156 -7.552 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.581 11.811 -6.227 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.638 11.959 -6.336 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.580 13.225 -5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.247 12.095 -8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.408 13.367 -8.238 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.525 14.734 -7.188 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.398 13.491 -7.695 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -0.360 15.146 -9.444 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.286 13.805 -10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.013 15.164 -10.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.054 15.466 -8.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.125 16.457 -9.686 1.00 0.00 H new ATOM 1306 N GLU A 87 -2.755 9.995 -4.541 1.00 0.00 N ATOM 1307 CA GLU A 87 -3.019 9.430 -3.225 1.00 0.00 C ATOM 1308 C GLU A 87 -1.801 8.649 -2.736 1.00 0.00 C ATOM 1309 O GLU A 87 -1.417 8.745 -1.569 1.00 0.00 O ATOM 1310 CB GLU A 87 -4.234 8.499 -3.292 1.00 0.00 C ATOM 1311 CG GLU A 87 -4.559 7.981 -1.889 1.00 0.00 C ATOM 1312 CD GLU A 87 -5.808 7.108 -1.932 1.00 0.00 C ATOM 1313 OE1 GLU A 87 -6.483 7.122 -2.948 1.00 0.00 O ATOM 1314 OE2 GLU A 87 -6.067 6.431 -0.950 1.00 0.00 O ATOM 0 H GLU A 87 -3.401 9.695 -5.271 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.225 10.242 -2.528 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -5.092 9.032 -3.702 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.029 7.663 -3.961 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.718 7.407 -1.500 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.714 8.819 -1.210 1.00 0.00 H new ATOM 1321 N ALA A 88 -1.191 7.880 -3.639 1.00 0.00 N ATOM 1322 CA ALA A 88 -0.016 7.089 -3.279 1.00 0.00 C ATOM 1323 C ALA A 88 1.134 8.006 -2.890 1.00 0.00 C ATOM 1324 O ALA A 88 1.675 7.911 -1.785 1.00 0.00 O ATOM 1325 CB ALA A 88 0.396 6.208 -4.456 1.00 0.00 C ATOM 0 H ALA A 88 -1.486 7.789 -4.611 1.00 0.00 H new ATOM 0 HA ALA A 88 -0.264 6.455 -2.428 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.272 5.621 -4.182 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.424 5.538 -4.713 1.00 0.00 H new ATOM 0 HB3 ALA A 88 0.634 6.836 -5.315 1.00 0.00 H new ATOM 1331 N PHE A 89 1.501 8.911 -3.800 1.00 0.00 N ATOM 1332 CA PHE A 89 2.584 9.849 -3.525 1.00 0.00 C ATOM 1333 C PHE A 89 2.281 10.652 -2.263 1.00 0.00 C ATOM 1334 O PHE A 89 3.167 10.906 -1.447 1.00 0.00 O ATOM 1335 CB PHE A 89 2.756 10.803 -4.713 1.00 0.00 C ATOM 1336 CG PHE A 89 3.719 11.908 -4.343 1.00 0.00 C ATOM 1337 CD1 PHE A 89 5.093 11.739 -4.539 1.00 0.00 C ATOM 1338 CD2 PHE A 89 3.230 13.103 -3.798 1.00 0.00 C ATOM 1339 CE1 PHE A 89 5.979 12.763 -4.191 1.00 0.00 C ATOM 1340 CE2 PHE A 89 4.117 14.126 -3.448 1.00 0.00 C ATOM 1341 CZ PHE A 89 5.490 13.957 -3.646 1.00 0.00 C ATOM 0 H PHE A 89 1.070 9.012 -4.719 1.00 0.00 H new ATOM 0 HA PHE A 89 3.506 9.287 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.129 10.257 -5.579 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.792 11.227 -4.994 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.470 10.818 -4.959 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.168 13.234 -3.648 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.040 12.633 -4.342 1.00 0.00 H new ATOM 0 HE2 PHE A 89 3.741 15.046 -3.025 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.175 14.748 -3.378 1.00 0.00 H new ATOM 1351 N LYS A 90 1.027 11.066 -2.117 1.00 0.00 N ATOM 1352 CA LYS A 90 0.625 11.859 -0.961 1.00 0.00 C ATOM 1353 C LYS A 90 0.950 11.115 0.329 1.00 0.00 C ATOM 1354 O LYS A 90 1.338 11.726 1.326 1.00 0.00 O ATOM 1355 CB LYS A 90 -0.878 12.146 -1.022 1.00 0.00 C ATOM 1356 CG LYS A 90 -1.260 13.114 0.099 1.00 0.00 C ATOM 1357 CD LYS A 90 -2.745 13.464 -0.009 1.00 0.00 C ATOM 1358 CE LYS A 90 -3.122 14.442 1.103 1.00 0.00 C ATOM 1359 NZ LYS A 90 -2.341 15.701 0.940 1.00 0.00 N ATOM 0 H LYS A 90 0.277 10.868 -2.779 1.00 0.00 H new ATOM 0 HA LYS A 90 1.174 12.800 -0.976 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.138 12.574 -1.990 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.440 11.218 -0.922 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.052 12.663 1.069 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.657 14.019 0.033 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.955 13.906 -0.983 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.349 12.560 0.068 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.190 14.656 1.067 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.918 13.998 2.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.831 16.479 1.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.394 15.578 1.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.253 15.926 -0.071 1.00 0.00 H new ATOM 1373 N VAL A 91 0.792 9.794 0.306 1.00 0.00 N ATOM 1374 CA VAL A 91 1.086 8.982 1.484 1.00 0.00 C ATOM 1375 C VAL A 91 2.592 8.856 1.692 1.00 0.00 C ATOM 1376 O VAL A 91 3.107 9.165 2.764 1.00 0.00 O ATOM 1377 CB VAL A 91 0.468 7.593 1.319 1.00 0.00 C ATOM 1378 CG1 VAL A 91 0.839 6.722 2.521 1.00 0.00 C ATOM 1379 CG2 VAL A 91 -1.064 7.722 1.229 1.00 0.00 C ATOM 0 H VAL A 91 0.466 9.268 -0.505 1.00 0.00 H new ATOM 0 HA VAL A 91 0.657 9.471 2.359 1.00 0.00 H new ATOM 0 HB VAL A 91 0.848 7.132 0.408 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.398 5.732 2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.923 6.631 2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.460 7.181 3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.506 6.733 1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.444 8.183 2.140 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.327 8.341 0.372 1.00 0.00 H new ATOM 1389 N PHE A 92 3.290 8.401 0.657 1.00 0.00 N ATOM 1390 CA PHE A 92 4.740 8.238 0.742 1.00 0.00 C ATOM 1391 C PHE A 92 5.390 9.540 1.141 1.00 0.00 C ATOM 1392 O PHE A 92 6.228 9.564 2.032 1.00 0.00 O ATOM 1393 CB PHE A 92 5.282 7.773 -0.612 1.00 0.00 C ATOM 1394 CG PHE A 92 4.453 6.615 -1.131 1.00 0.00 C ATOM 1395 CD1 PHE A 92 3.813 5.727 -0.242 1.00 0.00 C ATOM 1396 CD2 PHE A 92 4.318 6.422 -2.512 1.00 0.00 C ATOM 1397 CE1 PHE A 92 3.060 4.676 -0.726 1.00 0.00 C ATOM 1398 CE2 PHE A 92 3.557 5.352 -2.996 1.00 0.00 C ATOM 1399 CZ PHE A 92 2.928 4.480 -2.099 1.00 0.00 C ATOM 0 H PHE A 92 2.883 8.141 -0.241 1.00 0.00 H new ATOM 0 HA PHE A 92 4.971 7.489 1.499 1.00 0.00 H new ATOM 0 HB2 PHE A 92 5.258 8.597 -1.325 1.00 0.00 H new ATOM 0 HB3 PHE A 92 6.324 7.469 -0.511 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.913 5.870 0.824 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.801 7.098 -3.202 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.571 4.003 -0.037 1.00 0.00 H new ATOM 0 HE2 PHE A 92 3.455 5.199 -4.060 1.00 0.00 H new ATOM 0 HZ PHE A 92 2.340 3.655 -2.472 1.00 0.00 H new ATOM 1409 N ASP A 93 4.997 10.620 0.485 1.00 0.00 N ATOM 1410 CA ASP A 93 5.560 11.927 0.793 1.00 0.00 C ATOM 1411 C ASP A 93 4.809 12.572 1.948 1.00 0.00 C ATOM 1412 O ASP A 93 4.181 13.609 1.779 1.00 0.00 O ATOM 1413 CB ASP A 93 5.481 12.836 -0.438 1.00 0.00 C ATOM 1414 CG ASP A 93 6.419 14.032 -0.270 1.00 0.00 C ATOM 1415 OD1 ASP A 93 7.304 13.963 0.573 1.00 0.00 O ATOM 1416 OD2 ASP A 93 6.246 14.998 -0.994 1.00 0.00 O ATOM 0 H ASP A 93 4.297 10.620 -0.257 1.00 0.00 H new ATOM 0 HA ASP A 93 6.603 11.793 1.079 1.00 0.00 H new ATOM 0 HB2 ASP A 93 5.752 12.275 -1.332 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.457 13.184 -0.578 1.00 0.00 H new ATOM 1421 N LYS A 94 4.855 11.935 3.112 1.00 0.00 N ATOM 1422 CA LYS A 94 4.163 12.456 4.289 1.00 0.00 C ATOM 1423 C LYS A 94 4.310 13.972 4.378 1.00 0.00 C ATOM 1424 O LYS A 94 3.321 14.703 4.364 1.00 0.00 O ATOM 1425 CB LYS A 94 4.752 11.823 5.550 1.00 0.00 C ATOM 1426 CG LYS A 94 4.316 10.360 5.644 1.00 0.00 C ATOM 1427 CD LYS A 94 5.042 9.680 6.810 1.00 0.00 C ATOM 1428 CE LYS A 94 4.480 10.190 8.140 1.00 0.00 C ATOM 1429 NZ LYS A 94 4.918 9.294 9.241 1.00 0.00 N ATOM 0 H LYS A 94 5.360 11.063 3.268 1.00 0.00 H new ATOM 0 HA LYS A 94 3.105 12.209 4.203 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.840 11.888 5.527 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.419 12.369 6.432 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.237 10.300 5.790 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.541 9.843 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.921 8.599 6.744 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.111 9.885 6.754 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.825 11.207 8.326 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.391 10.225 8.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.536 9.641 10.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.568 8.331 9.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 5.957 9.282 9.286 1.00 0.00 H new ATOM 1443 N ASP A 95 5.555 14.437 4.453 1.00 0.00 N ATOM 1444 CA ASP A 95 5.818 15.868 4.540 1.00 0.00 C ATOM 1445 C ASP A 95 5.336 16.584 3.294 1.00 0.00 C ATOM 1446 O ASP A 95 5.425 17.803 3.215 1.00 0.00 O ATOM 1447 CB ASP A 95 7.316 16.118 4.726 1.00 0.00 C ATOM 1448 CG ASP A 95 8.055 15.881 3.414 1.00 0.00 C ATOM 1449 OD1 ASP A 95 7.468 15.280 2.529 1.00 0.00 O ATOM 1450 OD2 ASP A 95 9.192 16.306 3.313 1.00 0.00 O ATOM 0 H ASP A 95 6.389 13.849 4.455 1.00 0.00 H new ATOM 0 HA ASP A 95 5.274 16.259 5.400 1.00 0.00 H new ATOM 0 HB2 ASP A 95 7.482 17.140 5.066 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.710 15.457 5.498 1.00 0.00 H new ATOM 1455 N GLN A 96 4.848 15.816 2.324 1.00 0.00 N ATOM 1456 CA GLN A 96 4.346 16.379 1.069 1.00 0.00 C ATOM 1457 C GLN A 96 5.174 17.587 0.651 1.00 0.00 C ATOM 1458 O GLN A 96 4.653 18.693 0.513 1.00 0.00 O ATOM 1459 CB GLN A 96 2.881 16.791 1.237 1.00 0.00 C ATOM 1460 CG GLN A 96 2.718 17.640 2.501 1.00 0.00 C ATOM 1461 CD GLN A 96 1.319 18.218 2.573 1.00 0.00 C ATOM 1462 OE1 GLN A 96 0.334 17.583 2.008 1.00 0.00 O flip ATOM 1463 NE2 GLN A 96 1.118 19.278 3.166 1.00 0.00 N flip ATOM 0 H GLN A 96 4.788 14.799 2.381 1.00 0.00 H new ATOM 0 HA GLN A 96 4.425 15.619 0.292 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.551 17.355 0.365 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.250 15.904 1.301 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.912 17.031 3.384 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.452 18.446 2.502 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.895 19.771 3.607 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.175 19.663 3.216 1.00 0.00 H new ATOM 1472 N ASN A 97 6.472 17.372 0.463 1.00 0.00 N ATOM 1473 CA ASN A 97 7.369 18.458 0.072 1.00 0.00 C ATOM 1474 C ASN A 97 7.640 18.403 -1.424 1.00 0.00 C ATOM 1475 O ASN A 97 8.420 19.193 -1.952 1.00 0.00 O ATOM 1476 CB ASN A 97 8.686 18.353 0.839 1.00 0.00 C ATOM 1477 CG ASN A 97 9.411 17.069 0.455 1.00 0.00 C ATOM 1478 OD1 ASN A 97 8.801 16.149 -0.092 1.00 0.00 O ATOM 1479 ND2 ASN A 97 10.686 16.950 0.707 1.00 0.00 N ATOM 0 H ASN A 97 6.925 16.465 0.573 1.00 0.00 H new ATOM 0 HA ASN A 97 6.891 19.408 0.312 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.315 19.216 0.618 1.00 0.00 H new ATOM 0 HB3 ASN A 97 8.494 18.365 1.912 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.179 16.094 0.451 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.190 17.713 1.160 1.00 0.00 H new ATOM 1486 N GLY A 98 6.985 17.468 -2.108 1.00 0.00 N ATOM 1487 CA GLY A 98 7.162 17.323 -3.552 1.00 0.00 C ATOM 1488 C GLY A 98 8.207 16.264 -3.869 1.00 0.00 C ATOM 1489 O GLY A 98 8.497 15.996 -5.036 1.00 0.00 O ATOM 0 H GLY A 98 6.332 16.804 -1.691 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.212 17.051 -4.013 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.464 18.278 -3.983 1.00 0.00 H new ATOM 1493 N TYR A 99 8.771 15.655 -2.826 1.00 0.00 N ATOM 1494 CA TYR A 99 9.783 14.621 -3.016 1.00 0.00 C ATOM 1495 C TYR A 99 9.627 13.527 -1.969 1.00 0.00 C ATOM 1496 O TYR A 99 9.203 13.787 -0.846 1.00 0.00 O ATOM 1497 CB TYR A 99 11.176 15.235 -2.905 1.00 0.00 C ATOM 1498 CG TYR A 99 11.199 16.565 -3.618 1.00 0.00 C ATOM 1499 CD1 TYR A 99 10.772 17.720 -2.954 1.00 0.00 C ATOM 1500 CD2 TYR A 99 11.647 16.645 -4.941 1.00 0.00 C ATOM 1501 CE1 TYR A 99 10.791 18.955 -3.612 1.00 0.00 C ATOM 1502 CE2 TYR A 99 11.666 17.879 -5.601 1.00 0.00 C ATOM 1503 CZ TYR A 99 11.238 19.035 -4.936 1.00 0.00 C ATOM 1504 OH TYR A 99 11.257 20.252 -5.586 1.00 0.00 O ATOM 0 H TYR A 99 8.546 15.858 -1.852 1.00 0.00 H new ATOM 0 HA TYR A 99 9.653 14.185 -4.006 1.00 0.00 H new ATOM 0 HB2 TYR A 99 11.444 15.368 -1.857 1.00 0.00 H new ATOM 0 HB3 TYR A 99 11.916 14.564 -3.341 1.00 0.00 H new ATOM 0 HD1 TYR A 99 10.427 17.658 -1.932 1.00 0.00 H new ATOM 0 HD2 TYR A 99 11.978 15.754 -5.453 1.00 0.00 H new ATOM 0 HE1 TYR A 99 10.461 19.846 -3.098 1.00 0.00 H new ATOM 0 HE2 TYR A 99 12.011 17.940 -6.623 1.00 0.00 H new ATOM 0 HH TYR A 99 11.596 20.131 -6.498 1.00 0.00 H new ATOM 1514 N ILE A 100 9.970 12.298 -2.340 1.00 0.00 N ATOM 1515 CA ILE A 100 9.859 11.173 -1.415 1.00 0.00 C ATOM 1516 C ILE A 100 11.210 10.889 -0.771 1.00 0.00 C ATOM 1517 O ILE A 100 12.168 10.505 -1.449 1.00 0.00 O ATOM 1518 CB ILE A 100 9.386 9.923 -2.168 1.00 0.00 C ATOM 1519 CG1 ILE A 100 8.298 10.315 -3.172 1.00 0.00 C ATOM 1520 CG2 ILE A 100 8.815 8.910 -1.172 1.00 0.00 C ATOM 1521 CD1 ILE A 100 7.790 9.064 -3.894 1.00 0.00 C ATOM 0 H ILE A 100 10.324 12.055 -3.265 1.00 0.00 H new ATOM 0 HA ILE A 100 9.136 11.428 -0.640 1.00 0.00 H new ATOM 0 HB ILE A 100 10.229 9.478 -2.696 1.00 0.00 H new ATOM 0 HG12 ILE A 100 7.474 10.809 -2.657 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.696 11.028 -3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.479 8.022 -1.708 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.587 8.631 -0.455 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.972 9.355 -0.643 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.016 9.345 -4.608 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.616 8.588 -4.423 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.376 8.367 -3.166 1.00 0.00 H new ATOM 1533 N SER A 101 11.281 11.079 0.541 1.00 0.00 N ATOM 1534 CA SER A 101 12.523 10.836 1.276 1.00 0.00 C ATOM 1535 C SER A 101 12.613 9.374 1.698 1.00 0.00 C ATOM 1536 O SER A 101 11.594 8.700 1.863 1.00 0.00 O ATOM 1537 CB SER A 101 12.585 11.732 2.511 1.00 0.00 C ATOM 1538 OG SER A 101 11.908 11.097 3.582 1.00 0.00 O ATOM 0 H SER A 101 10.502 11.398 1.117 1.00 0.00 H new ATOM 0 HA SER A 101 13.363 11.067 0.622 1.00 0.00 H new ATOM 0 HB2 SER A 101 13.623 11.924 2.784 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.127 12.698 2.298 1.00 0.00 H new ATOM 0 HG SER A 101 12.131 11.548 4.423 1.00 0.00 H new ATOM 1544 N ALA A 102 13.837 8.884 1.875 1.00 0.00 N ATOM 1545 CA ALA A 102 14.041 7.501 2.276 1.00 0.00 C ATOM 1546 C ALA A 102 13.343 7.215 3.601 1.00 0.00 C ATOM 1547 O ALA A 102 12.683 6.189 3.752 1.00 0.00 O ATOM 1548 CB ALA A 102 15.541 7.216 2.418 1.00 0.00 C ATOM 0 H ALA A 102 14.694 9.422 1.748 1.00 0.00 H new ATOM 0 HA ALA A 102 13.616 6.855 1.508 1.00 0.00 H new ATOM 0 HB1 ALA A 102 15.687 6.179 2.719 1.00 0.00 H new ATOM 0 HB2 ALA A 102 16.037 7.390 1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 102 15.967 7.876 3.174 1.00 0.00 H new ATOM 1554 N SER A 103 13.491 8.130 4.556 1.00 0.00 N ATOM 1555 CA SER A 103 12.868 7.963 5.864 1.00 0.00 C ATOM 1556 C SER A 103 11.347 7.904 5.733 1.00 0.00 C ATOM 1557 O SER A 103 10.695 7.043 6.325 1.00 0.00 O ATOM 1558 CB SER A 103 13.260 9.121 6.778 1.00 0.00 C ATOM 1559 OG SER A 103 12.410 9.128 7.916 1.00 0.00 O ATOM 0 H SER A 103 14.033 8.988 4.449 1.00 0.00 H new ATOM 0 HA SER A 103 13.218 7.025 6.295 1.00 0.00 H new ATOM 0 HB2 SER A 103 14.300 9.019 7.087 1.00 0.00 H new ATOM 0 HB3 SER A 103 13.178 10.067 6.242 1.00 0.00 H new ATOM 0 HG SER A 103 12.660 9.869 8.506 1.00 0.00 H new ATOM 1565 N GLU A 104 10.793 8.816 4.940 1.00 0.00 N ATOM 1566 CA GLU A 104 9.346 8.850 4.728 1.00 0.00 C ATOM 1567 C GLU A 104 8.866 7.534 4.120 1.00 0.00 C ATOM 1568 O GLU A 104 7.962 6.868 4.657 1.00 0.00 O ATOM 1569 CB GLU A 104 8.985 10.012 3.803 1.00 0.00 C ATOM 1570 CG GLU A 104 9.131 11.332 4.558 1.00 0.00 C ATOM 1571 CD GLU A 104 8.936 12.501 3.602 1.00 0.00 C ATOM 1572 OE1 GLU A 104 8.542 12.261 2.471 1.00 0.00 O ATOM 1573 OE2 GLU A 104 9.198 13.619 4.010 1.00 0.00 O ATOM 0 H GLU A 104 11.315 9.534 4.438 1.00 0.00 H new ATOM 0 HA GLU A 104 8.854 8.990 5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 104 9.634 10.008 2.927 1.00 0.00 H new ATOM 0 HB3 GLU A 104 7.963 9.899 3.442 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.398 11.383 5.363 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.117 11.389 5.020 1.00 0.00 H new ATOM 1580 N LEU A 105 9.494 7.140 3.017 1.00 0.00 N ATOM 1581 CA LEU A 105 9.138 5.894 2.365 1.00 0.00 C ATOM 1582 C LEU A 105 9.434 4.709 3.285 1.00 0.00 C ATOM 1583 O LEU A 105 8.872 3.623 3.121 1.00 0.00 O ATOM 1584 CB LEU A 105 9.945 5.736 1.065 1.00 0.00 C ATOM 1585 CG LEU A 105 9.647 4.374 0.422 1.00 0.00 C ATOM 1586 CD1 LEU A 105 8.151 4.276 0.091 1.00 0.00 C ATOM 1587 CD2 LEU A 105 10.469 4.214 -0.852 1.00 0.00 C ATOM 0 H LEU A 105 10.244 7.662 2.563 1.00 0.00 H new ATOM 0 HA LEU A 105 8.072 5.915 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.692 6.538 0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.011 5.822 1.277 1.00 0.00 H new ATOM 0 HG LEU A 105 9.913 3.581 1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.942 3.308 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.568 4.379 1.006 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.879 5.071 -0.603 1.00 0.00 H new ATOM 0 HD21 LEU A 105 10.254 3.246 -1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.211 5.008 -1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 105 11.530 4.274 -0.610 1.00 0.00 H new ATOM 1599 N ARG A 106 10.306 4.927 4.262 1.00 0.00 N ATOM 1600 CA ARG A 106 10.668 3.869 5.202 1.00 0.00 C ATOM 1601 C ARG A 106 9.634 3.744 6.313 1.00 0.00 C ATOM 1602 O ARG A 106 9.238 2.629 6.678 1.00 0.00 O ATOM 1603 CB ARG A 106 12.045 4.155 5.797 1.00 0.00 C ATOM 1604 CG ARG A 106 12.456 3.009 6.717 1.00 0.00 C ATOM 1605 CD ARG A 106 13.891 3.229 7.195 1.00 0.00 C ATOM 1606 NE ARG A 106 13.970 4.425 8.026 1.00 0.00 N ATOM 1607 CZ ARG A 106 15.141 4.900 8.436 1.00 0.00 C ATOM 1608 NH1 ARG A 106 16.246 4.295 8.098 1.00 0.00 N ATOM 1609 NH2 ARG A 106 15.187 5.973 9.178 1.00 0.00 N ATOM 0 H ARG A 106 10.773 5.819 4.425 1.00 0.00 H new ATOM 0 HA ARG A 106 10.697 2.924 4.660 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.778 4.275 5.000 1.00 0.00 H new ATOM 0 HB3 ARG A 106 12.024 5.092 6.354 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.781 2.954 7.571 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.379 2.059 6.189 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.230 2.361 7.761 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.556 3.329 6.337 1.00 0.00 H new ATOM 0 HE ARG A 106 13.112 4.905 8.297 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.212 3.456 7.518 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.145 4.661 8.413 1.00 0.00 H new ATOM 0 HH21 ARG A 106 14.324 6.447 9.443 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.086 6.337 9.493 1.00 0.00 H new ATOM 1623 N HIS A 107 9.205 4.885 6.846 1.00 0.00 N ATOM 1624 CA HIS A 107 8.223 4.886 7.924 1.00 0.00 C ATOM 1625 C HIS A 107 6.997 4.094 7.497 1.00 0.00 C ATOM 1626 O HIS A 107 6.550 3.196 8.209 1.00 0.00 O ATOM 1627 CB HIS A 107 7.819 6.336 8.252 1.00 0.00 C ATOM 1628 CG HIS A 107 8.710 6.880 9.333 1.00 0.00 C ATOM 1629 ND1 HIS A 107 9.459 8.028 9.168 1.00 0.00 N ATOM 1630 CD2 HIS A 107 8.981 6.427 10.601 1.00 0.00 C ATOM 1631 CE1 HIS A 107 10.143 8.230 10.309 1.00 0.00 C ATOM 1632 NE2 HIS A 107 9.886 7.283 11.215 1.00 0.00 N ATOM 0 H HIS A 107 9.518 5.810 6.553 1.00 0.00 H new ATOM 0 HA HIS A 107 8.657 4.425 8.811 1.00 0.00 H new ATOM 0 HB2 HIS A 107 7.896 6.956 7.359 1.00 0.00 H new ATOM 0 HB3 HIS A 107 6.778 6.369 8.575 1.00 0.00 H new ATOM 0 HD2 HIS A 107 8.556 5.542 11.051 1.00 0.00 H new ATOM 0 HE1 HIS A 107 10.818 9.057 10.472 1.00 0.00 H new ATOM 0 HE2 HIS A 107 10.272 7.205 12.156 1.00 0.00 H new ATOM 1641 N VAL A 108 6.450 4.431 6.331 1.00 0.00 N ATOM 1642 CA VAL A 108 5.269 3.725 5.836 1.00 0.00 C ATOM 1643 C VAL A 108 5.598 2.260 5.610 1.00 0.00 C ATOM 1644 O VAL A 108 5.038 1.385 6.256 1.00 0.00 O ATOM 1645 CB VAL A 108 4.808 4.345 4.521 1.00 0.00 C ATOM 1646 CG1 VAL A 108 3.438 3.785 4.138 1.00 0.00 C ATOM 1647 CG2 VAL A 108 4.709 5.861 4.689 1.00 0.00 C ATOM 0 H VAL A 108 6.796 5.172 5.722 1.00 0.00 H new ATOM 0 HA VAL A 108 4.474 3.808 6.577 1.00 0.00 H new ATOM 0 HB VAL A 108 5.525 4.107 3.735 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.113 4.231 3.198 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.506 2.703 4.022 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.717 4.021 4.920 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.380 6.310 3.752 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.991 6.094 5.475 1.00 0.00 H new ATOM 0 HG23 VAL A 108 5.686 6.262 4.960 1.00 0.00 H new ATOM 1657 N MET A 109 6.510 1.991 4.673 1.00 0.00 N ATOM 1658 CA MET A 109 6.887 0.609 4.364 1.00 0.00 C ATOM 1659 C MET A 109 6.786 -0.288 5.596 1.00 0.00 C ATOM 1660 O MET A 109 5.848 -1.048 5.733 1.00 0.00 O ATOM 1661 CB MET A 109 8.329 0.573 3.849 1.00 0.00 C ATOM 1662 CG MET A 109 8.570 -0.714 3.069 1.00 0.00 C ATOM 1663 SD MET A 109 7.835 -0.562 1.421 1.00 0.00 S ATOM 1664 CE MET A 109 7.375 -2.299 1.211 1.00 0.00 C ATOM 0 H MET A 109 6.995 2.699 4.122 1.00 0.00 H new ATOM 0 HA MET A 109 6.198 0.239 3.605 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.518 1.436 3.211 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.025 0.637 4.686 1.00 0.00 H new ATOM 0 HG2 MET A 109 9.639 -0.908 2.986 1.00 0.00 H new ATOM 0 HG3 MET A 109 8.133 -1.561 3.598 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.896 -2.434 0.241 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.269 -2.921 1.264 1.00 0.00 H new ATOM 0 HE3 MET A 109 6.683 -2.590 2.001 1.00 0.00 H new ATOM 1674 N ILE A 110 7.743 -0.171 6.498 1.00 0.00 N ATOM 1675 CA ILE A 110 7.735 -0.978 7.709 1.00 0.00 C ATOM 1676 C ILE A 110 6.369 -0.974 8.376 1.00 0.00 C ATOM 1677 O ILE A 110 5.827 -2.033 8.695 1.00 0.00 O ATOM 1678 CB ILE A 110 8.780 -0.452 8.692 1.00 0.00 C ATOM 1679 CG1 ILE A 110 8.840 -1.375 9.912 1.00 0.00 C ATOM 1680 CG2 ILE A 110 8.399 0.959 9.138 1.00 0.00 C ATOM 1681 CD1 ILE A 110 10.090 -1.054 10.733 1.00 0.00 C ATOM 0 H ILE A 110 8.532 0.470 6.418 1.00 0.00 H new ATOM 0 HA ILE A 110 7.973 -2.003 7.425 1.00 0.00 H new ATOM 0 HB ILE A 110 9.755 -0.426 8.206 1.00 0.00 H new ATOM 0 HG12 ILE A 110 7.947 -1.246 10.524 1.00 0.00 H new ATOM 0 HG13 ILE A 110 8.859 -2.417 9.593 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.145 1.333 9.839 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.356 1.616 8.269 1.00 0.00 H new ATOM 0 HG23 ILE A 110 7.424 0.936 9.624 1.00 0.00 H new ATOM 0 HD11 ILE A 110 10.133 -1.711 11.602 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.978 -1.206 10.119 1.00 0.00 H new ATOM 0 HD13 ILE A 110 10.051 -0.016 11.064 1.00 0.00 H new ATOM 1693 N ASN A 111 5.820 0.216 8.582 1.00 0.00 N ATOM 1694 CA ASN A 111 4.513 0.345 9.216 1.00 0.00 C ATOM 1695 C ASN A 111 3.508 -0.619 8.597 1.00 0.00 C ATOM 1696 O ASN A 111 2.403 -0.782 9.107 1.00 0.00 O ATOM 1697 CB ASN A 111 4.000 1.784 9.088 1.00 0.00 C ATOM 1698 CG ASN A 111 4.760 2.704 10.035 1.00 0.00 C ATOM 1699 OD1 ASN A 111 5.260 2.225 11.141 1.00 0.00 O flip ATOM 1700 ND2 ASN A 111 4.905 3.895 9.759 1.00 0.00 N flip ATOM 0 H ASN A 111 6.255 1.101 8.322 1.00 0.00 H new ATOM 0 HA ASN A 111 4.625 0.097 10.271 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.119 2.130 8.061 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.934 1.819 9.314 1.00 0.00 H new ATOM 0 HD21 ASN A 111 4.514 4.269 8.894 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.416 4.507 10.395 1.00 0.00 H new ATOM 1707 N LEU A 112 3.906 -1.262 7.507 1.00 0.00 N ATOM 1708 CA LEU A 112 3.044 -2.223 6.833 1.00 0.00 C ATOM 1709 C LEU A 112 3.287 -3.626 7.368 1.00 0.00 C ATOM 1710 O LEU A 112 2.824 -4.609 6.787 1.00 0.00 O ATOM 1711 CB LEU A 112 3.311 -2.200 5.330 1.00 0.00 C ATOM 1712 CG LEU A 112 2.999 -0.802 4.780 1.00 0.00 C ATOM 1713 CD1 LEU A 112 3.394 -0.727 3.303 1.00 0.00 C ATOM 1714 CD2 LEU A 112 1.494 -0.504 4.931 1.00 0.00 C ATOM 0 H LEU A 112 4.820 -1.135 7.071 1.00 0.00 H new ATOM 0 HA LEU A 112 2.007 -1.946 7.023 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.351 -2.458 5.130 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.695 -2.946 4.828 1.00 0.00 H new ATOM 0 HG LEU A 112 3.569 -0.062 5.342 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.171 0.267 2.917 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.461 -0.925 3.201 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.832 -1.470 2.738 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.279 0.490 4.539 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.919 -1.245 4.376 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.219 -0.546 5.985 1.00 0.00 H new ATOM 1726 N GLY A 113 4.014 -3.719 8.478 1.00 0.00 N ATOM 1727 CA GLY A 113 4.307 -5.015 9.086 1.00 0.00 C ATOM 1728 C GLY A 113 5.626 -5.575 8.564 1.00 0.00 C ATOM 1729 O GLY A 113 6.457 -6.052 9.336 1.00 0.00 O ATOM 0 H GLY A 113 4.409 -2.919 8.972 1.00 0.00 H new ATOM 0 HA2 GLY A 113 4.355 -4.910 10.170 1.00 0.00 H new ATOM 0 HA3 GLY A 113 3.499 -5.714 8.869 1.00 0.00 H new ATOM 1733 N GLU A 114 5.807 -5.519 7.248 1.00 0.00 N ATOM 1734 CA GLU A 114 7.024 -6.035 6.632 1.00 0.00 C ATOM 1735 C GLU A 114 8.250 -5.418 7.288 1.00 0.00 C ATOM 1736 O GLU A 114 8.391 -4.206 7.343 1.00 0.00 O ATOM 1737 CB GLU A 114 7.027 -5.712 5.137 1.00 0.00 C ATOM 1738 CG GLU A 114 5.881 -6.458 4.453 1.00 0.00 C ATOM 1739 CD GLU A 114 5.807 -6.064 2.982 1.00 0.00 C ATOM 1740 OE1 GLU A 114 6.610 -5.245 2.567 1.00 0.00 O ATOM 1741 OE2 GLU A 114 4.945 -6.584 2.294 1.00 0.00 O ATOM 0 H GLU A 114 5.132 -5.125 6.592 1.00 0.00 H new ATOM 0 HA GLU A 114 7.054 -7.116 6.770 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.918 -4.638 4.986 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.980 -6.001 4.693 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.032 -7.534 4.543 1.00 0.00 H new ATOM 0 HG3 GLU A 114 4.938 -6.226 4.948 1.00 0.00 H new ATOM 1748 N LYS A 115 9.140 -6.265 7.792 1.00 0.00 N ATOM 1749 CA LYS A 115 10.354 -5.784 8.454 1.00 0.00 C ATOM 1750 C LYS A 115 11.535 -5.835 7.500 1.00 0.00 C ATOM 1751 O LYS A 115 12.094 -6.901 7.244 1.00 0.00 O ATOM 1752 CB LYS A 115 10.655 -6.649 9.678 1.00 0.00 C ATOM 1753 CG LYS A 115 9.535 -6.479 10.708 1.00 0.00 C ATOM 1754 CD LYS A 115 9.859 -7.306 11.954 1.00 0.00 C ATOM 1755 CE LYS A 115 8.738 -7.138 12.984 1.00 0.00 C ATOM 1756 NZ LYS A 115 9.066 -7.923 14.207 1.00 0.00 N ATOM 0 H LYS A 115 9.049 -7.280 7.757 1.00 0.00 H new ATOM 0 HA LYS A 115 10.193 -4.752 8.765 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.739 -7.696 9.386 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.612 -6.362 10.114 1.00 0.00 H new ATOM 0 HG2 LYS A 115 9.427 -5.427 10.974 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.584 -6.799 10.283 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.968 -8.357 11.688 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.810 -6.985 12.380 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.617 -6.085 13.237 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.791 -7.477 12.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 8.305 -7.809 14.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.161 -8.929 13.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.961 -7.580 14.610 1.00 0.00 H new ATOM 1770 N LEU A 116 11.915 -4.673 6.972 1.00 0.00 N ATOM 1771 CA LEU A 116 13.042 -4.590 6.036 1.00 0.00 C ATOM 1772 C LEU A 116 14.170 -3.757 6.630 1.00 0.00 C ATOM 1773 O LEU A 116 13.944 -2.659 7.137 1.00 0.00 O ATOM 1774 CB LEU A 116 12.580 -3.956 4.724 1.00 0.00 C ATOM 1775 CG LEU A 116 11.325 -4.675 4.220 1.00 0.00 C ATOM 1776 CD1 LEU A 116 10.854 -4.026 2.917 1.00 0.00 C ATOM 1777 CD2 LEU A 116 11.641 -6.155 3.969 1.00 0.00 C ATOM 0 H LEU A 116 11.465 -3.780 7.172 1.00 0.00 H new ATOM 0 HA LEU A 116 13.409 -5.599 5.847 1.00 0.00 H new ATOM 0 HB2 LEU A 116 12.369 -2.897 4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.372 -4.020 3.978 1.00 0.00 H new ATOM 0 HG LEU A 116 10.539 -4.597 4.971 1.00 0.00 H new ATOM 0 HD11 LEU A 116 9.961 -4.537 2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.624 -2.976 3.096 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.642 -4.102 2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.745 -6.663 3.611 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.429 -6.237 3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.974 -6.619 4.898 1.00 0.00 H new ATOM 1789 N THR A 117 15.382 -4.298 6.582 1.00 0.00 N ATOM 1790 CA THR A 117 16.540 -3.602 7.131 1.00 0.00 C ATOM 1791 C THR A 117 16.807 -2.318 6.354 1.00 0.00 C ATOM 1792 O THR A 117 16.232 -2.098 5.289 1.00 0.00 O ATOM 1793 CB THR A 117 17.773 -4.506 7.065 1.00 0.00 C ATOM 1794 OG1 THR A 117 18.083 -4.784 5.707 1.00 0.00 O ATOM 1795 CG2 THR A 117 17.488 -5.817 7.802 1.00 0.00 C ATOM 0 H THR A 117 15.588 -5.209 6.172 1.00 0.00 H new ATOM 0 HA THR A 117 16.331 -3.350 8.171 1.00 0.00 H new ATOM 0 HB THR A 117 18.617 -4.002 7.536 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.874 -5.361 5.664 1.00 0.00 H new ATOM 0 HG21 THR A 117 18.367 -6.460 7.754 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.250 -5.604 8.844 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.643 -6.322 7.333 1.00 0.00 H new ATOM 1803 N ASP A 118 17.676 -1.474 6.898 1.00 0.00 N ATOM 1804 CA ASP A 118 18.008 -0.213 6.248 1.00 0.00 C ATOM 1805 C ASP A 118 18.753 -0.465 4.942 1.00 0.00 C ATOM 1806 O ASP A 118 18.757 0.374 4.045 1.00 0.00 O ATOM 1807 CB ASP A 118 18.872 0.643 7.177 1.00 0.00 C ATOM 1808 CG ASP A 118 20.128 -0.122 7.573 1.00 0.00 C ATOM 1809 OD1 ASP A 118 20.230 -1.282 7.209 1.00 0.00 O ATOM 1810 OD2 ASP A 118 20.969 0.461 8.237 1.00 0.00 O ATOM 0 H ASP A 118 18.160 -1.638 7.781 1.00 0.00 H new ATOM 0 HA ASP A 118 17.081 0.316 6.027 1.00 0.00 H new ATOM 0 HB2 ASP A 118 19.145 1.573 6.679 1.00 0.00 H new ATOM 0 HB3 ASP A 118 18.305 0.913 8.068 1.00 0.00 H new ATOM 1815 N GLU A 119 19.391 -1.625 4.846 1.00 0.00 N ATOM 1816 CA GLU A 119 20.138 -1.974 3.643 1.00 0.00 C ATOM 1817 C GLU A 119 19.193 -2.202 2.469 1.00 0.00 C ATOM 1818 O GLU A 119 19.399 -1.670 1.383 1.00 0.00 O ATOM 1819 CB GLU A 119 20.960 -3.242 3.890 1.00 0.00 C ATOM 1820 CG GLU A 119 22.059 -2.948 4.910 1.00 0.00 C ATOM 1821 CD GLU A 119 22.845 -4.220 5.213 1.00 0.00 C ATOM 1822 OE1 GLU A 119 22.557 -5.231 4.594 1.00 0.00 O ATOM 1823 OE2 GLU A 119 23.723 -4.164 6.059 1.00 0.00 O ATOM 0 H GLU A 119 19.407 -2.334 5.579 1.00 0.00 H new ATOM 0 HA GLU A 119 20.805 -1.147 3.401 1.00 0.00 H new ATOM 0 HB2 GLU A 119 20.315 -4.041 4.255 1.00 0.00 H new ATOM 0 HB3 GLU A 119 21.400 -3.590 2.956 1.00 0.00 H new ATOM 0 HG2 GLU A 119 22.729 -2.180 4.523 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.620 -2.555 5.827 1.00 0.00 H new ATOM 1830 N GLU A 120 18.153 -2.995 2.697 1.00 0.00 N ATOM 1831 CA GLU A 120 17.183 -3.288 1.647 1.00 0.00 C ATOM 1832 C GLU A 120 16.418 -2.027 1.255 1.00 0.00 C ATOM 1833 O GLU A 120 16.217 -1.750 0.069 1.00 0.00 O ATOM 1834 CB GLU A 120 16.199 -4.356 2.132 1.00 0.00 C ATOM 1835 CG GLU A 120 16.933 -5.689 2.295 1.00 0.00 C ATOM 1836 CD GLU A 120 15.997 -6.730 2.900 1.00 0.00 C ATOM 1837 OE1 GLU A 120 14.945 -6.342 3.378 1.00 0.00 O ATOM 1838 OE2 GLU A 120 16.332 -7.901 2.852 1.00 0.00 O ATOM 0 H GLU A 120 17.960 -3.444 3.592 1.00 0.00 H new ATOM 0 HA GLU A 120 17.720 -3.657 0.773 1.00 0.00 H new ATOM 0 HB2 GLU A 120 15.756 -4.054 3.081 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.382 -4.463 1.419 1.00 0.00 H new ATOM 0 HG2 GLU A 120 17.297 -6.034 1.327 1.00 0.00 H new ATOM 0 HG3 GLU A 120 17.806 -5.557 2.935 1.00 0.00 H new ATOM 1845 N VAL A 121 15.994 -1.265 2.259 1.00 0.00 N ATOM 1846 CA VAL A 121 15.251 -0.034 2.002 1.00 0.00 C ATOM 1847 C VAL A 121 16.112 0.963 1.228 1.00 0.00 C ATOM 1848 O VAL A 121 15.677 1.537 0.222 1.00 0.00 O ATOM 1849 CB VAL A 121 14.811 0.591 3.328 1.00 0.00 C ATOM 1850 CG1 VAL A 121 14.148 1.944 3.062 1.00 0.00 C ATOM 1851 CG2 VAL A 121 13.813 -0.338 4.024 1.00 0.00 C ATOM 0 H VAL A 121 16.149 -1.473 3.245 1.00 0.00 H new ATOM 0 HA VAL A 121 14.374 -0.278 1.403 1.00 0.00 H new ATOM 0 HB VAL A 121 15.682 0.734 3.967 1.00 0.00 H new ATOM 0 HG11 VAL A 121 13.835 2.388 4.007 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.859 2.606 2.568 1.00 0.00 H new ATOM 0 HG13 VAL A 121 13.277 1.803 2.422 1.00 0.00 H new ATOM 0 HG21 VAL A 121 13.499 0.107 4.968 1.00 0.00 H new ATOM 0 HG22 VAL A 121 12.943 -0.482 3.384 1.00 0.00 H new ATOM 0 HG23 VAL A 121 14.285 -1.301 4.216 1.00 0.00 H new ATOM 1861 N GLU A 122 17.342 1.157 1.694 1.00 0.00 N ATOM 1862 CA GLU A 122 18.259 2.080 1.036 1.00 0.00 C ATOM 1863 C GLU A 122 18.565 1.610 -0.380 1.00 0.00 C ATOM 1864 O GLU A 122 18.739 2.422 -1.290 1.00 0.00 O ATOM 1865 CB GLU A 122 19.559 2.188 1.836 1.00 0.00 C ATOM 1866 CG GLU A 122 19.319 3.010 3.100 1.00 0.00 C ATOM 1867 CD GLU A 122 19.101 4.476 2.738 1.00 0.00 C ATOM 1868 OE1 GLU A 122 19.319 4.817 1.587 1.00 0.00 O ATOM 1869 OE2 GLU A 122 18.720 5.235 3.614 1.00 0.00 O ATOM 0 H GLU A 122 17.724 0.692 2.517 1.00 0.00 H new ATOM 0 HA GLU A 122 17.785 3.060 0.986 1.00 0.00 H new ATOM 0 HB2 GLU A 122 19.918 1.193 2.100 1.00 0.00 H new ATOM 0 HB3 GLU A 122 20.334 2.656 1.228 1.00 0.00 H new ATOM 0 HG2 GLU A 122 18.450 2.626 3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 122 20.172 2.916 3.772 1.00 0.00 H new ATOM 1876 N GLN A 123 18.632 0.296 -0.561 1.00 0.00 N ATOM 1877 CA GLN A 123 18.921 -0.261 -1.877 1.00 0.00 C ATOM 1878 C GLN A 123 17.868 0.178 -2.889 1.00 0.00 C ATOM 1879 O GLN A 123 18.196 0.734 -3.942 1.00 0.00 O ATOM 1880 CB GLN A 123 18.949 -1.798 -1.795 1.00 0.00 C ATOM 1881 CG GLN A 123 20.358 -2.273 -1.437 1.00 0.00 C ATOM 1882 CD GLN A 123 20.366 -3.783 -1.247 1.00 0.00 C ATOM 1883 OE1 GLN A 123 19.384 -4.355 -0.774 1.00 0.00 O ATOM 1884 NE2 GLN A 123 21.421 -4.466 -1.591 1.00 0.00 N ATOM 0 H GLN A 123 18.492 -0.395 0.176 1.00 0.00 H new ATOM 0 HA GLN A 123 19.894 0.106 -2.204 1.00 0.00 H new ATOM 0 HB2 GLN A 123 18.237 -2.144 -1.045 1.00 0.00 H new ATOM 0 HB3 GLN A 123 18.642 -2.228 -2.749 1.00 0.00 H new ATOM 0 HG2 GLN A 123 21.056 -1.994 -2.226 1.00 0.00 H new ATOM 0 HG3 GLN A 123 20.695 -1.782 -0.524 1.00 0.00 H new ATOM 0 HE21 GLN A 123 22.233 -3.988 -1.983 1.00 0.00 H new ATOM 0 HE22 GLN A 123 21.435 -5.479 -1.469 1.00 0.00 H new ATOM 1893 N MET A 124 16.602 -0.070 -2.569 1.00 0.00 N ATOM 1894 CA MET A 124 15.530 0.315 -3.468 1.00 0.00 C ATOM 1895 C MET A 124 15.641 1.805 -3.794 1.00 0.00 C ATOM 1896 O MET A 124 15.333 2.231 -4.904 1.00 0.00 O ATOM 1897 CB MET A 124 14.161 -0.028 -2.804 1.00 0.00 C ATOM 1898 CG MET A 124 13.337 1.246 -2.542 1.00 0.00 C ATOM 1899 SD MET A 124 12.754 1.914 -4.128 1.00 0.00 S ATOM 1900 CE MET A 124 12.171 3.497 -3.505 1.00 0.00 C ATOM 0 H MET A 124 16.301 -0.528 -1.709 1.00 0.00 H new ATOM 0 HA MET A 124 15.605 -0.236 -4.405 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.599 -0.702 -3.450 1.00 0.00 H new ATOM 0 HB3 MET A 124 14.331 -0.555 -1.865 1.00 0.00 H new ATOM 0 HG2 MET A 124 12.489 1.019 -1.895 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.945 1.987 -2.023 1.00 0.00 H new ATOM 0 HE1 MET A 124 12.266 4.252 -4.285 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.125 3.409 -3.210 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.768 3.791 -2.642 1.00 0.00 H new ATOM 1910 N ILE A 125 15.985 2.593 -2.779 1.00 0.00 N ATOM 1911 CA ILE A 125 16.053 4.030 -2.946 1.00 0.00 C ATOM 1912 C ILE A 125 17.101 4.366 -3.985 1.00 0.00 C ATOM 1913 O ILE A 125 16.906 5.250 -4.813 1.00 0.00 O ATOM 1914 CB ILE A 125 16.385 4.708 -1.601 1.00 0.00 C ATOM 1915 CG1 ILE A 125 15.112 4.819 -0.739 1.00 0.00 C ATOM 1916 CG2 ILE A 125 16.968 6.106 -1.856 1.00 0.00 C ATOM 1917 CD1 ILE A 125 14.335 6.088 -1.130 1.00 0.00 C ATOM 0 H ILE A 125 16.218 2.259 -1.844 1.00 0.00 H new ATOM 0 HA ILE A 125 15.086 4.402 -3.284 1.00 0.00 H new ATOM 0 HB ILE A 125 17.120 4.105 -1.069 1.00 0.00 H new ATOM 0 HG12 ILE A 125 14.486 3.938 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 125 15.378 4.854 0.318 1.00 0.00 H new ATOM 0 HG21 ILE A 125 17.201 6.582 -0.904 1.00 0.00 H new ATOM 0 HG22 ILE A 125 17.878 6.018 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 125 16.239 6.711 -2.395 1.00 0.00 H new ATOM 0 HD11 ILE A 125 13.435 6.166 -0.520 1.00 0.00 H new ATOM 0 HD12 ILE A 125 14.962 6.964 -0.965 1.00 0.00 H new ATOM 0 HD13 ILE A 125 14.057 6.034 -2.182 1.00 0.00 H new ATOM 1929 N LYS A 126 18.218 3.663 -3.919 1.00 0.00 N ATOM 1930 CA LYS A 126 19.307 3.898 -4.855 1.00 0.00 C ATOM 1931 C LYS A 126 18.858 3.572 -6.276 1.00 0.00 C ATOM 1932 O LYS A 126 19.299 4.200 -7.238 1.00 0.00 O ATOM 1933 CB LYS A 126 20.507 3.031 -4.487 1.00 0.00 C ATOM 1934 CG LYS A 126 21.726 3.467 -5.308 1.00 0.00 C ATOM 1935 CD LYS A 126 22.819 2.396 -5.219 1.00 0.00 C ATOM 1936 CE LYS A 126 23.453 2.418 -3.827 1.00 0.00 C ATOM 1937 NZ LYS A 126 23.884 3.807 -3.499 1.00 0.00 N ATOM 0 H LYS A 126 18.396 2.929 -3.233 1.00 0.00 H new ATOM 0 HA LYS A 126 19.592 4.949 -4.803 1.00 0.00 H new ATOM 0 HB2 LYS A 126 20.721 3.122 -3.422 1.00 0.00 H new ATOM 0 HB3 LYS A 126 20.283 1.982 -4.679 1.00 0.00 H new ATOM 0 HG2 LYS A 126 21.439 3.622 -6.348 1.00 0.00 H new ATOM 0 HG3 LYS A 126 22.105 4.419 -4.936 1.00 0.00 H new ATOM 0 HD2 LYS A 126 22.394 1.412 -5.420 1.00 0.00 H new ATOM 0 HD3 LYS A 126 23.580 2.576 -5.978 1.00 0.00 H new ATOM 0 HE2 LYS A 126 22.738 2.063 -3.085 1.00 0.00 H new ATOM 0 HE3 LYS A 126 24.308 1.743 -3.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 24.667 3.775 -2.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 24.201 4.286 -4.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 23.085 4.330 -3.087 1.00 0.00 H new ATOM 1951 N GLU A 127 17.987 2.574 -6.402 1.00 0.00 N ATOM 1952 CA GLU A 127 17.492 2.169 -7.716 1.00 0.00 C ATOM 1953 C GLU A 127 16.456 3.162 -8.237 1.00 0.00 C ATOM 1954 O GLU A 127 16.581 3.681 -9.345 1.00 0.00 O ATOM 1955 CB GLU A 127 16.863 0.777 -7.626 1.00 0.00 C ATOM 1956 CG GLU A 127 17.926 -0.238 -7.203 1.00 0.00 C ATOM 1957 CD GLU A 127 18.990 -0.369 -8.288 1.00 0.00 C ATOM 1958 OE1 GLU A 127 18.708 0.007 -9.413 1.00 0.00 O ATOM 1959 OE2 GLU A 127 20.072 -0.838 -7.976 1.00 0.00 O ATOM 0 H GLU A 127 17.613 2.036 -5.621 1.00 0.00 H new ATOM 0 HA GLU A 127 18.334 2.149 -8.408 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.044 0.782 -6.907 1.00 0.00 H new ATOM 0 HB3 GLU A 127 16.439 0.495 -8.590 1.00 0.00 H new ATOM 0 HG2 GLU A 127 18.387 0.076 -6.267 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.462 -1.207 -7.020 1.00 0.00 H new ATOM 1966 N ALA A 128 15.438 3.426 -7.424 1.00 0.00 N ATOM 1967 CA ALA A 128 14.387 4.361 -7.810 1.00 0.00 C ATOM 1968 C ALA A 128 14.968 5.758 -8.020 1.00 0.00 C ATOM 1969 O ALA A 128 14.542 6.487 -8.915 1.00 0.00 O ATOM 1970 CB ALA A 128 13.302 4.407 -6.727 1.00 0.00 C ATOM 0 H ALA A 128 15.319 3.009 -6.501 1.00 0.00 H new ATOM 0 HA ALA A 128 13.945 4.020 -8.746 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.521 5.108 -7.024 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.870 3.414 -6.602 1.00 0.00 H new ATOM 0 HB3 ALA A 128 13.742 4.732 -5.784 1.00 0.00 H new ATOM 1976 N ASP A 129 15.933 6.125 -7.182 1.00 0.00 N ATOM 1977 CA ASP A 129 16.555 7.441 -7.281 1.00 0.00 C ATOM 1978 C ASP A 129 17.507 7.482 -8.472 1.00 0.00 C ATOM 1979 O ASP A 129 18.599 6.916 -8.429 1.00 0.00 O ATOM 1980 CB ASP A 129 17.325 7.750 -5.996 1.00 0.00 C ATOM 1981 CG ASP A 129 17.769 9.205 -5.995 1.00 0.00 C ATOM 1982 OD1 ASP A 129 17.696 9.824 -7.044 1.00 0.00 O ATOM 1983 OD2 ASP A 129 18.171 9.679 -4.945 1.00 0.00 O ATOM 0 H ASP A 129 16.298 5.536 -6.434 1.00 0.00 H new ATOM 0 HA ASP A 129 15.775 8.189 -7.422 1.00 0.00 H new ATOM 0 HB2 ASP A 129 16.696 7.552 -5.128 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.193 7.096 -5.916 1.00 0.00 H new ATOM 1988 N LEU A 130 17.083 8.157 -9.533 1.00 0.00 N ATOM 1989 CA LEU A 130 17.904 8.271 -10.731 1.00 0.00 C ATOM 1990 C LEU A 130 19.161 9.089 -10.451 1.00 0.00 C ATOM 1991 O LEU A 130 20.240 8.775 -10.955 1.00 0.00 O ATOM 1992 CB LEU A 130 17.097 8.928 -11.862 1.00 0.00 C ATOM 1993 CG LEU A 130 16.211 7.877 -12.536 1.00 0.00 C ATOM 1994 CD1 LEU A 130 15.269 7.259 -11.498 1.00 0.00 C ATOM 1995 CD2 LEU A 130 15.389 8.541 -13.642 1.00 0.00 C ATOM 0 H LEU A 130 16.181 8.631 -9.588 1.00 0.00 H new ATOM 0 HA LEU A 130 18.204 7.269 -11.037 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.482 9.735 -11.463 1.00 0.00 H new ATOM 0 HB3 LEU A 130 17.772 9.373 -12.593 1.00 0.00 H new ATOM 0 HG LEU A 130 16.836 7.095 -12.966 1.00 0.00 H new ATOM 0 HD11 LEU A 130 14.639 6.511 -11.979 1.00 0.00 H new ATOM 0 HD12 LEU A 130 15.856 6.787 -10.710 1.00 0.00 H new ATOM 0 HD13 LEU A 130 14.642 8.039 -11.066 1.00 0.00 H new ATOM 0 HD21 LEU A 130 14.757 7.795 -14.124 1.00 0.00 H new ATOM 0 HD22 LEU A 130 14.763 9.323 -13.211 1.00 0.00 H new ATOM 0 HD23 LEU A 130 16.060 8.980 -14.381 1.00 0.00 H new ATOM 2007 N ASP A 131 19.007 10.151 -9.670 1.00 0.00 N ATOM 2008 CA ASP A 131 20.132 11.023 -9.351 1.00 0.00 C ATOM 2009 C ASP A 131 20.890 10.490 -8.142 1.00 0.00 C ATOM 2010 O ASP A 131 21.860 11.096 -7.688 1.00 0.00 O ATOM 2011 CB ASP A 131 19.627 12.437 -9.056 1.00 0.00 C ATOM 2012 CG ASP A 131 18.638 12.875 -10.130 1.00 0.00 C ATOM 2013 OD1 ASP A 131 19.069 13.114 -11.247 1.00 0.00 O ATOM 2014 OD2 ASP A 131 17.459 12.960 -9.821 1.00 0.00 O ATOM 0 H ASP A 131 18.121 10.429 -9.248 1.00 0.00 H new ATOM 0 HA ASP A 131 20.805 11.049 -10.208 1.00 0.00 H new ATOM 0 HB2 ASP A 131 19.148 12.464 -8.077 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.467 13.131 -9.019 1.00 0.00 H new ATOM 2019 N GLY A 132 20.440 9.351 -7.623 1.00 0.00 N ATOM 2020 CA GLY A 132 21.087 8.744 -6.467 1.00 0.00 C ATOM 2021 C GLY A 132 21.291 9.765 -5.357 1.00 0.00 C ATOM 2022 O GLY A 132 22.285 9.721 -4.634 1.00 0.00 O ATOM 0 H GLY A 132 19.637 8.835 -7.982 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.480 7.917 -6.098 1.00 0.00 H new ATOM 0 HA3 GLY A 132 22.049 8.326 -6.762 1.00 0.00 H new ATOM 2026 N ASP A 133 20.347 10.689 -5.229 1.00 0.00 N ATOM 2027 CA ASP A 133 20.430 11.727 -4.202 1.00 0.00 C ATOM 2028 C ASP A 133 19.615 11.326 -2.976 1.00 0.00 C ATOM 2029 O ASP A 133 19.248 12.171 -2.161 1.00 0.00 O ATOM 2030 CB ASP A 133 19.905 13.054 -4.752 1.00 0.00 C ATOM 2031 CG ASP A 133 18.525 12.857 -5.367 1.00 0.00 C ATOM 2032 OD1 ASP A 133 18.300 11.809 -5.942 1.00 0.00 O ATOM 2033 OD2 ASP A 133 17.715 13.762 -5.261 1.00 0.00 O ATOM 0 H ASP A 133 19.517 10.743 -5.820 1.00 0.00 H new ATOM 0 HA ASP A 133 21.474 11.844 -3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.853 13.793 -3.952 1.00 0.00 H new ATOM 0 HB3 ASP A 133 20.594 13.444 -5.502 1.00 0.00 H new ATOM 2038 N GLY A 134 19.347 10.028 -2.847 1.00 0.00 N ATOM 2039 CA GLY A 134 18.598 9.530 -1.698 1.00 0.00 C ATOM 2040 C GLY A 134 17.224 10.173 -1.648 1.00 0.00 C ATOM 2041 O GLY A 134 16.580 10.210 -0.599 1.00 0.00 O ATOM 0 H GLY A 134 19.633 9.312 -3.514 1.00 0.00 H new ATOM 0 HA2 GLY A 134 18.498 8.446 -1.762 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.142 9.746 -0.779 1.00 0.00 H new ATOM 2045 N GLN A 135 16.777 10.706 -2.782 1.00 0.00 N ATOM 2046 CA GLN A 135 15.479 11.369 -2.846 1.00 0.00 C ATOM 2047 C GLN A 135 14.824 11.128 -4.200 1.00 0.00 C ATOM 2048 O GLN A 135 15.504 11.059 -5.232 1.00 0.00 O ATOM 2049 CB GLN A 135 15.660 12.877 -2.627 1.00 0.00 C ATOM 2050 CG GLN A 135 14.301 13.571 -2.696 1.00 0.00 C ATOM 2051 CD GLN A 135 14.427 15.021 -2.236 1.00 0.00 C ATOM 2052 OE1 GLN A 135 14.019 15.984 -3.015 1.00 0.00 O flip ATOM 2053 NE2 GLN A 135 14.915 15.281 -1.137 1.00 0.00 N flip ATOM 0 H GLN A 135 17.291 10.692 -3.663 1.00 0.00 H new ATOM 0 HA GLN A 135 14.838 10.958 -2.066 1.00 0.00 H new ATOM 0 HB2 GLN A 135 16.125 13.061 -1.658 1.00 0.00 H new ATOM 0 HB3 GLN A 135 16.328 13.287 -3.384 1.00 0.00 H new ATOM 0 HG2 GLN A 135 13.918 13.537 -3.716 1.00 0.00 H new ATOM 0 HG3 GLN A 135 13.583 13.044 -2.068 1.00 0.00 H new ATOM 0 HE21 GLN A 135 15.234 14.526 -0.529 1.00 0.00 H new ATOM 0 HE22 GLN A 135 15.001 16.251 -0.834 1.00 0.00 H new ATOM 2062 N VAL A 136 13.495 11.016 -4.196 1.00 0.00 N ATOM 2063 CA VAL A 136 12.749 10.797 -5.428 1.00 0.00 C ATOM 2064 C VAL A 136 11.701 11.885 -5.623 1.00 0.00 C ATOM 2065 O VAL A 136 10.869 12.121 -4.756 1.00 0.00 O ATOM 2066 CB VAL A 136 12.070 9.419 -5.378 1.00 0.00 C ATOM 2067 CG1 VAL A 136 10.921 9.369 -6.385 1.00 0.00 C ATOM 2068 CG2 VAL A 136 13.088 8.336 -5.724 1.00 0.00 C ATOM 0 H VAL A 136 12.919 11.073 -3.356 1.00 0.00 H new ATOM 0 HA VAL A 136 13.441 10.833 -6.269 1.00 0.00 H new ATOM 0 HB VAL A 136 11.680 9.250 -4.374 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.444 8.390 -6.344 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.189 10.139 -6.141 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.309 9.542 -7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.606 7.359 -5.688 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.479 8.511 -6.726 1.00 0.00 H new ATOM 0 HG23 VAL A 136 13.907 8.363 -5.005 1.00 0.00 H new ATOM 2078 N ASN A 137 11.739 12.525 -6.783 1.00 0.00 N ATOM 2079 CA ASN A 137 10.778 13.577 -7.096 1.00 0.00 C ATOM 2080 C ASN A 137 9.524 12.987 -7.734 1.00 0.00 C ATOM 2081 O ASN A 137 9.552 11.881 -8.273 1.00 0.00 O ATOM 2082 CB ASN A 137 11.408 14.592 -8.051 1.00 0.00 C ATOM 2083 CG ASN A 137 10.441 15.747 -8.294 1.00 0.00 C ATOM 2084 OD1 ASN A 137 10.174 16.104 -9.442 1.00 0.00 O ATOM 2085 ND2 ASN A 137 9.895 16.354 -7.276 1.00 0.00 N ATOM 0 H ASN A 137 12.419 12.337 -7.519 1.00 0.00 H new ATOM 0 HA ASN A 137 10.499 14.075 -6.167 1.00 0.00 H new ATOM 0 HB2 ASN A 137 12.340 14.969 -7.631 1.00 0.00 H new ATOM 0 HB3 ASN A 137 11.656 14.109 -8.996 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.246 17.125 -7.430 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.117 16.057 -6.326 1.00 0.00 H new ATOM 2092 N TYR A 138 8.425 13.732 -7.665 1.00 0.00 N ATOM 2093 CA TYR A 138 7.166 13.271 -8.239 1.00 0.00 C ATOM 2094 C TYR A 138 7.372 12.845 -9.689 1.00 0.00 C ATOM 2095 O TYR A 138 6.838 11.825 -10.125 1.00 0.00 O ATOM 2096 CB TYR A 138 6.125 14.392 -8.177 1.00 0.00 C ATOM 2097 CG TYR A 138 4.857 13.941 -8.861 1.00 0.00 C ATOM 2098 CD1 TYR A 138 3.859 13.276 -8.133 1.00 0.00 C ATOM 2099 CD2 TYR A 138 4.676 14.188 -10.228 1.00 0.00 C ATOM 2100 CE1 TYR A 138 2.690 12.860 -8.772 1.00 0.00 C ATOM 2101 CE2 TYR A 138 3.503 13.771 -10.866 1.00 0.00 C ATOM 2102 CZ TYR A 138 2.510 13.106 -10.138 1.00 0.00 C ATOM 2103 OH TYR A 138 1.352 12.693 -10.766 1.00 0.00 O ATOM 0 H TYR A 138 8.380 14.649 -7.221 1.00 0.00 H new ATOM 0 HA TYR A 138 6.812 12.415 -7.664 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.918 14.653 -7.139 1.00 0.00 H new ATOM 0 HB3 TYR A 138 6.512 15.289 -8.660 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.995 13.086 -7.079 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.443 14.701 -10.790 1.00 0.00 H new ATOM 0 HE1 TYR A 138 1.923 12.347 -8.211 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.364 13.962 -11.920 1.00 0.00 H new ATOM 0 HH TYR A 138 1.386 12.943 -11.713 1.00 0.00 H new ATOM 2113 N GLU A 139 8.150 13.628 -10.432 1.00 0.00 N ATOM 2114 CA GLU A 139 8.417 13.314 -11.832 1.00 0.00 C ATOM 2115 C GLU A 139 9.104 11.955 -11.951 1.00 0.00 C ATOM 2116 O GLU A 139 8.679 11.094 -12.729 1.00 0.00 O ATOM 2117 CB GLU A 139 9.307 14.396 -12.444 1.00 0.00 C ATOM 2118 CG GLU A 139 9.519 14.101 -13.930 1.00 0.00 C ATOM 2119 CD GLU A 139 10.326 15.223 -14.573 1.00 0.00 C ATOM 2120 OE1 GLU A 139 10.444 16.271 -13.957 1.00 0.00 O ATOM 2121 OE2 GLU A 139 10.813 15.020 -15.673 1.00 0.00 O ATOM 0 H GLU A 139 8.603 14.476 -10.092 1.00 0.00 H new ATOM 0 HA GLU A 139 7.469 13.277 -12.369 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.845 15.375 -12.319 1.00 0.00 H new ATOM 0 HB3 GLU A 139 10.267 14.428 -11.928 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.041 13.151 -14.050 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.556 14.001 -14.431 1.00 0.00 H new ATOM 2128 N GLU A 140 10.160 11.761 -11.166 1.00 0.00 N ATOM 2129 CA GLU A 140 10.891 10.498 -11.187 1.00 0.00 C ATOM 2130 C GLU A 140 9.974 9.346 -10.789 1.00 0.00 C ATOM 2131 O GLU A 140 10.055 8.254 -11.350 1.00 0.00 O ATOM 2132 CB GLU A 140 12.076 10.565 -10.222 1.00 0.00 C ATOM 2133 CG GLU A 140 13.131 11.523 -10.768 1.00 0.00 C ATOM 2134 CD GLU A 140 14.273 11.668 -9.767 1.00 0.00 C ATOM 2135 OE1 GLU A 140 14.263 10.949 -8.784 1.00 0.00 O ATOM 2136 OE2 GLU A 140 15.147 12.489 -10.000 1.00 0.00 O ATOM 0 H GLU A 140 10.526 12.455 -10.514 1.00 0.00 H new ATOM 0 HA GLU A 140 11.257 10.326 -12.199 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.740 10.900 -9.241 1.00 0.00 H new ATOM 0 HB3 GLU A 140 12.506 9.572 -10.090 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.514 11.151 -11.718 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.683 12.497 -10.964 1.00 0.00 H new ATOM 2143 N PHE A 141 9.101 9.597 -9.816 1.00 0.00 N ATOM 2144 CA PHE A 141 8.176 8.569 -9.353 1.00 0.00 C ATOM 2145 C PHE A 141 7.264 8.113 -10.487 1.00 0.00 C ATOM 2146 O PHE A 141 7.073 6.915 -10.699 1.00 0.00 O ATOM 2147 CB PHE A 141 7.330 9.113 -8.200 1.00 0.00 C ATOM 2148 CG PHE A 141 6.331 8.063 -7.767 1.00 0.00 C ATOM 2149 CD1 PHE A 141 6.782 6.847 -7.235 1.00 0.00 C ATOM 2150 CD2 PHE A 141 4.957 8.301 -7.898 1.00 0.00 C ATOM 2151 CE1 PHE A 141 5.859 5.875 -6.837 1.00 0.00 C ATOM 2152 CE2 PHE A 141 4.038 7.328 -7.497 1.00 0.00 C ATOM 2153 CZ PHE A 141 4.490 6.116 -6.968 1.00 0.00 C ATOM 0 H PHE A 141 9.016 10.494 -9.338 1.00 0.00 H new ATOM 0 HA PHE A 141 8.756 7.714 -9.008 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.971 9.387 -7.362 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.810 10.018 -8.513 1.00 0.00 H new ATOM 0 HD1 PHE A 141 7.841 6.661 -7.133 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.608 9.237 -8.309 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.205 4.937 -6.428 1.00 0.00 H new ATOM 0 HE2 PHE A 141 2.978 7.512 -7.596 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.779 5.364 -6.660 1.00 0.00 H new ATOM 2163 N VAL A 142 6.698 9.074 -11.208 1.00 0.00 N ATOM 2164 CA VAL A 142 5.796 8.752 -12.307 1.00 0.00 C ATOM 2165 C VAL A 142 6.503 7.873 -13.333 1.00 0.00 C ATOM 2166 O VAL A 142 5.963 6.859 -13.771 1.00 0.00 O ATOM 2167 CB VAL A 142 5.329 10.045 -12.986 1.00 0.00 C ATOM 2168 CG1 VAL A 142 4.527 9.706 -14.246 1.00 0.00 C ATOM 2169 CG2 VAL A 142 4.443 10.836 -12.022 1.00 0.00 C ATOM 0 H VAL A 142 6.845 10.072 -11.054 1.00 0.00 H new ATOM 0 HA VAL A 142 4.937 8.213 -11.907 1.00 0.00 H new ATOM 0 HB VAL A 142 6.199 10.642 -13.259 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.197 10.627 -14.726 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.155 9.142 -14.936 1.00 0.00 H new ATOM 0 HG13 VAL A 142 3.658 9.107 -13.974 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.111 11.755 -12.504 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.575 10.235 -11.749 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.011 11.082 -11.125 1.00 0.00 H new ATOM 2179 N LYS A 143 7.717 8.261 -13.707 1.00 0.00 N ATOM 2180 CA LYS A 143 8.484 7.491 -14.678 1.00 0.00 C ATOM 2181 C LYS A 143 8.841 6.116 -14.128 1.00 0.00 C ATOM 2182 O LYS A 143 8.845 5.124 -14.858 1.00 0.00 O ATOM 2183 CB LYS A 143 9.766 8.236 -15.040 1.00 0.00 C ATOM 2184 CG LYS A 143 9.417 9.509 -15.814 1.00 0.00 C ATOM 2185 CD LYS A 143 10.701 10.158 -16.340 1.00 0.00 C ATOM 2186 CE LYS A 143 11.571 10.611 -15.163 1.00 0.00 C ATOM 2187 NZ LYS A 143 12.543 11.636 -15.631 1.00 0.00 N ATOM 0 H LYS A 143 8.187 9.096 -13.357 1.00 0.00 H new ATOM 0 HA LYS A 143 7.867 7.363 -15.567 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.320 8.488 -14.136 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.412 7.597 -15.642 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.751 9.271 -16.644 1.00 0.00 H new ATOM 0 HG3 LYS A 143 8.884 10.206 -15.167 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.251 9.449 -16.959 1.00 0.00 H new ATOM 0 HD3 LYS A 143 10.456 11.011 -16.973 1.00 0.00 H new ATOM 0 HE2 LYS A 143 10.945 11.023 -14.371 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.101 9.758 -14.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 13.134 11.944 -14.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 13.148 11.228 -16.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 12.027 12.453 -16.016 1.00 0.00 H new ATOM 2201 N MET A 144 9.127 6.058 -12.832 1.00 0.00 N ATOM 2202 CA MET A 144 9.473 4.800 -12.189 1.00 0.00 C ATOM 2203 C MET A 144 8.264 3.872 -12.112 1.00 0.00 C ATOM 2204 O MET A 144 8.398 2.651 -12.214 1.00 0.00 O ATOM 2205 CB MET A 144 10.012 5.062 -10.781 1.00 0.00 C ATOM 2206 CG MET A 144 10.388 3.731 -10.115 1.00 0.00 C ATOM 2207 SD MET A 144 8.915 3.008 -9.349 1.00 0.00 S ATOM 2208 CE MET A 144 9.356 1.274 -9.609 1.00 0.00 C ATOM 0 H MET A 144 9.126 6.866 -12.209 1.00 0.00 H new ATOM 0 HA MET A 144 10.243 4.314 -12.789 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.884 5.714 -10.830 1.00 0.00 H new ATOM 0 HB3 MET A 144 9.261 5.579 -10.184 1.00 0.00 H new ATOM 0 HG2 MET A 144 10.801 3.045 -10.854 1.00 0.00 H new ATOM 0 HG3 MET A 144 11.161 3.893 -9.363 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.501 0.641 -9.370 1.00 0.00 H new ATOM 0 HE2 MET A 144 9.639 1.123 -10.651 1.00 0.00 H new ATOM 0 HE3 MET A 144 10.194 1.011 -8.964 1.00 0.00 H new ATOM 2218 N MET A 145 7.091 4.459 -11.913 1.00 0.00 N ATOM 2219 CA MET A 145 5.866 3.680 -11.811 1.00 0.00 C ATOM 2220 C MET A 145 5.411 3.203 -13.184 1.00 0.00 C ATOM 2221 O MET A 145 4.691 2.210 -13.303 1.00 0.00 O ATOM 2222 CB MET A 145 4.761 4.517 -11.164 1.00 0.00 C ATOM 2223 CG MET A 145 3.506 3.660 -10.989 1.00 0.00 C ATOM 2224 SD MET A 145 2.439 4.406 -9.727 1.00 0.00 S ATOM 2225 CE MET A 145 2.533 3.062 -8.517 1.00 0.00 C ATOM 0 H MET A 145 6.963 5.467 -11.820 1.00 0.00 H new ATOM 0 HA MET A 145 6.069 2.808 -11.189 1.00 0.00 H new ATOM 0 HB2 MET A 145 5.095 4.893 -10.197 1.00 0.00 H new ATOM 0 HB3 MET A 145 4.538 5.385 -11.784 1.00 0.00 H new ATOM 0 HG2 MET A 145 2.970 3.583 -11.935 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.782 2.647 -10.695 1.00 0.00 H new ATOM 0 HE1 MET A 145 1.692 3.134 -7.828 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.497 2.103 -9.035 1.00 0.00 H new ATOM 0 HE3 MET A 145 3.467 3.139 -7.960 1.00 0.00 H new ATOM 2235 N MET A 146 5.829 3.923 -14.223 1.00 0.00 N ATOM 2236 CA MET A 146 5.452 3.572 -15.593 1.00 0.00 C ATOM 2237 C MET A 146 6.453 2.624 -16.169 1.00 0.00 C ATOM 2238 O MET A 146 7.043 1.890 -15.420 1.00 0.00 O ATOM 2239 CB MET A 146 5.378 4.830 -16.453 1.00 0.00 C ATOM 2240 CG MET A 146 4.192 5.677 -16.001 1.00 0.00 C ATOM 2241 SD MET A 146 2.645 4.829 -16.408 1.00 0.00 S ATOM 2242 CE MET A 146 2.502 5.418 -18.115 1.00 0.00 C ATOM 0 H MET A 146 6.425 4.747 -14.145 1.00 0.00 H new ATOM 0 HA MET A 146 4.473 3.093 -15.578 1.00 0.00 H new ATOM 0 HB2 MET A 146 6.303 5.401 -16.364 1.00 0.00 H new ATOM 0 HB3 MET A 146 5.269 4.561 -17.504 1.00 0.00 H new ATOM 0 HG2 MET A 146 4.248 5.855 -14.927 1.00 0.00 H new ATOM 0 HG3 MET A 146 4.222 6.652 -16.488 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.555 5.082 -18.538 1.00 0.00 H new ATOM 0 HE2 MET A 146 2.539 6.507 -18.128 1.00 0.00 H new ATOM 0 HE3 MET A 146 3.326 5.020 -18.707 1.00 0.00 H new ATOM 2252 N THR A 147 6.628 2.643 -17.496 1.00 0.00 N ATOM 2253 CA THR A 147 7.570 1.769 -18.191 1.00 0.00 C ATOM 2254 C THR A 147 8.352 0.917 -17.242 1.00 0.00 C ATOM 2255 O THR A 147 8.242 -0.289 -17.328 1.00 0.00 O ATOM 2256 CB THR A 147 8.550 2.594 -19.020 1.00 0.00 C ATOM 2257 OG1 THR A 147 7.859 3.676 -19.626 1.00 0.00 O ATOM 2258 CG2 THR A 147 9.183 1.711 -20.109 1.00 0.00 C ATOM 0 H THR A 147 6.116 3.269 -18.117 1.00 0.00 H new ATOM 0 HA THR A 147 6.978 1.121 -18.836 1.00 0.00 H new ATOM 0 HB THR A 147 9.336 2.980 -18.372 1.00 0.00 H new ATOM 0 HG1 THR A 147 8.487 4.208 -20.158 1.00 0.00 H new ATOM 0 HG21 THR A 147 9.882 2.305 -20.698 1.00 0.00 H new ATOM 0 HG22 THR A 147 9.715 0.882 -19.642 1.00 0.00 H new ATOM 0 HG23 THR A 147 8.401 1.319 -20.760 1.00 0.00 H new ATOM 2266 N VAL A 148 9.107 1.570 -16.331 1.00 0.00 N ATOM 2267 CA VAL A 148 9.901 0.870 -15.315 1.00 0.00 C ATOM 2268 C VAL A 148 11.335 0.757 -15.780 1.00 0.00 C ATOM 2269 O VAL A 148 12.176 0.175 -15.101 1.00 0.00 O ATOM 2270 CB VAL A 148 9.330 -0.537 -15.036 1.00 0.00 C ATOM 2271 CG1 VAL A 148 10.238 -1.297 -14.092 1.00 0.00 C ATOM 2272 CG2 VAL A 148 7.909 -0.412 -14.436 1.00 0.00 C ATOM 0 H VAL A 148 9.178 2.586 -16.285 1.00 0.00 H new ATOM 0 HA VAL A 148 9.859 1.445 -14.390 1.00 0.00 H new ATOM 0 HB VAL A 148 9.272 -1.090 -15.973 1.00 0.00 H new ATOM 0 HG11 VAL A 148 9.822 -2.287 -13.905 1.00 0.00 H new ATOM 0 HG12 VAL A 148 11.227 -1.398 -14.540 1.00 0.00 H new ATOM 0 HG13 VAL A 148 10.320 -0.754 -13.150 1.00 0.00 H new ATOM 0 HG21 VAL A 148 7.508 -1.406 -14.240 1.00 0.00 H new ATOM 0 HG22 VAL A 148 7.956 0.151 -13.504 1.00 0.00 H new ATOM 0 HG23 VAL A 148 7.261 0.108 -15.141 1.00 0.00 H new ATOM 2282 N ARG A 149 11.616 1.320 -16.949 1.00 0.00 N ATOM 2283 CA ARG A 149 12.966 1.272 -17.504 1.00 0.00 C ATOM 2284 C ARG A 149 13.215 2.467 -18.419 1.00 0.00 C ATOM 2285 O ARG A 149 12.248 3.087 -18.825 1.00 0.00 O ATOM 2286 CB ARG A 149 13.155 -0.029 -18.290 1.00 0.00 C ATOM 2287 CG ARG A 149 12.207 -0.046 -19.491 1.00 0.00 C ATOM 2288 CD ARG A 149 12.288 -1.404 -20.187 1.00 0.00 C ATOM 2289 NE ARG A 149 11.465 -1.401 -21.394 1.00 0.00 N ATOM 2290 CZ ARG A 149 10.174 -1.713 -21.351 1.00 0.00 C ATOM 2291 NH1 ARG A 149 9.617 -2.028 -20.213 1.00 0.00 N ATOM 2292 NH2 ARG A 149 9.463 -1.703 -22.444 1.00 0.00 N ATOM 2293 OXT ARG A 149 14.370 2.736 -18.707 1.00 0.00 O ATOM 0 H ARG A 149 10.935 1.811 -17.528 1.00 0.00 H new ATOM 0 HA ARG A 149 13.681 1.309 -16.682 1.00 0.00 H new ATOM 0 HB2 ARG A 149 14.188 -0.115 -18.628 1.00 0.00 H new ATOM 0 HB3 ARG A 149 12.958 -0.886 -17.646 1.00 0.00 H new ATOM 0 HG2 ARG A 149 11.185 0.146 -19.164 1.00 0.00 H new ATOM 0 HG3 ARG A 149 12.473 0.748 -20.189 1.00 0.00 H new ATOM 0 HD2 ARG A 149 13.323 -1.628 -20.444 1.00 0.00 H new ATOM 0 HD3 ARG A 149 11.951 -2.189 -19.510 1.00 0.00 H new ATOM 0 HE ARG A 149 11.890 -1.154 -22.288 1.00 0.00 H new ATOM 0 HH11 ARG A 149 10.173 -2.034 -19.358 1.00 0.00 H new ATOM 0 HH12 ARG A 149 8.626 -2.268 -20.179 1.00 0.00 H new ATOM 0 HH21 ARG A 149 9.898 -1.456 -23.333 1.00 0.00 H new ATOM 0 HH22 ARG A 149 8.472 -1.943 -22.410 1.00 0.00 H new TER 2307 ARG A 149 ATOM 2308 N ALA B 19 13.673 -3.437 -8.075 1.00 0.00 N ATOM 2309 CA ALA B 19 12.958 -2.862 -6.900 1.00 0.00 C ATOM 2310 C ALA B 19 11.558 -2.423 -7.323 1.00 0.00 C ATOM 2311 O ALA B 19 10.830 -1.803 -6.546 1.00 0.00 O ATOM 2312 CB ALA B 19 13.742 -1.662 -6.365 1.00 0.00 C ATOM 0 HA ALA B 19 12.876 -3.614 -6.116 1.00 0.00 H new ATOM 0 HB1 ALA B 19 13.220 -1.240 -5.506 1.00 0.00 H new ATOM 0 HB2 ALA B 19 14.738 -1.984 -6.062 1.00 0.00 H new ATOM 0 HB3 ALA B 19 13.826 -0.905 -7.145 1.00 0.00 H new ATOM 2320 N ARG B 20 11.191 -2.748 -8.557 1.00 0.00 N ATOM 2321 CA ARG B 20 9.878 -2.378 -9.072 1.00 0.00 C ATOM 2322 C ARG B 20 8.777 -3.061 -8.268 1.00 0.00 C ATOM 2323 O ARG B 20 7.710 -2.487 -8.048 1.00 0.00 O ATOM 2324 CB ARG B 20 9.768 -2.774 -10.547 1.00 0.00 C ATOM 2325 CG ARG B 20 9.811 -4.298 -10.676 1.00 0.00 C ATOM 2326 CD ARG B 20 9.846 -4.685 -12.153 1.00 0.00 C ATOM 2327 NE ARG B 20 9.831 -6.139 -12.290 1.00 0.00 N ATOM 2328 CZ ARG B 20 10.955 -6.847 -12.230 1.00 0.00 C ATOM 2329 NH1 ARG B 20 12.096 -6.244 -12.043 1.00 0.00 N ATOM 2330 NH2 ARG B 20 10.916 -8.145 -12.359 1.00 0.00 N ATOM 0 H ARG B 20 11.778 -3.262 -9.214 1.00 0.00 H new ATOM 0 HA ARG B 20 9.758 -1.299 -8.979 1.00 0.00 H new ATOM 0 HB2 ARG B 20 8.839 -2.390 -10.968 1.00 0.00 H new ATOM 0 HB3 ARG B 20 10.584 -2.328 -11.115 1.00 0.00 H new ATOM 0 HG2 ARG B 20 10.690 -4.692 -10.165 1.00 0.00 H new ATOM 0 HG3 ARG B 20 8.938 -4.739 -10.194 1.00 0.00 H new ATOM 0 HD2 ARG B 20 8.989 -4.254 -12.671 1.00 0.00 H new ATOM 0 HD3 ARG B 20 10.741 -4.277 -12.623 1.00 0.00 H new ATOM 0 HE ARG B 20 8.943 -6.620 -12.434 1.00 0.00 H new ATOM 0 HH11 ARG B 20 12.126 -5.229 -11.943 1.00 0.00 H new ATOM 0 HH12 ARG B 20 12.958 -6.787 -11.997 1.00 0.00 H new ATOM 0 HH21 ARG B 20 10.023 -8.616 -12.506 1.00 0.00 H new ATOM 0 HH22 ARG B 20 11.778 -8.688 -12.313 1.00 0.00 H new ATOM 2344 N GLN B 21 9.039 -4.294 -7.847 1.00 0.00 N ATOM 2345 CA GLN B 21 8.059 -5.048 -7.078 1.00 0.00 C ATOM 2346 C GLN B 21 7.811 -4.384 -5.731 1.00 0.00 C ATOM 2347 O GLN B 21 6.666 -4.234 -5.306 1.00 0.00 O ATOM 2348 CB GLN B 21 8.558 -6.481 -6.859 1.00 0.00 C ATOM 2349 CG GLN B 21 8.605 -7.218 -8.199 1.00 0.00 C ATOM 2350 CD GLN B 21 9.182 -8.616 -8.004 1.00 0.00 C ATOM 2351 OE1 GLN B 21 9.467 -9.020 -6.877 1.00 0.00 O ATOM 2352 NE2 GLN B 21 9.373 -9.384 -9.043 1.00 0.00 N ATOM 0 H GLN B 21 9.914 -4.788 -8.024 1.00 0.00 H new ATOM 0 HA GLN B 21 7.124 -5.070 -7.637 1.00 0.00 H new ATOM 0 HB2 GLN B 21 9.549 -6.466 -6.405 1.00 0.00 H new ATOM 0 HB3 GLN B 21 7.898 -7.005 -6.167 1.00 0.00 H new ATOM 0 HG2 GLN B 21 7.603 -7.285 -8.622 1.00 0.00 H new ATOM 0 HG3 GLN B 21 9.214 -6.660 -8.910 1.00 0.00 H new ATOM 0 HE21 GLN B 21 9.136 -9.048 -9.976 1.00 0.00 H new ATOM 0 HE22 GLN B 21 9.759 -10.320 -8.921 1.00 0.00 H new ATOM 2361 N ARG B 22 8.888 -3.977 -5.069 1.00 0.00 N ATOM 2362 CA ARG B 22 8.771 -3.321 -3.774 1.00 0.00 C ATOM 2363 C ARG B 22 7.960 -2.039 -3.903 1.00 0.00 C ATOM 2364 O ARG B 22 7.102 -1.753 -3.065 1.00 0.00 O ATOM 2365 CB ARG B 22 10.164 -3.006 -3.223 1.00 0.00 C ATOM 2366 CG ARG B 22 10.032 -2.342 -1.844 1.00 0.00 C ATOM 2367 CD ARG B 22 11.325 -2.542 -1.056 1.00 0.00 C ATOM 2368 NE ARG B 22 12.482 -2.412 -1.938 1.00 0.00 N ATOM 2369 CZ ARG B 22 13.630 -3.023 -1.663 1.00 0.00 C ATOM 2370 NH1 ARG B 22 13.738 -3.753 -0.586 1.00 0.00 N ATOM 2371 NH2 ARG B 22 14.649 -2.893 -2.467 1.00 0.00 N ATOM 0 H ARG B 22 9.845 -4.089 -5.405 1.00 0.00 H new ATOM 0 HA ARG B 22 8.257 -3.991 -3.085 1.00 0.00 H new ATOM 0 HB2 ARG B 22 10.750 -3.921 -3.143 1.00 0.00 H new ATOM 0 HB3 ARG B 22 10.696 -2.345 -3.907 1.00 0.00 H new ATOM 0 HG2 ARG B 22 9.825 -1.278 -1.959 1.00 0.00 H new ATOM 0 HG3 ARG B 22 9.192 -2.773 -1.300 1.00 0.00 H new ATOM 0 HD2 ARG B 22 11.387 -1.807 -0.253 1.00 0.00 H new ATOM 0 HD3 ARG B 22 11.325 -3.526 -0.588 1.00 0.00 H new ATOM 0 HE ARG B 22 12.408 -1.842 -2.780 1.00 0.00 H new ATOM 0 HH11 ARG B 22 12.942 -3.854 0.044 1.00 0.00 H new ATOM 0 HH12 ARG B 22 14.619 -4.222 -0.374 1.00 0.00 H new ATOM 0 HH21 ARG B 22 14.565 -2.322 -3.308 1.00 0.00 H new ATOM 0 HH22 ARG B 22 15.529 -3.362 -2.255 1.00 0.00 H new ATOM 2385 N TRP B 23 8.230 -1.276 -4.953 1.00 0.00 N ATOM 2386 CA TRP B 23 7.502 -0.029 -5.171 1.00 0.00 C ATOM 2387 C TRP B 23 6.015 -0.315 -5.374 1.00 0.00 C ATOM 2388 O TRP B 23 5.156 0.293 -4.723 1.00 0.00 O ATOM 2389 CB TRP B 23 8.078 0.692 -6.418 1.00 0.00 C ATOM 2390 CG TRP B 23 8.864 1.891 -6.000 1.00 0.00 C ATOM 2391 CD1 TRP B 23 10.164 2.100 -6.277 1.00 0.00 C ATOM 2392 CD2 TRP B 23 8.418 3.029 -5.208 1.00 0.00 C ATOM 2393 NE1 TRP B 23 10.545 3.304 -5.720 1.00 0.00 N ATOM 2394 CE2 TRP B 23 9.499 3.916 -5.052 1.00 0.00 C ATOM 2395 CE3 TRP B 23 7.189 3.377 -4.624 1.00 0.00 C ATOM 2396 CZ2 TRP B 23 9.374 5.108 -4.336 1.00 0.00 C ATOM 2397 CZ3 TRP B 23 7.056 4.578 -3.904 1.00 0.00 C ATOM 2398 CH2 TRP B 23 8.148 5.439 -3.762 1.00 0.00 C ATOM 0 H TRP B 23 8.935 -1.491 -5.658 1.00 0.00 H new ATOM 0 HA TRP B 23 7.617 0.611 -4.296 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.714 0.009 -6.981 1.00 0.00 H new ATOM 0 HB3 TRP B 23 7.267 0.992 -7.081 1.00 0.00 H new ATOM 0 HD1 TRP B 23 10.803 1.436 -6.841 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.484 3.695 -5.792 1.00 0.00 H new ATOM 0 HE3 TRP B 23 6.340 2.718 -4.729 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 10.221 5.769 -4.228 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 6.106 4.836 -3.459 1.00 0.00 H new ATOM 0 HH2 TRP B 23 8.042 6.360 -3.208 1.00 0.00 H new ATOM 2409 N ARG B 24 5.718 -1.250 -6.275 1.00 0.00 N ATOM 2410 CA ARG B 24 4.334 -1.611 -6.544 1.00 0.00 C ATOM 2411 C ARG B 24 3.718 -2.264 -5.318 1.00 0.00 C ATOM 2412 O ARG B 24 2.534 -2.085 -5.035 1.00 0.00 O ATOM 2413 CB ARG B 24 4.270 -2.568 -7.737 1.00 0.00 C ATOM 2414 CG ARG B 24 4.624 -1.813 -9.029 1.00 0.00 C ATOM 2415 CD ARG B 24 3.364 -1.159 -9.607 1.00 0.00 C ATOM 2416 NE ARG B 24 2.369 -2.181 -9.911 1.00 0.00 N ATOM 2417 CZ ARG B 24 1.158 -1.850 -10.346 1.00 0.00 C ATOM 2418 NH1 ARG B 24 0.845 -0.594 -10.506 1.00 0.00 N ATOM 2419 NH2 ARG B 24 0.283 -2.780 -10.611 1.00 0.00 N ATOM 0 H ARG B 24 6.409 -1.763 -6.823 1.00 0.00 H new ATOM 0 HA ARG B 24 3.771 -0.709 -6.781 1.00 0.00 H new ATOM 0 HB2 ARG B 24 4.962 -3.397 -7.588 1.00 0.00 H new ATOM 0 HB3 ARG B 24 3.271 -2.997 -7.818 1.00 0.00 H new ATOM 0 HG2 ARG B 24 5.378 -1.053 -8.823 1.00 0.00 H new ATOM 0 HG3 ARG B 24 5.055 -2.500 -9.757 1.00 0.00 H new ATOM 0 HD2 ARG B 24 2.956 -0.443 -8.894 1.00 0.00 H new ATOM 0 HD3 ARG B 24 3.614 -0.603 -10.510 1.00 0.00 H new ATOM 0 HE ARG B 24 2.606 -3.165 -9.788 1.00 0.00 H new ATOM 0 HH11 ARG B 24 1.530 0.133 -10.297 1.00 0.00 H new ATOM 0 HH12 ARG B 24 -0.084 -0.339 -10.840 1.00 0.00 H new ATOM 0 HH21 ARG B 24 0.528 -3.762 -10.484 1.00 0.00 H new ATOM 0 HH22 ARG B 24 -0.647 -2.525 -10.945 1.00 0.00 H new ATOM 2433 N SER B 25 4.532 -3.025 -4.591 1.00 0.00 N ATOM 2434 CA SER B 25 4.057 -3.695 -3.387 1.00 0.00 C ATOM 2435 C SER B 25 3.585 -2.667 -2.370 1.00 0.00 C ATOM 2436 O SER B 25 2.524 -2.817 -1.769 1.00 0.00 O ATOM 2437 CB SER B 25 5.178 -4.540 -2.781 1.00 0.00 C ATOM 2438 OG SER B 25 4.688 -5.217 -1.632 1.00 0.00 O ATOM 0 H SER B 25 5.514 -3.191 -4.813 1.00 0.00 H new ATOM 0 HA SER B 25 3.223 -4.344 -3.653 1.00 0.00 H new ATOM 0 HB2 SER B 25 5.543 -5.260 -3.514 1.00 0.00 H new ATOM 0 HB3 SER B 25 6.022 -3.905 -2.511 1.00 0.00 H new ATOM 0 HG SER B 25 5.404 -5.761 -1.242 1.00 0.00 H new ATOM 2444 N SER B 26 4.372 -1.608 -2.192 1.00 0.00 N ATOM 2445 CA SER B 26 4.006 -0.559 -1.244 1.00 0.00 C ATOM 2446 C SER B 26 2.663 0.052 -1.624 1.00 0.00 C ATOM 2447 O SER B 26 1.790 0.242 -0.774 1.00 0.00 O ATOM 2448 CB SER B 26 5.080 0.530 -1.242 1.00 0.00 C ATOM 2449 OG SER B 26 6.321 -0.034 -0.838 1.00 0.00 O ATOM 0 H SER B 26 5.253 -1.455 -2.683 1.00 0.00 H new ATOM 0 HA SER B 26 3.927 -0.997 -0.249 1.00 0.00 H new ATOM 0 HB2 SER B 26 5.173 0.967 -2.236 1.00 0.00 H new ATOM 0 HB3 SER B 26 4.796 1.336 -0.565 1.00 0.00 H new ATOM 0 HG SER B 26 6.497 0.198 0.098 1.00 0.00 H new ATOM 2455 N VAL B 27 2.494 0.341 -2.913 1.00 0.00 N ATOM 2456 CA VAL B 27 1.238 0.914 -3.391 1.00 0.00 C ATOM 2457 C VAL B 27 0.112 -0.108 -3.287 1.00 0.00 C ATOM 2458 O VAL B 27 -1.008 0.221 -2.888 1.00 0.00 O ATOM 2459 CB VAL B 27 1.396 1.374 -4.842 1.00 0.00 C ATOM 2460 CG1 VAL B 27 0.063 1.930 -5.353 1.00 0.00 C ATOM 2461 CG2 VAL B 27 2.479 2.464 -4.920 1.00 0.00 C ATOM 0 H VAL B 27 3.199 0.191 -3.635 1.00 0.00 H new ATOM 0 HA VAL B 27 0.985 1.772 -2.768 1.00 0.00 H new ATOM 0 HB VAL B 27 1.692 0.527 -5.461 1.00 0.00 H new ATOM 0 HG11 VAL B 27 0.177 2.257 -6.386 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.699 1.153 -5.301 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -0.239 2.776 -4.736 1.00 0.00 H new ATOM 0 HG21 VAL B 27 2.592 2.792 -5.953 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.187 3.312 -4.300 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.427 2.062 -4.562 1.00 0.00 H new ATOM 2471 N SER B 28 0.412 -1.349 -3.669 1.00 0.00 N ATOM 2472 CA SER B 28 -0.587 -2.409 -3.625 1.00 0.00 C ATOM 2473 C SER B 28 -1.075 -2.628 -2.201 1.00 0.00 C ATOM 2474 O SER B 28 -2.276 -2.787 -1.962 1.00 0.00 O ATOM 2475 CB SER B 28 0.010 -3.707 -4.171 1.00 0.00 C ATOM 2476 OG SER B 28 0.438 -3.504 -5.511 1.00 0.00 O ATOM 0 H SER B 28 1.329 -1.640 -4.008 1.00 0.00 H new ATOM 0 HA SER B 28 -1.435 -2.111 -4.242 1.00 0.00 H new ATOM 0 HB2 SER B 28 0.851 -4.021 -3.553 1.00 0.00 H new ATOM 0 HB3 SER B 28 -0.731 -4.506 -4.131 1.00 0.00 H new ATOM 0 HG SER B 28 1.393 -3.285 -5.520 1.00 0.00 H new ATOM 2482 N ILE B 29 -0.143 -2.611 -1.254 1.00 0.00 N ATOM 2483 CA ILE B 29 -0.493 -2.790 0.149 1.00 0.00 C ATOM 2484 C ILE B 29 -1.421 -1.670 0.607 1.00 0.00 C ATOM 2485 O ILE B 29 -2.390 -1.913 1.328 1.00 0.00 O ATOM 2486 CB ILE B 29 0.773 -2.812 1.008 1.00 0.00 C ATOM 2487 CG1 ILE B 29 1.544 -4.111 0.752 1.00 0.00 C ATOM 2488 CG2 ILE B 29 0.392 -2.724 2.486 1.00 0.00 C ATOM 2489 CD1 ILE B 29 2.962 -3.980 1.311 1.00 0.00 C ATOM 0 H ILE B 29 0.852 -2.476 -1.431 1.00 0.00 H new ATOM 0 HA ILE B 29 -1.011 -3.742 0.263 1.00 0.00 H new ATOM 0 HB ILE B 29 1.402 -1.961 0.747 1.00 0.00 H new ATOM 0 HG12 ILE B 29 1.032 -4.950 1.223 1.00 0.00 H new ATOM 0 HG13 ILE B 29 1.581 -4.320 -0.317 1.00 0.00 H new ATOM 0 HG21 ILE B 29 1.295 -2.740 3.096 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -0.152 -1.797 2.667 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -0.239 -3.572 2.750 1.00 0.00 H new ATOM 0 HD11 ILE B 29 3.511 -4.904 1.129 1.00 0.00 H new ATOM 0 HD12 ILE B 29 3.472 -3.152 0.819 1.00 0.00 H new ATOM 0 HD13 ILE B 29 2.914 -3.791 2.383 1.00 0.00 H new ATOM 2501 N VAL B 30 -1.115 -0.451 0.187 1.00 0.00 N ATOM 2502 CA VAL B 30 -1.929 0.696 0.561 1.00 0.00 C ATOM 2503 C VAL B 30 -3.365 0.485 0.092 1.00 0.00 C ATOM 2504 O VAL B 30 -4.316 0.778 0.820 1.00 0.00 O ATOM 2505 CB VAL B 30 -1.359 1.971 -0.068 1.00 0.00 C ATOM 2506 CG1 VAL B 30 -2.351 3.125 0.103 1.00 0.00 C ATOM 2507 CG2 VAL B 30 -0.039 2.329 0.620 1.00 0.00 C ATOM 0 H VAL B 30 -0.316 -0.232 -0.408 1.00 0.00 H new ATOM 0 HA VAL B 30 -1.918 0.801 1.646 1.00 0.00 H new ATOM 0 HB VAL B 30 -1.186 1.801 -1.131 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -1.939 4.028 -0.347 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -3.291 2.872 -0.387 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -2.530 3.297 1.164 1.00 0.00 H new ATOM 0 HG21 VAL B 30 0.369 3.236 0.174 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -0.216 2.495 1.683 1.00 0.00 H new ATOM 0 HG23 VAL B 30 0.671 1.511 0.493 1.00 0.00 H new ATOM 2517 N LYS B 31 -3.517 -0.022 -1.130 1.00 0.00 N ATOM 2518 CA LYS B 31 -4.852 -0.270 -1.672 1.00 0.00 C ATOM 2519 C LYS B 31 -5.601 -1.262 -0.790 1.00 0.00 C ATOM 2520 O LYS B 31 -6.771 -1.056 -0.469 1.00 0.00 O ATOM 2521 CB LYS B 31 -4.723 -0.823 -3.103 1.00 0.00 C ATOM 2522 CG LYS B 31 -4.911 0.304 -4.117 1.00 0.00 C ATOM 2523 CD LYS B 31 -4.649 -0.224 -5.523 1.00 0.00 C ATOM 2524 CE LYS B 31 -5.093 0.821 -6.545 1.00 0.00 C ATOM 2525 NZ LYS B 31 -4.580 2.161 -6.145 1.00 0.00 N ATOM 0 H LYS B 31 -2.748 -0.265 -1.754 1.00 0.00 H new ATOM 0 HA LYS B 31 -5.414 0.664 -1.694 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -3.744 -1.284 -3.237 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -5.468 -1.601 -3.270 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -5.924 0.702 -4.050 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -4.230 1.125 -3.893 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -3.589 -0.446 -5.649 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -5.191 -1.157 -5.681 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -4.719 0.558 -7.535 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -6.181 0.841 -6.610 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -4.673 2.821 -6.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -5.130 2.516 -5.337 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -3.579 2.083 -5.875 1.00 0.00 H new ATOM 2539 N ASN B 32 -4.922 -2.335 -0.408 1.00 0.00 N ATOM 2540 CA ASN B 32 -5.532 -3.350 0.439 1.00 0.00 C ATOM 2541 C ASN B 32 -5.743 -2.801 1.842 1.00 0.00 C ATOM 2542 O ASN B 32 -6.688 -3.176 2.537 1.00 0.00 O ATOM 2543 CB ASN B 32 -4.642 -4.592 0.499 1.00 0.00 C ATOM 2544 CG ASN B 32 -4.605 -5.267 -0.867 1.00 0.00 C ATOM 2545 OD1 ASN B 32 -3.567 -5.272 -1.529 1.00 0.00 O ATOM 2546 ND2 ASN B 32 -5.681 -5.842 -1.331 1.00 0.00 N ATOM 0 H ASN B 32 -3.954 -2.524 -0.669 1.00 0.00 H new ATOM 0 HA ASN B 32 -6.497 -3.625 0.014 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -3.633 -4.314 0.805 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -5.022 -5.287 1.248 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -5.663 -6.297 -2.244 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -6.540 -5.837 -0.781 1.00 0.00 H new ATOM 2553 N ARG B 33 -4.837 -1.921 2.271 1.00 0.00 N ATOM 2554 CA ARG B 33 -4.920 -1.338 3.609 1.00 0.00 C ATOM 2555 C ARG B 33 -5.484 0.072 3.543 1.00 0.00 C ATOM 2556 O ARG B 33 -5.349 0.846 4.490 1.00 0.00 O ATOM 2557 CB ARG B 33 -3.527 -1.305 4.253 1.00 0.00 C ATOM 2558 CG ARG B 33 -3.665 -1.290 5.779 1.00 0.00 C ATOM 2559 CD ARG B 33 -2.323 -0.935 6.409 1.00 0.00 C ATOM 2560 NE ARG B 33 -1.274 -1.787 5.865 1.00 0.00 N ATOM 2561 CZ ARG B 33 -1.039 -2.997 6.357 1.00 0.00 C ATOM 2562 NH1 ARG B 33 -1.756 -3.446 7.347 1.00 0.00 N ATOM 2563 NH2 ARG B 33 -0.091 -3.738 5.850 1.00 0.00 N ATOM 0 H ARG B 33 -4.044 -1.599 1.716 1.00 0.00 H new ATOM 0 HA ARG B 33 -5.585 -1.955 4.213 1.00 0.00 H new ATOM 0 HB2 ARG B 33 -2.950 -2.174 3.939 1.00 0.00 H new ATOM 0 HB3 ARG B 33 -2.982 -0.422 3.919 1.00 0.00 H new ATOM 0 HG2 ARG B 33 -4.422 -0.566 6.079 1.00 0.00 H new ATOM 0 HG3 ARG B 33 -3.998 -2.265 6.134 1.00 0.00 H new ATOM 0 HD2 ARG B 33 -2.088 0.112 6.217 1.00 0.00 H new ATOM 0 HD3 ARG B 33 -2.377 -1.057 7.491 1.00 0.00 H new ATOM 0 HE ARG B 33 -0.707 -1.446 5.088 1.00 0.00 H new ATOM 0 HH11 ARG B 33 -2.497 -2.868 7.743 1.00 0.00 H new ATOM 0 HH12 ARG B 33 -1.577 -4.376 7.726 1.00 0.00 H new ATOM 0 HH21 ARG B 33 0.471 -3.387 5.074 1.00 0.00 H new ATOM 0 HH22 ARG B 33 0.088 -4.668 6.230 1.00 0.00 H new ATOM 2577 N ALA B 34 -6.099 0.409 2.413 1.00 0.00 N ATOM 2578 CA ALA B 34 -6.676 1.739 2.231 1.00 0.00 C ATOM 2579 C ALA B 34 -7.281 2.257 3.536 1.00 0.00 C ATOM 2580 O ALA B 34 -8.442 1.992 3.842 1.00 0.00 O ATOM 2581 CB ALA B 34 -7.764 1.690 1.158 1.00 0.00 C ATOM 0 H ALA B 34 -6.211 -0.215 1.614 1.00 0.00 H new ATOM 0 HA ALA B 34 -5.878 2.415 1.922 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -8.191 2.684 1.027 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -7.331 1.354 0.216 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -8.547 0.997 1.465 1.00 0.00 H new ATOM 2587 N ARG B 35 -6.474 2.979 4.304 1.00 0.00 N ATOM 2588 CA ARG B 35 -6.931 3.520 5.576 1.00 0.00 C ATOM 2589 C ARG B 35 -7.865 4.697 5.340 1.00 0.00 C ATOM 2590 O ARG B 35 -8.592 5.122 6.238 1.00 0.00 O ATOM 2591 CB ARG B 35 -5.735 3.967 6.419 1.00 0.00 C ATOM 2592 CG ARG B 35 -6.223 4.436 7.792 1.00 0.00 C ATOM 2593 CD ARG B 35 -5.024 4.671 8.708 1.00 0.00 C ATOM 2594 NE ARG B 35 -4.184 5.740 8.178 1.00 0.00 N ATOM 2595 CZ ARG B 35 -3.020 6.040 8.743 1.00 0.00 C ATOM 2596 NH1 ARG B 35 -2.609 5.376 9.789 1.00 0.00 N ATOM 2597 NH2 ARG B 35 -2.285 6.999 8.251 1.00 0.00 N ATOM 0 H ARG B 35 -5.507 3.202 4.070 1.00 0.00 H new ATOM 0 HA ARG B 35 -7.472 2.740 6.113 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -5.030 3.144 6.534 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.203 4.774 5.915 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -6.801 5.354 7.690 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -6.886 3.689 8.228 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -5.368 4.932 9.709 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -4.442 3.754 8.800 1.00 0.00 H new ATOM 0 HE ARG B 35 -4.496 6.265 7.361 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -3.182 4.625 10.174 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -1.715 5.608 10.221 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -2.604 7.518 7.433 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -1.391 7.230 8.684 1.00 0.00 H new ATOM 2611 N ARG B 36 -7.842 5.231 4.120 1.00 0.00 N ATOM 2612 CA ARG B 36 -8.690 6.373 3.779 1.00 0.00 C ATOM 2613 C ARG B 36 -9.988 5.889 3.143 1.00 0.00 C ATOM 2614 O ARG B 36 -10.880 6.676 2.862 1.00 0.00 O ATOM 2615 CB ARG B 36 -7.956 7.299 2.806 1.00 0.00 C ATOM 2616 CG ARG B 36 -8.616 8.680 2.809 1.00 0.00 C ATOM 2617 CD ARG B 36 -7.954 9.564 1.757 1.00 0.00 C ATOM 2618 NE ARG B 36 -6.559 9.803 2.105 1.00 0.00 N ATOM 2619 CZ ARG B 36 -6.227 10.649 3.076 1.00 0.00 C ATOM 2620 NH1 ARG B 36 -7.157 11.284 3.734 1.00 0.00 N ATOM 2621 NH2 ARG B 36 -4.969 10.845 3.367 1.00 0.00 N ATOM 0 H ARG B 36 -7.252 4.896 3.358 1.00 0.00 H new ATOM 0 HA ARG B 36 -8.921 6.922 4.692 1.00 0.00 H new ATOM 0 HB2 ARG B 36 -6.908 7.386 3.092 1.00 0.00 H new ATOM 0 HB3 ARG B 36 -7.978 6.877 1.801 1.00 0.00 H new ATOM 0 HG2 ARG B 36 -9.682 8.586 2.601 1.00 0.00 H new ATOM 0 HG3 ARG B 36 -8.523 9.137 3.794 1.00 0.00 H new ATOM 0 HD2 ARG B 36 -8.016 9.086 0.779 1.00 0.00 H new ATOM 0 HD3 ARG B 36 -8.485 10.513 1.682 1.00 0.00 H new ATOM 0 HE ARG B 36 -5.824 9.313 1.595 1.00 0.00 H new ATOM 0 HH11 ARG B 36 -8.139 11.132 3.504 1.00 0.00 H new ATOM 0 HH12 ARG B 36 -6.902 11.933 4.479 1.00 0.00 H new ATOM 0 HH21 ARG B 36 -4.243 10.350 2.850 1.00 0.00 H new ATOM 0 HH22 ARG B 36 -4.713 11.494 4.111 1.00 0.00 H new ATOM 2635 N PHE B 37 -10.091 4.583 2.929 1.00 0.00 N ATOM 2636 CA PHE B 37 -11.296 4.007 2.330 1.00 0.00 C ATOM 2637 C PHE B 37 -11.513 4.576 0.927 1.00 0.00 C ATOM 2638 O PHE B 37 -12.456 5.316 0.680 1.00 0.00 O ATOM 2639 CB PHE B 37 -12.520 4.310 3.224 1.00 0.00 C ATOM 2640 CG PHE B 37 -12.060 4.602 4.632 1.00 0.00 C ATOM 2641 CD1 PHE B 37 -11.559 3.570 5.429 1.00 0.00 C ATOM 2642 CD2 PHE B 37 -12.134 5.907 5.136 1.00 0.00 C ATOM 2643 CE1 PHE B 37 -11.133 3.840 6.733 1.00 0.00 C ATOM 2644 CE2 PHE B 37 -11.709 6.178 6.437 1.00 0.00 C ATOM 2645 CZ PHE B 37 -11.209 5.144 7.239 1.00 0.00 C ATOM 0 H PHE B 37 -9.364 3.905 3.158 1.00 0.00 H new ATOM 0 HA PHE B 37 -11.172 2.927 2.251 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -13.071 5.162 2.827 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -13.203 3.460 3.223 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -11.501 2.565 5.038 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -12.520 6.704 4.517 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -10.745 3.043 7.350 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -11.765 7.184 6.825 1.00 0.00 H new ATOM 0 HZ PHE B 37 -10.882 5.352 8.247 1.00 0.00 H new ATOM 2655 N ARG B 38 -10.632 4.232 0.015 1.00 0.00 N ATOM 2656 CA ARG B 38 -10.732 4.738 -1.348 1.00 0.00 C ATOM 2657 C ARG B 38 -12.121 4.469 -1.918 1.00 0.00 C ATOM 2658 O ARG B 38 -12.705 5.326 -2.582 1.00 0.00 O ATOM 2659 CB ARG B 38 -9.684 4.050 -2.227 1.00 0.00 C ATOM 2660 CG ARG B 38 -8.293 4.314 -1.658 1.00 0.00 C ATOM 2661 CD ARG B 38 -7.254 3.493 -2.428 1.00 0.00 C ATOM 2662 NE ARG B 38 -7.168 3.966 -3.810 1.00 0.00 N ATOM 2663 CZ ARG B 38 -7.887 3.405 -4.780 1.00 0.00 C ATOM 2664 NH1 ARG B 38 -8.694 2.414 -4.504 1.00 0.00 N ATOM 2665 NH2 ARG B 38 -7.789 3.845 -6.002 1.00 0.00 N ATOM 0 H ARG B 38 -9.842 3.609 0.183 1.00 0.00 H new ATOM 0 HA ARG B 38 -10.558 5.814 -1.334 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -9.875 2.978 -2.268 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -9.748 4.424 -3.249 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -8.056 5.376 -1.729 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -8.267 4.051 -0.600 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -6.281 3.577 -1.945 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -7.527 2.438 -2.412 1.00 0.00 H new ATOM 0 HE ARG B 38 -6.545 4.741 -4.035 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -8.772 2.072 -3.546 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -9.245 1.983 -5.246 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -7.161 4.620 -6.216 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -8.340 3.415 -6.745 1.00 0.00 H new ATOM 2679 N MET B 39 -12.637 3.276 -1.662 1.00 0.00 N ATOM 2680 CA MET B 39 -13.953 2.908 -2.163 1.00 0.00 C ATOM 2681 C MET B 39 -15.042 3.780 -1.542 1.00 0.00 C ATOM 2682 O MET B 39 -15.748 4.506 -2.244 1.00 0.00 O ATOM 2683 CB MET B 39 -14.245 1.438 -1.857 1.00 0.00 C ATOM 2684 CG MET B 39 -15.494 0.985 -2.621 1.00 0.00 C ATOM 2685 SD MET B 39 -15.098 0.830 -4.381 1.00 0.00 S ATOM 2686 CE MET B 39 -16.800 0.783 -4.992 1.00 0.00 C ATOM 0 H MET B 39 -12.170 2.552 -1.116 1.00 0.00 H new ATOM 0 HA MET B 39 -13.953 3.064 -3.242 1.00 0.00 H new ATOM 0 HB2 MET B 39 -13.391 0.822 -2.140 1.00 0.00 H new ATOM 0 HB3 MET B 39 -14.394 1.303 -0.786 1.00 0.00 H new ATOM 0 HG2 MET B 39 -15.846 0.030 -2.231 1.00 0.00 H new ATOM 0 HG3 MET B 39 -16.301 1.704 -2.480 1.00 0.00 H new ATOM 0 HE1 MET B 39 -16.794 0.688 -6.078 1.00 0.00 H new ATOM 0 HE2 MET B 39 -17.320 -0.070 -4.556 1.00 0.00 H new ATOM 0 HE3 MET B 39 -17.313 1.703 -4.711 1.00 0.00 H new ATOM 2696 N ILE B 40 -15.181 3.688 -0.226 1.00 0.00 N ATOM 2697 CA ILE B 40 -16.197 4.458 0.475 1.00 0.00 C ATOM 2698 C ILE B 40 -15.939 5.953 0.325 1.00 0.00 C ATOM 2699 O ILE B 40 -16.865 6.727 0.082 1.00 0.00 O ATOM 2700 CB ILE B 40 -16.202 4.082 1.962 1.00 0.00 C ATOM 2701 CG1 ILE B 40 -16.687 2.638 2.124 1.00 0.00 C ATOM 2702 CG2 ILE B 40 -17.138 5.020 2.729 1.00 0.00 C ATOM 2703 CD1 ILE B 40 -16.428 2.166 3.558 1.00 0.00 C ATOM 0 H ILE B 40 -14.608 3.093 0.372 1.00 0.00 H new ATOM 0 HA ILE B 40 -17.168 4.226 0.038 1.00 0.00 H new ATOM 0 HB ILE B 40 -15.191 4.175 2.359 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -17.751 2.573 1.896 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -16.170 1.989 1.418 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -17.139 4.750 3.785 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -16.794 6.048 2.618 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -18.149 4.931 2.331 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -16.774 1.139 3.671 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -15.360 2.215 3.770 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -16.966 2.808 4.255 1.00 0.00 H new ATOM 2715 N SER B 41 -14.685 6.350 0.476 1.00 0.00 N ATOM 2716 CA SER B 41 -14.323 7.758 0.362 1.00 0.00 C ATOM 2717 C SER B 41 -14.749 8.301 -1.000 1.00 0.00 C ATOM 2718 O SER B 41 -15.343 9.376 -1.089 1.00 0.00 O ATOM 2719 CB SER B 41 -12.811 7.919 0.512 1.00 0.00 C ATOM 2720 OG SER B 41 -12.159 7.279 -0.574 1.00 0.00 O ATOM 0 H SER B 41 -13.905 5.724 0.676 1.00 0.00 H new ATOM 0 HA SER B 41 -14.832 8.313 1.150 1.00 0.00 H new ATOM 0 HB2 SER B 41 -12.547 8.976 0.537 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.480 7.486 1.456 1.00 0.00 H new ATOM 0 HG SER B 41 -12.519 6.374 -0.685 1.00 0.00 H new ATOM 2726 N ASN B 42 -14.456 7.548 -2.055 1.00 0.00 N ATOM 2727 CA ASN B 42 -14.826 7.961 -3.403 1.00 0.00 C ATOM 2728 C ASN B 42 -16.338 7.990 -3.559 1.00 0.00 C ATOM 2729 O ASN B 42 -16.892 8.900 -4.179 1.00 0.00 O ATOM 2730 CB ASN B 42 -14.225 7.000 -4.431 1.00 0.00 C ATOM 2731 CG ASN B 42 -12.716 7.198 -4.505 1.00 0.00 C ATOM 2732 OD1 ASN B 42 -12.204 8.237 -4.088 1.00 0.00 O ATOM 2733 ND2 ASN B 42 -11.968 6.257 -5.015 1.00 0.00 N ATOM 0 H ASN B 42 -13.967 6.654 -2.003 1.00 0.00 H new ATOM 0 HA ASN B 42 -14.435 8.964 -3.572 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -14.452 5.970 -4.156 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -14.672 7.174 -5.410 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -10.957 6.382 -5.069 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -12.395 5.397 -5.360 1.00 0.00 H new ATOM 2740 N LEU B 43 -17.009 6.983 -2.997 1.00 0.00 N ATOM 2741 CA LEU B 43 -18.466 6.904 -3.087 1.00 0.00 C ATOM 2742 C LEU B 43 -19.102 7.276 -1.751 1.00 0.00 C ATOM 2743 O LEU B 43 -19.665 8.353 -1.668 1.00 0.00 O ATOM 2744 CB LEU B 43 -18.881 5.476 -3.482 1.00 0.00 C ATOM 2745 CG LEU B 43 -20.215 5.520 -4.236 1.00 0.00 C ATOM 2746 CD1 LEU B 43 -20.618 4.106 -4.645 1.00 0.00 C ATOM 2747 CD2 LEU B 43 -21.293 6.124 -3.332 1.00 0.00 C ATOM 2748 OXT LEU B 43 -19.029 6.469 -0.840 1.00 0.00 O ATOM 0 H LEU B 43 -16.572 6.220 -2.481 1.00 0.00 H new ATOM 0 HA LEU B 43 -18.812 7.606 -3.845 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -18.112 5.023 -4.108 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -18.975 4.854 -2.592 1.00 0.00 H new ATOM 0 HG LEU B 43 -20.108 6.135 -5.129 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -21.567 4.139 -5.181 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -19.850 3.682 -5.292 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -20.725 3.486 -3.755 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -22.242 6.155 -3.868 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -21.402 5.512 -2.437 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -21.004 7.135 -3.047 1.00 0.00 H new TER 2760 LEU B 43 HETATM 2761 CA CA A 179 -20.251 2.027 15.838 1.00 0.00 CA HETATM 2762 CA CA A 192 -25.269 -6.167 6.905 1.00 0.00 CA HETATM 2763 CA CA A 221 9.716 14.405 1.594 1.00 0.00 CA HETATM 2764 CA CA A 234 16.362 11.961 -7.674 1.00 0.00 CA