USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 855 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 169 THR OG1 : rot -88:sc= -0.482 USER MOD Set 1.2: A 172 GLN :FLIP amide:sc= -0.539 F(o=-4.5,f=-1) USER MOD Set 2.1: A 125 GLN : amide:sc= 0 X(o=-0.6,f=-0.55) USER MOD Set 2.2: A 168 MET CE :methyl -157:sc= -0.601 (180deg=-1.01) USER MOD Set 3.1: A 122 TYR OH : rot -31:sc= -0.0165 USER MOD Set 3.2: A 165 TYR OH : rot -86:sc= 0.972 USER MOD Set 4.1: A 111 CYS SG : rot 65:sc= -0.0957 USER MOD Set 4.2: A 186 MET CE :methyl 159:sc= -0.0645 (180deg=-0.898) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 MET CE :methyl -158:sc= -0.387 (180deg=-1.33) USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 88 THR OG1 : rot -93:sc= 0.0718 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 CYS SG : rot 37:sc= 0.0276 USER MOD Single : A 99 GLN : amide:sc= -0.321 K(o=-0.32,f=-2.2!) USER MOD Single : A 102 GLN : amide:sc= -0.182 K(o=-0.18,f=-3!) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 84:sc= -1.56 USER MOD Single : A 123 THR OG1 : rot 77:sc= 0.877 USER MOD Single : A 126 SER OG : rot 143:sc= 0.301 USER MOD Single : A 131 TYR OH : rot -11:sc= 0.00533 USER MOD Single : A 136 HIS : no HD1:sc= -0.227 X(o=-0.23,f=-0.057) USER MOD Single : A 140 TYR OH : rot 165:sc= -0.508 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 ASN : amide:sc= -0.497 X(o=-0.5,f=0) USER MOD Single : A 150 GLN :FLIP amide:sc= -3.86! C(o=-4.9!,f=-3.9!) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.0796 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl -108:sc= -1.12 (180deg=-2.72) USER MOD Single : A 162 HIS : no HD1:sc= -3.57 X(o=-3.6,f=-3.1) USER MOD Single : A 163 LYS NZ :NH3+ -147:sc= 0.295 (180deg=-0.0274) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 180 ASN : amide:sc= -0.179 K(o=-0.18,f=-1.2) USER MOD Single : A 182 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.118) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 SER OG : rot 180:sc= 0 USER MOD Single : A 187 TYR OH : rot 150:sc= -0.539 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 79 25.055 19.898 2.642 1.00 0.00 N ATOM 2 CA GLY A 79 23.568 19.824 2.664 1.00 0.00 C ATOM 3 C GLY A 79 22.998 19.228 1.393 1.00 0.00 C ATOM 4 O GLY A 79 23.257 18.067 1.073 1.00 0.00 O ATOM 0 HA2 GLY A 79 23.250 19.225 3.517 1.00 0.00 H new ATOM 0 HA3 GLY A 79 23.160 20.824 2.807 1.00 0.00 H new ATOM 10 N SER A 80 22.219 20.022 0.665 1.00 0.00 N ATOM 11 CA SER A 80 21.610 19.566 -0.579 1.00 0.00 C ATOM 12 C SER A 80 20.681 18.383 -0.329 1.00 0.00 C ATOM 13 O SER A 80 21.129 17.296 0.036 1.00 0.00 O ATOM 14 CB SER A 80 22.692 19.176 -1.587 1.00 0.00 C ATOM 15 OG SER A 80 23.794 20.065 -1.523 1.00 0.00 O ATOM 0 H SER A 80 21.995 20.985 0.916 1.00 0.00 H new ATOM 0 HA SER A 80 21.021 20.387 -0.988 1.00 0.00 H new ATOM 0 HB2 SER A 80 23.029 18.159 -1.388 1.00 0.00 H new ATOM 0 HB3 SER A 80 22.274 19.182 -2.594 1.00 0.00 H new ATOM 0 HG SER A 80 24.472 19.793 -2.176 1.00 0.00 H new ATOM 21 N HIS A 81 19.386 18.601 -0.529 1.00 0.00 N ATOM 22 CA HIS A 81 18.393 17.553 -0.325 1.00 0.00 C ATOM 23 C HIS A 81 17.789 17.110 -1.654 1.00 0.00 C ATOM 24 O HIS A 81 17.571 15.920 -1.883 1.00 0.00 O ATOM 25 CB HIS A 81 17.288 18.043 0.612 1.00 0.00 C ATOM 26 CG HIS A 81 17.793 18.498 1.946 1.00 0.00 C ATOM 27 ND1 HIS A 81 17.812 17.686 3.061 1.00 0.00 N ATOM 28 CD2 HIS A 81 18.303 19.688 2.342 1.00 0.00 C ATOM 29 CE1 HIS A 81 18.309 18.358 4.084 1.00 0.00 C ATOM 30 NE2 HIS A 81 18.615 19.575 3.674 1.00 0.00 N ATOM 0 H HIS A 81 18.999 19.495 -0.832 1.00 0.00 H new ATOM 0 HA HIS A 81 18.893 16.698 0.130 1.00 0.00 H new ATOM 0 HB2 HIS A 81 16.756 18.866 0.134 1.00 0.00 H new ATOM 0 HB3 HIS A 81 16.566 17.240 0.760 1.00 0.00 H new ATOM 0 HD2 HIS A 81 18.439 20.564 1.725 1.00 0.00 H new ATOM 0 HE1 HIS A 81 18.442 17.977 5.086 1.00 0.00 H new ATOM 0 HE2 HIS A 81 19.018 20.312 4.253 1.00 0.00 H new ATOM 39 N MET A 82 17.521 18.075 -2.527 1.00 0.00 N ATOM 40 CA MET A 82 16.942 17.785 -3.834 1.00 0.00 C ATOM 41 C MET A 82 17.994 17.213 -4.779 1.00 0.00 C ATOM 42 O MET A 82 19.171 17.568 -4.702 1.00 0.00 O ATOM 43 CB MET A 82 16.331 19.050 -4.438 1.00 0.00 C ATOM 44 CG MET A 82 15.246 19.673 -3.575 1.00 0.00 C ATOM 45 SD MET A 82 13.775 18.638 -3.454 1.00 0.00 S ATOM 46 CE MET A 82 13.407 18.369 -5.186 1.00 0.00 C ATOM 0 H MET A 82 17.695 19.065 -2.353 1.00 0.00 H new ATOM 0 HA MET A 82 16.157 17.041 -3.699 1.00 0.00 H new ATOM 0 HB2 MET A 82 17.121 19.783 -4.600 1.00 0.00 H new ATOM 0 HB3 MET A 82 15.913 18.811 -5.416 1.00 0.00 H new ATOM 0 HG2 MET A 82 15.641 19.854 -2.575 1.00 0.00 H new ATOM 0 HG3 MET A 82 14.970 20.643 -3.989 1.00 0.00 H new ATOM 0 HE1 MET A 82 12.357 18.100 -5.297 1.00 0.00 H new ATOM 0 HE2 MET A 82 13.609 19.282 -5.747 1.00 0.00 H new ATOM 0 HE3 MET A 82 14.031 17.562 -5.569 1.00 0.00 H new ATOM 56 N ASP A 83 17.564 16.325 -5.669 1.00 0.00 N ATOM 57 CA ASP A 83 18.470 15.703 -6.628 1.00 0.00 C ATOM 58 C ASP A 83 17.751 15.398 -7.942 1.00 0.00 C ATOM 59 O ASP A 83 16.929 14.485 -8.008 1.00 0.00 O ATOM 60 CB ASP A 83 19.056 14.416 -6.043 1.00 0.00 C ATOM 61 CG ASP A 83 20.467 14.608 -5.523 1.00 0.00 C ATOM 62 OD1 ASP A 83 21.412 14.556 -6.338 1.00 0.00 O ATOM 63 OD2 ASP A 83 20.627 14.811 -4.301 1.00 0.00 O ATOM 0 H ASP A 83 16.594 16.020 -5.746 1.00 0.00 H new ATOM 0 HA ASP A 83 19.279 16.404 -6.834 1.00 0.00 H new ATOM 0 HB2 ASP A 83 18.418 14.065 -5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.056 13.639 -6.808 1.00 0.00 H new ATOM 68 N PRO A 84 18.052 16.159 -9.012 1.00 0.00 N ATOM 69 CA PRO A 84 17.426 15.956 -10.323 1.00 0.00 C ATOM 70 C PRO A 84 17.878 14.660 -10.993 1.00 0.00 C ATOM 71 O PRO A 84 17.320 14.252 -12.012 1.00 0.00 O ATOM 72 CB PRO A 84 17.894 17.167 -11.133 1.00 0.00 C ATOM 73 CG PRO A 84 19.173 17.579 -10.493 1.00 0.00 C ATOM 74 CD PRO A 84 19.022 17.271 -9.029 1.00 0.00 C ATOM 0 HA PRO A 84 16.342 15.870 -10.245 1.00 0.00 H new ATOM 0 HB2 PRO A 84 18.041 16.909 -12.182 1.00 0.00 H new ATOM 0 HB3 PRO A 84 17.159 17.971 -11.103 1.00 0.00 H new ATOM 0 HG2 PRO A 84 20.016 17.036 -10.921 1.00 0.00 H new ATOM 0 HG3 PRO A 84 19.364 18.640 -10.651 1.00 0.00 H new ATOM 0 HD2 PRO A 84 19.972 16.983 -8.579 1.00 0.00 H new ATOM 0 HD3 PRO A 84 18.655 18.133 -8.473 1.00 0.00 H new ATOM 82 N ALA A 85 18.890 14.015 -10.418 1.00 0.00 N ATOM 83 CA ALA A 85 19.411 12.768 -10.964 1.00 0.00 C ATOM 84 C ALA A 85 18.777 11.554 -10.288 1.00 0.00 C ATOM 85 O ALA A 85 18.901 10.430 -10.773 1.00 0.00 O ATOM 86 CB ALA A 85 20.925 12.722 -10.818 1.00 0.00 C ATOM 0 H ALA A 85 19.364 14.336 -9.574 1.00 0.00 H new ATOM 0 HA ALA A 85 19.153 12.733 -12.022 1.00 0.00 H new ATOM 0 HB1 ALA A 85 21.302 11.786 -11.230 1.00 0.00 H new ATOM 0 HB2 ALA A 85 21.368 13.560 -11.357 1.00 0.00 H new ATOM 0 HB3 ALA A 85 21.191 12.788 -9.763 1.00 0.00 H new ATOM 92 N GLN A 86 18.096 11.785 -9.167 1.00 0.00 N ATOM 93 CA GLN A 86 17.446 10.705 -8.434 1.00 0.00 C ATOM 94 C GLN A 86 16.010 10.509 -8.911 1.00 0.00 C ATOM 95 O GLN A 86 15.085 10.404 -8.104 1.00 0.00 O ATOM 96 CB GLN A 86 17.464 10.999 -6.932 1.00 0.00 C ATOM 97 CG GLN A 86 18.825 10.794 -6.288 1.00 0.00 C ATOM 98 CD GLN A 86 18.748 10.719 -4.775 1.00 0.00 C ATOM 99 OE1 GLN A 86 18.566 11.732 -4.101 1.00 0.00 O ATOM 100 NE2 GLN A 86 18.887 9.514 -4.234 1.00 0.00 N ATOM 0 H GLN A 86 17.981 12.708 -8.749 1.00 0.00 H new ATOM 0 HA GLN A 86 17.999 9.785 -8.624 1.00 0.00 H new ATOM 0 HB2 GLN A 86 17.145 12.028 -6.768 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.736 10.357 -6.436 1.00 0.00 H new ATOM 0 HG2 GLN A 86 19.270 9.876 -6.672 1.00 0.00 H new ATOM 0 HG3 GLN A 86 19.486 11.612 -6.575 1.00 0.00 H new ATOM 0 HE21 GLN A 86 19.036 8.701 -4.831 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.844 9.402 -3.221 1.00 0.00 H new ATOM 109 N LEU A 87 15.830 10.460 -10.226 1.00 0.00 N ATOM 110 CA LEU A 87 14.507 10.276 -10.812 1.00 0.00 C ATOM 111 C LEU A 87 14.239 8.802 -11.104 1.00 0.00 C ATOM 112 O LEU A 87 13.091 8.359 -11.102 1.00 0.00 O ATOM 113 CB LEU A 87 14.378 11.092 -12.099 1.00 0.00 C ATOM 114 CG LEU A 87 15.446 10.804 -13.158 1.00 0.00 C ATOM 115 CD1 LEU A 87 14.817 10.700 -14.540 1.00 0.00 C ATOM 116 CD2 LEU A 87 16.521 11.881 -13.139 1.00 0.00 C ATOM 0 H LEU A 87 16.584 10.545 -10.907 1.00 0.00 H new ATOM 0 HA LEU A 87 13.768 10.626 -10.091 1.00 0.00 H new ATOM 0 HB2 LEU A 87 13.396 10.904 -12.534 1.00 0.00 H new ATOM 0 HB3 LEU A 87 14.416 12.151 -11.845 1.00 0.00 H new ATOM 0 HG LEU A 87 15.913 9.848 -12.922 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.592 10.495 -15.278 1.00 0.00 H new ATOM 0 HD12 LEU A 87 14.086 9.891 -14.547 1.00 0.00 H new ATOM 0 HD13 LEU A 87 14.321 11.639 -14.786 1.00 0.00 H new ATOM 0 HD21 LEU A 87 17.271 11.660 -13.898 1.00 0.00 H new ATOM 0 HD22 LEU A 87 16.069 12.850 -13.348 1.00 0.00 H new ATOM 0 HD23 LEU A 87 16.994 11.905 -12.157 1.00 0.00 H new ATOM 128 N THR A 88 15.305 8.049 -11.358 1.00 0.00 N ATOM 129 CA THR A 88 15.183 6.626 -11.655 1.00 0.00 C ATOM 130 C THR A 88 14.482 5.886 -10.521 1.00 0.00 C ATOM 131 O THR A 88 13.519 5.152 -10.748 1.00 0.00 O ATOM 132 CB THR A 88 16.564 6.016 -11.900 1.00 0.00 C ATOM 133 OG1 THR A 88 17.551 6.686 -11.135 1.00 0.00 O ATOM 134 CG2 THR A 88 16.993 6.068 -13.350 1.00 0.00 C ATOM 0 H THR A 88 16.263 8.400 -11.364 1.00 0.00 H new ATOM 0 HA THR A 88 14.580 6.521 -12.557 1.00 0.00 H new ATOM 0 HB THR A 88 16.475 4.971 -11.602 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.952 7.401 -11.672 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.981 5.619 -13.453 1.00 0.00 H new ATOM 0 HG22 THR A 88 16.278 5.517 -13.961 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.030 7.106 -13.682 1.00 0.00 H new ATOM 142 N GLU A 89 14.968 6.082 -9.298 1.00 0.00 N ATOM 143 CA GLU A 89 14.383 5.429 -8.130 1.00 0.00 C ATOM 144 C GLU A 89 12.885 5.704 -8.047 1.00 0.00 C ATOM 145 O GLU A 89 12.119 4.882 -7.545 1.00 0.00 O ATOM 146 CB GLU A 89 15.071 5.898 -6.849 1.00 0.00 C ATOM 147 CG GLU A 89 16.585 5.985 -6.963 1.00 0.00 C ATOM 148 CD GLU A 89 17.300 5.194 -5.885 1.00 0.00 C ATOM 149 OE1 GLU A 89 17.003 3.990 -5.737 1.00 0.00 O ATOM 150 OE2 GLU A 89 18.155 5.779 -5.188 1.00 0.00 O ATOM 0 H GLU A 89 15.763 6.686 -9.090 1.00 0.00 H new ATOM 0 HA GLU A 89 14.534 4.355 -8.237 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.680 6.878 -6.575 1.00 0.00 H new ATOM 0 HB3 GLU A 89 14.815 5.215 -6.039 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.893 5.618 -7.942 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.890 7.030 -6.904 1.00 0.00 H new ATOM 157 N ASP A 90 12.471 6.861 -8.552 1.00 0.00 N ATOM 158 CA ASP A 90 11.061 7.226 -8.542 1.00 0.00 C ATOM 159 C ASP A 90 10.307 6.390 -9.569 1.00 0.00 C ATOM 160 O ASP A 90 9.256 5.819 -9.275 1.00 0.00 O ATOM 161 CB ASP A 90 10.891 8.715 -8.848 1.00 0.00 C ATOM 162 CG ASP A 90 9.555 9.254 -8.374 1.00 0.00 C ATOM 163 OD1 ASP A 90 9.112 8.859 -7.275 1.00 0.00 O ATOM 164 OD2 ASP A 90 8.953 10.071 -9.101 1.00 0.00 O ATOM 0 H ASP A 90 13.088 7.557 -8.971 1.00 0.00 H new ATOM 0 HA ASP A 90 10.653 7.030 -7.550 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.695 9.275 -8.371 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.984 8.875 -9.922 1.00 0.00 H new ATOM 169 N ILE A 91 10.862 6.321 -10.773 1.00 0.00 N ATOM 170 CA ILE A 91 10.261 5.553 -11.856 1.00 0.00 C ATOM 171 C ILE A 91 10.118 4.083 -11.471 1.00 0.00 C ATOM 172 O ILE A 91 9.066 3.476 -11.678 1.00 0.00 O ATOM 173 CB ILE A 91 11.104 5.654 -13.144 1.00 0.00 C ATOM 174 CG1 ILE A 91 11.271 7.117 -13.558 1.00 0.00 C ATOM 175 CG2 ILE A 91 10.465 4.848 -14.266 1.00 0.00 C ATOM 176 CD1 ILE A 91 9.965 7.807 -13.882 1.00 0.00 C ATOM 0 H ILE A 91 11.732 6.790 -11.024 1.00 0.00 H new ATOM 0 HA ILE A 91 9.273 5.976 -12.039 1.00 0.00 H new ATOM 0 HB ILE A 91 12.091 5.238 -12.945 1.00 0.00 H new ATOM 0 HG12 ILE A 91 11.769 7.659 -12.754 1.00 0.00 H new ATOM 0 HG13 ILE A 91 11.925 7.167 -14.429 1.00 0.00 H new ATOM 0 HG21 ILE A 91 11.074 4.931 -15.166 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.397 3.801 -13.969 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.465 5.233 -14.467 1.00 0.00 H new ATOM 0 HD11 ILE A 91 10.161 8.841 -14.167 1.00 0.00 H new ATOM 0 HD12 ILE A 91 9.475 7.289 -14.707 1.00 0.00 H new ATOM 0 HD13 ILE A 91 9.317 7.789 -13.006 1.00 0.00 H new ATOM 188 N THR A 92 11.182 3.517 -10.910 1.00 0.00 N ATOM 189 CA THR A 92 11.169 2.119 -10.502 1.00 0.00 C ATOM 190 C THR A 92 10.153 1.891 -9.383 1.00 0.00 C ATOM 191 O THR A 92 9.331 0.981 -9.463 1.00 0.00 O ATOM 192 CB THR A 92 12.569 1.665 -10.065 1.00 0.00 C ATOM 193 OG1 THR A 92 12.627 0.254 -9.962 1.00 0.00 O ATOM 194 CG2 THR A 92 13.005 2.237 -8.735 1.00 0.00 C ATOM 0 H THR A 92 12.060 4.004 -10.729 1.00 0.00 H new ATOM 0 HA THR A 92 10.870 1.518 -11.361 1.00 0.00 H new ATOM 0 HB THR A 92 13.242 2.038 -10.837 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.527 -0.017 -9.684 1.00 0.00 H new ATOM 0 HG21 THR A 92 14.003 1.872 -8.492 1.00 0.00 H new ATOM 0 HG22 THR A 92 13.021 3.325 -8.795 1.00 0.00 H new ATOM 0 HG23 THR A 92 12.306 1.926 -7.959 1.00 0.00 H new ATOM 202 N ARG A 93 10.224 2.708 -8.332 1.00 0.00 N ATOM 203 CA ARG A 93 9.320 2.573 -7.196 1.00 0.00 C ATOM 204 C ARG A 93 7.861 2.601 -7.641 1.00 0.00 C ATOM 205 O ARG A 93 7.080 1.721 -7.280 1.00 0.00 O ATOM 206 CB ARG A 93 9.578 3.690 -6.186 1.00 0.00 C ATOM 207 CG ARG A 93 9.176 3.332 -4.765 1.00 0.00 C ATOM 208 CD ARG A 93 8.950 4.574 -3.918 1.00 0.00 C ATOM 209 NE ARG A 93 10.094 4.867 -3.057 1.00 0.00 N ATOM 210 CZ ARG A 93 11.188 5.506 -3.465 1.00 0.00 C ATOM 211 NH1 ARG A 93 11.294 5.924 -4.720 1.00 0.00 N ATOM 212 NH2 ARG A 93 12.179 5.731 -2.613 1.00 0.00 N ATOM 0 H ARG A 93 10.898 3.469 -8.246 1.00 0.00 H new ATOM 0 HA ARG A 93 9.512 1.608 -6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.638 3.944 -6.201 1.00 0.00 H new ATOM 0 HB3 ARG A 93 9.032 4.581 -6.495 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.266 2.733 -4.784 1.00 0.00 H new ATOM 0 HG3 ARG A 93 9.953 2.717 -4.310 1.00 0.00 H new ATOM 0 HD2 ARG A 93 8.759 5.427 -4.569 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.060 4.437 -3.304 1.00 0.00 H new ATOM 0 HE ARG A 93 10.051 4.563 -2.084 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.534 5.756 -5.379 1.00 0.00 H new ATOM 0 HH12 ARG A 93 12.135 6.413 -5.025 1.00 0.00 H new ATOM 0 HH21 ARG A 93 12.102 5.414 -1.646 1.00 0.00 H new ATOM 0 HH22 ARG A 93 13.018 6.221 -2.924 1.00 0.00 H new ATOM 226 N TYR A 94 7.492 3.611 -8.424 1.00 0.00 N ATOM 227 CA TYR A 94 6.121 3.736 -8.909 1.00 0.00 C ATOM 228 C TYR A 94 5.667 2.456 -9.605 1.00 0.00 C ATOM 229 O TYR A 94 4.647 1.869 -9.244 1.00 0.00 O ATOM 230 CB TYR A 94 6.005 4.921 -9.869 1.00 0.00 C ATOM 231 CG TYR A 94 4.584 5.219 -10.293 1.00 0.00 C ATOM 232 CD1 TYR A 94 3.553 5.251 -9.362 1.00 0.00 C ATOM 233 CD2 TYR A 94 4.274 5.469 -11.624 1.00 0.00 C ATOM 234 CE1 TYR A 94 2.254 5.522 -9.746 1.00 0.00 C ATOM 235 CE2 TYR A 94 2.977 5.742 -12.015 1.00 0.00 C ATOM 236 CZ TYR A 94 1.971 5.767 -11.073 1.00 0.00 C ATOM 237 OH TYR A 94 0.678 6.038 -11.459 1.00 0.00 O ATOM 0 H TYR A 94 8.120 4.352 -8.735 1.00 0.00 H new ATOM 0 HA TYR A 94 5.473 3.907 -8.049 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.427 5.806 -9.393 1.00 0.00 H new ATOM 0 HB3 TYR A 94 6.605 4.720 -10.756 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.771 5.061 -8.321 1.00 0.00 H new ATOM 0 HD2 TYR A 94 5.059 5.450 -12.365 1.00 0.00 H new ATOM 0 HE1 TYR A 94 1.464 5.542 -9.010 1.00 0.00 H new ATOM 0 HE2 TYR A 94 2.753 5.935 -13.054 1.00 0.00 H new ATOM 0 HH TYR A 94 0.650 6.188 -12.427 1.00 0.00 H new ATOM 247 N TYR A 95 6.433 2.028 -10.604 1.00 0.00 N ATOM 248 CA TYR A 95 6.108 0.816 -11.348 1.00 0.00 C ATOM 249 C TYR A 95 6.065 -0.396 -10.422 1.00 0.00 C ATOM 250 O TYR A 95 5.169 -1.235 -10.522 1.00 0.00 O ATOM 251 CB TYR A 95 7.132 0.586 -12.460 1.00 0.00 C ATOM 252 CG TYR A 95 6.893 1.432 -13.691 1.00 0.00 C ATOM 253 CD1 TYR A 95 6.634 2.793 -13.582 1.00 0.00 C ATOM 254 CD2 TYR A 95 6.926 0.870 -14.961 1.00 0.00 C ATOM 255 CE1 TYR A 95 6.415 3.570 -14.704 1.00 0.00 C ATOM 256 CE2 TYR A 95 6.709 1.641 -16.088 1.00 0.00 C ATOM 257 CZ TYR A 95 6.454 2.989 -15.954 1.00 0.00 C ATOM 258 OH TYR A 95 6.237 3.759 -17.073 1.00 0.00 O ATOM 0 H TYR A 95 7.281 2.501 -10.916 1.00 0.00 H new ATOM 0 HA TYR A 95 5.121 0.946 -11.793 1.00 0.00 H new ATOM 0 HB2 TYR A 95 8.129 0.797 -12.073 1.00 0.00 H new ATOM 0 HB3 TYR A 95 7.116 -0.466 -12.744 1.00 0.00 H new ATOM 0 HD1 TYR A 95 6.603 3.251 -12.604 1.00 0.00 H new ATOM 0 HD2 TYR A 95 7.124 -0.186 -15.070 1.00 0.00 H new ATOM 0 HE1 TYR A 95 6.214 4.626 -14.602 1.00 0.00 H new ATOM 0 HE2 TYR A 95 6.739 1.189 -17.069 1.00 0.00 H new ATOM 0 HH TYR A 95 6.300 3.198 -17.874 1.00 0.00 H new ATOM 268 N LEU A 96 7.042 -0.483 -9.525 1.00 0.00 N ATOM 269 CA LEU A 96 7.128 -1.592 -8.579 1.00 0.00 C ATOM 270 C LEU A 96 5.810 -1.790 -7.836 1.00 0.00 C ATOM 271 O LEU A 96 5.236 -2.878 -7.846 1.00 0.00 O ATOM 272 CB LEU A 96 8.254 -1.335 -7.575 1.00 0.00 C ATOM 273 CG LEU A 96 9.118 -2.549 -7.241 1.00 0.00 C ATOM 274 CD1 LEU A 96 9.705 -3.152 -8.508 1.00 0.00 C ATOM 275 CD2 LEU A 96 10.225 -2.163 -6.271 1.00 0.00 C ATOM 0 H LEU A 96 7.789 0.205 -9.433 1.00 0.00 H new ATOM 0 HA LEU A 96 7.341 -2.500 -9.143 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.898 -0.549 -7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.816 -0.956 -6.652 1.00 0.00 H new ATOM 0 HG LEU A 96 8.488 -3.300 -6.764 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.318 -4.016 -8.250 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.898 -3.465 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.321 -2.408 -9.013 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.831 -3.040 -6.043 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.853 -1.395 -6.722 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.785 -1.778 -5.351 1.00 0.00 H new ATOM 287 N CYS A 97 5.338 -0.729 -7.192 1.00 0.00 N ATOM 288 CA CYS A 97 4.088 -0.782 -6.441 1.00 0.00 C ATOM 289 C CYS A 97 2.929 -1.199 -7.341 1.00 0.00 C ATOM 290 O CYS A 97 2.073 -1.987 -6.941 1.00 0.00 O ATOM 291 CB CYS A 97 3.792 0.578 -5.807 1.00 0.00 C ATOM 292 SG CYS A 97 2.819 0.487 -4.285 1.00 0.00 S ATOM 0 H CYS A 97 5.802 0.179 -7.174 1.00 0.00 H new ATOM 0 HA CYS A 97 4.198 -1.527 -5.653 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.735 1.080 -5.593 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.259 1.196 -6.530 1.00 0.00 H new ATOM 0 HG CYS A 97 3.170 -0.565 -3.608 1.00 0.00 H new ATOM 298 N LEU A 98 2.909 -0.664 -8.557 1.00 0.00 N ATOM 299 CA LEU A 98 1.854 -0.981 -9.513 1.00 0.00 C ATOM 300 C LEU A 98 1.840 -2.472 -9.838 1.00 0.00 C ATOM 301 O LEU A 98 0.790 -3.114 -9.806 1.00 0.00 O ATOM 302 CB LEU A 98 2.041 -0.171 -10.797 1.00 0.00 C ATOM 303 CG LEU A 98 1.818 1.335 -10.651 1.00 0.00 C ATOM 304 CD1 LEU A 98 2.488 2.086 -11.791 1.00 0.00 C ATOM 305 CD2 LEU A 98 0.331 1.650 -10.603 1.00 0.00 C ATOM 0 H LEU A 98 3.610 -0.010 -8.904 1.00 0.00 H new ATOM 0 HA LEU A 98 0.898 -0.718 -9.059 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.051 -0.339 -11.170 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.354 -0.553 -11.553 1.00 0.00 H new ATOM 0 HG LEU A 98 2.269 1.662 -9.714 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.319 3.156 -11.671 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.559 1.884 -11.780 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.067 1.757 -12.741 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.190 2.726 -10.499 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.143 1.309 -11.524 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.121 1.141 -9.752 1.00 0.00 H new ATOM 317 N GLN A 99 3.011 -3.015 -10.155 1.00 0.00 N ATOM 318 CA GLN A 99 3.131 -4.430 -10.490 1.00 0.00 C ATOM 319 C GLN A 99 2.834 -5.309 -9.279 1.00 0.00 C ATOM 320 O GLN A 99 2.059 -6.261 -9.366 1.00 0.00 O ATOM 321 CB GLN A 99 4.534 -4.731 -11.020 1.00 0.00 C ATOM 322 CG GLN A 99 4.709 -4.409 -12.495 1.00 0.00 C ATOM 323 CD GLN A 99 4.987 -5.642 -13.334 1.00 0.00 C ATOM 324 OE1 GLN A 99 5.405 -6.677 -12.817 1.00 0.00 O ATOM 325 NE2 GLN A 99 4.757 -5.535 -14.638 1.00 0.00 N ATOM 0 H GLN A 99 3.889 -2.498 -10.187 1.00 0.00 H new ATOM 0 HA GLN A 99 2.398 -4.655 -11.265 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.262 -4.160 -10.443 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.756 -5.786 -10.858 1.00 0.00 H new ATOM 0 HG2 GLN A 99 3.809 -3.918 -12.865 1.00 0.00 H new ATOM 0 HG3 GLN A 99 5.530 -3.701 -12.613 1.00 0.00 H new ATOM 0 HE21 GLN A 99 4.410 -4.657 -15.024 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.927 -6.331 -15.253 1.00 0.00 H new ATOM 334 N LEU A 100 3.457 -4.986 -8.149 1.00 0.00 N ATOM 335 CA LEU A 100 3.260 -5.749 -6.921 1.00 0.00 C ATOM 336 C LEU A 100 1.786 -5.784 -6.528 1.00 0.00 C ATOM 337 O LEU A 100 1.221 -6.853 -6.291 1.00 0.00 O ATOM 338 CB LEU A 100 4.088 -5.146 -5.784 1.00 0.00 C ATOM 339 CG LEU A 100 5.509 -5.696 -5.653 1.00 0.00 C ATOM 340 CD1 LEU A 100 6.429 -4.653 -5.037 1.00 0.00 C ATOM 341 CD2 LEU A 100 5.513 -6.970 -4.823 1.00 0.00 C ATOM 0 H LEU A 100 4.102 -4.201 -8.059 1.00 0.00 H new ATOM 0 HA LEU A 100 3.592 -6.771 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.145 -4.067 -5.929 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.562 -5.314 -4.844 1.00 0.00 H new ATOM 0 HG LEU A 100 5.880 -5.935 -6.650 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.436 -5.061 -4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.450 -3.766 -5.671 1.00 0.00 H new ATOM 0 HD13 LEU A 100 6.061 -4.383 -4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.532 -7.347 -4.740 1.00 0.00 H new ATOM 0 HD22 LEU A 100 5.123 -6.757 -3.828 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.886 -7.720 -5.305 1.00 0.00 H new ATOM 353 N ARG A 101 1.169 -4.609 -6.460 1.00 0.00 N ATOM 354 CA ARG A 101 -0.239 -4.505 -6.095 1.00 0.00 C ATOM 355 C ARG A 101 -1.124 -5.203 -7.123 1.00 0.00 C ATOM 356 O ARG A 101 -2.204 -5.694 -6.794 1.00 0.00 O ATOM 357 CB ARG A 101 -0.645 -3.036 -5.966 1.00 0.00 C ATOM 358 CG ARG A 101 -2.103 -2.837 -5.584 1.00 0.00 C ATOM 359 CD ARG A 101 -2.351 -1.444 -5.027 1.00 0.00 C ATOM 360 NE ARG A 101 -2.340 -0.425 -6.076 1.00 0.00 N ATOM 361 CZ ARG A 101 -1.263 0.277 -6.425 1.00 0.00 C ATOM 362 NH1 ARG A 101 -0.099 0.076 -5.818 1.00 0.00 N ATOM 363 NH2 ARG A 101 -1.349 1.185 -7.388 1.00 0.00 N ATOM 0 H ARG A 101 1.622 -3.716 -6.653 1.00 0.00 H new ATOM 0 HA ARG A 101 -0.376 -4.999 -5.133 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -0.014 -2.558 -5.217 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.454 -2.531 -6.913 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -2.734 -2.997 -6.458 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -2.390 -3.582 -4.842 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.312 -1.425 -4.513 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -1.588 -1.209 -4.285 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.212 -0.240 -6.572 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.024 -0.621 -5.077 1.00 0.00 H new ATOM 0 HH12 ARG A 101 0.720 0.619 -6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.239 1.345 -7.860 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -0.525 1.723 -7.656 1.00 0.00 H new ATOM 377 N GLN A 102 -0.660 -5.246 -8.368 1.00 0.00 N ATOM 378 CA GLN A 102 -1.413 -5.887 -9.440 1.00 0.00 C ATOM 379 C GLN A 102 -1.413 -7.404 -9.272 1.00 0.00 C ATOM 380 O GLN A 102 -2.423 -8.064 -9.513 1.00 0.00 O ATOM 381 CB GLN A 102 -0.824 -5.510 -10.802 1.00 0.00 C ATOM 382 CG GLN A 102 -1.609 -4.428 -11.524 1.00 0.00 C ATOM 383 CD GLN A 102 -2.890 -4.952 -12.142 1.00 0.00 C ATOM 384 OE1 GLN A 102 -3.641 -5.693 -11.508 1.00 0.00 O ATOM 385 NE2 GLN A 102 -3.146 -4.569 -13.388 1.00 0.00 N ATOM 0 H GLN A 102 0.232 -4.845 -8.659 1.00 0.00 H new ATOM 0 HA GLN A 102 -2.443 -5.535 -9.389 1.00 0.00 H new ATOM 0 HB2 GLN A 102 0.203 -5.172 -10.664 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -0.784 -6.400 -11.431 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -1.849 -3.629 -10.823 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -0.986 -3.991 -12.304 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -2.495 -3.954 -13.876 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.993 -4.890 -13.856 1.00 0.00 H new ATOM 394 N ASP A 103 -0.274 -7.948 -8.859 1.00 0.00 N ATOM 395 CA ASP A 103 -0.142 -9.387 -8.660 1.00 0.00 C ATOM 396 C ASP A 103 -0.963 -9.849 -7.460 1.00 0.00 C ATOM 397 O ASP A 103 -1.523 -10.945 -7.463 1.00 0.00 O ATOM 398 CB ASP A 103 1.327 -9.763 -8.463 1.00 0.00 C ATOM 399 CG ASP A 103 2.118 -9.699 -9.755 1.00 0.00 C ATOM 400 OD1 ASP A 103 1.816 -8.824 -10.593 1.00 0.00 O ATOM 401 OD2 ASP A 103 3.040 -10.524 -9.929 1.00 0.00 O ATOM 0 H ASP A 103 0.571 -7.415 -8.655 1.00 0.00 H new ATOM 0 HA ASP A 103 -0.522 -9.888 -9.551 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.776 -9.091 -7.731 1.00 0.00 H new ATOM 0 HB3 ASP A 103 1.389 -10.770 -8.051 1.00 0.00 H new ATOM 406 N ILE A 104 -1.027 -9.007 -6.433 1.00 0.00 N ATOM 407 CA ILE A 104 -1.777 -9.332 -5.226 1.00 0.00 C ATOM 408 C ILE A 104 -3.278 -9.378 -5.500 1.00 0.00 C ATOM 409 O ILE A 104 -3.945 -10.362 -5.183 1.00 0.00 O ATOM 410 CB ILE A 104 -1.502 -8.313 -4.101 1.00 0.00 C ATOM 411 CG1 ILE A 104 0.003 -8.165 -3.873 1.00 0.00 C ATOM 412 CG2 ILE A 104 -2.197 -8.739 -2.816 1.00 0.00 C ATOM 413 CD1 ILE A 104 0.410 -6.788 -3.395 1.00 0.00 C ATOM 0 H ILE A 104 -0.569 -8.096 -6.413 1.00 0.00 H new ATOM 0 HA ILE A 104 -1.441 -10.318 -4.905 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.902 -7.345 -4.404 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.326 -8.905 -3.141 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.527 -8.387 -4.803 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.993 -8.009 -2.033 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.272 -8.797 -2.986 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.825 -9.716 -2.508 1.00 0.00 H new ATOM 0 HD11 ILE A 104 1.490 -6.756 -3.254 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.119 -6.044 -4.137 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -0.085 -6.570 -2.449 1.00 0.00 H new ATOM 425 N VAL A 105 -3.804 -8.307 -6.086 1.00 0.00 N ATOM 426 CA VAL A 105 -5.227 -8.225 -6.395 1.00 0.00 C ATOM 427 C VAL A 105 -5.673 -9.369 -7.300 1.00 0.00 C ATOM 428 O VAL A 105 -6.809 -9.834 -7.211 1.00 0.00 O ATOM 429 CB VAL A 105 -5.578 -6.888 -7.075 1.00 0.00 C ATOM 430 CG1 VAL A 105 -5.355 -5.727 -6.119 1.00 0.00 C ATOM 431 CG2 VAL A 105 -4.764 -6.707 -8.347 1.00 0.00 C ATOM 0 H VAL A 105 -3.266 -7.484 -6.356 1.00 0.00 H new ATOM 0 HA VAL A 105 -5.754 -8.296 -5.443 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.634 -6.905 -7.346 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.608 -4.791 -6.618 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.987 -5.853 -5.240 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -4.309 -5.703 -5.813 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -5.025 -5.757 -8.814 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.702 -6.711 -8.103 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -4.981 -7.522 -9.037 1.00 0.00 H new ATOM 441 N ALA A 106 -4.776 -9.819 -8.172 1.00 0.00 N ATOM 442 CA ALA A 106 -5.087 -10.907 -9.091 1.00 0.00 C ATOM 443 C ALA A 106 -4.842 -12.273 -8.451 1.00 0.00 C ATOM 444 O ALA A 106 -5.107 -13.308 -9.063 1.00 0.00 O ATOM 445 CB ALA A 106 -4.268 -10.767 -10.366 1.00 0.00 C ATOM 0 H ALA A 106 -3.830 -9.448 -8.261 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.147 -10.843 -9.337 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.509 -11.585 -11.045 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.502 -9.817 -10.846 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.206 -10.799 -10.122 1.00 0.00 H new ATOM 451 N GLY A 107 -4.333 -12.275 -7.221 1.00 0.00 N ATOM 452 CA GLY A 107 -4.065 -13.525 -6.536 1.00 0.00 C ATOM 453 C GLY A 107 -2.945 -14.311 -7.189 1.00 0.00 C ATOM 454 O GLY A 107 -2.970 -15.541 -7.209 1.00 0.00 O ATOM 0 H GLY A 107 -4.103 -11.435 -6.689 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.804 -13.319 -5.498 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.971 -14.131 -6.523 1.00 0.00 H new ATOM 458 N ARG A 108 -1.961 -13.596 -7.725 1.00 0.00 N ATOM 459 CA ARG A 108 -0.825 -14.231 -8.384 1.00 0.00 C ATOM 460 C ARG A 108 0.228 -14.681 -7.371 1.00 0.00 C ATOM 461 O ARG A 108 1.267 -15.223 -7.747 1.00 0.00 O ATOM 462 CB ARG A 108 -0.196 -13.269 -9.393 1.00 0.00 C ATOM 463 CG ARG A 108 0.696 -13.957 -10.414 1.00 0.00 C ATOM 464 CD ARG A 108 1.446 -12.948 -11.271 1.00 0.00 C ATOM 465 NE ARG A 108 1.485 -13.345 -12.676 1.00 0.00 N ATOM 466 CZ ARG A 108 2.154 -12.681 -13.616 1.00 0.00 C ATOM 467 NH1 ARG A 108 2.838 -11.587 -13.306 1.00 0.00 N ATOM 468 NH2 ARG A 108 2.138 -13.112 -14.870 1.00 0.00 N ATOM 0 H ARG A 108 -1.927 -12.577 -7.716 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.194 -15.114 -8.906 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -0.989 -12.735 -9.917 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.389 -12.523 -8.855 1.00 0.00 H new ATOM 0 HG2 ARG A 108 1.410 -14.601 -9.900 1.00 0.00 H new ATOM 0 HG3 ARG A 108 0.090 -14.600 -11.053 1.00 0.00 H new ATOM 0 HD2 ARG A 108 0.969 -11.972 -11.183 1.00 0.00 H new ATOM 0 HD3 ARG A 108 2.464 -12.840 -10.896 1.00 0.00 H new ATOM 0 HE ARG A 108 0.969 -14.180 -12.953 1.00 0.00 H new ATOM 0 HH11 ARG A 108 2.853 -11.251 -12.343 1.00 0.00 H new ATOM 0 HH12 ARG A 108 3.349 -11.082 -14.031 1.00 0.00 H new ATOM 0 HH21 ARG A 108 1.613 -13.952 -15.114 1.00 0.00 H new ATOM 0 HH22 ARG A 108 2.650 -12.604 -15.591 1.00 0.00 H new ATOM 482 N LEU A 109 -0.042 -14.456 -6.087 1.00 0.00 N ATOM 483 CA LEU A 109 0.888 -14.843 -5.033 1.00 0.00 C ATOM 484 C LEU A 109 0.139 -15.147 -3.736 1.00 0.00 C ATOM 485 O LEU A 109 -0.723 -14.376 -3.316 1.00 0.00 O ATOM 486 CB LEU A 109 1.910 -13.731 -4.796 1.00 0.00 C ATOM 487 CG LEU A 109 3.217 -14.179 -4.140 1.00 0.00 C ATOM 488 CD1 LEU A 109 4.328 -13.182 -4.430 1.00 0.00 C ATOM 489 CD2 LEU A 109 3.028 -14.349 -2.639 1.00 0.00 C ATOM 0 H LEU A 109 -0.896 -14.009 -5.754 1.00 0.00 H new ATOM 0 HA LEU A 109 1.410 -15.745 -5.352 1.00 0.00 H new ATOM 0 HB2 LEU A 109 2.143 -13.264 -5.753 1.00 0.00 H new ATOM 0 HB3 LEU A 109 1.452 -12.965 -4.170 1.00 0.00 H new ATOM 0 HG LEU A 109 3.503 -15.143 -4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 109 5.250 -13.517 -3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.480 -13.109 -5.507 1.00 0.00 H new ATOM 0 HD13 LEU A 109 4.051 -12.204 -4.036 1.00 0.00 H new ATOM 0 HD21 LEU A 109 3.968 -14.668 -2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.719 -13.400 -2.201 1.00 0.00 H new ATOM 0 HD23 LEU A 109 2.262 -15.101 -2.452 1.00 0.00 H new ATOM 501 N PRO A 110 0.457 -16.278 -3.080 1.00 0.00 N ATOM 502 CA PRO A 110 -0.197 -16.670 -1.827 1.00 0.00 C ATOM 503 C PRO A 110 0.158 -15.737 -0.674 1.00 0.00 C ATOM 504 O PRO A 110 1.330 -15.574 -0.334 1.00 0.00 O ATOM 505 CB PRO A 110 0.347 -18.077 -1.563 1.00 0.00 C ATOM 506 CG PRO A 110 1.648 -18.122 -2.286 1.00 0.00 C ATOM 507 CD PRO A 110 1.472 -17.260 -3.504 1.00 0.00 C ATOM 0 HA PRO A 110 -1.283 -16.628 -1.905 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.481 -18.256 -0.496 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.337 -18.841 -1.931 1.00 0.00 H new ATOM 0 HG2 PRO A 110 2.457 -17.750 -1.658 1.00 0.00 H new ATOM 0 HG3 PRO A 110 1.905 -19.144 -2.565 1.00 0.00 H new ATOM 0 HD2 PRO A 110 2.405 -16.775 -3.792 1.00 0.00 H new ATOM 0 HD3 PRO A 110 1.136 -17.841 -4.363 1.00 0.00 H new ATOM 515 N CYS A 111 -0.860 -15.127 -0.077 1.00 0.00 N ATOM 516 CA CYS A 111 -0.655 -14.210 1.038 1.00 0.00 C ATOM 517 C CYS A 111 -1.712 -14.428 2.116 1.00 0.00 C ATOM 518 O CYS A 111 -2.701 -15.128 1.895 1.00 0.00 O ATOM 519 CB CYS A 111 -0.697 -12.761 0.551 1.00 0.00 C ATOM 520 SG CYS A 111 0.464 -12.397 -0.786 1.00 0.00 S ATOM 0 H CYS A 111 -1.836 -15.251 -0.347 1.00 0.00 H new ATOM 0 HA CYS A 111 0.327 -14.410 1.467 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.707 -12.532 0.212 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -0.485 -12.100 1.392 1.00 0.00 H new ATOM 0 HG CYS A 111 0.130 -13.071 -1.846 1.00 0.00 H new ATOM 526 N SER A 112 -1.496 -13.828 3.281 1.00 0.00 N ATOM 527 CA SER A 112 -2.432 -13.961 4.391 1.00 0.00 C ATOM 528 C SER A 112 -3.291 -12.709 4.537 1.00 0.00 C ATOM 529 O SER A 112 -2.963 -11.652 3.995 1.00 0.00 O ATOM 530 CB SER A 112 -1.675 -14.229 5.693 1.00 0.00 C ATOM 531 OG SER A 112 -1.033 -15.492 5.660 1.00 0.00 O ATOM 0 H SER A 112 -0.683 -13.246 3.481 1.00 0.00 H new ATOM 0 HA SER A 112 -3.089 -14.805 4.179 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.935 -13.446 5.855 1.00 0.00 H new ATOM 0 HB3 SER A 112 -2.367 -14.192 6.534 1.00 0.00 H new ATOM 0 HG SER A 112 -0.555 -15.638 6.503 1.00 0.00 H new ATOM 537 N PHE A 113 -4.392 -12.835 5.272 1.00 0.00 N ATOM 538 CA PHE A 113 -5.302 -11.715 5.492 1.00 0.00 C ATOM 539 C PHE A 113 -4.564 -10.522 6.094 1.00 0.00 C ATOM 540 O PHE A 113 -4.736 -9.387 5.651 1.00 0.00 O ATOM 541 CB PHE A 113 -6.451 -12.141 6.411 1.00 0.00 C ATOM 542 CG PHE A 113 -7.359 -11.012 6.814 1.00 0.00 C ATOM 543 CD1 PHE A 113 -6.989 -10.134 7.820 1.00 0.00 C ATOM 544 CD2 PHE A 113 -8.581 -10.829 6.186 1.00 0.00 C ATOM 545 CE1 PHE A 113 -7.820 -9.095 8.193 1.00 0.00 C ATOM 546 CE2 PHE A 113 -9.416 -9.792 6.555 1.00 0.00 C ATOM 547 CZ PHE A 113 -9.036 -8.924 7.560 1.00 0.00 C ATOM 0 H PHE A 113 -4.676 -13.703 5.726 1.00 0.00 H new ATOM 0 HA PHE A 113 -5.710 -11.413 4.527 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -7.041 -12.907 5.908 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -6.035 -12.598 7.309 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.040 -10.263 8.319 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.884 -11.504 5.400 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -7.519 -8.417 8.978 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.366 -9.660 6.058 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.688 -8.113 7.850 1.00 0.00 H new ATOM 557 N ALA A 114 -3.759 -10.784 7.118 1.00 0.00 N ATOM 558 CA ALA A 114 -3.017 -9.726 7.792 1.00 0.00 C ATOM 559 C ALA A 114 -2.150 -8.938 6.818 1.00 0.00 C ATOM 560 O ALA A 114 -2.169 -7.708 6.823 1.00 0.00 O ATOM 561 CB ALA A 114 -2.159 -10.306 8.904 1.00 0.00 C ATOM 0 H ALA A 114 -3.604 -11.718 7.498 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.745 -9.038 8.223 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.611 -9.503 9.397 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.797 -10.810 9.630 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.453 -11.022 8.483 1.00 0.00 H new ATOM 567 N THR A 115 -1.390 -9.638 5.980 1.00 0.00 N ATOM 568 CA THR A 115 -0.529 -8.975 5.010 1.00 0.00 C ATOM 569 C THR A 115 -1.361 -8.215 3.988 1.00 0.00 C ATOM 570 O THR A 115 -1.014 -7.103 3.594 1.00 0.00 O ATOM 571 CB THR A 115 0.363 -9.997 4.303 1.00 0.00 C ATOM 572 OG1 THR A 115 1.132 -10.727 5.243 1.00 0.00 O ATOM 573 CG2 THR A 115 1.321 -9.373 3.312 1.00 0.00 C ATOM 0 H THR A 115 -1.354 -10.657 5.954 1.00 0.00 H new ATOM 0 HA THR A 115 0.103 -8.265 5.543 1.00 0.00 H new ATOM 0 HB THR A 115 -0.321 -10.649 3.760 1.00 0.00 H new ATOM 0 HG1 THR A 115 1.694 -11.376 4.772 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.923 -10.154 2.847 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.757 -8.844 2.544 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.974 -8.671 3.830 1.00 0.00 H new ATOM 581 N LEU A 116 -2.469 -8.817 3.567 1.00 0.00 N ATOM 582 CA LEU A 116 -3.355 -8.184 2.598 1.00 0.00 C ATOM 583 C LEU A 116 -3.833 -6.839 3.126 1.00 0.00 C ATOM 584 O LEU A 116 -3.807 -5.833 2.417 1.00 0.00 O ATOM 585 CB LEU A 116 -4.556 -9.086 2.301 1.00 0.00 C ATOM 586 CG LEU A 116 -4.304 -10.190 1.272 1.00 0.00 C ATOM 587 CD1 LEU A 116 -5.594 -10.934 0.961 1.00 0.00 C ATOM 588 CD2 LEU A 116 -3.702 -9.608 0.001 1.00 0.00 C ATOM 0 H LEU A 116 -2.773 -9.739 3.881 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.800 -8.026 1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.882 -9.548 3.233 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.379 -8.464 1.948 1.00 0.00 H new ATOM 0 HG LEU A 116 -3.592 -10.899 1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.396 -11.715 0.227 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -5.984 -11.384 1.874 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -6.328 -10.236 0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.530 -10.408 -0.719 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.389 -8.877 -0.426 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.755 -9.122 0.236 1.00 0.00 H new ATOM 600 N ALA A 117 -4.271 -6.833 4.380 1.00 0.00 N ATOM 601 CA ALA A 117 -4.762 -5.623 5.020 1.00 0.00 C ATOM 602 C ALA A 117 -3.630 -4.639 5.309 1.00 0.00 C ATOM 603 O ALA A 117 -3.821 -3.426 5.231 1.00 0.00 O ATOM 604 CB ALA A 117 -5.487 -5.987 6.305 1.00 0.00 C ATOM 0 H ALA A 117 -4.295 -7.661 4.976 1.00 0.00 H new ATOM 0 HA ALA A 117 -5.454 -5.131 4.336 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.855 -5.080 6.785 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -6.327 -6.643 6.076 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -4.800 -6.500 6.978 1.00 0.00 H new ATOM 610 N LEU A 118 -2.455 -5.163 5.648 1.00 0.00 N ATOM 611 CA LEU A 118 -1.306 -4.314 5.953 1.00 0.00 C ATOM 612 C LEU A 118 -0.788 -3.618 4.696 1.00 0.00 C ATOM 613 O LEU A 118 -0.633 -2.395 4.670 1.00 0.00 O ATOM 614 CB LEU A 118 -0.188 -5.143 6.588 1.00 0.00 C ATOM 615 CG LEU A 118 1.094 -4.370 6.902 1.00 0.00 C ATOM 616 CD1 LEU A 118 1.731 -4.888 8.182 1.00 0.00 C ATOM 617 CD2 LEU A 118 2.072 -4.469 5.740 1.00 0.00 C ATOM 0 H LEU A 118 -2.274 -6.164 5.718 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.631 -3.550 6.659 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.563 -5.584 7.511 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.058 -5.967 5.918 1.00 0.00 H new ATOM 0 HG LEU A 118 0.837 -3.321 7.048 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.642 -4.326 8.389 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.033 -4.766 9.011 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.975 -5.944 8.065 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.979 -3.914 5.979 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.323 -5.515 5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.616 -4.049 4.844 1.00 0.00 H new ATOM 629 N LEU A 119 -0.528 -4.400 3.654 1.00 0.00 N ATOM 630 CA LEU A 119 -0.033 -3.855 2.396 1.00 0.00 C ATOM 631 C LEU A 119 -1.052 -2.896 1.795 1.00 0.00 C ATOM 632 O LEU A 119 -0.693 -1.888 1.186 1.00 0.00 O ATOM 633 CB LEU A 119 0.269 -4.983 1.407 1.00 0.00 C ATOM 634 CG LEU A 119 1.271 -6.027 1.902 1.00 0.00 C ATOM 635 CD1 LEU A 119 1.276 -7.239 0.984 1.00 0.00 C ATOM 636 CD2 LEU A 119 2.664 -5.423 1.998 1.00 0.00 C ATOM 0 H LEU A 119 -0.652 -5.412 3.656 1.00 0.00 H new ATOM 0 HA LEU A 119 0.888 -3.309 2.598 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.665 -5.487 1.158 1.00 0.00 H new ATOM 0 HB3 LEU A 119 0.650 -4.545 0.485 1.00 0.00 H new ATOM 0 HG LEU A 119 0.967 -6.352 2.897 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.995 -7.971 1.352 1.00 0.00 H new ATOM 0 HD12 LEU A 119 0.282 -7.685 0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.555 -6.931 -0.024 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.365 -6.179 2.352 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.976 -5.070 1.015 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.650 -4.586 2.696 1.00 0.00 H new ATOM 648 N GLY A 120 -2.328 -3.213 1.986 1.00 0.00 N ATOM 649 CA GLY A 120 -3.384 -2.366 1.473 1.00 0.00 C ATOM 650 C GLY A 120 -3.487 -1.064 2.239 1.00 0.00 C ATOM 651 O GLY A 120 -3.507 0.015 1.649 1.00 0.00 O ATOM 0 H GLY A 120 -2.648 -4.042 2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.200 -2.154 0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -4.334 -2.897 1.530 1.00 0.00 H new ATOM 655 N SER A 121 -3.550 -1.169 3.563 1.00 0.00 N ATOM 656 CA SER A 121 -3.652 0.002 4.426 1.00 0.00 C ATOM 657 C SER A 121 -2.540 1.005 4.134 1.00 0.00 C ATOM 658 O SER A 121 -2.747 2.215 4.223 1.00 0.00 O ATOM 659 CB SER A 121 -3.596 -0.418 5.894 1.00 0.00 C ATOM 660 OG SER A 121 -4.799 -1.053 6.288 1.00 0.00 O ATOM 0 H SER A 121 -3.532 -2.058 4.063 1.00 0.00 H new ATOM 0 HA SER A 121 -4.609 0.483 4.223 1.00 0.00 H new ATOM 0 HB2 SER A 121 -2.756 -1.095 6.050 1.00 0.00 H new ATOM 0 HB3 SER A 121 -3.421 0.457 6.520 1.00 0.00 H new ATOM 0 HG SER A 121 -4.763 -2.002 6.046 1.00 0.00 H new ATOM 666 N TYR A 122 -1.361 0.500 3.783 1.00 0.00 N ATOM 667 CA TYR A 122 -0.228 1.364 3.480 1.00 0.00 C ATOM 668 C TYR A 122 -0.408 2.039 2.125 1.00 0.00 C ATOM 669 O TYR A 122 -0.206 3.246 1.990 1.00 0.00 O ATOM 670 CB TYR A 122 1.072 0.559 3.497 1.00 0.00 C ATOM 671 CG TYR A 122 1.588 0.280 4.891 1.00 0.00 C ATOM 672 CD1 TYR A 122 1.708 1.302 5.824 1.00 0.00 C ATOM 673 CD2 TYR A 122 1.954 -1.004 5.273 1.00 0.00 C ATOM 674 CE1 TYR A 122 2.177 1.052 7.099 1.00 0.00 C ATOM 675 CE2 TYR A 122 2.425 -1.262 6.546 1.00 0.00 C ATOM 676 CZ TYR A 122 2.535 -0.231 7.455 1.00 0.00 C ATOM 677 OH TYR A 122 3.002 -0.484 8.724 1.00 0.00 O ATOM 0 H TYR A 122 -1.167 -0.498 3.702 1.00 0.00 H new ATOM 0 HA TYR A 122 -0.176 2.138 4.246 1.00 0.00 H new ATOM 0 HB2 TYR A 122 0.911 -0.388 2.981 1.00 0.00 H new ATOM 0 HB3 TYR A 122 1.834 1.102 2.937 1.00 0.00 H new ATOM 0 HD1 TYR A 122 1.430 2.308 5.548 1.00 0.00 H new ATOM 0 HD2 TYR A 122 1.869 -1.814 4.564 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.263 1.857 7.813 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.706 -2.266 6.828 1.00 0.00 H new ATOM 0 HH TYR A 122 3.475 0.305 9.062 1.00 0.00 H new ATOM 687 N THR A 123 -0.794 1.254 1.124 1.00 0.00 N ATOM 688 CA THR A 123 -1.005 1.781 -0.219 1.00 0.00 C ATOM 689 C THR A 123 -2.108 2.835 -0.217 1.00 0.00 C ATOM 690 O THR A 123 -2.004 3.857 -0.894 1.00 0.00 O ATOM 691 CB THR A 123 -1.363 0.651 -1.185 1.00 0.00 C ATOM 692 OG1 THR A 123 -0.352 -0.342 -1.193 1.00 0.00 O ATOM 693 CG2 THR A 123 -1.554 1.120 -2.611 1.00 0.00 C ATOM 0 H THR A 123 -0.967 0.253 1.217 1.00 0.00 H new ATOM 0 HA THR A 123 -0.078 2.248 -0.551 1.00 0.00 H new ATOM 0 HB THR A 123 -2.309 0.250 -0.821 1.00 0.00 H new ATOM 0 HG1 THR A 123 -0.432 -0.897 -0.389 1.00 0.00 H new ATOM 0 HG21 THR A 123 -1.806 0.269 -3.243 1.00 0.00 H new ATOM 0 HG22 THR A 123 -2.361 1.851 -2.648 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.632 1.578 -2.970 1.00 0.00 H new ATOM 701 N ILE A 124 -3.160 2.581 0.555 1.00 0.00 N ATOM 702 CA ILE A 124 -4.280 3.510 0.652 1.00 0.00 C ATOM 703 C ILE A 124 -3.829 4.838 1.258 1.00 0.00 C ATOM 704 O ILE A 124 -4.095 5.905 0.706 1.00 0.00 O ATOM 705 CB ILE A 124 -5.427 2.915 1.500 1.00 0.00 C ATOM 706 CG1 ILE A 124 -5.969 1.645 0.839 1.00 0.00 C ATOM 707 CG2 ILE A 124 -6.547 3.929 1.695 1.00 0.00 C ATOM 708 CD1 ILE A 124 -6.719 1.903 -0.450 1.00 0.00 C ATOM 0 H ILE A 124 -3.260 1.739 1.123 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.649 3.686 -0.358 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.027 2.660 2.482 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.139 0.968 0.637 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.632 1.136 1.539 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.341 3.484 2.295 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.156 4.809 2.206 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.947 4.221 0.724 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.073 0.957 -0.860 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.570 2.554 -0.252 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.054 2.384 -1.168 1.00 0.00 H new ATOM 720 N GLN A 125 -3.146 4.762 2.396 1.00 0.00 N ATOM 721 CA GLN A 125 -2.658 5.955 3.077 1.00 0.00 C ATOM 722 C GLN A 125 -1.720 6.750 2.174 1.00 0.00 C ATOM 723 O GLN A 125 -1.700 7.978 2.212 1.00 0.00 O ATOM 724 CB GLN A 125 -1.939 5.571 4.372 1.00 0.00 C ATOM 725 CG GLN A 125 -2.313 6.447 5.558 1.00 0.00 C ATOM 726 CD GLN A 125 -1.101 6.931 6.330 1.00 0.00 C ATOM 727 OE1 GLN A 125 -0.512 6.188 7.115 1.00 0.00 O ATOM 728 NE2 GLN A 125 -0.723 8.185 6.112 1.00 0.00 N ATOM 0 H GLN A 125 -2.918 3.886 2.866 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.516 6.582 3.320 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -2.168 4.533 4.611 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -0.863 5.631 4.212 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -2.882 7.307 5.205 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -2.966 5.887 6.227 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -1.240 8.766 5.452 1.00 0.00 H new ATOM 0 HE22 GLN A 125 0.085 8.567 6.604 1.00 0.00 H new ATOM 737 N SER A 126 -0.944 6.040 1.362 1.00 0.00 N ATOM 738 CA SER A 126 -0.007 6.682 0.447 1.00 0.00 C ATOM 739 C SER A 126 -0.726 7.214 -0.790 1.00 0.00 C ATOM 740 O SER A 126 -0.253 8.143 -1.444 1.00 0.00 O ATOM 741 CB SER A 126 1.086 5.697 0.029 1.00 0.00 C ATOM 742 OG SER A 126 1.818 6.188 -1.081 1.00 0.00 O ATOM 0 H SER A 126 -0.945 5.021 1.319 1.00 0.00 H new ATOM 0 HA SER A 126 0.449 7.523 0.969 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.762 5.523 0.866 1.00 0.00 H new ATOM 0 HB3 SER A 126 0.637 4.736 -0.224 1.00 0.00 H new ATOM 0 HG SER A 126 2.763 5.949 -0.981 1.00 0.00 H new ATOM 748 N GLU A 127 -1.865 6.608 -1.112 1.00 0.00 N ATOM 749 CA GLU A 127 -2.641 7.010 -2.278 1.00 0.00 C ATOM 750 C GLU A 127 -3.489 8.233 -1.974 1.00 0.00 C ATOM 751 O GLU A 127 -3.617 9.137 -2.799 1.00 0.00 O ATOM 752 CB GLU A 127 -3.543 5.862 -2.739 1.00 0.00 C ATOM 753 CG GLU A 127 -3.149 5.282 -4.088 1.00 0.00 C ATOM 754 CD GLU A 127 -1.695 4.856 -4.137 1.00 0.00 C ATOM 755 OE1 GLU A 127 -1.291 4.026 -3.295 1.00 0.00 O ATOM 756 OE2 GLU A 127 -0.960 5.351 -5.017 1.00 0.00 O ATOM 0 H GLU A 127 -2.270 5.837 -0.581 1.00 0.00 H new ATOM 0 HA GLU A 127 -1.941 7.261 -3.074 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.519 5.069 -1.991 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.572 6.218 -2.793 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.783 4.423 -4.309 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -3.333 6.023 -4.866 1.00 0.00 H new ATOM 763 N LEU A 128 -4.093 8.238 -0.796 1.00 0.00 N ATOM 764 CA LEU A 128 -4.962 9.326 -0.385 1.00 0.00 C ATOM 765 C LEU A 128 -4.346 10.167 0.732 1.00 0.00 C ATOM 766 O LEU A 128 -4.953 11.134 1.192 1.00 0.00 O ATOM 767 CB LEU A 128 -6.286 8.735 0.077 1.00 0.00 C ATOM 768 CG LEU A 128 -6.896 7.716 -0.889 1.00 0.00 C ATOM 769 CD1 LEU A 128 -6.869 6.324 -0.284 1.00 0.00 C ATOM 770 CD2 LEU A 128 -8.316 8.106 -1.262 1.00 0.00 C ATOM 0 H LEU A 128 -3.995 7.495 -0.104 1.00 0.00 H new ATOM 0 HA LEU A 128 -5.111 9.991 -1.236 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.138 8.256 1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.999 9.546 0.228 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.295 7.710 -1.798 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.307 5.614 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.838 6.038 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.443 6.319 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.728 7.367 -1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.930 8.147 -0.362 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.310 9.084 -1.743 1.00 0.00 H new ATOM 782 N GLY A 129 -3.144 9.803 1.167 1.00 0.00 N ATOM 783 CA GLY A 129 -2.488 10.546 2.223 1.00 0.00 C ATOM 784 C GLY A 129 -3.157 10.351 3.566 1.00 0.00 C ATOM 785 O GLY A 129 -3.855 9.361 3.785 1.00 0.00 O ATOM 0 H GLY A 129 -2.615 9.009 0.807 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -1.446 10.233 2.290 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -2.487 11.606 1.971 1.00 0.00 H new ATOM 789 N ASP A 130 -2.943 11.300 4.466 1.00 0.00 N ATOM 790 CA ASP A 130 -3.528 11.239 5.800 1.00 0.00 C ATOM 791 C ASP A 130 -5.051 11.188 5.723 1.00 0.00 C ATOM 792 O ASP A 130 -5.651 11.679 4.768 1.00 0.00 O ATOM 793 CB ASP A 130 -3.088 12.446 6.630 1.00 0.00 C ATOM 794 CG ASP A 130 -2.844 12.091 8.083 1.00 0.00 C ATOM 795 OD1 ASP A 130 -1.769 11.531 8.385 1.00 0.00 O ATOM 796 OD2 ASP A 130 -3.727 12.373 8.920 1.00 0.00 O ATOM 0 H ASP A 130 -2.367 12.124 4.297 1.00 0.00 H new ATOM 0 HA ASP A 130 -3.175 10.328 6.283 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -2.176 12.864 6.203 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -3.852 13.221 6.572 1.00 0.00 H new ATOM 801 N TYR A 131 -5.669 10.589 6.735 1.00 0.00 N ATOM 802 CA TYR A 131 -7.122 10.472 6.782 1.00 0.00 C ATOM 803 C TYR A 131 -7.766 11.810 7.129 1.00 0.00 C ATOM 804 O TYR A 131 -7.121 12.694 7.693 1.00 0.00 O ATOM 805 CB TYR A 131 -7.536 9.413 7.804 1.00 0.00 C ATOM 806 CG TYR A 131 -8.972 8.960 7.660 1.00 0.00 C ATOM 807 CD1 TYR A 131 -9.320 7.976 6.744 1.00 0.00 C ATOM 808 CD2 TYR A 131 -9.977 9.519 8.438 1.00 0.00 C ATOM 809 CE1 TYR A 131 -10.631 7.560 6.609 1.00 0.00 C ATOM 810 CE2 TYR A 131 -11.290 9.108 8.309 1.00 0.00 C ATOM 811 CZ TYR A 131 -11.612 8.129 7.393 1.00 0.00 C ATOM 812 OH TYR A 131 -12.918 7.718 7.262 1.00 0.00 O ATOM 0 H TYR A 131 -5.187 10.177 7.534 1.00 0.00 H new ATOM 0 HA TYR A 131 -7.469 10.169 5.794 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -6.880 8.548 7.705 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -7.389 9.812 8.808 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -8.554 7.529 6.128 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -9.729 10.287 9.155 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -10.886 6.793 5.893 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -12.060 9.551 8.923 1.00 0.00 H new ATOM 0 HH TYR A 131 -13.006 7.157 6.463 1.00 0.00 H new ATOM 822 N ASP A 132 -9.043 11.952 6.788 1.00 0.00 N ATOM 823 CA ASP A 132 -9.778 13.181 7.064 1.00 0.00 C ATOM 824 C ASP A 132 -11.234 12.878 7.413 1.00 0.00 C ATOM 825 O ASP A 132 -12.091 12.814 6.532 1.00 0.00 O ATOM 826 CB ASP A 132 -9.715 14.119 5.857 1.00 0.00 C ATOM 827 CG ASP A 132 -8.556 15.093 5.942 1.00 0.00 C ATOM 828 OD1 ASP A 132 -8.494 15.857 6.928 1.00 0.00 O ATOM 829 OD2 ASP A 132 -7.711 15.093 5.022 1.00 0.00 O ATOM 0 H ASP A 132 -9.591 11.230 6.320 1.00 0.00 H new ATOM 0 HA ASP A 132 -9.312 13.670 7.920 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -9.624 13.528 4.946 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -10.649 14.676 5.784 1.00 0.00 H new ATOM 834 N PRO A 133 -11.533 12.685 8.710 1.00 0.00 N ATOM 835 CA PRO A 133 -12.893 12.385 9.172 1.00 0.00 C ATOM 836 C PRO A 133 -13.888 13.484 8.807 1.00 0.00 C ATOM 837 O PRO A 133 -15.095 13.248 8.756 1.00 0.00 O ATOM 838 CB PRO A 133 -12.748 12.284 10.695 1.00 0.00 C ATOM 839 CG PRO A 133 -11.299 12.028 10.930 1.00 0.00 C ATOM 840 CD PRO A 133 -10.573 12.740 9.825 1.00 0.00 C ATOM 0 HA PRO A 133 -13.283 11.479 8.708 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -13.070 13.203 11.184 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -13.361 11.477 11.097 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -10.989 12.402 11.906 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -11.083 10.960 10.915 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -10.330 13.767 10.098 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -9.634 12.246 9.574 1.00 0.00 H new ATOM 848 N GLU A 134 -13.374 14.684 8.555 1.00 0.00 N ATOM 849 CA GLU A 134 -14.219 15.817 8.196 1.00 0.00 C ATOM 850 C GLU A 134 -14.963 15.552 6.891 1.00 0.00 C ATOM 851 O GLU A 134 -16.064 16.059 6.679 1.00 0.00 O ATOM 852 CB GLU A 134 -13.376 17.087 8.066 1.00 0.00 C ATOM 853 CG GLU A 134 -12.165 16.922 7.161 1.00 0.00 C ATOM 854 CD GLU A 134 -12.052 18.027 6.129 1.00 0.00 C ATOM 855 OE1 GLU A 134 -13.084 18.377 5.519 1.00 0.00 O ATOM 856 OE2 GLU A 134 -10.932 18.543 5.931 1.00 0.00 O ATOM 0 H GLU A 134 -12.377 14.896 8.593 1.00 0.00 H new ATOM 0 HA GLU A 134 -14.954 15.955 8.989 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -14.002 17.891 7.679 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -13.040 17.393 9.057 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -11.261 16.905 7.770 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -12.225 15.960 6.652 1.00 0.00 H new ATOM 863 N LEU A 135 -14.353 14.756 6.019 1.00 0.00 N ATOM 864 CA LEU A 135 -14.958 14.428 4.734 1.00 0.00 C ATOM 865 C LEU A 135 -15.682 13.086 4.796 1.00 0.00 C ATOM 866 O LEU A 135 -16.655 12.862 4.076 1.00 0.00 O ATOM 867 CB LEU A 135 -13.890 14.393 3.639 1.00 0.00 C ATOM 868 CG LEU A 135 -13.153 15.714 3.414 1.00 0.00 C ATOM 869 CD1 LEU A 135 -12.155 15.582 2.275 1.00 0.00 C ATOM 870 CD2 LEU A 135 -14.144 16.833 3.131 1.00 0.00 C ATOM 0 H LEU A 135 -13.442 14.327 6.179 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.688 15.202 4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.159 13.624 3.890 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -14.360 14.092 2.703 1.00 0.00 H new ATOM 0 HG LEU A 135 -12.604 15.962 4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -11.641 16.532 2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.427 14.808 2.517 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.681 15.311 1.360 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.604 17.766 2.973 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.720 16.592 2.238 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -14.820 16.944 3.979 1.00 0.00 H new ATOM 882 N HIS A 136 -15.201 12.197 5.660 1.00 0.00 N ATOM 883 CA HIS A 136 -15.804 10.878 5.813 1.00 0.00 C ATOM 884 C HIS A 136 -15.718 10.088 4.511 1.00 0.00 C ATOM 885 O HIS A 136 -15.242 10.595 3.496 1.00 0.00 O ATOM 886 CB HIS A 136 -17.265 11.008 6.249 1.00 0.00 C ATOM 887 CG HIS A 136 -17.442 11.089 7.733 1.00 0.00 C ATOM 888 ND1 HIS A 136 -18.464 11.795 8.332 1.00 0.00 N ATOM 889 CD2 HIS A 136 -16.722 10.546 8.743 1.00 0.00 C ATOM 890 CE1 HIS A 136 -18.364 11.684 9.645 1.00 0.00 C ATOM 891 NE2 HIS A 136 -17.315 10.930 9.920 1.00 0.00 N ATOM 0 H HIS A 136 -14.397 12.366 6.264 1.00 0.00 H new ATOM 0 HA HIS A 136 -15.250 10.340 6.582 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -17.694 11.899 5.791 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -17.826 10.153 5.871 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -15.844 9.926 8.641 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -19.027 12.133 10.370 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -16.997 10.675 10.855 1.00 0.00 H new ATOM 900 N GLY A 137 -16.180 8.842 4.550 1.00 0.00 N ATOM 901 CA GLY A 137 -16.146 8.001 3.368 1.00 0.00 C ATOM 902 C GLY A 137 -16.731 6.631 3.617 1.00 0.00 C ATOM 903 O GLY A 137 -17.678 6.223 2.945 1.00 0.00 O ATOM 0 H GLY A 137 -16.577 8.400 5.379 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -16.698 8.488 2.564 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -15.115 7.897 3.030 1.00 0.00 H new ATOM 907 N VAL A 138 -16.163 5.920 4.584 1.00 0.00 N ATOM 908 CA VAL A 138 -16.626 4.583 4.928 1.00 0.00 C ATOM 909 C VAL A 138 -16.351 3.597 3.793 1.00 0.00 C ATOM 910 O VAL A 138 -15.529 2.691 3.932 1.00 0.00 O ATOM 911 CB VAL A 138 -18.134 4.585 5.264 1.00 0.00 C ATOM 912 CG1 VAL A 138 -18.689 3.171 5.287 1.00 0.00 C ATOM 913 CG2 VAL A 138 -18.380 5.281 6.594 1.00 0.00 C ATOM 0 H VAL A 138 -15.378 6.250 5.145 1.00 0.00 H new ATOM 0 HA VAL A 138 -16.072 4.265 5.811 1.00 0.00 H new ATOM 0 HB VAL A 138 -18.656 5.137 4.482 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -19.752 3.201 5.526 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -18.550 2.710 4.309 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -18.164 2.586 6.042 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -19.447 5.274 6.816 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -17.841 4.757 7.384 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -18.028 6.311 6.536 1.00 0.00 H new ATOM 923 N ASP A 139 -17.044 3.776 2.673 1.00 0.00 N ATOM 924 CA ASP A 139 -16.875 2.899 1.521 1.00 0.00 C ATOM 925 C ASP A 139 -15.915 3.507 0.501 1.00 0.00 C ATOM 926 O ASP A 139 -16.036 3.264 -0.699 1.00 0.00 O ATOM 927 CB ASP A 139 -18.227 2.623 0.861 1.00 0.00 C ATOM 928 CG ASP A 139 -19.257 2.106 1.847 1.00 0.00 C ATOM 929 OD1 ASP A 139 -19.966 2.936 2.454 1.00 0.00 O ATOM 930 OD2 ASP A 139 -19.354 0.872 2.012 1.00 0.00 O ATOM 0 H ASP A 139 -17.728 4.521 2.539 1.00 0.00 H new ATOM 0 HA ASP A 139 -16.450 1.960 1.875 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -18.597 3.539 0.400 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -18.096 1.894 0.061 1.00 0.00 H new ATOM 935 N TYR A 140 -14.961 4.296 0.985 1.00 0.00 N ATOM 936 CA TYR A 140 -13.982 4.932 0.111 1.00 0.00 C ATOM 937 C TYR A 140 -12.964 3.915 -0.396 1.00 0.00 C ATOM 938 O TYR A 140 -12.440 4.045 -1.502 1.00 0.00 O ATOM 939 CB TYR A 140 -13.266 6.066 0.848 1.00 0.00 C ATOM 940 CG TYR A 140 -12.564 5.622 2.111 1.00 0.00 C ATOM 941 CD1 TYR A 140 -11.286 5.081 2.064 1.00 0.00 C ATOM 942 CD2 TYR A 140 -13.181 5.743 3.349 1.00 0.00 C ATOM 943 CE1 TYR A 140 -10.641 4.674 3.216 1.00 0.00 C ATOM 944 CE2 TYR A 140 -12.543 5.338 4.506 1.00 0.00 C ATOM 945 CZ TYR A 140 -11.274 4.804 4.434 1.00 0.00 C ATOM 946 OH TYR A 140 -10.636 4.399 5.584 1.00 0.00 O ATOM 0 H TYR A 140 -14.845 4.510 1.976 1.00 0.00 H new ATOM 0 HA TYR A 140 -14.513 5.346 -0.746 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -12.536 6.519 0.177 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -13.992 6.840 1.099 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -10.788 4.977 1.111 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -14.175 6.160 3.409 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -9.646 4.256 3.163 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -13.036 5.439 5.462 1.00 0.00 H new ATOM 0 HH TYR A 140 -11.100 4.770 6.363 1.00 0.00 H new ATOM 956 N VAL A 141 -12.692 2.901 0.419 1.00 0.00 N ATOM 957 CA VAL A 141 -11.740 1.858 0.052 1.00 0.00 C ATOM 958 C VAL A 141 -12.200 1.100 -1.192 1.00 0.00 C ATOM 959 O VAL A 141 -11.403 0.441 -1.860 1.00 0.00 O ATOM 960 CB VAL A 141 -11.537 0.854 1.202 1.00 0.00 C ATOM 961 CG1 VAL A 141 -10.395 -0.097 0.884 1.00 0.00 C ATOM 962 CG2 VAL A 141 -11.281 1.585 2.511 1.00 0.00 C ATOM 0 H VAL A 141 -13.117 2.779 1.338 1.00 0.00 H new ATOM 0 HA VAL A 141 -10.794 2.357 -0.160 1.00 0.00 H new ATOM 0 HB VAL A 141 -12.449 0.267 1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -10.266 -0.799 1.708 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.623 -0.647 -0.029 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.476 0.472 0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -11.140 0.859 3.312 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -10.385 2.199 2.416 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -12.134 2.222 2.745 1.00 0.00 H new ATOM 972 N SER A 142 -13.491 1.201 -1.499 1.00 0.00 N ATOM 973 CA SER A 142 -14.066 0.532 -2.661 1.00 0.00 C ATOM 974 C SER A 142 -13.461 1.049 -3.966 1.00 0.00 C ATOM 975 O SER A 142 -13.622 0.431 -5.018 1.00 0.00 O ATOM 976 CB SER A 142 -15.584 0.723 -2.683 1.00 0.00 C ATOM 977 OG SER A 142 -16.233 -0.248 -1.881 1.00 0.00 O ATOM 0 H SER A 142 -14.162 1.744 -0.955 1.00 0.00 H new ATOM 0 HA SER A 142 -13.833 -0.530 -2.578 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.833 1.721 -2.323 1.00 0.00 H new ATOM 0 HB3 SER A 142 -15.947 0.654 -3.708 1.00 0.00 H new ATOM 0 HG SER A 142 -17.202 -0.103 -1.911 1.00 0.00 H new ATOM 983 N ASP A 143 -12.763 2.180 -3.896 1.00 0.00 N ATOM 984 CA ASP A 143 -12.139 2.764 -5.077 1.00 0.00 C ATOM 985 C ASP A 143 -10.778 2.129 -5.353 1.00 0.00 C ATOM 986 O ASP A 143 -10.281 2.172 -6.479 1.00 0.00 O ATOM 987 CB ASP A 143 -11.983 4.276 -4.901 1.00 0.00 C ATOM 988 CG ASP A 143 -13.304 5.011 -5.012 1.00 0.00 C ATOM 989 OD1 ASP A 143 -13.984 4.858 -6.048 1.00 0.00 O ATOM 990 OD2 ASP A 143 -13.660 5.739 -4.061 1.00 0.00 O ATOM 0 H ASP A 143 -12.616 2.708 -3.036 1.00 0.00 H new ATOM 0 HA ASP A 143 -12.787 2.567 -5.931 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -11.537 4.481 -3.928 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.294 4.657 -5.655 1.00 0.00 H new ATOM 995 N PHE A 144 -10.175 1.544 -4.321 1.00 0.00 N ATOM 996 CA PHE A 144 -8.870 0.906 -4.461 1.00 0.00 C ATOM 997 C PHE A 144 -8.967 -0.601 -4.248 1.00 0.00 C ATOM 998 O PHE A 144 -9.372 -1.065 -3.182 1.00 0.00 O ATOM 999 CB PHE A 144 -7.876 1.508 -3.466 1.00 0.00 C ATOM 1000 CG PHE A 144 -7.729 2.997 -3.595 1.00 0.00 C ATOM 1001 CD1 PHE A 144 -6.826 3.541 -4.494 1.00 0.00 C ATOM 1002 CD2 PHE A 144 -8.493 3.851 -2.817 1.00 0.00 C ATOM 1003 CE1 PHE A 144 -6.688 4.911 -4.614 1.00 0.00 C ATOM 1004 CE2 PHE A 144 -8.360 5.222 -2.933 1.00 0.00 C ATOM 1005 CZ PHE A 144 -7.456 5.753 -3.833 1.00 0.00 C ATOM 0 H PHE A 144 -10.569 1.499 -3.381 1.00 0.00 H new ATOM 0 HA PHE A 144 -8.517 1.086 -5.476 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -8.198 1.269 -2.453 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -6.902 1.041 -3.609 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -6.224 2.888 -5.108 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -9.201 3.441 -2.112 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -5.980 5.323 -5.318 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -8.962 5.877 -2.321 1.00 0.00 H new ATOM 0 HZ PHE A 144 -7.350 6.824 -3.926 1.00 0.00 H new ATOM 1015 N LYS A 145 -8.594 -1.360 -5.273 1.00 0.00 N ATOM 1016 CA LYS A 145 -8.638 -2.817 -5.205 1.00 0.00 C ATOM 1017 C LYS A 145 -7.487 -3.363 -4.364 1.00 0.00 C ATOM 1018 O LYS A 145 -6.348 -3.432 -4.823 1.00 0.00 O ATOM 1019 CB LYS A 145 -8.583 -3.416 -6.612 1.00 0.00 C ATOM 1020 CG LYS A 145 -9.877 -3.254 -7.393 1.00 0.00 C ATOM 1021 CD LYS A 145 -10.100 -4.415 -8.347 1.00 0.00 C ATOM 1022 CE LYS A 145 -9.120 -4.379 -9.509 1.00 0.00 C ATOM 1023 NZ LYS A 145 -8.731 -5.746 -9.951 1.00 0.00 N ATOM 0 H LYS A 145 -8.257 -0.990 -6.162 1.00 0.00 H new ATOM 0 HA LYS A 145 -9.577 -3.102 -4.730 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -7.772 -2.945 -7.167 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -8.344 -4.477 -6.537 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -10.715 -3.185 -6.700 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -9.850 -2.320 -7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -9.992 -5.356 -7.808 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -11.120 -4.382 -8.729 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -9.568 -3.841 -10.345 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -8.228 -3.825 -9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -8.062 -5.677 -10.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -8.280 -6.251 -9.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -9.578 -6.266 -10.256 1.00 0.00 H new ATOM 1037 N LEU A 146 -7.795 -3.747 -3.129 1.00 0.00 N ATOM 1038 CA LEU A 146 -6.788 -4.286 -2.220 1.00 0.00 C ATOM 1039 C LEU A 146 -6.645 -5.798 -2.384 1.00 0.00 C ATOM 1040 O LEU A 146 -5.637 -6.380 -1.984 1.00 0.00 O ATOM 1041 CB LEU A 146 -7.148 -3.958 -0.770 1.00 0.00 C ATOM 1042 CG LEU A 146 -7.714 -2.555 -0.540 1.00 0.00 C ATOM 1043 CD1 LEU A 146 -8.801 -2.585 0.525 1.00 0.00 C ATOM 1044 CD2 LEU A 146 -6.602 -1.592 -0.147 1.00 0.00 C ATOM 0 H LEU A 146 -8.734 -3.695 -2.734 1.00 0.00 H new ATOM 0 HA LEU A 146 -5.835 -3.820 -2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -7.877 -4.688 -0.419 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -6.256 -4.078 -0.155 1.00 0.00 H new ATOM 0 HG LEU A 146 -8.159 -2.204 -1.471 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -9.191 -1.578 0.675 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -9.608 -3.243 0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -8.383 -2.955 1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.021 -0.598 0.013 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -6.128 -1.938 0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -5.860 -1.549 -0.944 1.00 0.00 H new ATOM 1056 N ALA A 147 -7.657 -6.431 -2.973 1.00 0.00 N ATOM 1057 CA ALA A 147 -7.633 -7.873 -3.183 1.00 0.00 C ATOM 1058 C ALA A 147 -8.851 -8.333 -3.980 1.00 0.00 C ATOM 1059 O ALA A 147 -9.819 -7.589 -4.136 1.00 0.00 O ATOM 1060 CB ALA A 147 -7.569 -8.599 -1.847 1.00 0.00 C ATOM 0 H ALA A 147 -8.501 -5.968 -3.312 1.00 0.00 H new ATOM 0 HA ALA A 147 -6.741 -8.117 -3.760 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -7.552 -9.675 -2.018 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -6.666 -8.302 -1.314 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -8.444 -8.341 -1.250 1.00 0.00 H new ATOM 1066 N PRO A 148 -8.818 -9.574 -4.498 1.00 0.00 N ATOM 1067 CA PRO A 148 -9.925 -10.132 -5.281 1.00 0.00 C ATOM 1068 C PRO A 148 -11.139 -10.456 -4.418 1.00 0.00 C ATOM 1069 O PRO A 148 -12.277 -10.187 -4.804 1.00 0.00 O ATOM 1070 CB PRO A 148 -9.330 -11.412 -5.871 1.00 0.00 C ATOM 1071 CG PRO A 148 -8.266 -11.811 -4.910 1.00 0.00 C ATOM 1072 CD PRO A 148 -7.702 -10.529 -4.359 1.00 0.00 C ATOM 0 HA PRO A 148 -10.290 -9.430 -6.031 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -10.086 -12.191 -5.971 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -8.920 -11.236 -6.866 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -8.674 -12.432 -4.113 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -7.492 -12.396 -5.406 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -7.396 -10.640 -3.319 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.824 -10.204 -4.917 1.00 0.00 H new ATOM 1080 N ASN A 149 -10.890 -11.036 -3.248 1.00 0.00 N ATOM 1081 CA ASN A 149 -11.965 -11.395 -2.330 1.00 0.00 C ATOM 1082 C ASN A 149 -11.998 -10.446 -1.137 1.00 0.00 C ATOM 1083 O ASN A 149 -11.656 -10.825 -0.017 1.00 0.00 O ATOM 1084 CB ASN A 149 -11.792 -12.838 -1.849 1.00 0.00 C ATOM 1085 CG ASN A 149 -12.534 -13.831 -2.721 1.00 0.00 C ATOM 1086 OD1 ASN A 149 -13.179 -14.753 -2.222 1.00 0.00 O ATOM 1087 ND2 ASN A 149 -12.444 -13.648 -4.033 1.00 0.00 N ATOM 0 H ASN A 149 -9.954 -11.267 -2.914 1.00 0.00 H new ATOM 0 HA ASN A 149 -12.912 -11.310 -2.864 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -10.732 -13.090 -1.838 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -12.150 -12.921 -0.823 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -12.921 -14.285 -4.671 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -11.898 -12.870 -4.403 1.00 0.00 H new ATOM 1094 N GLN A 150 -12.410 -9.208 -1.387 1.00 0.00 N ATOM 1095 CA GLN A 150 -12.486 -8.200 -0.336 1.00 0.00 C ATOM 1096 C GLN A 150 -13.763 -8.359 0.484 1.00 0.00 C ATOM 1097 O GLN A 150 -14.869 -8.289 -0.051 1.00 0.00 O ATOM 1098 CB GLN A 150 -12.427 -6.797 -0.940 1.00 0.00 C ATOM 1099 CG GLN A 150 -12.018 -5.725 0.056 1.00 0.00 C ATOM 1100 CD GLN A 150 -11.705 -4.400 -0.610 1.00 0.00 C ATOM 1101 OE1 GLN A 150 -10.502 -4.283 -1.158 1.00 0.00 O flip ATOM 1102 NE2 GLN A 150 -12.536 -3.491 -0.632 1.00 0.00 N flip ATOM 0 H GLN A 150 -12.697 -8.878 -2.309 1.00 0.00 H new ATOM 0 HA GLN A 150 -11.632 -8.340 0.326 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -11.722 -6.797 -1.771 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -13.405 -6.546 -1.351 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -12.820 -5.583 0.781 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -11.143 -6.064 0.611 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -13.449 -3.624 -0.198 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -12.311 -2.605 -1.084 1.00 0.00 H new ATOM 1111 N THR A 151 -13.599 -8.572 1.785 1.00 0.00 N ATOM 1112 CA THR A 151 -14.739 -8.740 2.682 1.00 0.00 C ATOM 1113 C THR A 151 -14.738 -7.671 3.765 1.00 0.00 C ATOM 1114 O THR A 151 -13.750 -6.960 3.948 1.00 0.00 O ATOM 1115 CB THR A 151 -14.716 -10.127 3.331 1.00 0.00 C ATOM 1116 OG1 THR A 151 -13.863 -10.139 4.461 1.00 0.00 O ATOM 1117 CG2 THR A 151 -14.252 -11.223 2.398 1.00 0.00 C ATOM 0 H THR A 151 -12.689 -8.633 2.243 1.00 0.00 H new ATOM 0 HA THR A 151 -15.647 -8.640 2.088 1.00 0.00 H new ATOM 0 HB THR A 151 -15.750 -10.326 3.612 1.00 0.00 H new ATOM 0 HG1 THR A 151 -13.864 -11.033 4.862 1.00 0.00 H new ATOM 0 HG21 THR A 151 -14.261 -12.177 2.925 1.00 0.00 H new ATOM 0 HG22 THR A 151 -14.921 -11.277 1.539 1.00 0.00 H new ATOM 0 HG23 THR A 151 -13.240 -11.006 2.057 1.00 0.00 H new ATOM 1125 N LYS A 152 -15.850 -7.565 4.489 1.00 0.00 N ATOM 1126 CA LYS A 152 -15.972 -6.584 5.562 1.00 0.00 C ATOM 1127 C LYS A 152 -14.749 -6.629 6.472 1.00 0.00 C ATOM 1128 O LYS A 152 -14.299 -5.600 6.975 1.00 0.00 O ATOM 1129 CB LYS A 152 -17.242 -6.844 6.376 1.00 0.00 C ATOM 1130 CG LYS A 152 -17.933 -5.575 6.848 1.00 0.00 C ATOM 1131 CD LYS A 152 -19.167 -5.888 7.678 1.00 0.00 C ATOM 1132 CE LYS A 152 -20.169 -4.745 7.641 1.00 0.00 C ATOM 1133 NZ LYS A 152 -21.574 -5.235 7.713 1.00 0.00 N ATOM 0 H LYS A 152 -16.677 -8.146 4.352 1.00 0.00 H new ATOM 0 HA LYS A 152 -16.036 -5.592 5.115 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -17.939 -7.424 5.771 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -16.989 -7.454 7.243 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -17.237 -4.979 7.439 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -18.217 -4.972 5.986 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -19.637 -6.797 7.304 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -18.873 -6.082 8.710 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -19.978 -4.068 8.473 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -20.031 -4.171 6.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -22.226 -4.425 7.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -21.765 -5.861 6.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -21.713 -5.761 8.599 1.00 0.00 H new ATOM 1147 N GLU A 153 -14.216 -7.830 6.677 1.00 0.00 N ATOM 1148 CA GLU A 153 -13.043 -8.007 7.524 1.00 0.00 C ATOM 1149 C GLU A 153 -11.843 -7.266 6.943 1.00 0.00 C ATOM 1150 O GLU A 153 -11.269 -6.390 7.591 1.00 0.00 O ATOM 1151 CB GLU A 153 -12.716 -9.493 7.681 1.00 0.00 C ATOM 1152 CG GLU A 153 -13.328 -10.123 8.922 1.00 0.00 C ATOM 1153 CD GLU A 153 -14.841 -10.181 8.860 1.00 0.00 C ATOM 1154 OE1 GLU A 153 -15.477 -9.106 8.854 1.00 0.00 O ATOM 1155 OE2 GLU A 153 -15.391 -11.302 8.818 1.00 0.00 O ATOM 0 H GLU A 153 -14.577 -8.692 6.269 1.00 0.00 H new ATOM 0 HA GLU A 153 -13.267 -7.591 8.506 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -13.069 -10.029 6.800 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -11.634 -9.616 7.717 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -12.934 -11.132 9.045 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -13.026 -9.554 9.801 1.00 0.00 H new ATOM 1162 N LEU A 154 -11.473 -7.619 5.716 1.00 0.00 N ATOM 1163 CA LEU A 154 -10.346 -6.981 5.046 1.00 0.00 C ATOM 1164 C LEU A 154 -10.587 -5.480 4.912 1.00 0.00 C ATOM 1165 O LEU A 154 -9.692 -4.672 5.155 1.00 0.00 O ATOM 1166 CB LEU A 154 -10.128 -7.610 3.667 1.00 0.00 C ATOM 1167 CG LEU A 154 -9.058 -6.939 2.802 1.00 0.00 C ATOM 1168 CD1 LEU A 154 -7.708 -6.960 3.506 1.00 0.00 C ATOM 1169 CD2 LEU A 154 -8.966 -7.623 1.446 1.00 0.00 C ATOM 0 H LEU A 154 -11.937 -8.342 5.166 1.00 0.00 H new ATOM 0 HA LEU A 154 -9.450 -7.135 5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.858 -8.657 3.803 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -11.073 -7.592 3.125 1.00 0.00 H new ATOM 0 HG LEU A 154 -9.344 -5.899 2.645 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.961 -6.478 2.875 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.783 -6.425 4.453 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.412 -7.992 3.695 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -8.201 -7.134 0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -8.704 -8.672 1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -9.928 -7.554 0.938 1.00 0.00 H new ATOM 1181 N GLU A 155 -11.809 -5.119 4.533 1.00 0.00 N ATOM 1182 CA GLU A 155 -12.177 -3.715 4.374 1.00 0.00 C ATOM 1183 C GLU A 155 -11.987 -2.959 5.686 1.00 0.00 C ATOM 1184 O GLU A 155 -11.302 -1.938 5.733 1.00 0.00 O ATOM 1185 CB GLU A 155 -13.630 -3.594 3.910 1.00 0.00 C ATOM 1186 CG GLU A 155 -13.880 -4.181 2.530 1.00 0.00 C ATOM 1187 CD GLU A 155 -15.327 -4.056 2.098 1.00 0.00 C ATOM 1188 OE1 GLU A 155 -16.220 -4.335 2.925 1.00 0.00 O ATOM 1189 OE2 GLU A 155 -15.568 -3.677 0.932 1.00 0.00 O ATOM 0 H GLU A 155 -12.561 -5.778 4.330 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.526 -3.275 3.618 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -14.276 -4.095 4.631 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -13.914 -2.542 3.905 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -13.243 -3.677 1.804 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -13.594 -5.233 2.529 1.00 0.00 H new ATOM 1196 N GLU A 156 -12.602 -3.470 6.748 1.00 0.00 N ATOM 1197 CA GLU A 156 -12.506 -2.848 8.065 1.00 0.00 C ATOM 1198 C GLU A 156 -11.049 -2.630 8.460 1.00 0.00 C ATOM 1199 O GLU A 156 -10.660 -1.533 8.858 1.00 0.00 O ATOM 1200 CB GLU A 156 -13.207 -3.714 9.114 1.00 0.00 C ATOM 1201 CG GLU A 156 -14.723 -3.607 9.076 1.00 0.00 C ATOM 1202 CD GLU A 156 -15.285 -2.839 10.257 1.00 0.00 C ATOM 1203 OE1 GLU A 156 -14.925 -1.654 10.419 1.00 0.00 O ATOM 1204 OE2 GLU A 156 -16.084 -3.423 11.019 1.00 0.00 O ATOM 0 H GLU A 156 -13.173 -4.315 6.723 1.00 0.00 H new ATOM 0 HA GLU A 156 -12.999 -1.877 8.017 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -12.921 -4.755 8.964 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -12.855 -3.426 10.105 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -15.025 -3.116 8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -15.154 -4.608 9.061 1.00 0.00 H new ATOM 1211 N LYS A 157 -10.251 -3.688 8.359 1.00 0.00 N ATOM 1212 CA LYS A 157 -8.839 -3.618 8.717 1.00 0.00 C ATOM 1213 C LYS A 157 -8.117 -2.546 7.904 1.00 0.00 C ATOM 1214 O LYS A 157 -7.167 -1.928 8.384 1.00 0.00 O ATOM 1215 CB LYS A 157 -8.169 -4.976 8.499 1.00 0.00 C ATOM 1216 CG LYS A 157 -7.094 -5.295 9.525 1.00 0.00 C ATOM 1217 CD LYS A 157 -7.690 -5.892 10.790 1.00 0.00 C ATOM 1218 CE LYS A 157 -6.608 -6.430 11.713 1.00 0.00 C ATOM 1219 NZ LYS A 157 -7.133 -6.722 13.076 1.00 0.00 N ATOM 0 H LYS A 157 -10.558 -4.604 8.032 1.00 0.00 H new ATOM 0 HA LYS A 157 -8.773 -3.350 9.772 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -8.930 -5.756 8.528 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -7.727 -4.998 7.503 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -6.376 -5.993 9.096 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -6.546 -4.386 9.774 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -8.272 -5.133 11.313 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -8.378 -6.695 10.526 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -6.185 -7.339 11.285 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -5.798 -5.704 11.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -6.364 -7.087 13.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -7.514 -5.850 13.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.889 -7.434 13.012 1.00 0.00 H new ATOM 1233 N VAL A 158 -8.574 -2.322 6.676 1.00 0.00 N ATOM 1234 CA VAL A 158 -7.966 -1.316 5.812 1.00 0.00 C ATOM 1235 C VAL A 158 -8.199 0.089 6.363 1.00 0.00 C ATOM 1236 O VAL A 158 -7.257 0.863 6.539 1.00 0.00 O ATOM 1237 CB VAL A 158 -8.519 -1.394 4.373 1.00 0.00 C ATOM 1238 CG1 VAL A 158 -7.874 -0.337 3.488 1.00 0.00 C ATOM 1239 CG2 VAL A 158 -8.306 -2.785 3.792 1.00 0.00 C ATOM 0 H VAL A 158 -9.360 -2.821 6.258 1.00 0.00 H new ATOM 0 HA VAL A 158 -6.896 -1.524 5.788 1.00 0.00 H new ATOM 0 HB VAL A 158 -9.591 -1.198 4.409 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.279 -0.411 2.479 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.084 0.653 3.892 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -6.796 -0.495 3.459 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -8.702 -2.820 2.777 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -7.240 -3.012 3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -8.823 -3.520 4.409 1.00 0.00 H new ATOM 1249 N MET A 159 -9.460 0.410 6.633 1.00 0.00 N ATOM 1250 CA MET A 159 -9.821 1.721 7.162 1.00 0.00 C ATOM 1251 C MET A 159 -9.304 1.902 8.586 1.00 0.00 C ATOM 1252 O MET A 159 -8.839 2.980 8.956 1.00 0.00 O ATOM 1253 CB MET A 159 -11.340 1.904 7.133 1.00 0.00 C ATOM 1254 CG MET A 159 -11.962 1.617 5.777 1.00 0.00 C ATOM 1255 SD MET A 159 -13.727 1.266 5.882 1.00 0.00 S ATOM 1256 CE MET A 159 -13.875 -0.080 4.709 1.00 0.00 C ATOM 0 H MET A 159 -10.250 -0.220 6.494 1.00 0.00 H new ATOM 0 HA MET A 159 -9.356 2.477 6.530 1.00 0.00 H new ATOM 0 HB2 MET A 159 -11.791 1.247 7.877 1.00 0.00 H new ATOM 0 HB3 MET A 159 -11.580 2.927 7.424 1.00 0.00 H new ATOM 0 HG2 MET A 159 -11.804 2.473 5.121 1.00 0.00 H new ATOM 0 HG3 MET A 159 -11.453 0.768 5.321 1.00 0.00 H new ATOM 0 HE1 MET A 159 -14.387 0.272 3.814 1.00 0.00 H new ATOM 0 HE2 MET A 159 -12.882 -0.440 4.441 1.00 0.00 H new ATOM 0 HE3 MET A 159 -14.447 -0.892 5.158 1.00 0.00 H new ATOM 1266 N GLU A 160 -9.392 0.841 9.382 1.00 0.00 N ATOM 1267 CA GLU A 160 -8.937 0.883 10.767 1.00 0.00 C ATOM 1268 C GLU A 160 -7.451 1.219 10.846 1.00 0.00 C ATOM 1269 O GLU A 160 -7.055 2.169 11.521 1.00 0.00 O ATOM 1270 CB GLU A 160 -9.207 -0.459 11.453 1.00 0.00 C ATOM 1271 CG GLU A 160 -10.436 -0.448 12.349 1.00 0.00 C ATOM 1272 CD GLU A 160 -10.106 -0.753 13.797 1.00 0.00 C ATOM 1273 OE1 GLU A 160 -9.889 -1.941 14.119 1.00 0.00 O ATOM 1274 OE2 GLU A 160 -10.065 0.195 14.609 1.00 0.00 O ATOM 0 H GLU A 160 -9.774 -0.059 9.091 1.00 0.00 H new ATOM 0 HA GLU A 160 -9.493 1.667 11.282 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -9.330 -1.229 10.691 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -8.336 -0.735 12.048 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -10.917 0.528 12.288 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -11.155 -1.181 11.982 1.00 0.00 H new ATOM 1281 N LEU A 161 -6.634 0.433 10.154 1.00 0.00 N ATOM 1282 CA LEU A 161 -5.191 0.646 10.147 1.00 0.00 C ATOM 1283 C LEU A 161 -4.846 2.032 9.612 1.00 0.00 C ATOM 1284 O LEU A 161 -3.936 2.693 10.114 1.00 0.00 O ATOM 1285 CB LEU A 161 -4.503 -0.423 9.298 1.00 0.00 C ATOM 1286 CG LEU A 161 -4.269 -1.760 10.002 1.00 0.00 C ATOM 1287 CD1 LEU A 161 -4.210 -2.890 8.986 1.00 0.00 C ATOM 1288 CD2 LEU A 161 -2.991 -1.712 10.825 1.00 0.00 C ATOM 0 H LEU A 161 -6.946 -0.358 9.590 1.00 0.00 H new ATOM 0 HA LEU A 161 -4.834 0.574 11.174 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.105 -0.600 8.407 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -3.542 -0.034 8.961 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.104 -1.947 10.677 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.043 -3.835 9.502 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -5.152 -2.937 8.439 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.393 -2.709 8.287 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -2.840 -2.672 11.319 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.144 -1.504 10.171 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -3.071 -0.926 11.576 1.00 0.00 H new ATOM 1300 N HIS A 162 -5.578 2.467 8.591 1.00 0.00 N ATOM 1301 CA HIS A 162 -5.348 3.776 7.987 1.00 0.00 C ATOM 1302 C HIS A 162 -5.431 4.883 9.034 1.00 0.00 C ATOM 1303 O HIS A 162 -4.502 5.675 9.189 1.00 0.00 O ATOM 1304 CB HIS A 162 -6.367 4.034 6.876 1.00 0.00 C ATOM 1305 CG HIS A 162 -6.063 5.250 6.057 1.00 0.00 C ATOM 1306 ND1 HIS A 162 -6.213 5.291 4.686 1.00 0.00 N ATOM 1307 CD2 HIS A 162 -5.616 6.475 6.421 1.00 0.00 C ATOM 1308 CE1 HIS A 162 -5.869 6.488 4.244 1.00 0.00 C ATOM 1309 NE2 HIS A 162 -5.504 7.225 5.276 1.00 0.00 N ATOM 0 H HIS A 162 -6.335 1.933 8.164 1.00 0.00 H new ATOM 0 HA HIS A 162 -4.345 3.779 7.560 1.00 0.00 H new ATOM 0 HB2 HIS A 162 -6.405 3.164 6.220 1.00 0.00 H new ATOM 0 HB3 HIS A 162 -7.357 4.143 7.320 1.00 0.00 H new ATOM 0 HD2 HIS A 162 -5.390 6.802 7.425 1.00 0.00 H new ATOM 0 HE1 HIS A 162 -5.884 6.809 3.213 1.00 0.00 H new ATOM 0 HE2 HIS A 162 -5.190 8.194 5.231 1.00 0.00 H new ATOM 1318 N LYS A 163 -6.549 4.929 9.750 1.00 0.00 N ATOM 1319 CA LYS A 163 -6.755 5.938 10.784 1.00 0.00 C ATOM 1320 C LYS A 163 -5.926 5.623 12.027 1.00 0.00 C ATOM 1321 O LYS A 163 -5.573 6.520 12.793 1.00 0.00 O ATOM 1322 CB LYS A 163 -8.236 6.021 11.157 1.00 0.00 C ATOM 1323 CG LYS A 163 -9.095 6.697 10.101 1.00 0.00 C ATOM 1324 CD LYS A 163 -10.577 6.496 10.378 1.00 0.00 C ATOM 1325 CE LYS A 163 -10.980 7.080 11.724 1.00 0.00 C ATOM 1326 NZ LYS A 163 -12.000 8.155 11.581 1.00 0.00 N ATOM 0 H LYS A 163 -7.327 4.280 9.634 1.00 0.00 H new ATOM 0 HA LYS A 163 -6.431 6.900 10.386 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -8.615 5.014 11.331 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -8.335 6.565 12.096 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -8.870 7.763 10.075 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -8.849 6.295 9.118 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -11.162 6.965 9.587 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -10.810 5.431 10.358 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -11.375 6.288 12.360 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -10.098 7.481 12.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -11.857 8.870 12.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -11.905 8.601 10.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -12.951 7.745 11.674 1.00 0.00 H new ATOM 1340 N SER A 164 -5.624 4.343 12.223 1.00 0.00 N ATOM 1341 CA SER A 164 -4.841 3.910 13.375 1.00 0.00 C ATOM 1342 C SER A 164 -3.437 4.508 13.347 1.00 0.00 C ATOM 1343 O SER A 164 -2.795 4.651 14.387 1.00 0.00 O ATOM 1344 CB SER A 164 -4.755 2.383 13.411 1.00 0.00 C ATOM 1345 OG SER A 164 -4.043 1.938 14.553 1.00 0.00 O ATOM 0 H SER A 164 -5.910 3.588 11.599 1.00 0.00 H new ATOM 0 HA SER A 164 -5.345 4.265 14.274 1.00 0.00 H new ATOM 0 HB2 SER A 164 -5.759 1.959 13.417 1.00 0.00 H new ATOM 0 HB3 SER A 164 -4.262 2.022 12.508 1.00 0.00 H new ATOM 0 HG SER A 164 -4.004 0.959 14.553 1.00 0.00 H new ATOM 1351 N TYR A 165 -2.962 4.853 12.154 1.00 0.00 N ATOM 1352 CA TYR A 165 -1.631 5.431 12.002 1.00 0.00 C ATOM 1353 C TYR A 165 -1.622 6.900 12.411 1.00 0.00 C ATOM 1354 O TYR A 165 -2.393 7.706 11.891 1.00 0.00 O ATOM 1355 CB TYR A 165 -1.155 5.291 10.555 1.00 0.00 C ATOM 1356 CG TYR A 165 -0.942 3.858 10.121 1.00 0.00 C ATOM 1357 CD1 TYR A 165 -0.174 2.988 10.885 1.00 0.00 C ATOM 1358 CD2 TYR A 165 -1.510 3.376 8.949 1.00 0.00 C ATOM 1359 CE1 TYR A 165 0.023 1.678 10.491 1.00 0.00 C ATOM 1360 CE2 TYR A 165 -1.318 2.067 8.549 1.00 0.00 C ATOM 1361 CZ TYR A 165 -0.551 1.223 9.323 1.00 0.00 C ATOM 1362 OH TYR A 165 -0.357 -0.081 8.928 1.00 0.00 O ATOM 0 H TYR A 165 -3.477 4.743 11.281 1.00 0.00 H new ATOM 0 HA TYR A 165 -0.951 4.887 12.658 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -1.887 5.756 9.895 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -0.221 5.841 10.434 1.00 0.00 H new ATOM 0 HD1 TYR A 165 0.276 3.341 11.801 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -2.112 4.035 8.340 1.00 0.00 H new ATOM 0 HE1 TYR A 165 0.624 1.014 11.095 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -1.767 1.707 7.635 1.00 0.00 H new ATOM 0 HH TYR A 165 0.480 -0.149 8.422 1.00 0.00 H new ATOM 1372 N ARG A 166 -0.740 7.241 13.345 1.00 0.00 N ATOM 1373 CA ARG A 166 -0.622 8.613 13.825 1.00 0.00 C ATOM 1374 C ARG A 166 -0.126 9.535 12.710 1.00 0.00 C ATOM 1375 O ARG A 166 -0.320 9.247 11.529 1.00 0.00 O ATOM 1376 CB ARG A 166 0.325 8.667 15.029 1.00 0.00 C ATOM 1377 CG ARG A 166 0.087 7.559 16.042 1.00 0.00 C ATOM 1378 CD ARG A 166 0.159 8.081 17.468 1.00 0.00 C ATOM 1379 NE ARG A 166 -0.225 7.064 18.444 1.00 0.00 N ATOM 1380 CZ ARG A 166 -1.487 6.737 18.717 1.00 0.00 C ATOM 1381 NH1 ARG A 166 -2.487 7.343 18.090 1.00 0.00 N ATOM 1382 NH2 ARG A 166 -1.748 5.801 19.619 1.00 0.00 N ATOM 0 H ARG A 166 -0.095 6.584 13.785 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.607 8.959 14.137 1.00 0.00 H new ATOM 0 HB2 ARG A 166 1.354 8.608 14.674 1.00 0.00 H new ATOM 0 HB3 ARG A 166 0.214 9.631 15.525 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -0.890 7.109 15.867 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.829 6.773 15.904 1.00 0.00 H new ATOM 0 HD2 ARG A 166 1.173 8.421 17.679 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -0.495 8.947 17.570 1.00 0.00 H new ATOM 0 HE ARG A 166 0.517 6.576 18.946 1.00 0.00 H new ATOM 0 HH11 ARG A 166 -2.291 8.063 17.395 1.00 0.00 H new ATOM 0 HH12 ARG A 166 -3.451 7.088 18.303 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -0.983 5.332 20.103 1.00 0.00 H new ATOM 0 HH22 ARG A 166 -2.714 5.550 19.829 1.00 0.00 H new ATOM 1396 N SER A 167 0.513 10.643 13.086 1.00 0.00 N ATOM 1397 CA SER A 167 1.032 11.596 12.112 1.00 0.00 C ATOM 1398 C SER A 167 2.172 10.981 11.306 1.00 0.00 C ATOM 1399 O SER A 167 3.339 11.324 11.497 1.00 0.00 O ATOM 1400 CB SER A 167 1.513 12.866 12.816 1.00 0.00 C ATOM 1401 OG SER A 167 0.441 13.767 13.033 1.00 0.00 O ATOM 0 H SER A 167 0.682 10.900 14.058 1.00 0.00 H new ATOM 0 HA SER A 167 0.225 11.855 11.426 1.00 0.00 H new ATOM 0 HB2 SER A 167 1.971 12.605 13.770 1.00 0.00 H new ATOM 0 HB3 SER A 167 2.282 13.350 12.214 1.00 0.00 H new ATOM 0 HG SER A 167 0.775 14.570 13.486 1.00 0.00 H new ATOM 1407 N MET A 168 1.823 10.071 10.405 1.00 0.00 N ATOM 1408 CA MET A 168 2.811 9.403 9.567 1.00 0.00 C ATOM 1409 C MET A 168 3.059 10.189 8.284 1.00 0.00 C ATOM 1410 O MET A 168 2.152 10.825 7.747 1.00 0.00 O ATOM 1411 CB MET A 168 2.346 7.985 9.227 1.00 0.00 C ATOM 1412 CG MET A 168 3.403 7.151 8.520 1.00 0.00 C ATOM 1413 SD MET A 168 3.808 5.635 9.409 1.00 0.00 S ATOM 1414 CE MET A 168 2.320 4.675 9.138 1.00 0.00 C ATOM 0 H MET A 168 0.861 9.778 10.236 1.00 0.00 H new ATOM 0 HA MET A 168 3.746 9.349 10.125 1.00 0.00 H new ATOM 0 HB2 MET A 168 2.050 7.479 10.146 1.00 0.00 H new ATOM 0 HB3 MET A 168 1.459 8.044 8.596 1.00 0.00 H new ATOM 0 HG2 MET A 168 3.050 6.897 7.520 1.00 0.00 H new ATOM 0 HG3 MET A 168 4.307 7.747 8.397 1.00 0.00 H new ATOM 0 HE1 MET A 168 2.226 3.922 9.920 1.00 0.00 H new ATOM 0 HE2 MET A 168 1.452 5.334 9.162 1.00 0.00 H new ATOM 0 HE3 MET A 168 2.376 4.184 8.166 1.00 0.00 H new ATOM 1424 N THR A 169 4.295 10.141 7.796 1.00 0.00 N ATOM 1425 CA THR A 169 4.664 10.846 6.575 1.00 0.00 C ATOM 1426 C THR A 169 4.502 9.940 5.358 1.00 0.00 C ATOM 1427 O THR A 169 4.514 8.715 5.481 1.00 0.00 O ATOM 1428 CB THR A 169 6.107 11.345 6.666 1.00 0.00 C ATOM 1429 OG1 THR A 169 6.973 10.302 7.076 1.00 0.00 O ATOM 1430 CG2 THR A 169 6.283 12.495 7.634 1.00 0.00 C ATOM 0 H THR A 169 5.058 9.620 8.229 1.00 0.00 H new ATOM 0 HA THR A 169 3.999 11.702 6.461 1.00 0.00 H new ATOM 0 HB THR A 169 6.356 11.694 5.664 1.00 0.00 H new ATOM 0 HG1 THR A 169 7.014 10.277 8.055 1.00 0.00 H new ATOM 0 HG21 THR A 169 7.329 12.800 7.650 1.00 0.00 H new ATOM 0 HG22 THR A 169 5.665 13.335 7.317 1.00 0.00 H new ATOM 0 HG23 THR A 169 5.982 12.179 8.633 1.00 0.00 H new ATOM 1438 N PRO A 170 4.353 10.531 4.161 1.00 0.00 N ATOM 1439 CA PRO A 170 4.192 9.771 2.919 1.00 0.00 C ATOM 1440 C PRO A 170 5.306 8.747 2.729 1.00 0.00 C ATOM 1441 O PRO A 170 5.044 7.564 2.511 1.00 0.00 O ATOM 1442 CB PRO A 170 4.247 10.841 1.817 1.00 0.00 C ATOM 1443 CG PRO A 170 4.758 12.076 2.483 1.00 0.00 C ATOM 1444 CD PRO A 170 4.332 11.980 3.918 1.00 0.00 C ATOM 0 HA PRO A 170 3.266 9.196 2.912 1.00 0.00 H new ATOM 0 HB2 PRO A 170 4.905 10.533 1.004 1.00 0.00 H new ATOM 0 HB3 PRO A 170 3.261 11.009 1.383 1.00 0.00 H new ATOM 0 HG2 PRO A 170 5.843 12.142 2.402 1.00 0.00 H new ATOM 0 HG3 PRO A 170 4.348 12.970 2.014 1.00 0.00 H new ATOM 0 HD2 PRO A 170 5.015 12.512 4.580 1.00 0.00 H new ATOM 0 HD3 PRO A 170 3.340 12.403 4.076 1.00 0.00 H new ATOM 1452 N ALA A 171 6.550 9.210 2.812 1.00 0.00 N ATOM 1453 CA ALA A 171 7.708 8.336 2.650 1.00 0.00 C ATOM 1454 C ALA A 171 7.604 7.107 3.547 1.00 0.00 C ATOM 1455 O ALA A 171 7.971 6.002 3.147 1.00 0.00 O ATOM 1456 CB ALA A 171 8.990 9.101 2.946 1.00 0.00 C ATOM 0 H ALA A 171 6.782 10.187 2.991 1.00 0.00 H new ATOM 0 HA ALA A 171 7.730 7.994 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 171 9.846 8.438 2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.079 9.942 2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 171 8.964 9.472 3.971 1.00 0.00 H new ATOM 1462 N GLN A 172 7.097 7.305 4.761 1.00 0.00 N ATOM 1463 CA GLN A 172 6.941 6.210 5.710 1.00 0.00 C ATOM 1464 C GLN A 172 6.062 5.111 5.121 1.00 0.00 C ATOM 1465 O GLN A 172 6.381 3.927 5.220 1.00 0.00 O ATOM 1466 CB GLN A 172 6.338 6.723 7.021 1.00 0.00 C ATOM 1467 CG GLN A 172 7.322 6.733 8.179 1.00 0.00 C ATOM 1468 CD GLN A 172 7.891 8.112 8.449 1.00 0.00 C ATOM 1469 OE1 GLN A 172 7.180 8.900 9.248 1.00 0.00 O flip ATOM 1470 NE2 GLN A 172 8.957 8.466 7.944 1.00 0.00 N flip ATOM 0 H GLN A 172 6.788 8.213 5.109 1.00 0.00 H new ATOM 0 HA GLN A 172 7.926 5.792 5.917 1.00 0.00 H new ATOM 0 HB2 GLN A 172 5.961 7.734 6.867 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.483 6.101 7.286 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.824 6.367 9.077 1.00 0.00 H new ATOM 0 HG3 GLN A 172 8.138 6.043 7.964 1.00 0.00 H new ATOM 0 HE21 GLN A 172 9.470 7.828 7.336 1.00 0.00 H new ATOM 0 HE22 GLN A 172 9.327 9.397 8.134 1.00 0.00 H new ATOM 1479 N ALA A 173 4.958 5.516 4.502 1.00 0.00 N ATOM 1480 CA ALA A 173 4.036 4.569 3.889 1.00 0.00 C ATOM 1481 C ALA A 173 4.696 3.862 2.710 1.00 0.00 C ATOM 1482 O ALA A 173 4.611 2.640 2.577 1.00 0.00 O ATOM 1483 CB ALA A 173 2.770 5.283 3.440 1.00 0.00 C ATOM 0 H ALA A 173 4.681 6.493 4.412 1.00 0.00 H new ATOM 0 HA ALA A 173 3.768 3.817 4.631 1.00 0.00 H new ATOM 0 HB1 ALA A 173 2.089 4.564 2.984 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.287 5.744 4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.025 6.053 2.712 1.00 0.00 H new ATOM 1489 N ASP A 174 5.362 4.639 1.861 1.00 0.00 N ATOM 1490 CA ASP A 174 6.048 4.092 0.697 1.00 0.00 C ATOM 1491 C ASP A 174 7.070 3.040 1.121 1.00 0.00 C ATOM 1492 O ASP A 174 7.184 1.977 0.507 1.00 0.00 O ATOM 1493 CB ASP A 174 6.745 5.210 -0.080 1.00 0.00 C ATOM 1494 CG ASP A 174 5.769 6.242 -0.611 1.00 0.00 C ATOM 1495 OD1 ASP A 174 4.832 5.853 -1.340 1.00 0.00 O ATOM 1496 OD2 ASP A 174 5.941 7.439 -0.298 1.00 0.00 O ATOM 0 H ASP A 174 5.441 5.651 1.958 1.00 0.00 H new ATOM 0 HA ASP A 174 5.306 3.619 0.053 1.00 0.00 H new ATOM 0 HB2 ASP A 174 7.471 5.701 0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 174 7.301 4.778 -0.912 1.00 0.00 H new ATOM 1501 N LEU A 175 7.799 3.348 2.188 1.00 0.00 N ATOM 1502 CA LEU A 175 8.808 2.441 2.722 1.00 0.00 C ATOM 1503 C LEU A 175 8.161 1.246 3.417 1.00 0.00 C ATOM 1504 O LEU A 175 8.724 0.154 3.447 1.00 0.00 O ATOM 1505 CB LEU A 175 9.718 3.184 3.702 1.00 0.00 C ATOM 1506 CG LEU A 175 11.075 2.525 3.954 1.00 0.00 C ATOM 1507 CD1 LEU A 175 11.917 2.534 2.688 1.00 0.00 C ATOM 1508 CD2 LEU A 175 11.804 3.230 5.087 1.00 0.00 C ATOM 0 H LEU A 175 7.709 4.224 2.703 1.00 0.00 H new ATOM 0 HA LEU A 175 9.404 2.070 1.888 1.00 0.00 H new ATOM 0 HB2 LEU A 175 9.886 4.193 3.325 1.00 0.00 H new ATOM 0 HB3 LEU A 175 9.197 3.283 4.654 1.00 0.00 H new ATOM 0 HG LEU A 175 10.907 1.488 4.245 1.00 0.00 H new ATOM 0 HD11 LEU A 175 12.879 2.061 2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.398 1.985 1.902 1.00 0.00 H new ATOM 0 HD13 LEU A 175 12.079 3.563 2.366 1.00 0.00 H new ATOM 0 HD21 LEU A 175 12.768 2.749 5.254 1.00 0.00 H new ATOM 0 HD22 LEU A 175 11.961 4.276 4.823 1.00 0.00 H new ATOM 0 HD23 LEU A 175 11.206 3.171 5.997 1.00 0.00 H new ATOM 1520 N GLU A 176 6.982 1.470 3.990 1.00 0.00 N ATOM 1521 CA GLU A 176 6.262 0.420 4.704 1.00 0.00 C ATOM 1522 C GLU A 176 5.910 -0.751 3.790 1.00 0.00 C ATOM 1523 O GLU A 176 6.217 -1.903 4.101 1.00 0.00 O ATOM 1524 CB GLU A 176 4.989 0.990 5.332 1.00 0.00 C ATOM 1525 CG GLU A 176 5.215 1.623 6.695 1.00 0.00 C ATOM 1526 CD GLU A 176 5.392 0.593 7.794 1.00 0.00 C ATOM 1527 OE1 GLU A 176 5.734 -0.564 7.473 1.00 0.00 O ATOM 1528 OE2 GLU A 176 5.189 0.945 8.975 1.00 0.00 O ATOM 0 H GLU A 176 6.504 2.371 3.974 1.00 0.00 H new ATOM 0 HA GLU A 176 6.921 0.044 5.487 1.00 0.00 H new ATOM 0 HB2 GLU A 176 4.565 1.736 4.660 1.00 0.00 H new ATOM 0 HB3 GLU A 176 4.253 0.192 5.429 1.00 0.00 H new ATOM 0 HG2 GLU A 176 6.098 2.260 6.654 1.00 0.00 H new ATOM 0 HG3 GLU A 176 4.369 2.266 6.938 1.00 0.00 H new ATOM 1535 N PHE A 177 5.266 -0.459 2.665 1.00 0.00 N ATOM 1536 CA PHE A 177 4.880 -1.504 1.722 1.00 0.00 C ATOM 1537 C PHE A 177 6.103 -2.062 1.000 1.00 0.00 C ATOM 1538 O PHE A 177 6.243 -3.275 0.851 1.00 0.00 O ATOM 1539 CB PHE A 177 3.863 -0.967 0.710 1.00 0.00 C ATOM 1540 CG PHE A 177 3.570 -1.914 -0.419 1.00 0.00 C ATOM 1541 CD1 PHE A 177 4.391 -1.953 -1.535 1.00 0.00 C ATOM 1542 CD2 PHE A 177 2.476 -2.762 -0.366 1.00 0.00 C ATOM 1543 CE1 PHE A 177 4.126 -2.821 -2.576 1.00 0.00 C ATOM 1544 CE2 PHE A 177 2.206 -3.632 -1.405 1.00 0.00 C ATOM 1545 CZ PHE A 177 3.032 -3.661 -2.511 1.00 0.00 C ATOM 0 H PHE A 177 5.002 0.485 2.385 1.00 0.00 H new ATOM 0 HA PHE A 177 4.416 -2.313 2.285 1.00 0.00 H new ATOM 0 HB2 PHE A 177 2.933 -0.739 1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 177 4.236 -0.029 0.297 1.00 0.00 H new ATOM 0 HD1 PHE A 177 5.247 -1.297 -1.591 1.00 0.00 H new ATOM 0 HD2 PHE A 177 1.827 -2.743 0.497 1.00 0.00 H new ATOM 0 HE1 PHE A 177 4.774 -2.843 -3.440 1.00 0.00 H new ATOM 0 HE2 PHE A 177 1.350 -4.288 -1.352 1.00 0.00 H new ATOM 0 HZ PHE A 177 2.823 -4.340 -3.324 1.00 0.00 H new ATOM 1555 N LEU A 178 6.988 -1.175 0.556 1.00 0.00 N ATOM 1556 CA LEU A 178 8.195 -1.598 -0.145 1.00 0.00 C ATOM 1557 C LEU A 178 9.057 -2.479 0.755 1.00 0.00 C ATOM 1558 O LEU A 178 9.584 -3.502 0.320 1.00 0.00 O ATOM 1559 CB LEU A 178 8.992 -0.381 -0.615 1.00 0.00 C ATOM 1560 CG LEU A 178 8.351 0.407 -1.760 1.00 0.00 C ATOM 1561 CD1 LEU A 178 9.278 1.519 -2.226 1.00 0.00 C ATOM 1562 CD2 LEU A 178 8.003 -0.520 -2.916 1.00 0.00 C ATOM 0 H LEU A 178 6.893 -0.166 0.668 1.00 0.00 H new ATOM 0 HA LEU A 178 7.899 -2.180 -1.018 1.00 0.00 H new ATOM 0 HB2 LEU A 178 9.136 0.290 0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 178 9.981 -0.713 -0.931 1.00 0.00 H new ATOM 0 HG LEU A 178 7.429 0.860 -1.394 1.00 0.00 H new ATOM 0 HD11 LEU A 178 8.806 2.069 -3.040 1.00 0.00 H new ATOM 0 HD12 LEU A 178 9.477 2.198 -1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 178 10.216 1.088 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 178 7.548 0.057 -3.721 1.00 0.00 H new ATOM 0 HD22 LEU A 178 8.910 -1.001 -3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 178 7.301 -1.281 -2.574 1.00 0.00 H new ATOM 1574 N GLU A 179 9.186 -2.076 2.015 1.00 0.00 N ATOM 1575 CA GLU A 179 9.972 -2.825 2.987 1.00 0.00 C ATOM 1576 C GLU A 179 9.308 -4.159 3.306 1.00 0.00 C ATOM 1577 O GLU A 179 9.982 -5.153 3.577 1.00 0.00 O ATOM 1578 CB GLU A 179 10.151 -2.010 4.268 1.00 0.00 C ATOM 1579 CG GLU A 179 10.994 -2.711 5.318 1.00 0.00 C ATOM 1580 CD GLU A 179 12.450 -2.292 5.272 1.00 0.00 C ATOM 1581 OE1 GLU A 179 13.110 -2.551 4.244 1.00 0.00 O ATOM 1582 OE2 GLU A 179 12.930 -1.704 6.264 1.00 0.00 O ATOM 0 H GLU A 179 8.754 -1.231 2.387 1.00 0.00 H new ATOM 0 HA GLU A 179 10.952 -3.021 2.553 1.00 0.00 H new ATOM 0 HB2 GLU A 179 10.614 -1.055 4.020 1.00 0.00 H new ATOM 0 HB3 GLU A 179 9.170 -1.789 4.689 1.00 0.00 H new ATOM 0 HG2 GLU A 179 10.589 -2.496 6.307 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.925 -3.789 5.173 1.00 0.00 H new ATOM 1589 N ASN A 180 7.982 -4.172 3.261 1.00 0.00 N ATOM 1590 CA ASN A 180 7.224 -5.386 3.534 1.00 0.00 C ATOM 1591 C ASN A 180 7.364 -6.368 2.374 1.00 0.00 C ATOM 1592 O ASN A 180 7.670 -7.544 2.573 1.00 0.00 O ATOM 1593 CB ASN A 180 5.752 -5.041 3.763 1.00 0.00 C ATOM 1594 CG ASN A 180 5.353 -5.153 5.222 1.00 0.00 C ATOM 1595 OD1 ASN A 180 4.661 -6.091 5.618 1.00 0.00 O ATOM 1596 ND2 ASN A 180 5.787 -4.193 6.030 1.00 0.00 N ATOM 0 H ASN A 180 7.410 -3.357 3.038 1.00 0.00 H new ATOM 0 HA ASN A 180 7.620 -5.855 4.435 1.00 0.00 H new ATOM 0 HB2 ASN A 180 5.561 -4.026 3.414 1.00 0.00 H new ATOM 0 HB3 ASN A 180 5.128 -5.707 3.166 1.00 0.00 H new ATOM 0 HD21 ASN A 180 5.549 -4.215 7.022 1.00 0.00 H new ATOM 0 HD22 ASN A 180 6.358 -3.434 5.659 1.00 0.00 H new ATOM 1603 N ALA A 181 7.143 -5.869 1.162 1.00 0.00 N ATOM 1604 CA ALA A 181 7.247 -6.691 -0.038 1.00 0.00 C ATOM 1605 C ALA A 181 8.662 -7.234 -0.204 1.00 0.00 C ATOM 1606 O ALA A 181 8.856 -8.375 -0.624 1.00 0.00 O ATOM 1607 CB ALA A 181 6.840 -5.888 -1.264 1.00 0.00 C ATOM 0 H ALA A 181 6.890 -4.897 0.985 1.00 0.00 H new ATOM 0 HA ALA A 181 6.569 -7.538 0.068 1.00 0.00 H new ATOM 0 HB1 ALA A 181 6.922 -6.514 -2.153 1.00 0.00 H new ATOM 0 HB2 ALA A 181 5.810 -5.550 -1.152 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.496 -5.024 -1.367 1.00 0.00 H new ATOM 1613 N LYS A 182 9.648 -6.408 0.133 1.00 0.00 N ATOM 1614 CA LYS A 182 11.048 -6.803 0.026 1.00 0.00 C ATOM 1615 C LYS A 182 11.405 -7.826 1.100 1.00 0.00 C ATOM 1616 O LYS A 182 12.242 -8.702 0.884 1.00 0.00 O ATOM 1617 CB LYS A 182 11.957 -5.578 0.145 1.00 0.00 C ATOM 1618 CG LYS A 182 12.495 -5.090 -1.190 1.00 0.00 C ATOM 1619 CD LYS A 182 12.841 -3.610 -1.144 1.00 0.00 C ATOM 1620 CE LYS A 182 13.940 -3.325 -0.133 1.00 0.00 C ATOM 1621 NZ LYS A 182 13.394 -2.788 1.144 1.00 0.00 N ATOM 0 H LYS A 182 9.503 -5.461 0.483 1.00 0.00 H new ATOM 0 HA LYS A 182 11.199 -7.261 -0.951 1.00 0.00 H new ATOM 0 HB2 LYS A 182 11.403 -4.769 0.622 1.00 0.00 H new ATOM 0 HB3 LYS A 182 12.795 -5.819 0.799 1.00 0.00 H new ATOM 0 HG2 LYS A 182 13.382 -5.664 -1.458 1.00 0.00 H new ATOM 0 HG3 LYS A 182 11.754 -5.267 -1.969 1.00 0.00 H new ATOM 0 HD2 LYS A 182 13.160 -3.279 -2.132 1.00 0.00 H new ATOM 0 HD3 LYS A 182 11.951 -3.035 -0.887 1.00 0.00 H new ATOM 0 HE2 LYS A 182 14.496 -4.241 0.067 1.00 0.00 H new ATOM 0 HE3 LYS A 182 14.645 -2.610 -0.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 14.174 -2.434 1.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 12.734 -2.011 0.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 12.892 -3.544 1.652 1.00 0.00 H new ATOM 1635 N LYS A 183 10.761 -7.709 2.257 1.00 0.00 N ATOM 1636 CA LYS A 183 11.008 -8.625 3.365 1.00 0.00 C ATOM 1637 C LYS A 183 10.359 -9.983 3.109 1.00 0.00 C ATOM 1638 O LYS A 183 10.756 -10.990 3.695 1.00 0.00 O ATOM 1639 CB LYS A 183 10.475 -8.032 4.671 1.00 0.00 C ATOM 1640 CG LYS A 183 11.449 -7.085 5.353 1.00 0.00 C ATOM 1641 CD LYS A 183 10.935 -6.643 6.713 1.00 0.00 C ATOM 1642 CE LYS A 183 9.725 -5.732 6.583 1.00 0.00 C ATOM 1643 NZ LYS A 183 8.703 -6.012 7.629 1.00 0.00 N ATOM 0 H LYS A 183 10.065 -6.989 2.452 1.00 0.00 H new ATOM 0 HA LYS A 183 12.085 -8.769 3.449 1.00 0.00 H new ATOM 0 HB2 LYS A 183 9.547 -7.499 4.466 1.00 0.00 H new ATOM 0 HB3 LYS A 183 10.231 -8.844 5.356 1.00 0.00 H new ATOM 0 HG2 LYS A 183 12.415 -7.577 5.470 1.00 0.00 H new ATOM 0 HG3 LYS A 183 11.611 -6.211 4.722 1.00 0.00 H new ATOM 0 HD2 LYS A 183 10.670 -7.519 7.305 1.00 0.00 H new ATOM 0 HD3 LYS A 183 11.727 -6.122 7.251 1.00 0.00 H new ATOM 0 HE2 LYS A 183 10.044 -4.692 6.657 1.00 0.00 H new ATOM 0 HE3 LYS A 183 9.279 -5.860 5.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 7.894 -5.370 7.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 8.379 -6.997 7.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 9.120 -5.866 8.570 1.00 0.00 H new ATOM 1657 N LEU A 184 9.362 -10.004 2.229 1.00 0.00 N ATOM 1658 CA LEU A 184 8.662 -11.240 1.897 1.00 0.00 C ATOM 1659 C LEU A 184 9.235 -11.882 0.634 1.00 0.00 C ATOM 1660 O LEU A 184 8.942 -13.038 0.330 1.00 0.00 O ATOM 1661 CB LEU A 184 7.166 -10.969 1.711 1.00 0.00 C ATOM 1662 CG LEU A 184 6.430 -10.417 2.941 1.00 0.00 C ATOM 1663 CD1 LEU A 184 5.025 -10.992 3.016 1.00 0.00 C ATOM 1664 CD2 LEU A 184 7.193 -10.721 4.224 1.00 0.00 C ATOM 0 H LEU A 184 9.021 -9.180 1.734 1.00 0.00 H new ATOM 0 HA LEU A 184 8.802 -11.935 2.725 1.00 0.00 H new ATOM 0 HB2 LEU A 184 7.043 -10.263 0.890 1.00 0.00 H new ATOM 0 HB3 LEU A 184 6.682 -11.898 1.408 1.00 0.00 H new ATOM 0 HG LEU A 184 6.366 -9.334 2.836 1.00 0.00 H new ATOM 0 HD11 LEU A 184 4.515 -10.592 3.892 1.00 0.00 H new ATOM 0 HD12 LEU A 184 4.472 -10.719 2.118 1.00 0.00 H new ATOM 0 HD13 LEU A 184 5.080 -12.078 3.092 1.00 0.00 H new ATOM 0 HD21 LEU A 184 6.647 -10.318 5.077 1.00 0.00 H new ATOM 0 HD22 LEU A 184 7.298 -11.800 4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 184 8.181 -10.263 4.177 1.00 0.00 H new ATOM 1676 N SER A 185 10.053 -11.127 -0.099 1.00 0.00 N ATOM 1677 CA SER A 185 10.661 -11.628 -1.327 1.00 0.00 C ATOM 1678 C SER A 185 9.603 -11.871 -2.398 1.00 0.00 C ATOM 1679 O SER A 185 9.612 -12.900 -3.074 1.00 0.00 O ATOM 1680 CB SER A 185 11.436 -12.919 -1.053 1.00 0.00 C ATOM 1681 OG SER A 185 12.315 -12.763 0.048 1.00 0.00 O ATOM 0 H SER A 185 10.308 -10.168 0.137 1.00 0.00 H new ATOM 0 HA SER A 185 11.355 -10.871 -1.693 1.00 0.00 H new ATOM 0 HB2 SER A 185 10.737 -13.731 -0.852 1.00 0.00 H new ATOM 0 HB3 SER A 185 12.005 -13.200 -1.939 1.00 0.00 H new ATOM 0 HG SER A 185 12.797 -13.602 0.203 1.00 0.00 H new ATOM 1687 N MET A 186 8.690 -10.917 -2.547 1.00 0.00 N ATOM 1688 CA MET A 186 7.624 -11.025 -3.535 1.00 0.00 C ATOM 1689 C MET A 186 8.183 -10.922 -4.951 1.00 0.00 C ATOM 1690 O MET A 186 7.661 -11.535 -5.881 1.00 0.00 O ATOM 1691 CB MET A 186 6.576 -9.934 -3.308 1.00 0.00 C ATOM 1692 CG MET A 186 6.142 -9.800 -1.857 1.00 0.00 C ATOM 1693 SD MET A 186 4.618 -8.854 -1.673 1.00 0.00 S ATOM 1694 CE MET A 186 3.421 -10.009 -2.338 1.00 0.00 C ATOM 0 H MET A 186 8.667 -10.059 -1.995 1.00 0.00 H new ATOM 0 HA MET A 186 7.153 -12.001 -3.419 1.00 0.00 H new ATOM 0 HB2 MET A 186 6.978 -8.979 -3.648 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.701 -10.149 -3.922 1.00 0.00 H new ATOM 0 HG2 MET A 186 6.002 -10.793 -1.430 1.00 0.00 H new ATOM 0 HG3 MET A 186 6.936 -9.317 -1.287 1.00 0.00 H new ATOM 0 HE1 MET A 186 2.427 -9.756 -1.969 1.00 0.00 H new ATOM 0 HE2 MET A 186 3.429 -9.955 -3.427 1.00 0.00 H new ATOM 0 HE3 MET A 186 3.678 -11.021 -2.023 1.00 0.00 H new ATOM 1704 N TYR A 187 9.248 -10.141 -5.105 1.00 0.00 N ATOM 1705 CA TYR A 187 9.879 -9.957 -6.407 1.00 0.00 C ATOM 1706 C TYR A 187 11.398 -10.023 -6.290 1.00 0.00 C ATOM 1707 O TYR A 187 12.024 -10.730 -7.109 1.00 0.00 O ATOM 1708 CB TYR A 187 9.461 -8.616 -7.014 1.00 0.00 C ATOM 1709 CG TYR A 187 9.869 -7.421 -6.183 1.00 0.00 C ATOM 1710 CD1 TYR A 187 9.307 -7.195 -4.933 1.00 0.00 C ATOM 1711 CD2 TYR A 187 10.817 -6.518 -6.649 1.00 0.00 C ATOM 1712 CE1 TYR A 187 9.677 -6.103 -4.171 1.00 0.00 C ATOM 1713 CE2 TYR A 187 11.192 -5.424 -5.893 1.00 0.00 C ATOM 1714 CZ TYR A 187 10.619 -5.221 -4.655 1.00 0.00 C ATOM 1715 OH TYR A 187 10.990 -4.133 -3.899 1.00 0.00 O ATOM 1716 OXT TYR A 187 11.950 -9.367 -5.382 1.00 0.00 O ATOM 0 H TYR A 187 9.692 -9.626 -4.345 1.00 0.00 H new ATOM 0 HA TYR A 187 9.548 -10.764 -7.061 1.00 0.00 H new ATOM 0 HB2 TYR A 187 9.900 -8.524 -8.007 1.00 0.00 H new ATOM 0 HB3 TYR A 187 8.379 -8.606 -7.142 1.00 0.00 H new ATOM 0 HD1 TYR A 187 8.569 -7.884 -4.550 1.00 0.00 H new ATOM 0 HD2 TYR A 187 11.268 -6.674 -7.618 1.00 0.00 H new ATOM 0 HE1 TYR A 187 9.230 -5.942 -3.201 1.00 0.00 H new ATOM 0 HE2 TYR A 187 11.930 -4.731 -6.270 1.00 0.00 H new ATOM 0 HH TYR A 187 11.920 -3.898 -4.098 1.00 0.00 H new TER 1726 TYR A 187