USER MOD reduce.3.24.130724 H: found=0, std=0, add=977, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 973 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 96 SER OG : rot -117:sc= 0.0662 USER MOD Set 1.2: A 120 THR OG1 : rot -144:sc= 0.249 USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.117 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 5:sc= 0.927 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HE2:sc= 0.569 K(o=0.57,f=-4!) USER MOD Single : A 23 THR OG1 : rot 49:sc= 0.986 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.143 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.00462 USER MOD Single : A 43 SER OG : rot 6:sc= -0.0188 USER MOD Single : A 49 GLN : amide:sc=-0.00229 X(o=-0.0023,f=0) USER MOD Single : A 55 ASN :FLIP amide:sc= -0.718 F(o=-2.5!,f=-0.72) USER MOD Single : A 61 TYR OH : rot 30:sc= 0 USER MOD Single : A 62 GLN :FLIP amide:sc= -3.47! C(o=-4.4!,f=-3.5!) USER MOD Single : A 64 THR OG1 : rot -1:sc= -2.82! USER MOD Single : A 65 HIS :FLIP no HD1:sc= -0.838 F(o=-2.6!,f=-0.84) USER MOD Single : A 68 ASN : amide:sc= -1.08 K(o=-1.1,f=-1.9!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.0159 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 THR OG1 : rot 43:sc= -0.672! USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 168:sc= -0.997! (180deg=-1.26!) USER MOD Single : A 98 TYR OH : rot 180:sc= 0.252 USER MOD Single : A 103 THR OG1 : rot 90:sc= -1.12 USER MOD Single : A 105 GLN : amide:sc= -0.209 K(o=-0.21,f=-1.5) USER MOD Single : A 106 THR OG1 : rot -80:sc= -1.63 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.55 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.686 -41.517 -53.880 1.00 0.00 N ATOM 2 CA GLY A 1 14.597 -41.009 -52.868 1.00 0.00 C ATOM 3 C GLY A 1 13.920 -39.940 -52.008 1.00 0.00 C ATOM 4 O GLY A 1 12.838 -39.462 -52.344 1.00 0.00 O ATOM 0 H1 GLY A 1 13.462 -42.512 -53.677 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.810 -40.956 -53.872 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.133 -41.447 -54.816 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.937 -41.829 -52.235 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.481 -40.589 -53.347 1.00 0.00 H new ATOM 8 N SER A 2 14.585 -39.598 -50.915 1.00 0.00 N ATOM 9 CA SER A 2 14.061 -38.594 -50.004 1.00 0.00 C ATOM 10 C SER A 2 14.999 -38.434 -48.806 1.00 0.00 C ATOM 11 O SER A 2 15.468 -39.423 -48.243 1.00 0.00 O ATOM 12 CB SER A 2 12.653 -38.962 -49.530 1.00 0.00 C ATOM 13 OG SER A 2 11.812 -37.818 -49.417 1.00 0.00 O ATOM 0 H SER A 2 15.482 -39.998 -50.639 1.00 0.00 H new ATOM 0 HA SER A 2 13.999 -37.646 -50.538 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.209 -39.671 -50.229 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.715 -39.463 -48.564 1.00 0.00 H new ATOM 0 HG SER A 2 10.922 -38.095 -49.114 1.00 0.00 H new ATOM 19 N SER A 3 15.246 -37.182 -48.451 1.00 0.00 N ATOM 20 CA SER A 3 16.120 -36.879 -47.331 1.00 0.00 C ATOM 21 C SER A 3 16.135 -35.371 -47.071 1.00 0.00 C ATOM 22 O SER A 3 15.669 -34.590 -47.900 1.00 0.00 O ATOM 23 CB SER A 3 17.540 -37.388 -47.587 1.00 0.00 C ATOM 24 OG SER A 3 18.269 -36.523 -48.452 1.00 0.00 O ATOM 0 H SER A 3 14.856 -36.365 -48.920 1.00 0.00 H new ATOM 0 HA SER A 3 15.734 -37.389 -46.448 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.068 -37.481 -46.638 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.494 -38.385 -48.026 1.00 0.00 H new ATOM 0 HG SER A 3 19.171 -36.882 -48.589 1.00 0.00 H new ATOM 30 N GLY A 4 16.676 -35.007 -45.918 1.00 0.00 N ATOM 31 CA GLY A 4 16.758 -33.607 -45.539 1.00 0.00 C ATOM 32 C GLY A 4 16.755 -33.450 -44.017 1.00 0.00 C ATOM 33 O GLY A 4 16.015 -34.142 -43.319 1.00 0.00 O ATOM 0 H GLY A 4 17.062 -35.657 -45.234 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.666 -33.167 -45.952 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.917 -33.061 -45.966 1.00 0.00 H new ATOM 37 N SER A 5 17.591 -32.535 -43.547 1.00 0.00 N ATOM 38 CA SER A 5 17.694 -32.278 -42.120 1.00 0.00 C ATOM 39 C SER A 5 18.657 -31.117 -41.866 1.00 0.00 C ATOM 40 O SER A 5 19.841 -31.206 -42.190 1.00 0.00 O ATOM 41 CB SER A 5 18.157 -33.527 -41.368 1.00 0.00 C ATOM 42 OG SER A 5 19.568 -33.707 -41.450 1.00 0.00 O ATOM 0 H SER A 5 18.203 -31.963 -44.129 1.00 0.00 H new ATOM 0 HA SER A 5 16.705 -32.009 -41.748 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.861 -33.451 -40.322 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.655 -34.404 -41.778 1.00 0.00 H new ATOM 0 HG SER A 5 19.969 -32.940 -41.909 1.00 0.00 H new ATOM 48 N SER A 6 18.114 -30.055 -41.289 1.00 0.00 N ATOM 49 CA SER A 6 18.911 -28.878 -40.987 1.00 0.00 C ATOM 50 C SER A 6 18.052 -27.835 -40.269 1.00 0.00 C ATOM 51 O SER A 6 17.218 -27.179 -40.889 1.00 0.00 O ATOM 52 CB SER A 6 19.516 -28.282 -42.259 1.00 0.00 C ATOM 53 OG SER A 6 20.891 -27.947 -42.091 1.00 0.00 O ATOM 0 H SER A 6 17.132 -29.985 -41.023 1.00 0.00 H new ATOM 0 HA SER A 6 19.730 -29.178 -40.333 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.414 -28.995 -43.077 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.958 -27.390 -42.542 1.00 0.00 H new ATOM 0 HG SER A 6 21.241 -27.571 -42.926 1.00 0.00 H new ATOM 59 N GLY A 7 18.287 -27.715 -38.970 1.00 0.00 N ATOM 60 CA GLY A 7 17.546 -26.763 -38.161 1.00 0.00 C ATOM 61 C GLY A 7 18.150 -26.647 -36.760 1.00 0.00 C ATOM 62 O GLY A 7 17.925 -27.507 -35.910 1.00 0.00 O ATOM 0 H GLY A 7 18.980 -28.261 -38.458 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.552 -25.787 -38.645 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.505 -27.076 -38.087 1.00 0.00 H new ATOM 66 N ARG A 8 18.905 -25.577 -36.562 1.00 0.00 N ATOM 67 CA ARG A 8 19.543 -25.337 -35.279 1.00 0.00 C ATOM 68 C ARG A 8 19.650 -23.834 -35.012 1.00 0.00 C ATOM 69 O ARG A 8 20.606 -23.190 -35.441 1.00 0.00 O ATOM 70 CB ARG A 8 20.942 -25.956 -35.235 1.00 0.00 C ATOM 71 CG ARG A 8 21.068 -26.942 -34.072 1.00 0.00 C ATOM 72 CD ARG A 8 21.714 -28.251 -34.531 1.00 0.00 C ATOM 73 NE ARG A 8 23.071 -27.988 -35.060 1.00 0.00 N ATOM 74 CZ ARG A 8 23.361 -27.880 -36.364 1.00 0.00 C ATOM 75 NH1 ARG A 8 22.391 -28.013 -37.279 1.00 0.00 N ATOM 76 NH2 ARG A 8 24.621 -27.640 -36.752 1.00 0.00 N ATOM 0 H ARG A 8 19.089 -24.866 -37.269 1.00 0.00 H new ATOM 0 HA ARG A 8 18.927 -25.803 -34.510 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.147 -26.469 -36.175 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.689 -25.169 -35.132 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.665 -26.497 -33.276 1.00 0.00 H new ATOM 0 HG3 ARG A 8 20.082 -27.146 -33.655 1.00 0.00 H new ATOM 0 HD2 ARG A 8 21.769 -28.951 -33.697 1.00 0.00 H new ATOM 0 HD3 ARG A 8 21.100 -28.719 -35.300 1.00 0.00 H new ATOM 0 HE ARG A 8 23.833 -27.882 -34.390 1.00 0.00 H new ATOM 0 HH11 ARG A 8 21.432 -28.196 -36.983 1.00 0.00 H new ATOM 0 HH12 ARG A 8 22.611 -27.931 -38.272 1.00 0.00 H new ATOM 0 HH21 ARG A 8 25.359 -27.540 -36.055 1.00 0.00 H new ATOM 0 HH22 ARG A 8 24.842 -27.558 -37.744 1.00 0.00 H new ATOM 90 N ILE A 9 18.656 -23.320 -34.303 1.00 0.00 N ATOM 91 CA ILE A 9 18.626 -21.905 -33.974 1.00 0.00 C ATOM 92 C ILE A 9 18.453 -21.741 -32.462 1.00 0.00 C ATOM 93 O ILE A 9 18.097 -22.692 -31.768 1.00 0.00 O ATOM 94 CB ILE A 9 17.555 -21.185 -34.796 1.00 0.00 C ATOM 95 CG1 ILE A 9 16.166 -21.763 -34.513 1.00 0.00 C ATOM 96 CG2 ILE A 9 17.896 -21.217 -36.287 1.00 0.00 C ATOM 97 CD1 ILE A 9 15.070 -20.847 -35.060 1.00 0.00 C ATOM 0 H ILE A 9 17.866 -23.858 -33.947 1.00 0.00 H new ATOM 0 HA ILE A 9 19.571 -21.432 -34.241 1.00 0.00 H new ATOM 0 HB ILE A 9 17.536 -20.138 -34.492 1.00 0.00 H new ATOM 0 HG12 ILE A 9 16.080 -22.750 -34.966 1.00 0.00 H new ATOM 0 HG13 ILE A 9 16.034 -21.893 -33.439 1.00 0.00 H new ATOM 0 HG21 ILE A 9 17.119 -20.699 -36.849 1.00 0.00 H new ATOM 0 HG22 ILE A 9 18.854 -20.723 -36.452 1.00 0.00 H new ATOM 0 HG23 ILE A 9 17.958 -22.252 -36.624 1.00 0.00 H new ATOM 0 HD11 ILE A 9 14.093 -21.280 -34.846 1.00 0.00 H new ATOM 0 HD12 ILE A 9 15.144 -19.868 -34.587 1.00 0.00 H new ATOM 0 HD13 ILE A 9 15.191 -20.739 -36.138 1.00 0.00 H new ATOM 109 N GLY A 10 18.714 -20.529 -31.997 1.00 0.00 N ATOM 110 CA GLY A 10 18.592 -20.228 -30.580 1.00 0.00 C ATOM 111 C GLY A 10 19.963 -19.957 -29.957 1.00 0.00 C ATOM 112 O GLY A 10 20.651 -20.885 -29.533 1.00 0.00 O ATOM 0 H GLY A 10 19.010 -19.743 -32.576 1.00 0.00 H new ATOM 0 HA2 GLY A 10 17.948 -19.359 -30.443 1.00 0.00 H new ATOM 0 HA3 GLY A 10 18.114 -21.063 -30.067 1.00 0.00 H new ATOM 116 N ASP A 11 20.320 -18.682 -29.922 1.00 0.00 N ATOM 117 CA ASP A 11 21.596 -18.277 -29.358 1.00 0.00 C ATOM 118 C ASP A 11 21.758 -16.763 -29.507 1.00 0.00 C ATOM 119 O ASP A 11 21.051 -16.134 -30.294 1.00 0.00 O ATOM 120 CB ASP A 11 22.759 -18.951 -30.087 1.00 0.00 C ATOM 121 CG ASP A 11 24.145 -18.647 -29.515 1.00 0.00 C ATOM 122 OD1 ASP A 11 24.524 -19.341 -28.546 1.00 0.00 O ATOM 123 OD2 ASP A 11 24.795 -17.728 -30.058 1.00 0.00 O ATOM 0 H ASP A 11 19.747 -17.915 -30.275 1.00 0.00 H new ATOM 0 HA ASP A 11 21.609 -18.571 -28.309 1.00 0.00 H new ATOM 0 HB2 ASP A 11 22.603 -20.030 -30.068 1.00 0.00 H new ATOM 0 HB3 ASP A 11 22.739 -18.644 -31.133 1.00 0.00 H new ATOM 128 N GLY A 12 22.692 -16.221 -28.740 1.00 0.00 N ATOM 129 CA GLY A 12 22.956 -14.793 -28.777 1.00 0.00 C ATOM 130 C GLY A 12 22.091 -14.049 -27.757 1.00 0.00 C ATOM 131 O GLY A 12 21.222 -13.262 -28.130 1.00 0.00 O ATOM 0 H GLY A 12 23.276 -16.746 -28.089 1.00 0.00 H new ATOM 0 HA2 GLY A 12 24.010 -14.609 -28.569 1.00 0.00 H new ATOM 0 HA3 GLY A 12 22.757 -14.408 -29.777 1.00 0.00 H new ATOM 135 N SER A 13 22.360 -14.324 -26.489 1.00 0.00 N ATOM 136 CA SER A 13 21.618 -13.691 -25.412 1.00 0.00 C ATOM 137 C SER A 13 22.146 -14.172 -24.059 1.00 0.00 C ATOM 138 O SER A 13 21.689 -15.187 -23.536 1.00 0.00 O ATOM 139 CB SER A 13 20.120 -13.980 -25.531 1.00 0.00 C ATOM 140 OG SER A 13 19.376 -13.384 -24.473 1.00 0.00 O ATOM 0 H SER A 13 23.082 -14.977 -26.183 1.00 0.00 H new ATOM 0 HA SER A 13 21.759 -12.613 -25.487 1.00 0.00 H new ATOM 0 HB2 SER A 13 19.754 -13.606 -26.487 1.00 0.00 H new ATOM 0 HB3 SER A 13 19.957 -15.058 -25.526 1.00 0.00 H new ATOM 0 HG SER A 13 18.425 -13.590 -24.586 1.00 0.00 H new ATOM 146 N PRO A 14 23.126 -13.401 -23.517 1.00 0.00 N ATOM 147 CA PRO A 14 23.721 -13.738 -22.235 1.00 0.00 C ATOM 148 C PRO A 14 22.771 -13.401 -21.084 1.00 0.00 C ATOM 149 O PRO A 14 22.497 -14.245 -20.233 1.00 0.00 O ATOM 150 CB PRO A 14 25.020 -12.950 -22.184 1.00 0.00 C ATOM 151 CG PRO A 14 24.880 -11.850 -23.224 1.00 0.00 C ATOM 152 CD PRO A 14 23.692 -12.192 -24.108 1.00 0.00 C ATOM 0 HA PRO A 14 23.914 -14.805 -22.129 1.00 0.00 H new ATOM 0 HB2 PRO A 14 25.184 -12.531 -21.191 1.00 0.00 H new ATOM 0 HB3 PRO A 14 25.874 -13.590 -22.405 1.00 0.00 H new ATOM 0 HG2 PRO A 14 24.731 -10.885 -22.741 1.00 0.00 H new ATOM 0 HG3 PRO A 14 25.789 -11.771 -23.820 1.00 0.00 H new ATOM 0 HD2 PRO A 14 22.964 -11.381 -24.124 1.00 0.00 H new ATOM 0 HD3 PRO A 14 24.002 -12.363 -25.139 1.00 0.00 H new ATOM 160 N SER A 15 22.294 -12.164 -21.096 1.00 0.00 N ATOM 161 CA SER A 15 21.381 -11.705 -20.064 1.00 0.00 C ATOM 162 C SER A 15 22.075 -11.731 -18.701 1.00 0.00 C ATOM 163 O SER A 15 22.416 -12.799 -18.194 1.00 0.00 O ATOM 164 CB SER A 15 20.113 -12.560 -20.030 1.00 0.00 C ATOM 165 OG SER A 15 18.955 -11.787 -19.728 1.00 0.00 O ATOM 0 H SER A 15 22.523 -11.467 -21.804 1.00 0.00 H new ATOM 0 HA SER A 15 21.090 -10.681 -20.297 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.980 -13.050 -20.995 1.00 0.00 H new ATOM 0 HB3 SER A 15 20.227 -13.348 -19.285 1.00 0.00 H new ATOM 0 HG SER A 15 18.167 -12.369 -19.717 1.00 0.00 H new ATOM 171 N HIS A 16 22.265 -10.543 -18.146 1.00 0.00 N ATOM 172 CA HIS A 16 22.913 -10.417 -16.852 1.00 0.00 C ATOM 173 C HIS A 16 22.011 -9.627 -15.901 1.00 0.00 C ATOM 174 O HIS A 16 21.204 -8.810 -16.341 1.00 0.00 O ATOM 175 CB HIS A 16 24.305 -9.799 -16.999 1.00 0.00 C ATOM 176 CG HIS A 16 24.291 -8.316 -17.287 1.00 0.00 C ATOM 177 ND1 HIS A 16 23.989 -7.369 -16.325 1.00 0.00 N ATOM 178 CD2 HIS A 16 24.546 -7.630 -18.437 1.00 0.00 C ATOM 179 CE1 HIS A 16 24.061 -6.169 -16.882 1.00 0.00 C ATOM 180 NE2 HIS A 16 24.406 -6.333 -18.192 1.00 0.00 N ATOM 0 H HIS A 16 21.981 -9.659 -18.569 1.00 0.00 H new ATOM 0 HA HIS A 16 23.062 -11.406 -16.418 1.00 0.00 H new ATOM 0 HB2 HIS A 16 24.868 -9.976 -16.083 1.00 0.00 H new ATOM 0 HB3 HIS A 16 24.835 -10.310 -17.803 1.00 0.00 H new ATOM 0 HD1 HIS A 16 23.751 -7.562 -15.352 1.00 0.00 H new ATOM 0 HD2 HIS A 16 24.816 -8.068 -19.387 1.00 0.00 H new ATOM 0 HE1 HIS A 16 23.879 -5.227 -16.386 1.00 0.00 H new ATOM 188 N PRO A 17 22.183 -9.906 -14.581 1.00 0.00 N ATOM 189 CA PRO A 17 21.394 -9.231 -13.565 1.00 0.00 C ATOM 190 C PRO A 17 21.878 -7.794 -13.360 1.00 0.00 C ATOM 191 O PRO A 17 23.038 -7.482 -13.622 1.00 0.00 O ATOM 192 CB PRO A 17 21.540 -10.090 -12.319 1.00 0.00 C ATOM 193 CG PRO A 17 22.770 -10.953 -12.549 1.00 0.00 C ATOM 194 CD PRO A 17 23.130 -10.867 -14.023 1.00 0.00 C ATOM 0 HA PRO A 17 20.345 -9.132 -13.844 1.00 0.00 H new ATOM 0 HB2 PRO A 17 21.658 -9.471 -11.430 1.00 0.00 H new ATOM 0 HB3 PRO A 17 20.654 -10.706 -12.163 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.600 -10.607 -11.933 1.00 0.00 H new ATOM 0 HG3 PRO A 17 22.570 -11.986 -12.264 1.00 0.00 H new ATOM 0 HD2 PRO A 17 24.159 -10.534 -14.160 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.041 -11.838 -14.510 1.00 0.00 H new ATOM 202 N PRO A 18 20.939 -6.934 -12.881 1.00 0.00 N ATOM 203 CA PRO A 18 21.257 -5.538 -12.638 1.00 0.00 C ATOM 204 C PRO A 18 22.099 -5.380 -11.370 1.00 0.00 C ATOM 205 O PRO A 18 21.643 -5.702 -10.274 1.00 0.00 O ATOM 206 CB PRO A 18 19.911 -4.837 -12.548 1.00 0.00 C ATOM 207 CG PRO A 18 18.890 -5.930 -12.280 1.00 0.00 C ATOM 208 CD PRO A 18 19.555 -7.268 -12.559 1.00 0.00 C ATOM 0 HA PRO A 18 21.866 -5.102 -13.430 1.00 0.00 H new ATOM 0 HB2 PRO A 18 19.909 -4.096 -11.749 1.00 0.00 H new ATOM 0 HB3 PRO A 18 19.683 -4.308 -13.473 1.00 0.00 H new ATOM 0 HG2 PRO A 18 18.544 -5.884 -11.248 1.00 0.00 H new ATOM 0 HG3 PRO A 18 18.015 -5.799 -12.916 1.00 0.00 H new ATOM 0 HD2 PRO A 18 19.498 -7.927 -11.693 1.00 0.00 H new ATOM 0 HD3 PRO A 18 19.070 -7.786 -13.386 1.00 0.00 H new ATOM 216 N ILE A 19 23.313 -4.884 -11.561 1.00 0.00 N ATOM 217 CA ILE A 19 24.222 -4.679 -10.447 1.00 0.00 C ATOM 218 C ILE A 19 23.661 -3.592 -9.529 1.00 0.00 C ATOM 219 O ILE A 19 22.765 -2.845 -9.921 1.00 0.00 O ATOM 220 CB ILE A 19 25.635 -4.386 -10.955 1.00 0.00 C ATOM 221 CG1 ILE A 19 26.348 -5.675 -11.368 1.00 0.00 C ATOM 222 CG2 ILE A 19 26.436 -3.593 -9.920 1.00 0.00 C ATOM 223 CD1 ILE A 19 25.839 -6.174 -12.722 1.00 0.00 C ATOM 0 H ILE A 19 23.688 -4.618 -12.472 1.00 0.00 H new ATOM 0 HA ILE A 19 24.305 -5.588 -9.851 1.00 0.00 H new ATOM 0 HB ILE A 19 25.555 -3.763 -11.846 1.00 0.00 H new ATOM 0 HG12 ILE A 19 27.422 -5.499 -11.422 1.00 0.00 H new ATOM 0 HG13 ILE A 19 26.188 -6.442 -10.610 1.00 0.00 H new ATOM 0 HG21 ILE A 19 27.437 -3.398 -10.306 1.00 0.00 H new ATOM 0 HG22 ILE A 19 25.934 -2.647 -9.719 1.00 0.00 H new ATOM 0 HG23 ILE A 19 26.509 -4.169 -8.997 1.00 0.00 H new ATOM 0 HD11 ILE A 19 26.362 -7.091 -12.992 1.00 0.00 H new ATOM 0 HD12 ILE A 19 24.769 -6.372 -12.658 1.00 0.00 H new ATOM 0 HD13 ILE A 19 26.023 -5.415 -13.482 1.00 0.00 H new ATOM 235 N LEU A 20 24.210 -3.537 -8.325 1.00 0.00 N ATOM 236 CA LEU A 20 23.775 -2.553 -7.348 1.00 0.00 C ATOM 237 C LEU A 20 24.198 -1.158 -7.813 1.00 0.00 C ATOM 238 O LEU A 20 23.956 -0.782 -8.959 1.00 0.00 O ATOM 239 CB LEU A 20 24.289 -2.918 -5.954 1.00 0.00 C ATOM 240 CG LEU A 20 23.592 -2.228 -4.780 1.00 0.00 C ATOM 241 CD1 LEU A 20 22.313 -2.970 -4.388 1.00 0.00 C ATOM 242 CD2 LEU A 20 24.546 -2.065 -3.595 1.00 0.00 C ATOM 0 H LEU A 20 24.953 -4.158 -8.003 1.00 0.00 H new ATOM 0 HA LEU A 20 22.688 -2.548 -7.270 1.00 0.00 H new ATOM 0 HB2 LEU A 20 24.194 -3.996 -5.824 1.00 0.00 H new ATOM 0 HB3 LEU A 20 25.353 -2.684 -5.908 1.00 0.00 H new ATOM 0 HG LEU A 20 23.299 -1.227 -5.098 1.00 0.00 H new ATOM 0 HD11 LEU A 20 21.838 -2.458 -3.551 1.00 0.00 H new ATOM 0 HD12 LEU A 20 21.629 -2.990 -5.237 1.00 0.00 H new ATOM 0 HD13 LEU A 20 22.559 -3.991 -4.096 1.00 0.00 H new ATOM 0 HD21 LEU A 20 24.026 -1.572 -2.774 1.00 0.00 H new ATOM 0 HD22 LEU A 20 24.892 -3.046 -3.268 1.00 0.00 H new ATOM 0 HD23 LEU A 20 25.402 -1.461 -3.897 1.00 0.00 H new ATOM 254 N GLU A 21 24.821 -0.428 -6.900 1.00 0.00 N ATOM 255 CA GLU A 21 25.280 0.917 -7.202 1.00 0.00 C ATOM 256 C GLU A 21 24.089 1.826 -7.514 1.00 0.00 C ATOM 257 O GLU A 21 22.944 1.376 -7.519 1.00 0.00 O ATOM 258 CB GLU A 21 26.281 0.909 -8.359 1.00 0.00 C ATOM 259 CG GLU A 21 27.408 1.915 -8.116 1.00 0.00 C ATOM 260 CD GLU A 21 28.772 1.294 -8.424 1.00 0.00 C ATOM 261 OE1 GLU A 21 29.050 0.221 -7.847 1.00 0.00 O ATOM 262 OE2 GLU A 21 29.506 1.907 -9.229 1.00 0.00 O ATOM 0 H GLU A 21 25.019 -0.743 -5.950 1.00 0.00 H new ATOM 0 HA GLU A 21 25.793 1.310 -6.324 1.00 0.00 H new ATOM 0 HB2 GLU A 21 26.700 -0.091 -8.475 1.00 0.00 H new ATOM 0 HB3 GLU A 21 25.768 1.150 -9.290 1.00 0.00 H new ATOM 0 HG2 GLU A 21 27.256 2.795 -8.741 1.00 0.00 H new ATOM 0 HG3 GLU A 21 27.383 2.251 -7.079 1.00 0.00 H new ATOM 269 N ARG A 22 24.400 3.089 -7.766 1.00 0.00 N ATOM 270 CA ARG A 22 23.370 4.065 -8.078 1.00 0.00 C ATOM 271 C ARG A 22 22.444 4.263 -6.875 1.00 0.00 C ATOM 272 O ARG A 22 21.319 4.737 -7.025 1.00 0.00 O ATOM 273 CB ARG A 22 22.539 3.624 -9.284 1.00 0.00 C ATOM 274 CG ARG A 22 21.843 4.819 -9.938 1.00 0.00 C ATOM 275 CD ARG A 22 20.922 4.364 -11.072 1.00 0.00 C ATOM 276 NE ARG A 22 20.180 5.523 -11.618 1.00 0.00 N ATOM 277 CZ ARG A 22 19.083 5.421 -12.380 1.00 0.00 C ATOM 278 NH1 ARG A 22 18.593 4.213 -12.691 1.00 0.00 N ATOM 279 NH2 ARG A 22 18.475 6.527 -12.830 1.00 0.00 N ATOM 0 H ARG A 22 25.351 3.459 -7.760 1.00 0.00 H new ATOM 0 HA ARG A 22 23.867 5.005 -8.318 1.00 0.00 H new ATOM 0 HB2 ARG A 22 23.182 3.130 -10.012 1.00 0.00 H new ATOM 0 HB3 ARG A 22 21.794 2.893 -8.969 1.00 0.00 H new ATOM 0 HG2 ARG A 22 21.264 5.361 -9.190 1.00 0.00 H new ATOM 0 HG3 ARG A 22 22.590 5.511 -10.327 1.00 0.00 H new ATOM 0 HD2 ARG A 22 21.508 3.893 -11.861 1.00 0.00 H new ATOM 0 HD3 ARG A 22 20.222 3.614 -10.704 1.00 0.00 H new ATOM 0 HE ARG A 22 20.526 6.458 -11.400 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.055 3.371 -12.347 1.00 0.00 H new ATOM 0 HH12 ARG A 22 17.758 4.135 -13.271 1.00 0.00 H new ATOM 0 HH21 ARG A 22 18.847 7.446 -12.592 1.00 0.00 H new ATOM 0 HH22 ARG A 22 17.640 6.450 -13.410 1.00 0.00 H new ATOM 293 N THR A 23 22.952 3.889 -5.710 1.00 0.00 N ATOM 294 CA THR A 23 22.185 4.019 -4.483 1.00 0.00 C ATOM 295 C THR A 23 22.542 5.322 -3.766 1.00 0.00 C ATOM 296 O THR A 23 23.534 5.385 -3.042 1.00 0.00 O ATOM 297 CB THR A 23 22.435 2.771 -3.635 1.00 0.00 C ATOM 298 OG1 THR A 23 23.847 2.758 -3.444 1.00 0.00 O ATOM 299 CG2 THR A 23 22.150 1.476 -4.399 1.00 0.00 C ATOM 0 H THR A 23 23.886 3.496 -5.590 1.00 0.00 H new ATOM 0 HA THR A 23 21.117 4.081 -4.689 1.00 0.00 H new ATOM 0 HB THR A 23 21.812 2.809 -2.741 1.00 0.00 H new ATOM 0 HG1 THR A 23 24.144 3.641 -3.140 1.00 0.00 H new ATOM 0 HG21 THR A 23 22.344 0.621 -3.751 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.107 1.462 -4.716 1.00 0.00 H new ATOM 0 HG23 THR A 23 22.796 1.421 -5.275 1.00 0.00 H new ATOM 307 N LEU A 24 21.714 6.331 -3.993 1.00 0.00 N ATOM 308 CA LEU A 24 21.930 7.630 -3.379 1.00 0.00 C ATOM 309 C LEU A 24 21.002 7.779 -2.171 1.00 0.00 C ATOM 310 O LEU A 24 20.386 6.808 -1.734 1.00 0.00 O ATOM 311 CB LEU A 24 21.775 8.746 -4.414 1.00 0.00 C ATOM 312 CG LEU A 24 22.834 9.849 -4.374 1.00 0.00 C ATOM 313 CD1 LEU A 24 24.120 9.400 -5.071 1.00 0.00 C ATOM 314 CD2 LEU A 24 22.290 11.153 -4.961 1.00 0.00 C ATOM 0 H LEU A 24 20.892 6.275 -4.594 1.00 0.00 H new ATOM 0 HA LEU A 24 22.952 7.710 -3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 24 21.784 8.297 -5.407 1.00 0.00 H new ATOM 0 HB3 LEU A 24 20.795 9.205 -4.280 1.00 0.00 H new ATOM 0 HG LEU A 24 23.084 10.045 -3.331 1.00 0.00 H new ATOM 0 HD11 LEU A 24 24.856 10.203 -5.028 1.00 0.00 H new ATOM 0 HD12 LEU A 24 24.516 8.517 -4.570 1.00 0.00 H new ATOM 0 HD13 LEU A 24 23.905 9.160 -6.112 1.00 0.00 H new ATOM 0 HD21 LEU A 24 23.063 11.921 -4.920 1.00 0.00 H new ATOM 0 HD22 LEU A 24 21.994 10.990 -5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.425 11.479 -4.384 1.00 0.00 H new ATOM 326 N ASP A 25 20.931 9.002 -1.667 1.00 0.00 N ATOM 327 CA ASP A 25 20.088 9.290 -0.518 1.00 0.00 C ATOM 328 C ASP A 25 18.846 10.054 -0.982 1.00 0.00 C ATOM 329 O ASP A 25 18.882 11.275 -1.125 1.00 0.00 O ATOM 330 CB ASP A 25 20.825 10.160 0.501 1.00 0.00 C ATOM 331 CG ASP A 25 22.064 10.879 -0.037 1.00 0.00 C ATOM 332 OD1 ASP A 25 23.050 10.169 -0.329 1.00 0.00 O ATOM 333 OD2 ASP A 25 21.996 12.122 -0.145 1.00 0.00 O ATOM 0 H ASP A 25 21.443 9.805 -2.033 1.00 0.00 H new ATOM 0 HA ASP A 25 19.816 8.343 -0.053 1.00 0.00 H new ATOM 0 HB2 ASP A 25 20.131 10.906 0.889 1.00 0.00 H new ATOM 0 HB3 ASP A 25 21.123 9.534 1.342 1.00 0.00 H new ATOM 338 N ASP A 26 17.777 9.303 -1.203 1.00 0.00 N ATOM 339 CA ASP A 26 16.526 9.895 -1.647 1.00 0.00 C ATOM 340 C ASP A 26 15.489 8.789 -1.854 1.00 0.00 C ATOM 341 O ASP A 26 15.844 7.645 -2.132 1.00 0.00 O ATOM 342 CB ASP A 26 16.706 10.630 -2.976 1.00 0.00 C ATOM 343 CG ASP A 26 18.044 10.383 -3.676 1.00 0.00 C ATOM 344 OD1 ASP A 26 18.443 9.200 -3.736 1.00 0.00 O ATOM 345 OD2 ASP A 26 18.637 11.382 -4.135 1.00 0.00 O ATOM 0 H ASP A 26 17.751 8.290 -1.083 1.00 0.00 H new ATOM 0 HA ASP A 26 16.198 10.603 -0.886 1.00 0.00 H new ATOM 0 HB2 ASP A 26 15.901 10.335 -3.649 1.00 0.00 H new ATOM 0 HB3 ASP A 26 16.598 11.700 -2.800 1.00 0.00 H new ATOM 350 N VAL A 27 14.228 9.170 -1.711 1.00 0.00 N ATOM 351 CA VAL A 27 13.137 8.225 -1.879 1.00 0.00 C ATOM 352 C VAL A 27 13.105 7.743 -3.330 1.00 0.00 C ATOM 353 O VAL A 27 13.662 8.390 -4.216 1.00 0.00 O ATOM 354 CB VAL A 27 11.820 8.861 -1.431 1.00 0.00 C ATOM 355 CG1 VAL A 27 11.712 8.882 0.095 1.00 0.00 C ATOM 356 CG2 VAL A 27 11.666 10.268 -2.011 1.00 0.00 C ATOM 0 H VAL A 27 13.938 10.120 -1.481 1.00 0.00 H new ATOM 0 HA VAL A 27 13.290 7.349 -1.249 1.00 0.00 H new ATOM 0 HB VAL A 27 11.004 8.249 -1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 27 10.766 9.339 0.387 1.00 0.00 H new ATOM 0 HG12 VAL A 27 11.755 7.862 0.477 1.00 0.00 H new ATOM 0 HG13 VAL A 27 12.538 9.460 0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.722 10.698 -1.677 1.00 0.00 H new ATOM 0 HG22 VAL A 27 12.490 10.894 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.676 10.216 -3.100 1.00 0.00 H new ATOM 366 N PRO A 28 12.430 6.580 -3.535 1.00 0.00 N ATOM 367 CA PRO A 28 12.318 6.003 -4.864 1.00 0.00 C ATOM 368 C PRO A 28 11.310 6.779 -5.715 1.00 0.00 C ATOM 369 O PRO A 28 10.774 7.795 -5.276 1.00 0.00 O ATOM 370 CB PRO A 28 11.913 4.557 -4.633 1.00 0.00 C ATOM 371 CG PRO A 28 11.362 4.500 -3.217 1.00 0.00 C ATOM 372 CD PRO A 28 11.759 5.786 -2.510 1.00 0.00 C ATOM 0 HA PRO A 28 13.251 6.055 -5.426 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.162 4.241 -5.357 1.00 0.00 H new ATOM 0 HB3 PRO A 28 12.767 3.889 -4.747 1.00 0.00 H new ATOM 0 HG2 PRO A 28 10.277 4.393 -3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.760 3.635 -2.687 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.887 6.306 -2.114 1.00 0.00 H new ATOM 0 HD3 PRO A 28 12.421 5.587 -1.667 1.00 0.00 H new ATOM 380 N GLY A 29 11.082 6.269 -6.916 1.00 0.00 N ATOM 381 CA GLY A 29 10.147 6.900 -7.832 1.00 0.00 C ATOM 382 C GLY A 29 8.819 6.142 -7.869 1.00 0.00 C ATOM 383 O GLY A 29 8.557 5.299 -7.013 1.00 0.00 O ATOM 0 H GLY A 29 11.529 5.426 -7.276 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.973 7.931 -7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.579 6.933 -8.832 1.00 0.00 H new ATOM 387 N PRO A 30 7.994 6.478 -8.897 1.00 0.00 N ATOM 388 CA PRO A 30 6.699 5.839 -9.057 1.00 0.00 C ATOM 389 C PRO A 30 6.853 4.417 -9.600 1.00 0.00 C ATOM 390 O PRO A 30 7.598 4.189 -10.551 1.00 0.00 O ATOM 391 CB PRO A 30 5.922 6.751 -9.992 1.00 0.00 C ATOM 392 CG PRO A 30 6.961 7.617 -10.687 1.00 0.00 C ATOM 393 CD PRO A 30 8.271 7.472 -9.929 1.00 0.00 C ATOM 0 HA PRO A 30 6.170 5.718 -8.111 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.349 6.172 -10.716 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.210 7.363 -9.438 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.084 7.307 -11.725 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.642 8.659 -10.701 1.00 0.00 H new ATOM 0 HD2 PRO A 30 9.076 7.145 -10.588 1.00 0.00 H new ATOM 0 HD3 PRO A 30 8.583 8.421 -9.492 1.00 0.00 H new ATOM 401 N PRO A 31 6.117 3.473 -8.955 1.00 0.00 N ATOM 402 CA PRO A 31 6.164 2.079 -9.364 1.00 0.00 C ATOM 403 C PRO A 31 5.377 1.860 -10.657 1.00 0.00 C ATOM 404 O PRO A 31 4.148 1.914 -10.656 1.00 0.00 O ATOM 405 CB PRO A 31 5.598 1.304 -8.185 1.00 0.00 C ATOM 406 CG PRO A 31 4.828 2.316 -7.352 1.00 0.00 C ATOM 407 CD PRO A 31 5.223 3.706 -7.824 1.00 0.00 C ATOM 0 HA PRO A 31 7.174 1.743 -9.597 1.00 0.00 H new ATOM 0 HB2 PRO A 31 4.945 0.499 -8.524 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.395 0.843 -7.601 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.754 2.165 -7.465 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.058 2.193 -6.294 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.350 4.286 -8.122 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.722 4.266 -7.033 1.00 0.00 H new ATOM 415 N MET A 32 6.117 1.616 -11.729 1.00 0.00 N ATOM 416 CA MET A 32 5.503 1.388 -13.026 1.00 0.00 C ATOM 417 C MET A 32 5.258 -0.103 -13.262 1.00 0.00 C ATOM 418 O MET A 32 5.821 -0.946 -12.566 1.00 0.00 O ATOM 419 CB MET A 32 6.414 1.937 -14.125 1.00 0.00 C ATOM 420 CG MET A 32 7.817 1.334 -14.026 1.00 0.00 C ATOM 421 SD MET A 32 8.665 1.500 -15.588 1.00 0.00 S ATOM 422 CE MET A 32 10.336 1.142 -15.072 1.00 0.00 C ATOM 0 H MET A 32 7.136 1.571 -11.726 1.00 0.00 H new ATOM 0 HA MET A 32 4.542 1.902 -13.048 1.00 0.00 H new ATOM 0 HB2 MET A 32 5.986 1.713 -15.102 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.474 3.022 -14.044 1.00 0.00 H new ATOM 0 HG2 MET A 32 8.383 1.836 -13.241 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.751 0.282 -13.749 1.00 0.00 H new ATOM 0 HE1 MET A 32 11.003 1.202 -15.932 1.00 0.00 H new ATOM 0 HE2 MET A 32 10.648 1.866 -14.320 1.00 0.00 H new ATOM 0 HE3 MET A 32 10.379 0.138 -14.649 1.00 0.00 H new ATOM 432 N GLY A 33 4.416 -0.383 -14.246 1.00 0.00 N ATOM 433 CA GLY A 33 4.090 -1.759 -14.583 1.00 0.00 C ATOM 434 C GLY A 33 2.923 -2.269 -13.735 1.00 0.00 C ATOM 435 O GLY A 33 3.012 -3.334 -13.127 1.00 0.00 O ATOM 0 H GLY A 33 3.950 0.319 -14.821 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.833 -1.827 -15.640 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.963 -2.392 -14.425 1.00 0.00 H new ATOM 439 N ILE A 34 1.856 -1.484 -13.721 1.00 0.00 N ATOM 440 CA ILE A 34 0.673 -1.842 -12.957 1.00 0.00 C ATOM 441 C ILE A 34 -0.343 -2.513 -13.884 1.00 0.00 C ATOM 442 O ILE A 34 -1.006 -1.842 -14.674 1.00 0.00 O ATOM 443 CB ILE A 34 0.120 -0.621 -12.221 1.00 0.00 C ATOM 444 CG1 ILE A 34 1.254 0.254 -11.682 1.00 0.00 C ATOM 445 CG2 ILE A 34 -0.854 -1.040 -11.118 1.00 0.00 C ATOM 446 CD1 ILE A 34 2.207 -0.561 -10.807 1.00 0.00 C ATOM 0 H ILE A 34 1.786 -0.601 -14.227 1.00 0.00 H new ATOM 0 HA ILE A 34 0.925 -2.565 -12.181 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.442 -0.018 -12.934 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.805 0.694 -12.513 1.00 0.00 H new ATOM 0 HG13 ILE A 34 0.838 1.078 -11.103 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.232 -0.153 -10.610 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.687 -1.590 -11.557 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.338 -1.677 -10.399 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.003 0.085 -10.437 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.658 -0.980 -9.964 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.640 -1.370 -11.396 1.00 0.00 H new ATOM 458 N LEU A 35 -0.433 -3.829 -13.757 1.00 0.00 N ATOM 459 CA LEU A 35 -1.357 -4.598 -14.573 1.00 0.00 C ATOM 460 C LEU A 35 -2.304 -5.382 -13.663 1.00 0.00 C ATOM 461 O LEU A 35 -1.932 -5.763 -12.554 1.00 0.00 O ATOM 462 CB LEU A 35 -0.592 -5.475 -15.566 1.00 0.00 C ATOM 463 CG LEU A 35 0.272 -4.734 -16.588 1.00 0.00 C ATOM 464 CD1 LEU A 35 1.163 -5.708 -17.361 1.00 0.00 C ATOM 465 CD2 LEU A 35 -0.591 -3.883 -17.522 1.00 0.00 C ATOM 0 H LEU A 35 0.119 -4.382 -13.101 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.974 -3.934 -15.179 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.048 -6.154 -15.003 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.312 -6.090 -16.106 1.00 0.00 H new ATOM 0 HG LEU A 35 0.930 -4.053 -16.049 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.767 -5.156 -18.081 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.818 -6.233 -16.665 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.540 -6.431 -17.888 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.048 -3.367 -18.238 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.291 -4.525 -18.057 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.146 -3.150 -16.937 1.00 0.00 H new ATOM 477 N PHE A 36 -3.511 -5.600 -14.165 1.00 0.00 N ATOM 478 CA PHE A 36 -4.514 -6.332 -13.410 1.00 0.00 C ATOM 479 C PHE A 36 -4.842 -7.666 -14.084 1.00 0.00 C ATOM 480 O PHE A 36 -5.707 -7.730 -14.955 1.00 0.00 O ATOM 481 CB PHE A 36 -5.775 -5.465 -13.384 1.00 0.00 C ATOM 482 CG PHE A 36 -5.682 -4.260 -12.445 1.00 0.00 C ATOM 483 CD1 PHE A 36 -6.027 -4.390 -11.136 1.00 0.00 C ATOM 484 CD2 PHE A 36 -5.254 -3.059 -12.920 1.00 0.00 C ATOM 485 CE1 PHE A 36 -5.941 -3.272 -10.265 1.00 0.00 C ATOM 486 CE2 PHE A 36 -5.168 -1.941 -12.049 1.00 0.00 C ATOM 487 CZ PHE A 36 -5.514 -2.071 -10.740 1.00 0.00 C ATOM 0 H PHE A 36 -3.817 -5.283 -15.085 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.144 -6.543 -12.407 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.981 -5.111 -14.394 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -6.622 -6.082 -13.084 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -6.366 -5.343 -10.759 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -4.980 -2.956 -13.960 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -6.215 -3.375 -9.225 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.828 -0.988 -12.426 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.450 -1.220 -10.078 1.00 0.00 H new ATOM 497 N PRO A 37 -4.113 -8.726 -13.643 1.00 0.00 N ATOM 498 CA PRO A 37 -4.317 -10.055 -14.193 1.00 0.00 C ATOM 499 C PRO A 37 -5.609 -10.677 -13.660 1.00 0.00 C ATOM 500 O PRO A 37 -6.410 -11.208 -14.428 1.00 0.00 O ATOM 501 CB PRO A 37 -3.075 -10.838 -13.801 1.00 0.00 C ATOM 502 CG PRO A 37 -2.438 -10.065 -12.657 1.00 0.00 C ATOM 503 CD PRO A 37 -3.079 -8.688 -12.612 1.00 0.00 C ATOM 0 HA PRO A 37 -4.441 -10.047 -15.276 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.333 -11.851 -13.492 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.388 -10.927 -14.642 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.589 -10.588 -11.712 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.362 -9.980 -12.806 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.506 -8.482 -11.630 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.348 -7.904 -12.813 1.00 0.00 H new ATOM 511 N GLU A 38 -5.772 -10.591 -12.348 1.00 0.00 N ATOM 512 CA GLU A 38 -6.953 -11.139 -11.703 1.00 0.00 C ATOM 513 C GLU A 38 -7.724 -10.032 -10.980 1.00 0.00 C ATOM 514 O GLU A 38 -7.205 -9.411 -10.055 1.00 0.00 O ATOM 515 CB GLU A 38 -6.578 -12.265 -10.738 1.00 0.00 C ATOM 516 CG GLU A 38 -7.804 -12.756 -9.965 1.00 0.00 C ATOM 517 CD GLU A 38 -7.422 -13.856 -8.972 1.00 0.00 C ATOM 518 OE1 GLU A 38 -6.303 -13.762 -8.424 1.00 0.00 O ATOM 519 OE2 GLU A 38 -8.258 -14.766 -8.784 1.00 0.00 O ATOM 0 H GLU A 38 -5.106 -10.150 -11.714 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.599 -11.564 -12.471 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.138 -13.093 -11.293 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.820 -11.912 -10.039 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.260 -11.922 -9.432 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.551 -13.135 -10.663 1.00 0.00 H new ATOM 526 N VAL A 39 -8.952 -9.820 -11.430 1.00 0.00 N ATOM 527 CA VAL A 39 -9.801 -8.800 -10.838 1.00 0.00 C ATOM 528 C VAL A 39 -11.230 -9.333 -10.727 1.00 0.00 C ATOM 529 O VAL A 39 -11.866 -9.632 -11.737 1.00 0.00 O ATOM 530 CB VAL A 39 -9.706 -7.506 -11.649 1.00 0.00 C ATOM 531 CG1 VAL A 39 -10.790 -6.512 -11.224 1.00 0.00 C ATOM 532 CG2 VAL A 39 -8.314 -6.884 -11.529 1.00 0.00 C ATOM 0 H VAL A 39 -9.380 -10.337 -12.198 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.465 -8.561 -9.829 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.872 -7.755 -12.697 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -10.700 -5.601 -11.816 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.773 -6.954 -11.386 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.670 -6.272 -10.168 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.274 -5.966 -12.115 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.106 -6.657 -10.483 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.568 -7.586 -11.903 1.00 0.00 H new ATOM 542 N ARG A 40 -11.695 -9.435 -9.490 1.00 0.00 N ATOM 543 CA ARG A 40 -13.038 -9.927 -9.234 1.00 0.00 C ATOM 544 C ARG A 40 -13.939 -8.786 -8.756 1.00 0.00 C ATOM 545 O ARG A 40 -13.595 -7.615 -8.906 1.00 0.00 O ATOM 546 CB ARG A 40 -13.027 -11.035 -8.178 1.00 0.00 C ATOM 547 CG ARG A 40 -11.662 -11.725 -8.123 1.00 0.00 C ATOM 548 CD ARG A 40 -11.686 -12.910 -7.155 1.00 0.00 C ATOM 549 NE ARG A 40 -11.985 -14.159 -7.891 1.00 0.00 N ATOM 550 CZ ARG A 40 -12.229 -15.338 -7.303 1.00 0.00 C ATOM 551 NH1 ARG A 40 -12.212 -15.436 -5.966 1.00 0.00 N ATOM 552 NH2 ARG A 40 -12.490 -16.418 -8.051 1.00 0.00 N ATOM 0 H ARG A 40 -11.166 -9.185 -8.655 1.00 0.00 H new ATOM 0 HA ARG A 40 -13.425 -10.334 -10.168 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.266 -10.614 -7.201 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.800 -11.768 -8.407 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.384 -12.070 -9.119 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.901 -11.010 -7.810 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -10.724 -12.997 -6.650 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -12.437 -12.744 -6.383 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.007 -14.120 -8.910 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -12.013 -14.613 -5.397 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.398 -16.333 -5.518 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -12.503 -16.343 -9.068 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -12.676 -17.316 -7.603 1.00 0.00 H new ATOM 566 N THR A 41 -15.074 -9.169 -8.190 1.00 0.00 N ATOM 567 CA THR A 41 -16.027 -8.192 -7.689 1.00 0.00 C ATOM 568 C THR A 41 -15.495 -7.534 -6.415 1.00 0.00 C ATOM 569 O THR A 41 -14.840 -6.494 -6.476 1.00 0.00 O ATOM 570 CB THR A 41 -17.369 -8.899 -7.493 1.00 0.00 C ATOM 571 OG1 THR A 41 -17.012 -10.244 -7.185 1.00 0.00 O ATOM 572 CG2 THR A 41 -18.166 -9.014 -8.794 1.00 0.00 C ATOM 0 H THR A 41 -15.355 -10.142 -8.067 1.00 0.00 H new ATOM 0 HA THR A 41 -16.172 -7.379 -8.401 1.00 0.00 H new ATOM 0 HB THR A 41 -17.959 -8.358 -6.753 1.00 0.00 H new ATOM 0 HG1 THR A 41 -17.824 -10.773 -7.041 1.00 0.00 H new ATOM 0 HG21 THR A 41 -19.110 -9.523 -8.599 1.00 0.00 H new ATOM 0 HG22 THR A 41 -18.366 -8.017 -9.187 1.00 0.00 H new ATOM 0 HG23 THR A 41 -17.591 -9.583 -9.524 1.00 0.00 H new ATOM 580 N THR A 42 -15.796 -8.166 -5.290 1.00 0.00 N ATOM 581 CA THR A 42 -15.357 -7.654 -4.003 1.00 0.00 C ATOM 582 C THR A 42 -13.911 -8.072 -3.728 1.00 0.00 C ATOM 583 O THR A 42 -13.404 -7.879 -2.624 1.00 0.00 O ATOM 584 CB THR A 42 -16.343 -8.140 -2.939 1.00 0.00 C ATOM 585 OG1 THR A 42 -16.192 -9.557 -2.948 1.00 0.00 O ATOM 586 CG2 THR A 42 -17.801 -7.918 -3.346 1.00 0.00 C ATOM 0 H THR A 42 -16.339 -9.028 -5.243 1.00 0.00 H new ATOM 0 HA THR A 42 -15.355 -6.564 -3.991 1.00 0.00 H new ATOM 0 HB THR A 42 -16.146 -7.624 -1.999 1.00 0.00 H new ATOM 0 HG1 THR A 42 -16.794 -9.954 -2.285 1.00 0.00 H new ATOM 0 HG21 THR A 42 -18.459 -8.280 -2.556 1.00 0.00 H new ATOM 0 HG22 THR A 42 -17.977 -6.854 -3.505 1.00 0.00 H new ATOM 0 HG23 THR A 42 -18.008 -8.461 -4.268 1.00 0.00 H new ATOM 594 N SER A 43 -13.287 -8.636 -4.752 1.00 0.00 N ATOM 595 CA SER A 43 -11.910 -9.083 -4.635 1.00 0.00 C ATOM 596 C SER A 43 -11.172 -8.856 -5.956 1.00 0.00 C ATOM 597 O SER A 43 -11.747 -9.027 -7.030 1.00 0.00 O ATOM 598 CB SER A 43 -11.841 -10.558 -4.236 1.00 0.00 C ATOM 599 OG SER A 43 -12.186 -10.758 -2.867 1.00 0.00 O ATOM 0 H SER A 43 -13.710 -8.793 -5.667 1.00 0.00 H new ATOM 0 HA SER A 43 -11.427 -8.500 -3.851 1.00 0.00 H new ATOM 0 HB2 SER A 43 -12.515 -11.136 -4.868 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.834 -10.935 -4.415 1.00 0.00 H new ATOM 0 HG SER A 43 -12.496 -9.912 -2.481 1.00 0.00 H new ATOM 605 N VAL A 44 -9.909 -8.474 -5.833 1.00 0.00 N ATOM 606 CA VAL A 44 -9.087 -8.221 -7.004 1.00 0.00 C ATOM 607 C VAL A 44 -7.625 -8.527 -6.671 1.00 0.00 C ATOM 608 O VAL A 44 -7.284 -8.756 -5.512 1.00 0.00 O ATOM 609 CB VAL A 44 -9.301 -6.788 -7.495 1.00 0.00 C ATOM 610 CG1 VAL A 44 -10.760 -6.362 -7.323 1.00 0.00 C ATOM 611 CG2 VAL A 44 -8.358 -5.818 -6.781 1.00 0.00 C ATOM 0 H VAL A 44 -9.435 -8.334 -4.941 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.378 -8.878 -7.824 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.068 -6.760 -8.559 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -10.885 -5.340 -7.680 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.404 -7.028 -7.898 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -11.033 -6.414 -6.269 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.530 -4.806 -7.148 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.546 -5.851 -5.708 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.325 -6.104 -6.977 1.00 0.00 H new ATOM 621 N ARG A 45 -6.801 -8.521 -7.708 1.00 0.00 N ATOM 622 CA ARG A 45 -5.384 -8.794 -7.540 1.00 0.00 C ATOM 623 C ARG A 45 -4.587 -8.198 -8.702 1.00 0.00 C ATOM 624 O ARG A 45 -4.777 -8.586 -9.854 1.00 0.00 O ATOM 625 CB ARG A 45 -5.118 -10.300 -7.468 1.00 0.00 C ATOM 626 CG ARG A 45 -3.644 -10.583 -7.171 1.00 0.00 C ATOM 627 CD ARG A 45 -3.180 -11.862 -7.870 1.00 0.00 C ATOM 628 NE ARG A 45 -3.255 -13.006 -6.934 1.00 0.00 N ATOM 629 CZ ARG A 45 -2.416 -13.192 -5.907 1.00 0.00 C ATOM 630 NH1 ARG A 45 -1.433 -12.311 -5.676 1.00 0.00 N ATOM 631 NH2 ARG A 45 -2.559 -14.259 -5.109 1.00 0.00 N ATOM 0 H ARG A 45 -7.088 -8.331 -8.668 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.067 -8.335 -6.604 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.741 -10.746 -6.693 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.399 -10.768 -8.411 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.035 -9.742 -7.502 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.498 -10.679 -6.095 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.802 -12.055 -8.744 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.158 -11.740 -8.228 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.992 -13.696 -7.080 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -1.324 -11.498 -6.283 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -0.794 -12.453 -4.894 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -3.307 -14.930 -5.284 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -1.920 -14.400 -4.327 1.00 0.00 H new ATOM 645 N LEU A 46 -3.710 -7.266 -8.360 1.00 0.00 N ATOM 646 CA LEU A 46 -2.883 -6.612 -9.360 1.00 0.00 C ATOM 647 C LEU A 46 -1.410 -6.912 -9.072 1.00 0.00 C ATOM 648 O LEU A 46 -1.076 -7.443 -8.014 1.00 0.00 O ATOM 649 CB LEU A 46 -3.205 -5.118 -9.428 1.00 0.00 C ATOM 650 CG LEU A 46 -2.421 -4.218 -8.471 1.00 0.00 C ATOM 651 CD1 LEU A 46 -2.263 -2.810 -9.048 1.00 0.00 C ATOM 652 CD2 LEU A 46 -3.065 -4.201 -7.083 1.00 0.00 C ATOM 0 H LEU A 46 -3.554 -6.948 -7.404 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.101 -7.006 -10.352 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.026 -4.774 -10.447 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.269 -4.987 -9.229 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.419 -4.632 -8.356 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -1.702 -2.191 -8.348 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.727 -2.863 -9.996 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.247 -2.372 -9.212 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -2.488 -3.554 -6.422 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.085 -3.825 -7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -3.081 -5.212 -6.677 1.00 0.00 H new ATOM 664 N ILE A 47 -0.569 -6.558 -10.033 1.00 0.00 N ATOM 665 CA ILE A 47 0.860 -6.782 -9.896 1.00 0.00 C ATOM 666 C ILE A 47 1.615 -5.556 -10.413 1.00 0.00 C ATOM 667 O ILE A 47 1.324 -5.055 -11.499 1.00 0.00 O ATOM 668 CB ILE A 47 1.265 -8.089 -10.581 1.00 0.00 C ATOM 669 CG1 ILE A 47 1.420 -7.891 -12.091 1.00 0.00 C ATOM 670 CG2 ILE A 47 0.280 -9.211 -10.248 1.00 0.00 C ATOM 671 CD1 ILE A 47 0.092 -7.480 -12.729 1.00 0.00 C ATOM 0 H ILE A 47 -0.850 -6.118 -10.909 1.00 0.00 H new ATOM 0 HA ILE A 47 1.129 -6.903 -8.847 1.00 0.00 H new ATOM 0 HB ILE A 47 2.238 -8.390 -10.194 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.173 -7.127 -12.286 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.777 -8.814 -12.548 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.591 -10.128 -10.747 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.263 -9.372 -9.170 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.717 -8.933 -10.589 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.230 -7.346 -13.802 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.652 -8.257 -12.553 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.250 -6.544 -12.287 1.00 0.00 H new ATOM 683 N TRP A 48 2.571 -5.108 -9.612 1.00 0.00 N ATOM 684 CA TRP A 48 3.371 -3.951 -9.976 1.00 0.00 C ATOM 685 C TRP A 48 4.836 -4.389 -10.037 1.00 0.00 C ATOM 686 O TRP A 48 5.147 -5.559 -9.820 1.00 0.00 O ATOM 687 CB TRP A 48 3.133 -2.794 -9.004 1.00 0.00 C ATOM 688 CG TRP A 48 3.644 -3.057 -7.586 1.00 0.00 C ATOM 689 CD1 TRP A 48 4.790 -2.638 -7.031 1.00 0.00 C ATOM 690 CD2 TRP A 48 2.976 -3.819 -6.559 1.00 0.00 C ATOM 691 NE1 TRP A 48 4.909 -3.074 -5.727 1.00 0.00 N ATOM 692 CE2 TRP A 48 3.771 -3.815 -5.431 1.00 0.00 C ATOM 693 CE3 TRP A 48 1.741 -4.491 -6.582 1.00 0.00 C ATOM 694 CZ2 TRP A 48 3.418 -4.465 -4.242 1.00 0.00 C ATOM 695 CZ3 TRP A 48 1.403 -5.136 -5.387 1.00 0.00 C ATOM 696 CH2 TRP A 48 2.192 -5.141 -4.242 1.00 0.00 C ATOM 0 H TRP A 48 2.809 -5.525 -8.712 1.00 0.00 H new ATOM 0 HA TRP A 48 3.080 -3.573 -10.956 1.00 0.00 H new ATOM 0 HB2 TRP A 48 3.619 -1.900 -9.394 1.00 0.00 H new ATOM 0 HB3 TRP A 48 2.064 -2.583 -8.961 1.00 0.00 H new ATOM 0 HD1 TRP A 48 5.527 -2.035 -7.540 1.00 0.00 H new ATOM 0 HE1 TRP A 48 5.689 -2.887 -5.096 1.00 0.00 H new ATOM 0 HE3 TRP A 48 1.103 -4.508 -7.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.057 -4.446 -3.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 0.463 -5.667 -5.352 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.861 -5.664 -3.357 1.00 0.00 H new ATOM 707 N GLN A 49 5.696 -3.426 -10.334 1.00 0.00 N ATOM 708 CA GLN A 49 7.120 -3.697 -10.427 1.00 0.00 C ATOM 709 C GLN A 49 7.917 -2.597 -9.724 1.00 0.00 C ATOM 710 O GLN A 49 7.395 -1.512 -9.471 1.00 0.00 O ATOM 711 CB GLN A 49 7.557 -3.843 -11.887 1.00 0.00 C ATOM 712 CG GLN A 49 7.525 -5.309 -12.324 1.00 0.00 C ATOM 713 CD GLN A 49 8.078 -5.469 -13.742 1.00 0.00 C ATOM 714 OE1 GLN A 49 9.231 -5.185 -14.022 1.00 0.00 O ATOM 715 NE2 GLN A 49 7.195 -5.939 -14.617 1.00 0.00 N ATOM 0 H GLN A 49 5.434 -2.457 -10.513 1.00 0.00 H new ATOM 0 HA GLN A 49 7.323 -4.643 -9.925 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.900 -3.254 -12.528 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.564 -3.445 -12.011 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.111 -5.912 -11.631 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.502 -5.682 -12.284 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.245 -6.157 -14.316 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.467 -6.082 -15.590 1.00 0.00 H new ATOM 724 N PRO A 50 9.202 -2.923 -9.420 1.00 0.00 N ATOM 725 CA PRO A 50 10.076 -1.975 -8.750 1.00 0.00 C ATOM 726 C PRO A 50 10.545 -0.885 -9.716 1.00 0.00 C ATOM 727 O PRO A 50 10.635 -1.115 -10.921 1.00 0.00 O ATOM 728 CB PRO A 50 11.219 -2.813 -8.201 1.00 0.00 C ATOM 729 CG PRO A 50 11.186 -4.121 -8.975 1.00 0.00 C ATOM 730 CD PRO A 50 9.854 -4.198 -9.704 1.00 0.00 C ATOM 0 HA PRO A 50 9.574 -1.435 -7.947 1.00 0.00 H new ATOM 0 HB2 PRO A 50 12.174 -2.305 -8.333 1.00 0.00 H new ATOM 0 HB3 PRO A 50 11.096 -2.988 -7.132 1.00 0.00 H new ATOM 0 HG2 PRO A 50 12.012 -4.166 -9.684 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.300 -4.968 -8.298 1.00 0.00 H new ATOM 0 HD2 PRO A 50 9.996 -4.340 -10.775 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.256 -5.037 -9.348 1.00 0.00 H new ATOM 738 N PRO A 51 10.839 0.310 -9.136 1.00 0.00 N ATOM 739 CA PRO A 51 11.297 1.436 -9.932 1.00 0.00 C ATOM 740 C PRO A 51 12.752 1.247 -10.363 1.00 0.00 C ATOM 741 O PRO A 51 13.637 1.087 -9.523 1.00 0.00 O ATOM 742 CB PRO A 51 11.093 2.653 -9.046 1.00 0.00 C ATOM 743 CG PRO A 51 10.967 2.120 -7.628 1.00 0.00 C ATOM 744 CD PRO A 51 10.745 0.619 -7.713 1.00 0.00 C ATOM 0 HA PRO A 51 10.745 1.543 -10.866 1.00 0.00 H new ATOM 0 HB2 PRO A 51 11.933 3.343 -9.131 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.198 3.203 -9.338 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.868 2.341 -7.056 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.136 2.600 -7.112 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.495 0.075 -7.139 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.771 0.339 -7.311 1.00 0.00 H new ATOM 752 N ALA A 52 12.957 1.273 -11.672 1.00 0.00 N ATOM 753 CA ALA A 52 14.290 1.106 -12.225 1.00 0.00 C ATOM 754 C ALA A 52 15.272 1.987 -11.450 1.00 0.00 C ATOM 755 O ALA A 52 16.460 1.676 -11.369 1.00 0.00 O ATOM 756 CB ALA A 52 14.268 1.434 -13.719 1.00 0.00 C ATOM 0 H ALA A 52 12.222 1.407 -12.366 1.00 0.00 H new ATOM 0 HA ALA A 52 14.621 0.073 -12.123 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.268 1.309 -14.134 1.00 0.00 H new ATOM 0 HB2 ALA A 52 13.577 0.763 -14.229 1.00 0.00 H new ATOM 0 HB3 ALA A 52 13.943 2.465 -13.860 1.00 0.00 H new ATOM 762 N ALA A 53 14.740 3.068 -10.899 1.00 0.00 N ATOM 763 CA ALA A 53 15.555 3.996 -10.133 1.00 0.00 C ATOM 764 C ALA A 53 15.069 4.018 -8.683 1.00 0.00 C ATOM 765 O ALA A 53 14.269 4.874 -8.305 1.00 0.00 O ATOM 766 CB ALA A 53 15.505 5.379 -10.786 1.00 0.00 C ATOM 0 H ALA A 53 13.755 3.322 -10.968 1.00 0.00 H new ATOM 0 HA ALA A 53 16.597 3.676 -10.126 1.00 0.00 H new ATOM 0 HB1 ALA A 53 16.116 6.075 -10.211 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.888 5.315 -11.804 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.475 5.734 -10.808 1.00 0.00 H new ATOM 772 N PRO A 54 15.584 3.042 -7.889 1.00 0.00 N ATOM 773 CA PRO A 54 15.211 2.941 -6.488 1.00 0.00 C ATOM 774 C PRO A 54 15.898 4.027 -5.658 1.00 0.00 C ATOM 775 O PRO A 54 15.306 4.568 -4.725 1.00 0.00 O ATOM 776 CB PRO A 54 15.611 1.535 -6.074 1.00 0.00 C ATOM 777 CG PRO A 54 16.611 1.062 -7.118 1.00 0.00 C ATOM 778 CD PRO A 54 16.533 2.012 -8.302 1.00 0.00 C ATOM 0 HA PRO A 54 14.145 3.102 -6.324 1.00 0.00 H new ATOM 0 HB2 PRO A 54 16.055 1.532 -5.078 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.743 0.877 -6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.619 1.051 -6.703 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.383 0.043 -7.431 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.509 2.441 -8.530 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.193 1.498 -9.201 1.00 0.00 H new ATOM 786 N ASN A 55 17.137 4.315 -6.028 1.00 0.00 N ATOM 787 CA ASN A 55 17.911 5.327 -5.329 1.00 0.00 C ATOM 788 C ASN A 55 17.652 5.213 -3.825 1.00 0.00 C ATOM 789 O ASN A 55 17.489 6.222 -3.142 1.00 0.00 O ATOM 790 CB ASN A 55 17.507 6.734 -5.773 1.00 0.00 C ATOM 791 CG ASN A 55 17.174 6.763 -7.266 1.00 0.00 C ATOM 792 OD1 ASN A 55 15.873 6.689 -7.532 1.00 0.00 O flip ATOM 793 ND2 ASN A 55 18.041 6.847 -8.120 1.00 0.00 N flip ATOM 0 H ASN A 55 17.624 3.865 -6.803 1.00 0.00 H new ATOM 0 HA ASN A 55 18.964 5.165 -5.560 1.00 0.00 H new ATOM 0 HB2 ASN A 55 16.643 7.067 -5.198 1.00 0.00 H new ATOM 0 HB3 ASN A 55 18.318 7.432 -5.564 1.00 0.00 H new ATOM 0 HD21 ASN A 55 19.022 6.900 -7.847 1.00 0.00 H new ATOM 0 HD22 ASN A 55 17.785 6.864 -9.107 1.00 0.00 H new ATOM 800 N GLY A 56 17.622 3.974 -3.355 1.00 0.00 N ATOM 801 CA GLY A 56 17.386 3.715 -1.945 1.00 0.00 C ATOM 802 C GLY A 56 16.758 2.335 -1.738 1.00 0.00 C ATOM 803 O GLY A 56 15.742 2.014 -2.353 1.00 0.00 O ATOM 0 H GLY A 56 17.757 3.139 -3.926 1.00 0.00 H new ATOM 0 HA2 GLY A 56 18.327 3.776 -1.398 1.00 0.00 H new ATOM 0 HA3 GLY A 56 16.729 4.482 -1.536 1.00 0.00 H new ATOM 807 N ILE A 57 17.389 1.557 -0.871 1.00 0.00 N ATOM 808 CA ILE A 57 16.905 0.219 -0.577 1.00 0.00 C ATOM 809 C ILE A 57 15.446 0.298 -0.123 1.00 0.00 C ATOM 810 O ILE A 57 15.091 1.148 0.693 1.00 0.00 O ATOM 811 CB ILE A 57 17.826 -0.474 0.430 1.00 0.00 C ATOM 812 CG1 ILE A 57 19.043 -1.083 -0.269 1.00 0.00 C ATOM 813 CG2 ILE A 57 17.058 -1.512 1.251 1.00 0.00 C ATOM 814 CD1 ILE A 57 19.568 -0.153 -1.365 1.00 0.00 C ATOM 0 H ILE A 57 18.231 1.828 -0.363 1.00 0.00 H new ATOM 0 HA ILE A 57 16.927 -0.400 -1.474 1.00 0.00 H new ATOM 0 HB ILE A 57 18.197 0.277 1.127 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.830 -1.271 0.461 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.774 -2.046 -0.702 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.735 -1.990 1.959 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.251 -1.021 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.639 -2.266 0.584 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.433 -0.610 -1.846 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.786 0.013 -2.106 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.859 0.801 -0.924 1.00 0.00 H new ATOM 826 N ILE A 58 14.640 -0.599 -0.671 1.00 0.00 N ATOM 827 CA ILE A 58 13.227 -0.642 -0.332 1.00 0.00 C ATOM 828 C ILE A 58 13.040 -1.447 0.956 1.00 0.00 C ATOM 829 O ILE A 58 13.498 -2.584 1.053 1.00 0.00 O ATOM 830 CB ILE A 58 12.410 -1.171 -1.512 1.00 0.00 C ATOM 831 CG1 ILE A 58 12.828 -0.491 -2.818 1.00 0.00 C ATOM 832 CG2 ILE A 58 10.909 -1.029 -1.247 1.00 0.00 C ATOM 833 CD1 ILE A 58 12.296 0.941 -2.885 1.00 0.00 C ATOM 0 H ILE A 58 14.938 -1.302 -1.347 1.00 0.00 H new ATOM 0 HA ILE A 58 12.851 0.362 -0.138 1.00 0.00 H new ATOM 0 HB ILE A 58 12.619 -2.235 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 58 13.915 -0.483 -2.896 1.00 0.00 H new ATOM 0 HG13 ILE A 58 12.452 -1.063 -3.666 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.351 -1.412 -2.101 1.00 0.00 H new ATOM 0 HG22 ILE A 58 10.642 -1.596 -0.355 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.664 0.022 -1.096 1.00 0.00 H new ATOM 0 HD11 ILE A 58 12.607 1.401 -3.823 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.207 0.928 -2.831 1.00 0.00 H new ATOM 0 HD13 ILE A 58 12.694 1.516 -2.049 1.00 0.00 H new ATOM 845 N LEU A 59 12.367 -0.824 1.912 1.00 0.00 N ATOM 846 CA LEU A 59 12.113 -1.468 3.190 1.00 0.00 C ATOM 847 C LEU A 59 10.729 -2.120 3.162 1.00 0.00 C ATOM 848 O LEU A 59 10.442 -3.010 3.961 1.00 0.00 O ATOM 849 CB LEU A 59 12.302 -0.474 4.337 1.00 0.00 C ATOM 850 CG LEU A 59 13.740 -0.027 4.607 1.00 0.00 C ATOM 851 CD1 LEU A 59 14.615 -0.215 3.366 1.00 0.00 C ATOM 852 CD2 LEU A 59 13.779 1.413 5.123 1.00 0.00 C ATOM 0 H LEU A 59 11.990 0.120 1.828 1.00 0.00 H new ATOM 0 HA LEU A 59 12.837 -2.264 3.366 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.701 0.411 4.127 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.904 -0.921 5.248 1.00 0.00 H new ATOM 0 HG LEU A 59 14.153 -0.661 5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 59 15.632 0.110 3.585 1.00 0.00 H new ATOM 0 HD12 LEU A 59 14.624 -1.268 3.083 1.00 0.00 H new ATOM 0 HD13 LEU A 59 14.213 0.378 2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.813 1.706 5.307 1.00 0.00 H new ATOM 0 HD22 LEU A 59 13.340 2.078 4.379 1.00 0.00 H new ATOM 0 HD23 LEU A 59 13.212 1.482 6.051 1.00 0.00 H new ATOM 864 N ALA A 60 9.908 -1.651 2.234 1.00 0.00 N ATOM 865 CA ALA A 60 8.561 -2.176 2.091 1.00 0.00 C ATOM 866 C ALA A 60 7.784 -1.314 1.094 1.00 0.00 C ATOM 867 O ALA A 60 8.356 -0.435 0.451 1.00 0.00 O ATOM 868 CB ALA A 60 7.887 -2.232 3.464 1.00 0.00 C ATOM 0 H ALA A 60 10.150 -0.913 1.573 1.00 0.00 H new ATOM 0 HA ALA A 60 8.585 -3.192 1.698 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.876 -2.626 3.357 1.00 0.00 H new ATOM 0 HB2 ALA A 60 8.461 -2.881 4.125 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.843 -1.229 3.889 1.00 0.00 H new ATOM 874 N TYR A 61 6.493 -1.596 0.997 1.00 0.00 N ATOM 875 CA TYR A 61 5.632 -0.857 0.090 1.00 0.00 C ATOM 876 C TYR A 61 4.279 -0.558 0.738 1.00 0.00 C ATOM 877 O TYR A 61 4.000 -1.024 1.842 1.00 0.00 O ATOM 878 CB TYR A 61 5.415 -1.767 -1.120 1.00 0.00 C ATOM 879 CG TYR A 61 6.515 -1.669 -2.179 1.00 0.00 C ATOM 880 CD1 TYR A 61 7.691 -2.374 -2.020 1.00 0.00 C ATOM 881 CD2 TYR A 61 6.331 -0.876 -3.293 1.00 0.00 C ATOM 882 CE1 TYR A 61 8.726 -2.282 -3.016 1.00 0.00 C ATOM 883 CE2 TYR A 61 7.367 -0.784 -4.290 1.00 0.00 C ATOM 884 CZ TYR A 61 8.513 -1.491 -4.102 1.00 0.00 C ATOM 885 OH TYR A 61 9.491 -1.404 -5.043 1.00 0.00 O ATOM 0 H TYR A 61 6.023 -2.326 1.532 1.00 0.00 H new ATOM 0 HA TYR A 61 6.087 0.096 -0.180 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.346 -2.799 -0.777 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.459 -1.520 -1.581 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.835 -2.995 -1.148 1.00 0.00 H new ATOM 0 HD2 TYR A 61 5.411 -0.325 -3.418 1.00 0.00 H new ATOM 0 HE1 TYR A 61 9.651 -2.829 -2.904 1.00 0.00 H new ATOM 0 HE2 TYR A 61 7.236 -0.167 -5.167 1.00 0.00 H new ATOM 0 HH TYR A 61 9.997 -2.243 -5.067 1.00 0.00 H new ATOM 895 N GLN A 62 3.475 0.217 0.025 1.00 0.00 N ATOM 896 CA GLN A 62 2.158 0.583 0.518 1.00 0.00 C ATOM 897 C GLN A 62 1.132 0.521 -0.615 1.00 0.00 C ATOM 898 O GLN A 62 1.370 1.046 -1.702 1.00 0.00 O ATOM 899 CB GLN A 62 2.180 1.970 1.163 1.00 0.00 C ATOM 900 CG GLN A 62 0.813 2.321 1.754 1.00 0.00 C ATOM 901 CD GLN A 62 0.931 3.462 2.767 1.00 0.00 C ATOM 902 OE1 GLN A 62 -0.138 4.252 2.818 1.00 0.00 O flip ATOM 903 NE2 GLN A 62 1.926 3.615 3.456 1.00 0.00 N flip ATOM 0 H GLN A 62 3.710 0.602 -0.890 1.00 0.00 H new ATOM 0 HA GLN A 62 1.866 -0.134 1.286 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.937 1.999 1.946 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.462 2.716 0.420 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.130 2.609 0.955 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.386 1.443 2.238 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.712 2.971 3.367 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.972 4.387 4.122 1.00 0.00 H new ATOM 912 N ILE A 63 0.012 -0.123 -0.322 1.00 0.00 N ATOM 913 CA ILE A 63 -1.052 -0.260 -1.303 1.00 0.00 C ATOM 914 C ILE A 63 -2.350 0.303 -0.722 1.00 0.00 C ATOM 915 O ILE A 63 -2.965 -0.313 0.147 1.00 0.00 O ATOM 916 CB ILE A 63 -1.166 -1.712 -1.770 1.00 0.00 C ATOM 917 CG1 ILE A 63 -0.713 -1.858 -3.224 1.00 0.00 C ATOM 918 CG2 ILE A 63 -2.583 -2.248 -1.555 1.00 0.00 C ATOM 919 CD1 ILE A 63 0.159 -3.102 -3.405 1.00 0.00 C ATOM 0 H ILE A 63 -0.182 -0.556 0.581 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.824 0.321 -2.197 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.496 -2.319 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.585 -1.923 -3.875 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -0.155 -0.972 -3.525 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.636 -3.282 -1.895 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.833 -2.202 -0.495 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.291 -1.643 -2.121 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.467 -3.182 -4.447 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.042 -3.023 -2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.410 -3.989 -3.126 1.00 0.00 H new ATOM 931 N THR A 64 -2.730 1.468 -1.226 1.00 0.00 N ATOM 932 CA THR A 64 -3.944 2.122 -0.768 1.00 0.00 C ATOM 933 C THR A 64 -5.079 1.899 -1.770 1.00 0.00 C ATOM 934 O THR A 64 -4.944 2.222 -2.949 1.00 0.00 O ATOM 935 CB THR A 64 -3.625 3.599 -0.530 1.00 0.00 C ATOM 936 OG1 THR A 64 -3.638 4.172 -1.834 1.00 0.00 O ATOM 937 CG2 THR A 64 -2.192 3.817 -0.041 1.00 0.00 C ATOM 0 H THR A 64 -2.218 1.976 -1.947 1.00 0.00 H new ATOM 0 HA THR A 64 -4.293 1.695 0.172 1.00 0.00 H new ATOM 0 HB THR A 64 -4.324 4.008 0.200 1.00 0.00 H new ATOM 0 HG1 THR A 64 -3.820 3.473 -2.497 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.018 4.882 0.112 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.044 3.286 0.899 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.492 3.438 -0.786 1.00 0.00 H new ATOM 945 N HIS A 65 -6.173 1.349 -1.263 1.00 0.00 N ATOM 946 CA HIS A 65 -7.331 1.079 -2.099 1.00 0.00 C ATOM 947 C HIS A 65 -8.503 1.952 -1.648 1.00 0.00 C ATOM 948 O HIS A 65 -8.710 2.151 -0.452 1.00 0.00 O ATOM 949 CB HIS A 65 -7.668 -0.413 -2.095 1.00 0.00 C ATOM 950 CG HIS A 65 -8.464 -0.861 -0.893 1.00 0.00 C ATOM 951 ND1 HIS A 65 -9.682 -0.457 -0.431 1.00 0.00 N flip ATOM 952 CD2 HIS A 65 -8.017 -1.834 -0.017 1.00 0.00 C flip ATOM 953 CE1 HIS A 65 -9.964 -1.147 0.667 1.00 0.00 C flip ATOM 954 NE2 HIS A 65 -8.933 -2.002 0.925 1.00 0.00 N flip ATOM 0 H HIS A 65 -6.282 1.083 -0.284 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.106 1.338 -3.133 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -8.230 -0.650 -2.999 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -6.741 -0.984 -2.137 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -7.080 -2.366 -0.089 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -10.862 -1.048 1.259 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -8.877 -2.656 1.706 1.00 0.00 H new ATOM 962 N ARG A 66 -9.240 2.451 -2.630 1.00 0.00 N ATOM 963 CA ARG A 66 -10.386 3.299 -2.349 1.00 0.00 C ATOM 964 C ARG A 66 -11.309 3.365 -3.568 1.00 0.00 C ATOM 965 O ARG A 66 -10.864 3.173 -4.699 1.00 0.00 O ATOM 966 CB ARG A 66 -9.946 4.715 -1.974 1.00 0.00 C ATOM 967 CG ARG A 66 -9.224 5.392 -3.141 1.00 0.00 C ATOM 968 CD ARG A 66 -9.407 6.910 -3.091 1.00 0.00 C ATOM 969 NE ARG A 66 -9.351 7.471 -4.460 1.00 0.00 N ATOM 970 CZ ARG A 66 -9.789 8.694 -4.788 1.00 0.00 C ATOM 971 NH1 ARG A 66 -10.317 9.492 -3.850 1.00 0.00 N ATOM 972 NH2 ARG A 66 -9.699 9.120 -6.056 1.00 0.00 N ATOM 0 H ARG A 66 -9.066 2.284 -3.621 1.00 0.00 H new ATOM 0 HA ARG A 66 -10.922 2.863 -1.506 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.816 5.306 -1.688 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.287 4.677 -1.107 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -8.162 5.149 -3.107 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -9.609 5.006 -4.085 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -10.363 7.154 -2.628 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -8.629 7.358 -2.473 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.954 6.891 -5.199 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.386 9.169 -2.885 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.650 10.423 -4.101 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -9.297 8.513 -6.771 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.032 10.051 -6.306 1.00 0.00 H new ATOM 986 N LEU A 67 -12.577 3.637 -3.297 1.00 0.00 N ATOM 987 CA LEU A 67 -13.565 3.732 -4.358 1.00 0.00 C ATOM 988 C LEU A 67 -13.452 5.099 -5.034 1.00 0.00 C ATOM 989 O LEU A 67 -13.773 6.122 -4.432 1.00 0.00 O ATOM 990 CB LEU A 67 -14.963 3.428 -3.815 1.00 0.00 C ATOM 991 CG LEU A 67 -15.429 1.976 -3.939 1.00 0.00 C ATOM 992 CD1 LEU A 67 -16.898 1.835 -3.535 1.00 0.00 C ATOM 993 CD2 LEU A 67 -15.167 1.433 -5.345 1.00 0.00 C ATOM 0 H LEU A 67 -12.943 3.795 -2.358 1.00 0.00 H new ATOM 0 HA LEU A 67 -13.375 2.981 -5.125 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.991 3.709 -2.762 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -15.679 4.064 -4.335 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.845 1.370 -3.246 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -17.204 0.793 -3.632 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -17.023 2.155 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.515 2.456 -4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.508 0.399 -5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -15.707 2.036 -6.075 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -14.099 1.476 -5.558 1.00 0.00 H new ATOM 1005 N ASN A 68 -12.995 5.073 -6.278 1.00 0.00 N ATOM 1006 CA ASN A 68 -12.835 6.297 -7.043 1.00 0.00 C ATOM 1007 C ASN A 68 -14.018 7.227 -6.761 1.00 0.00 C ATOM 1008 O ASN A 68 -13.878 8.448 -6.812 1.00 0.00 O ATOM 1009 CB ASN A 68 -12.808 6.009 -8.545 1.00 0.00 C ATOM 1010 CG ASN A 68 -12.066 7.112 -9.302 1.00 0.00 C ATOM 1011 OD1 ASN A 68 -11.579 8.073 -8.730 1.00 0.00 O ATOM 1012 ND2 ASN A 68 -12.008 6.921 -10.617 1.00 0.00 N ATOM 0 H ASN A 68 -12.730 4.222 -6.775 1.00 0.00 H new ATOM 0 HA ASN A 68 -11.893 6.758 -6.748 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.323 5.050 -8.726 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.828 5.927 -8.922 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -11.534 7.602 -11.211 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -12.437 6.094 -11.032 1.00 0.00 H new ATOM 1019 N THR A 69 -15.155 6.614 -6.470 1.00 0.00 N ATOM 1020 CA THR A 69 -16.361 7.371 -6.181 1.00 0.00 C ATOM 1021 C THR A 69 -17.020 6.856 -4.899 1.00 0.00 C ATOM 1022 O THR A 69 -16.373 6.199 -4.085 1.00 0.00 O ATOM 1023 CB THR A 69 -17.274 7.294 -7.406 1.00 0.00 C ATOM 1024 OG1 THR A 69 -17.636 5.918 -7.483 1.00 0.00 O ATOM 1025 CG2 THR A 69 -16.522 7.555 -8.713 1.00 0.00 C ATOM 0 H THR A 69 -15.267 5.601 -6.428 1.00 0.00 H new ATOM 0 HA THR A 69 -16.133 8.420 -5.994 1.00 0.00 H new ATOM 0 HB THR A 69 -18.083 8.017 -7.302 1.00 0.00 H new ATOM 0 HG1 THR A 69 -18.230 5.778 -8.250 1.00 0.00 H new ATOM 0 HG21 THR A 69 -17.216 7.489 -9.551 1.00 0.00 H new ATOM 0 HG22 THR A 69 -16.080 8.551 -8.686 1.00 0.00 H new ATOM 0 HG23 THR A 69 -15.734 6.812 -8.834 1.00 0.00 H new ATOM 1033 N THR A 70 -18.299 7.173 -4.761 1.00 0.00 N ATOM 1034 CA THR A 70 -19.052 6.750 -3.593 1.00 0.00 C ATOM 1035 C THR A 70 -18.299 7.114 -2.312 1.00 0.00 C ATOM 1036 O THR A 70 -17.184 7.631 -2.368 1.00 0.00 O ATOM 1037 CB THR A 70 -19.332 5.252 -3.727 1.00 0.00 C ATOM 1038 OG1 THR A 70 -20.591 5.075 -3.082 1.00 0.00 O ATOM 1039 CG2 THR A 70 -18.367 4.399 -2.902 1.00 0.00 C ATOM 0 H THR A 70 -18.833 7.718 -5.439 1.00 0.00 H new ATOM 0 HA THR A 70 -20.008 7.270 -3.530 1.00 0.00 H new ATOM 0 HB THR A 70 -19.265 4.963 -4.776 1.00 0.00 H new ATOM 0 HG1 THR A 70 -20.850 4.131 -3.124 1.00 0.00 H new ATOM 0 HG21 THR A 70 -18.610 3.345 -3.033 1.00 0.00 H new ATOM 0 HG22 THR A 70 -17.345 4.580 -3.236 1.00 0.00 H new ATOM 0 HG23 THR A 70 -18.457 4.664 -1.848 1.00 0.00 H new ATOM 1047 N THR A 71 -18.938 6.831 -1.186 1.00 0.00 N ATOM 1048 CA THR A 71 -18.343 7.123 0.107 1.00 0.00 C ATOM 1049 C THR A 71 -17.635 5.884 0.659 1.00 0.00 C ATOM 1050 O THR A 71 -17.966 4.759 0.289 1.00 0.00 O ATOM 1051 CB THR A 71 -19.445 7.654 1.026 1.00 0.00 C ATOM 1052 OG1 THR A 71 -20.399 6.597 1.070 1.00 0.00 O ATOM 1053 CG2 THR A 71 -20.212 8.823 0.405 1.00 0.00 C ATOM 0 H THR A 71 -19.863 6.402 -1.143 1.00 0.00 H new ATOM 0 HA THR A 71 -17.573 7.890 0.024 1.00 0.00 H new ATOM 0 HB THR A 71 -19.007 7.969 1.973 1.00 0.00 H new ATOM 0 HG1 THR A 71 -21.148 6.856 1.646 1.00 0.00 H new ATOM 0 HG21 THR A 71 -20.982 9.162 1.098 1.00 0.00 H new ATOM 0 HG22 THR A 71 -19.523 9.642 0.199 1.00 0.00 H new ATOM 0 HG23 THR A 71 -20.678 8.499 -0.525 1.00 0.00 H new ATOM 1061 N ALA A 72 -16.674 6.133 1.536 1.00 0.00 N ATOM 1062 CA ALA A 72 -15.916 5.052 2.143 1.00 0.00 C ATOM 1063 C ALA A 72 -15.028 5.618 3.253 1.00 0.00 C ATOM 1064 O ALA A 72 -14.258 6.549 3.022 1.00 0.00 O ATOM 1065 CB ALA A 72 -15.111 4.324 1.065 1.00 0.00 C ATOM 0 H ALA A 72 -16.403 7.068 1.841 1.00 0.00 H new ATOM 0 HA ALA A 72 -16.586 4.322 2.597 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -14.543 3.513 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -15.791 3.915 0.317 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -14.425 5.024 0.588 1.00 0.00 H new ATOM 1071 N ASN A 73 -15.164 5.031 4.433 1.00 0.00 N ATOM 1072 CA ASN A 73 -14.383 5.465 5.579 1.00 0.00 C ATOM 1073 C ASN A 73 -12.896 5.423 5.223 1.00 0.00 C ATOM 1074 O ASN A 73 -12.246 4.390 5.376 1.00 0.00 O ATOM 1075 CB ASN A 73 -14.608 4.545 6.780 1.00 0.00 C ATOM 1076 CG ASN A 73 -15.290 5.295 7.926 1.00 0.00 C ATOM 1077 OD1 ASN A 73 -16.501 5.284 8.075 1.00 0.00 O ATOM 1078 ND2 ASN A 73 -14.448 5.944 8.724 1.00 0.00 N ATOM 0 H ASN A 73 -15.803 4.259 4.620 1.00 0.00 H new ATOM 0 HA ASN A 73 -14.697 6.477 5.837 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -15.221 3.695 6.481 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -13.653 4.145 7.120 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -14.805 6.475 9.519 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -13.445 5.911 8.542 1.00 0.00 H new ATOM 1085 N THR A 74 -12.400 6.558 4.753 1.00 0.00 N ATOM 1086 CA THR A 74 -11.001 6.663 4.374 1.00 0.00 C ATOM 1087 C THR A 74 -10.597 5.481 3.491 1.00 0.00 C ATOM 1088 O THR A 74 -11.412 4.601 3.215 1.00 0.00 O ATOM 1089 CB THR A 74 -10.171 6.777 5.654 1.00 0.00 C ATOM 1090 OG1 THR A 74 -10.674 5.737 6.488 1.00 0.00 O ATOM 1091 CG2 THR A 74 -10.471 8.059 6.435 1.00 0.00 C ATOM 0 H THR A 74 -12.942 7.413 4.626 1.00 0.00 H new ATOM 0 HA THR A 74 -10.821 7.554 3.772 1.00 0.00 H new ATOM 0 HB THR A 74 -9.111 6.745 5.403 1.00 0.00 H new ATOM 0 HG1 THR A 74 -10.809 4.926 5.954 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.855 8.090 7.334 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.247 8.925 5.812 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.524 8.076 6.716 1.00 0.00 H new ATOM 1099 N ALA A 75 -9.340 5.497 3.073 1.00 0.00 N ATOM 1100 CA ALA A 75 -8.818 4.437 2.228 1.00 0.00 C ATOM 1101 C ALA A 75 -7.921 3.520 3.062 1.00 0.00 C ATOM 1102 O ALA A 75 -6.840 3.924 3.487 1.00 0.00 O ATOM 1103 CB ALA A 75 -8.079 5.050 1.037 1.00 0.00 C ATOM 0 H ALA A 75 -8.667 6.228 3.304 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.630 3.829 1.829 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.687 4.254 0.403 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.768 5.668 0.460 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.255 5.665 1.398 1.00 0.00 H new ATOM 1109 N THR A 76 -8.403 2.304 3.271 1.00 0.00 N ATOM 1110 CA THR A 76 -7.658 1.327 4.046 1.00 0.00 C ATOM 1111 C THR A 76 -6.397 0.898 3.293 1.00 0.00 C ATOM 1112 O THR A 76 -6.452 0.024 2.429 1.00 0.00 O ATOM 1113 CB THR A 76 -8.598 0.164 4.369 1.00 0.00 C ATOM 1114 OG1 THR A 76 -9.411 0.659 5.429 1.00 0.00 O ATOM 1115 CG2 THR A 76 -7.864 -1.028 4.988 1.00 0.00 C ATOM 0 H THR A 76 -9.301 1.973 2.917 1.00 0.00 H new ATOM 0 HA THR A 76 -7.308 1.752 4.987 1.00 0.00 H new ATOM 0 HB THR A 76 -9.106 -0.155 3.459 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.052 -0.031 5.700 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.577 -1.825 5.198 1.00 0.00 H new ATOM 0 HG22 THR A 76 -7.108 -1.391 4.292 1.00 0.00 H new ATOM 0 HG23 THR A 76 -7.384 -0.718 5.916 1.00 0.00 H new ATOM 1123 N VAL A 77 -5.290 1.533 3.649 1.00 0.00 N ATOM 1124 CA VAL A 77 -4.017 1.228 3.018 1.00 0.00 C ATOM 1125 C VAL A 77 -3.325 0.104 3.791 1.00 0.00 C ATOM 1126 O VAL A 77 -3.491 -0.013 5.005 1.00 0.00 O ATOM 1127 CB VAL A 77 -3.166 2.496 2.916 1.00 0.00 C ATOM 1128 CG1 VAL A 77 -4.048 3.739 2.791 1.00 0.00 C ATOM 1129 CG2 VAL A 77 -2.216 2.615 4.109 1.00 0.00 C ATOM 0 H VAL A 77 -5.248 2.257 4.366 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.172 0.874 1.999 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.561 2.423 2.012 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.419 4.626 2.720 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.665 3.659 1.896 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.690 3.819 3.668 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -1.623 3.524 4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.794 2.655 5.032 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -1.553 1.750 4.134 1.00 0.00 H new ATOM 1139 N GLU A 78 -2.564 -0.695 3.058 1.00 0.00 N ATOM 1140 CA GLU A 78 -1.846 -1.806 3.660 1.00 0.00 C ATOM 1141 C GLU A 78 -0.367 -1.754 3.273 1.00 0.00 C ATOM 1142 O GLU A 78 -0.033 -1.521 2.112 1.00 0.00 O ATOM 1143 CB GLU A 78 -2.472 -3.144 3.260 1.00 0.00 C ATOM 1144 CG GLU A 78 -1.523 -4.305 3.564 1.00 0.00 C ATOM 1145 CD GLU A 78 -2.269 -5.464 4.226 1.00 0.00 C ATOM 1146 OE1 GLU A 78 -3.023 -5.181 5.182 1.00 0.00 O ATOM 1147 OE2 GLU A 78 -2.069 -6.607 3.762 1.00 0.00 O ATOM 0 H GLU A 78 -2.429 -0.595 2.052 1.00 0.00 H new ATOM 0 HA GLU A 78 -1.920 -1.717 4.744 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.410 -3.286 3.797 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.712 -3.134 2.197 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.056 -4.649 2.641 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.722 -3.962 4.219 1.00 0.00 H new ATOM 1154 N VAL A 79 0.480 -1.975 4.267 1.00 0.00 N ATOM 1155 CA VAL A 79 1.916 -1.957 4.045 1.00 0.00 C ATOM 1156 C VAL A 79 2.377 -3.348 3.605 1.00 0.00 C ATOM 1157 O VAL A 79 2.034 -4.348 4.234 1.00 0.00 O ATOM 1158 CB VAL A 79 2.633 -1.459 5.301 1.00 0.00 C ATOM 1159 CG1 VAL A 79 3.995 -2.138 5.461 1.00 0.00 C ATOM 1160 CG2 VAL A 79 2.779 0.064 5.282 1.00 0.00 C ATOM 0 H VAL A 79 0.200 -2.168 5.229 1.00 0.00 H new ATOM 0 HA VAL A 79 2.170 -1.262 3.245 1.00 0.00 H new ATOM 0 HB VAL A 79 2.022 -1.726 6.163 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.483 -1.766 6.362 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.857 -3.216 5.542 1.00 0.00 H new ATOM 0 HG13 VAL A 79 4.616 -1.916 4.593 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.292 0.392 6.186 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.357 0.363 4.408 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.792 0.524 5.238 1.00 0.00 H new ATOM 1170 N LEU A 80 3.148 -3.367 2.528 1.00 0.00 N ATOM 1171 CA LEU A 80 3.660 -4.619 1.996 1.00 0.00 C ATOM 1172 C LEU A 80 5.171 -4.687 2.229 1.00 0.00 C ATOM 1173 O LEU A 80 5.780 -3.711 2.665 1.00 0.00 O ATOM 1174 CB LEU A 80 3.256 -4.783 0.530 1.00 0.00 C ATOM 1175 CG LEU A 80 1.781 -5.097 0.272 1.00 0.00 C ATOM 1176 CD1 LEU A 80 1.255 -4.311 -0.930 1.00 0.00 C ATOM 1177 CD2 LEU A 80 1.560 -6.603 0.113 1.00 0.00 C ATOM 0 H LEU A 80 3.431 -2.536 2.009 1.00 0.00 H new ATOM 0 HA LEU A 80 3.218 -5.466 2.521 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.510 -3.866 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.858 -5.580 0.095 1.00 0.00 H new ATOM 0 HG LEU A 80 1.207 -4.777 1.142 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.204 -4.553 -1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.356 -3.243 -0.739 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.829 -4.577 -1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.503 -6.798 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.147 -6.970 -0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.872 -7.115 1.024 1.00 0.00 H new ATOM 1189 N ALA A 81 5.732 -5.849 1.928 1.00 0.00 N ATOM 1190 CA ALA A 81 7.160 -6.057 2.099 1.00 0.00 C ATOM 1191 C ALA A 81 7.907 -5.430 0.920 1.00 0.00 C ATOM 1192 O ALA A 81 7.298 -5.082 -0.090 1.00 0.00 O ATOM 1193 CB ALA A 81 7.444 -7.554 2.241 1.00 0.00 C ATOM 0 H ALA A 81 5.224 -6.656 1.567 1.00 0.00 H new ATOM 0 HA ALA A 81 7.513 -5.571 3.008 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.515 -7.711 2.369 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.914 -7.944 3.110 1.00 0.00 H new ATOM 0 HB3 ALA A 81 7.106 -8.075 1.345 1.00 0.00 H new ATOM 1199 N PRO A 82 9.250 -5.303 1.093 1.00 0.00 N ATOM 1200 CA PRO A 82 10.086 -4.724 0.055 1.00 0.00 C ATOM 1201 C PRO A 82 10.293 -5.711 -1.096 1.00 0.00 C ATOM 1202 O PRO A 82 10.931 -5.380 -2.094 1.00 0.00 O ATOM 1203 CB PRO A 82 11.382 -4.351 0.757 1.00 0.00 C ATOM 1204 CG PRO A 82 11.402 -5.151 2.049 1.00 0.00 C ATOM 1205 CD PRO A 82 10.004 -5.705 2.276 1.00 0.00 C ATOM 0 HA PRO A 82 9.633 -3.848 -0.410 1.00 0.00 H new ATOM 0 HB2 PRO A 82 12.245 -4.590 0.136 1.00 0.00 H new ATOM 0 HB3 PRO A 82 11.422 -3.281 0.960 1.00 0.00 H new ATOM 0 HG2 PRO A 82 12.128 -5.961 1.985 1.00 0.00 H new ATOM 0 HG3 PRO A 82 11.703 -4.519 2.885 1.00 0.00 H new ATOM 0 HD2 PRO A 82 10.021 -6.789 2.385 1.00 0.00 H new ATOM 0 HD3 PRO A 82 9.560 -5.300 3.185 1.00 0.00 H new ATOM 1213 N SER A 83 9.742 -6.903 -0.918 1.00 0.00 N ATOM 1214 CA SER A 83 9.858 -7.939 -1.929 1.00 0.00 C ATOM 1215 C SER A 83 8.469 -8.334 -2.436 1.00 0.00 C ATOM 1216 O SER A 83 8.237 -9.491 -2.783 1.00 0.00 O ATOM 1217 CB SER A 83 10.590 -9.165 -1.380 1.00 0.00 C ATOM 1218 OG SER A 83 9.791 -9.893 -0.451 1.00 0.00 O ATOM 0 H SER A 83 9.214 -7.174 -0.088 1.00 0.00 H new ATOM 0 HA SER A 83 10.442 -7.542 -2.759 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.872 -9.818 -2.206 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.513 -8.849 -0.894 1.00 0.00 H new ATOM 0 HG SER A 83 10.293 -10.669 -0.125 1.00 0.00 H new ATOM 1224 N ALA A 84 7.583 -7.349 -2.463 1.00 0.00 N ATOM 1225 CA ALA A 84 6.223 -7.579 -2.922 1.00 0.00 C ATOM 1226 C ALA A 84 6.065 -7.018 -4.336 1.00 0.00 C ATOM 1227 O ALA A 84 6.285 -5.829 -4.564 1.00 0.00 O ATOM 1228 CB ALA A 84 5.238 -6.953 -1.933 1.00 0.00 C ATOM 0 H ALA A 84 7.780 -6.391 -2.175 1.00 0.00 H new ATOM 0 HA ALA A 84 6.008 -8.647 -2.965 1.00 0.00 H new ATOM 0 HB1 ALA A 84 4.218 -7.125 -2.277 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.371 -7.406 -0.951 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.422 -5.881 -1.866 1.00 0.00 H new ATOM 1234 N ARG A 85 5.685 -7.899 -5.249 1.00 0.00 N ATOM 1235 CA ARG A 85 5.495 -7.507 -6.635 1.00 0.00 C ATOM 1236 C ARG A 85 4.006 -7.497 -6.985 1.00 0.00 C ATOM 1237 O ARG A 85 3.624 -7.088 -8.080 1.00 0.00 O ATOM 1238 CB ARG A 85 6.228 -8.458 -7.583 1.00 0.00 C ATOM 1239 CG ARG A 85 7.745 -8.302 -7.452 1.00 0.00 C ATOM 1240 CD ARG A 85 8.363 -7.829 -8.769 1.00 0.00 C ATOM 1241 NE ARG A 85 9.285 -8.861 -9.294 1.00 0.00 N ATOM 1242 CZ ARG A 85 10.125 -8.667 -10.320 1.00 0.00 C ATOM 1243 NH1 ARG A 85 10.165 -7.478 -10.937 1.00 0.00 N ATOM 1244 NH2 ARG A 85 10.925 -9.661 -10.729 1.00 0.00 N ATOM 0 H ARG A 85 5.503 -8.884 -5.056 1.00 0.00 H new ATOM 0 HA ARG A 85 5.907 -6.505 -6.754 1.00 0.00 H new ATOM 0 HB2 ARG A 85 5.944 -9.487 -7.363 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.926 -8.257 -8.611 1.00 0.00 H new ATOM 0 HG2 ARG A 85 7.974 -7.587 -6.661 1.00 0.00 H new ATOM 0 HG3 ARG A 85 8.188 -9.254 -7.159 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.577 -7.627 -9.497 1.00 0.00 H new ATOM 0 HD3 ARG A 85 8.901 -6.894 -8.613 1.00 0.00 H new ATOM 0 HE ARG A 85 9.281 -9.778 -8.847 1.00 0.00 H new ATOM 0 HH11 ARG A 85 9.556 -6.721 -10.626 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.804 -7.330 -11.718 1.00 0.00 H new ATOM 0 HH21 ARG A 85 10.895 -10.566 -10.259 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.564 -9.513 -11.510 1.00 0.00 H new ATOM 1258 N GLN A 86 3.204 -7.954 -6.034 1.00 0.00 N ATOM 1259 CA GLN A 86 1.765 -8.003 -6.227 1.00 0.00 C ATOM 1260 C GLN A 86 1.046 -7.946 -4.878 1.00 0.00 C ATOM 1261 O GLN A 86 1.679 -8.047 -3.828 1.00 0.00 O ATOM 1262 CB GLN A 86 1.360 -9.252 -7.012 1.00 0.00 C ATOM 1263 CG GLN A 86 1.585 -10.518 -6.183 1.00 0.00 C ATOM 1264 CD GLN A 86 1.789 -11.736 -7.087 1.00 0.00 C ATOM 1265 OE1 GLN A 86 1.216 -11.850 -8.157 1.00 0.00 O ATOM 1266 NE2 GLN A 86 2.636 -12.637 -6.597 1.00 0.00 N ATOM 0 H GLN A 86 3.524 -8.294 -5.127 1.00 0.00 H new ATOM 0 HA GLN A 86 1.467 -7.133 -6.812 1.00 0.00 H new ATOM 0 HB2 GLN A 86 0.310 -9.182 -7.298 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.938 -9.309 -7.934 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.456 -10.387 -5.541 1.00 0.00 H new ATOM 0 HG3 GLN A 86 0.730 -10.685 -5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 86 3.082 -12.479 -5.693 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.839 -13.486 -7.125 1.00 0.00 H new ATOM 1275 N TYR A 87 -0.267 -7.784 -4.950 1.00 0.00 N ATOM 1276 CA TYR A 87 -1.080 -7.713 -3.747 1.00 0.00 C ATOM 1277 C TYR A 87 -2.529 -8.108 -4.040 1.00 0.00 C ATOM 1278 O TYR A 87 -3.038 -7.850 -5.129 1.00 0.00 O ATOM 1279 CB TYR A 87 -1.043 -6.250 -3.300 1.00 0.00 C ATOM 1280 CG TYR A 87 -2.118 -5.886 -2.274 1.00 0.00 C ATOM 1281 CD1 TYR A 87 -1.879 -6.075 -0.928 1.00 0.00 C ATOM 1282 CD2 TYR A 87 -3.326 -5.369 -2.694 1.00 0.00 C ATOM 1283 CE1 TYR A 87 -2.891 -5.733 0.038 1.00 0.00 C ATOM 1284 CE2 TYR A 87 -4.338 -5.026 -1.729 1.00 0.00 C ATOM 1285 CZ TYR A 87 -4.070 -5.225 -0.410 1.00 0.00 C ATOM 1286 OH TYR A 87 -5.026 -4.901 0.502 1.00 0.00 O ATOM 0 H TYR A 87 -0.788 -7.700 -5.823 1.00 0.00 H new ATOM 0 HA TYR A 87 -0.699 -8.393 -2.985 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -0.062 -6.035 -2.875 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -1.159 -5.610 -4.175 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -0.933 -6.479 -0.599 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.513 -5.221 -3.747 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -2.717 -5.877 1.094 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -5.288 -4.620 -2.045 1.00 0.00 H new ATOM 0 HH TYR A 87 -5.814 -4.549 0.038 1.00 0.00 H new ATOM 1296 N THR A 88 -3.151 -8.728 -3.048 1.00 0.00 N ATOM 1297 CA THR A 88 -4.531 -9.161 -3.185 1.00 0.00 C ATOM 1298 C THR A 88 -5.465 -8.214 -2.430 1.00 0.00 C ATOM 1299 O THR A 88 -5.233 -7.909 -1.261 1.00 0.00 O ATOM 1300 CB THR A 88 -4.621 -10.612 -2.708 1.00 0.00 C ATOM 1301 OG1 THR A 88 -3.684 -11.306 -3.527 1.00 0.00 O ATOM 1302 CG2 THR A 88 -5.965 -11.259 -3.049 1.00 0.00 C ATOM 0 H THR A 88 -2.725 -8.941 -2.146 1.00 0.00 H new ATOM 0 HA THR A 88 -4.855 -9.125 -4.225 1.00 0.00 H new ATOM 0 HB THR A 88 -4.464 -10.649 -1.630 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.677 -12.255 -3.283 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.976 -12.288 -2.688 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.770 -10.699 -2.573 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.108 -11.252 -4.129 1.00 0.00 H new ATOM 1310 N ALA A 89 -6.502 -7.774 -3.129 1.00 0.00 N ATOM 1311 CA ALA A 89 -7.472 -6.868 -2.539 1.00 0.00 C ATOM 1312 C ALA A 89 -8.800 -7.603 -2.348 1.00 0.00 C ATOM 1313 O ALA A 89 -9.352 -8.152 -3.300 1.00 0.00 O ATOM 1314 CB ALA A 89 -7.614 -5.627 -3.422 1.00 0.00 C ATOM 0 H ALA A 89 -6.691 -8.029 -4.098 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.137 -6.533 -1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.342 -4.947 -2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -6.650 -5.125 -3.502 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -7.952 -5.924 -4.415 1.00 0.00 H new ATOM 1320 N THR A 90 -9.275 -7.589 -1.111 1.00 0.00 N ATOM 1321 CA THR A 90 -10.528 -8.247 -0.784 1.00 0.00 C ATOM 1322 C THR A 90 -11.410 -7.326 0.062 1.00 0.00 C ATOM 1323 O THR A 90 -10.905 -6.464 0.780 1.00 0.00 O ATOM 1324 CB THR A 90 -10.200 -9.574 -0.095 1.00 0.00 C ATOM 1325 OG1 THR A 90 -9.317 -9.207 0.962 1.00 0.00 O ATOM 1326 CG2 THR A 90 -9.360 -10.499 -0.977 1.00 0.00 C ATOM 0 H THR A 90 -8.815 -7.132 -0.324 1.00 0.00 H new ATOM 0 HA THR A 90 -11.106 -8.464 -1.682 1.00 0.00 H new ATOM 0 HB THR A 90 -11.126 -10.078 0.182 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.055 -10.008 1.462 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.155 -11.426 -0.441 1.00 0.00 H new ATOM 0 HG22 THR A 90 -9.906 -10.723 -1.893 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.419 -10.009 -1.226 1.00 0.00 H new ATOM 1334 N GLY A 91 -12.713 -7.539 -0.051 1.00 0.00 N ATOM 1335 CA GLY A 91 -13.669 -6.738 0.694 1.00 0.00 C ATOM 1336 C GLY A 91 -14.014 -5.452 -0.061 1.00 0.00 C ATOM 1337 O GLY A 91 -14.067 -4.376 0.532 1.00 0.00 O ATOM 0 H GLY A 91 -13.129 -8.255 -0.647 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.576 -7.317 0.868 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.257 -6.490 1.672 1.00 0.00 H new ATOM 1341 N LEU A 92 -14.238 -5.607 -1.358 1.00 0.00 N ATOM 1342 CA LEU A 92 -14.576 -4.472 -2.199 1.00 0.00 C ATOM 1343 C LEU A 92 -16.034 -4.590 -2.647 1.00 0.00 C ATOM 1344 O LEU A 92 -16.701 -5.579 -2.346 1.00 0.00 O ATOM 1345 CB LEU A 92 -13.585 -4.351 -3.359 1.00 0.00 C ATOM 1346 CG LEU A 92 -12.123 -4.658 -3.027 1.00 0.00 C ATOM 1347 CD1 LEU A 92 -11.372 -5.152 -4.264 1.00 0.00 C ATOM 1348 CD2 LEU A 92 -11.440 -3.448 -2.387 1.00 0.00 C ATOM 0 H LEU A 92 -14.192 -6.501 -1.846 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.489 -3.542 -1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.905 -5.023 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -13.642 -3.337 -3.755 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.102 -5.464 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.336 -5.363 -4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.844 -6.061 -4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.401 -4.385 -5.038 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -10.402 -3.693 -2.161 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.472 -2.605 -3.077 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.959 -3.182 -1.466 1.00 0.00 H new ATOM 1360 N LYS A 93 -16.486 -3.567 -3.357 1.00 0.00 N ATOM 1361 CA LYS A 93 -17.853 -3.544 -3.849 1.00 0.00 C ATOM 1362 C LYS A 93 -17.847 -3.715 -5.369 1.00 0.00 C ATOM 1363 O LYS A 93 -17.056 -3.081 -6.066 1.00 0.00 O ATOM 1364 CB LYS A 93 -18.571 -2.278 -3.376 1.00 0.00 C ATOM 1365 CG LYS A 93 -19.940 -2.141 -4.047 1.00 0.00 C ATOM 1366 CD LYS A 93 -20.170 -0.709 -4.533 1.00 0.00 C ATOM 1367 CE LYS A 93 -20.240 -0.653 -6.061 1.00 0.00 C ATOM 1368 NZ LYS A 93 -20.402 0.744 -6.522 1.00 0.00 N ATOM 0 H LYS A 93 -15.930 -2.748 -3.603 1.00 0.00 H new ATOM 0 HA LYS A 93 -18.420 -4.378 -3.436 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -18.694 -2.308 -2.293 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.961 -1.403 -3.603 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -20.007 -2.830 -4.889 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -20.724 -2.421 -3.343 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -21.096 -0.321 -4.109 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -19.364 -0.067 -4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -19.333 -1.080 -6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -21.075 -1.258 -6.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -20.245 0.791 -7.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -21.364 1.072 -6.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -19.711 1.352 -6.038 1.00 0.00 H new ATOM 1382 N PRO A 94 -18.762 -4.599 -5.852 1.00 0.00 N ATOM 1383 CA PRO A 94 -18.869 -4.861 -7.277 1.00 0.00 C ATOM 1384 C PRO A 94 -19.557 -3.701 -7.998 1.00 0.00 C ATOM 1385 O PRO A 94 -20.398 -3.016 -7.418 1.00 0.00 O ATOM 1386 CB PRO A 94 -19.641 -6.167 -7.379 1.00 0.00 C ATOM 1387 CG PRO A 94 -20.338 -6.345 -6.040 1.00 0.00 C ATOM 1388 CD PRO A 94 -19.715 -5.368 -5.057 1.00 0.00 C ATOM 0 HA PRO A 94 -17.897 -4.949 -7.763 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -20.364 -6.131 -8.194 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -18.971 -7.002 -7.584 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.407 -6.158 -6.138 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -20.225 -7.369 -5.684 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.470 -4.721 -4.609 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -19.218 -5.891 -4.240 1.00 0.00 H new ATOM 1396 N GLU A 95 -19.175 -3.517 -9.254 1.00 0.00 N ATOM 1397 CA GLU A 95 -19.746 -2.451 -10.060 1.00 0.00 C ATOM 1398 C GLU A 95 -19.272 -1.088 -9.551 1.00 0.00 C ATOM 1399 O GLU A 95 -20.087 -0.222 -9.235 1.00 0.00 O ATOM 1400 CB GLU A 95 -21.273 -2.531 -10.074 1.00 0.00 C ATOM 1401 CG GLU A 95 -21.771 -3.319 -11.288 1.00 0.00 C ATOM 1402 CD GLU A 95 -23.011 -4.142 -10.936 1.00 0.00 C ATOM 1403 OE1 GLU A 95 -24.033 -3.510 -10.591 1.00 0.00 O ATOM 1404 OE2 GLU A 95 -22.910 -5.385 -11.021 1.00 0.00 O ATOM 0 H GLU A 95 -18.478 -4.088 -9.732 1.00 0.00 H new ATOM 0 HA GLU A 95 -19.400 -2.574 -11.086 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -21.624 -3.007 -9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -21.693 -1.525 -10.092 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -22.005 -2.632 -12.101 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -20.981 -3.980 -11.646 1.00 0.00 H new ATOM 1411 N SER A 96 -17.957 -0.940 -9.486 1.00 0.00 N ATOM 1412 CA SER A 96 -17.366 0.303 -9.021 1.00 0.00 C ATOM 1413 C SER A 96 -15.987 0.496 -9.655 1.00 0.00 C ATOM 1414 O SER A 96 -15.608 -0.244 -10.561 1.00 0.00 O ATOM 1415 CB SER A 96 -17.256 0.322 -7.495 1.00 0.00 C ATOM 1416 OG SER A 96 -16.632 -0.855 -6.989 1.00 0.00 O ATOM 0 H SER A 96 -17.284 -1.661 -9.748 1.00 0.00 H new ATOM 0 HA SER A 96 -18.015 1.125 -9.322 1.00 0.00 H new ATOM 0 HB2 SER A 96 -16.685 1.197 -7.184 1.00 0.00 H new ATOM 0 HB3 SER A 96 -18.251 0.420 -7.061 1.00 0.00 H new ATOM 0 HG SER A 96 -17.265 -1.343 -6.422 1.00 0.00 H new ATOM 1422 N VAL A 97 -15.275 1.495 -9.154 1.00 0.00 N ATOM 1423 CA VAL A 97 -13.947 1.795 -9.660 1.00 0.00 C ATOM 1424 C VAL A 97 -13.009 2.074 -8.485 1.00 0.00 C ATOM 1425 O VAL A 97 -13.042 3.157 -7.902 1.00 0.00 O ATOM 1426 CB VAL A 97 -14.017 2.954 -10.657 1.00 0.00 C ATOM 1427 CG1 VAL A 97 -12.621 3.331 -11.158 1.00 0.00 C ATOM 1428 CG2 VAL A 97 -14.946 2.617 -11.825 1.00 0.00 C ATOM 0 H VAL A 97 -15.593 2.107 -8.403 1.00 0.00 H new ATOM 0 HA VAL A 97 -13.543 0.940 -10.202 1.00 0.00 H new ATOM 0 HB VAL A 97 -14.432 3.818 -10.138 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -12.699 4.157 -11.865 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.001 3.633 -10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -12.168 2.472 -11.652 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -14.978 3.457 -12.519 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.574 1.733 -12.343 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -15.949 2.420 -11.447 1.00 0.00 H new ATOM 1438 N TYR A 98 -12.193 1.078 -8.170 1.00 0.00 N ATOM 1439 CA TYR A 98 -11.247 1.203 -7.074 1.00 0.00 C ATOM 1440 C TYR A 98 -9.865 1.610 -7.587 1.00 0.00 C ATOM 1441 O TYR A 98 -9.418 1.127 -8.627 1.00 0.00 O ATOM 1442 CB TYR A 98 -11.154 -0.186 -6.438 1.00 0.00 C ATOM 1443 CG TYR A 98 -12.278 -0.493 -5.447 1.00 0.00 C ATOM 1444 CD1 TYR A 98 -13.467 -1.031 -5.896 1.00 0.00 C ATOM 1445 CD2 TYR A 98 -12.103 -0.231 -4.103 1.00 0.00 C ATOM 1446 CE1 TYR A 98 -14.525 -1.320 -4.963 1.00 0.00 C ATOM 1447 CE2 TYR A 98 -13.161 -0.520 -3.170 1.00 0.00 C ATOM 1448 CZ TYR A 98 -14.320 -1.050 -3.646 1.00 0.00 C ATOM 1449 OH TYR A 98 -15.319 -1.323 -2.764 1.00 0.00 O ATOM 0 H TYR A 98 -12.168 0.181 -8.655 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.576 1.965 -6.368 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -11.164 -0.937 -7.228 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.197 -0.276 -5.925 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -13.604 -1.235 -6.948 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -11.173 0.191 -3.751 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -15.460 -1.742 -5.301 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -13.037 -0.320 -2.116 1.00 0.00 H new ATOM 0 HH TYR A 98 -15.032 -1.080 -1.859 1.00 0.00 H new ATOM 1459 N LEU A 99 -9.226 2.493 -6.835 1.00 0.00 N ATOM 1460 CA LEU A 99 -7.903 2.970 -7.200 1.00 0.00 C ATOM 1461 C LEU A 99 -6.868 2.372 -6.245 1.00 0.00 C ATOM 1462 O LEU A 99 -7.047 2.408 -5.029 1.00 0.00 O ATOM 1463 CB LEU A 99 -7.881 4.499 -7.252 1.00 0.00 C ATOM 1464 CG LEU A 99 -6.497 5.152 -7.207 1.00 0.00 C ATOM 1465 CD1 LEU A 99 -5.831 4.930 -5.848 1.00 0.00 C ATOM 1466 CD2 LEU A 99 -5.622 4.661 -8.362 1.00 0.00 C ATOM 0 H LEU A 99 -9.600 2.891 -5.974 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.641 2.636 -8.204 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.382 4.819 -8.165 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.468 4.880 -6.416 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.622 6.228 -7.332 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.849 5.404 -5.842 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.449 5.367 -5.064 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.719 3.861 -5.668 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.644 5.140 -8.307 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.501 3.580 -8.293 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.097 4.913 -9.310 1.00 0.00 H new ATOM 1478 N PHE A 100 -5.808 1.837 -6.832 1.00 0.00 N ATOM 1479 CA PHE A 100 -4.744 1.232 -6.049 1.00 0.00 C ATOM 1480 C PHE A 100 -3.468 2.073 -6.116 1.00 0.00 C ATOM 1481 O PHE A 100 -2.853 2.193 -7.175 1.00 0.00 O ATOM 1482 CB PHE A 100 -4.466 -0.143 -6.658 1.00 0.00 C ATOM 1483 CG PHE A 100 -5.465 -1.223 -6.237 1.00 0.00 C ATOM 1484 CD1 PHE A 100 -5.659 -1.493 -4.918 1.00 0.00 C ATOM 1485 CD2 PHE A 100 -6.159 -1.913 -7.181 1.00 0.00 C ATOM 1486 CE1 PHE A 100 -6.586 -2.495 -4.527 1.00 0.00 C ATOM 1487 CE2 PHE A 100 -7.086 -2.915 -6.790 1.00 0.00 C ATOM 1488 CZ PHE A 100 -7.280 -3.185 -5.472 1.00 0.00 C ATOM 0 H PHE A 100 -5.663 1.810 -7.841 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.046 1.161 -5.004 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.476 -0.057 -7.745 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.463 -0.459 -6.373 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.108 -0.945 -4.168 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -6.005 -1.699 -8.228 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -6.740 -2.709 -3.480 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.637 -3.463 -7.540 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.985 -3.947 -5.175 1.00 0.00 H new ATOM 1498 N ARG A 101 -3.106 2.635 -4.971 1.00 0.00 N ATOM 1499 CA ARG A 101 -1.914 3.461 -4.887 1.00 0.00 C ATOM 1500 C ARG A 101 -0.738 2.643 -4.350 1.00 0.00 C ATOM 1501 O ARG A 101 -0.715 2.281 -3.174 1.00 0.00 O ATOM 1502 CB ARG A 101 -2.145 4.669 -3.976 1.00 0.00 C ATOM 1503 CG ARG A 101 -1.420 5.906 -4.511 1.00 0.00 C ATOM 1504 CD ARG A 101 -2.346 7.124 -4.516 1.00 0.00 C ATOM 1505 NE ARG A 101 -1.621 8.309 -5.025 1.00 0.00 N ATOM 1506 CZ ARG A 101 -0.660 8.951 -4.346 1.00 0.00 C ATOM 1507 NH1 ARG A 101 -0.303 8.526 -3.127 1.00 0.00 N ATOM 1508 NH2 ARG A 101 -0.056 10.018 -4.887 1.00 0.00 N ATOM 0 H ARG A 101 -3.618 2.534 -4.094 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.685 3.816 -5.892 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.213 4.873 -3.901 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.792 4.443 -2.970 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.544 6.113 -3.896 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.061 5.713 -5.522 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.218 6.926 -5.139 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.712 7.317 -3.508 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.868 8.659 -5.951 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.762 7.714 -2.715 1.00 0.00 H new ATOM 0 HH12 ARG A 101 0.428 9.015 -2.610 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -0.328 10.342 -5.815 1.00 0.00 H new ATOM 0 HH22 ARG A 101 0.675 10.507 -4.370 1.00 0.00 H new ATOM 1522 N ILE A 102 0.209 2.376 -5.237 1.00 0.00 N ATOM 1523 CA ILE A 102 1.385 1.607 -4.866 1.00 0.00 C ATOM 1524 C ILE A 102 2.534 2.564 -4.542 1.00 0.00 C ATOM 1525 O ILE A 102 2.771 3.525 -5.272 1.00 0.00 O ATOM 1526 CB ILE A 102 1.724 0.588 -5.956 1.00 0.00 C ATOM 1527 CG1 ILE A 102 0.644 -0.492 -6.051 1.00 0.00 C ATOM 1528 CG2 ILE A 102 3.115 -0.010 -5.735 1.00 0.00 C ATOM 1529 CD1 ILE A 102 0.551 -1.051 -7.473 1.00 0.00 C ATOM 0 H ILE A 102 0.186 2.678 -6.211 1.00 0.00 H new ATOM 0 HA ILE A 102 1.190 1.025 -3.965 1.00 0.00 H new ATOM 0 HB ILE A 102 1.746 1.107 -6.914 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.869 -1.299 -5.353 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.319 -0.075 -5.757 1.00 0.00 H new ATOM 0 HG21 ILE A 102 3.331 -0.731 -6.524 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.860 0.785 -5.756 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.146 -0.511 -4.767 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.224 -1.817 -7.513 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.302 -0.246 -8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.509 -1.489 -7.755 1.00 0.00 H new ATOM 1541 N THR A 103 3.215 2.269 -3.445 1.00 0.00 N ATOM 1542 CA THR A 103 4.333 3.092 -3.014 1.00 0.00 C ATOM 1543 C THR A 103 5.382 2.236 -2.301 1.00 0.00 C ATOM 1544 O THR A 103 5.052 1.209 -1.710 1.00 0.00 O ATOM 1545 CB THR A 103 3.780 4.224 -2.146 1.00 0.00 C ATOM 1546 OG1 THR A 103 2.620 4.664 -2.847 1.00 0.00 O ATOM 1547 CG2 THR A 103 4.694 5.451 -2.131 1.00 0.00 C ATOM 0 H THR A 103 3.015 1.472 -2.841 1.00 0.00 H new ATOM 0 HA THR A 103 4.847 3.538 -3.865 1.00 0.00 H new ATOM 0 HB THR A 103 3.639 3.864 -1.127 1.00 0.00 H new ATOM 0 HG1 THR A 103 1.840 4.155 -2.541 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.255 6.224 -1.501 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.671 5.172 -1.736 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.808 5.832 -3.146 1.00 0.00 H new ATOM 1555 N ALA A 104 6.624 2.691 -2.381 1.00 0.00 N ATOM 1556 CA ALA A 104 7.723 1.979 -1.750 1.00 0.00 C ATOM 1557 C ALA A 104 8.180 2.751 -0.511 1.00 0.00 C ATOM 1558 O ALA A 104 7.993 3.964 -0.427 1.00 0.00 O ATOM 1559 CB ALA A 104 8.852 1.783 -2.764 1.00 0.00 C ATOM 0 H ALA A 104 6.894 3.543 -2.873 1.00 0.00 H new ATOM 0 HA ALA A 104 7.403 0.990 -1.423 1.00 0.00 H new ATOM 0 HB1 ALA A 104 9.677 1.249 -2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.484 1.205 -3.612 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.201 2.755 -3.112 1.00 0.00 H new ATOM 1565 N GLN A 105 8.770 2.016 0.420 1.00 0.00 N ATOM 1566 CA GLN A 105 9.255 2.616 1.652 1.00 0.00 C ATOM 1567 C GLN A 105 10.780 2.513 1.727 1.00 0.00 C ATOM 1568 O GLN A 105 11.337 1.421 1.635 1.00 0.00 O ATOM 1569 CB GLN A 105 8.600 1.968 2.873 1.00 0.00 C ATOM 1570 CG GLN A 105 9.202 2.510 4.171 1.00 0.00 C ATOM 1571 CD GLN A 105 8.814 1.634 5.363 1.00 0.00 C ATOM 1572 OE1 GLN A 105 8.886 0.417 5.322 1.00 0.00 O ATOM 1573 NE2 GLN A 105 8.400 2.319 6.426 1.00 0.00 N ATOM 0 H GLN A 105 8.923 1.010 0.346 1.00 0.00 H new ATOM 0 HA GLN A 105 8.981 3.671 1.652 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.527 2.159 2.858 1.00 0.00 H new ATOM 0 HB3 GLN A 105 8.732 0.887 2.830 1.00 0.00 H new ATOM 0 HG2 GLN A 105 10.288 2.551 4.083 1.00 0.00 H new ATOM 0 HG3 GLN A 105 8.857 3.531 4.338 1.00 0.00 H new ATOM 0 HE21 GLN A 105 8.364 3.338 6.394 1.00 0.00 H new ATOM 0 HE22 GLN A 105 8.119 1.825 7.273 1.00 0.00 H new ATOM 1582 N THR A 106 11.411 3.666 1.895 1.00 0.00 N ATOM 1583 CA THR A 106 12.860 3.719 1.984 1.00 0.00 C ATOM 1584 C THR A 106 13.290 4.370 3.301 1.00 0.00 C ATOM 1585 O THR A 106 12.449 4.730 4.123 1.00 0.00 O ATOM 1586 CB THR A 106 13.384 4.450 0.746 1.00 0.00 C ATOM 1587 OG1 THR A 106 12.412 5.464 0.505 1.00 0.00 O ATOM 1588 CG2 THR A 106 13.335 3.580 -0.511 1.00 0.00 C ATOM 0 H THR A 106 10.945 4.570 1.972 1.00 0.00 H new ATOM 0 HA THR A 106 13.292 2.718 1.995 1.00 0.00 H new ATOM 0 HB THR A 106 14.409 4.775 0.923 1.00 0.00 H new ATOM 0 HG1 THR A 106 11.641 5.075 0.041 1.00 0.00 H new ATOM 0 HG21 THR A 106 13.718 4.146 -1.360 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.947 2.691 -0.362 1.00 0.00 H new ATOM 0 HG23 THR A 106 12.305 3.283 -0.708 1.00 0.00 H new ATOM 1596 N ARG A 107 14.599 4.501 3.460 1.00 0.00 N ATOM 1597 CA ARG A 107 15.150 5.102 4.662 1.00 0.00 C ATOM 1598 C ARG A 107 14.897 6.611 4.665 1.00 0.00 C ATOM 1599 O ARG A 107 15.181 7.290 5.651 1.00 0.00 O ATOM 1600 CB ARG A 107 16.654 4.844 4.767 1.00 0.00 C ATOM 1601 CG ARG A 107 17.431 5.721 3.782 1.00 0.00 C ATOM 1602 CD ARG A 107 18.940 5.545 3.965 1.00 0.00 C ATOM 1603 NE ARG A 107 19.491 4.724 2.864 1.00 0.00 N ATOM 1604 CZ ARG A 107 20.791 4.672 2.544 1.00 0.00 C ATOM 1605 NH1 ARG A 107 21.682 5.392 3.239 1.00 0.00 N ATOM 1606 NH2 ARG A 107 21.201 3.899 1.528 1.00 0.00 N ATOM 0 H ARG A 107 15.294 4.201 2.776 1.00 0.00 H new ATOM 0 HA ARG A 107 14.654 4.645 5.518 1.00 0.00 H new ATOM 0 HB2 ARG A 107 16.991 5.046 5.784 1.00 0.00 H new ATOM 0 HB3 ARG A 107 16.861 3.793 4.565 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.152 5.462 2.761 1.00 0.00 H new ATOM 0 HG3 ARG A 107 17.162 6.767 3.930 1.00 0.00 H new ATOM 0 HD2 ARG A 107 19.429 6.519 3.983 1.00 0.00 H new ATOM 0 HD3 ARG A 107 19.145 5.068 4.923 1.00 0.00 H new ATOM 0 HE ARG A 107 18.840 4.163 2.314 1.00 0.00 H new ATOM 0 HH11 ARG A 107 21.371 5.980 4.012 1.00 0.00 H new ATOM 0 HH12 ARG A 107 22.672 5.352 2.995 1.00 0.00 H new ATOM 0 HH21 ARG A 107 20.523 3.351 0.999 1.00 0.00 H new ATOM 0 HH22 ARG A 107 22.191 3.859 1.284 1.00 0.00 H new ATOM 1620 N LYS A 108 14.366 7.092 3.551 1.00 0.00 N ATOM 1621 CA LYS A 108 14.071 8.508 3.413 1.00 0.00 C ATOM 1622 C LYS A 108 12.584 8.745 3.683 1.00 0.00 C ATOM 1623 O LYS A 108 12.214 9.725 4.327 1.00 0.00 O ATOM 1624 CB LYS A 108 14.538 9.022 2.050 1.00 0.00 C ATOM 1625 CG LYS A 108 16.030 8.753 1.843 1.00 0.00 C ATOM 1626 CD LYS A 108 16.862 9.396 2.954 1.00 0.00 C ATOM 1627 CE LYS A 108 16.412 10.835 3.213 1.00 0.00 C ATOM 1628 NZ LYS A 108 17.508 11.619 3.825 1.00 0.00 N ATOM 0 H LYS A 108 14.132 6.526 2.735 1.00 0.00 H new ATOM 0 HA LYS A 108 14.625 9.086 4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.965 8.538 1.259 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.344 10.092 1.975 1.00 0.00 H new ATOM 0 HG2 LYS A 108 16.210 7.678 1.824 1.00 0.00 H new ATOM 0 HG3 LYS A 108 16.343 9.146 0.876 1.00 0.00 H new ATOM 0 HD2 LYS A 108 16.767 8.811 3.869 1.00 0.00 H new ATOM 0 HD3 LYS A 108 17.916 9.385 2.677 1.00 0.00 H new ATOM 0 HE2 LYS A 108 16.103 11.300 2.277 1.00 0.00 H new ATOM 0 HE3 LYS A 108 15.543 10.838 3.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 17.186 12.593 3.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 17.784 11.184 4.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 18.326 11.632 3.183 1.00 0.00 H new ATOM 1642 N GLY A 109 11.771 7.829 3.176 1.00 0.00 N ATOM 1643 CA GLY A 109 10.332 7.925 3.355 1.00 0.00 C ATOM 1644 C GLY A 109 9.590 7.221 2.217 1.00 0.00 C ATOM 1645 O GLY A 109 10.072 6.225 1.680 1.00 0.00 O ATOM 0 H GLY A 109 12.081 7.017 2.642 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.050 7.479 4.309 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.036 8.973 3.393 1.00 0.00 H new ATOM 1649 N TRP A 110 8.430 7.767 1.882 1.00 0.00 N ATOM 1650 CA TRP A 110 7.617 7.204 0.818 1.00 0.00 C ATOM 1651 C TRP A 110 7.742 8.115 -0.405 1.00 0.00 C ATOM 1652 O TRP A 110 7.393 9.293 -0.343 1.00 0.00 O ATOM 1653 CB TRP A 110 6.170 7.012 1.276 1.00 0.00 C ATOM 1654 CG TRP A 110 6.003 5.984 2.396 1.00 0.00 C ATOM 1655 CD1 TRP A 110 6.084 6.184 3.719 1.00 0.00 C ATOM 1656 CD2 TRP A 110 5.721 4.577 2.237 1.00 0.00 C ATOM 1657 NE1 TRP A 110 5.876 5.014 4.421 1.00 0.00 N ATOM 1658 CE2 TRP A 110 5.648 4.006 3.491 1.00 0.00 C ATOM 1659 CE3 TRP A 110 5.534 3.813 1.072 1.00 0.00 C ATOM 1660 CZ2 TRP A 110 5.387 2.647 3.700 1.00 0.00 C ATOM 1661 CZ3 TRP A 110 5.274 2.456 1.298 1.00 0.00 C ATOM 1662 CH2 TRP A 110 5.197 1.866 2.554 1.00 0.00 C ATOM 0 H TRP A 110 8.034 8.594 2.329 1.00 0.00 H new ATOM 0 HA TRP A 110 7.970 6.209 0.548 1.00 0.00 H new ATOM 0 HB2 TRP A 110 5.777 7.970 1.615 1.00 0.00 H new ATOM 0 HB3 TRP A 110 5.567 6.704 0.422 1.00 0.00 H new ATOM 0 HD1 TRP A 110 6.287 7.140 4.178 1.00 0.00 H new ATOM 0 HE1 TRP A 110 5.887 4.908 5.435 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.587 4.239 0.081 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 5.335 2.224 4.692 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 5.123 1.823 0.436 1.00 0.00 H new ATOM 0 HH2 TRP A 110 4.991 0.810 2.645 1.00 0.00 H new ATOM 1673 N GLY A 111 8.240 7.535 -1.487 1.00 0.00 N ATOM 1674 CA GLY A 111 8.414 8.280 -2.722 1.00 0.00 C ATOM 1675 C GLY A 111 7.112 8.326 -3.523 1.00 0.00 C ATOM 1676 O GLY A 111 6.028 8.176 -2.962 1.00 0.00 O ATOM 0 H GLY A 111 8.529 6.558 -1.534 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.742 9.295 -2.496 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.198 7.818 -3.322 1.00 0.00 H new ATOM 1680 N GLU A 112 7.261 8.535 -4.823 1.00 0.00 N ATOM 1681 CA GLU A 112 6.110 8.603 -5.708 1.00 0.00 C ATOM 1682 C GLU A 112 5.166 7.429 -5.441 1.00 0.00 C ATOM 1683 O GLU A 112 5.533 6.477 -4.754 1.00 0.00 O ATOM 1684 CB GLU A 112 6.546 8.634 -7.174 1.00 0.00 C ATOM 1685 CG GLU A 112 6.110 9.936 -7.848 1.00 0.00 C ATOM 1686 CD GLU A 112 7.260 10.944 -7.890 1.00 0.00 C ATOM 1687 OE1 GLU A 112 8.406 10.489 -8.096 1.00 0.00 O ATOM 1688 OE2 GLU A 112 6.968 12.147 -7.716 1.00 0.00 O ATOM 0 H GLU A 112 8.162 8.660 -5.285 1.00 0.00 H new ATOM 0 HA GLU A 112 5.573 9.529 -5.504 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.629 8.533 -7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.115 7.784 -7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.767 9.728 -8.862 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.266 10.364 -7.308 1.00 0.00 H new ATOM 1695 N ALA A 113 3.969 7.535 -5.999 1.00 0.00 N ATOM 1696 CA ALA A 113 2.970 6.494 -5.830 1.00 0.00 C ATOM 1697 C ALA A 113 2.239 6.274 -7.156 1.00 0.00 C ATOM 1698 O ALA A 113 1.711 7.219 -7.741 1.00 0.00 O ATOM 1699 CB ALA A 113 2.018 6.879 -4.696 1.00 0.00 C ATOM 0 H ALA A 113 3.669 8.326 -6.569 1.00 0.00 H new ATOM 0 HA ALA A 113 3.442 5.551 -5.554 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.268 6.098 -4.569 1.00 0.00 H new ATOM 0 HB2 ALA A 113 2.582 6.994 -3.771 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.524 7.820 -4.939 1.00 0.00 H new ATOM 1705 N ALA A 114 2.232 5.023 -7.592 1.00 0.00 N ATOM 1706 CA ALA A 114 1.575 4.668 -8.838 1.00 0.00 C ATOM 1707 C ALA A 114 0.106 4.343 -8.560 1.00 0.00 C ATOM 1708 O ALA A 114 -0.197 3.435 -7.787 1.00 0.00 O ATOM 1709 CB ALA A 114 2.317 3.501 -9.492 1.00 0.00 C ATOM 0 H ALA A 114 2.671 4.242 -7.104 1.00 0.00 H new ATOM 0 HA ALA A 114 1.601 5.504 -9.538 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.824 3.235 -10.427 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.347 3.793 -9.695 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.309 2.643 -8.820 1.00 0.00 H new ATOM 1715 N GLU A 115 -0.768 5.102 -9.205 1.00 0.00 N ATOM 1716 CA GLU A 115 -2.198 4.906 -9.037 1.00 0.00 C ATOM 1717 C GLU A 115 -2.752 4.045 -10.174 1.00 0.00 C ATOM 1718 O GLU A 115 -2.519 4.333 -11.346 1.00 0.00 O ATOM 1719 CB GLU A 115 -2.929 6.247 -8.958 1.00 0.00 C ATOM 1720 CG GLU A 115 -3.004 6.746 -7.514 1.00 0.00 C ATOM 1721 CD GLU A 115 -3.849 8.019 -7.416 1.00 0.00 C ATOM 1722 OE1 GLU A 115 -4.749 8.169 -8.271 1.00 0.00 O ATOM 1723 OE2 GLU A 115 -3.575 8.812 -6.490 1.00 0.00 O ATOM 0 H GLU A 115 -0.513 5.854 -9.845 1.00 0.00 H new ATOM 0 HA GLU A 115 -2.366 4.382 -8.096 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.413 6.983 -9.575 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.936 6.141 -9.363 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -3.433 5.971 -6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -1.999 6.943 -7.141 1.00 0.00 H new ATOM 1730 N ALA A 116 -3.476 3.005 -9.786 1.00 0.00 N ATOM 1731 CA ALA A 116 -4.066 2.100 -10.758 1.00 0.00 C ATOM 1732 C ALA A 116 -5.535 1.862 -10.401 1.00 0.00 C ATOM 1733 O ALA A 116 -5.843 1.392 -9.307 1.00 0.00 O ATOM 1734 CB ALA A 116 -3.259 0.801 -10.802 1.00 0.00 C ATOM 0 H ALA A 116 -3.667 2.769 -8.812 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.036 2.536 -11.756 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.702 0.122 -11.531 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -2.231 1.021 -11.089 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.269 0.333 -9.818 1.00 0.00 H new ATOM 1740 N LEU A 117 -6.402 2.197 -11.345 1.00 0.00 N ATOM 1741 CA LEU A 117 -7.831 2.025 -11.144 1.00 0.00 C ATOM 1742 C LEU A 117 -8.262 0.671 -11.710 1.00 0.00 C ATOM 1743 O LEU A 117 -7.757 0.237 -12.745 1.00 0.00 O ATOM 1744 CB LEU A 117 -8.600 3.210 -11.731 1.00 0.00 C ATOM 1745 CG LEU A 117 -8.481 4.532 -10.968 1.00 0.00 C ATOM 1746 CD1 LEU A 117 -8.062 5.668 -11.902 1.00 0.00 C ATOM 1747 CD2 LEU A 117 -9.776 4.852 -10.220 1.00 0.00 C ATOM 0 H LEU A 117 -6.143 2.587 -12.251 1.00 0.00 H new ATOM 0 HA LEU A 117 -8.068 2.016 -10.080 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -8.256 3.371 -12.753 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.655 2.940 -11.789 1.00 0.00 H new ATOM 0 HG LEU A 117 -7.696 4.425 -10.220 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -7.985 6.596 -11.335 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.096 5.434 -12.348 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -8.807 5.785 -12.689 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -9.664 5.796 -9.687 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.597 4.933 -10.932 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.991 4.056 -9.507 1.00 0.00 H new ATOM 1759 N VAL A 118 -9.192 0.041 -11.007 1.00 0.00 N ATOM 1760 CA VAL A 118 -9.697 -1.255 -11.426 1.00 0.00 C ATOM 1761 C VAL A 118 -11.162 -1.388 -11.006 1.00 0.00 C ATOM 1762 O VAL A 118 -11.489 -1.243 -9.829 1.00 0.00 O ATOM 1763 CB VAL A 118 -8.811 -2.369 -10.865 1.00 0.00 C ATOM 1764 CG1 VAL A 118 -8.793 -2.336 -9.335 1.00 0.00 C ATOM 1765 CG2 VAL A 118 -9.260 -3.739 -11.379 1.00 0.00 C ATOM 0 H VAL A 118 -9.609 0.404 -10.150 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.661 -1.345 -12.512 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.794 -2.197 -11.216 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.156 -3.138 -8.961 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.404 -1.376 -8.996 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -9.806 -2.471 -8.956 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.613 -4.513 -10.965 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -10.289 -3.923 -11.072 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -9.197 -3.758 -12.467 1.00 0.00 H new ATOM 1775 N VAL A 119 -12.005 -1.661 -11.991 1.00 0.00 N ATOM 1776 CA VAL A 119 -13.427 -1.814 -11.738 1.00 0.00 C ATOM 1777 C VAL A 119 -13.697 -3.221 -11.201 1.00 0.00 C ATOM 1778 O VAL A 119 -12.960 -4.158 -11.507 1.00 0.00 O ATOM 1779 CB VAL A 119 -14.222 -1.496 -13.006 1.00 0.00 C ATOM 1780 CG1 VAL A 119 -15.610 -2.138 -12.959 1.00 0.00 C ATOM 1781 CG2 VAL A 119 -14.324 0.015 -13.224 1.00 0.00 C ATOM 0 H VAL A 119 -11.730 -1.780 -12.966 1.00 0.00 H new ATOM 0 HA VAL A 119 -13.757 -1.107 -10.977 1.00 0.00 H new ATOM 0 HB VAL A 119 -13.685 -1.922 -13.854 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -16.154 -1.896 -13.872 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -15.508 -3.220 -12.873 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -16.159 -1.756 -12.098 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -14.894 0.214 -14.132 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -14.827 0.472 -12.372 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -13.324 0.437 -13.324 1.00 0.00 H new ATOM 1791 N THR A 120 -14.754 -3.326 -10.409 1.00 0.00 N ATOM 1792 CA THR A 120 -15.130 -4.603 -9.827 1.00 0.00 C ATOM 1793 C THR A 120 -16.213 -5.276 -10.673 1.00 0.00 C ATOM 1794 O THR A 120 -17.341 -4.791 -10.744 1.00 0.00 O ATOM 1795 CB THR A 120 -15.556 -4.355 -8.379 1.00 0.00 C ATOM 1796 OG1 THR A 120 -16.555 -3.343 -8.479 1.00 0.00 O ATOM 1797 CG2 THR A 120 -14.450 -3.705 -7.546 1.00 0.00 C ATOM 0 H THR A 120 -15.362 -2.547 -10.157 1.00 0.00 H new ATOM 0 HA THR A 120 -14.290 -5.297 -9.819 1.00 0.00 H new ATOM 0 HB THR A 120 -15.848 -5.300 -7.920 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.486 -2.738 -7.711 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.805 -3.551 -6.527 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.575 -4.355 -7.531 1.00 0.00 H new ATOM 0 HG23 THR A 120 -14.180 -2.745 -7.985 1.00 0.00 H new ATOM 1805 N THR A 121 -15.832 -6.384 -11.292 1.00 0.00 N ATOM 1806 CA THR A 121 -16.756 -7.129 -12.129 1.00 0.00 C ATOM 1807 C THR A 121 -16.075 -8.376 -12.697 1.00 0.00 C ATOM 1808 O THR A 121 -14.861 -8.533 -12.578 1.00 0.00 O ATOM 1809 CB THR A 121 -17.285 -6.182 -13.208 1.00 0.00 C ATOM 1810 OG1 THR A 121 -17.982 -7.037 -14.110 1.00 0.00 O ATOM 1811 CG2 THR A 121 -16.165 -5.577 -14.058 1.00 0.00 C ATOM 0 H THR A 121 -14.896 -6.784 -11.230 1.00 0.00 H new ATOM 0 HA THR A 121 -17.605 -7.495 -11.552 1.00 0.00 H new ATOM 0 HB THR A 121 -17.857 -5.381 -12.739 1.00 0.00 H new ATOM 0 HG1 THR A 121 -18.359 -6.504 -14.841 1.00 0.00 H new ATOM 0 HG21 THR A 121 -16.595 -4.913 -14.808 1.00 0.00 H new ATOM 0 HG22 THR A 121 -15.488 -5.011 -13.418 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.613 -6.375 -14.554 1.00 0.00 H new ATOM 1819 N GLU A 122 -16.887 -9.231 -13.302 1.00 0.00 N ATOM 1820 CA GLU A 122 -16.378 -10.459 -13.888 1.00 0.00 C ATOM 1821 C GLU A 122 -16.258 -10.313 -15.406 1.00 0.00 C ATOM 1822 O GLU A 122 -17.264 -10.308 -16.114 1.00 0.00 O ATOM 1823 CB GLU A 122 -17.264 -11.651 -13.520 1.00 0.00 C ATOM 1824 CG GLU A 122 -16.839 -12.257 -12.181 1.00 0.00 C ATOM 1825 CD GLU A 122 -16.581 -13.759 -12.317 1.00 0.00 C ATOM 1826 OE1 GLU A 122 -15.628 -14.108 -13.047 1.00 0.00 O ATOM 1827 OE2 GLU A 122 -17.343 -14.525 -11.688 1.00 0.00 O ATOM 0 H GLU A 122 -17.894 -9.097 -13.399 1.00 0.00 H new ATOM 0 HA GLU A 122 -15.385 -10.648 -13.481 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -18.305 -11.332 -13.465 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -17.204 -12.408 -14.302 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -15.937 -11.760 -11.823 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.616 -12.084 -11.436 1.00 0.00 H new ATOM 1834 N LYS A 123 -15.019 -10.198 -15.862 1.00 0.00 N ATOM 1835 CA LYS A 123 -14.755 -10.052 -17.283 1.00 0.00 C ATOM 1836 C LYS A 123 -14.055 -11.310 -17.800 1.00 0.00 C ATOM 1837 O LYS A 123 -12.890 -11.549 -17.487 1.00 0.00 O ATOM 1838 CB LYS A 123 -13.979 -8.761 -17.555 1.00 0.00 C ATOM 1839 CG LYS A 123 -13.229 -8.842 -18.885 1.00 0.00 C ATOM 1840 CD LYS A 123 -13.420 -7.562 -19.701 1.00 0.00 C ATOM 1841 CE LYS A 123 -14.182 -7.846 -20.997 1.00 0.00 C ATOM 1842 NZ LYS A 123 -14.636 -6.582 -21.619 1.00 0.00 N ATOM 0 H LYS A 123 -14.187 -10.203 -15.272 1.00 0.00 H new ATOM 0 HA LYS A 123 -15.690 -9.957 -17.835 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -14.667 -7.916 -17.572 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -13.272 -8.580 -16.745 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -12.167 -9.004 -18.699 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -13.586 -9.699 -19.457 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -13.965 -6.827 -19.109 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -12.448 -7.127 -19.934 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -13.541 -8.390 -21.691 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -15.040 -8.485 -20.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -15.151 -6.793 -22.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -15.264 -6.078 -20.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -13.812 -5.986 -21.836 1.00 0.00 H new ATOM 1856 N ARG A 124 -14.796 -12.082 -18.581 1.00 0.00 N ATOM 1857 CA ARG A 124 -14.261 -13.311 -19.144 1.00 0.00 C ATOM 1858 C ARG A 124 -13.547 -13.022 -20.466 1.00 0.00 C ATOM 1859 O ARG A 124 -14.192 -12.760 -21.480 1.00 0.00 O ATOM 1860 CB ARG A 124 -15.372 -14.335 -19.385 1.00 0.00 C ATOM 1861 CG ARG A 124 -14.789 -15.688 -19.798 1.00 0.00 C ATOM 1862 CD ARG A 124 -14.924 -16.712 -18.669 1.00 0.00 C ATOM 1863 NE ARG A 124 -13.791 -17.663 -18.710 1.00 0.00 N ATOM 1864 CZ ARG A 124 -13.563 -18.599 -17.778 1.00 0.00 C ATOM 1865 NH1 ARG A 124 -14.387 -18.715 -16.728 1.00 0.00 N ATOM 1866 NH2 ARG A 124 -12.509 -19.419 -17.897 1.00 0.00 N ATOM 0 H ARG A 124 -15.762 -11.881 -18.837 1.00 0.00 H new ATOM 0 HA ARG A 124 -13.552 -13.724 -18.427 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -15.966 -14.452 -18.479 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -16.044 -13.972 -20.162 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -15.302 -16.053 -20.688 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -13.738 -15.570 -20.062 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -14.947 -16.202 -17.706 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -15.866 -17.251 -18.767 1.00 0.00 H new ATOM 0 HE ARG A 124 -13.144 -17.603 -19.496 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -15.189 -18.091 -16.637 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -14.213 -19.428 -16.019 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -11.881 -19.330 -18.696 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -12.335 -20.132 -17.188 1.00 0.00 H new ATOM 1880 N SER A 125 -12.224 -13.079 -20.412 1.00 0.00 N ATOM 1881 CA SER A 125 -11.416 -12.827 -21.593 1.00 0.00 C ATOM 1882 C SER A 125 -10.010 -13.398 -21.395 1.00 0.00 C ATOM 1883 O SER A 125 -9.425 -13.260 -20.322 1.00 0.00 O ATOM 1884 CB SER A 125 -11.343 -11.331 -21.901 1.00 0.00 C ATOM 1885 OG SER A 125 -11.764 -11.038 -23.230 1.00 0.00 O ATOM 0 H SER A 125 -11.692 -13.296 -19.569 1.00 0.00 H new ATOM 0 HA SER A 125 -11.887 -13.322 -22.442 1.00 0.00 H new ATOM 0 HB2 SER A 125 -11.968 -10.785 -21.194 1.00 0.00 H new ATOM 0 HB3 SER A 125 -10.320 -10.981 -21.759 1.00 0.00 H new ATOM 0 HG SER A 125 -11.704 -10.072 -23.387 1.00 0.00 H new ATOM 1891 N GLY A 126 -9.508 -14.027 -22.448 1.00 0.00 N ATOM 1892 CA GLY A 126 -8.182 -14.619 -22.404 1.00 0.00 C ATOM 1893 C GLY A 126 -7.304 -14.081 -23.535 1.00 0.00 C ATOM 1894 O GLY A 126 -7.360 -14.577 -24.660 1.00 0.00 O ATOM 0 H GLY A 126 -9.996 -14.139 -23.337 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -7.715 -14.404 -21.443 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.261 -15.703 -22.484 1.00 0.00 H new ATOM 1898 N PRO A 127 -6.490 -13.047 -23.190 1.00 0.00 N ATOM 1899 CA PRO A 127 -5.601 -12.436 -24.163 1.00 0.00 C ATOM 1900 C PRO A 127 -4.396 -13.335 -24.445 1.00 0.00 C ATOM 1901 O PRO A 127 -4.261 -14.403 -23.849 1.00 0.00 O ATOM 1902 CB PRO A 127 -5.215 -11.097 -23.557 1.00 0.00 C ATOM 1903 CG PRO A 127 -5.525 -11.206 -22.073 1.00 0.00 C ATOM 1904 CD PRO A 127 -6.397 -12.434 -21.868 1.00 0.00 C ATOM 0 HA PRO A 127 -6.074 -12.296 -25.135 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -4.159 -10.884 -23.721 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -5.778 -10.284 -24.015 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -4.604 -11.291 -21.496 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -6.039 -10.310 -21.724 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -5.954 -13.118 -21.144 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -7.381 -12.162 -21.488 1.00 0.00 H new ATOM 1912 N SER A 128 -3.550 -12.870 -25.352 1.00 0.00 N ATOM 1913 CA SER A 128 -2.360 -13.619 -25.720 1.00 0.00 C ATOM 1914 C SER A 128 -1.526 -12.817 -26.720 1.00 0.00 C ATOM 1915 O SER A 128 -2.058 -12.288 -27.695 1.00 0.00 O ATOM 1916 CB SER A 128 -2.728 -14.983 -26.308 1.00 0.00 C ATOM 1917 OG SER A 128 -1.581 -15.803 -26.511 1.00 0.00 O ATOM 0 H SER A 128 -3.665 -11.984 -25.843 1.00 0.00 H new ATOM 0 HA SER A 128 -1.770 -13.789 -24.819 1.00 0.00 H new ATOM 0 HB2 SER A 128 -3.423 -15.491 -25.639 1.00 0.00 H new ATOM 0 HB3 SER A 128 -3.245 -14.841 -27.257 1.00 0.00 H new ATOM 0 HG SER A 128 -1.858 -16.665 -26.886 1.00 0.00 H new ATOM 1923 N SER A 129 -0.231 -12.753 -26.445 1.00 0.00 N ATOM 1924 CA SER A 129 0.682 -12.024 -27.308 1.00 0.00 C ATOM 1925 C SER A 129 0.099 -10.652 -27.648 1.00 0.00 C ATOM 1926 O SER A 129 -0.685 -10.522 -28.587 1.00 0.00 O ATOM 1927 CB SER A 129 0.974 -12.809 -28.589 1.00 0.00 C ATOM 1928 OG SER A 129 2.369 -12.873 -28.870 1.00 0.00 O ATOM 0 H SER A 129 0.207 -13.194 -25.636 1.00 0.00 H new ATOM 0 HA SER A 129 1.623 -11.889 -26.774 1.00 0.00 H new ATOM 0 HB2 SER A 129 0.577 -13.820 -28.493 1.00 0.00 H new ATOM 0 HB3 SER A 129 0.457 -12.341 -29.427 1.00 0.00 H new ATOM 0 HG SER A 129 2.514 -13.383 -29.694 1.00 0.00 H new ATOM 1934 N GLY A 130 0.503 -9.662 -26.866 1.00 0.00 N ATOM 1935 CA GLY A 130 0.030 -8.304 -27.073 1.00 0.00 C ATOM 1936 C GLY A 130 0.760 -7.323 -26.152 1.00 0.00 C ATOM 1937 O GLY A 130 0.476 -6.126 -26.165 1.00 0.00 O ATOM 0 H GLY A 130 1.153 -9.773 -26.088 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.184 -8.016 -28.113 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -1.043 -8.256 -26.885 1.00 0.00 H new TER 1941 GLY A 130