USER MOD reduce.3.24.130724 H: found=0, std=0, add=793, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 791 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.127 (180deg=-0.744) USER MOD Single : A 5 SER OG : rot 180:sc=-0.00168 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ -125:sc= -0.918 (180deg=-1.99!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.279 X(o=0.28,f=-0.02) USER MOD Single : A 24 LYS NZ :NH3+ 151:sc= -0.139 (180deg=-0.641) USER MOD Single : A 28 SER OG : rot 130:sc= -1.05 USER MOD Single : A 29 SER OG : rot 180:sc= 0.0755 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -164:sc=-0.00772 (180deg=-0.122) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 151:sc= 0.0643 (180deg=-1.73) USER MOD Single : A 45 ASN : amide:sc= -0.0716 K(o=-0.072,f=-0.59) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 MET CE :methyl -157:sc= -0.107 (180deg=-0.648) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -167:sc= -0.0589 (180deg=-0.301) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl 157:sc= -1.56 (180deg=-4.22!) USER MOD Single : A 78 SER OG : rot -121:sc= 0.617 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -154:sc= -0.135 (180deg=-0.757) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.895 K(o=-0.9,f=-3.5!) USER MOD Single : A 96 LYS NZ :NH3+ 155:sc= 0.512 (180deg=0.288) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.329 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.093 -0.001 -1.242 1.00 52.33 C ATOM 3 C MET A 1 2.522 -1.416 -1.616 1.00 33.10 C ATOM 4 O MET A 1 3.117 -2.128 -0.808 1.00 12.13 O ATOM 5 CB MET A 1 3.323 0.899 -1.110 1.00 51.32 C ATOM 6 CG MET A 1 3.022 2.253 -0.487 1.00 75.32 C ATOM 7 SD MET A 1 4.496 3.273 -0.296 1.00 53.24 S ATOM 8 CE MET A 1 4.027 4.287 1.103 1.00 15.44 C ATOM 0 H1 MET A 1 0.810 0.897 0.088 1.00 0.00 H new ATOM 0 H2 MET A 1 0.654 -0.791 -0.007 1.00 0.00 H new ATOM 0 H3 MET A 1 1.977 -0.105 0.806 1.00 0.00 H new ATOM 0 HA MET A 1 1.452 0.386 -2.034 1.00 52.33 H new ATOM 0 HB2 MET A 1 4.073 0.389 -0.506 1.00 51.32 H new ATOM 0 HB3 MET A 1 3.759 1.051 -2.097 1.00 51.32 H new ATOM 0 HG2 MET A 1 2.298 2.781 -1.107 1.00 75.32 H new ATOM 0 HG3 MET A 1 2.559 2.105 0.488 1.00 75.32 H new ATOM 0 HE1 MET A 1 4.839 4.973 1.344 1.00 15.44 H new ATOM 0 HE2 MET A 1 3.132 4.857 0.855 1.00 15.44 H new ATOM 0 HE3 MET A 1 3.824 3.649 1.963 1.00 15.44 H new ATOM 18 N ALA A 2 2.215 -1.817 -2.845 1.00 60.43 N ATOM 19 CA ALA A 2 2.570 -3.147 -3.326 1.00 5.22 C ATOM 20 C ALA A 2 4.079 -3.280 -3.508 1.00 54.53 C ATOM 21 O ALA A 2 4.831 -2.345 -3.237 1.00 42.11 O ATOM 22 CB ALA A 2 1.850 -3.446 -4.632 1.00 45.34 C ATOM 0 H ALA A 2 1.721 -1.240 -3.526 1.00 60.43 H new ATOM 0 HA ALA A 2 2.255 -3.873 -2.577 1.00 5.22 H new ATOM 0 HB1 ALA A 2 2.125 -4.442 -4.979 1.00 45.34 H new ATOM 0 HB2 ALA A 2 0.773 -3.402 -4.472 1.00 45.34 H new ATOM 0 HB3 ALA A 2 2.136 -2.709 -5.382 1.00 45.34 H new ATOM 28 N GLY A 3 4.514 -4.448 -3.969 1.00 71.33 N ATOM 29 CA GLY A 3 5.931 -4.682 -4.179 1.00 52.21 C ATOM 30 C GLY A 3 6.590 -5.353 -2.990 1.00 50.15 C ATOM 31 O GLY A 3 7.790 -5.197 -2.768 1.00 63.33 O ATOM 0 H GLY A 3 3.911 -5.237 -4.201 1.00 71.33 H new ATOM 0 HA2 GLY A 3 6.066 -5.304 -5.064 1.00 52.21 H new ATOM 0 HA3 GLY A 3 6.428 -3.732 -4.378 1.00 52.21 H new ATOM 35 N ALA A 4 5.803 -6.100 -2.223 1.00 61.24 N ATOM 36 CA ALA A 4 6.318 -6.797 -1.051 1.00 74.53 C ATOM 37 C ALA A 4 7.303 -7.890 -1.451 1.00 62.24 C ATOM 38 O ALA A 4 8.172 -8.273 -0.668 1.00 3.50 O ATOM 39 CB ALA A 4 5.172 -7.388 -0.243 1.00 13.20 C ATOM 0 H ALA A 4 4.807 -6.238 -2.392 1.00 61.24 H new ATOM 0 HA ALA A 4 6.849 -6.073 -0.433 1.00 74.53 H new ATOM 0 HB1 ALA A 4 5.571 -7.906 0.629 1.00 13.20 H new ATOM 0 HB2 ALA A 4 4.506 -6.589 0.082 1.00 13.20 H new ATOM 0 HB3 ALA A 4 4.617 -8.094 -0.861 1.00 13.20 H new ATOM 45 N SER A 5 7.162 -8.389 -2.675 1.00 75.50 N ATOM 46 CA SER A 5 8.037 -9.442 -3.177 1.00 51.03 C ATOM 47 C SER A 5 7.884 -10.716 -2.352 1.00 54.00 C ATOM 48 O SER A 5 8.807 -11.526 -2.263 1.00 15.11 O ATOM 49 CB SER A 5 9.494 -8.977 -3.153 1.00 23.23 C ATOM 50 OG SER A 5 9.594 -7.595 -3.451 1.00 21.51 O ATOM 0 H SER A 5 6.450 -8.081 -3.337 1.00 75.50 H new ATOM 0 HA SER A 5 7.749 -9.660 -4.205 1.00 51.03 H new ATOM 0 HB2 SER A 5 9.925 -9.172 -2.171 1.00 23.23 H new ATOM 0 HB3 SER A 5 10.074 -9.551 -3.876 1.00 23.23 H new ATOM 0 HG SER A 5 10.535 -7.323 -3.428 1.00 21.51 H new ATOM 56 N ASP A 6 6.711 -10.886 -1.750 1.00 45.24 N ATOM 57 CA ASP A 6 6.435 -12.061 -0.933 1.00 20.33 C ATOM 58 C ASP A 6 5.422 -12.973 -1.617 1.00 71.43 C ATOM 59 O ASP A 6 5.464 -14.194 -1.459 1.00 10.51 O ATOM 60 CB ASP A 6 5.914 -11.641 0.443 1.00 61.14 C ATOM 61 CG ASP A 6 7.030 -11.238 1.386 1.00 22.42 C ATOM 62 OD1 ASP A 6 8.064 -11.938 1.416 1.00 62.52 O ATOM 63 OD2 ASP A 6 6.870 -10.223 2.094 1.00 2.35 O ATOM 0 H ASP A 6 5.937 -10.225 -1.813 1.00 45.24 H new ATOM 0 HA ASP A 6 7.367 -12.613 -0.808 1.00 20.33 H new ATOM 0 HB2 ASP A 6 5.221 -10.807 0.327 1.00 61.14 H new ATOM 0 HB3 ASP A 6 5.351 -12.465 0.882 1.00 61.14 H new ATOM 68 N ARG A 7 4.512 -12.373 -2.377 1.00 72.24 N ATOM 69 CA ARG A 7 3.486 -13.131 -3.084 1.00 64.21 C ATOM 70 C ARG A 7 3.673 -13.021 -4.595 1.00 20.15 C ATOM 71 O ARG A 7 4.595 -12.358 -5.071 1.00 11.10 O ATOM 72 CB ARG A 7 2.094 -12.633 -2.694 1.00 13.21 C ATOM 73 CG ARG A 7 1.878 -12.542 -1.192 1.00 42.41 C ATOM 74 CD ARG A 7 0.598 -11.791 -0.858 1.00 23.55 C ATOM 75 NE ARG A 7 -0.576 -12.657 -0.921 1.00 71.33 N ATOM 76 CZ ARG A 7 -0.880 -13.553 0.011 1.00 32.02 C ATOM 77 NH1 ARG A 7 -0.101 -13.700 1.074 1.00 42.43 N ATOM 78 NH2 ARG A 7 -1.966 -14.304 -0.118 1.00 35.22 N ATOM 0 H ARG A 7 4.464 -11.364 -2.519 1.00 72.24 H new ATOM 0 HA ARG A 7 3.582 -14.179 -2.799 1.00 64.21 H new ATOM 0 HB2 ARG A 7 1.932 -11.650 -3.136 1.00 13.21 H new ATOM 0 HB3 ARG A 7 1.346 -13.301 -3.120 1.00 13.21 H new ATOM 0 HG2 ARG A 7 1.834 -13.545 -0.768 1.00 42.41 H new ATOM 0 HG3 ARG A 7 2.728 -12.038 -0.731 1.00 42.41 H new ATOM 0 HD2 ARG A 7 0.679 -11.362 0.141 1.00 23.55 H new ATOM 0 HD3 ARG A 7 0.473 -10.960 -1.552 1.00 23.55 H new ATOM 0 HE ARG A 7 -1.197 -12.569 -1.725 1.00 71.33 H new ATOM 0 HH11 ARG A 7 0.734 -13.124 1.178 1.00 42.43 H new ATOM 0 HH12 ARG A 7 -0.337 -14.389 1.788 1.00 42.43 H new ATOM 0 HH21 ARG A 7 -2.568 -14.194 -0.934 1.00 35.22 H new ATOM 0 HH22 ARG A 7 -2.198 -14.992 0.598 1.00 35.22 H new ATOM 92 N THR A 8 2.792 -13.676 -5.344 1.00 32.40 N ATOM 93 CA THR A 8 2.860 -13.654 -6.800 1.00 10.14 C ATOM 94 C THR A 8 2.290 -12.355 -7.357 1.00 11.53 C ATOM 95 O THR A 8 2.646 -11.929 -8.455 1.00 24.24 O ATOM 96 CB THR A 8 2.097 -14.842 -7.416 1.00 43.21 C ATOM 97 OG1 THR A 8 0.743 -14.849 -6.952 1.00 12.54 O ATOM 98 CG2 THR A 8 2.768 -16.160 -7.059 1.00 10.44 C ATOM 0 H THR A 8 2.022 -14.229 -4.966 1.00 32.40 H new ATOM 0 HA THR A 8 3.914 -13.730 -7.069 1.00 10.14 H new ATOM 0 HB THR A 8 2.108 -14.729 -8.500 1.00 43.21 H new ATOM 0 HG1 THR A 8 0.265 -15.606 -7.350 1.00 12.54 H new ATOM 0 HG21 THR A 8 2.211 -16.984 -7.505 1.00 10.44 H new ATOM 0 HG22 THR A 8 3.789 -16.163 -7.440 1.00 10.44 H new ATOM 0 HG23 THR A 8 2.785 -16.278 -5.976 1.00 10.44 H new ATOM 106 N GLY A 9 1.402 -11.727 -6.591 1.00 52.15 N ATOM 107 CA GLY A 9 0.797 -10.481 -7.026 1.00 21.31 C ATOM 108 C GLY A 9 0.150 -9.722 -5.885 1.00 0.13 C ATOM 109 O GLY A 9 -1.075 -9.671 -5.779 1.00 55.33 O ATOM 0 H GLY A 9 1.091 -12.059 -5.678 1.00 52.15 H new ATOM 0 HA2 GLY A 9 1.558 -9.854 -7.490 1.00 21.31 H new ATOM 0 HA3 GLY A 9 0.048 -10.691 -7.789 1.00 21.31 H new ATOM 113 N VAL A 10 0.975 -9.131 -5.026 1.00 30.32 N ATOM 114 CA VAL A 10 0.476 -8.371 -3.886 1.00 20.41 C ATOM 115 C VAL A 10 -0.326 -7.158 -4.343 1.00 31.22 C ATOM 116 O VAL A 10 0.174 -6.316 -5.089 1.00 13.12 O ATOM 117 CB VAL A 10 1.628 -7.900 -2.978 1.00 53.55 C ATOM 118 CG1 VAL A 10 1.088 -7.097 -1.804 1.00 61.51 C ATOM 119 CG2 VAL A 10 2.444 -9.088 -2.493 1.00 41.20 C ATOM 0 H VAL A 10 1.992 -9.164 -5.098 1.00 30.32 H new ATOM 0 HA VAL A 10 -0.173 -9.039 -3.319 1.00 20.41 H new ATOM 0 HB VAL A 10 2.284 -7.252 -3.559 1.00 53.55 H new ATOM 0 HG11 VAL A 10 1.916 -6.773 -1.174 1.00 61.51 H new ATOM 0 HG12 VAL A 10 0.552 -6.224 -2.176 1.00 61.51 H new ATOM 0 HG13 VAL A 10 0.409 -7.718 -1.220 1.00 61.51 H new ATOM 0 HG21 VAL A 10 3.253 -8.737 -1.853 1.00 41.20 H new ATOM 0 HG22 VAL A 10 1.802 -9.764 -1.928 1.00 41.20 H new ATOM 0 HG23 VAL A 10 2.862 -9.616 -3.350 1.00 41.20 H new ATOM 129 N ARG A 11 -1.573 -7.075 -3.890 1.00 22.21 N ATOM 130 CA ARG A 11 -2.445 -5.965 -4.253 1.00 12.12 C ATOM 131 C ARG A 11 -2.285 -4.805 -3.274 1.00 33.42 C ATOM 132 O ARG A 11 -1.830 -4.991 -2.145 1.00 72.31 O ATOM 133 CB ARG A 11 -3.904 -6.424 -4.283 1.00 13.43 C ATOM 134 CG ARG A 11 -4.787 -5.587 -5.194 1.00 52.01 C ATOM 135 CD ARG A 11 -4.448 -5.812 -6.659 1.00 64.41 C ATOM 136 NE ARG A 11 -5.266 -6.865 -7.255 1.00 20.00 N ATOM 137 CZ ARG A 11 -5.363 -7.068 -8.564 1.00 61.21 C ATOM 138 NH1 ARG A 11 -4.696 -6.295 -9.410 1.00 5.05 N ATOM 139 NH2 ARG A 11 -6.128 -8.047 -9.030 1.00 52.10 N ATOM 0 H ARG A 11 -2.002 -7.763 -3.271 1.00 22.21 H new ATOM 0 HA ARG A 11 -2.159 -5.621 -5.247 1.00 12.12 H new ATOM 0 HB2 ARG A 11 -3.942 -7.463 -4.609 1.00 13.43 H new ATOM 0 HB3 ARG A 11 -4.307 -6.392 -3.271 1.00 13.43 H new ATOM 0 HG2 ARG A 11 -5.833 -5.838 -5.019 1.00 52.01 H new ATOM 0 HG3 ARG A 11 -4.667 -4.532 -4.950 1.00 52.01 H new ATOM 0 HD2 ARG A 11 -4.593 -4.884 -7.211 1.00 64.41 H new ATOM 0 HD3 ARG A 11 -3.394 -6.076 -6.751 1.00 64.41 H new ATOM 0 HE ARG A 11 -5.792 -7.478 -6.632 1.00 20.00 H new ATOM 0 HH11 ARG A 11 -4.106 -5.542 -9.056 1.00 5.05 H new ATOM 0 HH12 ARG A 11 -4.773 -6.454 -10.415 1.00 5.05 H new ATOM 0 HH21 ARG A 11 -6.642 -8.644 -8.383 1.00 52.10 H new ATOM 0 HH22 ARG A 11 -6.202 -8.202 -10.035 1.00 52.10 H new ATOM 153 N ARG A 12 -2.662 -3.610 -3.714 1.00 40.55 N ATOM 154 CA ARG A 12 -2.559 -2.420 -2.878 1.00 43.21 C ATOM 155 C ARG A 12 -3.942 -1.879 -2.529 1.00 51.11 C ATOM 156 O ARG A 12 -4.916 -2.083 -3.254 1.00 13.51 O ATOM 157 CB ARG A 12 -1.742 -1.340 -3.589 1.00 44.34 C ATOM 158 CG ARG A 12 -2.348 -0.886 -4.907 1.00 53.11 C ATOM 159 CD ARG A 12 -1.846 -1.726 -6.071 1.00 21.45 C ATOM 160 NE ARG A 12 -0.702 -1.110 -6.737 1.00 61.21 N ATOM 161 CZ ARG A 12 -0.796 -0.043 -7.522 1.00 52.23 C ATOM 162 NH1 ARG A 12 -1.975 0.524 -7.738 1.00 34.25 N ATOM 163 NH2 ARG A 12 0.291 0.460 -8.094 1.00 13.24 N ATOM 0 H ARG A 12 -3.042 -3.440 -4.645 1.00 40.55 H new ATOM 0 HA ARG A 12 -2.053 -2.699 -1.954 1.00 43.21 H new ATOM 0 HB2 ARG A 12 -1.642 -0.478 -2.929 1.00 44.34 H new ATOM 0 HB3 ARG A 12 -0.737 -1.719 -3.773 1.00 44.34 H new ATOM 0 HG2 ARG A 12 -3.435 -0.953 -4.851 1.00 53.11 H new ATOM 0 HG3 ARG A 12 -2.101 0.162 -5.080 1.00 53.11 H new ATOM 0 HD2 ARG A 12 -1.566 -2.715 -5.710 1.00 21.45 H new ATOM 0 HD3 ARG A 12 -2.652 -1.866 -6.791 1.00 21.45 H new ATOM 0 HE ARG A 12 0.220 -1.522 -6.591 1.00 61.21 H new ATOM 0 HH11 ARG A 12 -2.813 0.141 -7.301 1.00 34.25 H new ATOM 0 HH12 ARG A 12 -2.044 1.343 -8.341 1.00 34.25 H new ATOM 0 HH21 ARG A 12 1.200 0.027 -7.931 1.00 13.24 H new ATOM 0 HH22 ARG A 12 0.217 1.280 -8.697 1.00 13.24 H new ATOM 177 N PRO A 13 -4.032 -1.173 -1.392 1.00 73.10 N ATOM 178 CA PRO A 13 -5.291 -0.588 -0.921 1.00 33.51 C ATOM 179 C PRO A 13 -5.753 0.573 -1.794 1.00 13.42 C ATOM 180 O PRO A 13 -6.880 1.052 -1.661 1.00 5.54 O ATOM 181 CB PRO A 13 -4.949 -0.096 0.487 1.00 4.03 C ATOM 182 CG PRO A 13 -3.478 0.139 0.459 1.00 22.10 C ATOM 183 CD PRO A 13 -2.912 -0.891 -0.479 1.00 61.10 C ATOM 0 HA PRO A 13 -6.110 -1.307 -0.948 1.00 33.51 H new ATOM 0 HB2 PRO A 13 -5.491 0.818 0.730 1.00 4.03 H new ATOM 0 HB3 PRO A 13 -5.217 -0.836 1.241 1.00 4.03 H new ATOM 0 HG2 PRO A 13 -3.250 1.148 0.114 1.00 22.10 H new ATOM 0 HG3 PRO A 13 -3.048 0.038 1.455 1.00 22.10 H new ATOM 0 HD2 PRO A 13 -2.042 -0.511 -1.015 1.00 61.10 H new ATOM 0 HD3 PRO A 13 -2.592 -1.787 0.053 1.00 61.10 H new ATOM 191 N ARG A 14 -4.877 1.021 -2.687 1.00 11.51 N ATOM 192 CA ARG A 14 -5.196 2.128 -3.581 1.00 63.12 C ATOM 193 C ARG A 14 -6.112 1.667 -4.711 1.00 13.42 C ATOM 194 O ARG A 14 -6.806 2.474 -5.331 1.00 4.23 O ATOM 195 CB ARG A 14 -3.914 2.727 -4.162 1.00 42.25 C ATOM 196 CG ARG A 14 -4.094 4.131 -4.716 1.00 53.11 C ATOM 197 CD ARG A 14 -2.756 4.808 -4.964 1.00 44.53 C ATOM 198 NE ARG A 14 -2.911 6.106 -5.617 1.00 72.41 N ATOM 199 CZ ARG A 14 -1.929 6.727 -6.260 1.00 50.22 C ATOM 200 NH1 ARG A 14 -0.727 6.173 -6.337 1.00 31.25 N ATOM 201 NH2 ARG A 14 -2.148 7.906 -6.829 1.00 74.31 N ATOM 0 H ARG A 14 -3.941 0.635 -2.811 1.00 11.51 H new ATOM 0 HA ARG A 14 -5.716 2.891 -3.003 1.00 63.12 H new ATOM 0 HB2 ARG A 14 -3.148 2.747 -3.386 1.00 42.25 H new ATOM 0 HB3 ARG A 14 -3.547 2.077 -4.956 1.00 42.25 H new ATOM 0 HG2 ARG A 14 -4.658 4.086 -5.647 1.00 53.11 H new ATOM 0 HG3 ARG A 14 -4.680 4.727 -4.016 1.00 53.11 H new ATOM 0 HD2 ARG A 14 -2.235 4.939 -4.016 1.00 44.53 H new ATOM 0 HD3 ARG A 14 -2.133 4.163 -5.583 1.00 44.53 H new ATOM 0 HE ARG A 14 -3.824 6.560 -5.577 1.00 72.41 H new ATOM 0 HH11 ARG A 14 -0.554 5.267 -5.902 1.00 31.25 H new ATOM 0 HH12 ARG A 14 0.025 6.653 -6.832 1.00 31.25 H new ATOM 0 HH21 ARG A 14 -3.071 8.336 -6.773 1.00 74.31 H new ATOM 0 HH22 ARG A 14 -1.393 8.382 -7.323 1.00 74.31 H new ATOM 215 N LYS A 15 -6.110 0.365 -4.974 1.00 33.14 N ATOM 216 CA LYS A 15 -6.941 -0.205 -6.028 1.00 13.25 C ATOM 217 C LYS A 15 -8.392 0.242 -5.878 1.00 11.02 C ATOM 218 O LYS A 15 -8.995 0.080 -4.817 1.00 43.41 O ATOM 219 CB LYS A 15 -6.862 -1.733 -5.998 1.00 44.24 C ATOM 220 CG LYS A 15 -5.567 -2.285 -6.570 1.00 74.22 C ATOM 221 CD LYS A 15 -5.525 -2.154 -8.083 1.00 53.44 C ATOM 222 CE LYS A 15 -6.348 -3.239 -8.760 1.00 70.14 C ATOM 223 NZ LYS A 15 -7.757 -2.811 -8.981 1.00 41.44 N ATOM 0 H LYS A 15 -5.541 -0.316 -4.471 1.00 33.14 H new ATOM 0 HA LYS A 15 -6.565 0.154 -6.986 1.00 13.25 H new ATOM 0 HB2 LYS A 15 -6.970 -2.074 -4.968 1.00 44.24 H new ATOM 0 HB3 LYS A 15 -7.702 -2.143 -6.559 1.00 44.24 H new ATOM 0 HG2 LYS A 15 -4.720 -1.754 -6.134 1.00 74.22 H new ATOM 0 HG3 LYS A 15 -5.463 -3.334 -6.292 1.00 74.22 H new ATOM 0 HD2 LYS A 15 -5.903 -1.174 -8.375 1.00 53.44 H new ATOM 0 HD3 LYS A 15 -4.492 -2.212 -8.426 1.00 53.44 H new ATOM 0 HE2 LYS A 15 -5.893 -3.497 -9.716 1.00 70.14 H new ATOM 0 HE3 LYS A 15 -6.334 -4.140 -8.147 1.00 70.14 H new ATOM 0 HZ1 LYS A 15 -8.402 -3.504 -8.550 1.00 41.44 H new ATOM 0 HZ2 LYS A 15 -7.909 -1.879 -8.546 1.00 41.44 H new ATOM 0 HZ3 LYS A 15 -7.946 -2.751 -10.002 1.00 41.44 H new ATOM 237 N ALA A 16 -8.947 0.803 -6.947 1.00 51.11 N ATOM 238 CA ALA A 16 -10.328 1.269 -6.935 1.00 50.51 C ATOM 239 C ALA A 16 -11.294 0.117 -6.681 1.00 54.51 C ATOM 240 O ALA A 16 -12.262 0.258 -5.932 1.00 44.14 O ATOM 241 CB ALA A 16 -10.663 1.962 -8.248 1.00 24.01 C ATOM 0 H ALA A 16 -8.461 0.946 -7.833 1.00 51.11 H new ATOM 0 HA ALA A 16 -10.436 1.986 -6.121 1.00 50.51 H new ATOM 0 HB1 ALA A 16 -11.697 2.305 -8.225 1.00 24.01 H new ATOM 0 HB2 ALA A 16 -10.001 2.816 -8.388 1.00 24.01 H new ATOM 0 HB3 ALA A 16 -10.531 1.262 -9.073 1.00 24.01 H new ATOM 247 N LYS A 17 -11.027 -1.022 -7.310 1.00 31.23 N ATOM 248 CA LYS A 17 -11.872 -2.200 -7.152 1.00 53.11 C ATOM 249 C LYS A 17 -11.920 -2.644 -5.694 1.00 13.25 C ATOM 250 O LYS A 17 -12.881 -3.279 -5.258 1.00 52.32 O ATOM 251 CB LYS A 17 -11.357 -3.344 -8.028 1.00 25.13 C ATOM 252 CG LYS A 17 -11.928 -3.338 -9.435 1.00 20.20 C ATOM 253 CD LYS A 17 -11.388 -2.176 -10.251 1.00 55.51 C ATOM 254 CE LYS A 17 -11.950 -2.179 -11.665 1.00 11.44 C ATOM 255 NZ LYS A 17 -11.027 -1.520 -12.630 1.00 23.32 N ATOM 0 H LYS A 17 -10.232 -1.155 -7.935 1.00 31.23 H new ATOM 0 HA LYS A 17 -12.882 -1.936 -7.466 1.00 53.11 H new ATOM 0 HB2 LYS A 17 -10.270 -3.285 -8.086 1.00 25.13 H new ATOM 0 HB3 LYS A 17 -11.600 -4.293 -7.551 1.00 25.13 H new ATOM 0 HG2 LYS A 17 -11.684 -4.277 -9.932 1.00 20.20 H new ATOM 0 HG3 LYS A 17 -13.015 -3.276 -9.387 1.00 20.20 H new ATOM 0 HD2 LYS A 17 -11.641 -1.236 -9.760 1.00 55.51 H new ATOM 0 HD3 LYS A 17 -10.300 -2.232 -10.291 1.00 55.51 H new ATOM 0 HE2 LYS A 17 -12.133 -3.206 -11.981 1.00 11.44 H new ATOM 0 HE3 LYS A 17 -12.912 -1.666 -11.675 1.00 11.44 H new ATOM 0 HZ1 LYS A 17 -11.446 -1.543 -13.582 1.00 23.32 H new ATOM 0 HZ2 LYS A 17 -10.872 -0.532 -12.343 1.00 23.32 H new ATOM 0 HZ3 LYS A 17 -10.117 -2.024 -12.640 1.00 23.32 H new ATOM 269 N LYS A 18 -10.878 -2.305 -4.942 1.00 53.30 N ATOM 270 CA LYS A 18 -10.802 -2.665 -3.531 1.00 71.43 C ATOM 271 C LYS A 18 -11.598 -1.685 -2.675 1.00 61.34 C ATOM 272 O LYS A 18 -11.328 -0.484 -2.677 1.00 71.10 O ATOM 273 CB LYS A 18 -9.343 -2.695 -3.069 1.00 55.33 C ATOM 274 CG LYS A 18 -9.154 -3.308 -1.693 1.00 24.40 C ATOM 275 CD LYS A 18 -8.929 -4.809 -1.778 1.00 15.14 C ATOM 276 CE LYS A 18 -7.455 -5.144 -1.941 1.00 41.24 C ATOM 277 NZ LYS A 18 -7.167 -6.563 -1.595 1.00 63.33 N ATOM 0 H LYS A 18 -10.074 -1.781 -5.287 1.00 53.30 H new ATOM 0 HA LYS A 18 -11.235 -3.658 -3.412 1.00 71.43 H new ATOM 0 HB2 LYS A 18 -8.753 -3.258 -3.792 1.00 55.33 H new ATOM 0 HB3 LYS A 18 -8.952 -1.678 -3.061 1.00 55.33 H new ATOM 0 HG2 LYS A 18 -8.303 -2.839 -1.198 1.00 24.40 H new ATOM 0 HG3 LYS A 18 -10.032 -3.105 -1.079 1.00 24.40 H new ATOM 0 HD2 LYS A 18 -9.314 -5.287 -0.877 1.00 15.14 H new ATOM 0 HD3 LYS A 18 -9.491 -5.215 -2.619 1.00 15.14 H new ATOM 0 HE2 LYS A 18 -7.151 -4.952 -2.970 1.00 41.24 H new ATOM 0 HE3 LYS A 18 -6.861 -4.487 -1.305 1.00 41.24 H new ATOM 0 HZ1 LYS A 18 -6.152 -6.751 -1.719 1.00 63.33 H new ATOM 0 HZ2 LYS A 18 -7.434 -6.740 -0.605 1.00 63.33 H new ATOM 0 HZ3 LYS A 18 -7.714 -7.190 -2.218 1.00 63.33 H new ATOM 291 N ASP A 19 -12.578 -2.206 -1.945 1.00 3.54 N ATOM 292 CA ASP A 19 -13.411 -1.376 -1.082 1.00 31.33 C ATOM 293 C ASP A 19 -12.556 -0.588 -0.095 1.00 24.24 C ATOM 294 O ASP A 19 -11.438 -0.978 0.245 1.00 51.40 O ATOM 295 CB ASP A 19 -14.418 -2.243 -0.324 1.00 55.22 C ATOM 296 CG ASP A 19 -13.771 -3.451 0.323 1.00 34.40 C ATOM 297 OD1 ASP A 19 -12.784 -3.269 1.066 1.00 31.52 O ATOM 298 OD2 ASP A 19 -14.253 -4.579 0.087 1.00 23.01 O ATOM 0 H ASP A 19 -12.815 -3.198 -1.933 1.00 3.54 H new ATOM 0 HA ASP A 19 -13.952 -0.669 -1.711 1.00 31.33 H new ATOM 0 HB2 ASP A 19 -14.906 -1.642 0.443 1.00 55.22 H new ATOM 0 HB3 ASP A 19 -15.196 -2.576 -1.011 1.00 55.22 H new ATOM 303 N PRO A 20 -13.091 0.548 0.377 1.00 24.31 N ATOM 304 CA PRO A 20 -12.393 1.415 1.331 1.00 30.33 C ATOM 305 C PRO A 20 -12.277 0.780 2.713 1.00 3.51 C ATOM 306 O PRO A 20 -11.266 0.939 3.396 1.00 64.22 O ATOM 307 CB PRO A 20 -13.277 2.663 1.389 1.00 73.14 C ATOM 308 CG PRO A 20 -14.635 2.183 1.006 1.00 1.23 C ATOM 309 CD PRO A 20 -14.418 1.073 0.016 1.00 70.13 C ATOM 0 HA PRO A 20 -11.367 1.617 1.023 1.00 30.33 H new ATOM 0 HB2 PRO A 20 -13.279 3.101 2.387 1.00 73.14 H new ATOM 0 HB3 PRO A 20 -12.921 3.432 0.704 1.00 73.14 H new ATOM 0 HG2 PRO A 20 -15.183 1.826 1.878 1.00 1.23 H new ATOM 0 HG3 PRO A 20 -15.224 2.988 0.567 1.00 1.23 H new ATOM 0 HD2 PRO A 20 -15.189 0.307 0.096 1.00 70.13 H new ATOM 0 HD3 PRO A 20 -14.439 1.440 -1.010 1.00 70.13 H new ATOM 317 N ASN A 21 -13.318 0.062 3.119 1.00 74.42 N ATOM 318 CA ASN A 21 -13.332 -0.597 4.420 1.00 14.21 C ATOM 319 C ASN A 21 -12.983 0.388 5.532 1.00 63.12 C ATOM 320 O ASN A 21 -12.268 0.048 6.474 1.00 62.22 O ATOM 321 CB ASN A 21 -12.348 -1.768 4.433 1.00 72.21 C ATOM 322 CG ASN A 21 -12.759 -2.858 5.405 1.00 42.35 C ATOM 323 OD1 ASN A 21 -13.412 -3.829 5.025 1.00 73.52 O ATOM 324 ND2 ASN A 21 -12.376 -2.700 6.666 1.00 12.13 N ATOM 0 H ASN A 21 -14.163 -0.079 2.566 1.00 74.42 H new ATOM 0 HA ASN A 21 -14.339 -0.976 4.597 1.00 14.21 H new ATOM 0 HB2 ASN A 21 -12.274 -2.188 3.430 1.00 72.21 H new ATOM 0 HB3 ASN A 21 -11.356 -1.403 4.699 1.00 72.21 H new ATOM 0 HD21 ASN A 21 -12.622 -3.400 7.365 1.00 12.13 H new ATOM 0 HD22 ASN A 21 -11.835 -1.878 6.936 1.00 12.13 H new ATOM 331 N ALA A 22 -13.493 1.610 5.415 1.00 63.44 N ATOM 332 CA ALA A 22 -13.237 2.643 6.410 1.00 21.23 C ATOM 333 C ALA A 22 -14.495 2.954 7.214 1.00 41.52 C ATOM 334 O ALA A 22 -15.615 2.660 6.797 1.00 15.22 O ATOM 335 CB ALA A 22 -12.711 3.903 5.740 1.00 42.32 C ATOM 0 H ALA A 22 -14.086 1.908 4.641 1.00 63.44 H new ATOM 0 HA ALA A 22 -12.480 2.269 7.099 1.00 21.23 H new ATOM 0 HB1 ALA A 22 -12.524 4.666 6.496 1.00 42.32 H new ATOM 0 HB2 ALA A 22 -11.782 3.676 5.216 1.00 42.32 H new ATOM 0 HB3 ALA A 22 -13.449 4.271 5.027 1.00 42.32 H new ATOM 341 N PRO A 23 -14.308 3.564 8.394 1.00 35.31 N ATOM 342 CA PRO A 23 -15.417 3.928 9.281 1.00 55.22 C ATOM 343 C PRO A 23 -16.261 5.066 8.716 1.00 34.20 C ATOM 344 O PRO A 23 -15.731 6.080 8.262 1.00 13.12 O ATOM 345 CB PRO A 23 -14.713 4.372 10.566 1.00 74.44 C ATOM 346 CG PRO A 23 -13.363 4.818 10.123 1.00 62.13 C ATOM 347 CD PRO A 23 -13.001 3.944 8.954 1.00 44.23 C ATOM 0 HA PRO A 23 -16.113 3.101 9.424 1.00 55.22 H new ATOM 0 HB2 PRO A 23 -15.256 5.180 11.056 1.00 74.44 H new ATOM 0 HB3 PRO A 23 -14.644 3.554 11.283 1.00 74.44 H new ATOM 0 HG2 PRO A 23 -13.374 5.869 9.835 1.00 62.13 H new ATOM 0 HG3 PRO A 23 -12.635 4.715 10.927 1.00 62.13 H new ATOM 0 HD2 PRO A 23 -12.392 4.479 8.225 1.00 44.23 H new ATOM 0 HD3 PRO A 23 -12.429 3.071 9.267 1.00 44.23 H new ATOM 355 N LYS A 24 -17.578 4.891 8.747 1.00 12.10 N ATOM 356 CA LYS A 24 -18.497 5.903 8.240 1.00 1.50 C ATOM 357 C LYS A 24 -19.400 6.425 9.353 1.00 33.31 C ATOM 358 O LYS A 24 -20.514 6.882 9.098 1.00 55.11 O ATOM 359 CB LYS A 24 -19.348 5.327 7.106 1.00 43.41 C ATOM 360 CG LYS A 24 -18.551 4.512 6.102 1.00 53.01 C ATOM 361 CD LYS A 24 -17.402 5.316 5.517 1.00 73.02 C ATOM 362 CE LYS A 24 -17.072 4.867 4.101 1.00 12.54 C ATOM 363 NZ LYS A 24 -18.207 5.103 3.166 1.00 22.01 N ATOM 0 H LYS A 24 -18.033 4.057 9.118 1.00 12.10 H new ATOM 0 HA LYS A 24 -17.906 6.734 7.856 1.00 1.50 H new ATOM 0 HB2 LYS A 24 -20.130 4.699 7.533 1.00 43.41 H new ATOM 0 HB3 LYS A 24 -19.845 6.145 6.585 1.00 43.41 H new ATOM 0 HG2 LYS A 24 -18.160 3.617 6.587 1.00 53.01 H new ATOM 0 HG3 LYS A 24 -19.208 4.178 5.299 1.00 53.01 H new ATOM 0 HD2 LYS A 24 -17.662 6.375 5.513 1.00 73.02 H new ATOM 0 HD3 LYS A 24 -16.521 5.207 6.149 1.00 73.02 H new ATOM 0 HE2 LYS A 24 -16.192 5.403 3.746 1.00 12.54 H new ATOM 0 HE3 LYS A 24 -16.820 3.807 4.106 1.00 12.54 H new ATOM 0 HZ1 LYS A 24 -17.839 5.264 2.207 1.00 22.01 H new ATOM 0 HZ2 LYS A 24 -18.832 4.272 3.162 1.00 22.01 H new ATOM 0 HZ3 LYS A 24 -18.744 5.938 3.475 1.00 22.01 H new ATOM 377 N ARG A 25 -18.912 6.354 10.587 1.00 32.12 N ATOM 378 CA ARG A 25 -19.676 6.819 11.739 1.00 41.03 C ATOM 379 C ARG A 25 -19.661 8.343 11.821 1.00 32.43 C ATOM 380 O ARG A 25 -18.780 8.996 11.263 1.00 31.23 O ATOM 381 CB ARG A 25 -19.109 6.222 13.028 1.00 12.12 C ATOM 382 CG ARG A 25 -20.175 5.706 13.981 1.00 55.25 C ATOM 383 CD ARG A 25 -20.508 6.732 15.053 1.00 22.41 C ATOM 384 NE ARG A 25 -20.974 6.103 16.286 1.00 22.30 N ATOM 385 CZ ARG A 25 -21.419 6.784 17.336 1.00 52.13 C ATOM 386 NH1 ARG A 25 -21.459 8.109 17.302 1.00 72.11 N ATOM 387 NH2 ARG A 25 -21.826 6.140 18.422 1.00 14.01 N ATOM 0 H ARG A 25 -17.991 5.979 10.815 1.00 32.12 H new ATOM 0 HA ARG A 25 -20.708 6.489 11.617 1.00 41.03 H new ATOM 0 HB2 ARG A 25 -18.435 5.404 12.774 1.00 12.12 H new ATOM 0 HB3 ARG A 25 -18.514 6.979 13.538 1.00 12.12 H new ATOM 0 HG2 ARG A 25 -21.076 5.458 13.421 1.00 55.25 H new ATOM 0 HG3 ARG A 25 -19.829 4.786 14.452 1.00 55.25 H new ATOM 0 HD2 ARG A 25 -19.625 7.335 15.265 1.00 22.41 H new ATOM 0 HD3 ARG A 25 -21.275 7.411 14.680 1.00 22.41 H new ATOM 0 HE ARG A 25 -20.957 5.085 16.344 1.00 22.30 H new ATOM 0 HH11 ARG A 25 -21.148 8.607 16.468 1.00 72.11 H new ATOM 0 HH12 ARG A 25 -21.801 8.630 18.110 1.00 72.11 H new ATOM 0 HH21 ARG A 25 -21.797 5.121 18.451 1.00 14.01 H new ATOM 0 HH22 ARG A 25 -22.168 6.664 19.228 1.00 14.01 H new ATOM 401 N ALA A 26 -20.643 8.902 12.521 1.00 72.41 N ATOM 402 CA ALA A 26 -20.742 10.347 12.678 1.00 53.32 C ATOM 403 C ALA A 26 -19.912 10.829 13.863 1.00 52.12 C ATOM 404 O ALA A 26 -19.511 10.037 14.716 1.00 34.44 O ATOM 405 CB ALA A 26 -22.197 10.761 12.846 1.00 4.54 C ATOM 0 H ALA A 26 -21.381 8.375 12.988 1.00 72.41 H new ATOM 0 HA ALA A 26 -20.345 10.814 11.777 1.00 53.32 H new ATOM 0 HB1 ALA A 26 -22.256 11.843 12.962 1.00 4.54 H new ATOM 0 HB2 ALA A 26 -22.765 10.459 11.966 1.00 4.54 H new ATOM 0 HB3 ALA A 26 -22.613 10.278 13.730 1.00 4.54 H new ATOM 411 N LEU A 27 -19.657 12.132 13.909 1.00 22.14 N ATOM 412 CA LEU A 27 -18.873 12.720 14.990 1.00 31.34 C ATOM 413 C LEU A 27 -19.591 12.569 16.328 1.00 70.13 C ATOM 414 O LEU A 27 -20.772 12.895 16.450 1.00 4.31 O ATOM 415 CB LEU A 27 -18.605 14.199 14.706 1.00 20.34 C ATOM 416 CG LEU A 27 -17.305 14.515 13.967 1.00 42.15 C ATOM 417 CD1 LEU A 27 -17.111 13.563 12.797 1.00 71.04 C ATOM 418 CD2 LEU A 27 -17.302 15.959 13.487 1.00 2.42 C ATOM 0 H LEU A 27 -19.981 12.801 13.211 1.00 22.14 H new ATOM 0 HA LEU A 27 -17.923 12.189 15.047 1.00 31.34 H new ATOM 0 HB2 LEU A 27 -19.437 14.593 14.122 1.00 20.34 H new ATOM 0 HB3 LEU A 27 -18.600 14.736 15.655 1.00 20.34 H new ATOM 0 HG LEU A 27 -16.474 14.381 14.660 1.00 42.15 H new ATOM 0 HD11 LEU A 27 -16.180 13.803 12.283 1.00 71.04 H new ATOM 0 HD12 LEU A 27 -17.068 12.538 13.165 1.00 71.04 H new ATOM 0 HD13 LEU A 27 -17.945 13.664 12.103 1.00 71.04 H new ATOM 0 HD21 LEU A 27 -16.369 16.166 12.963 1.00 2.42 H new ATOM 0 HD22 LEU A 27 -18.141 16.119 12.810 1.00 2.42 H new ATOM 0 HD23 LEU A 27 -17.393 16.627 14.343 1.00 2.42 H new ATOM 430 N SER A 28 -18.869 12.074 17.328 1.00 14.24 N ATOM 431 CA SER A 28 -19.438 11.879 18.657 1.00 62.20 C ATOM 432 C SER A 28 -20.112 13.155 19.153 1.00 63.34 C ATOM 433 O SER A 28 -19.893 14.237 18.609 1.00 45.01 O ATOM 434 CB SER A 28 -18.350 11.447 19.642 1.00 44.50 C ATOM 435 OG SER A 28 -18.837 11.447 20.973 1.00 72.15 O ATOM 0 H SER A 28 -17.890 11.801 17.244 1.00 14.24 H new ATOM 0 HA SER A 28 -20.191 11.094 18.591 1.00 62.20 H new ATOM 0 HB2 SER A 28 -17.995 10.450 19.382 1.00 44.50 H new ATOM 0 HB3 SER A 28 -17.496 12.120 19.564 1.00 44.50 H new ATOM 0 HG SER A 28 -18.621 10.592 21.401 1.00 72.15 H new ATOM 441 N SER A 29 -20.933 13.018 20.189 1.00 40.52 N ATOM 442 CA SER A 29 -21.643 14.159 20.757 1.00 62.33 C ATOM 443 C SER A 29 -20.697 15.037 21.570 1.00 41.21 C ATOM 444 O SER A 29 -20.438 16.187 21.212 1.00 23.54 O ATOM 445 CB SER A 29 -22.797 13.680 21.639 1.00 73.21 C ATOM 446 OG SER A 29 -22.373 12.658 22.524 1.00 2.23 O ATOM 0 H SER A 29 -21.123 12.129 20.652 1.00 40.52 H new ATOM 0 HA SER A 29 -22.045 14.752 19.935 1.00 62.33 H new ATOM 0 HB2 SER A 29 -23.194 14.519 22.211 1.00 73.21 H new ATOM 0 HB3 SER A 29 -23.608 13.309 21.012 1.00 73.21 H new ATOM 0 HG SER A 29 -23.129 12.370 23.078 1.00 2.23 H new ATOM 452 N TYR A 30 -20.185 14.488 22.665 1.00 24.33 N ATOM 453 CA TYR A 30 -19.269 15.221 23.532 1.00 73.22 C ATOM 454 C TYR A 30 -17.844 15.163 22.992 1.00 64.43 C ATOM 455 O TYR A 30 -17.075 16.114 23.133 1.00 74.40 O ATOM 456 CB TYR A 30 -19.312 14.653 24.951 1.00 34.33 C ATOM 457 CG TYR A 30 -18.927 15.654 26.016 1.00 2.33 C ATOM 458 CD1 TYR A 30 -17.603 16.039 26.189 1.00 42.22 C ATOM 459 CD2 TYR A 30 -19.886 16.215 26.851 1.00 41.04 C ATOM 460 CE1 TYR A 30 -17.246 16.954 27.161 1.00 64.50 C ATOM 461 CE2 TYR A 30 -19.538 17.131 27.824 1.00 11.13 C ATOM 462 CZ TYR A 30 -18.217 17.497 27.976 1.00 62.12 C ATOM 463 OH TYR A 30 -17.866 18.408 28.946 1.00 51.04 O ATOM 0 H TYR A 30 -20.388 13.537 22.974 1.00 24.33 H new ATOM 0 HA TYR A 30 -19.587 16.263 23.555 1.00 73.22 H new ATOM 0 HB2 TYR A 30 -20.318 14.286 25.156 1.00 34.33 H new ATOM 0 HB3 TYR A 30 -18.641 13.796 25.011 1.00 34.33 H new ATOM 0 HD1 TYR A 30 -16.840 15.616 25.553 1.00 42.22 H new ATOM 0 HD2 TYR A 30 -20.921 15.930 26.737 1.00 41.04 H new ATOM 0 HE1 TYR A 30 -16.212 17.242 27.282 1.00 64.50 H new ATOM 0 HE2 TYR A 30 -20.297 17.559 28.463 1.00 11.13 H new ATOM 0 HH TYR A 30 -18.668 18.694 29.432 1.00 51.04 H new ATOM 473 N MET A 31 -17.498 14.039 22.372 1.00 71.11 N ATOM 474 CA MET A 31 -16.166 13.856 21.808 1.00 4.23 C ATOM 475 C MET A 31 -16.011 14.645 20.512 1.00 43.10 C ATOM 476 O MET A 31 -14.927 14.693 19.929 1.00 55.33 O ATOM 477 CB MET A 31 -15.896 12.372 21.551 1.00 14.32 C ATOM 478 CG MET A 31 -14.677 11.840 22.286 1.00 60.40 C ATOM 479 SD MET A 31 -14.943 10.193 22.970 1.00 22.32 S ATOM 480 CE MET A 31 -16.069 10.562 24.313 1.00 75.43 C ATOM 0 H MET A 31 -18.122 13.242 22.248 1.00 71.11 H new ATOM 0 HA MET A 31 -15.439 14.230 22.529 1.00 4.23 H new ATOM 0 HB2 MET A 31 -16.771 11.795 21.850 1.00 14.32 H new ATOM 0 HB3 MET A 31 -15.762 12.216 20.481 1.00 14.32 H new ATOM 0 HG2 MET A 31 -13.829 11.813 21.602 1.00 60.40 H new ATOM 0 HG3 MET A 31 -14.415 12.526 23.092 1.00 60.40 H new ATOM 0 HE1 MET A 31 -16.106 9.716 24.999 1.00 75.43 H new ATOM 0 HE2 MET A 31 -15.722 11.447 24.846 1.00 75.43 H new ATOM 0 HE3 MET A 31 -17.065 10.748 23.912 1.00 75.43 H new ATOM 490 N PHE A 32 -17.100 15.262 20.066 1.00 31.21 N ATOM 491 CA PHE A 32 -17.085 16.048 18.838 1.00 71.53 C ATOM 492 C PHE A 32 -15.837 16.922 18.767 1.00 42.22 C ATOM 493 O PHE A 32 -15.293 17.161 17.688 1.00 22.04 O ATOM 494 CB PHE A 32 -18.339 16.920 18.750 1.00 2.31 C ATOM 495 CG PHE A 32 -18.268 18.158 19.599 1.00 73.52 C ATOM 496 CD1 PHE A 32 -18.253 18.065 20.981 1.00 10.33 C ATOM 497 CD2 PHE A 32 -18.217 19.413 19.014 1.00 22.34 C ATOM 498 CE1 PHE A 32 -18.189 19.202 21.764 1.00 11.25 C ATOM 499 CE2 PHE A 32 -18.152 20.553 19.792 1.00 13.35 C ATOM 500 CZ PHE A 32 -18.137 20.448 21.169 1.00 34.44 C ATOM 0 H PHE A 32 -18.004 15.233 20.537 1.00 31.21 H new ATOM 0 HA PHE A 32 -17.072 15.358 17.994 1.00 71.53 H new ATOM 0 HB2 PHE A 32 -18.498 17.210 17.711 1.00 2.31 H new ATOM 0 HB3 PHE A 32 -19.204 16.330 19.053 1.00 2.31 H new ATOM 0 HD1 PHE A 32 -18.292 17.094 21.452 1.00 10.33 H new ATOM 0 HD2 PHE A 32 -18.228 19.501 17.938 1.00 22.34 H new ATOM 0 HE1 PHE A 32 -18.180 19.117 22.841 1.00 11.25 H new ATOM 0 HE2 PHE A 32 -18.113 21.525 19.324 1.00 13.35 H new ATOM 0 HZ PHE A 32 -18.085 21.338 21.779 1.00 34.44 H new ATOM 510 N PHE A 33 -15.388 17.398 19.924 1.00 74.22 N ATOM 511 CA PHE A 33 -14.205 18.248 19.994 1.00 34.51 C ATOM 512 C PHE A 33 -13.026 17.598 19.276 1.00 50.43 C ATOM 513 O PHE A 33 -12.414 18.201 18.394 1.00 13.45 O ATOM 514 CB PHE A 33 -13.838 18.526 21.453 1.00 44.30 C ATOM 515 CG PHE A 33 -12.596 19.356 21.610 1.00 2.40 C ATOM 516 CD1 PHE A 33 -12.474 20.575 20.961 1.00 34.23 C ATOM 517 CD2 PHE A 33 -11.550 18.919 22.407 1.00 71.23 C ATOM 518 CE1 PHE A 33 -11.332 21.340 21.104 1.00 54.14 C ATOM 519 CE2 PHE A 33 -10.406 19.680 22.553 1.00 3.11 C ATOM 520 CZ PHE A 33 -10.297 20.893 21.901 1.00 34.14 C ATOM 0 H PHE A 33 -15.826 17.209 20.826 1.00 74.22 H new ATOM 0 HA PHE A 33 -14.435 19.191 19.498 1.00 34.51 H new ATOM 0 HB2 PHE A 33 -14.670 19.036 21.938 1.00 44.30 H new ATOM 0 HB3 PHE A 33 -13.700 17.577 21.972 1.00 44.30 H new ATOM 0 HD1 PHE A 33 -13.280 20.931 20.337 1.00 34.23 H new ATOM 0 HD2 PHE A 33 -11.630 17.972 22.920 1.00 71.23 H new ATOM 0 HE1 PHE A 33 -11.249 22.287 20.592 1.00 54.14 H new ATOM 0 HE2 PHE A 33 -9.598 19.327 23.176 1.00 3.11 H new ATOM 0 HZ PHE A 33 -9.404 21.490 22.014 1.00 34.14 H new ATOM 530 N ALA A 34 -12.713 16.365 19.660 1.00 41.32 N ATOM 531 CA ALA A 34 -11.609 15.633 19.052 1.00 4.23 C ATOM 532 C ALA A 34 -12.050 14.941 17.767 1.00 21.23 C ATOM 533 O ALA A 34 -11.335 14.954 16.765 1.00 1.41 O ATOM 534 CB ALA A 34 -11.045 14.617 20.035 1.00 50.23 C ATOM 0 H ALA A 34 -13.208 15.852 20.389 1.00 41.32 H new ATOM 0 HA ALA A 34 -10.827 16.349 18.797 1.00 4.23 H new ATOM 0 HB1 ALA A 34 -10.221 14.077 19.568 1.00 50.23 H new ATOM 0 HB2 ALA A 34 -10.683 15.133 20.924 1.00 50.23 H new ATOM 0 HB3 ALA A 34 -11.827 13.912 20.318 1.00 50.23 H new ATOM 540 N LYS A 35 -13.232 14.335 17.803 1.00 1.10 N ATOM 541 CA LYS A 35 -13.770 13.637 16.641 1.00 10.15 C ATOM 542 C LYS A 35 -13.871 14.574 15.442 1.00 12.32 C ATOM 543 O LYS A 35 -13.918 14.127 14.297 1.00 55.42 O ATOM 544 CB LYS A 35 -15.148 13.054 16.964 1.00 24.11 C ATOM 545 CG LYS A 35 -15.123 11.565 17.264 1.00 42.04 C ATOM 546 CD LYS A 35 -14.161 11.240 18.394 1.00 30.41 C ATOM 547 CE LYS A 35 -14.445 9.870 18.991 1.00 71.45 C ATOM 548 NZ LYS A 35 -13.249 9.302 19.672 1.00 44.31 N ATOM 0 H LYS A 35 -13.836 14.313 18.625 1.00 1.10 H new ATOM 0 HA LYS A 35 -13.088 12.825 16.388 1.00 10.15 H new ATOM 0 HB2 LYS A 35 -15.565 13.582 17.822 1.00 24.11 H new ATOM 0 HB3 LYS A 35 -15.816 13.235 16.122 1.00 24.11 H new ATOM 0 HG2 LYS A 35 -16.125 11.230 17.531 1.00 42.04 H new ATOM 0 HG3 LYS A 35 -14.831 11.017 16.368 1.00 42.04 H new ATOM 0 HD2 LYS A 35 -13.137 11.271 18.022 1.00 30.41 H new ATOM 0 HD3 LYS A 35 -14.241 12.000 19.171 1.00 30.41 H new ATOM 0 HE2 LYS A 35 -15.266 9.948 19.704 1.00 71.45 H new ATOM 0 HE3 LYS A 35 -14.771 9.191 18.203 1.00 71.45 H new ATOM 0 HZ1 LYS A 35 -13.484 8.368 20.065 1.00 44.31 H new ATOM 0 HZ2 LYS A 35 -12.473 9.204 18.986 1.00 44.31 H new ATOM 0 HZ3 LYS A 35 -12.953 9.937 20.441 1.00 44.31 H new ATOM 562 N GLU A 36 -13.903 15.875 15.714 1.00 4.24 N ATOM 563 CA GLU A 36 -13.997 16.874 14.656 1.00 14.14 C ATOM 564 C GLU A 36 -12.843 16.731 13.668 1.00 14.32 C ATOM 565 O GLU A 36 -12.945 17.144 12.513 1.00 52.12 O ATOM 566 CB GLU A 36 -14.001 18.283 15.253 1.00 24.15 C ATOM 567 CG GLU A 36 -13.907 19.386 14.212 1.00 31.52 C ATOM 568 CD GLU A 36 -13.911 20.771 14.828 1.00 54.31 C ATOM 569 OE1 GLU A 36 -13.719 20.874 16.058 1.00 63.13 O ATOM 570 OE2 GLU A 36 -14.108 21.752 14.081 1.00 45.40 O ATOM 0 H GLU A 36 -13.865 16.261 16.657 1.00 4.24 H new ATOM 0 HA GLU A 36 -14.932 16.712 14.121 1.00 14.14 H new ATOM 0 HB2 GLU A 36 -14.913 18.420 15.834 1.00 24.15 H new ATOM 0 HB3 GLU A 36 -13.165 18.377 15.946 1.00 24.15 H new ATOM 0 HG2 GLU A 36 -12.995 19.254 13.630 1.00 31.52 H new ATOM 0 HG3 GLU A 36 -14.743 19.298 13.519 1.00 31.52 H new ATOM 577 N LYS A 37 -11.745 16.144 14.131 1.00 11.13 N ATOM 578 CA LYS A 37 -10.571 15.945 13.290 1.00 3.14 C ATOM 579 C LYS A 37 -10.767 14.758 12.353 1.00 34.34 C ATOM 580 O LYS A 37 -9.947 14.510 11.470 1.00 61.23 O ATOM 581 CB LYS A 37 -9.329 15.724 14.157 1.00 1.20 C ATOM 582 CG LYS A 37 -9.171 14.293 14.640 1.00 31.21 C ATOM 583 CD LYS A 37 -8.029 14.162 15.634 1.00 12.41 C ATOM 584 CE LYS A 37 -8.541 14.088 17.064 1.00 11.04 C ATOM 585 NZ LYS A 37 -9.426 12.909 17.276 1.00 11.22 N ATOM 0 H LYS A 37 -11.644 15.797 15.085 1.00 11.13 H new ATOM 0 HA LYS A 37 -10.431 16.842 12.687 1.00 3.14 H new ATOM 0 HB2 LYS A 37 -8.444 16.006 13.587 1.00 1.20 H new ATOM 0 HB3 LYS A 37 -9.377 16.387 15.021 1.00 1.20 H new ATOM 0 HG2 LYS A 37 -10.099 13.961 15.105 1.00 31.21 H new ATOM 0 HG3 LYS A 37 -8.989 13.638 13.788 1.00 31.21 H new ATOM 0 HD2 LYS A 37 -7.449 13.268 15.407 1.00 12.41 H new ATOM 0 HD3 LYS A 37 -7.356 15.013 15.531 1.00 12.41 H new ATOM 0 HE2 LYS A 37 -7.696 14.036 17.750 1.00 11.04 H new ATOM 0 HE3 LYS A 37 -9.088 15.000 17.301 1.00 11.04 H new ATOM 0 HZ1 LYS A 37 -9.361 12.600 18.267 1.00 11.22 H new ATOM 0 HZ2 LYS A 37 -10.409 13.169 17.058 1.00 11.22 H new ATOM 0 HZ3 LYS A 37 -9.127 12.133 16.651 1.00 11.22 H new ATOM 599 N ARG A 38 -11.860 14.028 12.552 1.00 74.04 N ATOM 600 CA ARG A 38 -12.164 12.867 11.724 1.00 74.02 C ATOM 601 C ARG A 38 -12.083 13.220 10.242 1.00 75.15 C ATOM 602 O ARG A 38 -11.756 12.375 9.408 1.00 22.13 O ATOM 603 CB ARG A 38 -13.557 12.328 12.055 1.00 12.15 C ATOM 604 CG ARG A 38 -13.877 11.007 11.375 1.00 21.15 C ATOM 605 CD ARG A 38 -15.377 10.808 11.222 1.00 23.02 C ATOM 606 NE ARG A 38 -15.738 10.393 9.870 1.00 73.35 N ATOM 607 CZ ARG A 38 -15.510 9.176 9.389 1.00 60.43 C ATOM 608 NH1 ARG A 38 -14.924 8.259 10.147 1.00 73.14 N ATOM 609 NH2 ARG A 38 -15.868 8.873 8.147 1.00 12.43 N ATOM 0 H ARG A 38 -12.549 14.220 13.279 1.00 74.04 H new ATOM 0 HA ARG A 38 -11.423 12.096 11.938 1.00 74.02 H new ATOM 0 HB2 ARG A 38 -13.641 12.201 13.134 1.00 12.15 H new ATOM 0 HB3 ARG A 38 -14.302 13.067 11.762 1.00 12.15 H new ATOM 0 HG2 ARG A 38 -13.403 10.977 10.394 1.00 21.15 H new ATOM 0 HG3 ARG A 38 -13.457 10.186 11.957 1.00 21.15 H new ATOM 0 HD2 ARG A 38 -15.718 10.057 11.935 1.00 23.02 H new ATOM 0 HD3 ARG A 38 -15.893 11.737 11.466 1.00 23.02 H new ATOM 0 HE ARG A 38 -16.190 11.075 9.261 1.00 73.35 H new ATOM 0 HH11 ARG A 38 -14.647 8.487 11.102 1.00 73.14 H new ATOM 0 HH12 ARG A 38 -14.750 7.325 9.775 1.00 73.14 H new ATOM 0 HH21 ARG A 38 -16.319 9.575 7.561 1.00 12.43 H new ATOM 0 HH22 ARG A 38 -15.692 7.938 7.779 1.00 12.43 H new ATOM 623 N VAL A 39 -12.385 14.474 9.920 1.00 60.13 N ATOM 624 CA VAL A 39 -12.346 14.939 8.538 1.00 0.25 C ATOM 625 C VAL A 39 -10.981 14.683 7.911 1.00 45.23 C ATOM 626 O VAL A 39 -10.849 14.632 6.688 1.00 22.14 O ATOM 627 CB VAL A 39 -12.669 16.442 8.443 1.00 1.22 C ATOM 628 CG1 VAL A 39 -12.585 16.916 7.000 1.00 2.24 C ATOM 629 CG2 VAL A 39 -14.043 16.730 9.028 1.00 35.52 C ATOM 0 H VAL A 39 -12.659 15.186 10.597 1.00 60.13 H new ATOM 0 HA VAL A 39 -13.104 14.377 7.993 1.00 0.25 H new ATOM 0 HB VAL A 39 -11.929 16.992 9.025 1.00 1.22 H new ATOM 0 HG11 VAL A 39 -12.816 17.980 6.953 1.00 2.24 H new ATOM 0 HG12 VAL A 39 -11.578 16.746 6.619 1.00 2.24 H new ATOM 0 HG13 VAL A 39 -13.301 16.362 6.393 1.00 2.24 H new ATOM 0 HG21 VAL A 39 -14.254 17.797 8.952 1.00 35.52 H new ATOM 0 HG22 VAL A 39 -14.798 16.170 8.476 1.00 35.52 H new ATOM 0 HG23 VAL A 39 -14.063 16.430 10.076 1.00 35.52 H new ATOM 639 N GLU A 40 -9.967 14.523 8.756 1.00 32.41 N ATOM 640 CA GLU A 40 -8.611 14.272 8.283 1.00 61.01 C ATOM 641 C GLU A 40 -8.523 12.925 7.570 1.00 14.53 C ATOM 642 O GLU A 40 -7.679 12.728 6.696 1.00 20.11 O ATOM 643 CB GLU A 40 -7.624 14.308 9.452 1.00 34.30 C ATOM 644 CG GLU A 40 -6.238 14.793 9.064 1.00 41.42 C ATOM 645 CD GLU A 40 -5.799 16.004 9.864 1.00 43.31 C ATOM 646 OE1 GLU A 40 -5.726 15.899 11.106 1.00 13.23 O ATOM 647 OE2 GLU A 40 -5.528 17.056 9.248 1.00 1.45 O ATOM 0 H GLU A 40 -10.059 14.563 9.771 1.00 32.41 H new ATOM 0 HA GLU A 40 -8.351 15.057 7.573 1.00 61.01 H new ATOM 0 HB2 GLU A 40 -8.022 14.957 10.232 1.00 34.30 H new ATOM 0 HB3 GLU A 40 -7.543 13.308 9.879 1.00 34.30 H new ATOM 0 HG2 GLU A 40 -5.520 13.986 9.210 1.00 41.42 H new ATOM 0 HG3 GLU A 40 -6.227 15.040 8.002 1.00 41.42 H new ATOM 654 N ILE A 41 -9.401 12.003 7.951 1.00 51.32 N ATOM 655 CA ILE A 41 -9.424 10.676 7.348 1.00 4.24 C ATOM 656 C ILE A 41 -9.574 10.763 5.833 1.00 24.44 C ATOM 657 O ILE A 41 -9.220 9.831 5.110 1.00 31.55 O ATOM 658 CB ILE A 41 -10.569 9.819 7.918 1.00 21.43 C ATOM 659 CG1 ILE A 41 -11.921 10.356 7.446 1.00 73.13 C ATOM 660 CG2 ILE A 41 -10.505 9.792 9.438 1.00 11.21 C ATOM 661 CD1 ILE A 41 -12.551 9.526 6.349 1.00 34.12 C ATOM 0 H ILE A 41 -10.105 12.150 8.674 1.00 51.32 H new ATOM 0 HA ILE A 41 -8.472 10.203 7.589 1.00 4.24 H new ATOM 0 HB ILE A 41 -10.456 8.799 7.551 1.00 21.43 H new ATOM 0 HG12 ILE A 41 -12.603 10.398 8.295 1.00 73.13 H new ATOM 0 HG13 ILE A 41 -11.792 11.378 7.089 1.00 73.13 H new ATOM 0 HG21 ILE A 41 -11.321 9.182 9.826 1.00 11.21 H new ATOM 0 HG22 ILE A 41 -9.552 9.367 9.755 1.00 11.21 H new ATOM 0 HG23 ILE A 41 -10.596 10.807 9.824 1.00 11.21 H new ATOM 0 HD11 ILE A 41 -13.507 9.965 6.064 1.00 34.12 H new ATOM 0 HD12 ILE A 41 -11.889 9.504 5.483 1.00 34.12 H new ATOM 0 HD13 ILE A 41 -12.712 8.510 6.708 1.00 34.12 H new ATOM 673 N ILE A 42 -10.098 11.888 5.360 1.00 71.34 N ATOM 674 CA ILE A 42 -10.292 12.097 3.930 1.00 22.02 C ATOM 675 C ILE A 42 -9.012 11.807 3.154 1.00 61.54 C ATOM 676 O ILE A 42 -9.057 11.394 1.995 1.00 1.11 O ATOM 677 CB ILE A 42 -10.746 13.537 3.629 1.00 52.35 C ATOM 678 CG1 ILE A 42 -11.227 13.651 2.180 1.00 21.14 C ATOM 679 CG2 ILE A 42 -9.613 14.517 3.895 1.00 70.14 C ATOM 680 CD1 ILE A 42 -10.140 14.065 1.214 1.00 63.55 C ATOM 0 H ILE A 42 -10.396 12.669 5.945 1.00 71.34 H new ATOM 0 HA ILE A 42 -11.072 11.405 3.612 1.00 22.02 H new ATOM 0 HB ILE A 42 -11.577 13.785 4.289 1.00 52.35 H new ATOM 0 HG12 ILE A 42 -11.636 12.691 1.865 1.00 21.14 H new ATOM 0 HG13 ILE A 42 -12.040 14.375 2.131 1.00 21.14 H new ATOM 0 HG21 ILE A 42 -9.950 15.531 3.677 1.00 70.14 H new ATOM 0 HG22 ILE A 42 -9.313 14.451 4.941 1.00 70.14 H new ATOM 0 HG23 ILE A 42 -8.763 14.273 3.258 1.00 70.14 H new ATOM 0 HD11 ILE A 42 -10.552 14.126 0.207 1.00 63.55 H new ATOM 0 HD12 ILE A 42 -9.747 15.039 1.504 1.00 63.55 H new ATOM 0 HD13 ILE A 42 -9.336 13.329 1.234 1.00 63.55 H new ATOM 692 N ALA A 43 -7.872 12.023 3.801 1.00 44.11 N ATOM 693 CA ALA A 43 -6.579 11.781 3.173 1.00 62.13 C ATOM 694 C ALA A 43 -6.201 10.305 3.246 1.00 43.51 C ATOM 695 O ALA A 43 -5.740 9.725 2.264 1.00 63.40 O ATOM 696 CB ALA A 43 -5.505 12.636 3.829 1.00 42.25 C ATOM 0 H ALA A 43 -7.817 12.365 4.760 1.00 44.11 H new ATOM 0 HA ALA A 43 -6.656 12.058 2.122 1.00 62.13 H new ATOM 0 HB1 ALA A 43 -4.545 12.445 3.350 1.00 42.25 H new ATOM 0 HB2 ALA A 43 -5.762 13.690 3.720 1.00 42.25 H new ATOM 0 HB3 ALA A 43 -5.438 12.387 4.888 1.00 42.25 H new ATOM 702 N GLU A 44 -6.398 9.706 4.416 1.00 73.12 N ATOM 703 CA GLU A 44 -6.076 8.298 4.616 1.00 61.01 C ATOM 704 C GLU A 44 -6.909 7.413 3.693 1.00 22.44 C ATOM 705 O GLU A 44 -6.519 6.290 3.376 1.00 75.24 O ATOM 706 CB GLU A 44 -6.313 7.900 6.074 1.00 33.21 C ATOM 707 CG GLU A 44 -5.823 6.502 6.411 1.00 70.42 C ATOM 708 CD GLU A 44 -5.606 6.302 7.898 1.00 23.02 C ATOM 709 OE1 GLU A 44 -6.508 6.660 8.684 1.00 72.45 O ATOM 710 OE2 GLU A 44 -4.532 5.787 8.277 1.00 54.55 O ATOM 0 H GLU A 44 -6.779 10.173 5.239 1.00 73.12 H new ATOM 0 HA GLU A 44 -5.023 8.155 4.375 1.00 61.01 H new ATOM 0 HB2 GLU A 44 -5.812 8.618 6.724 1.00 33.21 H new ATOM 0 HB3 GLU A 44 -7.379 7.964 6.290 1.00 33.21 H new ATOM 0 HG2 GLU A 44 -6.547 5.771 6.052 1.00 70.42 H new ATOM 0 HG3 GLU A 44 -4.889 6.311 5.883 1.00 70.42 H new ATOM 717 N ASN A 45 -8.058 7.927 3.268 1.00 40.31 N ATOM 718 CA ASN A 45 -8.947 7.184 2.383 1.00 73.31 C ATOM 719 C ASN A 45 -9.217 7.965 1.101 1.00 42.33 C ATOM 720 O ASN A 45 -10.287 8.544 0.910 1.00 4.45 O ATOM 721 CB ASN A 45 -10.267 6.876 3.093 1.00 52.20 C ATOM 722 CG ASN A 45 -10.358 5.431 3.544 1.00 1.21 C ATOM 723 OD1 ASN A 45 -9.787 5.051 4.566 1.00 5.33 O ATOM 724 ND2 ASN A 45 -11.079 4.617 2.781 1.00 4.52 N ATOM 0 H ASN A 45 -8.395 8.855 3.522 1.00 40.31 H new ATOM 0 HA ASN A 45 -8.456 6.247 2.120 1.00 73.31 H new ATOM 0 HB2 ASN A 45 -10.373 7.531 3.958 1.00 52.20 H new ATOM 0 HB3 ASN A 45 -11.097 7.097 2.422 1.00 52.20 H new ATOM 0 HD21 ASN A 45 -11.176 3.634 3.034 1.00 4.52 H new ATOM 0 HD22 ASN A 45 -11.535 4.975 1.942 1.00 4.52 H new ATOM 731 N PRO A 46 -8.224 7.983 0.199 1.00 74.34 N ATOM 732 CA PRO A 46 -8.331 8.688 -1.082 1.00 3.41 C ATOM 733 C PRO A 46 -9.316 8.018 -2.033 1.00 63.33 C ATOM 734 O PRO A 46 -9.637 8.559 -3.091 1.00 11.15 O ATOM 735 CB PRO A 46 -6.909 8.617 -1.646 1.00 34.44 C ATOM 736 CG PRO A 46 -6.311 7.408 -1.012 1.00 11.42 C ATOM 737 CD PRO A 46 -6.922 7.314 0.359 1.00 51.31 C ATOM 0 HA PRO A 46 -8.705 9.704 -0.957 1.00 3.41 H new ATOM 0 HB2 PRO A 46 -6.918 8.531 -2.733 1.00 34.44 H new ATOM 0 HB3 PRO A 46 -6.341 9.514 -1.402 1.00 34.44 H new ATOM 0 HG2 PRO A 46 -6.526 6.514 -1.597 1.00 11.42 H new ATOM 0 HG3 PRO A 46 -5.226 7.496 -0.951 1.00 11.42 H new ATOM 0 HD2 PRO A 46 -7.039 6.278 0.677 1.00 51.31 H new ATOM 0 HD3 PRO A 46 -6.305 7.809 1.109 1.00 51.31 H new ATOM 745 N GLU A 47 -9.791 6.837 -1.650 1.00 71.11 N ATOM 746 CA GLU A 47 -10.740 6.093 -2.471 1.00 4.22 C ATOM 747 C GLU A 47 -12.033 6.881 -2.656 1.00 53.03 C ATOM 748 O GLU A 47 -12.485 7.096 -3.781 1.00 53.14 O ATOM 749 CB GLU A 47 -11.043 4.735 -1.835 1.00 13.24 C ATOM 750 CG GLU A 47 -11.449 3.670 -2.839 1.00 33.31 C ATOM 751 CD GLU A 47 -10.387 3.428 -3.894 1.00 74.30 C ATOM 752 OE1 GLU A 47 -9.492 2.591 -3.654 1.00 42.43 O ATOM 753 OE2 GLU A 47 -10.453 4.075 -4.960 1.00 41.20 O ATOM 0 H GLU A 47 -9.535 6.375 -0.777 1.00 71.11 H new ATOM 0 HA GLU A 47 -10.289 5.934 -3.450 1.00 4.22 H new ATOM 0 HB2 GLU A 47 -10.162 4.393 -1.292 1.00 13.24 H new ATOM 0 HB3 GLU A 47 -11.842 4.856 -1.103 1.00 13.24 H new ATOM 0 HG2 GLU A 47 -11.652 2.738 -2.312 1.00 33.31 H new ATOM 0 HG3 GLU A 47 -12.377 3.969 -3.325 1.00 33.31 H new ATOM 760 N ILE A 48 -12.624 7.308 -1.545 1.00 63.41 N ATOM 761 CA ILE A 48 -13.864 8.072 -1.585 1.00 34.52 C ATOM 762 C ILE A 48 -13.599 9.561 -1.396 1.00 51.34 C ATOM 763 O ILE A 48 -14.529 10.355 -1.260 1.00 52.54 O ATOM 764 CB ILE A 48 -14.853 7.597 -0.503 1.00 63.22 C ATOM 765 CG1 ILE A 48 -14.577 8.313 0.820 1.00 2.14 C ATOM 766 CG2 ILE A 48 -14.759 6.089 -0.325 1.00 61.22 C ATOM 767 CD1 ILE A 48 -13.151 8.165 1.302 1.00 65.31 C ATOM 0 H ILE A 48 -12.264 7.138 -0.606 1.00 63.41 H new ATOM 0 HA ILE A 48 -14.305 7.906 -2.568 1.00 34.52 H new ATOM 0 HB ILE A 48 -15.865 7.843 -0.823 1.00 63.22 H new ATOM 0 HG12 ILE A 48 -14.805 9.373 0.704 1.00 2.14 H new ATOM 0 HG13 ILE A 48 -15.252 7.923 1.582 1.00 2.14 H new ATOM 0 HG21 ILE A 48 -15.464 5.769 0.443 1.00 61.22 H new ATOM 0 HG22 ILE A 48 -14.999 5.596 -1.267 1.00 61.22 H new ATOM 0 HG23 ILE A 48 -13.747 5.821 -0.023 1.00 61.22 H new ATOM 0 HD11 ILE A 48 -13.028 8.698 2.245 1.00 65.31 H new ATOM 0 HD12 ILE A 48 -12.925 7.109 1.450 1.00 65.31 H new ATOM 0 HD13 ILE A 48 -12.471 8.581 0.559 1.00 65.31 H new ATOM 779 N ALA A 49 -12.323 9.933 -1.391 1.00 52.41 N ATOM 780 CA ALA A 49 -11.935 11.328 -1.224 1.00 10.45 C ATOM 781 C ALA A 49 -12.567 12.207 -2.298 1.00 64.11 C ATOM 782 O ALA A 49 -12.716 13.416 -2.118 1.00 73.40 O ATOM 783 CB ALA A 49 -10.420 11.462 -1.253 1.00 63.34 C ATOM 0 H ALA A 49 -11.541 9.288 -1.501 1.00 52.41 H new ATOM 0 HA ALA A 49 -12.300 11.667 -0.254 1.00 10.45 H new ATOM 0 HB1 ALA A 49 -10.145 12.509 -1.127 1.00 63.34 H new ATOM 0 HB2 ALA A 49 -9.987 10.873 -0.444 1.00 63.34 H new ATOM 0 HB3 ALA A 49 -10.041 11.100 -2.209 1.00 63.34 H new ATOM 789 N LYS A 50 -12.935 11.592 -3.417 1.00 12.21 N ATOM 790 CA LYS A 50 -13.551 12.317 -4.522 1.00 14.44 C ATOM 791 C LYS A 50 -15.036 11.983 -4.631 1.00 43.21 C ATOM 792 O LYS A 50 -15.602 11.983 -5.724 1.00 75.10 O ATOM 793 CB LYS A 50 -12.844 11.982 -5.837 1.00 1.35 C ATOM 794 CG LYS A 50 -11.539 12.734 -6.034 1.00 0.11 C ATOM 795 CD LYS A 50 -11.775 14.117 -6.617 1.00 41.13 C ATOM 796 CE LYS A 50 -10.482 14.736 -7.125 1.00 63.13 C ATOM 797 NZ LYS A 50 -9.527 15.014 -6.017 1.00 11.22 N ATOM 0 H LYS A 50 -12.817 10.592 -3.583 1.00 12.21 H new ATOM 0 HA LYS A 50 -13.450 13.384 -4.325 1.00 14.44 H new ATOM 0 HB2 LYS A 50 -12.645 10.911 -5.870 1.00 1.35 H new ATOM 0 HB3 LYS A 50 -13.513 12.208 -6.667 1.00 1.35 H new ATOM 0 HG2 LYS A 50 -11.022 12.824 -5.079 1.00 0.11 H new ATOM 0 HG3 LYS A 50 -10.887 12.165 -6.697 1.00 0.11 H new ATOM 0 HD2 LYS A 50 -12.493 14.051 -7.434 1.00 41.13 H new ATOM 0 HD3 LYS A 50 -12.215 14.763 -5.857 1.00 41.13 H new ATOM 0 HE2 LYS A 50 -10.016 14.064 -7.846 1.00 63.13 H new ATOM 0 HE3 LYS A 50 -10.706 15.663 -7.652 1.00 63.13 H new ATOM 0 HZ1 LYS A 50 -8.659 15.435 -6.405 1.00 11.22 H new ATOM 0 HZ2 LYS A 50 -9.961 15.675 -5.342 1.00 11.22 H new ATOM 0 HZ3 LYS A 50 -9.293 14.126 -5.529 1.00 11.22 H new ATOM 811 N ASP A 51 -15.659 11.701 -3.493 1.00 33.23 N ATOM 812 CA ASP A 51 -17.079 11.368 -3.461 1.00 23.42 C ATOM 813 C ASP A 51 -17.934 12.617 -3.643 1.00 15.22 C ATOM 814 O ASP A 51 -18.278 13.294 -2.673 1.00 61.14 O ATOM 815 CB ASP A 51 -17.433 10.679 -2.142 1.00 12.23 C ATOM 816 CG ASP A 51 -17.401 9.167 -2.251 1.00 12.52 C ATOM 817 OD1 ASP A 51 -16.681 8.651 -3.131 1.00 22.23 O ATOM 818 OD2 ASP A 51 -18.096 8.501 -1.456 1.00 23.14 O ATOM 0 H ASP A 51 -15.204 11.696 -2.580 1.00 33.23 H new ATOM 0 HA ASP A 51 -17.286 10.685 -4.285 1.00 23.42 H new ATOM 0 HB2 ASP A 51 -16.734 10.999 -1.369 1.00 12.23 H new ATOM 0 HB3 ASP A 51 -18.426 10.996 -1.825 1.00 12.23 H new ATOM 823 N VAL A 52 -18.275 12.918 -4.892 1.00 1.50 N ATOM 824 CA VAL A 52 -19.090 14.087 -5.202 1.00 34.35 C ATOM 825 C VAL A 52 -20.568 13.809 -4.947 1.00 63.44 C ATOM 826 O VAL A 52 -21.355 14.729 -4.730 1.00 43.43 O ATOM 827 CB VAL A 52 -18.907 14.527 -6.666 1.00 2.31 C ATOM 828 CG1 VAL A 52 -17.451 14.872 -6.941 1.00 52.34 C ATOM 829 CG2 VAL A 52 -19.395 13.442 -7.614 1.00 23.14 C ATOM 0 H VAL A 52 -17.999 12.368 -5.706 1.00 1.50 H new ATOM 0 HA VAL A 52 -18.755 14.890 -4.545 1.00 34.35 H new ATOM 0 HB VAL A 52 -19.506 15.421 -6.836 1.00 2.31 H new ATOM 0 HG11 VAL A 52 -17.340 15.181 -7.980 1.00 52.34 H new ATOM 0 HG12 VAL A 52 -17.140 15.685 -6.286 1.00 52.34 H new ATOM 0 HG13 VAL A 52 -16.828 13.997 -6.754 1.00 52.34 H new ATOM 0 HG21 VAL A 52 -19.258 13.770 -8.644 1.00 23.14 H new ATOM 0 HG22 VAL A 52 -18.825 12.528 -7.446 1.00 23.14 H new ATOM 0 HG23 VAL A 52 -20.452 13.249 -7.432 1.00 23.14 H new ATOM 839 N ALA A 53 -20.937 12.532 -4.975 1.00 52.44 N ATOM 840 CA ALA A 53 -22.320 12.132 -4.746 1.00 1.25 C ATOM 841 C ALA A 53 -22.636 12.080 -3.255 1.00 25.05 C ATOM 842 O ALA A 53 -23.794 12.184 -2.852 1.00 4.33 O ATOM 843 CB ALA A 53 -22.593 10.782 -5.392 1.00 52.54 C ATOM 0 H ALA A 53 -20.298 11.758 -5.154 1.00 52.44 H new ATOM 0 HA ALA A 53 -22.969 12.879 -5.203 1.00 1.25 H new ATOM 0 HB1 ALA A 53 -23.629 10.496 -5.213 1.00 52.54 H new ATOM 0 HB2 ALA A 53 -22.415 10.850 -6.465 1.00 52.54 H new ATOM 0 HB3 ALA A 53 -21.930 10.032 -4.961 1.00 52.54 H new ATOM 849 N ALA A 54 -21.598 11.917 -2.440 1.00 50.21 N ATOM 850 CA ALA A 54 -21.765 11.852 -0.994 1.00 12.44 C ATOM 851 C ALA A 54 -22.505 13.079 -0.471 1.00 4.41 C ATOM 852 O ALA A 54 -23.237 13.001 0.516 1.00 61.41 O ATOM 853 CB ALA A 54 -20.412 11.719 -0.311 1.00 42.03 C ATOM 0 H ALA A 54 -20.633 11.828 -2.757 1.00 50.21 H new ATOM 0 HA ALA A 54 -22.365 10.972 -0.762 1.00 12.44 H new ATOM 0 HB1 ALA A 54 -20.553 11.672 0.769 1.00 42.03 H new ATOM 0 HB2 ALA A 54 -19.920 10.809 -0.653 1.00 42.03 H new ATOM 0 HB3 ALA A 54 -19.793 12.581 -0.559 1.00 42.03 H new ATOM 859 N ILE A 55 -22.308 14.212 -1.138 1.00 23.42 N ATOM 860 CA ILE A 55 -22.957 15.455 -0.740 1.00 25.31 C ATOM 861 C ILE A 55 -24.472 15.351 -0.874 1.00 50.21 C ATOM 862 O ILE A 55 -25.216 15.889 -0.056 1.00 14.23 O ATOM 863 CB ILE A 55 -22.458 16.644 -1.581 1.00 40.43 C ATOM 864 CG1 ILE A 55 -20.944 16.806 -1.428 1.00 52.45 C ATOM 865 CG2 ILE A 55 -23.177 17.921 -1.172 1.00 1.14 C ATOM 866 CD1 ILE A 55 -20.163 16.367 -2.647 1.00 74.12 C ATOM 0 H ILE A 55 -21.704 14.294 -1.956 1.00 23.42 H new ATOM 0 HA ILE A 55 -22.699 15.626 0.305 1.00 25.31 H new ATOM 0 HB ILE A 55 -22.679 16.446 -2.630 1.00 40.43 H new ATOM 0 HG12 ILE A 55 -20.718 17.852 -1.219 1.00 52.45 H new ATOM 0 HG13 ILE A 55 -20.610 16.229 -0.566 1.00 52.45 H new ATOM 0 HG21 ILE A 55 -22.813 18.753 -1.776 1.00 1.14 H new ATOM 0 HG22 ILE A 55 -24.249 17.801 -1.328 1.00 1.14 H new ATOM 0 HG23 ILE A 55 -22.984 18.126 -0.119 1.00 1.14 H new ATOM 0 HD11 ILE A 55 -19.097 16.510 -2.467 1.00 74.12 H new ATOM 0 HD12 ILE A 55 -20.359 15.313 -2.845 1.00 74.12 H new ATOM 0 HD13 ILE A 55 -20.469 16.961 -3.508 1.00 74.12 H new ATOM 878 N GLY A 56 -24.923 14.654 -1.913 1.00 24.45 N ATOM 879 CA GLY A 56 -26.347 14.490 -2.134 1.00 54.24 C ATOM 880 C GLY A 56 -26.932 13.348 -1.328 1.00 75.43 C ATOM 881 O GLY A 56 -28.115 13.362 -0.984 1.00 64.42 O ATOM 0 H GLY A 56 -24.327 14.200 -2.605 1.00 24.45 H new ATOM 0 HA2 GLY A 56 -26.861 15.415 -1.873 1.00 54.24 H new ATOM 0 HA3 GLY A 56 -26.529 14.313 -3.194 1.00 54.24 H new ATOM 885 N LYS A 57 -26.104 12.353 -1.027 1.00 12.41 N ATOM 886 CA LYS A 57 -26.545 11.197 -0.257 1.00 30.54 C ATOM 887 C LYS A 57 -26.502 11.491 1.240 1.00 71.45 C ATOM 888 O LYS A 57 -27.183 10.837 2.030 1.00 41.45 O ATOM 889 CB LYS A 57 -25.669 9.983 -0.574 1.00 23.31 C ATOM 890 CG LYS A 57 -26.316 8.656 -0.218 1.00 71.52 C ATOM 891 CD LYS A 57 -25.308 7.519 -0.244 1.00 31.21 C ATOM 892 CE LYS A 57 -24.314 7.630 0.902 1.00 61.52 C ATOM 893 NZ LYS A 57 -23.495 6.394 1.047 1.00 11.20 N ATOM 0 H LYS A 57 -25.123 12.325 -1.305 1.00 12.41 H new ATOM 0 HA LYS A 57 -27.575 10.977 -0.537 1.00 30.54 H new ATOM 0 HB2 LYS A 57 -25.429 9.987 -1.637 1.00 23.31 H new ATOM 0 HB3 LYS A 57 -24.727 10.075 -0.034 1.00 23.31 H new ATOM 0 HG2 LYS A 57 -26.764 8.723 0.773 1.00 71.52 H new ATOM 0 HG3 LYS A 57 -27.123 8.444 -0.919 1.00 71.52 H new ATOM 0 HD2 LYS A 57 -25.832 6.565 -0.182 1.00 31.21 H new ATOM 0 HD3 LYS A 57 -24.773 7.527 -1.194 1.00 31.21 H new ATOM 0 HE2 LYS A 57 -23.657 8.483 0.732 1.00 61.52 H new ATOM 0 HE3 LYS A 57 -24.851 7.821 1.831 1.00 61.52 H new ATOM 0 HZ1 LYS A 57 -22.830 6.509 1.838 1.00 11.20 H new ATOM 0 HZ2 LYS A 57 -24.119 5.584 1.235 1.00 11.20 H new ATOM 0 HZ3 LYS A 57 -22.963 6.225 0.169 1.00 11.20 H new ATOM 907 N MET A 58 -25.699 12.478 1.621 1.00 42.30 N ATOM 908 CA MET A 58 -25.570 12.860 3.023 1.00 51.15 C ATOM 909 C MET A 58 -26.941 13.089 3.652 1.00 43.33 C ATOM 910 O MET A 58 -27.129 12.870 4.849 1.00 44.23 O ATOM 911 CB MET A 58 -24.718 14.124 3.153 1.00 54.22 C ATOM 912 CG MET A 58 -25.495 15.408 2.910 1.00 51.14 C ATOM 913 SD MET A 58 -24.424 16.853 2.775 1.00 75.40 S ATOM 914 CE MET A 58 -24.864 17.740 4.267 1.00 11.13 C ATOM 0 H MET A 58 -25.128 13.028 0.979 1.00 42.30 H new ATOM 0 HA MET A 58 -25.079 12.044 3.553 1.00 51.15 H new ATOM 0 HB2 MET A 58 -24.281 14.157 4.151 1.00 54.22 H new ATOM 0 HB3 MET A 58 -23.891 14.070 2.445 1.00 54.22 H new ATOM 0 HG2 MET A 58 -26.079 15.307 1.995 1.00 51.14 H new ATOM 0 HG3 MET A 58 -26.203 15.560 3.725 1.00 51.14 H new ATOM 0 HE1 MET A 58 -24.625 18.797 4.146 1.00 11.13 H new ATOM 0 HE2 MET A 58 -25.932 17.629 4.455 1.00 11.13 H new ATOM 0 HE3 MET A 58 -24.303 17.335 5.110 1.00 11.13 H new ATOM 924 N ILE A 59 -27.894 13.531 2.838 1.00 3.11 N ATOM 925 CA ILE A 59 -29.246 13.789 3.316 1.00 75.31 C ATOM 926 C ILE A 59 -29.841 12.550 3.978 1.00 2.41 C ATOM 927 O ILE A 59 -30.155 12.560 5.168 1.00 62.24 O ATOM 928 CB ILE A 59 -30.172 14.239 2.170 1.00 31.42 C ATOM 929 CG1 ILE A 59 -29.567 15.437 1.437 1.00 3.41 C ATOM 930 CG2 ILE A 59 -31.553 14.582 2.709 1.00 41.33 C ATOM 931 CD1 ILE A 59 -29.328 16.634 2.331 1.00 45.34 C ATOM 0 H ILE A 59 -27.754 13.718 1.845 1.00 3.11 H new ATOM 0 HA ILE A 59 -29.173 14.591 4.050 1.00 75.31 H new ATOM 0 HB ILE A 59 -30.274 13.418 1.461 1.00 31.42 H new ATOM 0 HG12 ILE A 59 -28.622 15.137 0.985 1.00 3.41 H new ATOM 0 HG13 ILE A 59 -30.231 15.728 0.623 1.00 3.41 H new ATOM 0 HG21 ILE A 59 -32.196 14.898 1.888 1.00 41.33 H new ATOM 0 HG22 ILE A 59 -31.984 13.704 3.190 1.00 41.33 H new ATOM 0 HG23 ILE A 59 -31.469 15.390 3.436 1.00 41.33 H new ATOM 0 HD11 ILE A 59 -28.898 17.446 1.745 1.00 45.34 H new ATOM 0 HD12 ILE A 59 -30.274 16.960 2.763 1.00 45.34 H new ATOM 0 HD13 ILE A 59 -28.640 16.359 3.130 1.00 45.34 H new ATOM 943 N GLY A 60 -29.991 11.483 3.199 1.00 40.51 N ATOM 944 CA GLY A 60 -30.546 10.251 3.727 1.00 24.14 C ATOM 945 C GLY A 60 -29.615 9.572 4.713 1.00 51.21 C ATOM 946 O GLY A 60 -30.050 8.762 5.530 1.00 31.42 O ATOM 0 H GLY A 60 -29.738 11.450 2.211 1.00 40.51 H new ATOM 0 HA2 GLY A 60 -31.496 10.465 4.217 1.00 24.14 H new ATOM 0 HA3 GLY A 60 -30.758 9.569 2.903 1.00 24.14 H new ATOM 950 N ALA A 61 -28.330 9.903 4.635 1.00 71.41 N ATOM 951 CA ALA A 61 -27.336 9.319 5.527 1.00 0.42 C ATOM 952 C ALA A 61 -27.329 10.027 6.878 1.00 24.21 C ATOM 953 O ALA A 61 -26.819 9.496 7.864 1.00 4.14 O ATOM 954 CB ALA A 61 -25.955 9.379 4.890 1.00 15.23 C ATOM 0 H ALA A 61 -27.953 10.572 3.964 1.00 71.41 H new ATOM 0 HA ALA A 61 -27.602 8.275 5.694 1.00 0.42 H new ATOM 0 HB1 ALA A 61 -25.223 8.939 5.567 1.00 15.23 H new ATOM 0 HB2 ALA A 61 -25.962 8.823 3.953 1.00 15.23 H new ATOM 0 HB3 ALA A 61 -25.690 10.418 4.693 1.00 15.23 H new ATOM 960 N ALA A 62 -27.897 11.228 6.915 1.00 22.41 N ATOM 961 CA ALA A 62 -27.956 12.007 8.146 1.00 74.15 C ATOM 962 C ALA A 62 -28.517 11.176 9.295 1.00 41.11 C ATOM 963 O ALA A 62 -28.097 11.324 10.443 1.00 50.45 O ATOM 964 CB ALA A 62 -28.797 13.258 7.938 1.00 44.25 C ATOM 0 H ALA A 62 -28.323 11.682 6.107 1.00 22.41 H new ATOM 0 HA ALA A 62 -26.941 12.304 8.409 1.00 74.15 H new ATOM 0 HB1 ALA A 62 -28.833 13.831 8.865 1.00 44.25 H new ATOM 0 HB2 ALA A 62 -28.353 13.868 7.151 1.00 44.25 H new ATOM 0 HB3 ALA A 62 -29.808 12.973 7.649 1.00 44.25 H new ATOM 970 N TRP A 63 -29.467 10.303 8.979 1.00 3.32 N ATOM 971 CA TRP A 63 -30.085 9.449 9.987 1.00 52.21 C ATOM 972 C TRP A 63 -29.225 8.220 10.261 1.00 12.41 C ATOM 973 O TRP A 63 -29.226 7.686 11.369 1.00 10.02 O ATOM 974 CB TRP A 63 -31.481 9.019 9.533 1.00 12.24 C ATOM 975 CG TRP A 63 -32.373 10.171 9.181 1.00 4.42 C ATOM 976 CD1 TRP A 63 -32.337 11.428 9.715 1.00 40.12 C ATOM 977 CD2 TRP A 63 -33.433 10.172 8.219 1.00 64.12 C ATOM 978 NE1 TRP A 63 -33.311 12.210 9.142 1.00 31.21 N ATOM 979 CE2 TRP A 63 -33.996 11.463 8.221 1.00 73.13 C ATOM 980 CE3 TRP A 63 -33.959 9.208 7.354 1.00 11.44 C ATOM 981 CZ2 TRP A 63 -35.060 11.811 7.393 1.00 41.54 C ATOM 982 CZ3 TRP A 63 -35.015 9.556 6.533 1.00 21.14 C ATOM 983 CH2 TRP A 63 -35.556 10.848 6.556 1.00 3.44 C ATOM 0 H TRP A 63 -29.826 10.168 8.034 1.00 3.32 H new ATOM 0 HA TRP A 63 -30.171 10.022 10.910 1.00 52.21 H new ATOM 0 HB2 TRP A 63 -31.388 8.363 8.667 1.00 12.24 H new ATOM 0 HB3 TRP A 63 -31.949 8.435 10.326 1.00 12.24 H new ATOM 0 HD1 TRP A 63 -31.645 11.758 10.475 1.00 40.12 H new ATOM 0 HE1 TRP A 63 -33.494 13.188 9.366 1.00 31.21 H new ATOM 0 HE3 TRP A 63 -33.548 8.210 7.328 1.00 11.44 H new ATOM 0 HZ2 TRP A 63 -35.479 12.806 7.411 1.00 41.54 H new ATOM 0 HZ3 TRP A 63 -35.430 8.819 5.862 1.00 21.14 H new ATOM 0 HH2 TRP A 63 -36.380 11.089 5.901 1.00 3.44 H new ATOM 994 N ASN A 64 -28.492 7.777 9.245 1.00 53.53 N ATOM 995 CA ASN A 64 -27.628 6.611 9.377 1.00 24.53 C ATOM 996 C ASN A 64 -26.218 7.022 9.790 1.00 43.33 C ATOM 997 O ASN A 64 -25.285 6.222 9.734 1.00 61.41 O ATOM 998 CB ASN A 64 -27.579 5.833 8.060 1.00 13.33 C ATOM 999 CG ASN A 64 -28.858 5.061 7.797 1.00 2.34 C ATOM 1000 OD1 ASN A 64 -29.060 3.972 8.335 1.00 51.24 O ATOM 1001 ND2 ASN A 64 -29.728 5.624 6.967 1.00 72.52 N ATOM 0 H ASN A 64 -28.479 8.209 8.321 1.00 53.53 H new ATOM 0 HA ASN A 64 -28.043 5.970 10.155 1.00 24.53 H new ATOM 0 HB2 ASN A 64 -27.401 6.526 7.238 1.00 13.33 H new ATOM 0 HB3 ASN A 64 -26.738 5.140 8.081 1.00 13.33 H new ATOM 0 HD21 ASN A 64 -30.606 5.152 6.752 1.00 72.52 H new ATOM 0 HD22 ASN A 64 -29.518 6.528 6.544 1.00 72.52 H new ATOM 1008 N ALA A 65 -26.071 8.276 10.204 1.00 2.43 N ATOM 1009 CA ALA A 65 -24.776 8.794 10.629 1.00 50.13 C ATOM 1010 C ALA A 65 -24.376 8.227 11.987 1.00 74.03 C ATOM 1011 O ALA A 65 -23.202 7.952 12.235 1.00 43.01 O ATOM 1012 CB ALA A 65 -24.806 10.314 10.678 1.00 43.55 C ATOM 0 H ALA A 65 -26.833 8.952 10.254 1.00 2.43 H new ATOM 0 HA ALA A 65 -24.030 8.479 9.899 1.00 50.13 H new ATOM 0 HB1 ALA A 65 -23.833 10.687 10.997 1.00 43.55 H new ATOM 0 HB2 ALA A 65 -25.038 10.705 9.688 1.00 43.55 H new ATOM 0 HB3 ALA A 65 -25.569 10.640 11.385 1.00 43.55 H new ATOM 1018 N LEU A 66 -25.360 8.055 12.863 1.00 22.21 N ATOM 1019 CA LEU A 66 -25.111 7.521 14.198 1.00 65.45 C ATOM 1020 C LEU A 66 -25.246 6.001 14.210 1.00 51.40 C ATOM 1021 O LEU A 66 -25.655 5.397 13.219 1.00 70.51 O ATOM 1022 CB LEU A 66 -26.081 8.139 15.205 1.00 31.13 C ATOM 1023 CG LEU A 66 -25.643 9.462 15.834 1.00 21.25 C ATOM 1024 CD1 LEU A 66 -24.436 9.250 16.736 1.00 53.52 C ATOM 1025 CD2 LEU A 66 -25.331 10.488 14.755 1.00 13.42 C ATOM 0 H LEU A 66 -26.337 8.277 12.673 1.00 22.21 H new ATOM 0 HA LEU A 66 -24.091 7.779 14.481 1.00 65.45 H new ATOM 0 HB2 LEU A 66 -27.038 8.295 14.708 1.00 31.13 H new ATOM 0 HB3 LEU A 66 -26.251 7.418 16.005 1.00 31.13 H new ATOM 0 HG LEU A 66 -26.463 9.843 16.442 1.00 21.25 H new ATOM 0 HD11 LEU A 66 -24.138 10.202 17.175 1.00 53.52 H new ATOM 0 HD12 LEU A 66 -24.694 8.549 17.530 1.00 53.52 H new ATOM 0 HD13 LEU A 66 -23.610 8.847 16.150 1.00 53.52 H new ATOM 0 HD21 LEU A 66 -25.021 11.423 15.221 1.00 13.42 H new ATOM 0 HD22 LEU A 66 -24.527 10.115 14.120 1.00 13.42 H new ATOM 0 HD23 LEU A 66 -26.221 10.662 14.150 1.00 13.42 H new ATOM 1037 N SER A 67 -24.902 5.391 15.339 1.00 20.14 N ATOM 1038 CA SER A 67 -24.984 3.942 15.481 1.00 63.13 C ATOM 1039 C SER A 67 -26.424 3.462 15.333 1.00 14.03 C ATOM 1040 O SER A 67 -27.364 4.152 15.729 1.00 2.42 O ATOM 1041 CB SER A 67 -24.426 3.508 16.838 1.00 51.32 C ATOM 1042 OG SER A 67 -24.668 2.132 17.072 1.00 22.23 O ATOM 0 H SER A 67 -24.564 5.878 16.169 1.00 20.14 H new ATOM 0 HA SER A 67 -24.386 3.490 14.690 1.00 63.13 H new ATOM 0 HB2 SER A 67 -23.354 3.703 16.873 1.00 51.32 H new ATOM 0 HB3 SER A 67 -24.884 4.101 17.630 1.00 51.32 H new ATOM 0 HG SER A 67 -24.300 1.879 17.945 1.00 22.23 H new ATOM 1048 N ASP A 68 -26.590 2.275 14.761 1.00 31.31 N ATOM 1049 CA ASP A 68 -27.916 1.700 14.562 1.00 44.45 C ATOM 1050 C ASP A 68 -28.547 1.315 15.896 1.00 54.15 C ATOM 1051 O ASP A 68 -29.692 1.669 16.176 1.00 50.23 O ATOM 1052 CB ASP A 68 -27.832 0.475 13.650 1.00 40.21 C ATOM 1053 CG ASP A 68 -27.476 0.839 12.222 1.00 50.31 C ATOM 1054 OD1 ASP A 68 -26.965 1.958 12.005 1.00 31.30 O ATOM 1055 OD2 ASP A 68 -27.709 0.006 11.321 1.00 12.10 O ATOM 0 H ASP A 68 -25.823 1.692 14.427 1.00 31.31 H new ATOM 0 HA ASP A 68 -28.545 2.454 14.088 1.00 44.45 H new ATOM 0 HB2 ASP A 68 -27.086 -0.216 14.042 1.00 40.21 H new ATOM 0 HB3 ASP A 68 -28.788 -0.048 13.661 1.00 40.21 H new ATOM 1060 N GLU A 69 -27.793 0.587 16.713 1.00 15.03 N ATOM 1061 CA GLU A 69 -28.281 0.152 18.017 1.00 55.41 C ATOM 1062 C GLU A 69 -28.702 1.348 18.867 1.00 44.11 C ATOM 1063 O GLU A 69 -29.598 1.243 19.703 1.00 20.03 O ATOM 1064 CB GLU A 69 -27.204 -0.653 18.747 1.00 55.12 C ATOM 1065 CG GLU A 69 -26.681 -1.834 17.947 1.00 4.20 C ATOM 1066 CD GLU A 69 -27.731 -2.906 17.734 1.00 75.04 C ATOM 1067 OE1 GLU A 69 -28.298 -3.390 18.736 1.00 70.15 O ATOM 1068 OE2 GLU A 69 -27.987 -3.261 16.564 1.00 51.33 O ATOM 0 H GLU A 69 -26.843 0.286 16.496 1.00 15.03 H new ATOM 0 HA GLU A 69 -29.152 -0.483 17.857 1.00 55.41 H new ATOM 0 HB2 GLU A 69 -26.372 0.007 18.991 1.00 55.12 H new ATOM 0 HB3 GLU A 69 -27.611 -1.016 19.691 1.00 55.12 H new ATOM 0 HG2 GLU A 69 -26.325 -1.483 16.979 1.00 4.20 H new ATOM 0 HG3 GLU A 69 -25.825 -2.267 18.464 1.00 4.20 H new ATOM 1075 N GLU A 70 -28.046 2.483 18.646 1.00 54.43 N ATOM 1076 CA GLU A 70 -28.351 3.698 19.392 1.00 10.33 C ATOM 1077 C GLU A 70 -29.339 4.574 18.627 1.00 44.23 C ATOM 1078 O GLU A 70 -29.761 5.624 19.112 1.00 73.12 O ATOM 1079 CB GLU A 70 -27.069 4.484 19.676 1.00 51.20 C ATOM 1080 CG GLU A 70 -26.641 4.446 21.133 1.00 35.45 C ATOM 1081 CD GLU A 70 -27.743 4.889 22.077 1.00 42.34 C ATOM 1082 OE1 GLU A 70 -28.703 5.533 21.605 1.00 55.03 O ATOM 1083 OE2 GLU A 70 -27.644 4.593 23.286 1.00 54.43 O ATOM 0 H GLU A 70 -27.301 2.586 17.957 1.00 54.43 H new ATOM 0 HA GLU A 70 -28.808 3.407 20.338 1.00 10.33 H new ATOM 0 HB2 GLU A 70 -26.264 4.084 19.059 1.00 51.20 H new ATOM 0 HB3 GLU A 70 -27.215 5.522 19.376 1.00 51.20 H new ATOM 0 HG2 GLU A 70 -26.332 3.433 21.391 1.00 35.45 H new ATOM 0 HG3 GLU A 70 -25.771 5.089 21.269 1.00 35.45 H new ATOM 1090 N LYS A 71 -29.702 4.135 17.426 1.00 12.44 N ATOM 1091 CA LYS A 71 -30.640 4.877 16.592 1.00 72.11 C ATOM 1092 C LYS A 71 -32.077 4.458 16.885 1.00 55.50 C ATOM 1093 O LYS A 71 -33.026 5.120 16.462 1.00 31.41 O ATOM 1094 CB LYS A 71 -30.324 4.653 15.111 1.00 15.23 C ATOM 1095 CG LYS A 71 -31.287 5.357 14.171 1.00 52.41 C ATOM 1096 CD LYS A 71 -30.831 5.254 12.725 1.00 23.13 C ATOM 1097 CE LYS A 71 -31.812 4.449 11.887 1.00 13.41 C ATOM 1098 NZ LYS A 71 -31.166 3.876 10.674 1.00 31.02 N ATOM 0 H LYS A 71 -29.361 3.269 17.009 1.00 12.44 H new ATOM 0 HA LYS A 71 -30.535 5.937 16.824 1.00 72.11 H new ATOM 0 HB2 LYS A 71 -29.311 5.001 14.908 1.00 15.23 H new ATOM 0 HB3 LYS A 71 -30.342 3.583 14.902 1.00 15.23 H new ATOM 0 HG2 LYS A 71 -32.280 4.920 14.272 1.00 52.41 H new ATOM 0 HG3 LYS A 71 -31.370 6.407 14.453 1.00 52.41 H new ATOM 0 HD2 LYS A 71 -30.726 6.254 12.304 1.00 23.13 H new ATOM 0 HD3 LYS A 71 -29.847 4.786 12.685 1.00 23.13 H new ATOM 0 HE2 LYS A 71 -32.230 3.643 12.491 1.00 13.41 H new ATOM 0 HE3 LYS A 71 -32.644 5.087 11.588 1.00 13.41 H new ATOM 0 HZ1 LYS A 71 -31.868 3.335 10.130 1.00 31.02 H new ATOM 0 HZ2 LYS A 71 -30.790 4.646 10.085 1.00 31.02 H new ATOM 0 HZ3 LYS A 71 -30.389 3.247 10.959 1.00 31.02 H new ATOM 1112 N LYS A 72 -32.232 3.357 17.612 1.00 4.45 N ATOM 1113 CA LYS A 72 -33.553 2.852 17.965 1.00 21.42 C ATOM 1114 C LYS A 72 -34.275 3.819 18.898 1.00 25.32 C ATOM 1115 O LYS A 72 -35.414 4.217 18.658 1.00 54.03 O ATOM 1116 CB LYS A 72 -33.435 1.478 18.629 1.00 32.22 C ATOM 1117 CG LYS A 72 -32.365 0.594 18.012 1.00 30.23 C ATOM 1118 CD LYS A 72 -32.528 0.490 16.505 1.00 31.12 C ATOM 1119 CE LYS A 72 -33.878 -0.102 16.130 1.00 12.12 C ATOM 1120 NZ LYS A 72 -34.119 -1.406 16.807 1.00 34.20 N ATOM 0 H LYS A 72 -31.458 2.797 17.969 1.00 4.45 H new ATOM 0 HA LYS A 72 -34.135 2.758 17.048 1.00 21.42 H new ATOM 0 HB2 LYS A 72 -33.216 1.613 19.688 1.00 32.22 H new ATOM 0 HB3 LYS A 72 -34.397 0.969 18.565 1.00 32.22 H new ATOM 0 HG2 LYS A 72 -31.380 0.997 18.245 1.00 30.23 H new ATOM 0 HG3 LYS A 72 -32.415 -0.401 18.454 1.00 30.23 H new ATOM 0 HD2 LYS A 72 -32.426 1.479 16.058 1.00 31.12 H new ATOM 0 HD3 LYS A 72 -31.731 -0.129 16.094 1.00 31.12 H new ATOM 0 HE2 LYS A 72 -34.669 0.598 16.399 1.00 12.12 H new ATOM 0 HE3 LYS A 72 -33.927 -0.239 15.050 1.00 12.12 H new ATOM 0 HZ1 LYS A 72 -34.933 -1.880 16.367 1.00 34.20 H new ATOM 0 HZ2 LYS A 72 -33.276 -2.007 16.713 1.00 34.20 H new ATOM 0 HZ3 LYS A 72 -34.317 -1.243 17.815 1.00 34.20 H new ATOM 1134 N PRO A 73 -33.597 4.208 19.988 1.00 24.43 N ATOM 1135 CA PRO A 73 -34.154 5.135 20.978 1.00 25.50 C ATOM 1136 C PRO A 73 -34.285 6.553 20.434 1.00 74.10 C ATOM 1137 O PRO A 73 -35.008 7.378 20.994 1.00 42.14 O ATOM 1138 CB PRO A 73 -33.133 5.092 22.118 1.00 63.22 C ATOM 1139 CG PRO A 73 -31.854 4.692 21.466 1.00 31.54 C ATOM 1140 CD PRO A 73 -32.234 3.773 20.338 1.00 20.33 C ATOM 0 HA PRO A 73 -35.162 4.852 21.280 1.00 25.50 H new ATOM 0 HB2 PRO A 73 -33.042 6.063 22.605 1.00 63.22 H new ATOM 0 HB3 PRO A 73 -33.427 4.376 22.886 1.00 63.22 H new ATOM 0 HG2 PRO A 73 -31.316 5.564 21.094 1.00 31.54 H new ATOM 0 HG3 PRO A 73 -31.196 4.189 22.174 1.00 31.54 H new ATOM 0 HD2 PRO A 73 -31.552 3.870 19.493 1.00 20.33 H new ATOM 0 HD3 PRO A 73 -32.213 2.728 20.647 1.00 20.33 H new ATOM 1148 N TYR A 74 -33.584 6.830 19.340 1.00 30.54 N ATOM 1149 CA TYR A 74 -33.622 8.149 18.722 1.00 45.42 C ATOM 1150 C TYR A 74 -33.035 9.205 19.654 1.00 31.13 C ATOM 1151 O TYR A 74 -33.217 10.404 19.444 1.00 34.55 O ATOM 1152 CB TYR A 74 -35.058 8.522 18.352 1.00 72.54 C ATOM 1153 CG TYR A 74 -35.156 9.716 17.430 1.00 1.20 C ATOM 1154 CD1 TYR A 74 -34.300 9.853 16.345 1.00 44.43 C ATOM 1155 CD2 TYR A 74 -36.106 10.708 17.644 1.00 23.44 C ATOM 1156 CE1 TYR A 74 -34.385 10.944 15.501 1.00 61.32 C ATOM 1157 CE2 TYR A 74 -36.199 11.801 16.805 1.00 73.33 C ATOM 1158 CZ TYR A 74 -35.336 11.914 15.735 1.00 54.43 C ATOM 1159 OH TYR A 74 -35.426 13.001 14.895 1.00 4.35 O ATOM 0 H TYR A 74 -32.983 6.158 18.863 1.00 30.54 H new ATOM 0 HA TYR A 74 -33.018 8.114 17.815 1.00 45.42 H new ATOM 0 HB2 TYR A 74 -35.535 7.666 17.876 1.00 72.54 H new ATOM 0 HB3 TYR A 74 -35.616 8.731 19.264 1.00 72.54 H new ATOM 0 HD1 TYR A 74 -33.555 9.094 16.158 1.00 44.43 H new ATOM 0 HD2 TYR A 74 -36.783 10.622 18.481 1.00 23.44 H new ATOM 0 HE1 TYR A 74 -33.710 11.036 14.663 1.00 61.32 H new ATOM 0 HE2 TYR A 74 -36.943 12.563 16.986 1.00 73.33 H new ATOM 0 HH TYR A 74 -36.148 13.590 15.198 1.00 4.35 H new ATOM 1169 N GLU A 75 -32.329 8.749 20.685 1.00 75.35 N ATOM 1170 CA GLU A 75 -31.716 9.653 21.650 1.00 40.33 C ATOM 1171 C GLU A 75 -30.390 10.193 21.123 1.00 43.45 C ATOM 1172 O GLU A 75 -30.071 11.369 21.301 1.00 20.15 O ATOM 1173 CB GLU A 75 -31.493 8.937 22.983 1.00 15.05 C ATOM 1174 CG GLU A 75 -32.729 8.898 23.867 1.00 71.11 C ATOM 1175 CD GLU A 75 -32.601 7.905 25.006 1.00 62.14 C ATOM 1176 OE1 GLU A 75 -32.267 6.732 24.736 1.00 1.33 O ATOM 1177 OE2 GLU A 75 -32.834 8.301 26.167 1.00 55.32 O ATOM 0 H GLU A 75 -32.168 7.759 20.873 1.00 75.35 H new ATOM 0 HA GLU A 75 -32.395 10.492 21.805 1.00 40.33 H new ATOM 0 HB2 GLU A 75 -31.164 7.916 22.787 1.00 15.05 H new ATOM 0 HB3 GLU A 75 -30.686 9.434 23.522 1.00 15.05 H new ATOM 0 HG2 GLU A 75 -32.910 9.892 24.275 1.00 71.11 H new ATOM 0 HG3 GLU A 75 -33.597 8.639 23.260 1.00 71.11 H new ATOM 1184 N ARG A 76 -29.621 9.326 20.472 1.00 22.15 N ATOM 1185 CA ARG A 76 -28.328 9.714 19.921 1.00 55.33 C ATOM 1186 C ARG A 76 -28.500 10.420 18.579 1.00 72.24 C ATOM 1187 O ARG A 76 -28.027 11.540 18.390 1.00 12.13 O ATOM 1188 CB ARG A 76 -27.432 8.486 19.752 1.00 1.34 C ATOM 1189 CG ARG A 76 -26.926 7.917 21.068 1.00 70.34 C ATOM 1190 CD ARG A 76 -26.071 8.925 21.819 1.00 21.21 C ATOM 1191 NE ARG A 76 -25.437 8.336 22.996 1.00 73.12 N ATOM 1192 CZ ARG A 76 -24.376 7.539 22.938 1.00 71.04 C ATOM 1193 NH1 ARG A 76 -23.832 7.238 21.766 1.00 35.14 N ATOM 1194 NH2 ARG A 76 -23.856 7.042 24.053 1.00 72.13 N ATOM 0 H ARG A 76 -29.871 8.350 20.313 1.00 22.15 H new ATOM 0 HA ARG A 76 -27.856 10.406 20.619 1.00 55.33 H new ATOM 0 HB2 ARG A 76 -27.986 7.712 19.220 1.00 1.34 H new ATOM 0 HB3 ARG A 76 -26.578 8.752 19.129 1.00 1.34 H new ATOM 0 HG2 ARG A 76 -27.773 7.623 21.688 1.00 70.34 H new ATOM 0 HG3 ARG A 76 -26.344 7.016 20.876 1.00 70.34 H new ATOM 0 HD2 ARG A 76 -25.303 9.318 21.152 1.00 21.21 H new ATOM 0 HD3 ARG A 76 -26.690 9.769 22.125 1.00 21.21 H new ATOM 0 HE ARG A 76 -25.831 8.548 23.913 1.00 73.12 H new ATOM 0 HH11 ARG A 76 -24.228 7.619 20.907 1.00 35.14 H new ATOM 0 HH12 ARG A 76 -23.017 6.626 21.724 1.00 35.14 H new ATOM 0 HH21 ARG A 76 -24.271 7.272 24.956 1.00 72.13 H new ATOM 0 HH22 ARG A 76 -23.041 6.430 24.007 1.00 72.13 H new ATOM 1208 N MET A 77 -29.180 9.755 17.649 1.00 4.44 N ATOM 1209 CA MET A 77 -29.414 10.319 16.325 1.00 10.42 C ATOM 1210 C MET A 77 -30.024 11.714 16.428 1.00 33.43 C ATOM 1211 O MET A 77 -29.835 12.551 15.546 1.00 32.11 O ATOM 1212 CB MET A 77 -30.335 9.406 15.514 1.00 63.30 C ATOM 1213 CG MET A 77 -30.850 10.043 14.234 1.00 44.52 C ATOM 1214 SD MET A 77 -31.532 8.836 13.082 1.00 60.21 S ATOM 1215 CE MET A 77 -33.026 9.674 12.558 1.00 3.00 C ATOM 0 H MET A 77 -29.578 8.826 17.788 1.00 4.44 H new ATOM 0 HA MET A 77 -28.453 10.398 15.816 1.00 10.42 H new ATOM 0 HB2 MET A 77 -29.798 8.491 15.264 1.00 63.30 H new ATOM 0 HB3 MET A 77 -31.184 9.118 16.134 1.00 63.30 H new ATOM 0 HG2 MET A 77 -31.617 10.777 14.481 1.00 44.52 H new ATOM 0 HG3 MET A 77 -30.037 10.583 13.749 1.00 44.52 H new ATOM 0 HE1 MET A 77 -33.340 9.287 11.589 1.00 3.00 H new ATOM 0 HE2 MET A 77 -33.815 9.502 13.290 1.00 3.00 H new ATOM 0 HE3 MET A 77 -32.834 10.744 12.476 1.00 3.00 H new ATOM 1225 N SER A 78 -30.757 11.955 17.511 1.00 50.54 N ATOM 1226 CA SER A 78 -31.398 13.247 17.726 1.00 14.15 C ATOM 1227 C SER A 78 -30.375 14.299 18.145 1.00 72.33 C ATOM 1228 O SER A 78 -30.328 15.393 17.583 1.00 71.04 O ATOM 1229 CB SER A 78 -32.488 13.127 18.793 1.00 14.14 C ATOM 1230 OG SER A 78 -31.963 12.607 20.003 1.00 54.34 O ATOM 0 H SER A 78 -30.921 11.273 18.252 1.00 50.54 H new ATOM 0 HA SER A 78 -31.851 13.561 16.786 1.00 14.15 H new ATOM 0 HB2 SER A 78 -32.931 14.106 18.976 1.00 14.14 H new ATOM 0 HB3 SER A 78 -33.286 12.479 18.431 1.00 14.14 H new ATOM 0 HG SER A 78 -32.439 11.783 20.239 1.00 54.34 H new ATOM 1236 N ASP A 79 -29.558 13.958 19.135 1.00 43.31 N ATOM 1237 CA ASP A 79 -28.534 14.871 19.629 1.00 3.52 C ATOM 1238 C ASP A 79 -27.560 15.249 18.517 1.00 22.04 C ATOM 1239 O ASP A 79 -26.860 16.257 18.609 1.00 62.31 O ATOM 1240 CB ASP A 79 -27.775 14.237 20.796 1.00 45.24 C ATOM 1241 CG ASP A 79 -26.855 15.222 21.492 1.00 74.42 C ATOM 1242 OD1 ASP A 79 -25.695 15.364 21.052 1.00 71.32 O ATOM 1243 OD2 ASP A 79 -27.297 15.850 22.476 1.00 3.51 O ATOM 0 H ASP A 79 -29.585 13.056 19.611 1.00 43.31 H new ATOM 0 HA ASP A 79 -29.028 15.778 19.977 1.00 3.52 H new ATOM 0 HB2 ASP A 79 -28.489 13.840 21.517 1.00 45.24 H new ATOM 0 HB3 ASP A 79 -27.189 13.394 20.430 1.00 45.24 H new ATOM 1248 N GLU A 80 -27.521 14.432 17.469 1.00 2.31 N ATOM 1249 CA GLU A 80 -26.631 14.680 16.341 1.00 42.50 C ATOM 1250 C GLU A 80 -26.973 16.002 15.659 1.00 44.11 C ATOM 1251 O GLU A 80 -26.179 16.536 14.883 1.00 35.13 O ATOM 1252 CB GLU A 80 -26.720 13.535 15.331 1.00 62.41 C ATOM 1253 CG GLU A 80 -25.936 13.786 14.054 1.00 4.51 C ATOM 1254 CD GLU A 80 -26.823 14.201 12.896 1.00 31.44 C ATOM 1255 OE1 GLU A 80 -27.734 15.027 13.114 1.00 43.30 O ATOM 1256 OE2 GLU A 80 -26.608 13.698 11.774 1.00 43.43 O ATOM 0 H GLU A 80 -28.095 13.594 17.378 1.00 2.31 H new ATOM 0 HA GLU A 80 -25.612 14.740 16.722 1.00 42.50 H new ATOM 0 HB2 GLU A 80 -26.354 12.621 15.798 1.00 62.41 H new ATOM 0 HB3 GLU A 80 -27.767 13.366 15.077 1.00 62.41 H new ATOM 0 HG2 GLU A 80 -25.194 14.563 14.235 1.00 4.51 H new ATOM 0 HG3 GLU A 80 -25.391 12.882 13.783 1.00 4.51 H new ATOM 1263 N ASP A 81 -28.158 16.523 15.953 1.00 14.43 N ATOM 1264 CA ASP A 81 -28.606 17.783 15.370 1.00 73.43 C ATOM 1265 C ASP A 81 -27.539 18.862 15.522 1.00 13.22 C ATOM 1266 O ASP A 81 -27.428 19.761 14.688 1.00 64.40 O ATOM 1267 CB ASP A 81 -29.909 18.239 16.027 1.00 14.34 C ATOM 1268 CG ASP A 81 -30.256 19.676 15.690 1.00 42.14 C ATOM 1269 OD1 ASP A 81 -30.624 19.940 14.526 1.00 74.03 O ATOM 1270 OD2 ASP A 81 -30.159 20.536 16.589 1.00 13.43 O ATOM 0 H ASP A 81 -28.827 16.093 16.592 1.00 14.43 H new ATOM 0 HA ASP A 81 -28.783 17.620 14.307 1.00 73.43 H new ATOM 0 HB2 ASP A 81 -30.722 17.587 15.706 1.00 14.34 H new ATOM 0 HB3 ASP A 81 -29.824 18.133 17.108 1.00 14.34 H new ATOM 1275 N ARG A 82 -26.758 18.768 16.593 1.00 33.14 N ATOM 1276 CA ARG A 82 -25.702 19.738 16.856 1.00 30.34 C ATOM 1277 C ARG A 82 -24.421 19.359 16.120 1.00 45.03 C ATOM 1278 O ARG A 82 -23.951 20.094 15.251 1.00 50.21 O ATOM 1279 CB ARG A 82 -25.430 19.833 18.359 1.00 71.41 C ATOM 1280 CG ARG A 82 -24.325 20.812 18.717 1.00 3.41 C ATOM 1281 CD ARG A 82 -23.437 20.270 19.826 1.00 33.24 C ATOM 1282 NE ARG A 82 -22.558 21.298 20.376 1.00 43.10 N ATOM 1283 CZ ARG A 82 -21.631 21.057 21.297 1.00 52.12 C ATOM 1284 NH1 ARG A 82 -21.464 19.829 21.768 1.00 1.33 N ATOM 1285 NH2 ARG A 82 -20.869 22.046 21.748 1.00 72.54 N ATOM 0 H ARG A 82 -26.837 18.030 17.293 1.00 33.14 H new ATOM 0 HA ARG A 82 -26.036 20.709 16.492 1.00 30.34 H new ATOM 0 HB2 ARG A 82 -26.347 20.131 18.867 1.00 71.41 H new ATOM 0 HB3 ARG A 82 -25.164 18.845 18.735 1.00 71.41 H new ATOM 0 HG2 ARG A 82 -23.720 21.019 17.834 1.00 3.41 H new ATOM 0 HG3 ARG A 82 -24.764 21.759 19.031 1.00 3.41 H new ATOM 0 HD2 ARG A 82 -24.060 19.862 20.622 1.00 33.24 H new ATOM 0 HD3 ARG A 82 -22.835 19.448 19.439 1.00 33.24 H new ATOM 0 HE ARG A 82 -22.661 22.254 20.034 1.00 43.10 H new ATOM 0 HH11 ARG A 82 -22.048 19.067 21.423 1.00 1.33 H new ATOM 0 HH12 ARG A 82 -20.752 19.646 22.475 1.00 1.33 H new ATOM 0 HH21 ARG A 82 -20.995 22.992 21.388 1.00 72.54 H new ATOM 0 HH22 ARG A 82 -20.158 21.860 22.455 1.00 72.54 H new ATOM 1299 N VAL A 83 -23.859 18.207 16.473 1.00 10.22 N ATOM 1300 CA VAL A 83 -22.632 17.730 15.846 1.00 54.23 C ATOM 1301 C VAL A 83 -22.768 17.700 14.327 1.00 4.34 C ATOM 1302 O VAL A 83 -21.774 17.771 13.604 1.00 21.41 O ATOM 1303 CB VAL A 83 -22.258 16.322 16.345 1.00 44.14 C ATOM 1304 CG1 VAL A 83 -22.192 16.294 17.864 1.00 63.30 C ATOM 1305 CG2 VAL A 83 -23.250 15.292 15.826 1.00 2.04 C ATOM 0 H VAL A 83 -24.234 17.587 17.190 1.00 10.22 H new ATOM 0 HA VAL A 83 -21.842 18.427 16.124 1.00 54.23 H new ATOM 0 HB VAL A 83 -21.271 16.068 15.958 1.00 44.14 H new ATOM 0 HG11 VAL A 83 -21.926 15.291 18.198 1.00 63.30 H new ATOM 0 HG12 VAL A 83 -21.439 17.003 18.209 1.00 63.30 H new ATOM 0 HG13 VAL A 83 -23.163 16.568 18.276 1.00 63.30 H new ATOM 0 HG21 VAL A 83 -22.970 14.303 16.188 1.00 2.04 H new ATOM 0 HG22 VAL A 83 -24.250 15.539 16.181 1.00 2.04 H new ATOM 0 HG23 VAL A 83 -23.241 15.295 14.736 1.00 2.04 H new ATOM 1315 N ARG A 84 -24.004 17.596 13.851 1.00 62.11 N ATOM 1316 CA ARG A 84 -24.269 17.556 12.418 1.00 74.01 C ATOM 1317 C ARG A 84 -23.542 18.688 11.698 1.00 25.34 C ATOM 1318 O ARG A 84 -23.128 18.541 10.548 1.00 61.00 O ATOM 1319 CB ARG A 84 -25.773 17.653 12.153 1.00 20.24 C ATOM 1320 CG ARG A 84 -26.126 17.764 10.679 1.00 11.23 C ATOM 1321 CD ARG A 84 -27.624 17.929 10.476 1.00 32.02 C ATOM 1322 NE ARG A 84 -27.964 18.169 9.076 1.00 4.43 N ATOM 1323 CZ ARG A 84 -29.119 18.691 8.679 1.00 1.03 C ATOM 1324 NH1 ARG A 84 -30.041 19.025 9.572 1.00 44.52 N ATOM 1325 NH2 ARG A 84 -29.354 18.880 7.387 1.00 30.41 N ATOM 0 H ARG A 84 -24.837 17.538 14.436 1.00 62.11 H new ATOM 0 HA ARG A 84 -23.899 16.606 12.032 1.00 74.01 H new ATOM 0 HB2 ARG A 84 -26.264 16.774 12.570 1.00 20.24 H new ATOM 0 HB3 ARG A 84 -26.171 18.521 12.679 1.00 20.24 H new ATOM 0 HG2 ARG A 84 -25.603 18.614 10.241 1.00 11.23 H new ATOM 0 HG3 ARG A 84 -25.782 16.873 10.153 1.00 11.23 H new ATOM 0 HD2 ARG A 84 -28.138 17.033 10.825 1.00 32.02 H new ATOM 0 HD3 ARG A 84 -27.983 18.760 11.084 1.00 32.02 H new ATOM 0 HE ARG A 84 -27.277 17.922 8.364 1.00 4.43 H new ATOM 0 HH11 ARG A 84 -29.864 18.881 10.566 1.00 44.52 H new ATOM 0 HH12 ARG A 84 -30.927 19.426 9.265 1.00 44.52 H new ATOM 0 HH21 ARG A 84 -28.647 18.624 6.697 1.00 30.41 H new ATOM 0 HH22 ARG A 84 -30.241 19.281 7.083 1.00 30.41 H new ATOM 1339 N TYR A 85 -23.389 19.816 12.383 1.00 34.31 N ATOM 1340 CA TYR A 85 -22.714 20.973 11.809 1.00 54.43 C ATOM 1341 C TYR A 85 -21.248 20.663 11.522 1.00 34.24 C ATOM 1342 O TYR A 85 -20.715 21.041 10.480 1.00 73.01 O ATOM 1343 CB TYR A 85 -22.818 22.172 12.754 1.00 73.41 C ATOM 1344 CG TYR A 85 -22.348 23.470 12.139 1.00 1.41 C ATOM 1345 CD1 TYR A 85 -20.993 23.742 11.993 1.00 21.21 C ATOM 1346 CD2 TYR A 85 -23.258 24.426 11.705 1.00 2.42 C ATOM 1347 CE1 TYR A 85 -20.558 24.927 11.433 1.00 53.44 C ATOM 1348 CE2 TYR A 85 -22.832 25.614 11.142 1.00 33.12 C ATOM 1349 CZ TYR A 85 -21.482 25.860 11.008 1.00 23.13 C ATOM 1350 OH TYR A 85 -21.054 27.042 10.449 1.00 2.33 O ATOM 0 H TYR A 85 -23.724 19.953 13.337 1.00 34.31 H new ATOM 0 HA TYR A 85 -23.206 21.217 10.867 1.00 54.43 H new ATOM 0 HB2 TYR A 85 -23.855 22.285 13.072 1.00 73.41 H new ATOM 0 HB3 TYR A 85 -22.230 21.970 13.649 1.00 73.41 H new ATOM 0 HD1 TYR A 85 -20.267 23.014 12.323 1.00 21.21 H new ATOM 0 HD2 TYR A 85 -24.316 24.237 11.809 1.00 2.42 H new ATOM 0 HE1 TYR A 85 -19.501 25.123 11.328 1.00 53.44 H new ATOM 0 HE2 TYR A 85 -23.553 26.346 10.809 1.00 33.12 H new ATOM 0 HH TYR A 85 -21.830 27.587 10.202 1.00 2.33 H new ATOM 1360 N GLU A 86 -20.604 19.971 12.456 1.00 24.34 N ATOM 1361 CA GLU A 86 -19.199 19.609 12.305 1.00 71.00 C ATOM 1362 C GLU A 86 -19.049 18.365 11.434 1.00 24.35 C ATOM 1363 O GLU A 86 -18.062 18.214 10.714 1.00 40.34 O ATOM 1364 CB GLU A 86 -18.561 19.367 13.675 1.00 73.24 C ATOM 1365 CG GLU A 86 -18.967 20.388 14.724 1.00 34.32 C ATOM 1366 CD GLU A 86 -17.852 20.690 15.706 1.00 50.41 C ATOM 1367 OE1 GLU A 86 -16.931 19.856 15.832 1.00 13.03 O ATOM 1368 OE2 GLU A 86 -17.900 21.760 16.347 1.00 3.55 O ATOM 0 H GLU A 86 -21.032 19.650 13.325 1.00 24.34 H new ATOM 0 HA GLU A 86 -18.687 20.438 11.816 1.00 71.00 H new ATOM 0 HB2 GLU A 86 -18.836 18.371 14.024 1.00 73.24 H new ATOM 0 HB3 GLU A 86 -17.476 19.379 13.569 1.00 73.24 H new ATOM 0 HG2 GLU A 86 -19.270 21.311 14.229 1.00 34.32 H new ATOM 0 HG3 GLU A 86 -19.836 20.018 15.269 1.00 34.32 H new ATOM 1375 N ARG A 87 -20.034 17.476 11.508 1.00 63.31 N ATOM 1376 CA ARG A 87 -20.011 16.244 10.729 1.00 63.33 C ATOM 1377 C ARG A 87 -20.000 16.546 9.233 1.00 3.42 C ATOM 1378 O ARG A 87 -19.230 15.956 8.477 1.00 63.22 O ATOM 1379 CB ARG A 87 -21.220 15.373 11.075 1.00 52.51 C ATOM 1380 CG ARG A 87 -21.356 14.142 10.195 1.00 31.40 C ATOM 1381 CD ARG A 87 -22.310 14.387 9.037 1.00 72.14 C ATOM 1382 NE ARG A 87 -23.707 14.251 9.440 1.00 52.01 N ATOM 1383 CZ ARG A 87 -24.725 14.745 8.743 1.00 4.45 C ATOM 1384 NH1 ARG A 87 -24.502 15.404 7.615 1.00 43.32 N ATOM 1385 NH2 ARG A 87 -25.968 14.581 9.176 1.00 74.44 N ATOM 0 H ARG A 87 -20.858 17.586 12.099 1.00 63.31 H new ATOM 0 HA ARG A 87 -19.099 15.703 10.980 1.00 63.33 H new ATOM 0 HB2 ARG A 87 -21.144 15.058 12.116 1.00 52.51 H new ATOM 0 HB3 ARG A 87 -22.126 15.973 10.988 1.00 52.51 H new ATOM 0 HG2 ARG A 87 -20.377 13.861 9.808 1.00 31.40 H new ATOM 0 HG3 ARG A 87 -21.715 13.304 10.793 1.00 31.40 H new ATOM 0 HD2 ARG A 87 -22.144 15.387 8.636 1.00 72.14 H new ATOM 0 HD3 ARG A 87 -22.094 13.682 8.234 1.00 72.14 H new ATOM 0 HE ARG A 87 -23.913 13.749 10.304 1.00 52.01 H new ATOM 0 HH11 ARG A 87 -23.547 15.533 7.280 1.00 43.32 H new ATOM 0 HH12 ARG A 87 -25.285 15.782 7.082 1.00 43.32 H new ATOM 0 HH21 ARG A 87 -26.143 14.075 10.044 1.00 74.44 H new ATOM 0 HH22 ARG A 87 -26.749 14.960 8.641 1.00 74.44 H new ATOM 1399 N GLU A 88 -20.860 17.470 8.815 1.00 22.02 N ATOM 1400 CA GLU A 88 -20.949 17.849 7.410 1.00 12.31 C ATOM 1401 C GLU A 88 -19.596 18.323 6.887 1.00 30.31 C ATOM 1402 O GLU A 88 -19.314 18.235 5.692 1.00 50.32 O ATOM 1403 CB GLU A 88 -21.995 18.951 7.222 1.00 63.53 C ATOM 1404 CG GLU A 88 -22.015 19.537 5.820 1.00 11.22 C ATOM 1405 CD GLU A 88 -23.086 20.597 5.647 1.00 62.22 C ATOM 1406 OE1 GLU A 88 -24.181 20.434 6.223 1.00 35.21 O ATOM 1407 OE2 GLU A 88 -22.827 21.590 4.934 1.00 33.45 O ATOM 0 H GLU A 88 -21.504 17.969 9.429 1.00 22.02 H new ATOM 0 HA GLU A 88 -21.251 16.969 6.841 1.00 12.31 H new ATOM 0 HB2 GLU A 88 -22.981 18.548 7.452 1.00 63.53 H new ATOM 0 HB3 GLU A 88 -21.802 19.750 7.938 1.00 63.53 H new ATOM 0 HG2 GLU A 88 -21.040 19.971 5.597 1.00 11.22 H new ATOM 0 HG3 GLU A 88 -22.180 18.737 5.098 1.00 11.22 H new ATOM 1414 N LYS A 89 -18.762 18.825 7.791 1.00 10.32 N ATOM 1415 CA LYS A 89 -17.438 19.313 7.424 1.00 62.42 C ATOM 1416 C LYS A 89 -16.666 18.254 6.642 1.00 52.41 C ATOM 1417 O LYS A 89 -16.023 18.558 5.638 1.00 60.54 O ATOM 1418 CB LYS A 89 -16.653 19.710 8.676 1.00 43.42 C ATOM 1419 CG LYS A 89 -15.630 20.806 8.430 1.00 62.22 C ATOM 1420 CD LYS A 89 -16.076 22.130 9.026 1.00 15.12 C ATOM 1421 CE LYS A 89 -16.976 22.897 8.069 1.00 35.14 C ATOM 1422 NZ LYS A 89 -16.271 23.248 6.806 1.00 74.34 N ATOM 0 H LYS A 89 -18.980 18.905 8.784 1.00 10.32 H new ATOM 0 HA LYS A 89 -17.564 20.190 6.789 1.00 62.42 H new ATOM 0 HB2 LYS A 89 -17.352 20.043 9.443 1.00 43.42 H new ATOM 0 HB3 LYS A 89 -16.143 18.830 9.069 1.00 43.42 H new ATOM 0 HG2 LYS A 89 -14.673 20.515 8.863 1.00 62.22 H new ATOM 0 HG3 LYS A 89 -15.472 20.923 7.358 1.00 62.22 H new ATOM 0 HD2 LYS A 89 -16.607 21.949 9.960 1.00 15.12 H new ATOM 0 HD3 LYS A 89 -15.202 22.734 9.268 1.00 15.12 H new ATOM 0 HE2 LYS A 89 -17.856 22.297 7.839 1.00 35.14 H new ATOM 0 HE3 LYS A 89 -17.329 23.808 8.553 1.00 35.14 H new ATOM 0 HZ1 LYS A 89 -16.706 24.096 6.389 1.00 74.34 H new ATOM 0 HZ2 LYS A 89 -15.269 23.438 7.009 1.00 74.34 H new ATOM 0 HZ3 LYS A 89 -16.345 22.456 6.136 1.00 74.34 H new ATOM 1436 N ALA A 90 -16.736 17.012 7.109 1.00 53.04 N ATOM 1437 CA ALA A 90 -16.047 15.909 6.451 1.00 72.23 C ATOM 1438 C ALA A 90 -16.394 15.851 4.967 1.00 53.50 C ATOM 1439 O ALA A 90 -15.518 15.967 4.111 1.00 71.11 O ATOM 1440 CB ALA A 90 -16.395 14.591 7.127 1.00 4.14 C ATOM 0 H ALA A 90 -17.263 16.744 7.940 1.00 53.04 H new ATOM 0 HA ALA A 90 -14.974 16.079 6.540 1.00 72.23 H new ATOM 0 HB1 ALA A 90 -15.873 13.776 6.625 1.00 4.14 H new ATOM 0 HB2 ALA A 90 -16.091 14.627 8.173 1.00 4.14 H new ATOM 0 HB3 ALA A 90 -17.471 14.424 7.068 1.00 4.14 H new ATOM 1446 N GLU A 91 -17.678 15.672 4.671 1.00 62.14 N ATOM 1447 CA GLU A 91 -18.139 15.598 3.289 1.00 20.33 C ATOM 1448 C GLU A 91 -17.772 16.866 2.524 1.00 24.12 C ATOM 1449 O GLU A 91 -17.678 16.858 1.297 1.00 41.24 O ATOM 1450 CB GLU A 91 -19.653 15.383 3.245 1.00 72.43 C ATOM 1451 CG GLU A 91 -20.139 14.278 4.168 1.00 65.21 C ATOM 1452 CD GLU A 91 -21.388 13.591 3.650 1.00 4.51 C ATOM 1453 OE1 GLU A 91 -21.533 13.478 2.415 1.00 65.22 O ATOM 1454 OE2 GLU A 91 -22.220 13.169 4.479 1.00 21.53 O ATOM 0 H GLU A 91 -18.416 15.576 5.368 1.00 62.14 H new ATOM 0 HA GLU A 91 -17.644 14.752 2.813 1.00 20.33 H new ATOM 0 HB2 GLU A 91 -20.151 16.314 3.514 1.00 72.43 H new ATOM 0 HB3 GLU A 91 -19.948 15.147 2.223 1.00 72.43 H new ATOM 0 HG2 GLU A 91 -19.347 13.539 4.292 1.00 65.21 H new ATOM 0 HG3 GLU A 91 -20.342 14.696 5.154 1.00 65.21 H new ATOM 1461 N TYR A 92 -17.565 17.954 3.258 1.00 34.43 N ATOM 1462 CA TYR A 92 -17.211 19.230 2.650 1.00 53.50 C ATOM 1463 C TYR A 92 -15.746 19.245 2.227 1.00 63.53 C ATOM 1464 O TYR A 92 -15.404 19.730 1.149 1.00 41.40 O ATOM 1465 CB TYR A 92 -17.483 20.377 3.626 1.00 60.24 C ATOM 1466 CG TYR A 92 -17.881 21.668 2.947 1.00 41.11 C ATOM 1467 CD1 TYR A 92 -18.945 21.707 2.054 1.00 0.12 C ATOM 1468 CD2 TYR A 92 -17.192 22.849 3.197 1.00 35.54 C ATOM 1469 CE1 TYR A 92 -19.312 22.884 1.431 1.00 2.32 C ATOM 1470 CE2 TYR A 92 -17.553 24.031 2.580 1.00 32.52 C ATOM 1471 CZ TYR A 92 -18.613 24.043 1.698 1.00 52.42 C ATOM 1472 OH TYR A 92 -18.975 25.219 1.080 1.00 63.52 O ATOM 0 H TYR A 92 -17.636 17.977 4.275 1.00 34.43 H new ATOM 0 HA TYR A 92 -17.828 19.363 1.761 1.00 53.50 H new ATOM 0 HB2 TYR A 92 -18.275 20.078 4.313 1.00 60.24 H new ATOM 0 HB3 TYR A 92 -16.590 20.552 4.226 1.00 60.24 H new ATOM 0 HD1 TYR A 92 -19.495 20.801 1.843 1.00 0.12 H new ATOM 0 HD2 TYR A 92 -16.360 22.842 3.886 1.00 35.54 H new ATOM 0 HE1 TYR A 92 -20.141 22.897 0.739 1.00 2.32 H new ATOM 0 HE2 TYR A 92 -17.008 24.940 2.787 1.00 32.52 H new ATOM 0 HH TYR A 92 -18.383 25.941 1.378 1.00 63.52 H new ATOM 1482 N ALA A 93 -14.884 18.707 3.084 1.00 61.13 N ATOM 1483 CA ALA A 93 -13.455 18.654 2.799 1.00 54.30 C ATOM 1484 C ALA A 93 -13.147 17.612 1.730 1.00 64.40 C ATOM 1485 O ALA A 93 -12.077 17.632 1.122 1.00 51.04 O ATOM 1486 CB ALA A 93 -12.674 18.357 4.070 1.00 34.24 C ATOM 0 H ALA A 93 -15.150 18.302 3.981 1.00 61.13 H new ATOM 0 HA ALA A 93 -13.149 19.628 2.418 1.00 54.30 H new ATOM 0 HB1 ALA A 93 -11.609 18.320 3.842 1.00 34.24 H new ATOM 0 HB2 ALA A 93 -12.861 19.141 4.804 1.00 34.24 H new ATOM 0 HB3 ALA A 93 -12.991 17.397 4.476 1.00 34.24 H new ATOM 1492 N GLN A 94 -14.090 16.702 1.508 1.00 64.24 N ATOM 1493 CA GLN A 94 -13.916 15.650 0.513 1.00 52.25 C ATOM 1494 C GLN A 94 -14.132 16.193 -0.896 1.00 74.23 C ATOM 1495 O GLN A 94 -13.351 15.914 -1.806 1.00 32.00 O ATOM 1496 CB GLN A 94 -14.886 14.498 0.783 1.00 50.44 C ATOM 1497 CG GLN A 94 -14.768 13.919 2.183 1.00 10.52 C ATOM 1498 CD GLN A 94 -14.550 12.419 2.178 1.00 1.32 C ATOM 1499 OE1 GLN A 94 -15.159 11.694 1.391 1.00 50.41 O ATOM 1500 NE2 GLN A 94 -13.677 11.945 3.059 1.00 21.21 N ATOM 0 H GLN A 94 -14.981 16.672 2.003 1.00 64.24 H new ATOM 0 HA GLN A 94 -12.894 15.279 0.587 1.00 52.25 H new ATOM 0 HB2 GLN A 94 -15.906 14.849 0.629 1.00 50.44 H new ATOM 0 HB3 GLN A 94 -14.708 13.706 0.055 1.00 50.44 H new ATOM 0 HG2 GLN A 94 -13.940 14.401 2.703 1.00 10.52 H new ATOM 0 HG3 GLN A 94 -15.674 14.149 2.745 1.00 10.52 H new ATOM 0 HE21 GLN A 94 -13.195 12.582 3.693 1.00 21.21 H new ATOM 0 HE22 GLN A 94 -13.489 10.943 3.102 1.00 21.21 H new ATOM 1509 N ARG A 95 -15.198 16.969 -1.069 1.00 65.42 N ATOM 1510 CA ARG A 95 -15.517 17.549 -2.368 1.00 12.01 C ATOM 1511 C ARG A 95 -14.312 18.286 -2.946 1.00 32.24 C ATOM 1512 O ARG A 95 -14.148 18.372 -4.163 1.00 15.22 O ATOM 1513 CB ARG A 95 -16.703 18.507 -2.244 1.00 51.40 C ATOM 1514 CG ARG A 95 -17.482 18.683 -3.537 1.00 73.42 C ATOM 1515 CD ARG A 95 -16.931 19.831 -4.368 1.00 75.23 C ATOM 1516 NE ARG A 95 -17.987 20.546 -5.081 1.00 64.45 N ATOM 1517 CZ ARG A 95 -18.769 21.457 -4.515 1.00 14.02 C ATOM 1518 NH1 ARG A 95 -18.616 21.763 -3.234 1.00 12.21 N ATOM 1519 NH2 ARG A 95 -19.708 22.065 -5.230 1.00 24.41 N ATOM 0 H ARG A 95 -15.854 17.210 -0.326 1.00 65.42 H new ATOM 0 HA ARG A 95 -15.783 16.737 -3.045 1.00 12.01 H new ATOM 0 HB2 ARG A 95 -17.377 18.139 -1.471 1.00 51.40 H new ATOM 0 HB3 ARG A 95 -16.340 19.480 -1.913 1.00 51.40 H new ATOM 0 HG2 ARG A 95 -17.441 17.761 -4.116 1.00 73.42 H new ATOM 0 HG3 ARG A 95 -18.531 18.869 -3.308 1.00 73.42 H new ATOM 0 HD2 ARG A 95 -16.398 20.525 -3.719 1.00 75.23 H new ATOM 0 HD3 ARG A 95 -16.207 19.445 -5.085 1.00 75.23 H new ATOM 0 HE ARG A 95 -18.131 20.333 -6.068 1.00 64.45 H new ATOM 0 HH11 ARG A 95 -17.896 21.298 -2.681 1.00 12.21 H new ATOM 0 HH12 ARG A 95 -19.218 22.463 -2.802 1.00 12.21 H new ATOM 0 HH21 ARG A 95 -19.829 21.832 -6.216 1.00 24.41 H new ATOM 0 HH22 ARG A 95 -20.308 22.765 -4.794 1.00 24.41 H new ATOM 1533 N LYS A 96 -13.471 18.816 -2.064 1.00 52.11 N ATOM 1534 CA LYS A 96 -12.281 19.545 -2.485 1.00 4.13 C ATOM 1535 C LYS A 96 -11.103 18.596 -2.683 1.00 72.23 C ATOM 1536 O LYS A 96 -10.415 18.649 -3.703 1.00 11.03 O ATOM 1537 CB LYS A 96 -11.919 20.613 -1.450 1.00 13.12 C ATOM 1538 CG LYS A 96 -12.496 21.983 -1.763 1.00 21.01 C ATOM 1539 CD LYS A 96 -13.941 22.097 -1.307 1.00 2.31 C ATOM 1540 CE LYS A 96 -14.033 22.413 0.178 1.00 13.30 C ATOM 1541 NZ LYS A 96 -15.397 22.869 0.564 1.00 14.41 N ATOM 0 H LYS A 96 -13.592 18.754 -1.053 1.00 52.11 H new ATOM 0 HA LYS A 96 -12.500 20.029 -3.437 1.00 4.13 H new ATOM 0 HB2 LYS A 96 -12.275 20.293 -0.471 1.00 13.12 H new ATOM 0 HB3 LYS A 96 -10.834 20.691 -1.385 1.00 13.12 H new ATOM 0 HG2 LYS A 96 -11.897 22.751 -1.274 1.00 21.01 H new ATOM 0 HG3 LYS A 96 -12.436 22.168 -2.836 1.00 21.01 H new ATOM 0 HD2 LYS A 96 -14.443 22.878 -1.878 1.00 2.31 H new ATOM 0 HD3 LYS A 96 -14.464 21.163 -1.515 1.00 2.31 H new ATOM 0 HE2 LYS A 96 -13.769 21.527 0.755 1.00 13.30 H new ATOM 0 HE3 LYS A 96 -13.307 23.185 0.431 1.00 13.30 H new ATOM 0 HZ1 LYS A 96 -15.556 22.673 1.573 1.00 14.41 H new ATOM 0 HZ2 LYS A 96 -15.483 23.891 0.392 1.00 14.41 H new ATOM 0 HZ3 LYS A 96 -16.106 22.362 -0.003 1.00 14.41 H new ATOM 1555 N VAL A 97 -10.878 17.726 -1.703 1.00 42.52 N ATOM 1556 CA VAL A 97 -9.785 16.763 -1.772 1.00 14.42 C ATOM 1557 C VAL A 97 -10.312 15.333 -1.758 1.00 32.15 C ATOM 1558 O VAL A 97 -10.115 14.578 -2.710 1.00 11.31 O ATOM 1559 CB VAL A 97 -8.800 16.948 -0.602 1.00 74.21 C ATOM 1560 CG1 VAL A 97 -7.687 15.914 -0.674 1.00 3.24 C ATOM 1561 CG2 VAL A 97 -8.231 18.358 -0.603 1.00 43.31 C ATOM 0 H VAL A 97 -11.438 17.668 -0.852 1.00 42.52 H new ATOM 0 HA VAL A 97 -9.261 16.945 -2.710 1.00 14.42 H new ATOM 0 HB VAL A 97 -9.340 16.800 0.333 1.00 74.21 H new ATOM 0 HG11 VAL A 97 -7.001 16.060 0.160 1.00 3.24 H new ATOM 0 HG12 VAL A 97 -8.116 14.913 -0.620 1.00 3.24 H new ATOM 0 HG13 VAL A 97 -7.146 16.027 -1.613 1.00 3.24 H new ATOM 0 HG21 VAL A 97 -7.537 18.471 0.230 1.00 43.31 H new ATOM 0 HG22 VAL A 97 -7.705 18.537 -1.540 1.00 43.31 H new ATOM 0 HG23 VAL A 97 -9.043 19.078 -0.499 1.00 43.31 H new