USER MOD reduce.3.24.130724 H: found=0, std=0, add=970, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 970 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: B 47 LYS NZ :NH3+ -151:sc= 1.81 (180deg=-1.28!) USER MOD Set 1.2: B 53 SER OG : rot -101:sc= 1.75 USER MOD Set 2.1: A 47 LYS NZ :NH3+ -174:sc= 3.45 (180deg=2.05) USER MOD Set 2.2: A 53 SER OG : rot -123:sc= 1.41 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc=-0.00883 (180deg=-0.133) USER MOD Single : A 2 LYS NZ :NH3+ 179:sc= -0.029 (180deg=-0.0345) USER MOD Single : A 4 THR OG1 : rot 87:sc= -1.19! USER MOD Single : A 20 LYS NZ :NH3+ 144:sc= -2.83! (180deg=-3.7!) USER MOD Single : A 25 THR OG1 : rot 77:sc= 0.21 USER MOD Single : A 48 LYS NZ :NH3+ 140:sc= 0.607 (180deg=0.0516) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -170:sc=-0.00754 (180deg=-0.122) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 79:sc= -0.958! USER MOD Single : B 20 LYS NZ :NH3+ 155:sc= -2.1! (180deg=-3.41!) USER MOD Single : B 25 THR OG1 : rot 73:sc= 0.162 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 SER OG : rot 180:sc= -3.84! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.813 -12.744 9.678 1.00 3.96 N ATOM 2 CA MET A 1 6.515 -12.489 10.341 1.00 3.42 C ATOM 3 C MET A 1 5.970 -11.139 9.903 1.00 2.72 C ATOM 4 O MET A 1 4.937 -11.070 9.233 1.00 3.29 O ATOM 5 CB MET A 1 6.675 -12.519 11.865 1.00 3.67 C ATOM 6 CG MET A 1 7.252 -13.824 12.392 1.00 4.16 C ATOM 7 SD MET A 1 6.292 -15.262 11.883 1.00 4.95 S ATOM 8 CE MET A 1 7.295 -16.588 12.554 1.00 5.91 C ATOM 0 H1 MET A 1 8.116 -13.720 9.872 1.00 3.96 H new ATOM 0 H2 MET A 1 7.711 -12.611 8.652 1.00 3.96 H new ATOM 0 H3 MET A 1 8.526 -12.081 10.044 1.00 3.96 H new ATOM 0 HA MET A 1 5.814 -13.272 10.051 1.00 3.42 H new ATOM 0 HB2 MET A 1 7.322 -11.696 12.170 1.00 3.67 H new ATOM 0 HB3 MET A 1 5.703 -12.349 12.327 1.00 3.67 H new ATOM 0 HG2 MET A 1 8.277 -13.933 12.038 1.00 4.16 H new ATOM 0 HG3 MET A 1 7.293 -13.786 13.481 1.00 4.16 H new ATOM 0 HE1 MET A 1 6.832 -17.547 12.322 1.00 5.91 H new ATOM 0 HE2 MET A 1 8.291 -16.549 12.113 1.00 5.91 H new ATOM 0 HE3 MET A 1 7.372 -16.475 13.635 1.00 5.91 H new ATOM 20 N LYS A 2 6.682 -10.072 10.274 1.00 1.76 N ATOM 21 CA LYS A 2 6.334 -8.717 9.861 1.00 1.11 C ATOM 22 C LYS A 2 4.926 -8.341 10.316 1.00 0.77 C ATOM 23 O LYS A 2 4.507 -8.698 11.422 1.00 0.80 O ATOM 24 CB LYS A 2 6.462 -8.574 8.336 1.00 0.64 C ATOM 25 CG LYS A 2 7.880 -8.767 7.818 1.00 0.98 C ATOM 26 CD LYS A 2 8.867 -7.850 8.523 1.00 1.79 C ATOM 27 CE LYS A 2 8.622 -6.393 8.181 1.00 2.66 C ATOM 28 NZ LYS A 2 9.134 -6.051 6.829 1.00 3.71 N ATOM 0 H LYS A 2 7.511 -10.126 10.866 1.00 1.76 H new ATOM 0 HA LYS A 2 7.033 -8.031 10.339 1.00 1.11 H new ATOM 0 HB2 LYS A 2 5.808 -9.302 7.856 1.00 0.64 H new ATOM 0 HB3 LYS A 2 6.109 -7.585 8.042 1.00 0.64 H new ATOM 0 HG2 LYS A 2 8.181 -9.805 7.961 1.00 0.98 H new ATOM 0 HG3 LYS A 2 7.905 -8.573 6.746 1.00 0.98 H new ATOM 0 HD2 LYS A 2 8.787 -7.989 9.601 1.00 1.79 H new ATOM 0 HD3 LYS A 2 9.884 -8.124 8.241 1.00 1.79 H new ATOM 0 HE2 LYS A 2 7.554 -6.183 8.229 1.00 2.66 H new ATOM 0 HE3 LYS A 2 9.105 -5.759 8.924 1.00 2.66 H new ATOM 0 HZ1 LYS A 2 8.933 -5.051 6.624 1.00 3.71 H new ATOM 0 HZ2 LYS A 2 10.161 -6.212 6.796 1.00 3.71 H new ATOM 0 HZ3 LYS A 2 8.667 -6.650 6.119 1.00 3.71 H new ATOM 42 N ALA A 3 4.222 -7.624 9.446 1.00 0.50 N ATOM 43 CA ALA A 3 2.888 -7.096 9.720 1.00 0.32 C ATOM 44 C ALA A 3 2.922 -5.971 10.750 1.00 0.37 C ATOM 45 O ALA A 3 3.690 -6.001 11.711 1.00 0.72 O ATOM 46 CB ALA A 3 1.920 -8.192 10.142 1.00 0.44 C ATOM 0 H ALA A 3 4.567 -7.389 8.515 1.00 0.50 H new ATOM 0 HA ALA A 3 2.521 -6.675 8.784 1.00 0.32 H new ATOM 0 HB1 ALA A 3 0.940 -7.757 10.336 1.00 0.44 H new ATOM 0 HB2 ALA A 3 1.837 -8.931 9.345 1.00 0.44 H new ATOM 0 HB3 ALA A 3 2.289 -8.674 11.047 1.00 0.44 H new ATOM 52 N THR A 4 2.092 -4.967 10.525 1.00 0.23 N ATOM 53 CA THR A 4 2.030 -3.812 11.399 1.00 0.26 C ATOM 54 C THR A 4 0.595 -3.523 11.803 1.00 0.27 C ATOM 55 O THR A 4 0.269 -3.492 12.989 1.00 0.41 O ATOM 56 CB THR A 4 2.649 -2.575 10.730 1.00 0.26 C ATOM 57 OG1 THR A 4 2.118 -2.423 9.413 1.00 0.23 O ATOM 58 CG2 THR A 4 4.160 -2.689 10.641 1.00 0.27 C ATOM 0 H THR A 4 1.447 -4.931 9.736 1.00 0.23 H new ATOM 0 HA THR A 4 2.609 -4.042 12.294 1.00 0.26 H new ATOM 0 HB THR A 4 2.401 -1.707 11.342 1.00 0.26 H new ATOM 0 HG1 THR A 4 1.284 -1.909 9.454 1.00 0.23 H new ATOM 0 HG21 THR A 4 4.565 -1.797 10.163 1.00 0.27 H new ATOM 0 HG22 THR A 4 4.577 -2.784 11.643 1.00 0.27 H new ATOM 0 HG23 THR A 4 4.425 -3.568 10.053 1.00 0.27 H new ATOM 66 N GLY A 5 -0.265 -3.317 10.817 1.00 0.21 N ATOM 67 CA GLY A 5 -1.669 -3.158 11.098 1.00 0.24 C ATOM 68 C GLY A 5 -2.034 -1.735 11.456 1.00 0.25 C ATOM 69 O GLY A 5 -2.707 -1.487 12.460 1.00 0.32 O ATOM 0 H GLY A 5 -0.013 -3.258 9.830 1.00 0.21 H new ATOM 0 HA2 GLY A 5 -2.247 -3.469 10.228 1.00 0.24 H new ATOM 0 HA3 GLY A 5 -1.948 -3.818 11.919 1.00 0.24 H new ATOM 73 N ILE A 6 -1.583 -0.795 10.643 1.00 0.21 N ATOM 74 CA ILE A 6 -1.975 0.592 10.805 1.00 0.22 C ATOM 75 C ILE A 6 -2.976 0.961 9.719 1.00 0.19 C ATOM 76 O ILE A 6 -2.634 1.031 8.544 1.00 0.17 O ATOM 77 CB ILE A 6 -0.760 1.568 10.792 1.00 0.23 C ATOM 78 CG1 ILE A 6 -1.218 3.013 10.556 1.00 0.26 C ATOM 79 CG2 ILE A 6 0.278 1.165 9.751 1.00 0.20 C ATOM 80 CD1 ILE A 6 -2.113 3.566 11.647 1.00 0.31 C ATOM 0 H ILE A 6 -0.946 -0.968 9.865 1.00 0.21 H new ATOM 0 HA ILE A 6 -2.437 0.695 11.787 1.00 0.22 H new ATOM 0 HB ILE A 6 -0.290 1.507 11.773 1.00 0.23 H new ATOM 0 HG12 ILE A 6 -0.339 3.651 10.464 1.00 0.26 H new ATOM 0 HG13 ILE A 6 -1.749 3.064 9.605 1.00 0.26 H new ATOM 0 HG21 ILE A 6 1.109 1.870 9.774 1.00 0.20 H new ATOM 0 HG22 ILE A 6 0.646 0.163 9.973 1.00 0.20 H new ATOM 0 HG23 ILE A 6 -0.178 1.173 8.761 1.00 0.20 H new ATOM 0 HD11 ILE A 6 -2.392 4.591 11.404 1.00 0.31 H new ATOM 0 HD12 ILE A 6 -3.012 2.954 11.725 1.00 0.31 H new ATOM 0 HD13 ILE A 6 -1.580 3.551 12.598 1.00 0.31 H new ATOM 92 N VAL A 7 -4.222 1.146 10.115 1.00 0.24 N ATOM 93 CA VAL A 7 -5.263 1.516 9.175 1.00 0.22 C ATOM 94 C VAL A 7 -5.206 3.008 8.867 1.00 0.23 C ATOM 95 O VAL A 7 -5.121 3.842 9.771 1.00 0.28 O ATOM 96 CB VAL A 7 -6.669 1.119 9.674 1.00 0.23 C ATOM 97 CG1 VAL A 7 -7.751 1.795 8.836 1.00 0.24 C ATOM 98 CG2 VAL A 7 -6.829 -0.396 9.624 1.00 0.23 C ATOM 0 H VAL A 7 -4.537 1.046 11.080 1.00 0.24 H new ATOM 0 HA VAL A 7 -5.077 0.959 8.257 1.00 0.22 H new ATOM 0 HB VAL A 7 -6.779 1.454 10.705 1.00 0.23 H new ATOM 0 HG11 VAL A 7 -8.734 1.501 9.205 1.00 0.24 H new ATOM 0 HG12 VAL A 7 -7.645 2.877 8.909 1.00 0.24 H new ATOM 0 HG13 VAL A 7 -7.648 1.490 7.795 1.00 0.24 H new ATOM 0 HG21 VAL A 7 -7.823 -0.669 9.978 1.00 0.23 H new ATOM 0 HG22 VAL A 7 -6.701 -0.742 8.598 1.00 0.23 H new ATOM 0 HG23 VAL A 7 -6.077 -0.862 10.260 1.00 0.23 H new ATOM 108 N ARG A 8 -5.270 3.337 7.586 1.00 0.22 N ATOM 109 CA ARG A 8 -5.226 4.701 7.116 1.00 0.25 C ATOM 110 C ARG A 8 -6.405 4.883 6.177 1.00 0.23 C ATOM 111 O ARG A 8 -6.573 4.103 5.241 1.00 0.26 O ATOM 112 CB ARG A 8 -3.885 4.976 6.389 1.00 0.26 C ATOM 113 CG ARG A 8 -3.984 5.809 5.098 1.00 0.27 C ATOM 114 CD ARG A 8 -4.535 7.200 5.346 1.00 0.31 C ATOM 115 NE ARG A 8 -3.737 7.976 6.294 1.00 1.12 N ATOM 116 CZ ARG A 8 -3.854 9.295 6.446 1.00 1.16 C ATOM 117 NH1 ARG A 8 -4.698 9.984 5.678 1.00 0.64 N ATOM 118 NH2 ARG A 8 -3.125 9.928 7.356 1.00 1.99 N ATOM 0 H ARG A 8 -5.355 2.649 6.838 1.00 0.22 H new ATOM 0 HA ARG A 8 -5.289 5.406 7.945 1.00 0.25 H new ATOM 0 HB2 ARG A 8 -3.217 5.489 7.080 1.00 0.26 H new ATOM 0 HB3 ARG A 8 -3.421 4.020 6.148 1.00 0.26 H new ATOM 0 HG2 ARG A 8 -2.996 5.888 4.644 1.00 0.27 H new ATOM 0 HG3 ARG A 8 -4.623 5.291 4.383 1.00 0.27 H new ATOM 0 HD2 ARG A 8 -4.586 7.737 4.399 1.00 0.31 H new ATOM 0 HD3 ARG A 8 -5.555 7.118 5.722 1.00 0.31 H new ATOM 0 HE ARG A 8 -3.055 7.482 6.869 1.00 1.12 H new ATOM 0 HH11 ARG A 8 -5.255 9.502 4.973 1.00 0.64 H new ATOM 0 HH12 ARG A 8 -4.786 10.993 5.796 1.00 0.64 H new ATOM 0 HH21 ARG A 8 -2.473 9.405 7.941 1.00 1.99 H new ATOM 0 HH22 ARG A 8 -3.216 10.937 7.470 1.00 1.99 H new ATOM 132 N ARG A 9 -7.239 5.865 6.438 1.00 0.19 N ATOM 133 CA ARG A 9 -8.328 6.162 5.532 1.00 0.18 C ATOM 134 C ARG A 9 -7.813 7.096 4.467 1.00 0.20 C ATOM 135 O ARG A 9 -7.655 8.285 4.733 1.00 0.22 O ATOM 136 CB ARG A 9 -9.488 6.800 6.282 1.00 0.19 C ATOM 137 CG ARG A 9 -10.843 6.530 5.665 1.00 0.28 C ATOM 138 CD ARG A 9 -11.730 5.838 6.685 1.00 0.62 C ATOM 139 NE ARG A 9 -13.009 5.397 6.143 1.00 1.45 N ATOM 140 CZ ARG A 9 -14.090 5.166 6.888 1.00 1.80 C ATOM 141 NH1 ARG A 9 -14.106 5.504 8.172 1.00 1.59 N ATOM 142 NH2 ARG A 9 -15.173 4.636 6.332 1.00 2.80 N ATOM 0 H ARG A 9 -7.186 6.466 7.260 1.00 0.19 H new ATOM 0 HA ARG A 9 -8.694 5.242 5.077 1.00 0.18 H new ATOM 0 HB2 ARG A 9 -9.488 6.434 7.309 1.00 0.19 H new ATOM 0 HB3 ARG A 9 -9.329 7.877 6.328 1.00 0.19 H new ATOM 0 HG2 ARG A 9 -11.301 7.465 5.342 1.00 0.28 H new ATOM 0 HG3 ARG A 9 -10.734 5.906 4.778 1.00 0.28 H new ATOM 0 HD2 ARG A 9 -11.200 4.976 7.090 1.00 0.62 H new ATOM 0 HD3 ARG A 9 -11.913 6.519 7.516 1.00 0.62 H new ATOM 0 HE ARG A 9 -13.081 5.257 5.135 1.00 1.45 H new ATOM 0 HH11 ARG A 9 -13.288 5.943 8.594 1.00 1.59 H new ATOM 0 HH12 ARG A 9 -14.936 5.324 8.736 1.00 1.59 H new ATOM 0 HH21 ARG A 9 -15.176 4.407 5.338 1.00 2.80 H new ATOM 0 HH22 ARG A 9 -16.002 4.458 6.899 1.00 2.80 H new ATOM 156 N ILE A 10 -7.549 6.517 3.285 1.00 0.21 N ATOM 157 CA ILE A 10 -6.967 7.207 2.113 1.00 0.24 C ATOM 158 C ILE A 10 -6.793 8.721 2.292 1.00 0.29 C ATOM 159 O ILE A 10 -5.890 9.146 3.027 1.00 0.33 O ATOM 160 CB ILE A 10 -7.762 6.899 0.810 1.00 0.22 C ATOM 161 CG1 ILE A 10 -9.258 6.632 1.088 1.00 0.21 C ATOM 162 CG2 ILE A 10 -7.130 5.708 0.116 1.00 0.21 C ATOM 163 CD1 ILE A 10 -9.902 7.613 2.040 1.00 0.22 C ATOM 0 H ILE A 10 -7.738 5.530 3.109 1.00 0.21 H new ATOM 0 HA ILE A 10 -5.961 6.797 2.021 1.00 0.24 H new ATOM 0 HB ILE A 10 -7.715 7.776 0.165 1.00 0.22 H new ATOM 0 HG12 ILE A 10 -9.800 6.653 0.142 1.00 0.21 H new ATOM 0 HG13 ILE A 10 -9.365 5.626 1.494 1.00 0.21 H new ATOM 0 HG21 ILE A 10 -7.681 5.485 -0.798 1.00 0.21 H new ATOM 0 HG22 ILE A 10 -6.094 5.939 -0.132 1.00 0.21 H new ATOM 0 HG23 ILE A 10 -7.161 4.843 0.778 1.00 0.21 H new ATOM 0 HD11 ILE A 10 -10.951 7.351 2.178 1.00 0.22 H new ATOM 0 HD12 ILE A 10 -9.389 7.577 3.001 1.00 0.22 H new ATOM 0 HD13 ILE A 10 -9.831 8.620 1.628 1.00 0.22 H new ATOM 175 N ASP A 11 -7.659 9.510 1.637 1.00 0.30 N ATOM 176 CA ASP A 11 -7.665 10.967 1.747 1.00 0.36 C ATOM 177 C ASP A 11 -8.427 11.538 0.570 1.00 0.36 C ATOM 178 O ASP A 11 -9.103 10.801 -0.140 1.00 0.36 O ATOM 179 CB ASP A 11 -6.247 11.566 1.791 1.00 0.37 C ATOM 180 CG ASP A 11 -5.555 11.627 0.438 1.00 0.34 C ATOM 181 OD1 ASP A 11 -5.140 10.579 -0.084 1.00 1.13 O ATOM 182 OD2 ASP A 11 -5.415 12.737 -0.107 1.00 1.12 O ATOM 0 H ASP A 11 -8.379 9.146 1.012 1.00 0.30 H new ATOM 0 HA ASP A 11 -8.147 11.231 2.689 1.00 0.36 H new ATOM 0 HB2 ASP A 11 -6.303 12.573 2.204 1.00 0.37 H new ATOM 0 HB3 ASP A 11 -5.636 10.975 2.473 1.00 0.37 H new ATOM 187 N ASP A 12 -8.298 12.839 0.358 1.00 0.41 N ATOM 188 CA ASP A 12 -9.011 13.526 -0.710 1.00 0.43 C ATOM 189 C ASP A 12 -8.496 13.091 -2.076 1.00 0.37 C ATOM 190 O ASP A 12 -9.197 13.214 -3.081 1.00 0.50 O ATOM 191 CB ASP A 12 -8.851 15.039 -0.561 1.00 0.54 C ATOM 192 CG ASP A 12 -9.470 15.570 0.716 1.00 1.38 C ATOM 193 OD1 ASP A 12 -8.933 15.281 1.808 1.00 2.26 O ATOM 194 OD2 ASP A 12 -10.491 16.281 0.635 1.00 1.98 O ATOM 0 H ASP A 12 -7.700 13.446 0.918 1.00 0.41 H new ATOM 0 HA ASP A 12 -10.066 13.263 -0.635 1.00 0.43 H new ATOM 0 HB2 ASP A 12 -7.791 15.291 -0.578 1.00 0.54 H new ATOM 0 HB3 ASP A 12 -9.311 15.535 -1.416 1.00 0.54 H new ATOM 199 N LEU A 13 -7.271 12.594 -2.110 1.00 0.32 N ATOM 200 CA LEU A 13 -6.666 12.141 -3.348 1.00 0.29 C ATOM 201 C LEU A 13 -6.741 10.618 -3.453 1.00 0.24 C ATOM 202 O LEU A 13 -7.267 10.088 -4.430 1.00 0.26 O ATOM 203 CB LEU A 13 -5.214 12.625 -3.427 1.00 0.32 C ATOM 204 CG LEU A 13 -4.559 12.582 -4.815 1.00 0.40 C ATOM 205 CD1 LEU A 13 -4.208 11.157 -5.222 1.00 0.36 C ATOM 206 CD2 LEU A 13 -5.468 13.226 -5.851 1.00 0.53 C ATOM 0 H LEU A 13 -6.674 12.494 -1.289 1.00 0.32 H new ATOM 0 HA LEU A 13 -7.217 12.563 -4.188 1.00 0.29 H new ATOM 0 HB2 LEU A 13 -5.175 13.651 -3.061 1.00 0.32 H new ATOM 0 HB3 LEU A 13 -4.614 12.021 -2.746 1.00 0.32 H new ATOM 0 HG LEU A 13 -3.630 13.149 -4.763 1.00 0.40 H new ATOM 0 HD11 LEU A 13 -3.746 11.164 -6.209 1.00 0.36 H new ATOM 0 HD12 LEU A 13 -3.511 10.733 -4.499 1.00 0.36 H new ATOM 0 HD13 LEU A 13 -5.115 10.553 -5.250 1.00 0.36 H new ATOM 0 HD21 LEU A 13 -4.989 13.187 -6.829 1.00 0.53 H new ATOM 0 HD22 LEU A 13 -6.415 12.688 -5.889 1.00 0.53 H new ATOM 0 HD23 LEU A 13 -5.652 14.265 -5.578 1.00 0.53 H new ATOM 218 N GLY A 14 -6.216 9.917 -2.455 1.00 0.21 N ATOM 219 CA GLY A 14 -6.236 8.468 -2.485 1.00 0.19 C ATOM 220 C GLY A 14 -4.908 7.848 -2.102 1.00 0.19 C ATOM 221 O GLY A 14 -4.667 6.679 -2.379 1.00 0.22 O ATOM 0 H GLY A 14 -5.779 10.325 -1.629 1.00 0.21 H new ATOM 0 HA2 GLY A 14 -7.008 8.107 -1.806 1.00 0.19 H new ATOM 0 HA3 GLY A 14 -6.511 8.135 -3.486 1.00 0.19 H new ATOM 225 N ARG A 15 -4.038 8.610 -1.453 1.00 0.19 N ATOM 226 CA ARG A 15 -2.745 8.074 -1.068 1.00 0.20 C ATOM 227 C ARG A 15 -2.888 7.176 0.138 1.00 0.17 C ATOM 228 O ARG A 15 -3.823 7.306 0.928 1.00 0.17 O ATOM 229 CB ARG A 15 -1.731 9.151 -0.698 1.00 0.25 C ATOM 230 CG ARG A 15 -1.630 10.306 -1.655 1.00 0.25 C ATOM 231 CD ARG A 15 -2.322 11.510 -1.066 1.00 0.29 C ATOM 232 NE ARG A 15 -1.664 12.759 -1.446 1.00 0.40 N ATOM 233 CZ ARG A 15 -2.039 13.970 -1.028 1.00 0.54 C ATOM 234 NH1 ARG A 15 -3.178 14.136 -0.364 1.00 0.67 N ATOM 235 NH2 ARG A 15 -1.294 15.027 -1.317 1.00 0.69 N ATOM 0 H ARG A 15 -4.201 9.581 -1.188 1.00 0.19 H new ATOM 0 HA ARG A 15 -2.384 7.532 -1.942 1.00 0.20 H new ATOM 0 HB2 ARG A 15 -1.985 9.541 0.288 1.00 0.25 H new ATOM 0 HB3 ARG A 15 -0.749 8.686 -0.613 1.00 0.25 H new ATOM 0 HG2 ARG A 15 -0.583 10.536 -1.854 1.00 0.25 H new ATOM 0 HG3 ARG A 15 -2.086 10.042 -2.609 1.00 0.25 H new ATOM 0 HD2 ARG A 15 -3.360 11.531 -1.399 1.00 0.29 H new ATOM 0 HD3 ARG A 15 -2.337 11.424 0.020 1.00 0.29 H new ATOM 0 HE ARG A 15 -0.863 12.701 -2.074 1.00 0.40 H new ATOM 0 HH11 ARG A 15 -3.776 13.333 -0.169 1.00 0.67 H new ATOM 0 HH12 ARG A 15 -3.454 15.066 -0.050 1.00 0.67 H new ATOM 0 HH21 ARG A 15 -0.436 14.914 -1.858 1.00 0.69 H new ATOM 0 HH22 ARG A 15 -1.578 15.954 -0.999 1.00 0.69 H new ATOM 249 N VAL A 16 -1.945 6.280 0.284 1.00 0.18 N ATOM 250 CA VAL A 16 -1.805 5.542 1.506 1.00 0.20 C ATOM 251 C VAL A 16 -0.536 5.997 2.173 1.00 0.19 C ATOM 252 O VAL A 16 0.556 5.583 1.799 1.00 0.21 O ATOM 253 CB VAL A 16 -1.786 4.024 1.282 1.00 0.29 C ATOM 254 CG1 VAL A 16 -1.584 3.299 2.598 1.00 1.11 C ATOM 255 CG2 VAL A 16 -3.078 3.576 0.617 1.00 1.24 C ATOM 0 H VAL A 16 -1.261 6.046 -0.435 1.00 0.18 H new ATOM 0 HA VAL A 16 -2.671 5.739 2.139 1.00 0.20 H new ATOM 0 HB VAL A 16 -0.954 3.777 0.623 1.00 0.29 H new ATOM 0 HG11 VAL A 16 -1.573 2.223 2.423 1.00 1.11 H new ATOM 0 HG12 VAL A 16 -0.636 3.605 3.040 1.00 1.11 H new ATOM 0 HG13 VAL A 16 -2.398 3.547 3.279 1.00 1.11 H new ATOM 0 HG21 VAL A 16 -3.053 2.497 0.463 1.00 1.24 H new ATOM 0 HG22 VAL A 16 -3.924 3.832 1.255 1.00 1.24 H new ATOM 0 HG23 VAL A 16 -3.185 4.077 -0.345 1.00 1.24 H new ATOM 265 N VAL A 17 -0.692 6.893 3.125 1.00 0.20 N ATOM 266 CA VAL A 17 0.445 7.520 3.760 1.00 0.21 C ATOM 267 C VAL A 17 1.242 6.478 4.526 1.00 0.21 C ATOM 268 O VAL A 17 0.796 5.978 5.557 1.00 0.26 O ATOM 269 CB VAL A 17 0.021 8.657 4.709 1.00 0.25 C ATOM 270 CG1 VAL A 17 1.248 9.369 5.256 1.00 0.28 C ATOM 271 CG2 VAL A 17 -0.906 9.632 3.996 1.00 0.27 C ATOM 0 H VAL A 17 -1.598 7.203 3.476 1.00 0.20 H new ATOM 0 HA VAL A 17 1.063 7.959 2.977 1.00 0.21 H new ATOM 0 HB VAL A 17 -0.527 8.228 5.548 1.00 0.25 H new ATOM 0 HG11 VAL A 17 0.935 10.170 5.925 1.00 0.28 H new ATOM 0 HG12 VAL A 17 1.867 8.659 5.805 1.00 0.28 H new ATOM 0 HG13 VAL A 17 1.823 9.789 4.431 1.00 0.28 H new ATOM 0 HG21 VAL A 17 -1.195 10.428 4.683 1.00 0.27 H new ATOM 0 HG22 VAL A 17 -0.390 10.063 3.138 1.00 0.27 H new ATOM 0 HG23 VAL A 17 -1.797 9.105 3.657 1.00 0.27 H new ATOM 281 N ILE A 18 2.397 6.129 3.986 1.00 0.20 N ATOM 282 CA ILE A 18 3.244 5.118 4.580 1.00 0.22 C ATOM 283 C ILE A 18 4.304 5.770 5.450 1.00 0.20 C ATOM 284 O ILE A 18 5.220 6.425 4.951 1.00 0.21 O ATOM 285 CB ILE A 18 3.909 4.227 3.499 1.00 0.26 C ATOM 286 CG1 ILE A 18 2.854 3.379 2.786 1.00 0.42 C ATOM 287 CG2 ILE A 18 4.985 3.338 4.116 1.00 0.25 C ATOM 288 CD1 ILE A 18 2.091 2.454 3.703 1.00 0.77 C ATOM 0 H ILE A 18 2.769 6.538 3.129 1.00 0.20 H new ATOM 0 HA ILE A 18 2.617 4.477 5.199 1.00 0.22 H new ATOM 0 HB ILE A 18 4.386 4.876 2.765 1.00 0.26 H new ATOM 0 HG12 ILE A 18 2.148 4.041 2.284 1.00 0.42 H new ATOM 0 HG13 ILE A 18 3.341 2.787 2.011 1.00 0.42 H new ATOM 0 HG21 ILE A 18 5.438 2.722 3.339 1.00 0.25 H new ATOM 0 HG22 ILE A 18 5.751 3.961 4.577 1.00 0.25 H new ATOM 0 HG23 ILE A 18 4.536 2.695 4.873 1.00 0.25 H new ATOM 0 HD11 ILE A 18 1.362 1.887 3.124 1.00 0.77 H new ATOM 0 HD12 ILE A 18 2.785 1.766 4.186 1.00 0.77 H new ATOM 0 HD13 ILE A 18 1.574 3.040 4.463 1.00 0.77 H new ATOM 300 N PRO A 19 4.163 5.640 6.775 1.00 0.23 N ATOM 301 CA PRO A 19 5.154 6.129 7.720 1.00 0.26 C ATOM 302 C PRO A 19 6.571 5.729 7.344 1.00 0.24 C ATOM 303 O PRO A 19 6.813 4.638 6.818 1.00 0.23 O ATOM 304 CB PRO A 19 4.751 5.459 9.015 1.00 0.29 C ATOM 305 CG PRO A 19 3.275 5.366 8.914 1.00 0.32 C ATOM 306 CD PRO A 19 3.004 5.043 7.468 1.00 0.29 C ATOM 0 HA PRO A 19 5.170 7.218 7.763 1.00 0.26 H new ATOM 0 HB2 PRO A 19 5.209 4.475 9.117 1.00 0.29 H new ATOM 0 HB3 PRO A 19 5.058 6.044 9.882 1.00 0.29 H new ATOM 0 HG2 PRO A 19 2.882 4.591 9.572 1.00 0.32 H new ATOM 0 HG3 PRO A 19 2.799 6.303 9.205 1.00 0.32 H new ATOM 0 HD2 PRO A 19 2.942 3.968 7.299 1.00 0.29 H new ATOM 0 HD3 PRO A 19 2.063 5.474 7.127 1.00 0.29 H new ATOM 314 N LYS A 20 7.509 6.600 7.643 1.00 0.27 N ATOM 315 CA LYS A 20 8.906 6.347 7.345 1.00 0.28 C ATOM 316 C LYS A 20 9.433 5.163 8.139 1.00 0.25 C ATOM 317 O LYS A 20 10.496 4.662 7.840 1.00 0.26 O ATOM 318 CB LYS A 20 9.780 7.586 7.578 1.00 0.35 C ATOM 319 CG LYS A 20 9.440 8.384 8.830 1.00 0.40 C ATOM 320 CD LYS A 20 8.212 9.267 8.633 1.00 0.55 C ATOM 321 CE LYS A 20 8.524 10.536 7.837 1.00 0.77 C ATOM 322 NZ LYS A 20 8.939 10.265 6.427 1.00 1.57 N ATOM 0 H LYS A 20 7.330 7.497 8.095 1.00 0.27 H new ATOM 0 HA LYS A 20 8.962 6.102 6.284 1.00 0.28 H new ATOM 0 HB2 LYS A 20 10.822 7.272 7.637 1.00 0.35 H new ATOM 0 HB3 LYS A 20 9.693 8.242 6.712 1.00 0.35 H new ATOM 0 HG2 LYS A 20 9.264 7.699 9.659 1.00 0.40 H new ATOM 0 HG3 LYS A 20 10.292 9.005 9.106 1.00 0.40 H new ATOM 0 HD2 LYS A 20 7.439 8.699 8.116 1.00 0.55 H new ATOM 0 HD3 LYS A 20 7.807 9.543 9.607 1.00 0.55 H new ATOM 0 HE2 LYS A 20 7.643 11.178 7.832 1.00 0.77 H new ATOM 0 HE3 LYS A 20 9.317 11.087 8.342 1.00 0.77 H new ATOM 0 HZ1 LYS A 20 8.566 11.011 5.806 1.00 1.57 H new ATOM 0 HZ2 LYS A 20 9.977 10.252 6.367 1.00 1.57 H new ATOM 0 HZ3 LYS A 20 8.563 9.343 6.126 1.00 1.57 H new ATOM 336 N GLU A 21 8.694 4.729 9.155 1.00 0.24 N ATOM 337 CA GLU A 21 9.090 3.574 9.961 1.00 0.24 C ATOM 338 C GLU A 21 9.129 2.275 9.141 1.00 0.22 C ATOM 339 O GLU A 21 9.869 1.339 9.473 1.00 0.23 O ATOM 340 CB GLU A 21 8.155 3.419 11.160 1.00 0.27 C ATOM 341 CG GLU A 21 6.706 3.180 10.786 1.00 0.35 C ATOM 342 CD GLU A 21 5.782 3.293 11.978 1.00 0.73 C ATOM 343 OE1 GLU A 21 5.306 4.412 12.261 1.00 1.32 O ATOM 344 OE2 GLU A 21 5.527 2.268 12.642 1.00 1.30 O ATOM 0 H GLU A 21 7.815 5.159 9.442 1.00 0.24 H new ATOM 0 HA GLU A 21 10.104 3.760 10.316 1.00 0.24 H new ATOM 0 HB2 GLU A 21 8.503 2.588 11.774 1.00 0.27 H new ATOM 0 HB3 GLU A 21 8.217 4.317 11.775 1.00 0.27 H new ATOM 0 HG2 GLU A 21 6.405 3.901 10.026 1.00 0.35 H new ATOM 0 HG3 GLU A 21 6.606 2.189 10.343 1.00 0.35 H new ATOM 351 N ILE A 22 8.394 2.229 8.033 1.00 0.23 N ATOM 352 CA ILE A 22 8.363 1.020 7.228 1.00 0.25 C ATOM 353 C ILE A 22 9.516 1.079 6.245 1.00 0.24 C ATOM 354 O ILE A 22 10.287 0.133 6.115 1.00 0.25 O ATOM 355 CB ILE A 22 7.026 0.830 6.476 1.00 0.29 C ATOM 356 CG1 ILE A 22 5.866 0.794 7.471 1.00 0.27 C ATOM 357 CG2 ILE A 22 7.050 -0.449 5.646 1.00 0.35 C ATOM 358 CD1 ILE A 22 5.219 2.136 7.707 1.00 0.25 C ATOM 0 H ILE A 22 7.825 2.999 7.681 1.00 0.23 H new ATOM 0 HA ILE A 22 8.458 0.162 7.894 1.00 0.25 H new ATOM 0 HB ILE A 22 6.887 1.673 5.800 1.00 0.29 H new ATOM 0 HG12 ILE A 22 5.111 0.097 7.108 1.00 0.27 H new ATOM 0 HG13 ILE A 22 6.229 0.404 8.422 1.00 0.27 H new ATOM 0 HG21 ILE A 22 6.099 -0.563 5.125 1.00 0.35 H new ATOM 0 HG22 ILE A 22 7.859 -0.395 4.917 1.00 0.35 H new ATOM 0 HG23 ILE A 22 7.209 -1.305 6.301 1.00 0.35 H new ATOM 0 HD11 ILE A 22 4.406 2.027 8.424 1.00 0.25 H new ATOM 0 HD12 ILE A 22 5.959 2.833 8.101 1.00 0.25 H new ATOM 0 HD13 ILE A 22 4.824 2.520 6.766 1.00 0.25 H new ATOM 370 N ARG A 23 9.651 2.237 5.609 1.00 0.23 N ATOM 371 CA ARG A 23 10.784 2.533 4.741 1.00 0.22 C ATOM 372 C ARG A 23 12.071 2.479 5.559 1.00 0.23 C ATOM 373 O ARG A 23 13.153 2.208 5.045 1.00 0.24 O ATOM 374 CB ARG A 23 10.544 3.901 4.065 1.00 0.24 C ATOM 375 CG ARG A 23 11.741 4.838 3.984 1.00 0.48 C ATOM 376 CD ARG A 23 11.991 5.547 5.305 1.00 0.39 C ATOM 377 NE ARG A 23 12.150 6.992 5.162 1.00 0.82 N ATOM 378 CZ ARG A 23 12.854 7.744 6.006 1.00 0.96 C ATOM 379 NH1 ARG A 23 13.513 7.185 7.016 1.00 1.34 N ATOM 380 NH2 ARG A 23 12.895 9.055 5.836 1.00 1.50 N ATOM 0 H ARG A 23 8.976 2.999 5.681 1.00 0.23 H new ATOM 0 HA ARG A 23 10.886 1.793 3.947 1.00 0.22 H new ATOM 0 HB2 ARG A 23 10.182 3.722 3.053 1.00 0.24 H new ATOM 0 HB3 ARG A 23 9.746 4.412 4.604 1.00 0.24 H new ATOM 0 HG2 ARG A 23 12.628 4.271 3.702 1.00 0.48 H new ATOM 0 HG3 ARG A 23 11.572 5.577 3.201 1.00 0.48 H new ATOM 0 HD2 ARG A 23 11.160 5.345 5.981 1.00 0.39 H new ATOM 0 HD3 ARG A 23 12.887 5.134 5.768 1.00 0.39 H new ATOM 0 HE ARG A 23 11.697 7.451 4.372 1.00 0.82 H new ATOM 0 HH11 ARG A 23 13.481 6.174 7.148 1.00 1.34 H new ATOM 0 HH12 ARG A 23 14.050 7.767 7.659 1.00 1.34 H new ATOM 0 HH21 ARG A 23 12.389 9.485 5.062 1.00 1.50 H new ATOM 0 HH22 ARG A 23 13.433 9.636 6.479 1.00 1.50 H new ATOM 394 N ARG A 24 11.922 2.750 6.842 1.00 0.24 N ATOM 395 CA ARG A 24 12.995 2.613 7.805 1.00 0.27 C ATOM 396 C ARG A 24 13.447 1.169 7.918 1.00 0.29 C ATOM 397 O ARG A 24 14.641 0.884 7.837 1.00 0.32 O ATOM 398 CB ARG A 24 12.549 3.126 9.168 1.00 0.31 C ATOM 399 CG ARG A 24 13.589 2.954 10.252 1.00 0.39 C ATOM 400 CD ARG A 24 13.092 3.473 11.589 1.00 0.45 C ATOM 401 NE ARG A 24 14.143 3.440 12.604 1.00 1.39 N ATOM 402 CZ ARG A 24 13.939 3.674 13.899 1.00 1.90 C ATOM 403 NH1 ARG A 24 12.725 3.982 14.342 1.00 1.52 N ATOM 404 NH2 ARG A 24 14.955 3.602 14.749 1.00 2.96 N ATOM 0 H ARG A 24 11.044 3.074 7.247 1.00 0.24 H new ATOM 0 HA ARG A 24 13.838 3.209 7.456 1.00 0.27 H new ATOM 0 HB2 ARG A 24 12.296 4.183 9.084 1.00 0.31 H new ATOM 0 HB3 ARG A 24 11.639 2.603 9.463 1.00 0.31 H new ATOM 0 HG2 ARG A 24 13.849 1.899 10.344 1.00 0.39 H new ATOM 0 HG3 ARG A 24 14.500 3.483 9.971 1.00 0.39 H new ATOM 0 HD2 ARG A 24 12.731 4.495 11.472 1.00 0.45 H new ATOM 0 HD3 ARG A 24 12.246 2.872 11.921 1.00 0.45 H new ATOM 0 HE ARG A 24 15.093 3.224 12.301 1.00 1.39 H new ATOM 0 HH11 ARG A 24 11.943 4.040 13.689 1.00 1.52 H new ATOM 0 HH12 ARG A 24 12.574 4.160 15.335 1.00 1.52 H new ATOM 0 HH21 ARG A 24 15.888 3.368 14.410 1.00 2.96 H new ATOM 0 HH22 ARG A 24 14.803 3.781 15.742 1.00 2.96 H new ATOM 418 N THR A 25 12.511 0.248 8.131 1.00 0.29 N ATOM 419 CA THR A 25 12.832 -1.170 8.097 1.00 0.31 C ATOM 420 C THR A 25 13.346 -1.574 6.712 1.00 0.30 C ATOM 421 O THR A 25 14.180 -2.467 6.579 1.00 0.33 O ATOM 422 CB THR A 25 11.584 -1.999 8.464 1.00 0.34 C ATOM 423 OG1 THR A 25 11.042 -1.520 9.707 1.00 0.36 O ATOM 424 CG2 THR A 25 11.915 -3.479 8.590 1.00 0.40 C ATOM 0 H THR A 25 11.532 0.459 8.327 1.00 0.29 H new ATOM 0 HA THR A 25 13.618 -1.367 8.826 1.00 0.31 H new ATOM 0 HB THR A 25 10.852 -1.884 7.665 1.00 0.34 H new ATOM 0 HG1 THR A 25 10.547 -0.689 9.549 1.00 0.36 H new ATOM 0 HG21 THR A 25 11.013 -4.033 8.849 1.00 0.40 H new ATOM 0 HG22 THR A 25 12.306 -3.846 7.641 1.00 0.40 H new ATOM 0 HG23 THR A 25 12.664 -3.619 9.370 1.00 0.40 H new ATOM 432 N LEU A 26 12.847 -0.886 5.691 1.00 0.27 N ATOM 433 CA LEU A 26 13.328 -1.056 4.323 1.00 0.28 C ATOM 434 C LEU A 26 14.788 -0.606 4.202 1.00 0.31 C ATOM 435 O LEU A 26 15.498 -1.024 3.289 1.00 0.36 O ATOM 436 CB LEU A 26 12.447 -0.250 3.351 1.00 0.25 C ATOM 437 CG LEU A 26 11.331 -1.031 2.646 1.00 0.26 C ATOM 438 CD1 LEU A 26 11.916 -2.173 1.842 1.00 0.32 C ATOM 439 CD2 LEU A 26 10.307 -1.561 3.637 1.00 0.26 C ATOM 0 H LEU A 26 12.101 -0.197 5.786 1.00 0.27 H new ATOM 0 HA LEU A 26 13.270 -2.114 4.066 1.00 0.28 H new ATOM 0 HB2 LEU A 26 11.994 0.574 3.902 1.00 0.25 H new ATOM 0 HB3 LEU A 26 13.091 0.191 2.590 1.00 0.25 H new ATOM 0 HG LEU A 26 10.820 -0.343 1.973 1.00 0.26 H new ATOM 0 HD11 LEU A 26 11.113 -2.719 1.347 1.00 0.32 H new ATOM 0 HD12 LEU A 26 12.601 -1.777 1.092 1.00 0.32 H new ATOM 0 HD13 LEU A 26 12.456 -2.847 2.507 1.00 0.32 H new ATOM 0 HD21 LEU A 26 9.532 -2.109 3.101 1.00 0.26 H new ATOM 0 HD22 LEU A 26 10.798 -2.227 4.346 1.00 0.26 H new ATOM 0 HD23 LEU A 26 9.856 -0.727 4.175 1.00 0.26 H new ATOM 451 N ARG A 27 15.221 0.238 5.151 1.00 0.32 N ATOM 452 CA ARG A 27 16.566 0.827 5.158 1.00 0.40 C ATOM 453 C ARG A 27 16.718 1.849 4.041 1.00 0.39 C ATOM 454 O ARG A 27 17.827 2.189 3.626 1.00 0.46 O ATOM 455 CB ARG A 27 17.647 -0.246 5.047 1.00 0.51 C ATOM 456 CG ARG A 27 18.420 -0.458 6.335 1.00 0.78 C ATOM 457 CD ARG A 27 17.490 -0.760 7.498 1.00 0.90 C ATOM 458 NE ARG A 27 18.202 -0.788 8.770 1.00 1.76 N ATOM 459 CZ ARG A 27 17.651 -0.460 9.938 1.00 2.28 C ATOM 460 NH1 ARG A 27 16.378 -0.078 9.998 1.00 2.36 N ATOM 461 NH2 ARG A 27 18.380 -0.501 11.042 1.00 3.20 N ATOM 0 H ARG A 27 14.644 0.532 5.939 1.00 0.32 H new ATOM 0 HA ARG A 27 16.693 1.336 6.114 1.00 0.40 H new ATOM 0 HB2 ARG A 27 17.185 -1.187 4.750 1.00 0.51 H new ATOM 0 HB3 ARG A 27 18.343 0.031 4.255 1.00 0.51 H new ATOM 0 HG2 ARG A 27 19.124 -1.280 6.207 1.00 0.78 H new ATOM 0 HG3 ARG A 27 19.007 0.432 6.559 1.00 0.78 H new ATOM 0 HD2 ARG A 27 16.703 -0.007 7.539 1.00 0.90 H new ATOM 0 HD3 ARG A 27 17.003 -1.721 7.333 1.00 0.90 H new ATOM 0 HE ARG A 27 19.181 -1.076 8.766 1.00 1.76 H new ATOM 0 HH11 ARG A 27 15.818 -0.035 9.147 1.00 2.36 H new ATOM 0 HH12 ARG A 27 15.962 0.172 10.895 1.00 2.36 H new ATOM 0 HH21 ARG A 27 19.359 -0.783 10.996 1.00 3.20 H new ATOM 0 HH22 ARG A 27 17.963 -0.251 11.938 1.00 3.20 H new ATOM 475 N ILE A 28 15.589 2.356 3.588 1.00 0.33 N ATOM 476 CA ILE A 28 15.552 3.309 2.495 1.00 0.33 C ATOM 477 C ILE A 28 14.970 4.630 3.007 1.00 0.31 C ATOM 478 O ILE A 28 14.873 4.830 4.219 1.00 0.34 O ATOM 479 CB ILE A 28 14.738 2.720 1.316 1.00 0.36 C ATOM 480 CG1 ILE A 28 15.049 1.221 1.197 1.00 0.44 C ATOM 481 CG2 ILE A 28 15.086 3.419 0.003 1.00 0.38 C ATOM 482 CD1 ILE A 28 14.294 0.503 0.104 1.00 0.48 C ATOM 0 H ILE A 28 14.672 2.120 3.966 1.00 0.33 H new ATOM 0 HA ILE A 28 16.557 3.508 2.122 1.00 0.33 H new ATOM 0 HB ILE A 28 13.677 2.874 1.511 1.00 0.36 H new ATOM 0 HG12 ILE A 28 16.118 1.099 1.022 1.00 0.44 H new ATOM 0 HG13 ILE A 28 14.825 0.741 2.150 1.00 0.44 H new ATOM 0 HG21 ILE A 28 14.500 2.985 -0.807 1.00 0.38 H new ATOM 0 HG22 ILE A 28 14.860 4.482 0.086 1.00 0.38 H new ATOM 0 HG23 ILE A 28 16.148 3.289 -0.208 1.00 0.38 H new ATOM 0 HD11 ILE A 28 14.578 -0.549 0.096 1.00 0.48 H new ATOM 0 HD12 ILE A 28 13.223 0.588 0.286 1.00 0.48 H new ATOM 0 HD13 ILE A 28 14.535 0.951 -0.860 1.00 0.48 H new ATOM 494 N ARG A 29 14.601 5.533 2.113 1.00 0.32 N ATOM 495 CA ARG A 29 14.134 6.858 2.505 1.00 0.32 C ATOM 496 C ARG A 29 13.107 7.394 1.522 1.00 0.30 C ATOM 497 O ARG A 29 12.431 6.623 0.844 1.00 0.28 O ATOM 498 CB ARG A 29 15.329 7.815 2.637 1.00 0.40 C ATOM 499 CG ARG A 29 16.374 7.658 1.540 1.00 0.58 C ATOM 500 CD ARG A 29 15.793 7.943 0.169 1.00 0.64 C ATOM 501 NE ARG A 29 16.764 7.739 -0.901 1.00 0.92 N ATOM 502 CZ ARG A 29 16.857 8.529 -1.969 1.00 1.58 C ATOM 503 NH1 ARG A 29 16.053 9.578 -2.085 1.00 2.40 N ATOM 504 NH2 ARG A 29 17.765 8.289 -2.903 1.00 1.98 N ATOM 0 H ARG A 29 14.615 5.374 1.106 1.00 0.32 H new ATOM 0 HA ARG A 29 13.641 6.780 3.474 1.00 0.32 H new ATOM 0 HB2 ARG A 29 14.962 8.841 2.630 1.00 0.40 H new ATOM 0 HB3 ARG A 29 15.805 7.653 3.604 1.00 0.40 H new ATOM 0 HG2 ARG A 29 17.207 8.335 1.731 1.00 0.58 H new ATOM 0 HG3 ARG A 29 16.776 6.645 1.562 1.00 0.58 H new ATOM 0 HD2 ARG A 29 14.931 7.297 0.001 1.00 0.64 H new ATOM 0 HD3 ARG A 29 15.432 8.971 0.137 1.00 0.64 H new ATOM 0 HE ARG A 29 17.406 6.949 -0.827 1.00 0.92 H new ATOM 0 HH11 ARG A 29 15.366 9.777 -1.357 1.00 2.40 H new ATOM 0 HH12 ARG A 29 16.122 10.185 -2.902 1.00 2.40 H new ATOM 0 HH21 ARG A 29 18.398 7.495 -2.807 1.00 1.98 H new ATOM 0 HH22 ARG A 29 17.831 8.898 -3.719 1.00 1.98 H new ATOM 518 N GLU A 30 13.013 8.714 1.437 1.00 0.34 N ATOM 519 CA GLU A 30 12.042 9.376 0.574 1.00 0.36 C ATOM 520 C GLU A 30 12.449 9.326 -0.896 1.00 0.35 C ATOM 521 O GLU A 30 12.382 10.314 -1.627 1.00 0.44 O ATOM 522 CB GLU A 30 11.830 10.803 1.044 1.00 0.45 C ATOM 523 CG GLU A 30 10.764 10.899 2.120 1.00 0.50 C ATOM 524 CD GLU A 30 11.194 10.320 3.461 1.00 0.62 C ATOM 525 OE1 GLU A 30 11.131 9.086 3.637 1.00 1.08 O ATOM 526 OE2 GLU A 30 11.603 11.095 4.351 1.00 1.23 O ATOM 0 H GLU A 30 13.606 9.356 1.963 1.00 0.34 H new ATOM 0 HA GLU A 30 11.098 8.836 0.647 1.00 0.36 H new ATOM 0 HB2 GLU A 30 12.769 11.200 1.429 1.00 0.45 H new ATOM 0 HB3 GLU A 30 11.545 11.425 0.195 1.00 0.45 H new ATOM 0 HG2 GLU A 30 10.492 11.946 2.257 1.00 0.50 H new ATOM 0 HG3 GLU A 30 9.869 10.378 1.780 1.00 0.50 H new ATOM 533 N GLY A 31 12.885 8.142 -1.293 1.00 0.30 N ATOM 534 CA GLY A 31 13.172 7.825 -2.669 1.00 0.30 C ATOM 535 C GLY A 31 13.149 6.325 -2.858 1.00 0.30 C ATOM 536 O GLY A 31 13.862 5.776 -3.693 1.00 0.36 O ATOM 0 H GLY A 31 13.050 7.366 -0.652 1.00 0.30 H new ATOM 0 HA2 GLY A 31 12.437 8.296 -3.322 1.00 0.30 H new ATOM 0 HA3 GLY A 31 14.148 8.222 -2.949 1.00 0.30 H new ATOM 540 N ASP A 32 12.339 5.668 -2.038 1.00 0.28 N ATOM 541 CA ASP A 32 12.103 4.238 -2.153 1.00 0.31 C ATOM 542 C ASP A 32 10.944 3.995 -3.097 1.00 0.28 C ATOM 543 O ASP A 32 9.889 4.624 -2.978 1.00 0.31 O ATOM 544 CB ASP A 32 11.790 3.634 -0.780 1.00 0.38 C ATOM 545 CG ASP A 32 11.328 2.190 -0.849 1.00 0.43 C ATOM 546 OD1 ASP A 32 11.996 1.383 -1.528 1.00 1.26 O ATOM 547 OD2 ASP A 32 10.319 1.861 -0.194 1.00 1.07 O ATOM 0 H ASP A 32 11.828 6.113 -1.275 1.00 0.28 H new ATOM 0 HA ASP A 32 13.001 3.761 -2.544 1.00 0.31 H new ATOM 0 HB2 ASP A 32 12.680 3.694 -0.153 1.00 0.38 H new ATOM 0 HB3 ASP A 32 11.018 4.232 -0.295 1.00 0.38 H new ATOM 552 N PRO A 33 11.134 3.130 -4.080 1.00 0.23 N ATOM 553 CA PRO A 33 10.079 2.744 -4.973 1.00 0.26 C ATOM 554 C PRO A 33 9.247 1.640 -4.373 1.00 0.47 C ATOM 555 O PRO A 33 9.729 0.856 -3.577 1.00 1.30 O ATOM 556 CB PRO A 33 10.804 2.242 -6.220 1.00 0.22 C ATOM 557 CG PRO A 33 12.267 2.226 -5.879 1.00 0.14 C ATOM 558 CD PRO A 33 12.381 2.444 -4.392 1.00 0.23 C ATOM 0 HA PRO A 33 9.396 3.567 -5.185 1.00 0.26 H new ATOM 0 HB2 PRO A 33 10.458 1.246 -6.496 1.00 0.22 H new ATOM 0 HB3 PRO A 33 10.610 2.894 -7.072 1.00 0.22 H new ATOM 0 HG2 PRO A 33 12.718 1.276 -6.164 1.00 0.14 H new ATOM 0 HG3 PRO A 33 12.798 3.007 -6.424 1.00 0.14 H new ATOM 0 HD2 PRO A 33 12.474 1.503 -3.849 1.00 0.23 H new ATOM 0 HD3 PRO A 33 13.252 3.047 -4.135 1.00 0.23 H new ATOM 566 N LEU A 34 7.991 1.599 -4.723 1.00 0.29 N ATOM 567 CA LEU A 34 7.170 0.492 -4.340 1.00 0.21 C ATOM 568 C LEU A 34 6.269 0.119 -5.489 1.00 0.22 C ATOM 569 O LEU A 34 5.918 0.948 -6.303 1.00 0.27 O ATOM 570 CB LEU A 34 6.339 0.804 -3.093 1.00 0.23 C ATOM 571 CG LEU A 34 7.046 1.645 -2.034 1.00 0.31 C ATOM 572 CD1 LEU A 34 6.539 3.076 -2.067 1.00 0.38 C ATOM 573 CD2 LEU A 34 6.860 1.035 -0.654 1.00 0.38 C ATOM 0 H LEU A 34 7.518 2.318 -5.271 1.00 0.29 H new ATOM 0 HA LEU A 34 7.821 -0.347 -4.093 1.00 0.21 H new ATOM 0 HB2 LEU A 34 5.432 1.324 -3.401 1.00 0.23 H new ATOM 0 HB3 LEU A 34 6.028 -0.137 -2.639 1.00 0.23 H new ATOM 0 HG LEU A 34 8.113 1.657 -2.257 1.00 0.31 H new ATOM 0 HD11 LEU A 34 7.054 3.662 -1.305 1.00 0.38 H new ATOM 0 HD12 LEU A 34 6.732 3.508 -3.049 1.00 0.38 H new ATOM 0 HD13 LEU A 34 5.467 3.087 -1.870 1.00 0.38 H new ATOM 0 HD21 LEU A 34 7.371 1.649 0.087 1.00 0.38 H new ATOM 0 HD22 LEU A 34 5.797 0.989 -0.417 1.00 0.38 H new ATOM 0 HD23 LEU A 34 7.278 0.028 -0.642 1.00 0.38 H new ATOM 585 N GLU A 35 5.881 -1.119 -5.505 1.00 0.20 N ATOM 586 CA GLU A 35 5.045 -1.636 -6.561 1.00 0.20 C ATOM 587 C GLU A 35 3.687 -1.892 -6.003 1.00 0.16 C ATOM 588 O GLU A 35 3.544 -2.737 -5.134 1.00 0.16 O ATOM 589 CB GLU A 35 5.605 -2.907 -7.187 1.00 0.22 C ATOM 590 CG GLU A 35 4.705 -3.495 -8.265 1.00 0.23 C ATOM 591 CD GLU A 35 5.323 -4.681 -8.969 1.00 0.34 C ATOM 592 OE1 GLU A 35 6.139 -4.473 -9.884 1.00 1.12 O ATOM 593 OE2 GLU A 35 4.991 -5.829 -8.611 1.00 0.95 O ATOM 0 H GLU A 35 6.131 -1.804 -4.791 1.00 0.20 H new ATOM 0 HA GLU A 35 5.004 -0.894 -7.358 1.00 0.20 H new ATOM 0 HB2 GLU A 35 6.583 -2.691 -7.618 1.00 0.22 H new ATOM 0 HB3 GLU A 35 5.758 -3.651 -6.406 1.00 0.22 H new ATOM 0 HG2 GLU A 35 3.760 -3.799 -7.815 1.00 0.23 H new ATOM 0 HG3 GLU A 35 4.475 -2.723 -8.999 1.00 0.23 H new ATOM 600 N ILE A 36 2.718 -1.141 -6.491 1.00 0.14 N ATOM 601 CA ILE A 36 1.353 -1.241 -6.043 1.00 0.11 C ATOM 602 C ILE A 36 0.647 -2.331 -6.830 1.00 0.10 C ATOM 603 O ILE A 36 0.429 -2.195 -8.036 1.00 0.14 O ATOM 604 CB ILE A 36 0.601 0.105 -6.244 1.00 0.12 C ATOM 605 CG1 ILE A 36 1.107 1.182 -5.278 1.00 0.15 C ATOM 606 CG2 ILE A 36 -0.902 -0.072 -6.088 1.00 0.14 C ATOM 607 CD1 ILE A 36 2.439 1.801 -5.653 1.00 0.39 C ATOM 0 H ILE A 36 2.864 -0.439 -7.217 1.00 0.14 H new ATOM 0 HA ILE A 36 1.354 -1.482 -4.980 1.00 0.11 H new ATOM 0 HB ILE A 36 0.807 0.435 -7.262 1.00 0.12 H new ATOM 0 HG12 ILE A 36 0.360 1.973 -5.215 1.00 0.15 H new ATOM 0 HG13 ILE A 36 1.193 0.745 -4.283 1.00 0.15 H new ATOM 0 HG21 ILE A 36 -1.398 0.887 -6.234 1.00 0.14 H new ATOM 0 HG22 ILE A 36 -1.263 -0.785 -6.830 1.00 0.14 H new ATOM 0 HG23 ILE A 36 -1.123 -0.446 -5.088 1.00 0.14 H new ATOM 0 HD11 ILE A 36 2.714 2.551 -4.911 1.00 0.39 H new ATOM 0 HD12 ILE A 36 3.204 1.026 -5.686 1.00 0.39 H new ATOM 0 HD13 ILE A 36 2.358 2.272 -6.632 1.00 0.39 H new ATOM 619 N PHE A 37 0.340 -3.426 -6.162 1.00 0.09 N ATOM 620 CA PHE A 37 -0.419 -4.494 -6.778 1.00 0.10 C ATOM 621 C PHE A 37 -1.247 -5.216 -5.723 1.00 0.09 C ATOM 622 O PHE A 37 -0.726 -5.652 -4.704 1.00 0.09 O ATOM 623 CB PHE A 37 0.520 -5.451 -7.540 1.00 0.12 C ATOM 624 CG PHE A 37 0.891 -6.713 -6.806 1.00 0.16 C ATOM 625 CD1 PHE A 37 0.117 -7.857 -6.929 1.00 1.12 C ATOM 626 CD2 PHE A 37 2.014 -6.756 -5.999 1.00 1.10 C ATOM 627 CE1 PHE A 37 0.454 -9.015 -6.261 1.00 1.12 C ATOM 628 CE2 PHE A 37 2.355 -7.914 -5.329 1.00 1.15 C ATOM 629 CZ PHE A 37 1.575 -9.044 -5.460 1.00 0.35 C ATOM 0 H PHE A 37 0.605 -3.598 -5.192 1.00 0.09 H new ATOM 0 HA PHE A 37 -1.110 -4.076 -7.510 1.00 0.10 H new ATOM 0 HB2 PHE A 37 0.045 -5.725 -8.482 1.00 0.12 H new ATOM 0 HB3 PHE A 37 1.435 -4.913 -7.789 1.00 0.12 H new ATOM 0 HD1 PHE A 37 -0.762 -7.841 -7.557 1.00 1.12 H new ATOM 0 HD2 PHE A 37 2.630 -5.875 -5.892 1.00 1.10 H new ATOM 0 HE1 PHE A 37 -0.159 -9.898 -6.365 1.00 1.12 H new ATOM 0 HE2 PHE A 37 3.234 -7.935 -4.701 1.00 1.15 H new ATOM 0 HZ PHE A 37 1.842 -9.950 -4.936 1.00 0.35 H new ATOM 639 N VAL A 38 -2.540 -5.313 -5.953 1.00 0.09 N ATOM 640 CA VAL A 38 -3.423 -5.981 -5.007 1.00 0.09 C ATOM 641 C VAL A 38 -3.357 -7.492 -5.182 1.00 0.11 C ATOM 642 O VAL A 38 -3.355 -8.006 -6.304 1.00 0.17 O ATOM 643 CB VAL A 38 -4.883 -5.480 -5.132 1.00 0.11 C ATOM 644 CG1 VAL A 38 -5.267 -5.296 -6.593 1.00 0.16 C ATOM 645 CG2 VAL A 38 -5.864 -6.430 -4.442 1.00 0.11 C ATOM 0 H VAL A 38 -3.005 -4.941 -6.781 1.00 0.09 H new ATOM 0 HA VAL A 38 -3.075 -5.732 -4.004 1.00 0.09 H new ATOM 0 HB VAL A 38 -4.941 -4.514 -4.630 1.00 0.11 H new ATOM 0 HG11 VAL A 38 -6.296 -4.944 -6.657 1.00 0.16 H new ATOM 0 HG12 VAL A 38 -4.604 -4.564 -7.054 1.00 0.16 H new ATOM 0 HG13 VAL A 38 -5.176 -6.248 -7.116 1.00 0.16 H new ATOM 0 HG21 VAL A 38 -6.879 -6.047 -4.550 1.00 0.11 H new ATOM 0 HG22 VAL A 38 -5.798 -7.417 -4.900 1.00 0.11 H new ATOM 0 HG23 VAL A 38 -5.615 -6.504 -3.383 1.00 0.11 H new ATOM 655 N ASP A 39 -3.308 -8.176 -4.051 1.00 0.09 N ATOM 656 CA ASP A 39 -3.060 -9.611 -4.005 1.00 0.12 C ATOM 657 C ASP A 39 -4.350 -10.414 -4.107 1.00 0.16 C ATOM 658 O ASP A 39 -4.587 -11.131 -5.078 1.00 0.18 O ATOM 659 CB ASP A 39 -2.359 -9.965 -2.689 1.00 0.19 C ATOM 660 CG ASP A 39 -1.829 -11.389 -2.632 1.00 0.23 C ATOM 661 OD1 ASP A 39 -2.633 -12.341 -2.692 1.00 1.04 O ATOM 662 OD2 ASP A 39 -0.597 -11.562 -2.496 1.00 1.11 O ATOM 0 H ASP A 39 -3.440 -7.751 -3.133 1.00 0.09 H new ATOM 0 HA ASP A 39 -2.431 -9.865 -4.858 1.00 0.12 H new ATOM 0 HB2 ASP A 39 -1.531 -9.274 -2.534 1.00 0.19 H new ATOM 0 HB3 ASP A 39 -3.058 -9.815 -1.866 1.00 0.19 H new ATOM 667 N ARG A 40 -5.184 -10.258 -3.094 1.00 0.32 N ATOM 668 CA ARG A 40 -6.309 -11.152 -2.860 1.00 0.43 C ATOM 669 C ARG A 40 -7.630 -10.484 -3.217 1.00 0.43 C ATOM 670 O ARG A 40 -8.132 -10.635 -4.329 1.00 0.49 O ATOM 671 CB ARG A 40 -6.302 -11.570 -1.387 1.00 0.53 C ATOM 672 CG ARG A 40 -5.222 -10.857 -0.597 1.00 0.53 C ATOM 673 CD ARG A 40 -4.200 -11.825 -0.032 1.00 0.72 C ATOM 674 NE ARG A 40 -4.524 -12.220 1.331 1.00 1.09 N ATOM 675 CZ ARG A 40 -4.526 -13.474 1.768 1.00 1.66 C ATOM 676 NH1 ARG A 40 -4.350 -14.484 0.916 1.00 2.22 N ATOM 677 NH2 ARG A 40 -4.733 -13.713 3.055 1.00 2.29 N ATOM 0 H ARG A 40 -5.102 -9.507 -2.408 1.00 0.32 H new ATOM 0 HA ARG A 40 -6.207 -12.030 -3.498 1.00 0.43 H new ATOM 0 HB2 ARG A 40 -7.275 -11.356 -0.945 1.00 0.53 H new ATOM 0 HB3 ARG A 40 -6.150 -12.647 -1.317 1.00 0.53 H new ATOM 0 HG2 ARG A 40 -4.720 -10.134 -1.240 1.00 0.53 H new ATOM 0 HG3 ARG A 40 -5.679 -10.296 0.218 1.00 0.53 H new ATOM 0 HD2 ARG A 40 -4.150 -12.711 -0.665 1.00 0.72 H new ATOM 0 HD3 ARG A 40 -3.213 -11.363 -0.052 1.00 0.72 H new ATOM 0 HE ARG A 40 -4.766 -11.484 1.995 1.00 1.09 H new ATOM 0 HH11 ARG A 40 -4.213 -14.296 -0.077 1.00 2.22 H new ATOM 0 HH12 ARG A 40 -4.352 -15.445 1.257 1.00 2.22 H new ATOM 0 HH21 ARG A 40 -4.889 -12.938 3.699 1.00 2.29 H new ATOM 0 HH22 ARG A 40 -4.737 -14.672 3.401 1.00 2.29 H new ATOM 691 N ASP A 41 -8.172 -9.724 -2.277 1.00 0.47 N ATOM 692 CA ASP A 41 -9.460 -9.073 -2.474 1.00 0.52 C ATOM 693 C ASP A 41 -9.295 -7.566 -2.577 1.00 0.43 C ATOM 694 O ASP A 41 -9.417 -6.989 -3.654 1.00 0.50 O ATOM 695 CB ASP A 41 -10.411 -9.419 -1.323 1.00 0.57 C ATOM 696 CG ASP A 41 -11.787 -8.802 -1.491 1.00 0.96 C ATOM 697 OD1 ASP A 41 -12.002 -7.670 -1.013 1.00 1.34 O ATOM 698 OD2 ASP A 41 -12.664 -9.450 -2.096 1.00 1.53 O ATOM 0 H ASP A 41 -7.741 -9.543 -1.371 1.00 0.47 H new ATOM 0 HA ASP A 41 -9.885 -9.438 -3.409 1.00 0.52 H new ATOM 0 HB2 ASP A 41 -10.510 -10.502 -1.253 1.00 0.57 H new ATOM 0 HB3 ASP A 41 -9.977 -9.077 -0.384 1.00 0.57 H new ATOM 703 N GLY A 42 -9.007 -6.942 -1.449 1.00 0.32 N ATOM 704 CA GLY A 42 -8.811 -5.508 -1.425 1.00 0.26 C ATOM 705 C GLY A 42 -7.537 -5.133 -0.712 1.00 0.18 C ATOM 706 O GLY A 42 -7.415 -4.037 -0.177 1.00 0.18 O ATOM 0 H GLY A 42 -8.905 -7.403 -0.545 1.00 0.32 H new ATOM 0 HA2 GLY A 42 -8.783 -5.127 -2.446 1.00 0.26 H new ATOM 0 HA3 GLY A 42 -9.658 -5.033 -0.931 1.00 0.26 H new ATOM 710 N GLU A 43 -6.595 -6.064 -0.685 1.00 0.15 N ATOM 711 CA GLU A 43 -5.305 -5.825 -0.060 1.00 0.12 C ATOM 712 C GLU A 43 -4.299 -5.448 -1.127 1.00 0.08 C ATOM 713 O GLU A 43 -3.977 -6.263 -1.991 1.00 0.09 O ATOM 714 CB GLU A 43 -4.826 -7.072 0.698 1.00 0.14 C ATOM 715 CG GLU A 43 -5.967 -7.897 1.277 1.00 0.53 C ATOM 716 CD GLU A 43 -5.579 -8.722 2.490 1.00 1.00 C ATOM 717 OE1 GLU A 43 -5.494 -8.162 3.599 1.00 1.97 O ATOM 718 OE2 GLU A 43 -5.394 -9.944 2.347 1.00 1.30 O ATOM 0 H GLU A 43 -6.701 -6.994 -1.090 1.00 0.15 H new ATOM 0 HA GLU A 43 -5.404 -5.011 0.658 1.00 0.12 H new ATOM 0 HB2 GLU A 43 -4.240 -7.697 0.023 1.00 0.14 H new ATOM 0 HB3 GLU A 43 -4.162 -6.765 1.506 1.00 0.14 H new ATOM 0 HG2 GLU A 43 -6.783 -7.228 1.551 1.00 0.53 H new ATOM 0 HG3 GLU A 43 -6.348 -8.564 0.504 1.00 0.53 H new ATOM 725 N VAL A 44 -3.837 -4.211 -1.090 1.00 0.07 N ATOM 726 CA VAL A 44 -2.853 -3.734 -2.042 1.00 0.07 C ATOM 727 C VAL A 44 -1.464 -3.975 -1.498 1.00 0.07 C ATOM 728 O VAL A 44 -1.175 -3.662 -0.354 1.00 0.08 O ATOM 729 CB VAL A 44 -2.990 -2.234 -2.341 1.00 0.09 C ATOM 730 CG1 VAL A 44 -2.431 -1.924 -3.719 1.00 0.14 C ATOM 731 CG2 VAL A 44 -4.437 -1.777 -2.221 1.00 0.12 C ATOM 0 H VAL A 44 -4.131 -3.515 -0.405 1.00 0.07 H new ATOM 0 HA VAL A 44 -3.023 -4.284 -2.968 1.00 0.07 H new ATOM 0 HB VAL A 44 -2.413 -1.681 -1.600 1.00 0.09 H new ATOM 0 HG11 VAL A 44 -2.533 -0.858 -3.922 1.00 0.14 H new ATOM 0 HG12 VAL A 44 -1.377 -2.201 -3.755 1.00 0.14 H new ATOM 0 HG13 VAL A 44 -2.981 -2.490 -4.471 1.00 0.14 H new ATOM 0 HG21 VAL A 44 -4.501 -0.711 -2.438 1.00 0.12 H new ATOM 0 HG22 VAL A 44 -5.053 -2.330 -2.930 1.00 0.12 H new ATOM 0 HG23 VAL A 44 -4.794 -1.963 -1.208 1.00 0.12 H new ATOM 741 N ILE A 45 -0.612 -4.514 -2.325 1.00 0.08 N ATOM 742 CA ILE A 45 0.721 -4.892 -1.918 1.00 0.08 C ATOM 743 C ILE A 45 1.714 -3.976 -2.606 1.00 0.11 C ATOM 744 O ILE A 45 1.763 -3.933 -3.830 1.00 0.14 O ATOM 745 CB ILE A 45 1.023 -6.357 -2.296 1.00 0.09 C ATOM 746 CG1 ILE A 45 0.250 -7.339 -1.397 1.00 0.09 C ATOM 747 CG2 ILE A 45 2.517 -6.635 -2.215 1.00 0.11 C ATOM 748 CD1 ILE A 45 -1.248 -7.210 -1.438 1.00 0.08 C ATOM 0 H ILE A 45 -0.819 -4.706 -3.305 1.00 0.08 H new ATOM 0 HA ILE A 45 0.801 -4.800 -0.835 1.00 0.08 H new ATOM 0 HB ILE A 45 0.692 -6.507 -3.324 1.00 0.09 H new ATOM 0 HG12 ILE A 45 0.518 -8.356 -1.684 1.00 0.09 H new ATOM 0 HG13 ILE A 45 0.581 -7.201 -0.368 1.00 0.09 H new ATOM 0 HG21 ILE A 45 2.709 -7.673 -2.485 1.00 0.11 H new ATOM 0 HG22 ILE A 45 3.047 -5.977 -2.903 1.00 0.11 H new ATOM 0 HG23 ILE A 45 2.866 -6.454 -1.198 1.00 0.11 H new ATOM 0 HD11 ILE A 45 -1.695 -7.946 -0.770 1.00 0.08 H new ATOM 0 HD12 ILE A 45 -1.536 -6.208 -1.118 1.00 0.08 H new ATOM 0 HD13 ILE A 45 -1.600 -7.382 -2.455 1.00 0.08 H new ATOM 760 N LEU A 46 2.451 -3.217 -1.817 1.00 0.11 N ATOM 761 CA LEU A 46 3.454 -2.286 -2.331 1.00 0.13 C ATOM 762 C LEU A 46 4.850 -2.789 -1.990 1.00 0.11 C ATOM 763 O LEU A 46 5.189 -2.880 -0.821 1.00 0.17 O ATOM 764 CB LEU A 46 3.254 -0.919 -1.671 1.00 0.20 C ATOM 765 CG LEU A 46 1.837 -0.665 -1.177 1.00 0.14 C ATOM 766 CD1 LEU A 46 1.826 0.484 -0.186 1.00 0.19 C ATOM 767 CD2 LEU A 46 0.906 -0.372 -2.339 1.00 0.23 C ATOM 0 H LEU A 46 2.376 -3.224 -0.800 1.00 0.11 H new ATOM 0 HA LEU A 46 3.346 -2.206 -3.413 1.00 0.13 H new ATOM 0 HB2 LEU A 46 3.941 -0.830 -0.830 1.00 0.20 H new ATOM 0 HB3 LEU A 46 3.523 -0.141 -2.385 1.00 0.20 H new ATOM 0 HG LEU A 46 1.481 -1.565 -0.675 1.00 0.14 H new ATOM 0 HD11 LEU A 46 0.807 0.656 0.160 1.00 0.19 H new ATOM 0 HD12 LEU A 46 2.461 0.237 0.665 1.00 0.19 H new ATOM 0 HD13 LEU A 46 2.202 1.385 -0.670 1.00 0.19 H new ATOM 0 HD21 LEU A 46 -0.101 -0.194 -1.962 1.00 0.23 H new ATOM 0 HD22 LEU A 46 1.256 0.512 -2.872 1.00 0.23 H new ATOM 0 HD23 LEU A 46 0.893 -1.224 -3.019 1.00 0.23 H new ATOM 779 N LYS A 47 5.675 -3.102 -2.982 1.00 0.15 N ATOM 780 CA LYS A 47 7.031 -3.570 -2.661 1.00 0.27 C ATOM 781 C LYS A 47 8.116 -2.769 -3.372 1.00 0.16 C ATOM 782 O LYS A 47 7.914 -2.274 -4.467 1.00 0.15 O ATOM 783 CB LYS A 47 7.182 -5.078 -2.911 1.00 0.63 C ATOM 784 CG LYS A 47 7.809 -5.482 -4.240 1.00 0.29 C ATOM 785 CD LYS A 47 6.896 -5.251 -5.433 1.00 0.55 C ATOM 786 CE LYS A 47 5.538 -5.929 -5.271 1.00 0.69 C ATOM 787 NZ LYS A 47 5.308 -6.966 -6.311 1.00 0.76 N ATOM 0 H LYS A 47 5.450 -3.047 -3.975 1.00 0.15 H new ATOM 0 HA LYS A 47 7.173 -3.396 -1.594 1.00 0.27 H new ATOM 0 HB2 LYS A 47 7.784 -5.500 -2.106 1.00 0.63 H new ATOM 0 HB3 LYS A 47 6.195 -5.536 -2.845 1.00 0.63 H new ATOM 0 HG2 LYS A 47 8.732 -4.920 -4.384 1.00 0.29 H new ATOM 0 HG3 LYS A 47 8.081 -6.537 -4.199 1.00 0.29 H new ATOM 0 HD2 LYS A 47 6.749 -4.180 -5.572 1.00 0.55 H new ATOM 0 HD3 LYS A 47 7.380 -5.626 -6.335 1.00 0.55 H new ATOM 0 HE2 LYS A 47 5.476 -6.386 -4.283 1.00 0.69 H new ATOM 0 HE3 LYS A 47 4.749 -5.179 -5.326 1.00 0.69 H new ATOM 0 HZ1 LYS A 47 4.338 -7.331 -6.229 1.00 0.76 H new ATOM 0 HZ2 LYS A 47 5.442 -6.548 -7.254 1.00 0.76 H new ATOM 0 HZ3 LYS A 47 5.983 -7.746 -6.179 1.00 0.76 H new ATOM 801 N LYS A 48 9.275 -2.723 -2.727 1.00 0.19 N ATOM 802 CA LYS A 48 10.413 -1.833 -3.052 1.00 0.15 C ATOM 803 C LYS A 48 10.786 -1.679 -4.538 1.00 0.14 C ATOM 804 O LYS A 48 11.551 -0.779 -4.873 1.00 0.17 O ATOM 805 CB LYS A 48 11.623 -2.335 -2.298 1.00 0.17 C ATOM 806 CG LYS A 48 11.650 -3.850 -2.233 1.00 0.19 C ATOM 807 CD LYS A 48 12.055 -4.354 -0.863 1.00 0.20 C ATOM 808 CE LYS A 48 13.493 -3.988 -0.534 1.00 0.21 C ATOM 809 NZ LYS A 48 14.029 -4.801 0.593 1.00 0.32 N ATOM 0 H LYS A 48 9.469 -3.325 -1.927 1.00 0.19 H new ATOM 0 HA LYS A 48 10.085 -0.836 -2.757 1.00 0.15 H new ATOM 0 HB2 LYS A 48 12.530 -1.975 -2.783 1.00 0.17 H new ATOM 0 HB3 LYS A 48 11.618 -1.927 -1.287 1.00 0.17 H new ATOM 0 HG2 LYS A 48 10.664 -4.241 -2.486 1.00 0.19 H new ATOM 0 HG3 LYS A 48 12.346 -4.232 -2.980 1.00 0.19 H new ATOM 0 HD2 LYS A 48 11.390 -3.933 -0.109 1.00 0.20 H new ATOM 0 HD3 LYS A 48 11.937 -5.437 -0.824 1.00 0.20 H new ATOM 0 HE2 LYS A 48 14.116 -4.135 -1.416 1.00 0.21 H new ATOM 0 HE3 LYS A 48 13.549 -2.930 -0.277 1.00 0.21 H new ATOM 0 HZ1 LYS A 48 15.015 -5.064 0.393 1.00 0.32 H new ATOM 0 HZ2 LYS A 48 13.990 -4.245 1.471 1.00 0.32 H new ATOM 0 HZ3 LYS A 48 13.456 -5.662 0.703 1.00 0.32 H new ATOM 823 N TYR A 49 10.315 -2.570 -5.401 1.00 0.14 N ATOM 824 CA TYR A 49 10.511 -2.446 -6.852 1.00 0.16 C ATOM 825 C TYR A 49 11.947 -2.751 -7.278 1.00 0.17 C ATOM 826 O TYR A 49 12.167 -3.574 -8.162 1.00 0.24 O ATOM 827 CB TYR A 49 10.157 -1.045 -7.345 1.00 0.19 C ATOM 828 CG TYR A 49 10.526 -0.820 -8.801 1.00 0.24 C ATOM 829 CD1 TYR A 49 10.157 -1.735 -9.785 1.00 1.03 C ATOM 830 CD2 TYR A 49 11.263 0.294 -9.185 1.00 1.22 C ATOM 831 CE1 TYR A 49 10.509 -1.540 -11.104 1.00 1.01 C ATOM 832 CE2 TYR A 49 11.619 0.491 -10.503 1.00 1.28 C ATOM 833 CZ TYR A 49 11.239 -0.427 -11.458 1.00 0.40 C ATOM 834 OH TYR A 49 11.597 -0.235 -12.772 1.00 0.49 O ATOM 0 H TYR A 49 9.788 -3.398 -5.123 1.00 0.14 H new ATOM 0 HA TYR A 49 9.844 -3.182 -7.300 1.00 0.16 H new ATOM 0 HB2 TYR A 49 9.087 -0.880 -7.217 1.00 0.19 H new ATOM 0 HB3 TYR A 49 10.670 -0.308 -6.727 1.00 0.19 H new ATOM 0 HD1 TYR A 49 9.587 -2.610 -9.511 1.00 1.03 H new ATOM 0 HD2 TYR A 49 11.562 1.017 -8.440 1.00 1.22 H new ATOM 0 HE1 TYR A 49 10.214 -2.257 -11.856 1.00 1.01 H new ATOM 0 HE2 TYR A 49 12.193 1.361 -10.785 1.00 1.28 H new ATOM 0 HH TYR A 49 12.108 0.597 -12.854 1.00 0.49 H new ATOM 844 N SER A 50 12.906 -2.053 -6.673 1.00 0.19 N ATOM 845 CA SER A 50 14.311 -2.164 -7.053 1.00 0.25 C ATOM 846 C SER A 50 14.765 -3.632 -7.099 1.00 0.28 C ATOM 847 O SER A 50 15.364 -4.060 -8.084 1.00 0.34 O ATOM 848 CB SER A 50 15.197 -1.341 -6.104 1.00 0.37 C ATOM 849 OG SER A 50 16.537 -1.274 -6.574 1.00 1.36 O ATOM 0 H SER A 50 12.732 -1.399 -5.910 1.00 0.19 H new ATOM 0 HA SER A 50 14.419 -1.757 -8.058 1.00 0.25 H new ATOM 0 HB2 SER A 50 14.792 -0.333 -6.008 1.00 0.37 H new ATOM 0 HB3 SER A 50 15.180 -1.787 -5.110 1.00 0.37 H new ATOM 0 HG SER A 50 17.076 -0.743 -5.951 1.00 1.36 H new ATOM 855 N PRO A 51 14.495 -4.427 -6.044 1.00 0.32 N ATOM 856 CA PRO A 51 14.717 -5.863 -6.074 1.00 0.42 C ATOM 857 C PRO A 51 13.444 -6.621 -6.422 1.00 0.45 C ATOM 858 O PRO A 51 13.376 -7.844 -6.280 1.00 0.58 O ATOM 859 CB PRO A 51 15.099 -6.165 -4.641 1.00 0.52 C ATOM 860 CG PRO A 51 14.379 -5.147 -3.814 1.00 0.46 C ATOM 861 CD PRO A 51 13.989 -4.013 -4.725 1.00 0.36 C ATOM 0 HA PRO A 51 15.459 -6.155 -6.818 1.00 0.42 H new ATOM 0 HB2 PRO A 51 14.806 -7.177 -4.361 1.00 0.52 H new ATOM 0 HB3 PRO A 51 16.177 -6.095 -4.499 1.00 0.52 H new ATOM 0 HG2 PRO A 51 13.496 -5.586 -3.350 1.00 0.46 H new ATOM 0 HG3 PRO A 51 15.018 -4.788 -3.007 1.00 0.46 H new ATOM 0 HD2 PRO A 51 12.909 -3.866 -4.740 1.00 0.36 H new ATOM 0 HD3 PRO A 51 14.435 -3.071 -4.404 1.00 0.36 H new ATOM 869 N ILE A 52 12.443 -5.875 -6.885 1.00 0.37 N ATOM 870 CA ILE A 52 11.116 -6.413 -7.145 1.00 0.46 C ATOM 871 C ILE A 52 10.618 -7.134 -5.899 1.00 0.61 C ATOM 872 O ILE A 52 10.832 -6.659 -4.780 1.00 0.61 O ATOM 873 CB ILE A 52 11.134 -7.361 -8.366 1.00 0.62 C ATOM 874 CG1 ILE A 52 12.248 -6.948 -9.330 1.00 0.51 C ATOM 875 CG2 ILE A 52 9.787 -7.326 -9.087 1.00 0.78 C ATOM 876 CD1 ILE A 52 12.310 -7.783 -10.590 1.00 0.69 C ATOM 0 H ILE A 52 12.533 -4.880 -7.090 1.00 0.37 H new ATOM 0 HA ILE A 52 10.435 -5.595 -7.381 1.00 0.46 H new ATOM 0 HB ILE A 52 11.319 -8.377 -8.016 1.00 0.62 H new ATOM 0 HG12 ILE A 52 12.108 -5.903 -9.605 1.00 0.51 H new ATOM 0 HG13 ILE A 52 13.205 -7.016 -8.814 1.00 0.51 H new ATOM 0 HG21 ILE A 52 9.816 -7.999 -9.944 1.00 0.78 H new ATOM 0 HG22 ILE A 52 9.000 -7.643 -8.403 1.00 0.78 H new ATOM 0 HG23 ILE A 52 9.583 -6.311 -9.429 1.00 0.78 H new ATOM 0 HD11 ILE A 52 13.125 -7.429 -11.222 1.00 0.69 H new ATOM 0 HD12 ILE A 52 12.482 -8.827 -10.327 1.00 0.69 H new ATOM 0 HD13 ILE A 52 11.368 -7.696 -11.131 1.00 0.69 H new ATOM 888 N SER A 53 9.958 -8.257 -6.075 1.00 0.85 N ATOM 889 CA SER A 53 9.520 -9.043 -4.946 1.00 1.06 C ATOM 890 C SER A 53 10.438 -10.232 -4.750 1.00 1.29 C ATOM 891 O SER A 53 10.209 -11.088 -3.893 1.00 1.96 O ATOM 892 CB SER A 53 8.092 -9.514 -5.162 1.00 1.21 C ATOM 893 OG SER A 53 7.213 -8.421 -5.243 1.00 1.67 O ATOM 0 H SER A 53 9.714 -8.645 -6.986 1.00 0.85 H new ATOM 0 HA SER A 53 9.555 -8.423 -4.050 1.00 1.06 H new ATOM 0 HB2 SER A 53 8.033 -10.103 -6.078 1.00 1.21 H new ATOM 0 HB3 SER A 53 7.792 -10.168 -4.343 1.00 1.21 H new ATOM 0 HG SER A 53 6.518 -8.509 -4.557 1.00 1.67 H new ATOM 899 N GLU A 54 11.488 -10.238 -5.546 1.00 1.17 N ATOM 900 CA GLU A 54 12.431 -11.344 -5.618 1.00 1.35 C ATOM 901 C GLU A 54 13.430 -11.086 -6.738 1.00 1.52 C ATOM 902 O GLU A 54 13.064 -11.079 -7.914 1.00 2.38 O ATOM 903 CB GLU A 54 11.707 -12.668 -5.887 1.00 1.52 C ATOM 904 CG GLU A 54 12.645 -13.856 -5.999 1.00 1.95 C ATOM 905 CD GLU A 54 11.934 -15.118 -6.427 1.00 2.29 C ATOM 906 OE1 GLU A 54 11.525 -15.203 -7.602 1.00 2.89 O ATOM 907 OE2 GLU A 54 11.799 -16.040 -5.597 1.00 2.47 O ATOM 0 H GLU A 54 11.717 -9.465 -6.171 1.00 1.17 H new ATOM 0 HA GLU A 54 12.947 -11.417 -4.661 1.00 1.35 H new ATOM 0 HB2 GLU A 54 10.993 -12.853 -5.084 1.00 1.52 H new ATOM 0 HB3 GLU A 54 11.134 -12.579 -6.810 1.00 1.52 H new ATOM 0 HG2 GLU A 54 13.433 -13.626 -6.716 1.00 1.95 H new ATOM 0 HG3 GLU A 54 13.129 -14.024 -5.037 1.00 1.95 H new ATOM 914 N LEU A 55 14.676 -10.850 -6.377 1.00 1.27 N ATOM 915 CA LEU A 55 15.709 -10.599 -7.363 1.00 1.43 C ATOM 916 C LEU A 55 16.712 -11.749 -7.369 1.00 2.04 C ATOM 917 O LEU A 55 17.722 -11.674 -6.637 1.00 2.28 O ATOM 918 CB LEU A 55 16.405 -9.267 -7.068 1.00 1.60 C ATOM 919 CG LEU A 55 16.742 -8.416 -8.295 1.00 1.53 C ATOM 920 CD1 LEU A 55 17.811 -9.082 -9.146 1.00 2.27 C ATOM 921 CD2 LEU A 55 15.489 -8.167 -9.122 1.00 1.11 C ATOM 922 OXT LEU A 55 16.482 -12.732 -8.099 1.00 2.65 O ATOM 0 H LEU A 55 14.998 -10.827 -5.409 1.00 1.27 H new ATOM 0 HA LEU A 55 15.255 -10.534 -8.352 1.00 1.43 H new ATOM 0 HB2 LEU A 55 15.767 -8.682 -6.405 1.00 1.60 H new ATOM 0 HB3 LEU A 55 17.327 -9.471 -6.524 1.00 1.60 H new ATOM 0 HG LEU A 55 17.134 -7.460 -7.948 1.00 1.53 H new ATOM 0 HD11 LEU A 55 18.030 -8.455 -10.011 1.00 2.27 H new ATOM 0 HD12 LEU A 55 18.717 -9.214 -8.554 1.00 2.27 H new ATOM 0 HD13 LEU A 55 17.453 -10.054 -9.484 1.00 2.27 H new ATOM 0 HD21 LEU A 55 15.742 -7.561 -9.992 1.00 1.11 H new ATOM 0 HD22 LEU A 55 15.075 -9.120 -9.452 1.00 1.11 H new ATOM 0 HD23 LEU A 55 14.751 -7.642 -8.516 1.00 1.11 H new TER 934 LEU A 55 ATOM 935 N MET B 1 -7.219 -13.069 -9.040 1.00 3.94 N ATOM 936 CA MET B 1 -5.966 -12.810 -9.790 1.00 3.42 C ATOM 937 C MET B 1 -5.418 -11.441 -9.422 1.00 2.74 C ATOM 938 O MET B 1 -4.446 -11.332 -8.673 1.00 3.34 O ATOM 939 CB MET B 1 -6.206 -12.872 -11.306 1.00 3.88 C ATOM 940 CG MET B 1 -6.694 -14.218 -11.813 1.00 4.32 C ATOM 941 SD MET B 1 -5.482 -15.532 -11.594 1.00 5.25 S ATOM 942 CE MET B 1 -6.401 -16.920 -12.247 1.00 6.17 C ATOM 0 H1 MET B 1 -7.498 -14.063 -9.163 1.00 3.94 H new ATOM 0 H2 MET B 1 -7.065 -12.875 -8.030 1.00 3.94 H new ATOM 0 H3 MET B 1 -7.974 -12.451 -9.401 1.00 3.94 H new ATOM 0 HA MET B 1 -5.245 -13.582 -9.521 1.00 3.42 H new ATOM 0 HB2 MET B 1 -6.937 -12.110 -11.577 1.00 3.88 H new ATOM 0 HB3 MET B 1 -5.278 -12.620 -11.818 1.00 3.88 H new ATOM 0 HG2 MET B 1 -7.612 -14.486 -11.290 1.00 4.32 H new ATOM 0 HG3 MET B 1 -6.943 -14.133 -12.871 1.00 4.32 H new ATOM 0 HE1 MET B 1 -5.791 -17.821 -12.186 1.00 6.17 H new ATOM 0 HE2 MET B 1 -7.313 -17.059 -11.666 1.00 6.17 H new ATOM 0 HE3 MET B 1 -6.660 -16.727 -13.288 1.00 6.17 H new ATOM 954 N LYS B 2 -6.072 -10.402 -9.939 1.00 1.78 N ATOM 955 CA LYS B 2 -5.671 -9.022 -9.704 1.00 1.13 C ATOM 956 C LYS B 2 -4.214 -8.783 -10.061 1.00 0.88 C ATOM 957 O LYS B 2 -3.767 -9.200 -11.128 1.00 1.16 O ATOM 958 CB LYS B 2 -5.979 -8.587 -8.270 1.00 0.55 C ATOM 959 CG LYS B 2 -7.463 -8.344 -8.030 1.00 1.01 C ATOM 960 CD LYS B 2 -8.071 -7.448 -9.108 1.00 1.83 C ATOM 961 CE LYS B 2 -7.436 -6.064 -9.130 1.00 2.68 C ATOM 962 NZ LYS B 2 -7.678 -5.356 -10.417 1.00 3.61 N ATOM 0 H LYS B 2 -6.896 -10.497 -10.533 1.00 1.78 H new ATOM 0 HA LYS B 2 -6.266 -8.398 -10.371 1.00 1.13 H new ATOM 0 HB2 LYS B 2 -5.625 -9.353 -7.580 1.00 0.55 H new ATOM 0 HB3 LYS B 2 -5.426 -7.675 -8.046 1.00 0.55 H new ATOM 0 HG2 LYS B 2 -7.989 -9.298 -8.011 1.00 1.01 H new ATOM 0 HG3 LYS B 2 -7.603 -7.883 -7.052 1.00 1.01 H new ATOM 0 HD2 LYS B 2 -7.946 -7.919 -10.083 1.00 1.83 H new ATOM 0 HD3 LYS B 2 -9.143 -7.352 -8.936 1.00 1.83 H new ATOM 0 HE2 LYS B 2 -7.836 -5.469 -8.309 1.00 2.68 H new ATOM 0 HE3 LYS B 2 -6.363 -6.156 -8.964 1.00 2.68 H new ATOM 0 HZ1 LYS B 2 -7.228 -4.419 -10.388 1.00 3.61 H new ATOM 0 HZ2 LYS B 2 -7.274 -5.910 -11.199 1.00 3.61 H new ATOM 0 HZ3 LYS B 2 -8.701 -5.244 -10.565 1.00 3.61 H new ATOM 976 N ALA B 3 -3.502 -8.104 -9.169 1.00 0.51 N ATOM 977 CA ALA B 3 -2.146 -7.624 -9.435 1.00 0.33 C ATOM 978 C ALA B 3 -2.171 -6.506 -10.475 1.00 0.42 C ATOM 979 O ALA B 3 -2.713 -6.658 -11.571 1.00 0.86 O ATOM 980 CB ALA B 3 -1.224 -8.758 -9.880 1.00 0.48 C ATOM 0 H ALA B 3 -3.847 -7.869 -8.238 1.00 0.51 H new ATOM 0 HA ALA B 3 -1.745 -7.225 -8.503 1.00 0.33 H new ATOM 0 HB1 ALA B 3 -0.226 -8.363 -10.068 1.00 0.48 H new ATOM 0 HB2 ALA B 3 -1.173 -9.514 -9.097 1.00 0.48 H new ATOM 0 HB3 ALA B 3 -1.614 -9.207 -10.793 1.00 0.48 H new ATOM 986 N THR B 4 -1.607 -5.369 -10.116 1.00 0.24 N ATOM 987 CA THR B 4 -1.590 -4.222 -11.004 1.00 0.26 C ATOM 988 C THR B 4 -0.164 -3.854 -11.405 1.00 0.30 C ATOM 989 O THR B 4 0.119 -3.621 -12.578 1.00 0.43 O ATOM 990 CB THR B 4 -2.304 -3.025 -10.357 1.00 0.26 C ATOM 991 OG1 THR B 4 -1.889 -2.890 -8.990 1.00 0.27 O ATOM 992 CG2 THR B 4 -3.816 -3.201 -10.402 1.00 0.26 C ATOM 0 H THR B 4 -1.154 -5.214 -9.215 1.00 0.24 H new ATOM 0 HA THR B 4 -2.129 -4.492 -11.912 1.00 0.26 H new ATOM 0 HB THR B 4 -2.037 -2.130 -10.918 1.00 0.26 H new ATOM 0 HG1 THR B 4 -1.008 -2.463 -8.956 1.00 0.27 H new ATOM 0 HG21 THR B 4 -4.297 -2.340 -9.938 1.00 0.26 H new ATOM 0 HG22 THR B 4 -4.142 -3.283 -11.439 1.00 0.26 H new ATOM 0 HG23 THR B 4 -4.093 -4.106 -9.862 1.00 0.26 H new ATOM 1000 N GLY B 5 0.721 -3.800 -10.424 1.00 0.23 N ATOM 1001 CA GLY B 5 2.130 -3.612 -10.702 1.00 0.25 C ATOM 1002 C GLY B 5 2.467 -2.202 -11.142 1.00 0.26 C ATOM 1003 O GLY B 5 3.137 -2.001 -12.155 1.00 0.33 O ATOM 0 H GLY B 5 0.488 -3.883 -9.434 1.00 0.23 H new ATOM 0 HA2 GLY B 5 2.706 -3.855 -9.809 1.00 0.25 H new ATOM 0 HA3 GLY B 5 2.437 -4.312 -11.479 1.00 0.25 H new ATOM 1007 N ILE B 6 1.997 -1.227 -10.384 1.00 0.21 N ATOM 1008 CA ILE B 6 2.339 0.163 -10.631 1.00 0.22 C ATOM 1009 C ILE B 6 3.313 0.633 -9.563 1.00 0.19 C ATOM 1010 O ILE B 6 2.962 0.737 -8.394 1.00 0.16 O ATOM 1011 CB ILE B 6 1.085 1.081 -10.676 1.00 0.23 C ATOM 1012 CG1 ILE B 6 1.460 2.559 -10.479 1.00 0.26 C ATOM 1013 CG2 ILE B 6 0.053 0.655 -9.642 1.00 0.21 C ATOM 1014 CD1 ILE B 6 2.379 3.117 -11.547 1.00 0.30 C ATOM 0 H ILE B 6 1.375 -1.373 -9.589 1.00 0.21 H new ATOM 0 HA ILE B 6 2.806 0.230 -11.614 1.00 0.22 H new ATOM 0 HB ILE B 6 0.644 0.973 -11.667 1.00 0.23 H new ATOM 0 HG12 ILE B 6 0.547 3.153 -10.455 1.00 0.26 H new ATOM 0 HG13 ILE B 6 1.940 2.673 -9.507 1.00 0.26 H new ATOM 0 HG21 ILE B 6 -0.812 1.316 -9.698 1.00 0.21 H new ATOM 0 HG22 ILE B 6 -0.260 -0.370 -9.841 1.00 0.21 H new ATOM 0 HG23 ILE B 6 0.491 0.714 -8.645 1.00 0.21 H new ATOM 0 HD11 ILE B 6 2.593 4.164 -11.332 1.00 0.30 H new ATOM 0 HD12 ILE B 6 3.310 2.551 -11.558 1.00 0.30 H new ATOM 0 HD13 ILE B 6 1.895 3.038 -12.521 1.00 0.30 H new ATOM 1026 N VAL B 7 4.549 0.868 -9.963 1.00 0.24 N ATOM 1027 CA VAL B 7 5.567 1.317 -9.036 1.00 0.22 C ATOM 1028 C VAL B 7 5.461 2.814 -8.777 1.00 0.24 C ATOM 1029 O VAL B 7 5.308 3.616 -9.703 1.00 0.27 O ATOM 1030 CB VAL B 7 6.986 0.947 -9.513 1.00 0.23 C ATOM 1031 CG1 VAL B 7 8.039 1.714 -8.719 1.00 0.24 C ATOM 1032 CG2 VAL B 7 7.198 -0.557 -9.378 1.00 0.23 C ATOM 0 H VAL B 7 4.871 0.755 -10.924 1.00 0.24 H new ATOM 0 HA VAL B 7 5.389 0.795 -8.096 1.00 0.22 H new ATOM 0 HB VAL B 7 7.090 1.225 -10.562 1.00 0.23 H new ATOM 0 HG11 VAL B 7 9.033 1.438 -9.071 1.00 0.24 H new ATOM 0 HG12 VAL B 7 7.890 2.785 -8.856 1.00 0.24 H new ATOM 0 HG13 VAL B 7 7.948 1.468 -7.661 1.00 0.24 H new ATOM 0 HG21 VAL B 7 8.202 -0.815 -9.716 1.00 0.23 H new ATOM 0 HG22 VAL B 7 7.080 -0.849 -8.334 1.00 0.23 H new ATOM 0 HG23 VAL B 7 6.464 -1.084 -9.987 1.00 0.23 H new ATOM 1042 N ARG B 8 5.553 3.172 -7.506 1.00 0.23 N ATOM 1043 CA ARG B 8 5.427 4.527 -7.035 1.00 0.25 C ATOM 1044 C ARG B 8 6.618 4.810 -6.125 1.00 0.23 C ATOM 1045 O ARG B 8 6.829 4.096 -5.150 1.00 0.26 O ATOM 1046 CB ARG B 8 4.100 4.652 -6.254 1.00 0.29 C ATOM 1047 CG ARG B 8 4.106 5.633 -5.076 1.00 0.27 C ATOM 1048 CD ARG B 8 4.562 7.024 -5.465 1.00 0.24 C ATOM 1049 NE ARG B 8 3.715 7.641 -6.481 1.00 0.99 N ATOM 1050 CZ ARG B 8 3.943 8.849 -6.988 1.00 0.92 C ATOM 1051 NH1 ARG B 8 4.943 9.589 -6.517 1.00 0.53 N ATOM 1052 NH2 ARG B 8 3.166 9.319 -7.954 1.00 1.69 N ATOM 0 H ARG B 8 5.723 2.501 -6.757 1.00 0.23 H new ATOM 0 HA ARG B 8 5.417 5.243 -7.857 1.00 0.25 H new ATOM 0 HB2 ARG B 8 3.318 4.955 -6.950 1.00 0.29 H new ATOM 0 HB3 ARG B 8 3.827 3.666 -5.879 1.00 0.29 H new ATOM 0 HG2 ARG B 8 3.103 5.691 -4.654 1.00 0.27 H new ATOM 0 HG3 ARG B 8 4.760 5.248 -4.293 1.00 0.27 H new ATOM 0 HD2 ARG B 8 4.575 7.657 -4.578 1.00 0.24 H new ATOM 0 HD3 ARG B 8 5.586 6.974 -5.836 1.00 0.24 H new ATOM 0 HE ARG B 8 2.907 7.119 -6.819 1.00 0.99 H new ATOM 0 HH11 ARG B 8 5.534 9.230 -5.768 1.00 0.53 H new ATOM 0 HH12 ARG B 8 5.119 10.516 -6.905 1.00 0.53 H new ATOM 0 HH21 ARG B 8 2.394 8.754 -8.308 1.00 1.69 H new ATOM 0 HH22 ARG B 8 3.340 10.246 -8.343 1.00 1.69 H new ATOM 1066 N ARG B 9 7.412 5.812 -6.453 1.00 0.20 N ATOM 1067 CA ARG B 9 8.486 6.230 -5.570 1.00 0.19 C ATOM 1068 C ARG B 9 7.910 7.180 -4.549 1.00 0.20 C ATOM 1069 O ARG B 9 7.662 8.340 -4.874 1.00 0.21 O ATOM 1070 CB ARG B 9 9.595 6.912 -6.360 1.00 0.18 C ATOM 1071 CG ARG B 9 10.880 7.129 -5.598 1.00 0.24 C ATOM 1072 CD ARG B 9 12.036 7.194 -6.583 1.00 0.62 C ATOM 1073 NE ARG B 9 13.282 7.679 -5.998 1.00 1.35 N ATOM 1074 CZ ARG B 9 14.486 7.209 -6.338 1.00 1.74 C ATOM 1075 NH1 ARG B 9 14.590 6.237 -7.242 1.00 1.51 N ATOM 1076 NH2 ARG B 9 15.582 7.725 -5.793 1.00 2.71 N ATOM 0 H ARG B 9 7.335 6.348 -7.317 1.00 0.20 H new ATOM 0 HA ARG B 9 8.919 5.361 -5.074 1.00 0.19 H new ATOM 0 HB2 ARG B 9 9.811 6.313 -7.245 1.00 0.18 H new ATOM 0 HB3 ARG B 9 9.230 7.878 -6.710 1.00 0.18 H new ATOM 0 HG2 ARG B 9 10.824 8.053 -5.022 1.00 0.24 H new ATOM 0 HG3 ARG B 9 11.037 6.318 -4.887 1.00 0.24 H new ATOM 0 HD2 ARG B 9 12.203 6.200 -6.999 1.00 0.62 H new ATOM 0 HD3 ARG B 9 11.758 7.844 -7.413 1.00 0.62 H new ATOM 0 HE ARG B 9 13.231 8.415 -5.293 1.00 1.35 H new ATOM 0 HH11 ARG B 9 13.751 5.851 -7.675 1.00 1.51 H new ATOM 0 HH12 ARG B 9 15.509 5.878 -7.502 1.00 1.51 H new ATOM 0 HH21 ARG B 9 15.506 8.482 -5.113 1.00 2.71 H new ATOM 0 HH22 ARG B 9 16.500 7.364 -6.054 1.00 2.71 H new ATOM 1090 N ILE B 10 7.716 6.651 -3.334 1.00 0.22 N ATOM 1091 CA ILE B 10 7.063 7.345 -2.203 1.00 0.25 C ATOM 1092 C ILE B 10 6.800 8.838 -2.442 1.00 0.30 C ATOM 1093 O ILE B 10 5.845 9.183 -3.149 1.00 0.34 O ATOM 1094 CB ILE B 10 7.864 7.142 -0.890 1.00 0.23 C ATOM 1095 CG1 ILE B 10 9.373 6.978 -1.166 1.00 0.22 C ATOM 1096 CG2 ILE B 10 7.318 5.928 -0.163 1.00 0.21 C ATOM 1097 CD1 ILE B 10 9.949 8.030 -2.081 1.00 0.23 C ATOM 0 H ILE B 10 8.014 5.704 -3.099 1.00 0.22 H new ATOM 0 HA ILE B 10 6.082 6.880 -2.110 1.00 0.25 H new ATOM 0 HB ILE B 10 7.748 8.028 -0.266 1.00 0.23 H new ATOM 0 HG12 ILE B 10 9.910 7.003 -0.218 1.00 0.22 H new ATOM 0 HG13 ILE B 10 9.547 5.995 -1.605 1.00 0.22 H new ATOM 0 HG21 ILE B 10 7.875 5.777 0.762 1.00 0.21 H new ATOM 0 HG22 ILE B 10 6.265 6.086 0.069 1.00 0.21 H new ATOM 0 HG23 ILE B 10 7.421 5.047 -0.797 1.00 0.21 H new ATOM 0 HD11 ILE B 10 11.013 7.844 -2.225 1.00 0.23 H new ATOM 0 HD12 ILE B 10 9.441 7.992 -3.045 1.00 0.23 H new ATOM 0 HD13 ILE B 10 9.810 9.015 -1.636 1.00 0.23 H new ATOM 1109 N ASP B 11 7.652 9.698 -1.866 1.00 0.32 N ATOM 1110 CA ASP B 11 7.615 11.140 -2.084 1.00 0.39 C ATOM 1111 C ASP B 11 8.435 11.817 -1.006 1.00 0.40 C ATOM 1112 O ASP B 11 9.341 11.205 -0.466 1.00 0.42 O ATOM 1113 CB ASP B 11 6.181 11.703 -2.108 1.00 0.43 C ATOM 1114 CG ASP B 11 5.501 11.772 -0.750 1.00 0.33 C ATOM 1115 OD1 ASP B 11 5.171 10.722 -0.174 1.00 1.18 O ATOM 1116 OD2 ASP B 11 5.276 12.897 -0.263 1.00 1.08 O ATOM 0 H ASP B 11 8.392 9.402 -1.230 1.00 0.32 H new ATOM 0 HA ASP B 11 8.038 11.345 -3.067 1.00 0.39 H new ATOM 0 HB2 ASP B 11 6.206 12.704 -2.538 1.00 0.43 H new ATOM 0 HB3 ASP B 11 5.575 11.087 -2.772 1.00 0.43 H new ATOM 1121 N ASP B 12 8.123 13.066 -0.699 1.00 0.44 N ATOM 1122 CA ASP B 12 8.868 13.815 0.306 1.00 0.47 C ATOM 1123 C ASP B 12 8.326 13.527 1.701 1.00 0.43 C ATOM 1124 O ASP B 12 8.910 13.933 2.705 1.00 0.63 O ATOM 1125 CB ASP B 12 8.810 15.315 0.012 1.00 0.58 C ATOM 1126 CG ASP B 12 9.677 15.707 -1.168 1.00 1.42 C ATOM 1127 OD1 ASP B 12 9.201 15.623 -2.321 1.00 2.39 O ATOM 1128 OD2 ASP B 12 10.843 16.099 -0.949 1.00 1.78 O ATOM 0 H ASP B 12 7.358 13.585 -1.131 1.00 0.44 H new ATOM 0 HA ASP B 12 9.909 13.495 0.267 1.00 0.47 H new ATOM 0 HB2 ASP B 12 7.778 15.604 -0.187 1.00 0.58 H new ATOM 0 HB3 ASP B 12 9.131 15.868 0.895 1.00 0.58 H new ATOM 1133 N LEU B 13 7.198 12.833 1.756 1.00 0.34 N ATOM 1134 CA LEU B 13 6.612 12.425 3.016 1.00 0.28 C ATOM 1135 C LEU B 13 6.749 10.912 3.189 1.00 0.23 C ATOM 1136 O LEU B 13 7.311 10.441 4.181 1.00 0.25 O ATOM 1137 CB LEU B 13 5.136 12.852 3.067 1.00 0.27 C ATOM 1138 CG LEU B 13 4.454 12.783 4.439 1.00 0.29 C ATOM 1139 CD1 LEU B 13 4.164 11.346 4.839 1.00 0.32 C ATOM 1140 CD2 LEU B 13 5.315 13.467 5.488 1.00 0.40 C ATOM 0 H LEU B 13 6.670 12.541 0.933 1.00 0.34 H new ATOM 0 HA LEU B 13 7.140 12.912 3.836 1.00 0.28 H new ATOM 0 HB2 LEU B 13 5.064 13.876 2.700 1.00 0.27 H new ATOM 0 HB3 LEU B 13 4.575 12.225 2.374 1.00 0.27 H new ATOM 0 HG LEU B 13 3.501 13.307 4.371 1.00 0.29 H new ATOM 0 HD11 LEU B 13 3.681 11.331 5.816 1.00 0.32 H new ATOM 0 HD12 LEU B 13 3.505 10.889 4.101 1.00 0.32 H new ATOM 0 HD13 LEU B 13 5.098 10.786 4.888 1.00 0.32 H new ATOM 0 HD21 LEU B 13 4.820 13.411 6.458 1.00 0.40 H new ATOM 0 HD22 LEU B 13 6.283 12.969 5.545 1.00 0.40 H new ATOM 0 HD23 LEU B 13 5.460 14.512 5.214 1.00 0.40 H new ATOM 1152 N GLY B 14 6.231 10.161 2.223 1.00 0.21 N ATOM 1153 CA GLY B 14 6.286 8.718 2.298 1.00 0.18 C ATOM 1154 C GLY B 14 4.957 8.065 1.977 1.00 0.17 C ATOM 1155 O GLY B 14 4.721 6.921 2.339 1.00 0.20 O ATOM 0 H GLY B 14 5.774 10.529 1.389 1.00 0.21 H new ATOM 0 HA2 GLY B 14 7.043 8.351 1.605 1.00 0.18 H new ATOM 0 HA3 GLY B 14 6.599 8.422 3.299 1.00 0.18 H new ATOM 1159 N ARG B 15 4.083 8.777 1.285 1.00 0.18 N ATOM 1160 CA ARG B 15 2.795 8.210 0.928 1.00 0.20 C ATOM 1161 C ARG B 15 2.945 7.276 -0.248 1.00 0.18 C ATOM 1162 O ARG B 15 3.850 7.419 -1.068 1.00 0.20 O ATOM 1163 CB ARG B 15 1.769 9.269 0.537 1.00 0.29 C ATOM 1164 CG ARG B 15 1.601 10.391 1.527 1.00 0.24 C ATOM 1165 CD ARG B 15 2.211 11.659 0.978 1.00 0.42 C ATOM 1166 NE ARG B 15 1.637 12.856 1.597 1.00 0.52 N ATOM 1167 CZ ARG B 15 2.144 14.083 1.483 1.00 0.51 C ATOM 1168 NH1 ARG B 15 3.278 14.291 0.824 1.00 0.87 N ATOM 1169 NH2 ARG B 15 1.519 15.106 2.049 1.00 0.90 N ATOM 0 H ARG B 15 4.238 9.733 0.964 1.00 0.18 H new ATOM 0 HA ARG B 15 2.442 7.686 1.816 1.00 0.20 H new ATOM 0 HB2 ARG B 15 2.057 9.694 -0.425 1.00 0.29 H new ATOM 0 HB3 ARG B 15 0.804 8.783 0.395 1.00 0.29 H new ATOM 0 HG2 ARG B 15 0.543 10.547 1.736 1.00 0.24 H new ATOM 0 HG3 ARG B 15 2.077 10.128 2.472 1.00 0.24 H new ATOM 0 HD2 ARG B 15 3.288 11.645 1.145 1.00 0.42 H new ATOM 0 HD3 ARG B 15 2.056 11.699 -0.100 1.00 0.42 H new ATOM 0 HE ARG B 15 0.790 12.742 2.154 1.00 0.52 H new ATOM 0 HH11 ARG B 15 3.771 13.507 0.398 1.00 0.87 H new ATOM 0 HH12 ARG B 15 3.656 15.235 0.744 1.00 0.87 H new ATOM 0 HH21 ARG B 15 0.655 14.952 2.568 1.00 0.90 H new ATOM 0 HH22 ARG B 15 1.902 16.047 1.965 1.00 0.90 H new ATOM 1183 N VAL B 16 2.042 6.334 -0.337 1.00 0.18 N ATOM 1184 CA VAL B 16 1.923 5.534 -1.522 1.00 0.19 C ATOM 1185 C VAL B 16 0.649 5.938 -2.214 1.00 0.17 C ATOM 1186 O VAL B 16 -0.437 5.506 -1.843 1.00 0.20 O ATOM 1187 CB VAL B 16 1.934 4.024 -1.225 1.00 0.27 C ATOM 1188 CG1 VAL B 16 1.724 3.230 -2.501 1.00 1.15 C ATOM 1189 CG2 VAL B 16 3.245 3.630 -0.564 1.00 1.27 C ATOM 0 H VAL B 16 1.377 6.104 0.402 1.00 0.18 H new ATOM 0 HA VAL B 16 2.788 5.711 -2.161 1.00 0.19 H new ATOM 0 HB VAL B 16 1.116 3.797 -0.541 1.00 0.27 H new ATOM 0 HG11 VAL B 16 1.735 2.164 -2.272 1.00 1.15 H new ATOM 0 HG12 VAL B 16 0.763 3.497 -2.942 1.00 1.15 H new ATOM 0 HG13 VAL B 16 2.523 3.458 -3.207 1.00 1.15 H new ATOM 0 HG21 VAL B 16 3.242 2.560 -0.358 1.00 1.27 H new ATOM 0 HG22 VAL B 16 4.074 3.869 -1.230 1.00 1.27 H new ATOM 0 HG23 VAL B 16 3.360 4.179 0.371 1.00 1.27 H new ATOM 1199 N VAL B 17 0.796 6.827 -3.174 1.00 0.18 N ATOM 1200 CA VAL B 17 -0.342 7.425 -3.831 1.00 0.19 C ATOM 1201 C VAL B 17 -1.123 6.361 -4.584 1.00 0.19 C ATOM 1202 O VAL B 17 -0.684 5.879 -5.627 1.00 0.22 O ATOM 1203 CB VAL B 17 0.087 8.550 -4.792 1.00 0.23 C ATOM 1204 CG1 VAL B 17 -1.131 9.214 -5.410 1.00 0.27 C ATOM 1205 CG2 VAL B 17 0.960 9.568 -4.065 1.00 0.25 C ATOM 0 H VAL B 17 1.700 7.152 -3.517 1.00 0.18 H new ATOM 0 HA VAL B 17 -0.979 7.868 -3.065 1.00 0.19 H new ATOM 0 HB VAL B 17 0.678 8.115 -5.598 1.00 0.23 H new ATOM 0 HG11 VAL B 17 -0.810 10.006 -6.086 1.00 0.27 H new ATOM 0 HG12 VAL B 17 -1.706 8.474 -5.966 1.00 0.27 H new ATOM 0 HG13 VAL B 17 -1.753 9.639 -4.622 1.00 0.27 H new ATOM 0 HG21 VAL B 17 1.254 10.356 -4.758 1.00 0.25 H new ATOM 0 HG22 VAL B 17 0.399 10.003 -3.238 1.00 0.25 H new ATOM 0 HG23 VAL B 17 1.851 9.073 -3.679 1.00 0.25 H new ATOM 1215 N ILE B 18 -2.259 5.980 -4.023 1.00 0.19 N ATOM 1216 CA ILE B 18 -3.083 4.938 -4.595 1.00 0.20 C ATOM 1217 C ILE B 18 -4.133 5.535 -5.524 1.00 0.18 C ATOM 1218 O ILE B 18 -5.029 6.261 -5.090 1.00 0.18 O ATOM 1219 CB ILE B 18 -3.763 4.088 -3.491 1.00 0.24 C ATOM 1220 CG1 ILE B 18 -2.720 3.244 -2.756 1.00 0.39 C ATOM 1221 CG2 ILE B 18 -4.863 3.209 -4.073 1.00 0.25 C ATOM 1222 CD1 ILE B 18 -1.980 2.268 -3.644 1.00 0.82 C ATOM 0 H ILE B 18 -2.631 6.384 -3.163 1.00 0.19 H new ATOM 0 HA ILE B 18 -2.434 4.282 -5.174 1.00 0.20 H new ATOM 0 HB ILE B 18 -4.228 4.765 -2.775 1.00 0.24 H new ATOM 0 HG12 ILE B 18 -1.997 3.909 -2.283 1.00 0.39 H new ATOM 0 HG13 ILE B 18 -3.213 2.690 -1.957 1.00 0.39 H new ATOM 0 HG21 ILE B 18 -5.322 2.624 -3.276 1.00 0.25 H new ATOM 0 HG22 ILE B 18 -5.619 3.837 -4.544 1.00 0.25 H new ATOM 0 HG23 ILE B 18 -4.436 2.536 -4.816 1.00 0.25 H new ATOM 0 HD11 ILE B 18 -1.259 1.708 -3.048 1.00 0.82 H new ATOM 0 HD12 ILE B 18 -2.691 1.577 -4.097 1.00 0.82 H new ATOM 0 HD13 ILE B 18 -1.456 2.815 -4.428 1.00 0.82 H new ATOM 1234 N PRO B 19 -3.993 5.285 -6.830 1.00 0.21 N ATOM 1235 CA PRO B 19 -4.995 5.657 -7.823 1.00 0.23 C ATOM 1236 C PRO B 19 -6.394 5.238 -7.421 1.00 0.21 C ATOM 1237 O PRO B 19 -6.608 4.164 -6.849 1.00 0.21 O ATOM 1238 CB PRO B 19 -4.546 4.880 -9.050 1.00 0.28 C ATOM 1239 CG PRO B 19 -3.072 4.855 -8.923 1.00 0.30 C ATOM 1240 CD PRO B 19 -2.819 4.648 -7.457 1.00 0.27 C ATOM 0 HA PRO B 19 -5.056 6.736 -7.967 1.00 0.23 H new ATOM 0 HB2 PRO B 19 -4.965 3.874 -9.063 1.00 0.28 H new ATOM 0 HB3 PRO B 19 -4.861 5.369 -9.972 1.00 0.28 H new ATOM 0 HG2 PRO B 19 -2.637 4.051 -9.517 1.00 0.30 H new ATOM 0 HG3 PRO B 19 -2.628 5.787 -9.274 1.00 0.30 H new ATOM 0 HD2 PRO B 19 -2.749 3.590 -7.204 1.00 0.27 H new ATOM 0 HD3 PRO B 19 -1.887 5.114 -7.138 1.00 0.27 H new ATOM 1248 N LYS B 20 -7.347 6.089 -7.736 1.00 0.23 N ATOM 1249 CA LYS B 20 -8.736 5.821 -7.439 1.00 0.23 C ATOM 1250 C LYS B 20 -9.212 4.545 -8.114 1.00 0.21 C ATOM 1251 O LYS B 20 -10.229 4.010 -7.732 1.00 0.22 O ATOM 1252 CB LYS B 20 -9.639 6.984 -7.855 1.00 0.28 C ATOM 1253 CG LYS B 20 -9.535 7.357 -9.329 1.00 0.39 C ATOM 1254 CD LYS B 20 -8.257 8.118 -9.641 1.00 0.53 C ATOM 1255 CE LYS B 20 -8.338 9.594 -9.260 1.00 0.90 C ATOM 1256 NZ LYS B 20 -8.446 9.811 -7.792 1.00 1.77 N ATOM 0 H LYS B 20 -7.181 6.981 -8.202 1.00 0.23 H new ATOM 0 HA LYS B 20 -8.804 5.697 -6.358 1.00 0.23 H new ATOM 0 HB2 LYS B 20 -10.673 6.725 -7.629 1.00 0.28 H new ATOM 0 HB3 LYS B 20 -9.390 7.857 -7.252 1.00 0.28 H new ATOM 0 HG2 LYS B 20 -9.573 6.451 -9.935 1.00 0.39 H new ATOM 0 HG3 LYS B 20 -10.395 7.965 -9.610 1.00 0.39 H new ATOM 0 HD2 LYS B 20 -7.425 7.656 -9.109 1.00 0.53 H new ATOM 0 HD3 LYS B 20 -8.041 8.034 -10.706 1.00 0.53 H new ATOM 0 HE2 LYS B 20 -7.453 10.109 -9.634 1.00 0.90 H new ATOM 0 HE3 LYS B 20 -9.200 10.044 -9.752 1.00 0.90 H new ATOM 0 HZ1 LYS B 20 -8.082 10.755 -7.553 1.00 1.77 H new ATOM 0 HZ2 LYS B 20 -9.443 9.741 -7.503 1.00 1.77 H new ATOM 0 HZ3 LYS B 20 -7.889 9.089 -7.292 1.00 1.77 H new ATOM 1270 N GLU B 21 -8.462 4.054 -9.100 1.00 0.21 N ATOM 1271 CA GLU B 21 -8.849 2.854 -9.840 1.00 0.20 C ATOM 1272 C GLU B 21 -8.848 1.606 -8.952 1.00 0.20 C ATOM 1273 O GLU B 21 -9.533 0.623 -9.249 1.00 0.20 O ATOM 1274 CB GLU B 21 -7.933 2.657 -11.047 1.00 0.23 C ATOM 1275 CG GLU B 21 -6.463 2.581 -10.695 1.00 0.47 C ATOM 1276 CD GLU B 21 -5.582 2.629 -11.922 1.00 1.08 C ATOM 1277 OE1 GLU B 21 -5.321 3.744 -12.421 1.00 1.92 O ATOM 1278 OE2 GLU B 21 -5.153 1.560 -12.399 1.00 1.53 O ATOM 0 H GLU B 21 -7.582 4.470 -9.405 1.00 0.21 H new ATOM 0 HA GLU B 21 -9.871 2.999 -10.190 1.00 0.20 H new ATOM 0 HB2 GLU B 21 -8.221 1.741 -11.564 1.00 0.23 H new ATOM 0 HB3 GLU B 21 -8.087 3.479 -11.746 1.00 0.23 H new ATOM 0 HG2 GLU B 21 -6.206 3.407 -10.032 1.00 0.47 H new ATOM 0 HG3 GLU B 21 -6.269 1.660 -10.146 1.00 0.47 H new ATOM 1285 N ILE B 22 -8.144 1.660 -7.828 1.00 0.22 N ATOM 1286 CA ILE B 22 -8.096 0.521 -6.933 1.00 0.25 C ATOM 1287 C ILE B 22 -9.277 0.609 -5.979 1.00 0.24 C ATOM 1288 O ILE B 22 -10.039 -0.340 -5.826 1.00 0.24 O ATOM 1289 CB ILE B 22 -6.769 0.446 -6.140 1.00 0.32 C ATOM 1290 CG1 ILE B 22 -5.591 0.286 -7.101 1.00 0.28 C ATOM 1291 CG2 ILE B 22 -6.797 -0.705 -5.145 1.00 0.44 C ATOM 1292 CD1 ILE B 22 -5.004 1.591 -7.586 1.00 0.25 C ATOM 0 H ILE B 22 -7.607 2.471 -7.521 1.00 0.22 H new ATOM 0 HA ILE B 22 -8.151 -0.389 -7.531 1.00 0.25 H new ATOM 0 HB ILE B 22 -6.649 1.375 -5.583 1.00 0.32 H new ATOM 0 HG12 ILE B 22 -4.809 -0.289 -6.606 1.00 0.28 H new ATOM 0 HG13 ILE B 22 -5.917 -0.295 -7.963 1.00 0.28 H new ATOM 0 HG21 ILE B 22 -5.854 -0.738 -4.600 1.00 0.44 H new ATOM 0 HG22 ILE B 22 -7.618 -0.559 -4.443 1.00 0.44 H new ATOM 0 HG23 ILE B 22 -6.940 -1.644 -5.679 1.00 0.44 H new ATOM 0 HD11 ILE B 22 -4.174 1.387 -8.263 1.00 0.25 H new ATOM 0 HD12 ILE B 22 -5.770 2.161 -8.112 1.00 0.25 H new ATOM 0 HD13 ILE B 22 -4.644 2.167 -6.734 1.00 0.25 H new ATOM 1304 N ARG B 23 -9.443 1.792 -5.385 1.00 0.24 N ATOM 1305 CA ARG B 23 -10.626 2.121 -4.588 1.00 0.23 C ATOM 1306 C ARG B 23 -11.875 1.900 -5.431 1.00 0.22 C ATOM 1307 O ARG B 23 -12.945 1.546 -4.934 1.00 0.23 O ATOM 1308 CB ARG B 23 -10.509 3.583 -4.106 1.00 0.26 C ATOM 1309 CG ARG B 23 -11.813 4.368 -4.031 1.00 0.50 C ATOM 1310 CD ARG B 23 -12.198 4.954 -5.382 1.00 0.35 C ATOM 1311 NE ARG B 23 -13.307 5.903 -5.289 1.00 0.85 N ATOM 1312 CZ ARG B 23 -13.159 7.227 -5.311 1.00 0.95 C ATOM 1313 NH1 ARG B 23 -11.953 7.758 -5.411 1.00 1.36 N ATOM 1314 NH2 ARG B 23 -14.218 8.025 -5.228 1.00 1.40 N ATOM 0 H ARG B 23 -8.761 2.549 -5.443 1.00 0.24 H new ATOM 0 HA ARG B 23 -10.697 1.477 -3.711 1.00 0.23 H new ATOM 0 HB2 ARG B 23 -10.051 3.583 -3.117 1.00 0.26 H new ATOM 0 HB3 ARG B 23 -9.828 4.111 -4.773 1.00 0.26 H new ATOM 0 HG2 ARG B 23 -12.611 3.715 -3.677 1.00 0.50 H new ATOM 0 HG3 ARG B 23 -11.712 5.172 -3.302 1.00 0.50 H new ATOM 0 HD2 ARG B 23 -11.333 5.454 -5.817 1.00 0.35 H new ATOM 0 HD3 ARG B 23 -12.473 4.145 -6.059 1.00 0.35 H new ATOM 0 HE ARG B 23 -14.252 5.528 -5.202 1.00 0.85 H new ATOM 0 HH11 ARG B 23 -11.133 7.154 -5.472 1.00 1.36 H new ATOM 0 HH12 ARG B 23 -11.842 8.772 -5.428 1.00 1.36 H new ATOM 0 HH21 ARG B 23 -15.153 7.625 -5.147 1.00 1.40 H new ATOM 0 HH22 ARG B 23 -14.096 9.038 -5.246 1.00 1.40 H new ATOM 1328 N ARG B 24 -11.705 2.139 -6.712 1.00 0.22 N ATOM 1329 CA ARG B 24 -12.726 1.921 -7.706 1.00 0.25 C ATOM 1330 C ARG B 24 -13.136 0.462 -7.760 1.00 0.26 C ATOM 1331 O ARG B 24 -14.321 0.150 -7.641 1.00 0.28 O ATOM 1332 CB ARG B 24 -12.197 2.367 -9.060 1.00 0.29 C ATOM 1333 CG ARG B 24 -13.087 2.028 -10.226 1.00 0.42 C ATOM 1334 CD ARG B 24 -12.449 2.494 -11.524 1.00 0.55 C ATOM 1335 NE ARG B 24 -13.393 2.488 -12.637 1.00 1.47 N ATOM 1336 CZ ARG B 24 -13.199 3.148 -13.778 1.00 2.06 C ATOM 1337 NH1 ARG B 24 -12.110 3.894 -13.943 1.00 1.83 N ATOM 1338 NH2 ARG B 24 -14.101 3.079 -14.748 1.00 3.19 N ATOM 0 H ARG B 24 -10.832 2.499 -7.098 1.00 0.22 H new ATOM 0 HA ARG B 24 -13.609 2.502 -7.440 1.00 0.25 H new ATOM 0 HB2 ARG B 24 -12.045 3.446 -9.038 1.00 0.29 H new ATOM 0 HB3 ARG B 24 -11.220 1.911 -9.221 1.00 0.29 H new ATOM 0 HG2 ARG B 24 -13.258 0.952 -10.262 1.00 0.42 H new ATOM 0 HG3 ARG B 24 -14.061 2.502 -10.100 1.00 0.42 H new ATOM 0 HD2 ARG B 24 -12.053 3.501 -11.391 1.00 0.55 H new ATOM 0 HD3 ARG B 24 -11.604 1.849 -11.763 1.00 0.55 H new ATOM 0 HE ARG B 24 -14.252 1.947 -12.535 1.00 1.47 H new ATOM 0 HH11 ARG B 24 -11.420 3.962 -13.195 1.00 1.83 H new ATOM 0 HH12 ARG B 24 -11.965 4.398 -14.818 1.00 1.83 H new ATOM 0 HH21 ARG B 24 -14.945 2.520 -14.621 1.00 3.19 H new ATOM 0 HH22 ARG B 24 -13.951 3.585 -15.621 1.00 3.19 H new ATOM 1352 N THR B 25 -12.174 -0.447 -7.929 1.00 0.26 N ATOM 1353 CA THR B 25 -12.472 -1.866 -7.857 1.00 0.29 C ATOM 1354 C THR B 25 -13.018 -2.227 -6.475 1.00 0.28 C ATOM 1355 O THR B 25 -13.881 -3.095 -6.335 1.00 0.33 O ATOM 1356 CB THR B 25 -11.203 -2.699 -8.140 1.00 0.32 C ATOM 1357 OG1 THR B 25 -10.643 -2.322 -9.402 1.00 0.35 O ATOM 1358 CG2 THR B 25 -11.501 -4.190 -8.147 1.00 0.40 C ATOM 0 H THR B 25 -11.196 -0.224 -8.114 1.00 0.26 H new ATOM 0 HA THR B 25 -13.225 -2.093 -8.611 1.00 0.29 H new ATOM 0 HB THR B 25 -10.490 -2.497 -7.340 1.00 0.32 H new ATOM 0 HG1 THR B 25 -10.217 -1.443 -9.321 1.00 0.35 H new ATOM 0 HG21 THR B 25 -10.584 -4.743 -8.349 1.00 0.40 H new ATOM 0 HG22 THR B 25 -11.897 -4.486 -7.176 1.00 0.40 H new ATOM 0 HG23 THR B 25 -12.236 -4.410 -8.921 1.00 0.40 H new ATOM 1366 N LEU B 26 -12.516 -1.522 -5.466 1.00 0.26 N ATOM 1367 CA LEU B 26 -12.952 -1.695 -4.087 1.00 0.26 C ATOM 1368 C LEU B 26 -14.425 -1.312 -3.916 1.00 0.26 C ATOM 1369 O LEU B 26 -15.065 -1.743 -2.956 1.00 0.29 O ATOM 1370 CB LEU B 26 -12.087 -0.833 -3.158 1.00 0.24 C ATOM 1371 CG LEU B 26 -10.975 -1.564 -2.383 1.00 0.27 C ATOM 1372 CD1 LEU B 26 -11.542 -2.752 -1.631 1.00 0.33 C ATOM 1373 CD2 LEU B 26 -9.848 -2.009 -3.304 1.00 0.27 C ATOM 0 H LEU B 26 -11.793 -0.812 -5.584 1.00 0.26 H new ATOM 0 HA LEU B 26 -12.840 -2.748 -3.827 1.00 0.26 H new ATOM 0 HB2 LEU B 26 -11.627 -0.045 -3.754 1.00 0.24 H new ATOM 0 HB3 LEU B 26 -12.742 -0.345 -2.436 1.00 0.24 H new ATOM 0 HG LEU B 26 -10.558 -0.858 -1.665 1.00 0.27 H new ATOM 0 HD11 LEU B 26 -10.741 -3.256 -1.090 1.00 0.33 H new ATOM 0 HD12 LEU B 26 -12.298 -2.408 -0.924 1.00 0.33 H new ATOM 0 HD13 LEU B 26 -11.995 -3.447 -2.338 1.00 0.33 H new ATOM 0 HD21 LEU B 26 -9.082 -2.521 -2.721 1.00 0.27 H new ATOM 0 HD22 LEU B 26 -10.243 -2.688 -4.060 1.00 0.27 H new ATOM 0 HD23 LEU B 26 -9.411 -1.138 -3.791 1.00 0.27 H new ATOM 1385 N ARG B 27 -14.952 -0.517 -4.860 1.00 0.27 N ATOM 1386 CA ARG B 27 -16.330 -0.006 -4.798 1.00 0.32 C ATOM 1387 C ARG B 27 -16.469 1.022 -3.679 1.00 0.31 C ATOM 1388 O ARG B 27 -17.544 1.203 -3.111 1.00 0.34 O ATOM 1389 CB ARG B 27 -17.330 -1.147 -4.578 1.00 0.37 C ATOM 1390 CG ARG B 27 -18.193 -1.482 -5.786 1.00 0.75 C ATOM 1391 CD ARG B 27 -17.374 -1.983 -6.962 1.00 1.00 C ATOM 1392 NE ARG B 27 -18.221 -2.615 -7.975 1.00 1.79 N ATOM 1393 CZ ARG B 27 -17.890 -2.743 -9.261 1.00 2.41 C ATOM 1394 NH1 ARG B 27 -16.767 -2.206 -9.720 1.00 2.67 N ATOM 1395 NH2 ARG B 27 -18.695 -3.394 -10.091 1.00 3.28 N ATOM 0 H ARG B 27 -14.437 -0.211 -5.685 1.00 0.27 H new ATOM 0 HA ARG B 27 -16.551 0.472 -5.752 1.00 0.32 H new ATOM 0 HB2 ARG B 27 -16.780 -2.041 -4.283 1.00 0.37 H new ATOM 0 HB3 ARG B 27 -17.982 -0.884 -3.745 1.00 0.37 H new ATOM 0 HG2 ARG B 27 -18.925 -2.240 -5.507 1.00 0.75 H new ATOM 0 HG3 ARG B 27 -18.751 -0.596 -6.087 1.00 0.75 H new ATOM 0 HD2 ARG B 27 -16.830 -1.151 -7.409 1.00 1.00 H new ATOM 0 HD3 ARG B 27 -16.630 -2.698 -6.610 1.00 1.00 H new ATOM 0 HE ARG B 27 -19.125 -2.982 -7.678 1.00 1.79 H new ATOM 0 HH11 ARG B 27 -16.152 -1.692 -9.089 1.00 2.67 H new ATOM 0 HH12 ARG B 27 -16.519 -2.307 -10.704 1.00 2.67 H new ATOM 0 HH21 ARG B 27 -19.566 -3.796 -9.746 1.00 3.28 H new ATOM 0 HH22 ARG B 27 -18.442 -3.492 -11.074 1.00 3.28 H new ATOM 1409 N ILE B 28 -15.372 1.700 -3.377 1.00 0.29 N ATOM 1410 CA ILE B 28 -15.330 2.645 -2.269 1.00 0.30 C ATOM 1411 C ILE B 28 -14.920 4.029 -2.779 1.00 0.30 C ATOM 1412 O ILE B 28 -15.066 4.308 -3.967 1.00 0.33 O ATOM 1413 CB ILE B 28 -14.371 2.121 -1.175 1.00 0.31 C ATOM 1414 CG1 ILE B 28 -14.570 0.608 -1.031 1.00 0.34 C ATOM 1415 CG2 ILE B 28 -14.655 2.804 0.159 1.00 0.34 C ATOM 1416 CD1 ILE B 28 -13.660 -0.061 -0.033 1.00 0.37 C ATOM 0 H ILE B 28 -14.493 1.613 -3.887 1.00 0.29 H new ATOM 0 HA ILE B 28 -16.320 2.741 -1.824 1.00 0.30 H new ATOM 0 HB ILE B 28 -13.343 2.341 -1.462 1.00 0.31 H new ATOM 0 HG12 ILE B 28 -15.604 0.418 -0.742 1.00 0.34 H new ATOM 0 HG13 ILE B 28 -14.421 0.143 -2.005 1.00 0.34 H new ATOM 0 HG21 ILE B 28 -13.970 2.422 0.916 1.00 0.34 H new ATOM 0 HG22 ILE B 28 -14.516 3.880 0.054 1.00 0.34 H new ATOM 0 HG23 ILE B 28 -15.682 2.599 0.462 1.00 0.34 H new ATOM 0 HD11 ILE B 28 -13.876 -1.129 -0.002 1.00 0.37 H new ATOM 0 HD12 ILE B 28 -12.622 0.091 -0.328 1.00 0.37 H new ATOM 0 HD13 ILE B 28 -13.823 0.371 0.954 1.00 0.37 H new ATOM 1428 N ARG B 29 -14.429 4.898 -1.897 1.00 0.28 N ATOM 1429 CA ARG B 29 -14.123 6.283 -2.273 1.00 0.30 C ATOM 1430 C ARG B 29 -13.063 6.913 -1.371 1.00 0.27 C ATOM 1431 O ARG B 29 -12.303 6.204 -0.714 1.00 0.25 O ATOM 1432 CB ARG B 29 -15.419 7.110 -2.279 1.00 0.33 C ATOM 1433 CG ARG B 29 -16.313 6.874 -1.067 1.00 0.57 C ATOM 1434 CD ARG B 29 -15.678 7.410 0.196 1.00 0.59 C ATOM 1435 NE ARG B 29 -16.416 7.046 1.403 1.00 1.03 N ATOM 1436 CZ ARG B 29 -16.676 7.894 2.398 1.00 1.47 C ATOM 1437 NH1 ARG B 29 -16.323 9.168 2.293 1.00 2.15 N ATOM 1438 NH2 ARG B 29 -17.298 7.473 3.492 1.00 1.99 N ATOM 0 H ARG B 29 -14.234 4.672 -0.922 1.00 0.28 H new ATOM 0 HA ARG B 29 -13.697 6.275 -3.276 1.00 0.30 H new ATOM 0 HB2 ARG B 29 -15.162 8.168 -2.327 1.00 0.33 H new ATOM 0 HB3 ARG B 29 -15.982 6.877 -3.183 1.00 0.33 H new ATOM 0 HG2 ARG B 29 -17.278 7.356 -1.225 1.00 0.57 H new ATOM 0 HG3 ARG B 29 -16.504 5.807 -0.956 1.00 0.57 H new ATOM 0 HD2 ARG B 29 -14.658 7.033 0.272 1.00 0.59 H new ATOM 0 HD3 ARG B 29 -15.612 8.496 0.131 1.00 0.59 H new ATOM 0 HE ARG B 29 -16.752 6.087 1.489 1.00 1.03 H new ATOM 0 HH11 ARG B 29 -15.852 9.499 1.451 1.00 2.15 H new ATOM 0 HH12 ARG B 29 -16.522 9.817 3.054 1.00 2.15 H new ATOM 0 HH21 ARG B 29 -17.580 6.496 3.575 1.00 1.99 H new ATOM 0 HH22 ARG B 29 -17.494 8.126 4.250 1.00 1.99 H new ATOM 1452 N GLU B 30 -13.019 8.256 -1.357 1.00 0.30 N ATOM 1453 CA GLU B 30 -12.080 9.024 -0.523 1.00 0.31 C ATOM 1454 C GLU B 30 -12.419 8.927 0.955 1.00 0.30 C ATOM 1455 O GLU B 30 -12.271 9.879 1.723 1.00 0.36 O ATOM 1456 CB GLU B 30 -12.080 10.483 -0.938 1.00 0.39 C ATOM 1457 CG GLU B 30 -11.271 10.726 -2.182 1.00 0.44 C ATOM 1458 CD GLU B 30 -11.991 10.320 -3.453 1.00 0.55 C ATOM 1459 OE1 GLU B 30 -13.237 10.198 -3.431 1.00 1.18 O ATOM 1460 OE2 GLU B 30 -11.315 10.132 -4.485 1.00 1.08 O ATOM 0 H GLU B 30 -13.634 8.840 -1.924 1.00 0.30 H new ATOM 0 HA GLU B 30 -11.091 8.592 -0.675 1.00 0.31 H new ATOM 0 HB2 GLU B 30 -13.106 10.810 -1.106 1.00 0.39 H new ATOM 0 HB3 GLU B 30 -11.681 11.089 -0.125 1.00 0.39 H new ATOM 0 HG2 GLU B 30 -11.015 11.784 -2.240 1.00 0.44 H new ATOM 0 HG3 GLU B 30 -10.334 10.174 -2.111 1.00 0.44 H new ATOM 1467 N GLY B 31 -12.860 7.755 1.327 1.00 0.26 N ATOM 1468 CA GLY B 31 -13.148 7.436 2.692 1.00 0.26 C ATOM 1469 C GLY B 31 -13.070 5.947 2.888 1.00 0.27 C ATOM 1470 O GLY B 31 -13.816 5.363 3.664 1.00 0.35 O ATOM 0 H GLY B 31 -13.030 6.987 0.678 1.00 0.26 H new ATOM 0 HA2 GLY B 31 -12.439 7.938 3.351 1.00 0.26 H new ATOM 0 HA3 GLY B 31 -14.141 7.797 2.959 1.00 0.26 H new ATOM 1474 N ASP B 32 -12.173 5.333 2.134 1.00 0.27 N ATOM 1475 CA ASP B 32 -11.869 3.925 2.291 1.00 0.29 C ATOM 1476 C ASP B 32 -10.705 3.769 3.246 1.00 0.26 C ATOM 1477 O ASP B 32 -9.655 4.389 3.077 1.00 0.29 O ATOM 1478 CB ASP B 32 -11.511 3.285 0.951 1.00 0.35 C ATOM 1479 CG ASP B 32 -11.165 1.814 1.088 1.00 0.41 C ATOM 1480 OD1 ASP B 32 -11.828 1.123 1.896 1.00 1.29 O ATOM 1481 OD2 ASP B 32 -10.267 1.344 0.361 1.00 1.07 O ATOM 0 H ASP B 32 -11.638 5.797 1.399 1.00 0.27 H new ATOM 0 HA ASP B 32 -12.753 3.424 2.686 1.00 0.29 H new ATOM 0 HB2 ASP B 32 -12.349 3.396 0.263 1.00 0.35 H new ATOM 0 HB3 ASP B 32 -10.666 3.815 0.512 1.00 0.35 H new ATOM 1486 N PRO B 33 -10.893 2.979 4.282 1.00 0.21 N ATOM 1487 CA PRO B 33 -9.835 2.649 5.195 1.00 0.24 C ATOM 1488 C PRO B 33 -8.962 1.572 4.606 1.00 0.41 C ATOM 1489 O PRO B 33 -9.405 0.800 3.775 1.00 1.10 O ATOM 1490 CB PRO B 33 -10.552 2.145 6.447 1.00 0.19 C ATOM 1491 CG PRO B 33 -12.012 2.070 6.100 1.00 0.12 C ATOM 1492 CD PRO B 33 -12.139 2.310 4.617 1.00 0.20 C ATOM 0 HA PRO B 33 -9.184 3.496 5.411 1.00 0.24 H new ATOM 0 HB2 PRO B 33 -10.173 1.167 6.744 1.00 0.19 H new ATOM 0 HB3 PRO B 33 -10.387 2.820 7.287 1.00 0.19 H new ATOM 0 HG2 PRO B 33 -12.420 1.095 6.367 1.00 0.12 H new ATOM 0 HG3 PRO B 33 -12.578 2.816 6.659 1.00 0.12 H new ATOM 0 HD2 PRO B 33 -12.256 1.377 4.066 1.00 0.20 H new ATOM 0 HD3 PRO B 33 -13.005 2.929 4.382 1.00 0.20 H new ATOM 1500 N LEU B 34 -7.712 1.551 4.982 1.00 0.25 N ATOM 1501 CA LEU B 34 -6.855 0.465 4.596 1.00 0.19 C ATOM 1502 C LEU B 34 -5.952 0.106 5.746 1.00 0.19 C ATOM 1503 O LEU B 34 -5.555 0.958 6.515 1.00 0.22 O ATOM 1504 CB LEU B 34 -6.018 0.812 3.362 1.00 0.19 C ATOM 1505 CG LEU B 34 -6.764 1.574 2.270 1.00 0.27 C ATOM 1506 CD1 LEU B 34 -6.242 2.998 2.168 1.00 0.32 C ATOM 1507 CD2 LEU B 34 -6.647 0.857 0.936 1.00 0.44 C ATOM 0 H LEU B 34 -7.267 2.270 5.552 1.00 0.25 H new ATOM 0 HA LEU B 34 -7.484 -0.387 4.337 1.00 0.19 H new ATOM 0 HB2 LEU B 34 -5.161 1.407 3.678 1.00 0.19 H new ATOM 0 HB3 LEU B 34 -5.626 -0.112 2.936 1.00 0.19 H new ATOM 0 HG LEU B 34 -7.820 1.614 2.537 1.00 0.27 H new ATOM 0 HD11 LEU B 34 -6.784 3.529 1.385 1.00 0.32 H new ATOM 0 HD12 LEU B 34 -6.388 3.508 3.120 1.00 0.32 H new ATOM 0 HD13 LEU B 34 -5.179 2.980 1.926 1.00 0.32 H new ATOM 0 HD21 LEU B 34 -7.186 1.418 0.173 1.00 0.44 H new ATOM 0 HD22 LEU B 34 -5.597 0.780 0.655 1.00 0.44 H new ATOM 0 HD23 LEU B 34 -7.074 -0.142 1.021 1.00 0.44 H new ATOM 1519 N GLU B 35 -5.600 -1.148 5.807 1.00 0.18 N ATOM 1520 CA GLU B 35 -4.752 -1.639 6.861 1.00 0.17 C ATOM 1521 C GLU B 35 -3.395 -1.832 6.285 1.00 0.13 C ATOM 1522 O GLU B 35 -3.227 -2.671 5.414 1.00 0.12 O ATOM 1523 CB GLU B 35 -5.245 -2.950 7.464 1.00 0.20 C ATOM 1524 CG GLU B 35 -4.401 -3.413 8.643 1.00 0.21 C ATOM 1525 CD GLU B 35 -4.928 -4.676 9.285 1.00 0.28 C ATOM 1526 OE1 GLU B 35 -6.128 -4.974 9.114 1.00 1.09 O ATOM 1527 OE2 GLU B 35 -4.141 -5.393 9.936 1.00 1.10 O ATOM 0 H GLU B 35 -5.890 -1.856 5.133 1.00 0.18 H new ATOM 0 HA GLU B 35 -4.752 -0.912 7.673 1.00 0.17 H new ATOM 0 HB2 GLU B 35 -6.278 -2.829 7.789 1.00 0.20 H new ATOM 0 HB3 GLU B 35 -5.241 -3.722 6.695 1.00 0.20 H new ATOM 0 HG2 GLU B 35 -3.378 -3.582 8.307 1.00 0.21 H new ATOM 0 HG3 GLU B 35 -4.364 -2.620 9.390 1.00 0.21 H new ATOM 1534 N ILE B 36 -2.462 -1.021 6.730 1.00 0.12 N ATOM 1535 CA ILE B 36 -1.099 -1.089 6.283 1.00 0.11 C ATOM 1536 C ILE B 36 -0.363 -2.098 7.129 1.00 0.11 C ATOM 1537 O ILE B 36 -0.189 -1.899 8.328 1.00 0.14 O ATOM 1538 CB ILE B 36 -0.402 0.293 6.410 1.00 0.13 C ATOM 1539 CG1 ILE B 36 -0.941 1.294 5.381 1.00 0.15 C ATOM 1540 CG2 ILE B 36 1.104 0.161 6.274 1.00 0.17 C ATOM 1541 CD1 ILE B 36 -2.352 1.775 5.645 1.00 0.62 C ATOM 0 H ILE B 36 -2.635 -0.290 7.420 1.00 0.12 H new ATOM 0 HA ILE B 36 -1.085 -1.384 5.234 1.00 0.11 H new ATOM 0 HB ILE B 36 -0.629 0.676 7.405 1.00 0.13 H new ATOM 0 HG12 ILE B 36 -0.277 2.158 5.352 1.00 0.15 H new ATOM 0 HG13 ILE B 36 -0.908 0.833 4.394 1.00 0.15 H new ATOM 0 HG21 ILE B 36 1.565 1.144 6.367 1.00 0.17 H new ATOM 0 HG22 ILE B 36 1.484 -0.494 7.058 1.00 0.17 H new ATOM 0 HG23 ILE B 36 1.346 -0.262 5.299 1.00 0.17 H new ATOM 0 HD11 ILE B 36 -2.648 2.479 4.867 1.00 0.62 H new ATOM 0 HD12 ILE B 36 -3.033 0.924 5.643 1.00 0.62 H new ATOM 0 HD13 ILE B 36 -2.392 2.269 6.616 1.00 0.62 H new ATOM 1553 N PHE B 37 0.001 -3.205 6.522 1.00 0.10 N ATOM 1554 CA PHE B 37 0.845 -4.174 7.178 1.00 0.11 C ATOM 1555 C PHE B 37 1.674 -4.900 6.143 1.00 0.10 C ATOM 1556 O PHE B 37 1.154 -5.374 5.143 1.00 0.10 O ATOM 1557 CB PHE B 37 0.029 -5.140 8.051 1.00 0.12 C ATOM 1558 CG PHE B 37 -0.667 -6.250 7.311 1.00 0.21 C ATOM 1559 CD1 PHE B 37 -1.926 -6.058 6.769 1.00 1.09 C ATOM 1560 CD2 PHE B 37 -0.064 -7.490 7.171 1.00 1.16 C ATOM 1561 CE1 PHE B 37 -2.568 -7.080 6.100 1.00 1.14 C ATOM 1562 CE2 PHE B 37 -0.702 -8.517 6.504 1.00 1.20 C ATOM 1563 CZ PHE B 37 -1.956 -8.310 5.967 1.00 0.49 C ATOM 0 H PHE B 37 -0.276 -3.456 5.573 1.00 0.10 H new ATOM 0 HA PHE B 37 1.520 -3.654 7.857 1.00 0.11 H new ATOM 0 HB2 PHE B 37 0.694 -5.582 8.793 1.00 0.12 H new ATOM 0 HB3 PHE B 37 -0.719 -4.565 8.597 1.00 0.12 H new ATOM 0 HD1 PHE B 37 -2.411 -5.098 6.871 1.00 1.09 H new ATOM 0 HD2 PHE B 37 0.918 -7.655 7.589 1.00 1.16 H new ATOM 0 HE1 PHE B 37 -3.550 -6.917 5.680 1.00 1.14 H new ATOM 0 HE2 PHE B 37 -0.221 -9.479 6.403 1.00 1.20 H new ATOM 0 HZ PHE B 37 -2.458 -9.110 5.443 1.00 0.49 H new ATOM 1573 N VAL B 38 2.964 -4.957 6.366 1.00 0.10 N ATOM 1574 CA VAL B 38 3.864 -5.541 5.391 1.00 0.10 C ATOM 1575 C VAL B 38 3.928 -7.047 5.526 1.00 0.13 C ATOM 1576 O VAL B 38 4.109 -7.584 6.621 1.00 0.20 O ATOM 1577 CB VAL B 38 5.286 -4.929 5.489 1.00 0.13 C ATOM 1578 CG1 VAL B 38 5.707 -4.767 6.943 1.00 0.18 C ATOM 1579 CG2 VAL B 38 6.307 -5.778 4.739 1.00 0.17 C ATOM 0 H VAL B 38 3.417 -4.608 7.210 1.00 0.10 H new ATOM 0 HA VAL B 38 3.460 -5.305 4.406 1.00 0.10 H new ATOM 0 HB VAL B 38 5.252 -3.944 5.023 1.00 0.13 H new ATOM 0 HG11 VAL B 38 6.707 -4.336 6.986 1.00 0.18 H new ATOM 0 HG12 VAL B 38 5.005 -4.107 7.454 1.00 0.18 H new ATOM 0 HG13 VAL B 38 5.710 -5.741 7.432 1.00 0.18 H new ATOM 0 HG21 VAL B 38 7.293 -5.323 4.827 1.00 0.17 H new ATOM 0 HG22 VAL B 38 6.331 -6.780 5.166 1.00 0.17 H new ATOM 0 HG23 VAL B 38 6.027 -5.839 3.687 1.00 0.17 H new ATOM 1589 N ASP B 39 3.755 -7.711 4.400 1.00 0.14 N ATOM 1590 CA ASP B 39 3.918 -9.143 4.320 1.00 0.19 C ATOM 1591 C ASP B 39 5.340 -9.430 3.871 1.00 0.42 C ATOM 1592 O ASP B 39 6.049 -8.514 3.451 1.00 1.05 O ATOM 1593 CB ASP B 39 2.964 -9.758 3.311 1.00 0.26 C ATOM 1594 CG ASP B 39 2.437 -11.110 3.759 1.00 0.32 C ATOM 1595 OD1 ASP B 39 1.494 -11.148 4.573 1.00 1.13 O ATOM 1596 OD2 ASP B 39 2.959 -12.144 3.290 1.00 1.14 O ATOM 0 H ASP B 39 3.498 -7.270 3.517 1.00 0.14 H new ATOM 0 HA ASP B 39 3.707 -9.574 5.299 1.00 0.19 H new ATOM 0 HB2 ASP B 39 2.126 -9.080 3.148 1.00 0.26 H new ATOM 0 HB3 ASP B 39 3.474 -9.869 2.354 1.00 0.26 H new ATOM 1601 N ARG B 40 5.730 -10.694 3.910 1.00 0.46 N ATOM 1602 CA ARG B 40 7.048 -11.142 3.448 1.00 0.54 C ATOM 1603 C ARG B 40 8.194 -10.213 3.855 1.00 0.52 C ATOM 1604 O ARG B 40 8.576 -10.166 5.024 1.00 0.59 O ATOM 1605 CB ARG B 40 7.096 -11.413 1.932 1.00 0.65 C ATOM 1606 CG ARG B 40 6.091 -10.643 1.093 1.00 0.75 C ATOM 1607 CD ARG B 40 4.769 -11.392 0.996 1.00 0.77 C ATOM 1608 NE ARG B 40 3.939 -10.918 -0.111 1.00 1.29 N ATOM 1609 CZ ARG B 40 2.664 -11.258 -0.291 1.00 2.04 C ATOM 1610 NH1 ARG B 40 2.031 -11.975 0.629 1.00 2.59 N ATOM 1611 NH2 ARG B 40 2.016 -10.858 -1.383 1.00 2.71 N ATOM 0 H ARG B 40 5.142 -11.448 4.264 1.00 0.46 H new ATOM 0 HA ARG B 40 7.200 -12.089 3.966 1.00 0.54 H new ATOM 0 HB2 ARG B 40 8.098 -11.179 1.571 1.00 0.65 H new ATOM 0 HB3 ARG B 40 6.939 -12.479 1.767 1.00 0.65 H new ATOM 0 HG2 ARG B 40 5.924 -9.659 1.532 1.00 0.75 H new ATOM 0 HG3 ARG B 40 6.495 -10.481 0.094 1.00 0.75 H new ATOM 0 HD2 ARG B 40 4.966 -12.456 0.869 1.00 0.77 H new ATOM 0 HD3 ARG B 40 4.221 -11.279 1.931 1.00 0.77 H new ATOM 0 HE ARG B 40 4.364 -10.286 -0.789 1.00 1.29 H new ATOM 0 HH11 ARG B 40 2.521 -12.266 1.475 1.00 2.59 H new ATOM 0 HH12 ARG B 40 1.054 -12.235 0.490 1.00 2.59 H new ATOM 0 HH21 ARG B 40 2.496 -10.291 -2.082 1.00 2.71 H new ATOM 0 HH22 ARG B 40 1.039 -11.119 -1.521 1.00 2.71 H new ATOM 1625 N ASP B 41 8.734 -9.473 2.891 1.00 0.53 N ATOM 1626 CA ASP B 41 9.909 -8.641 3.129 1.00 0.56 C ATOM 1627 C ASP B 41 9.549 -7.166 3.142 1.00 0.48 C ATOM 1628 O ASP B 41 9.337 -6.574 4.198 1.00 0.59 O ATOM 1629 CB ASP B 41 10.972 -8.900 2.061 1.00 0.59 C ATOM 1630 CG ASP B 41 12.114 -7.894 2.117 1.00 0.62 C ATOM 1631 OD1 ASP B 41 12.643 -7.641 3.221 1.00 1.32 O ATOM 1632 OD2 ASP B 41 12.466 -7.332 1.057 1.00 1.18 O ATOM 0 H ASP B 41 8.376 -9.433 1.937 1.00 0.53 H new ATOM 0 HA ASP B 41 10.307 -8.907 4.108 1.00 0.56 H new ATOM 0 HB2 ASP B 41 11.372 -9.906 2.188 1.00 0.59 H new ATOM 0 HB3 ASP B 41 10.508 -8.863 1.075 1.00 0.59 H new ATOM 1637 N GLY B 42 9.468 -6.583 1.959 1.00 0.34 N ATOM 1638 CA GLY B 42 9.218 -5.165 1.846 1.00 0.26 C ATOM 1639 C GLY B 42 7.940 -4.878 1.106 1.00 0.18 C ATOM 1640 O GLY B 42 7.795 -3.828 0.486 1.00 0.17 O ATOM 0 H GLY B 42 9.572 -7.071 1.069 1.00 0.34 H new ATOM 0 HA2 GLY B 42 9.168 -4.725 2.842 1.00 0.26 H new ATOM 0 HA3 GLY B 42 10.052 -4.689 1.329 1.00 0.26 H new ATOM 1644 N GLU B 43 7.018 -5.825 1.152 1.00 0.15 N ATOM 1645 CA GLU B 43 5.726 -5.654 0.514 1.00 0.12 C ATOM 1646 C GLU B 43 4.710 -5.187 1.538 1.00 0.09 C ATOM 1647 O GLU B 43 4.368 -5.936 2.441 1.00 0.09 O ATOM 1648 CB GLU B 43 5.240 -6.968 -0.103 1.00 0.16 C ATOM 1649 CG GLU B 43 6.351 -7.809 -0.708 1.00 0.57 C ATOM 1650 CD GLU B 43 5.898 -8.557 -1.942 1.00 1.17 C ATOM 1651 OE1 GLU B 43 5.978 -7.995 -3.047 1.00 2.07 O ATOM 1652 OE2 GLU B 43 5.458 -9.709 -1.815 1.00 1.65 O ATOM 0 H GLU B 43 7.141 -6.720 1.625 1.00 0.15 H new ATOM 0 HA GLU B 43 5.834 -4.912 -0.277 1.00 0.12 H new ATOM 0 HB2 GLU B 43 4.731 -7.552 0.664 1.00 0.16 H new ATOM 0 HB3 GLU B 43 4.504 -6.746 -0.875 1.00 0.16 H new ATOM 0 HG2 GLU B 43 7.192 -7.165 -0.965 1.00 0.57 H new ATOM 0 HG3 GLU B 43 6.710 -8.522 0.035 1.00 0.57 H new ATOM 1659 N VAL B 44 4.239 -3.961 1.419 1.00 0.08 N ATOM 1660 CA VAL B 44 3.234 -3.463 2.343 1.00 0.07 C ATOM 1661 C VAL B 44 1.854 -3.807 1.825 1.00 0.07 C ATOM 1662 O VAL B 44 1.549 -3.584 0.664 1.00 0.08 O ATOM 1663 CB VAL B 44 3.298 -1.942 2.545 1.00 0.09 C ATOM 1664 CG1 VAL B 44 2.708 -1.577 3.899 1.00 0.10 C ATOM 1665 CG2 VAL B 44 4.720 -1.423 2.409 1.00 0.13 C ATOM 0 H VAL B 44 4.530 -3.297 0.702 1.00 0.08 H new ATOM 0 HA VAL B 44 3.436 -3.939 3.302 1.00 0.07 H new ATOM 0 HB VAL B 44 2.707 -1.464 1.764 1.00 0.09 H new ATOM 0 HG11 VAL B 44 2.756 -0.497 4.037 1.00 0.10 H new ATOM 0 HG12 VAL B 44 1.669 -1.903 3.943 1.00 0.10 H new ATOM 0 HG13 VAL B 44 3.276 -2.069 4.688 1.00 0.10 H new ATOM 0 HG21 VAL B 44 4.729 -0.343 2.558 1.00 0.13 H new ATOM 0 HG22 VAL B 44 5.354 -1.898 3.158 1.00 0.13 H new ATOM 0 HG23 VAL B 44 5.098 -1.655 1.414 1.00 0.13 H new ATOM 1675 N ILE B 45 1.028 -4.333 2.692 1.00 0.07 N ATOM 1676 CA ILE B 45 -0.303 -4.762 2.322 1.00 0.08 C ATOM 1677 C ILE B 45 -1.298 -3.799 2.935 1.00 0.09 C ATOM 1678 O ILE B 45 -1.302 -3.617 4.144 1.00 0.11 O ATOM 1679 CB ILE B 45 -0.593 -6.196 2.825 1.00 0.10 C ATOM 1680 CG1 ILE B 45 0.191 -7.244 2.009 1.00 0.10 C ATOM 1681 CG2 ILE B 45 -2.091 -6.495 2.776 1.00 0.12 C ATOM 1682 CD1 ILE B 45 1.688 -7.085 2.017 1.00 0.09 C ATOM 0 H ILE B 45 1.256 -4.478 3.676 1.00 0.07 H new ATOM 0 HA ILE B 45 -0.386 -4.768 1.235 1.00 0.08 H new ATOM 0 HB ILE B 45 -0.260 -6.257 3.861 1.00 0.10 H new ATOM 0 HG12 ILE B 45 -0.054 -8.235 2.392 1.00 0.10 H new ATOM 0 HG13 ILE B 45 -0.155 -7.208 0.976 1.00 0.10 H new ATOM 0 HG21 ILE B 45 -2.272 -7.509 3.134 1.00 0.12 H new ATOM 0 HG22 ILE B 45 -2.624 -5.786 3.409 1.00 0.12 H new ATOM 0 HG23 ILE B 45 -2.447 -6.404 1.750 1.00 0.12 H new ATOM 0 HD11 ILE B 45 2.141 -7.872 1.414 1.00 0.09 H new ATOM 0 HD12 ILE B 45 1.953 -6.112 1.602 1.00 0.09 H new ATOM 0 HD13 ILE B 45 2.056 -7.155 3.041 1.00 0.09 H new ATOM 1694 N LEU B 46 -2.072 -3.143 2.095 1.00 0.09 N ATOM 1695 CA LEU B 46 -3.104 -2.210 2.537 1.00 0.10 C ATOM 1696 C LEU B 46 -4.483 -2.767 2.213 1.00 0.11 C ATOM 1697 O LEU B 46 -4.810 -2.945 1.047 1.00 0.11 O ATOM 1698 CB LEU B 46 -2.931 -0.880 1.799 1.00 0.11 C ATOM 1699 CG LEU B 46 -1.510 -0.601 1.324 1.00 0.10 C ATOM 1700 CD1 LEU B 46 -1.518 0.495 0.274 1.00 0.15 C ATOM 1701 CD2 LEU B 46 -0.623 -0.217 2.494 1.00 0.13 C ATOM 0 H LEU B 46 -2.008 -3.238 1.081 1.00 0.09 H new ATOM 0 HA LEU B 46 -3.011 -2.063 3.613 1.00 0.10 H new ATOM 0 HB2 LEU B 46 -3.598 -0.868 0.937 1.00 0.11 H new ATOM 0 HB3 LEU B 46 -3.246 -0.070 2.457 1.00 0.11 H new ATOM 0 HG LEU B 46 -1.105 -1.509 0.876 1.00 0.10 H new ATOM 0 HD11 LEU B 46 -0.498 0.687 -0.059 1.00 0.15 H new ATOM 0 HD12 LEU B 46 -2.124 0.180 -0.576 1.00 0.15 H new ATOM 0 HD13 LEU B 46 -1.938 1.406 0.702 1.00 0.15 H new ATOM 0 HD21 LEU B 46 0.388 -0.022 2.136 1.00 0.13 H new ATOM 0 HD22 LEU B 46 -1.018 0.680 2.971 1.00 0.13 H new ATOM 0 HD23 LEU B 46 -0.600 -1.033 3.216 1.00 0.13 H new ATOM 1713 N LYS B 47 -5.304 -3.034 3.216 1.00 0.12 N ATOM 1714 CA LYS B 47 -6.638 -3.575 2.933 1.00 0.16 C ATOM 1715 C LYS B 47 -7.757 -2.811 3.644 1.00 0.14 C ATOM 1716 O LYS B 47 -7.572 -2.324 4.742 1.00 0.14 O ATOM 1717 CB LYS B 47 -6.669 -5.079 3.238 1.00 0.22 C ATOM 1718 CG LYS B 47 -7.732 -5.534 4.225 1.00 0.24 C ATOM 1719 CD LYS B 47 -7.253 -5.439 5.665 1.00 0.40 C ATOM 1720 CE LYS B 47 -5.874 -6.056 5.834 1.00 0.52 C ATOM 1721 NZ LYS B 47 -5.698 -6.669 7.175 1.00 0.95 N ATOM 0 H LYS B 47 -5.088 -2.894 4.203 1.00 0.12 H new ATOM 0 HA LYS B 47 -6.834 -3.436 1.870 1.00 0.16 H new ATOM 0 HB2 LYS B 47 -6.816 -5.617 2.302 1.00 0.22 H new ATOM 0 HB3 LYS B 47 -5.693 -5.372 3.624 1.00 0.22 H new ATOM 0 HG2 LYS B 47 -8.627 -4.924 4.100 1.00 0.24 H new ATOM 0 HG3 LYS B 47 -8.014 -6.563 4.004 1.00 0.24 H new ATOM 0 HD2 LYS B 47 -7.225 -4.394 5.972 1.00 0.40 H new ATOM 0 HD3 LYS B 47 -7.962 -5.945 6.320 1.00 0.40 H new ATOM 0 HE2 LYS B 47 -5.720 -6.814 5.066 1.00 0.52 H new ATOM 0 HE3 LYS B 47 -5.113 -5.290 5.683 1.00 0.52 H new ATOM 0 HZ1 LYS B 47 -4.694 -6.631 7.445 1.00 0.95 H new ATOM 0 HZ2 LYS B 47 -6.264 -6.146 7.873 1.00 0.95 H new ATOM 0 HZ3 LYS B 47 -6.012 -7.660 7.148 1.00 0.95 H new ATOM 1735 N LYS B 48 -8.925 -2.788 2.999 1.00 0.17 N ATOM 1736 CA LYS B 48 -10.081 -1.922 3.339 1.00 0.17 C ATOM 1737 C LYS B 48 -10.399 -1.709 4.826 1.00 0.13 C ATOM 1738 O LYS B 48 -11.114 -0.764 5.146 1.00 0.16 O ATOM 1739 CB LYS B 48 -11.324 -2.472 2.677 1.00 0.22 C ATOM 1740 CG LYS B 48 -11.267 -3.973 2.506 1.00 0.24 C ATOM 1741 CD LYS B 48 -12.028 -4.425 1.279 1.00 0.35 C ATOM 1742 CE LYS B 48 -13.512 -4.104 1.370 1.00 0.43 C ATOM 1743 NZ LYS B 48 -14.314 -4.945 0.438 1.00 0.64 N ATOM 0 H LYS B 48 -9.109 -3.389 2.196 1.00 0.17 H new ATOM 0 HA LYS B 48 -9.777 -0.941 2.973 1.00 0.17 H new ATOM 0 HB2 LYS B 48 -12.197 -2.210 3.274 1.00 0.22 H new ATOM 0 HB3 LYS B 48 -11.452 -2.002 1.702 1.00 0.22 H new ATOM 0 HG2 LYS B 48 -10.227 -4.291 2.427 1.00 0.24 H new ATOM 0 HG3 LYS B 48 -11.682 -4.456 3.390 1.00 0.24 H new ATOM 0 HD2 LYS B 48 -11.608 -3.944 0.396 1.00 0.35 H new ATOM 0 HD3 LYS B 48 -11.898 -5.499 1.149 1.00 0.35 H new ATOM 0 HE2 LYS B 48 -13.857 -4.262 2.392 1.00 0.43 H new ATOM 0 HE3 LYS B 48 -13.672 -3.051 1.139 1.00 0.43 H new ATOM 0 HZ1 LYS B 48 -15.321 -4.699 0.527 1.00 0.64 H new ATOM 0 HZ2 LYS B 48 -14.001 -4.775 -0.539 1.00 0.64 H new ATOM 0 HZ3 LYS B 48 -14.181 -5.949 0.674 1.00 0.64 H new ATOM 1757 N TYR B 49 -9.953 -2.592 5.716 1.00 0.13 N ATOM 1758 CA TYR B 49 -10.180 -2.433 7.160 1.00 0.15 C ATOM 1759 C TYR B 49 -11.627 -2.765 7.535 1.00 0.18 C ATOM 1760 O TYR B 49 -11.880 -3.480 8.503 1.00 0.25 O ATOM 1761 CB TYR B 49 -9.878 -1.008 7.629 1.00 0.19 C ATOM 1762 CG TYR B 49 -10.311 -0.723 9.059 1.00 0.31 C ATOM 1763 CD1 TYR B 49 -9.884 -1.517 10.120 1.00 1.18 C ATOM 1764 CD2 TYR B 49 -11.163 0.338 9.339 1.00 1.14 C ATOM 1765 CE1 TYR B 49 -10.293 -1.256 11.415 1.00 1.26 C ATOM 1766 CE2 TYR B 49 -11.575 0.603 10.631 1.00 1.19 C ATOM 1767 CZ TYR B 49 -11.138 -0.195 11.664 1.00 0.62 C ATOM 1768 OH TYR B 49 -11.553 0.067 12.951 1.00 0.79 O ATOM 0 H TYR B 49 -9.429 -3.431 5.466 1.00 0.13 H new ATOM 0 HA TYR B 49 -9.500 -3.128 7.653 1.00 0.15 H new ATOM 0 HB2 TYR B 49 -8.807 -0.827 7.542 1.00 0.19 H new ATOM 0 HB3 TYR B 49 -10.376 -0.304 6.962 1.00 0.19 H new ATOM 0 HD1 TYR B 49 -9.223 -2.350 9.929 1.00 1.18 H new ATOM 0 HD2 TYR B 49 -11.510 0.967 8.532 1.00 1.14 H new ATOM 0 HE1 TYR B 49 -9.952 -1.880 12.228 1.00 1.26 H new ATOM 0 HE2 TYR B 49 -12.237 1.433 10.830 1.00 1.19 H new ATOM 0 HH TYR B 49 -12.144 0.849 12.951 1.00 0.79 H new ATOM 1778 N SER B 50 -12.559 -2.222 6.758 1.00 0.20 N ATOM 1779 CA SER B 50 -13.987 -2.346 7.013 1.00 0.28 C ATOM 1780 C SER B 50 -14.416 -3.809 7.258 1.00 0.29 C ATOM 1781 O SER B 50 -15.128 -4.084 8.225 1.00 0.35 O ATOM 1782 CB SER B 50 -14.765 -1.690 5.854 1.00 0.39 C ATOM 1783 OG SER B 50 -14.088 -1.850 4.617 1.00 1.22 O ATOM 0 H SER B 50 -12.339 -1.677 5.924 1.00 0.20 H new ATOM 0 HA SER B 50 -14.226 -1.820 7.937 1.00 0.28 H new ATOM 0 HB2 SER B 50 -15.759 -2.132 5.786 1.00 0.39 H new ATOM 0 HB3 SER B 50 -14.901 -0.629 6.061 1.00 0.39 H new ATOM 0 HG SER B 50 -14.607 -1.425 3.903 1.00 1.22 H new ATOM 1789 N PRO B 51 -14.005 -4.771 6.404 1.00 0.34 N ATOM 1790 CA PRO B 51 -14.184 -6.190 6.665 1.00 0.43 C ATOM 1791 C PRO B 51 -12.891 -6.846 7.119 1.00 0.45 C ATOM 1792 O PRO B 51 -12.777 -8.073 7.150 1.00 0.56 O ATOM 1793 CB PRO B 51 -14.539 -6.705 5.288 1.00 0.52 C ATOM 1794 CG PRO B 51 -13.681 -5.888 4.368 1.00 0.47 C ATOM 1795 CD PRO B 51 -13.390 -4.585 5.079 1.00 0.41 C ATOM 0 HA PRO B 51 -14.915 -6.392 7.448 1.00 0.43 H new ATOM 0 HB2 PRO B 51 -14.327 -7.770 5.192 1.00 0.52 H new ATOM 0 HB3 PRO B 51 -15.599 -6.570 5.071 1.00 0.52 H new ATOM 0 HG2 PRO B 51 -12.756 -6.415 4.134 1.00 0.47 H new ATOM 0 HG3 PRO B 51 -14.193 -5.706 3.423 1.00 0.47 H new ATOM 0 HD2 PRO B 51 -12.318 -4.401 5.156 1.00 0.41 H new ATOM 0 HD3 PRO B 51 -13.823 -3.735 4.552 1.00 0.41 H new ATOM 1803 N ILE B 52 -11.926 -6.008 7.479 1.00 0.37 N ATOM 1804 CA ILE B 52 -10.559 -6.444 7.707 1.00 0.45 C ATOM 1805 C ILE B 52 -10.079 -7.204 6.470 1.00 0.57 C ATOM 1806 O ILE B 52 -10.404 -6.810 5.347 1.00 0.57 O ATOM 1807 CB ILE B 52 -10.442 -7.312 8.980 1.00 0.60 C ATOM 1808 CG1 ILE B 52 -11.545 -6.933 9.973 1.00 0.50 C ATOM 1809 CG2 ILE B 52 -9.068 -7.122 9.624 1.00 0.73 C ATOM 1810 CD1 ILE B 52 -11.438 -7.633 11.311 1.00 0.70 C ATOM 0 H ILE B 52 -12.072 -5.008 7.620 1.00 0.37 H new ATOM 0 HA ILE B 52 -9.925 -5.572 7.870 1.00 0.45 H new ATOM 0 HB ILE B 52 -10.557 -8.360 8.704 1.00 0.60 H new ATOM 0 HG12 ILE B 52 -11.518 -5.855 10.135 1.00 0.50 H new ATOM 0 HG13 ILE B 52 -12.514 -7.165 9.530 1.00 0.50 H new ATOM 0 HG21 ILE B 52 -8.998 -7.739 10.520 1.00 0.73 H new ATOM 0 HG22 ILE B 52 -8.291 -7.417 8.918 1.00 0.73 H new ATOM 0 HG23 ILE B 52 -8.934 -6.074 9.893 1.00 0.73 H new ATOM 0 HD11 ILE B 52 -12.255 -7.311 11.957 1.00 0.70 H new ATOM 0 HD12 ILE B 52 -11.496 -8.711 11.163 1.00 0.70 H new ATOM 0 HD13 ILE B 52 -10.486 -7.382 11.778 1.00 0.70 H new ATOM 1822 N SER B 53 -9.313 -8.265 6.649 1.00 0.78 N ATOM 1823 CA SER B 53 -8.888 -9.067 5.511 1.00 0.95 C ATOM 1824 C SER B 53 -9.979 -10.059 5.137 1.00 1.16 C ATOM 1825 O SER B 53 -10.119 -10.458 3.975 1.00 1.86 O ATOM 1826 CB SER B 53 -7.592 -9.823 5.817 1.00 1.08 C ATOM 1827 OG SER B 53 -6.502 -8.938 5.978 1.00 1.48 O ATOM 0 H SER B 53 -8.976 -8.590 7.555 1.00 0.78 H new ATOM 0 HA SER B 53 -8.703 -8.392 4.676 1.00 0.95 H new ATOM 0 HB2 SER B 53 -7.720 -10.414 6.724 1.00 1.08 H new ATOM 0 HB3 SER B 53 -7.378 -10.522 5.009 1.00 1.08 H new ATOM 0 HG SER B 53 -5.966 -8.926 5.157 1.00 1.48 H new ATOM 1833 N GLU B 54 -10.752 -10.428 6.146 1.00 1.07 N ATOM 1834 CA GLU B 54 -11.807 -11.418 6.018 1.00 1.27 C ATOM 1835 C GLU B 54 -12.689 -11.374 7.259 1.00 1.46 C ATOM 1836 O GLU B 54 -12.214 -11.595 8.376 1.00 2.29 O ATOM 1837 CB GLU B 54 -11.196 -12.810 5.846 1.00 1.47 C ATOM 1838 CG GLU B 54 -12.214 -13.912 5.627 1.00 1.75 C ATOM 1839 CD GLU B 54 -11.558 -15.260 5.443 1.00 2.00 C ATOM 1840 OE1 GLU B 54 -11.203 -15.601 4.294 1.00 2.41 O ATOM 1841 OE2 GLU B 54 -11.382 -15.979 6.447 1.00 2.62 O ATOM 0 H GLU B 54 -10.663 -10.044 7.087 1.00 1.07 H new ATOM 0 HA GLU B 54 -12.414 -11.197 5.140 1.00 1.27 H new ATOM 0 HB2 GLU B 54 -10.510 -12.791 5.000 1.00 1.47 H new ATOM 0 HB3 GLU B 54 -10.605 -13.047 6.731 1.00 1.47 H new ATOM 0 HG2 GLU B 54 -12.893 -13.953 6.479 1.00 1.75 H new ATOM 0 HG3 GLU B 54 -12.817 -13.679 4.749 1.00 1.75 H new ATOM 1848 N LEU B 55 -13.957 -11.065 7.070 1.00 1.27 N ATOM 1849 CA LEU B 55 -14.878 -10.931 8.184 1.00 1.44 C ATOM 1850 C LEU B 55 -15.891 -12.073 8.180 1.00 2.03 C ATOM 1851 O LEU B 55 -16.962 -11.922 7.555 1.00 2.28 O ATOM 1852 CB LEU B 55 -15.590 -9.579 8.101 1.00 1.59 C ATOM 1853 CG LEU B 55 -15.874 -8.899 9.442 1.00 1.50 C ATOM 1854 CD1 LEU B 55 -16.841 -9.722 10.279 1.00 2.31 C ATOM 1855 CD2 LEU B 55 -14.576 -8.671 10.196 1.00 0.94 C ATOM 1856 OXT LEU B 55 -15.610 -13.124 8.797 1.00 2.64 O ATOM 0 H LEU B 55 -14.375 -10.902 6.154 1.00 1.27 H new ATOM 0 HA LEU B 55 -14.318 -10.980 9.118 1.00 1.44 H new ATOM 0 HB2 LEU B 55 -14.985 -8.906 7.494 1.00 1.59 H new ATOM 0 HB3 LEU B 55 -16.535 -9.718 7.577 1.00 1.59 H new ATOM 0 HG LEU B 55 -16.341 -7.934 9.245 1.00 1.50 H new ATOM 0 HD11 LEU B 55 -17.025 -9.215 11.226 1.00 2.31 H new ATOM 0 HD12 LEU B 55 -17.782 -9.837 9.740 1.00 2.31 H new ATOM 0 HD13 LEU B 55 -16.411 -10.705 10.471 1.00 2.31 H new ATOM 0 HD21 LEU B 55 -14.789 -8.187 11.149 1.00 0.94 H new ATOM 0 HD22 LEU B 55 -14.087 -9.628 10.377 1.00 0.94 H new ATOM 0 HD23 LEU B 55 -13.919 -8.034 9.604 1.00 0.94 H new TER 1868 LEU B 55