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 Single : A 1 MET CE :methyl -163:sc= -0.0446 (180deg=-0.446) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.0214 (180deg=-0.0767) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 70:sc= -0.363 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 77:sc= 0.794 USER MOD Single : A 47 LYS NZ :NH3+ -132:sc= -0.387! (180deg=-2.74!) USER MOD Single : A 48 LYS NZ :NH3+ 138:sc= 1.18 (180deg=0.594) 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 : A 53 SER OG : rot 59:sc= 0.0454 USER MOD Single : B 1 MET CE :methyl -165:sc= -0.107 (180deg=-0.512) USER MOD Single : B 1 MET N :NH3+ -120:sc= 0.124 (180deg=-0.0163) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 57:sc= 0.303 USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 THR OG1 : rot 73:sc= 0.647 USER MOD Single : B 47 LYS NZ :NH3+ -140:sc= -0.242! (180deg=-2.93!) USER MOD Single : B 48 LYS NZ :NH3+ 148:sc= 0.899 (180deg=0.0197) USER MOD Single : B 49 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 SER OG : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 180:sc= 0.00675 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.300 -7.417 11.226 1.00 3.96 N ATOM 2 CA MET A 1 9.954 -7.975 11.475 1.00 3.42 C ATOM 3 C MET A 1 8.916 -7.205 10.681 1.00 2.72 C ATOM 4 O MET A 1 9.089 -6.015 10.413 1.00 3.29 O ATOM 5 CB MET A 1 9.619 -7.926 12.970 1.00 3.67 C ATOM 6 CG MET A 1 10.500 -8.830 13.818 1.00 4.16 C ATOM 7 SD MET A 1 10.052 -8.811 15.568 1.00 4.95 S ATOM 8 CE MET A 1 10.407 -7.108 15.991 1.00 5.91 C ATOM 0 H1 MET A 1 11.916 -8.158 10.835 1.00 3.96 H new ATOM 0 H2 MET A 1 11.230 -6.632 10.548 1.00 3.96 H new ATOM 0 H3 MET A 1 11.702 -7.068 12.120 1.00 3.96 H new ATOM 0 HA MET A 1 9.945 -9.016 11.153 1.00 3.42 H new ATOM 0 HB2 MET A 1 9.718 -6.900 13.323 1.00 3.67 H new ATOM 0 HB3 MET A 1 8.577 -8.212 13.110 1.00 3.67 H new ATOM 0 HG2 MET A 1 10.432 -9.851 13.442 1.00 4.16 H new ATOM 0 HG3 MET A 1 11.539 -8.519 13.711 1.00 4.16 H new ATOM 0 HE1 MET A 1 10.475 -7.009 17.074 1.00 5.91 H new ATOM 0 HE2 MET A 1 11.354 -6.811 15.540 1.00 5.91 H new ATOM 0 HE3 MET A 1 9.609 -6.466 15.617 1.00 5.91 H new ATOM 20 N LYS A 2 7.844 -7.881 10.301 1.00 1.76 N ATOM 21 CA LYS A 2 6.842 -7.280 9.441 1.00 1.11 C ATOM 22 C LYS A 2 5.448 -7.360 10.087 1.00 0.77 C ATOM 23 O LYS A 2 5.332 -7.763 11.244 1.00 0.80 O ATOM 24 CB LYS A 2 6.887 -7.955 8.055 1.00 0.64 C ATOM 25 CG LYS A 2 5.885 -9.077 7.840 1.00 0.98 C ATOM 26 CD LYS A 2 6.051 -10.233 8.806 1.00 1.79 C ATOM 27 CE LYS A 2 4.755 -11.013 8.909 1.00 2.66 C ATOM 28 NZ LYS A 2 4.885 -12.218 9.768 1.00 3.71 N ATOM 0 H LYS A 2 7.647 -8.844 10.575 1.00 1.76 H new ATOM 0 HA LYS A 2 7.060 -6.220 9.307 1.00 1.11 H new ATOM 0 HB2 LYS A 2 6.721 -7.193 7.294 1.00 0.64 H new ATOM 0 HB3 LYS A 2 7.890 -8.352 7.896 1.00 0.64 H new ATOM 0 HG2 LYS A 2 4.876 -8.675 7.937 1.00 0.98 H new ATOM 0 HG3 LYS A 2 5.983 -9.450 6.820 1.00 0.98 H new ATOM 0 HD2 LYS A 2 6.853 -10.888 8.467 1.00 1.79 H new ATOM 0 HD3 LYS A 2 6.339 -9.858 9.788 1.00 1.79 H new ATOM 0 HE2 LYS A 2 3.976 -10.366 9.312 1.00 2.66 H new ATOM 0 HE3 LYS A 2 4.435 -11.314 7.911 1.00 2.66 H new ATOM 0 HZ1 LYS A 2 3.973 -12.717 9.807 1.00 3.71 H new ATOM 0 HZ2 LYS A 2 5.609 -12.850 9.372 1.00 3.71 H new ATOM 0 HZ3 LYS A 2 5.164 -11.931 10.728 1.00 3.71 H new ATOM 42 N ALA A 3 4.406 -7.004 9.319 1.00 0.50 N ATOM 43 CA ALA A 3 3.033 -6.892 9.821 1.00 0.32 C ATOM 44 C ALA A 3 2.912 -5.788 10.858 1.00 0.37 C ATOM 45 O ALA A 3 3.469 -5.864 11.952 1.00 0.72 O ATOM 46 CB ALA A 3 2.516 -8.209 10.373 1.00 0.44 C ATOM 0 H ALA A 3 4.496 -6.785 8.327 1.00 0.50 H new ATOM 0 HA ALA A 3 2.407 -6.629 8.968 1.00 0.32 H new ATOM 0 HB1 ALA A 3 1.496 -8.077 10.733 1.00 0.44 H new ATOM 0 HB2 ALA A 3 2.528 -8.963 9.586 1.00 0.44 H new ATOM 0 HB3 ALA A 3 3.152 -8.533 11.196 1.00 0.44 H new ATOM 52 N THR A 4 2.175 -4.756 10.504 1.00 0.23 N ATOM 53 CA THR A 4 2.082 -3.577 11.335 1.00 0.26 C ATOM 54 C THR A 4 0.634 -3.218 11.654 1.00 0.27 C ATOM 55 O THR A 4 0.332 -2.754 12.754 1.00 0.41 O ATOM 56 CB THR A 4 2.810 -2.405 10.658 1.00 0.26 C ATOM 57 OG1 THR A 4 2.334 -2.248 9.314 1.00 0.23 O ATOM 58 CG2 THR A 4 4.310 -2.662 10.618 1.00 0.27 C ATOM 0 H THR A 4 1.630 -4.711 9.643 1.00 0.23 H new ATOM 0 HA THR A 4 2.567 -3.792 12.287 1.00 0.26 H new ATOM 0 HB THR A 4 2.612 -1.501 11.233 1.00 0.26 H new ATOM 0 HG1 THR A 4 1.412 -1.917 9.330 1.00 0.23 H new ATOM 0 HG21 THR A 4 4.810 -1.822 10.135 1.00 0.27 H new ATOM 0 HG22 THR A 4 4.687 -2.774 11.635 1.00 0.27 H new ATOM 0 HG23 THR A 4 4.508 -3.574 10.055 1.00 0.27 H new ATOM 66 N GLY A 5 -0.253 -3.438 10.693 1.00 0.21 N ATOM 67 CA GLY A 5 -1.670 -3.261 10.934 1.00 0.24 C ATOM 68 C GLY A 5 -2.039 -1.826 11.254 1.00 0.25 C ATOM 69 O GLY A 5 -2.803 -1.567 12.183 1.00 0.32 O ATOM 0 H GLY A 5 -0.014 -3.737 9.747 1.00 0.21 H new ATOM 0 HA2 GLY A 5 -2.226 -3.587 10.055 1.00 0.24 H new ATOM 0 HA3 GLY A 5 -1.976 -3.902 11.760 1.00 0.24 H new ATOM 73 N ILE A 6 -1.503 -0.890 10.487 1.00 0.21 N ATOM 74 CA ILE A 6 -1.823 0.516 10.678 1.00 0.22 C ATOM 75 C ILE A 6 -2.785 0.971 9.590 1.00 0.19 C ATOM 76 O ILE A 6 -2.409 1.138 8.435 1.00 0.17 O ATOM 77 CB ILE A 6 -0.556 1.422 10.716 1.00 0.23 C ATOM 78 CG1 ILE A 6 -0.920 2.902 10.520 1.00 0.26 C ATOM 79 CG2 ILE A 6 0.472 0.989 9.681 1.00 0.20 C ATOM 80 CD1 ILE A 6 -1.855 3.462 11.573 1.00 0.31 C ATOM 0 H ILE A 6 -0.847 -1.077 9.729 1.00 0.21 H new ATOM 0 HA ILE A 6 -2.299 0.618 11.653 1.00 0.22 H new ATOM 0 HB ILE A 6 -0.111 1.307 11.704 1.00 0.23 H new ATOM 0 HG12 ILE A 6 -0.003 3.491 10.515 1.00 0.26 H new ATOM 0 HG13 ILE A 6 -1.382 3.023 9.540 1.00 0.26 H new ATOM 0 HG21 ILE A 6 1.342 1.643 9.736 1.00 0.20 H new ATOM 0 HG22 ILE A 6 0.777 -0.038 9.879 1.00 0.20 H new ATOM 0 HG23 ILE A 6 0.034 1.051 8.685 1.00 0.20 H new ATOM 0 HD11 ILE A 6 -2.059 4.511 11.358 1.00 0.31 H new ATOM 0 HD12 ILE A 6 -2.790 2.901 11.565 1.00 0.31 H new ATOM 0 HD13 ILE A 6 -1.390 3.377 12.555 1.00 0.31 H new ATOM 92 N VAL A 7 -4.038 1.136 9.968 1.00 0.24 N ATOM 93 CA VAL A 7 -5.052 1.564 9.028 1.00 0.22 C ATOM 94 C VAL A 7 -4.904 3.046 8.727 1.00 0.23 C ATOM 95 O VAL A 7 -4.774 3.873 9.633 1.00 0.28 O ATOM 96 CB VAL A 7 -6.474 1.255 9.527 1.00 0.23 C ATOM 97 CG1 VAL A 7 -7.519 1.930 8.644 1.00 0.24 C ATOM 98 CG2 VAL A 7 -6.685 -0.250 9.558 1.00 0.23 C ATOM 0 H VAL A 7 -4.376 0.980 10.918 1.00 0.24 H new ATOM 0 HA VAL A 7 -4.902 0.997 8.109 1.00 0.22 H new ATOM 0 HB VAL A 7 -6.589 1.651 10.536 1.00 0.23 H new ATOM 0 HG11 VAL A 7 -8.516 1.697 9.017 1.00 0.24 H new ATOM 0 HG12 VAL A 7 -7.368 3.009 8.662 1.00 0.24 H new ATOM 0 HG13 VAL A 7 -7.420 1.567 7.621 1.00 0.24 H new ATOM 0 HG21 VAL A 7 -7.693 -0.469 9.912 1.00 0.23 H new ATOM 0 HG22 VAL A 7 -6.556 -0.656 8.555 1.00 0.23 H new ATOM 0 HG23 VAL A 7 -5.958 -0.706 10.230 1.00 0.23 H new ATOM 108 N ARG A 8 -4.925 3.369 7.448 1.00 0.22 N ATOM 109 CA ARG A 8 -4.846 4.717 6.966 1.00 0.25 C ATOM 110 C ARG A 8 -6.018 4.908 6.028 1.00 0.23 C ATOM 111 O ARG A 8 -6.097 4.249 4.990 1.00 0.26 O ATOM 112 CB ARG A 8 -3.525 4.962 6.206 1.00 0.26 C ATOM 113 CG ARG A 8 -3.624 5.983 5.060 1.00 0.27 C ATOM 114 CD ARG A 8 -4.130 7.333 5.544 1.00 0.31 C ATOM 115 NE ARG A 8 -3.312 7.873 6.627 1.00 1.12 N ATOM 116 CZ ARG A 8 -3.227 9.166 6.928 1.00 1.16 C ATOM 117 NH1 ARG A 8 -3.911 10.062 6.227 1.00 0.64 N ATOM 118 NH2 ARG A 8 -2.463 9.556 7.940 1.00 1.99 N ATOM 0 H ARG A 8 -5.000 2.676 6.703 1.00 0.22 H new ATOM 0 HA ARG A 8 -4.874 5.420 7.799 1.00 0.25 H new ATOM 0 HB2 ARG A 8 -2.771 5.304 6.915 1.00 0.26 H new ATOM 0 HB3 ARG A 8 -3.174 4.013 5.800 1.00 0.26 H new ATOM 0 HG2 ARG A 8 -2.644 6.107 4.599 1.00 0.27 H new ATOM 0 HG3 ARG A 8 -4.293 5.600 4.289 1.00 0.27 H new ATOM 0 HD2 ARG A 8 -4.137 8.036 4.711 1.00 0.31 H new ATOM 0 HD3 ARG A 8 -5.160 7.232 5.885 1.00 0.31 H new ATOM 0 HE ARG A 8 -2.771 7.216 7.189 1.00 1.12 H new ATOM 0 HH11 ARG A 8 -4.505 9.760 5.454 1.00 0.64 H new ATOM 0 HH12 ARG A 8 -3.843 11.052 6.461 1.00 0.64 H new ATOM 0 HH21 ARG A 8 -1.944 8.866 8.483 1.00 1.99 H new ATOM 0 HH22 ARG A 8 -2.394 10.546 8.175 1.00 1.99 H new ATOM 132 N ARG A 9 -6.936 5.766 6.391 1.00 0.19 N ATOM 133 CA ARG A 9 -8.017 6.080 5.495 1.00 0.18 C ATOM 134 C ARG A 9 -7.487 7.038 4.459 1.00 0.20 C ATOM 135 O ARG A 9 -7.348 8.222 4.750 1.00 0.22 O ATOM 136 CB ARG A 9 -9.167 6.702 6.266 1.00 0.19 C ATOM 137 CG ARG A 9 -10.477 6.708 5.519 1.00 0.28 C ATOM 138 CD ARG A 9 -11.596 6.251 6.431 1.00 0.62 C ATOM 139 NE ARG A 9 -11.635 7.033 7.670 1.00 1.45 N ATOM 140 CZ ARG A 9 -12.749 7.491 8.243 1.00 1.80 C ATOM 141 NH1 ARG A 9 -13.931 7.298 7.671 1.00 1.59 N ATOM 142 NH2 ARG A 9 -12.667 8.154 9.392 1.00 2.80 N ATOM 0 H ARG A 9 -6.958 6.253 7.287 1.00 0.19 H new ATOM 0 HA ARG A 9 -8.393 5.178 5.012 1.00 0.18 H new ATOM 0 HB2 ARG A 9 -9.298 6.160 7.203 1.00 0.19 H new ATOM 0 HB3 ARG A 9 -8.904 7.728 6.525 1.00 0.19 H new ATOM 0 HG2 ARG A 9 -10.688 7.710 5.146 1.00 0.28 H new ATOM 0 HG3 ARG A 9 -10.413 6.052 4.651 1.00 0.28 H new ATOM 0 HD2 ARG A 9 -12.550 6.343 5.912 1.00 0.62 H new ATOM 0 HD3 ARG A 9 -11.464 5.196 6.670 1.00 0.62 H new ATOM 0 HE ARG A 9 -10.747 7.242 8.127 1.00 1.45 H new ATOM 0 HH11 ARG A 9 -13.993 6.796 6.785 1.00 1.59 H new ATOM 0 HH12 ARG A 9 -14.777 7.652 8.117 1.00 1.59 H new ATOM 0 HH21 ARG A 9 -11.758 8.309 9.828 1.00 2.80 H new ATOM 0 HH22 ARG A 9 -13.513 8.508 9.838 1.00 2.80 H new ATOM 156 N ILE A 10 -7.196 6.482 3.271 1.00 0.21 N ATOM 157 CA ILE A 10 -6.575 7.193 2.134 1.00 0.24 C ATOM 158 C ILE A 10 -6.438 8.703 2.346 1.00 0.29 C ATOM 159 O ILE A 10 -5.546 9.142 3.083 1.00 0.33 O ATOM 160 CB ILE A 10 -7.316 6.893 0.799 1.00 0.22 C ATOM 161 CG1 ILE A 10 -8.799 6.552 1.038 1.00 0.21 C ATOM 162 CG2 ILE A 10 -6.617 5.756 0.085 1.00 0.21 C ATOM 163 CD1 ILE A 10 -9.515 7.539 1.920 1.00 0.22 C ATOM 0 H ILE A 10 -7.390 5.502 3.067 1.00 0.21 H new ATOM 0 HA ILE A 10 -5.560 6.800 2.071 1.00 0.24 H new ATOM 0 HB ILE A 10 -7.288 7.788 0.178 1.00 0.22 H new ATOM 0 HG12 ILE A 10 -9.310 6.501 0.076 1.00 0.21 H new ATOM 0 HG13 ILE A 10 -8.866 5.561 1.488 1.00 0.21 H new ATOM 0 HG21 ILE A 10 -7.133 5.542 -0.851 1.00 0.21 H new ATOM 0 HG22 ILE A 10 -5.585 6.038 -0.125 1.00 0.21 H new ATOM 0 HG23 ILE A 10 -6.629 4.868 0.717 1.00 0.21 H new ATOM 0 HD11 ILE A 10 -10.554 7.232 2.042 1.00 0.22 H new ATOM 0 HD12 ILE A 10 -9.030 7.574 2.896 1.00 0.22 H new ATOM 0 HD13 ILE A 10 -9.481 8.528 1.462 1.00 0.22 H new ATOM 175 N ASP A 11 -7.328 9.478 1.721 1.00 0.30 N ATOM 176 CA ASP A 11 -7.392 10.921 1.898 1.00 0.36 C ATOM 177 C ASP A 11 -8.233 11.496 0.787 1.00 0.36 C ATOM 178 O ASP A 11 -9.002 10.773 0.179 1.00 0.36 O ATOM 179 CB ASP A 11 -6.004 11.587 1.908 1.00 0.37 C ATOM 180 CG ASP A 11 -5.349 11.685 0.542 1.00 0.34 C ATOM 181 OD1 ASP A 11 -4.927 10.656 -0.019 1.00 1.12 O ATOM 182 OD2 ASP A 11 -5.253 12.813 0.025 1.00 1.13 O ATOM 0 H ASP A 11 -8.027 9.114 1.074 1.00 0.30 H new ATOM 0 HA ASP A 11 -7.835 11.124 2.873 1.00 0.36 H new ATOM 0 HB2 ASP A 11 -6.098 12.589 2.326 1.00 0.37 H new ATOM 0 HB3 ASP A 11 -5.349 11.024 2.573 1.00 0.37 H new ATOM 187 N ASP A 12 -8.079 12.780 0.520 1.00 0.41 N ATOM 188 CA ASP A 12 -8.853 13.444 -0.521 1.00 0.43 C ATOM 189 C ASP A 12 -8.345 13.057 -1.912 1.00 0.37 C ATOM 190 O ASP A 12 -9.041 13.233 -2.914 1.00 0.50 O ATOM 191 CB ASP A 12 -8.798 14.962 -0.336 1.00 0.54 C ATOM 192 CG ASP A 12 -9.562 15.711 -1.410 1.00 1.38 C ATOM 193 OD1 ASP A 12 -10.779 15.471 -1.565 1.00 1.98 O ATOM 194 OD2 ASP A 12 -8.951 16.556 -2.100 1.00 2.26 O ATOM 0 H ASP A 12 -7.423 13.389 1.010 1.00 0.41 H new ATOM 0 HA ASP A 12 -9.889 13.117 -0.436 1.00 0.43 H new ATOM 0 HB2 ASP A 12 -9.206 15.220 0.641 1.00 0.54 H new ATOM 0 HB3 ASP A 12 -7.758 15.287 -0.342 1.00 0.54 H new ATOM 199 N LEU A 13 -7.131 12.528 -1.965 1.00 0.32 N ATOM 200 CA LEU A 13 -6.533 12.113 -3.224 1.00 0.29 C ATOM 201 C LEU A 13 -6.585 10.588 -3.375 1.00 0.24 C ATOM 202 O LEU A 13 -7.163 10.080 -4.336 1.00 0.26 O ATOM 203 CB LEU A 13 -5.090 12.634 -3.311 1.00 0.32 C ATOM 204 CG LEU A 13 -4.431 12.597 -4.696 1.00 0.40 C ATOM 205 CD1 LEU A 13 -4.032 11.183 -5.082 1.00 0.36 C ATOM 206 CD2 LEU A 13 -5.360 13.194 -5.742 1.00 0.53 C ATOM 0 H LEU A 13 -6.540 12.376 -1.148 1.00 0.32 H new ATOM 0 HA LEU A 13 -7.105 12.542 -4.047 1.00 0.29 H new ATOM 0 HB2 LEU A 13 -5.077 13.664 -2.955 1.00 0.32 H new ATOM 0 HB3 LEU A 13 -4.475 12.052 -2.625 1.00 0.32 H new ATOM 0 HG LEU A 13 -3.523 13.198 -4.650 1.00 0.40 H new ATOM 0 HD11 LEU A 13 -3.568 11.192 -6.068 1.00 0.36 H new ATOM 0 HD12 LEU A 13 -3.323 10.793 -4.351 1.00 0.36 H new ATOM 0 HD13 LEU A 13 -4.918 10.548 -5.104 1.00 0.36 H new ATOM 0 HD21 LEU A 13 -4.878 13.160 -6.719 1.00 0.53 H new ATOM 0 HD22 LEU A 13 -6.287 12.621 -5.775 1.00 0.53 H new ATOM 0 HD23 LEU A 13 -5.582 14.229 -5.483 1.00 0.53 H new ATOM 218 N GLY A 14 -5.976 9.862 -2.439 1.00 0.21 N ATOM 219 CA GLY A 14 -5.967 8.415 -2.529 1.00 0.19 C ATOM 220 C GLY A 14 -4.627 7.801 -2.164 1.00 0.19 C ATOM 221 O GLY A 14 -4.357 6.656 -2.510 1.00 0.22 O ATOM 0 H GLY A 14 -5.493 10.248 -1.628 1.00 0.21 H new ATOM 0 HA2 GLY A 14 -6.736 8.012 -1.870 1.00 0.19 H new ATOM 0 HA3 GLY A 14 -6.230 8.119 -3.544 1.00 0.19 H new ATOM 225 N ARG A 15 -3.773 8.540 -1.464 1.00 0.19 N ATOM 226 CA ARG A 15 -2.512 7.964 -1.017 1.00 0.20 C ATOM 227 C ARG A 15 -2.728 7.159 0.219 1.00 0.17 C ATOM 228 O ARG A 15 -3.679 7.371 0.970 1.00 0.17 O ATOM 229 CB ARG A 15 -1.437 8.991 -0.665 1.00 0.25 C ATOM 230 CG ARG A 15 -1.229 10.105 -1.652 1.00 0.25 C ATOM 231 CD ARG A 15 -2.069 11.290 -1.266 1.00 0.29 C ATOM 232 NE ARG A 15 -1.536 12.528 -1.841 1.00 0.40 N ATOM 233 CZ ARG A 15 -1.981 13.755 -1.569 1.00 0.54 C ATOM 234 NH1 ARG A 15 -3.059 13.943 -0.823 1.00 0.67 N ATOM 235 NH2 ARG A 15 -1.349 14.802 -2.078 1.00 0.69 N ATOM 0 H ARG A 15 -3.925 9.513 -1.200 1.00 0.19 H new ATOM 0 HA ARG A 15 -2.167 7.371 -1.864 1.00 0.20 H new ATOM 0 HB2 ARG A 15 -1.688 9.432 0.300 1.00 0.25 H new ATOM 0 HB3 ARG A 15 -0.491 8.465 -0.539 1.00 0.25 H new ATOM 0 HG2 ARG A 15 -0.177 10.387 -1.679 1.00 0.25 H new ATOM 0 HG3 ARG A 15 -1.495 9.770 -2.654 1.00 0.25 H new ATOM 0 HD2 ARG A 15 -3.093 11.139 -1.607 1.00 0.29 H new ATOM 0 HD3 ARG A 15 -2.104 11.376 -0.180 1.00 0.29 H new ATOM 0 HE ARG A 15 -0.763 12.444 -2.502 1.00 0.40 H new ATOM 0 HH11 ARG A 15 -3.564 13.141 -0.446 1.00 0.67 H new ATOM 0 HH12 ARG A 15 -3.384 14.890 -0.626 1.00 0.67 H new ATOM 0 HH21 ARG A 15 -0.531 14.665 -2.671 1.00 0.69 H new ATOM 0 HH22 ARG A 15 -1.681 15.745 -1.877 1.00 0.69 H new ATOM 249 N VAL A 16 -1.823 6.252 0.443 1.00 0.18 N ATOM 250 CA VAL A 16 -1.728 5.650 1.720 1.00 0.20 C ATOM 251 C VAL A 16 -0.484 6.191 2.368 1.00 0.19 C ATOM 252 O VAL A 16 0.637 5.968 1.908 1.00 0.21 O ATOM 253 CB VAL A 16 -1.743 4.114 1.677 1.00 0.29 C ATOM 254 CG1 VAL A 16 -2.973 3.613 0.939 1.00 1.11 C ATOM 255 CG2 VAL A 16 -0.475 3.535 1.080 1.00 1.24 C ATOM 0 H VAL A 16 -1.147 5.921 -0.245 1.00 0.18 H new ATOM 0 HA VAL A 16 -2.611 5.902 2.307 1.00 0.20 H new ATOM 0 HB VAL A 16 -1.787 3.765 2.709 1.00 0.29 H new ATOM 0 HG11 VAL A 16 -2.966 2.523 0.919 1.00 1.11 H new ATOM 0 HG12 VAL A 16 -3.871 3.961 1.450 1.00 1.11 H new ATOM 0 HG13 VAL A 16 -2.966 3.995 -0.082 1.00 1.11 H new ATOM 0 HG21 VAL A 16 -0.539 2.447 1.074 1.00 1.24 H new ATOM 0 HG22 VAL A 16 -0.355 3.897 0.059 1.00 1.24 H new ATOM 0 HG23 VAL A 16 0.383 3.844 1.677 1.00 1.24 H new ATOM 265 N VAL A 17 -0.690 7.004 3.371 1.00 0.20 N ATOM 266 CA VAL A 17 0.412 7.658 4.012 1.00 0.21 C ATOM 267 C VAL A 17 1.193 6.645 4.819 1.00 0.21 C ATOM 268 O VAL A 17 0.817 6.317 5.943 1.00 0.26 O ATOM 269 CB VAL A 17 -0.050 8.821 4.908 1.00 0.25 C ATOM 270 CG1 VAL A 17 1.149 9.497 5.558 1.00 0.28 C ATOM 271 CG2 VAL A 17 -0.872 9.816 4.095 1.00 0.27 C ATOM 0 H VAL A 17 -1.607 7.226 3.758 1.00 0.20 H new ATOM 0 HA VAL A 17 1.051 8.086 3.240 1.00 0.21 H new ATOM 0 HB VAL A 17 -0.684 8.427 5.703 1.00 0.25 H new ATOM 0 HG11 VAL A 17 0.806 10.317 6.189 1.00 0.28 H new ATOM 0 HG12 VAL A 17 1.689 8.772 6.167 1.00 0.28 H new ATOM 0 HG13 VAL A 17 1.811 9.886 4.784 1.00 0.28 H new ATOM 0 HG21 VAL A 17 -1.194 10.634 4.739 1.00 0.27 H new ATOM 0 HG22 VAL A 17 -0.264 10.212 3.282 1.00 0.27 H new ATOM 0 HG23 VAL A 17 -1.747 9.314 3.682 1.00 0.27 H new ATOM 281 N ILE A 18 2.237 6.106 4.206 1.00 0.20 N ATOM 282 CA ILE A 18 3.085 5.139 4.862 1.00 0.22 C ATOM 283 C ILE A 18 4.108 5.843 5.736 1.00 0.20 C ATOM 284 O ILE A 18 5.003 6.530 5.242 1.00 0.21 O ATOM 285 CB ILE A 18 3.794 4.191 3.860 1.00 0.26 C ATOM 286 CG1 ILE A 18 2.805 3.141 3.353 1.00 0.42 C ATOM 287 CG2 ILE A 18 5.007 3.525 4.505 1.00 0.25 C ATOM 288 CD1 ILE A 18 3.447 2.051 2.523 1.00 0.77 C ATOM 0 H ILE A 18 2.513 6.328 3.249 1.00 0.20 H new ATOM 0 HA ILE A 18 2.440 4.519 5.485 1.00 0.22 H new ATOM 0 HB ILE A 18 4.149 4.779 3.014 1.00 0.26 H new ATOM 0 HG12 ILE A 18 2.302 2.687 4.207 1.00 0.42 H new ATOM 0 HG13 ILE A 18 2.038 3.635 2.757 1.00 0.42 H new ATOM 0 HG21 ILE A 18 5.487 2.865 3.782 1.00 0.25 H new ATOM 0 HG22 ILE A 18 5.715 4.290 4.824 1.00 0.25 H new ATOM 0 HG23 ILE A 18 4.686 2.944 5.370 1.00 0.25 H new ATOM 0 HD11 ILE A 18 2.684 1.343 2.199 1.00 0.77 H new ATOM 0 HD12 ILE A 18 3.926 2.493 1.650 1.00 0.77 H new ATOM 0 HD13 ILE A 18 4.194 1.530 3.122 1.00 0.77 H new ATOM 300 N PRO A 19 3.945 5.721 7.055 1.00 0.23 N ATOM 301 CA PRO A 19 4.895 6.244 8.023 1.00 0.26 C ATOM 302 C PRO A 19 6.316 5.806 7.731 1.00 0.24 C ATOM 303 O PRO A 19 6.556 4.728 7.176 1.00 0.23 O ATOM 304 CB PRO A 19 4.414 5.636 9.328 1.00 0.29 C ATOM 305 CG PRO A 19 2.955 5.508 9.141 1.00 0.32 C ATOM 306 CD PRO A 19 2.794 5.081 7.717 1.00 0.29 C ATOM 0 HA PRO A 19 4.929 7.333 8.022 1.00 0.26 H new ATOM 0 HB2 PRO A 19 4.880 4.668 9.514 1.00 0.29 H new ATOM 0 HB3 PRO A 19 4.654 6.274 10.179 1.00 0.29 H new ATOM 0 HG2 PRO A 19 2.530 4.774 9.826 1.00 0.32 H new ATOM 0 HG3 PRO A 19 2.446 6.453 9.332 1.00 0.32 H new ATOM 0 HD2 PRO A 19 2.819 3.996 7.614 1.00 0.29 H new ATOM 0 HD3 PRO A 19 1.846 5.419 7.298 1.00 0.29 H new ATOM 314 N LYS A 20 7.258 6.631 8.131 1.00 0.27 N ATOM 315 CA LYS A 20 8.651 6.365 7.854 1.00 0.28 C ATOM 316 C LYS A 20 9.120 5.082 8.512 1.00 0.25 C ATOM 317 O LYS A 20 10.048 4.479 8.032 1.00 0.26 O ATOM 318 CB LYS A 20 9.551 7.515 8.291 1.00 0.35 C ATOM 319 CG LYS A 20 9.300 7.987 9.713 1.00 0.40 C ATOM 320 CD LYS A 20 8.167 8.996 9.771 1.00 0.55 C ATOM 321 CE LYS A 20 8.600 10.340 9.203 1.00 0.77 C ATOM 322 NZ LYS A 20 7.556 11.387 9.362 1.00 1.57 N ATOM 0 H LYS A 20 7.084 7.492 8.649 1.00 0.27 H new ATOM 0 HA LYS A 20 8.727 6.255 6.772 1.00 0.28 H new ATOM 0 HB2 LYS A 20 10.592 7.204 8.200 1.00 0.35 H new ATOM 0 HB3 LYS A 20 9.409 8.354 7.610 1.00 0.35 H new ATOM 0 HG2 LYS A 20 9.060 7.132 10.345 1.00 0.40 H new ATOM 0 HG3 LYS A 20 10.209 8.435 10.115 1.00 0.40 H new ATOM 0 HD2 LYS A 20 7.312 8.619 9.210 1.00 0.55 H new ATOM 0 HD3 LYS A 20 7.841 9.122 10.803 1.00 0.55 H new ATOM 0 HE2 LYS A 20 9.514 10.664 9.701 1.00 0.77 H new ATOM 0 HE3 LYS A 20 8.837 10.225 8.145 1.00 0.77 H new ATOM 0 HZ1 LYS A 20 7.899 12.283 8.960 1.00 1.57 H new ATOM 0 HZ2 LYS A 20 6.691 11.093 8.865 1.00 1.57 H new ATOM 0 HZ3 LYS A 20 7.347 11.519 10.372 1.00 1.57 H new ATOM 336 N GLU A 21 8.470 4.660 9.597 1.00 0.24 N ATOM 337 CA GLU A 21 8.876 3.447 10.318 1.00 0.24 C ATOM 338 C GLU A 21 8.929 2.206 9.415 1.00 0.22 C ATOM 339 O GLU A 21 9.719 1.284 9.660 1.00 0.23 O ATOM 340 CB GLU A 21 7.959 3.181 11.521 1.00 0.27 C ATOM 341 CG GLU A 21 6.510 3.548 11.291 1.00 0.35 C ATOM 342 CD GLU A 21 6.175 4.929 11.818 1.00 0.73 C ATOM 343 OE1 GLU A 21 6.739 5.918 11.303 1.00 1.32 O ATOM 344 OE2 GLU A 21 5.337 5.035 12.733 1.00 1.30 O ATOM 0 H GLU A 21 7.662 5.137 9.997 1.00 0.24 H new ATOM 0 HA GLU A 21 9.889 3.634 10.675 1.00 0.24 H new ATOM 0 HB2 GLU A 21 8.017 2.124 11.781 1.00 0.27 H new ATOM 0 HB3 GLU A 21 8.332 3.741 12.378 1.00 0.27 H new ATOM 0 HG2 GLU A 21 6.292 3.506 10.224 1.00 0.35 H new ATOM 0 HG3 GLU A 21 5.870 2.811 11.776 1.00 0.35 H new ATOM 351 N ILE A 22 8.159 2.199 8.332 1.00 0.23 N ATOM 352 CA ILE A 22 8.112 1.021 7.481 1.00 0.25 C ATOM 353 C ILE A 22 9.223 1.132 6.444 1.00 0.24 C ATOM 354 O ILE A 22 10.002 0.205 6.246 1.00 0.25 O ATOM 355 CB ILE A 22 6.742 0.843 6.784 1.00 0.29 C ATOM 356 CG1 ILE A 22 5.619 0.796 7.825 1.00 0.27 C ATOM 357 CG2 ILE A 22 6.728 -0.427 5.942 1.00 0.35 C ATOM 358 CD1 ILE A 22 4.985 2.140 8.111 1.00 0.25 C ATOM 0 H ILE A 22 7.573 2.977 8.029 1.00 0.23 H new ATOM 0 HA ILE A 22 8.254 0.140 8.107 1.00 0.25 H new ATOM 0 HB ILE A 22 6.579 1.697 6.126 1.00 0.29 H new ATOM 0 HG12 ILE A 22 4.847 0.108 7.480 1.00 0.27 H new ATOM 0 HG13 ILE A 22 6.017 0.389 8.755 1.00 0.27 H new ATOM 0 HG21 ILE A 22 5.756 -0.534 5.460 1.00 0.35 H new ATOM 0 HG22 ILE A 22 7.506 -0.367 5.181 1.00 0.35 H new ATOM 0 HG23 ILE A 22 6.912 -1.290 6.582 1.00 0.35 H new ATOM 0 HD11 ILE A 22 4.200 2.020 8.858 1.00 0.25 H new ATOM 0 HD12 ILE A 22 5.743 2.827 8.488 1.00 0.25 H new ATOM 0 HD13 ILE A 22 4.555 2.542 7.194 1.00 0.25 H new ATOM 370 N ARG A 23 9.312 2.312 5.834 1.00 0.23 N ATOM 371 CA ARG A 23 10.381 2.647 4.892 1.00 0.22 C ATOM 372 C ARG A 23 11.729 2.569 5.600 1.00 0.23 C ATOM 373 O ARG A 23 12.757 2.251 5.004 1.00 0.24 O ATOM 374 CB ARG A 23 10.090 4.042 4.302 1.00 0.24 C ATOM 375 CG ARG A 23 11.292 4.953 4.081 1.00 0.48 C ATOM 376 CD ARG A 23 11.676 5.702 5.346 1.00 0.39 C ATOM 377 NE ARG A 23 12.071 7.087 5.081 1.00 0.82 N ATOM 378 CZ ARG A 23 13.124 7.683 5.639 1.00 0.96 C ATOM 379 NH1 ARG A 23 13.919 7.007 6.458 1.00 1.34 N ATOM 380 NH2 ARG A 23 13.378 8.957 5.375 1.00 1.50 N ATOM 0 H ARG A 23 8.642 3.067 5.979 1.00 0.23 H new ATOM 0 HA ARG A 23 10.421 1.936 4.066 1.00 0.22 H new ATOM 0 HB2 ARG A 23 9.583 3.909 3.346 1.00 0.24 H new ATOM 0 HB3 ARG A 23 9.392 4.554 4.965 1.00 0.24 H new ATOM 0 HG2 ARG A 23 12.140 4.359 3.739 1.00 0.48 H new ATOM 0 HG3 ARG A 23 11.065 5.668 3.290 1.00 0.48 H new ATOM 0 HD2 ARG A 23 10.834 5.694 6.038 1.00 0.39 H new ATOM 0 HD3 ARG A 23 12.498 5.181 5.837 1.00 0.39 H new ATOM 0 HE ARG A 23 11.505 7.629 4.429 1.00 0.82 H new ATOM 0 HH11 ARG A 23 13.725 6.027 6.663 1.00 1.34 H new ATOM 0 HH12 ARG A 23 14.724 7.467 6.883 1.00 1.34 H new ATOM 0 HH21 ARG A 23 12.768 9.479 4.746 1.00 1.50 H new ATOM 0 HH22 ARG A 23 14.183 9.415 5.801 1.00 1.50 H new ATOM 394 N ARG A 24 11.685 2.865 6.879 1.00 0.24 N ATOM 395 CA ARG A 24 12.821 2.769 7.773 1.00 0.27 C ATOM 396 C ARG A 24 13.292 1.330 7.903 1.00 0.29 C ATOM 397 O ARG A 24 14.472 1.046 7.706 1.00 0.32 O ATOM 398 CB ARG A 24 12.423 3.332 9.133 1.00 0.31 C ATOM 399 CG ARG A 24 13.470 3.223 10.216 1.00 0.39 C ATOM 400 CD ARG A 24 12.942 3.815 11.512 1.00 0.45 C ATOM 401 NE ARG A 24 13.924 3.767 12.592 1.00 1.39 N ATOM 402 CZ ARG A 24 13.648 4.068 13.863 1.00 1.90 C ATOM 403 NH1 ARG A 24 12.432 4.491 14.201 1.00 1.52 N ATOM 404 NH2 ARG A 24 14.592 3.968 14.789 1.00 2.96 N ATOM 0 H ARG A 24 10.835 3.188 7.341 1.00 0.24 H new ATOM 0 HA ARG A 24 13.651 3.346 7.366 1.00 0.27 H new ATOM 0 HB2 ARG A 24 12.162 4.383 9.009 1.00 0.31 H new ATOM 0 HB3 ARG A 24 11.523 2.818 9.470 1.00 0.31 H new ATOM 0 HG2 ARG A 24 13.740 2.178 10.368 1.00 0.39 H new ATOM 0 HG3 ARG A 24 14.376 3.746 9.911 1.00 0.39 H new ATOM 0 HD2 ARG A 24 12.646 4.850 11.340 1.00 0.45 H new ATOM 0 HD3 ARG A 24 12.046 3.274 11.816 1.00 0.45 H new ATOM 0 HE ARG A 24 14.877 3.487 12.361 1.00 1.39 H new ATOM 0 HH11 ARG A 24 11.709 4.586 13.488 1.00 1.52 H new ATOM 0 HH12 ARG A 24 12.224 4.720 15.173 1.00 1.52 H new ATOM 0 HH21 ARG A 24 15.530 3.661 14.530 1.00 2.96 H new ATOM 0 HH22 ARG A 24 14.380 4.198 15.760 1.00 2.96 H new ATOM 418 N THR A 25 12.377 0.410 8.222 1.00 0.29 N ATOM 419 CA THR A 25 12.714 -1.005 8.271 1.00 0.31 C ATOM 420 C THR A 25 13.103 -1.513 6.880 1.00 0.30 C ATOM 421 O THR A 25 13.894 -2.450 6.741 1.00 0.33 O ATOM 422 CB THR A 25 11.514 -1.816 8.806 1.00 0.34 C ATOM 423 OG1 THR A 25 11.056 -1.235 10.034 1.00 0.36 O ATOM 424 CG2 THR A 25 11.887 -3.272 9.047 1.00 0.40 C ATOM 0 H THR A 25 11.405 0.623 8.448 1.00 0.29 H new ATOM 0 HA THR A 25 13.564 -1.135 8.942 1.00 0.31 H new ATOM 0 HB THR A 25 10.724 -1.787 8.055 1.00 0.34 H new ATOM 0 HG1 THR A 25 10.543 -0.423 9.840 1.00 0.36 H new ATOM 0 HG21 THR A 25 11.018 -3.813 9.423 1.00 0.40 H new ATOM 0 HG22 THR A 25 12.218 -3.723 8.111 1.00 0.40 H new ATOM 0 HG23 THR A 25 12.692 -3.325 9.779 1.00 0.40 H new ATOM 432 N LEU A 26 12.550 -0.867 5.859 1.00 0.27 N ATOM 433 CA LEU A 26 12.886 -1.150 4.467 1.00 0.28 C ATOM 434 C LEU A 26 14.343 -0.793 4.167 1.00 0.31 C ATOM 435 O LEU A 26 14.908 -1.274 3.185 1.00 0.36 O ATOM 436 CB LEU A 26 11.958 -0.354 3.536 1.00 0.25 C ATOM 437 CG LEU A 26 10.882 -1.169 2.813 1.00 0.26 C ATOM 438 CD1 LEU A 26 11.506 -2.354 2.097 1.00 0.32 C ATOM 439 CD2 LEU A 26 9.806 -1.633 3.783 1.00 0.26 C ATOM 0 H LEU A 26 11.854 -0.130 5.973 1.00 0.27 H new ATOM 0 HA LEU A 26 12.752 -2.218 4.296 1.00 0.28 H new ATOM 0 HB2 LEU A 26 11.467 0.423 4.121 1.00 0.25 H new ATOM 0 HB3 LEU A 26 12.570 0.150 2.788 1.00 0.25 H new ATOM 0 HG LEU A 26 10.410 -0.526 2.071 1.00 0.26 H new ATOM 0 HD11 LEU A 26 10.728 -2.923 1.588 1.00 0.32 H new ATOM 0 HD12 LEU A 26 12.231 -1.997 1.366 1.00 0.32 H new ATOM 0 HD13 LEU A 26 12.008 -2.994 2.822 1.00 0.32 H new ATOM 0 HD21 LEU A 26 9.054 -2.209 3.244 1.00 0.26 H new ATOM 0 HD22 LEU A 26 10.257 -2.257 4.555 1.00 0.26 H new ATOM 0 HD23 LEU A 26 9.335 -0.766 4.246 1.00 0.26 H new ATOM 451 N ARG A 27 14.941 0.032 5.038 1.00 0.32 N ATOM 452 CA ARG A 27 16.288 0.574 4.837 1.00 0.40 C ATOM 453 C ARG A 27 16.290 1.594 3.706 1.00 0.39 C ATOM 454 O ARG A 27 17.336 1.913 3.135 1.00 0.46 O ATOM 455 CB ARG A 27 17.303 -0.532 4.546 1.00 0.51 C ATOM 456 CG ARG A 27 17.989 -1.102 5.778 1.00 0.78 C ATOM 457 CD ARG A 27 17.015 -1.832 6.685 1.00 0.90 C ATOM 458 NE ARG A 27 17.695 -2.456 7.815 1.00 1.76 N ATOM 459 CZ ARG A 27 17.096 -3.255 8.694 1.00 2.28 C ATOM 460 NH1 ARG A 27 15.797 -3.518 8.582 1.00 2.36 N ATOM 461 NH2 ARG A 27 17.795 -3.792 9.683 1.00 3.20 N ATOM 0 H ARG A 27 14.501 0.342 5.904 1.00 0.32 H new ATOM 0 HA ARG A 27 16.583 1.067 5.763 1.00 0.40 H new ATOM 0 HB2 ARG A 27 16.797 -1.342 4.020 1.00 0.51 H new ATOM 0 HB3 ARG A 27 18.064 -0.140 3.871 1.00 0.51 H new ATOM 0 HG2 ARG A 27 18.779 -1.786 5.469 1.00 0.78 H new ATOM 0 HG3 ARG A 27 18.466 -0.295 6.333 1.00 0.78 H new ATOM 0 HD2 ARG A 27 16.265 -1.132 7.053 1.00 0.90 H new ATOM 0 HD3 ARG A 27 16.486 -2.594 6.113 1.00 0.90 H new ATOM 0 HE ARG A 27 18.690 -2.268 7.939 1.00 1.76 H new ATOM 0 HH11 ARG A 27 15.257 -3.107 7.821 1.00 2.36 H new ATOM 0 HH12 ARG A 27 15.341 -4.131 9.258 1.00 2.36 H new ATOM 0 HH21 ARG A 27 18.792 -3.593 9.770 1.00 3.20 H new ATOM 0 HH22 ARG A 27 17.337 -4.405 10.357 1.00 3.20 H new ATOM 475 N ILE A 28 15.115 2.118 3.404 1.00 0.33 N ATOM 476 CA ILE A 28 14.957 3.045 2.301 1.00 0.33 C ATOM 477 C ILE A 28 14.510 4.406 2.839 1.00 0.31 C ATOM 478 O ILE A 28 14.593 4.657 4.043 1.00 0.34 O ATOM 479 CB ILE A 28 13.956 2.479 1.263 1.00 0.36 C ATOM 480 CG1 ILE A 28 14.097 0.954 1.205 1.00 0.44 C ATOM 481 CG2 ILE A 28 14.236 3.052 -0.126 1.00 0.38 C ATOM 482 CD1 ILE A 28 13.190 0.280 0.205 1.00 0.48 C ATOM 0 H ILE A 28 14.253 1.915 3.911 1.00 0.33 H new ATOM 0 HA ILE A 28 15.911 3.178 1.792 1.00 0.33 H new ATOM 0 HB ILE A 28 12.947 2.758 1.566 1.00 0.36 H new ATOM 0 HG12 ILE A 28 15.131 0.706 0.964 1.00 0.44 H new ATOM 0 HG13 ILE A 28 13.894 0.545 2.195 1.00 0.44 H new ATOM 0 HG21 ILE A 28 13.522 2.641 -0.840 1.00 0.38 H new ATOM 0 HG22 ILE A 28 14.138 4.137 -0.098 1.00 0.38 H new ATOM 0 HG23 ILE A 28 15.248 2.786 -0.432 1.00 0.38 H new ATOM 0 HD11 ILE A 28 13.356 -0.797 0.231 1.00 0.48 H new ATOM 0 HD12 ILE A 28 12.151 0.493 0.455 1.00 0.48 H new ATOM 0 HD13 ILE A 28 13.407 0.657 -0.795 1.00 0.48 H new ATOM 494 N ARG A 29 14.050 5.275 1.957 1.00 0.32 N ATOM 495 CA ARG A 29 13.727 6.649 2.315 1.00 0.32 C ATOM 496 C ARG A 29 12.691 7.222 1.363 1.00 0.30 C ATOM 497 O ARG A 29 11.941 6.473 0.737 1.00 0.28 O ATOM 498 CB ARG A 29 15.001 7.512 2.328 1.00 0.40 C ATOM 499 CG ARG A 29 16.015 7.178 1.237 1.00 0.58 C ATOM 500 CD ARG A 29 15.395 7.185 -0.150 1.00 0.64 C ATOM 501 NE ARG A 29 16.411 7.171 -1.206 1.00 0.92 N ATOM 502 CZ ARG A 29 16.496 6.252 -2.170 1.00 1.58 C ATOM 503 NH1 ARG A 29 15.679 5.207 -2.185 1.00 2.40 N ATOM 504 NH2 ARG A 29 17.425 6.368 -3.108 1.00 1.98 N ATOM 0 H ARG A 29 13.889 5.052 0.975 1.00 0.32 H new ATOM 0 HA ARG A 29 13.300 6.655 3.318 1.00 0.32 H new ATOM 0 HB2 ARG A 29 14.714 8.559 2.229 1.00 0.40 H new ATOM 0 HB3 ARG A 29 15.485 7.405 3.299 1.00 0.40 H new ATOM 0 HG2 ARG A 29 16.832 7.899 1.271 1.00 0.58 H new ATOM 0 HG3 ARG A 29 16.447 6.197 1.434 1.00 0.58 H new ATOM 0 HD2 ARG A 29 14.745 6.317 -0.261 1.00 0.64 H new ATOM 0 HD3 ARG A 29 14.768 8.069 -0.262 1.00 0.64 H new ATOM 0 HE ARG A 29 17.104 7.919 -1.204 1.00 0.92 H new ATOM 0 HH11 ARG A 29 14.976 5.099 -1.454 1.00 2.40 H new ATOM 0 HH12 ARG A 29 15.754 4.512 -2.927 1.00 2.40 H new ATOM 0 HH21 ARG A 29 18.071 7.157 -3.091 1.00 1.98 H new ATOM 0 HH22 ARG A 29 17.494 5.668 -3.847 1.00 1.98 H new ATOM 518 N GLU A 30 12.670 8.548 1.237 1.00 0.34 N ATOM 519 CA GLU A 30 11.727 9.232 0.355 1.00 0.36 C ATOM 520 C GLU A 30 12.129 9.087 -1.106 1.00 0.35 C ATOM 521 O GLU A 30 12.093 10.034 -1.892 1.00 0.44 O ATOM 522 CB GLU A 30 11.609 10.696 0.742 1.00 0.45 C ATOM 523 CG GLU A 30 10.686 10.895 1.921 1.00 0.50 C ATOM 524 CD GLU A 30 11.282 10.414 3.232 1.00 0.62 C ATOM 525 OE1 GLU A 30 12.003 11.197 3.885 1.00 1.23 O ATOM 526 OE2 GLU A 30 11.053 9.248 3.615 1.00 1.08 O ATOM 0 H GLU A 30 13.300 9.173 1.739 1.00 0.34 H new ATOM 0 HA GLU A 30 10.751 8.762 0.474 1.00 0.36 H new ATOM 0 HB2 GLU A 30 12.597 11.088 0.984 1.00 0.45 H new ATOM 0 HB3 GLU A 30 11.239 11.268 -0.109 1.00 0.45 H new ATOM 0 HG2 GLU A 30 10.440 11.953 2.007 1.00 0.50 H new ATOM 0 HG3 GLU A 30 9.752 10.364 1.737 1.00 0.50 H new ATOM 533 N GLY A 31 12.499 7.863 -1.439 1.00 0.30 N ATOM 534 CA GLY A 31 12.833 7.487 -2.789 1.00 0.30 C ATOM 535 C GLY A 31 12.612 5.999 -3.002 1.00 0.30 C ATOM 536 O GLY A 31 13.161 5.406 -3.929 1.00 0.36 O ATOM 0 H GLY A 31 12.575 7.099 -0.768 1.00 0.30 H new ATOM 0 HA2 GLY A 31 12.223 8.055 -3.491 1.00 0.30 H new ATOM 0 HA3 GLY A 31 13.873 7.738 -2.995 1.00 0.30 H new ATOM 540 N ASP A 32 11.803 5.401 -2.126 1.00 0.28 N ATOM 541 CA ASP A 32 11.441 3.987 -2.238 1.00 0.31 C ATOM 542 C ASP A 32 10.346 3.817 -3.279 1.00 0.28 C ATOM 543 O ASP A 32 9.265 4.398 -3.175 1.00 0.31 O ATOM 544 CB ASP A 32 10.973 3.438 -0.887 1.00 0.38 C ATOM 545 CG ASP A 32 10.506 1.993 -0.953 1.00 0.43 C ATOM 546 OD1 ASP A 32 11.073 1.214 -1.746 1.00 1.07 O ATOM 547 OD2 ASP A 32 9.584 1.640 -0.196 1.00 1.26 O ATOM 0 H ASP A 32 11.384 5.877 -1.327 1.00 0.28 H new ATOM 0 HA ASP A 32 12.322 3.426 -2.548 1.00 0.31 H new ATOM 0 HB2 ASP A 32 11.789 3.516 -0.169 1.00 0.38 H new ATOM 0 HB3 ASP A 32 10.159 4.059 -0.513 1.00 0.38 H new ATOM 552 N PRO A 33 10.639 3.036 -4.308 1.00 0.23 N ATOM 553 CA PRO A 33 9.768 2.846 -5.454 1.00 0.26 C ATOM 554 C PRO A 33 8.777 1.717 -5.297 1.00 0.47 C ATOM 555 O PRO A 33 8.731 0.843 -6.138 1.00 1.30 O ATOM 556 CB PRO A 33 10.727 2.435 -6.567 1.00 0.22 C ATOM 557 CG PRO A 33 12.082 2.276 -5.933 1.00 0.14 C ATOM 558 CD PRO A 33 11.867 2.272 -4.446 1.00 0.23 C ATOM 0 HA PRO A 33 9.184 3.751 -5.621 1.00 0.26 H new ATOM 0 HB2 PRO A 33 10.405 1.503 -7.031 1.00 0.22 H new ATOM 0 HB3 PRO A 33 10.754 3.190 -7.353 1.00 0.22 H new ATOM 0 HG2 PRO A 33 12.555 1.349 -6.258 1.00 0.14 H new ATOM 0 HG3 PRO A 33 12.744 3.091 -6.226 1.00 0.14 H new ATOM 0 HD2 PRO A 33 11.763 1.261 -4.053 1.00 0.23 H new ATOM 0 HD3 PRO A 33 12.697 2.737 -3.914 1.00 0.23 H new ATOM 566 N LEU A 34 7.964 1.723 -4.282 1.00 0.29 N ATOM 567 CA LEU A 34 7.120 0.574 -4.060 1.00 0.21 C ATOM 568 C LEU A 34 6.197 0.290 -5.251 1.00 0.22 C ATOM 569 O LEU A 34 5.809 1.174 -5.998 1.00 0.27 O ATOM 570 CB LEU A 34 6.282 0.702 -2.783 1.00 0.23 C ATOM 571 CG LEU A 34 6.816 1.642 -1.700 1.00 0.31 C ATOM 572 CD1 LEU A 34 6.343 3.069 -1.943 1.00 0.38 C ATOM 573 CD2 LEU A 34 6.376 1.166 -0.322 1.00 0.38 C ATOM 0 H LEU A 34 7.864 2.483 -3.610 1.00 0.29 H new ATOM 0 HA LEU A 34 7.803 -0.267 -3.942 1.00 0.21 H new ATOM 0 HB2 LEU A 34 5.284 1.039 -3.064 1.00 0.23 H new ATOM 0 HB3 LEU A 34 6.172 -0.291 -2.347 1.00 0.23 H new ATOM 0 HG LEU A 34 7.905 1.630 -1.743 1.00 0.31 H new ATOM 0 HD11 LEU A 34 6.734 3.720 -1.161 1.00 0.38 H new ATOM 0 HD12 LEU A 34 6.702 3.411 -2.914 1.00 0.38 H new ATOM 0 HD13 LEU A 34 5.254 3.099 -1.928 1.00 0.38 H new ATOM 0 HD21 LEU A 34 6.763 1.844 0.438 1.00 0.38 H new ATOM 0 HD22 LEU A 34 5.287 1.150 -0.273 1.00 0.38 H new ATOM 0 HD23 LEU A 34 6.762 0.162 -0.143 1.00 0.38 H new ATOM 585 N GLU A 35 5.823 -0.964 -5.345 1.00 0.20 N ATOM 586 CA GLU A 35 5.022 -1.472 -6.444 1.00 0.20 C ATOM 587 C GLU A 35 3.652 -1.747 -5.924 1.00 0.16 C ATOM 588 O GLU A 35 3.501 -2.633 -5.099 1.00 0.16 O ATOM 589 CB GLU A 35 5.607 -2.760 -7.032 1.00 0.22 C ATOM 590 CG GLU A 35 4.766 -3.381 -8.143 1.00 0.23 C ATOM 591 CD GLU A 35 5.424 -4.605 -8.754 1.00 0.34 C ATOM 592 OE1 GLU A 35 5.444 -5.666 -8.091 1.00 1.12 O ATOM 593 OE2 GLU A 35 5.927 -4.508 -9.896 1.00 0.95 O ATOM 0 H GLU A 35 6.067 -1.673 -4.654 1.00 0.20 H new ATOM 0 HA GLU A 35 5.006 -0.728 -7.240 1.00 0.20 H new ATOM 0 HB2 GLU A 35 6.603 -2.548 -7.421 1.00 0.22 H new ATOM 0 HB3 GLU A 35 5.726 -3.490 -6.231 1.00 0.22 H new ATOM 0 HG2 GLU A 35 3.790 -3.658 -7.744 1.00 0.23 H new ATOM 0 HG3 GLU A 35 4.593 -2.638 -8.922 1.00 0.23 H new ATOM 600 N ILE A 36 2.681 -0.978 -6.379 1.00 0.14 N ATOM 601 CA ILE A 36 1.308 -1.134 -5.953 1.00 0.11 C ATOM 602 C ILE A 36 0.647 -2.237 -6.752 1.00 0.10 C ATOM 603 O ILE A 36 0.468 -2.111 -7.958 1.00 0.14 O ATOM 604 CB ILE A 36 0.515 0.178 -6.145 1.00 0.12 C ATOM 605 CG1 ILE A 36 0.994 1.227 -5.154 1.00 0.15 C ATOM 606 CG2 ILE A 36 -0.983 -0.040 -6.002 1.00 0.14 C ATOM 607 CD1 ILE A 36 1.508 2.473 -5.816 1.00 0.39 C ATOM 0 H ILE A 36 2.825 -0.228 -7.055 1.00 0.14 H new ATOM 0 HA ILE A 36 1.308 -1.390 -4.893 1.00 0.11 H new ATOM 0 HB ILE A 36 0.698 0.531 -7.160 1.00 0.12 H new ATOM 0 HG12 ILE A 36 0.173 1.490 -4.487 1.00 0.15 H new ATOM 0 HG13 ILE A 36 1.783 0.800 -4.535 1.00 0.15 H new ATOM 0 HG21 ILE A 36 -1.504 0.907 -6.144 1.00 0.14 H new ATOM 0 HG22 ILE A 36 -1.320 -0.755 -6.752 1.00 0.14 H new ATOM 0 HG23 ILE A 36 -1.201 -0.428 -5.007 1.00 0.14 H new ATOM 0 HD11 ILE A 36 1.834 3.181 -5.055 1.00 0.39 H new ATOM 0 HD12 ILE A 36 2.349 2.221 -6.462 1.00 0.39 H new ATOM 0 HD13 ILE A 36 0.714 2.922 -6.413 1.00 0.39 H new ATOM 619 N PHE A 37 0.347 -3.337 -6.100 1.00 0.09 N ATOM 620 CA PHE A 37 -0.407 -4.390 -6.737 1.00 0.10 C ATOM 621 C PHE A 37 -1.211 -5.157 -5.697 1.00 0.09 C ATOM 622 O PHE A 37 -0.673 -5.622 -4.704 1.00 0.09 O ATOM 623 CB PHE A 37 0.521 -5.295 -7.566 1.00 0.12 C ATOM 624 CG PHE A 37 0.954 -6.577 -6.900 1.00 0.16 C ATOM 625 CD1 PHE A 37 2.098 -6.617 -6.121 1.00 1.10 C ATOM 626 CD2 PHE A 37 0.219 -7.743 -7.064 1.00 1.12 C ATOM 627 CE1 PHE A 37 2.500 -7.792 -5.514 1.00 1.15 C ATOM 628 CE2 PHE A 37 0.618 -8.921 -6.460 1.00 1.12 C ATOM 629 CZ PHE A 37 1.758 -8.945 -5.683 1.00 0.35 C ATOM 0 H PHE A 37 0.613 -3.525 -5.133 1.00 0.09 H new ATOM 0 HA PHE A 37 -1.121 -3.957 -7.437 1.00 0.10 H new ATOM 0 HB2 PHE A 37 0.015 -5.545 -8.499 1.00 0.12 H new ATOM 0 HB3 PHE A 37 1.412 -4.726 -7.829 1.00 0.12 H new ATOM 0 HD1 PHE A 37 2.683 -5.719 -5.986 1.00 1.10 H new ATOM 0 HD2 PHE A 37 -0.675 -7.730 -7.670 1.00 1.12 H new ATOM 0 HE1 PHE A 37 3.394 -7.809 -4.908 1.00 1.15 H new ATOM 0 HE2 PHE A 37 0.038 -9.822 -6.596 1.00 1.12 H new ATOM 0 HZ PHE A 37 2.070 -9.863 -5.208 1.00 0.35 H new ATOM 639 N VAL A 38 -2.503 -5.263 -5.915 1.00 0.09 N ATOM 640 CA VAL A 38 -3.382 -5.921 -4.959 1.00 0.09 C ATOM 641 C VAL A 38 -3.314 -7.437 -5.115 1.00 0.11 C ATOM 642 O VAL A 38 -3.256 -7.955 -6.227 1.00 0.17 O ATOM 643 CB VAL A 38 -4.843 -5.399 -5.093 1.00 0.11 C ATOM 644 CG1 VAL A 38 -5.226 -5.201 -6.555 1.00 0.16 C ATOM 645 CG2 VAL A 38 -5.840 -6.331 -4.414 1.00 0.11 C ATOM 0 H VAL A 38 -2.974 -4.903 -6.745 1.00 0.09 H new ATOM 0 HA VAL A 38 -3.037 -5.675 -3.954 1.00 0.09 H new ATOM 0 HB VAL A 38 -4.882 -4.434 -4.588 1.00 0.11 H new ATOM 0 HG11 VAL A 38 -6.251 -4.836 -6.616 1.00 0.16 H new ATOM 0 HG12 VAL A 38 -4.554 -4.474 -7.012 1.00 0.16 H new ATOM 0 HG13 VAL A 38 -5.147 -6.151 -7.084 1.00 0.16 H new ATOM 0 HG21 VAL A 38 -6.848 -5.932 -4.530 1.00 0.11 H new ATOM 0 HG22 VAL A 38 -5.786 -7.318 -4.873 1.00 0.11 H new ATOM 0 HG23 VAL A 38 -5.600 -6.410 -3.354 1.00 0.11 H new ATOM 655 N ASP A 39 -3.295 -8.134 -3.985 1.00 0.09 N ATOM 656 CA ASP A 39 -3.102 -9.581 -3.971 1.00 0.12 C ATOM 657 C ASP A 39 -4.401 -10.324 -4.196 1.00 0.16 C ATOM 658 O ASP A 39 -4.483 -11.219 -5.036 1.00 0.18 O ATOM 659 CB ASP A 39 -2.532 -10.039 -2.629 1.00 0.19 C ATOM 660 CG ASP A 39 -2.002 -11.466 -2.691 1.00 0.23 C ATOM 661 OD1 ASP A 39 -0.846 -11.654 -3.119 1.00 1.04 O ATOM 662 OD2 ASP A 39 -2.743 -12.405 -2.329 1.00 1.11 O ATOM 0 H ASP A 39 -3.412 -7.718 -3.061 1.00 0.09 H new ATOM 0 HA ASP A 39 -2.408 -9.806 -4.780 1.00 0.12 H new ATOM 0 HB2 ASP A 39 -1.729 -9.367 -2.328 1.00 0.19 H new ATOM 0 HB3 ASP A 39 -3.306 -9.973 -1.865 1.00 0.19 H new ATOM 667 N ARG A 40 -5.416 -9.941 -3.443 1.00 0.32 N ATOM 668 CA ARG A 40 -6.615 -10.747 -3.334 1.00 0.43 C ATOM 669 C ARG A 40 -7.888 -9.915 -3.429 1.00 0.43 C ATOM 670 O ARG A 40 -8.339 -9.594 -4.527 1.00 0.49 O ATOM 671 CB ARG A 40 -6.563 -11.547 -2.027 1.00 0.53 C ATOM 672 CG ARG A 40 -5.751 -10.860 -0.943 1.00 0.53 C ATOM 673 CD ARG A 40 -4.774 -11.814 -0.284 1.00 0.72 C ATOM 674 NE ARG A 40 -5.423 -12.995 0.280 1.00 1.09 N ATOM 675 CZ ARG A 40 -5.014 -14.238 0.038 1.00 1.66 C ATOM 676 NH1 ARG A 40 -4.011 -14.451 -0.809 1.00 2.22 N ATOM 677 NH2 ARG A 40 -5.597 -15.268 0.635 1.00 2.29 N ATOM 0 H ARG A 40 -5.433 -9.078 -2.899 1.00 0.32 H new ATOM 0 HA ARG A 40 -6.646 -11.434 -4.180 1.00 0.43 H new ATOM 0 HB2 ARG A 40 -7.579 -11.708 -1.665 1.00 0.53 H new ATOM 0 HB3 ARG A 40 -6.136 -12.530 -2.226 1.00 0.53 H new ATOM 0 HG2 ARG A 40 -5.205 -10.021 -1.374 1.00 0.53 H new ATOM 0 HG3 ARG A 40 -6.423 -10.450 -0.190 1.00 0.53 H new ATOM 0 HD2 ARG A 40 -4.032 -12.129 -1.017 1.00 0.72 H new ATOM 0 HD3 ARG A 40 -4.238 -11.288 0.506 1.00 0.72 H new ATOM 0 HE ARG A 40 -6.230 -12.860 0.890 1.00 1.09 H new ATOM 0 HH11 ARG A 40 -3.558 -13.663 -1.271 1.00 2.22 H new ATOM 0 HH12 ARG A 40 -3.695 -15.403 -0.997 1.00 2.22 H new ATOM 0 HH21 ARG A 40 -6.366 -15.111 1.286 1.00 2.29 H new ATOM 0 HH22 ARG A 40 -5.276 -16.217 0.443 1.00 2.29 H new ATOM 691 N ASP A 41 -8.456 -9.555 -2.289 1.00 0.47 N ATOM 692 CA ASP A 41 -9.716 -8.810 -2.270 1.00 0.52 C ATOM 693 C ASP A 41 -9.465 -7.324 -2.416 1.00 0.43 C ATOM 694 O ASP A 41 -9.696 -6.734 -3.468 1.00 0.50 O ATOM 695 CB ASP A 41 -10.489 -9.071 -0.972 1.00 0.57 C ATOM 696 CG ASP A 41 -11.753 -8.229 -0.867 1.00 0.96 C ATOM 697 OD1 ASP A 41 -12.789 -8.634 -1.424 1.00 1.53 O ATOM 698 OD2 ASP A 41 -11.715 -7.158 -0.219 1.00 1.34 O ATOM 0 H ASP A 41 -8.072 -9.762 -1.367 1.00 0.47 H new ATOM 0 HA ASP A 41 -10.314 -9.156 -3.113 1.00 0.52 H new ATOM 0 HB2 ASP A 41 -10.754 -10.127 -0.917 1.00 0.57 H new ATOM 0 HB3 ASP A 41 -9.843 -8.859 -0.120 1.00 0.57 H new ATOM 703 N GLY A 42 -8.978 -6.730 -1.347 1.00 0.32 N ATOM 704 CA GLY A 42 -8.725 -5.313 -1.336 1.00 0.26 C ATOM 705 C GLY A 42 -7.425 -5.007 -0.657 1.00 0.18 C ATOM 706 O GLY A 42 -7.240 -3.933 -0.095 1.00 0.18 O ATOM 0 H GLY A 42 -8.751 -7.210 -0.476 1.00 0.32 H new ATOM 0 HA2 GLY A 42 -8.704 -4.935 -2.358 1.00 0.26 H new ATOM 0 HA3 GLY A 42 -9.538 -4.798 -0.823 1.00 0.26 H new ATOM 710 N GLU A 43 -6.533 -5.983 -0.685 1.00 0.15 N ATOM 711 CA GLU A 43 -5.223 -5.833 -0.091 1.00 0.12 C ATOM 712 C GLU A 43 -4.243 -5.400 -1.155 1.00 0.08 C ATOM 713 O GLU A 43 -3.917 -6.175 -2.052 1.00 0.09 O ATOM 714 CB GLU A 43 -4.750 -7.148 0.526 1.00 0.14 C ATOM 715 CG GLU A 43 -5.869 -7.974 1.128 1.00 0.53 C ATOM 716 CD GLU A 43 -5.410 -8.806 2.304 1.00 1.00 C ATOM 717 OE1 GLU A 43 -4.762 -9.846 2.087 1.00 1.30 O ATOM 718 OE2 GLU A 43 -5.703 -8.421 3.450 1.00 1.97 O ATOM 0 H GLU A 43 -6.698 -6.892 -1.117 1.00 0.15 H new ATOM 0 HA GLU A 43 -5.282 -5.082 0.697 1.00 0.12 H new ATOM 0 HB2 GLU A 43 -4.246 -7.738 -0.239 1.00 0.14 H new ATOM 0 HB3 GLU A 43 -4.013 -6.932 1.299 1.00 0.14 H new ATOM 0 HG2 GLU A 43 -6.673 -7.311 1.448 1.00 0.53 H new ATOM 0 HG3 GLU A 43 -6.283 -8.631 0.363 1.00 0.53 H new ATOM 725 N VAL A 44 -3.804 -4.164 -1.078 1.00 0.07 N ATOM 726 CA VAL A 44 -2.828 -3.658 -2.015 1.00 0.07 C ATOM 727 C VAL A 44 -1.441 -3.928 -1.484 1.00 0.07 C ATOM 728 O VAL A 44 -1.148 -3.639 -0.334 1.00 0.08 O ATOM 729 CB VAL A 44 -2.964 -2.152 -2.265 1.00 0.09 C ATOM 730 CG1 VAL A 44 -2.376 -1.805 -3.618 1.00 0.14 C ATOM 731 CG2 VAL A 44 -4.415 -1.700 -2.163 1.00 0.12 C ATOM 0 H VAL A 44 -4.108 -3.490 -0.375 1.00 0.07 H new ATOM 0 HA VAL A 44 -3.003 -4.170 -2.961 1.00 0.07 H new ATOM 0 HB VAL A 44 -2.409 -1.619 -1.493 1.00 0.09 H new ATOM 0 HG11 VAL A 44 -2.474 -0.734 -3.793 1.00 0.14 H new ATOM 0 HG12 VAL A 44 -1.322 -2.081 -3.638 1.00 0.14 H new ATOM 0 HG13 VAL A 44 -2.909 -2.350 -4.397 1.00 0.14 H new ATOM 0 HG21 VAL A 44 -4.476 -0.627 -2.346 1.00 0.12 H new ATOM 0 HG22 VAL A 44 -5.014 -2.229 -2.905 1.00 0.12 H new ATOM 0 HG23 VAL A 44 -4.795 -1.920 -1.166 1.00 0.12 H new ATOM 741 N ILE A 45 -0.599 -4.472 -2.324 1.00 0.08 N ATOM 742 CA ILE A 45 0.734 -4.854 -1.930 1.00 0.08 C ATOM 743 C ILE A 45 1.713 -3.923 -2.604 1.00 0.11 C ATOM 744 O ILE A 45 1.770 -3.878 -3.825 1.00 0.14 O ATOM 745 CB ILE A 45 1.055 -6.305 -2.339 1.00 0.09 C ATOM 746 CG1 ILE A 45 0.296 -7.312 -1.462 1.00 0.09 C ATOM 747 CG2 ILE A 45 2.557 -6.568 -2.256 1.00 0.11 C ATOM 748 CD1 ILE A 45 -1.205 -7.207 -1.510 1.00 0.08 C ATOM 0 H ILE A 45 -0.818 -4.663 -3.302 1.00 0.08 H new ATOM 0 HA ILE A 45 0.809 -4.788 -0.845 1.00 0.08 H new ATOM 0 HB ILE A 45 0.729 -6.437 -3.371 1.00 0.09 H new ATOM 0 HG12 ILE A 45 0.583 -8.319 -1.764 1.00 0.09 H new ATOM 0 HG13 ILE A 45 0.619 -7.185 -0.429 1.00 0.09 H new ATOM 0 HG21 ILE A 45 2.763 -7.598 -2.549 1.00 0.11 H new ATOM 0 HG22 ILE A 45 3.083 -5.888 -2.926 1.00 0.11 H new ATOM 0 HG23 ILE A 45 2.899 -6.406 -1.234 1.00 0.11 H new ATOM 0 HD11 ILE A 45 -1.644 -7.961 -0.857 1.00 0.08 H new ATOM 0 HD12 ILE A 45 -1.511 -6.216 -1.176 1.00 0.08 H new ATOM 0 HD13 ILE A 45 -1.549 -7.368 -2.532 1.00 0.08 H new ATOM 760 N LEU A 46 2.426 -3.155 -1.810 1.00 0.11 N ATOM 761 CA LEU A 46 3.413 -2.210 -2.313 1.00 0.13 C ATOM 762 C LEU A 46 4.807 -2.698 -1.970 1.00 0.11 C ATOM 763 O LEU A 46 5.135 -2.818 -0.799 1.00 0.17 O ATOM 764 CB LEU A 46 3.196 -0.847 -1.655 1.00 0.20 C ATOM 765 CG LEU A 46 1.790 -0.625 -1.118 1.00 0.14 C ATOM 766 CD1 LEU A 46 1.791 0.516 -0.126 1.00 0.19 C ATOM 767 CD2 LEU A 46 0.817 -0.346 -2.250 1.00 0.23 C ATOM 0 H LEU A 46 2.341 -3.164 -0.794 1.00 0.11 H new ATOM 0 HA LEU A 46 3.306 -2.124 -3.394 1.00 0.13 H new ATOM 0 HB2 LEU A 46 3.906 -0.735 -0.836 1.00 0.20 H new ATOM 0 HB3 LEU A 46 3.422 -0.066 -2.381 1.00 0.20 H new ATOM 0 HG LEU A 46 1.464 -1.533 -0.611 1.00 0.14 H new ATOM 0 HD11 LEU A 46 0.781 0.669 0.254 1.00 0.19 H new ATOM 0 HD12 LEU A 46 2.458 0.277 0.702 1.00 0.19 H new ATOM 0 HD13 LEU A 46 2.135 1.426 -0.618 1.00 0.19 H new ATOM 0 HD21 LEU A 46 -0.182 -0.191 -1.842 1.00 0.23 H new ATOM 0 HD22 LEU A 46 1.132 0.548 -2.788 1.00 0.23 H new ATOM 0 HD23 LEU A 46 0.801 -1.195 -2.934 1.00 0.23 H new ATOM 779 N LYS A 47 5.637 -2.985 -2.959 1.00 0.15 N ATOM 780 CA LYS A 47 7.007 -3.377 -2.634 1.00 0.27 C ATOM 781 C LYS A 47 8.045 -2.614 -3.438 1.00 0.16 C ATOM 782 O LYS A 47 7.845 -2.318 -4.599 1.00 0.15 O ATOM 783 CB LYS A 47 7.222 -4.896 -2.742 1.00 0.63 C ATOM 784 CG LYS A 47 7.837 -5.401 -4.043 1.00 0.29 C ATOM 785 CD LYS A 47 6.911 -5.225 -5.225 1.00 0.55 C ATOM 786 CE LYS A 47 5.568 -5.902 -5.011 1.00 0.69 C ATOM 787 NZ LYS A 47 5.676 -7.385 -4.997 1.00 0.76 N ATOM 0 H LYS A 47 5.406 -2.958 -3.952 1.00 0.15 H new ATOM 0 HA LYS A 47 7.152 -3.101 -1.589 1.00 0.27 H new ATOM 0 HB2 LYS A 47 7.861 -5.211 -1.917 1.00 0.63 H new ATOM 0 HB3 LYS A 47 6.259 -5.388 -2.605 1.00 0.63 H new ATOM 0 HG2 LYS A 47 8.769 -4.868 -4.232 1.00 0.29 H new ATOM 0 HG3 LYS A 47 8.090 -6.456 -3.937 1.00 0.29 H new ATOM 0 HD2 LYS A 47 6.755 -4.162 -5.406 1.00 0.55 H new ATOM 0 HD3 LYS A 47 7.383 -5.634 -6.118 1.00 0.55 H new ATOM 0 HE2 LYS A 47 5.140 -5.563 -4.068 1.00 0.69 H new ATOM 0 HE3 LYS A 47 4.881 -5.598 -5.801 1.00 0.69 H new ATOM 0 HZ1 LYS A 47 4.947 -7.792 -5.617 1.00 0.76 H new ATOM 0 HZ2 LYS A 47 6.617 -7.668 -5.338 1.00 0.76 H new ATOM 0 HZ3 LYS A 47 5.540 -7.734 -4.027 1.00 0.76 H new ATOM 801 N LYS A 48 9.143 -2.345 -2.752 1.00 0.19 N ATOM 802 CA LYS A 48 10.341 -1.608 -3.208 1.00 0.15 C ATOM 803 C LYS A 48 10.619 -1.467 -4.725 1.00 0.14 C ATOM 804 O LYS A 48 11.343 -0.555 -5.100 1.00 0.17 O ATOM 805 CB LYS A 48 11.529 -2.294 -2.568 1.00 0.17 C ATOM 806 CG LYS A 48 11.337 -3.798 -2.460 1.00 0.19 C ATOM 807 CD LYS A 48 11.697 -4.309 -1.075 1.00 0.20 C ATOM 808 CE LYS A 48 13.142 -3.995 -0.723 1.00 0.21 C ATOM 809 NZ LYS A 48 13.539 -4.602 0.575 1.00 0.32 N ATOM 0 H LYS A 48 9.242 -2.654 -1.785 1.00 0.19 H new ATOM 0 HA LYS A 48 10.156 -0.576 -2.910 1.00 0.15 H new ATOM 0 HB2 LYS A 48 12.425 -2.085 -3.153 1.00 0.17 H new ATOM 0 HB3 LYS A 48 11.694 -1.879 -1.574 1.00 0.17 H new ATOM 0 HG2 LYS A 48 10.300 -4.050 -2.684 1.00 0.19 H new ATOM 0 HG3 LYS A 48 11.955 -4.299 -3.205 1.00 0.19 H new ATOM 0 HD2 LYS A 48 11.035 -3.857 -0.336 1.00 0.20 H new ATOM 0 HD3 LYS A 48 11.536 -5.386 -1.030 1.00 0.20 H new ATOM 0 HE2 LYS A 48 13.797 -4.364 -1.512 1.00 0.21 H new ATOM 0 HE3 LYS A 48 13.278 -2.915 -0.676 1.00 0.21 H new ATOM 0 HZ1 LYS A 48 14.494 -5.005 0.492 1.00 0.32 H new ATOM 0 HZ2 LYS A 48 13.535 -3.872 1.315 1.00 0.32 H new ATOM 0 HZ3 LYS A 48 12.866 -5.354 0.827 1.00 0.32 H new ATOM 823 N TYR A 49 10.142 -2.379 -5.574 1.00 0.14 N ATOM 824 CA TYR A 49 10.384 -2.322 -7.032 1.00 0.16 C ATOM 825 C TYR A 49 11.817 -2.683 -7.395 1.00 0.17 C ATOM 826 O TYR A 49 12.063 -3.315 -8.417 1.00 0.24 O ATOM 827 CB TYR A 49 10.093 -0.948 -7.607 1.00 0.19 C ATOM 828 CG TYR A 49 10.521 -0.782 -9.056 1.00 0.24 C ATOM 829 CD1 TYR A 49 9.994 -1.580 -10.063 1.00 1.03 C ATOM 830 CD2 TYR A 49 11.469 0.169 -9.406 1.00 1.22 C ATOM 831 CE1 TYR A 49 10.402 -1.438 -11.377 1.00 1.01 C ATOM 832 CE2 TYR A 49 11.886 0.318 -10.715 1.00 1.28 C ATOM 833 CZ TYR A 49 11.348 -0.485 -11.699 1.00 0.40 C ATOM 834 OH TYR A 49 11.766 -0.340 -13.006 1.00 0.49 O ATOM 0 H TYR A 49 9.579 -3.177 -5.281 1.00 0.14 H new ATOM 0 HA TYR A 49 9.701 -3.055 -7.461 1.00 0.16 H new ATOM 0 HB2 TYR A 49 9.024 -0.752 -7.530 1.00 0.19 H new ATOM 0 HB3 TYR A 49 10.599 -0.197 -7.001 1.00 0.19 H new ATOM 0 HD1 TYR A 49 9.252 -2.325 -9.816 1.00 1.03 H new ATOM 0 HD2 TYR A 49 11.889 0.805 -8.641 1.00 1.22 H new ATOM 0 HE1 TYR A 49 9.983 -2.069 -12.147 1.00 1.01 H new ATOM 0 HE2 TYR A 49 12.630 1.060 -10.966 1.00 1.28 H new ATOM 0 HH TYR A 49 12.434 0.376 -13.058 1.00 0.49 H new ATOM 844 N SER A 50 12.757 -2.242 -6.577 1.00 0.19 N ATOM 845 CA SER A 50 14.164 -2.473 -6.831 1.00 0.25 C ATOM 846 C SER A 50 14.431 -3.972 -7.077 1.00 0.28 C ATOM 847 O SER A 50 15.036 -4.330 -8.088 1.00 0.34 O ATOM 848 CB SER A 50 15.002 -1.902 -5.676 1.00 0.37 C ATOM 849 OG SER A 50 16.391 -1.994 -5.951 1.00 1.36 O ATOM 0 H SER A 50 12.566 -1.717 -5.724 1.00 0.19 H new ATOM 0 HA SER A 50 14.464 -1.951 -7.740 1.00 0.25 H new ATOM 0 HB2 SER A 50 14.731 -0.860 -5.508 1.00 0.37 H new ATOM 0 HB3 SER A 50 14.775 -2.443 -4.757 1.00 0.37 H new ATOM 0 HG SER A 50 16.899 -1.622 -5.200 1.00 1.36 H new ATOM 855 N PRO A 51 13.986 -4.877 -6.172 1.00 0.32 N ATOM 856 CA PRO A 51 13.950 -6.313 -6.452 1.00 0.42 C ATOM 857 C PRO A 51 12.598 -6.745 -7.025 1.00 0.45 C ATOM 858 O PRO A 51 12.331 -7.936 -7.201 1.00 0.58 O ATOM 859 CB PRO A 51 14.157 -6.924 -5.079 1.00 0.52 C ATOM 860 CG PRO A 51 13.510 -5.964 -4.135 1.00 0.46 C ATOM 861 CD PRO A 51 13.554 -4.599 -4.789 1.00 0.36 C ATOM 0 HA PRO A 51 14.690 -6.617 -7.192 1.00 0.42 H new ATOM 0 HB2 PRO A 51 13.702 -7.912 -5.013 1.00 0.52 H new ATOM 0 HB3 PRO A 51 15.217 -7.046 -4.855 1.00 0.52 H new ATOM 0 HG2 PRO A 51 12.481 -6.260 -3.930 1.00 0.46 H new ATOM 0 HG3 PRO A 51 14.035 -5.951 -3.180 1.00 0.46 H new ATOM 0 HD2 PRO A 51 12.578 -4.114 -4.766 1.00 0.36 H new ATOM 0 HD3 PRO A 51 14.252 -3.935 -4.279 1.00 0.36 H new ATOM 869 N ILE A 52 11.770 -5.743 -7.321 1.00 0.37 N ATOM 870 CA ILE A 52 10.425 -5.920 -7.879 1.00 0.46 C ATOM 871 C ILE A 52 9.641 -6.985 -7.121 1.00 0.61 C ATOM 872 O ILE A 52 9.846 -7.196 -5.925 1.00 0.61 O ATOM 873 CB ILE A 52 10.472 -6.293 -9.380 1.00 0.62 C ATOM 874 CG1 ILE A 52 11.849 -5.987 -9.965 1.00 0.51 C ATOM 875 CG2 ILE A 52 9.396 -5.532 -10.150 1.00 0.78 C ATOM 876 CD1 ILE A 52 11.988 -6.355 -11.423 1.00 0.69 C ATOM 0 H ILE A 52 12.019 -4.764 -7.177 1.00 0.37 H new ATOM 0 HA ILE A 52 9.918 -4.961 -7.771 1.00 0.46 H new ATOM 0 HB ILE A 52 10.283 -7.362 -9.474 1.00 0.62 H new ATOM 0 HG12 ILE A 52 12.055 -4.923 -9.847 1.00 0.51 H new ATOM 0 HG13 ILE A 52 12.605 -6.523 -9.391 1.00 0.51 H new ATOM 0 HG21 ILE A 52 9.441 -5.805 -11.204 1.00 0.78 H new ATOM 0 HG22 ILE A 52 8.414 -5.787 -9.751 1.00 0.78 H new ATOM 0 HG23 ILE A 52 9.563 -4.460 -10.045 1.00 0.78 H new ATOM 0 HD11 ILE A 52 12.993 -6.108 -11.766 1.00 0.69 H new ATOM 0 HD12 ILE A 52 11.815 -7.424 -11.547 1.00 0.69 H new ATOM 0 HD13 ILE A 52 11.257 -5.799 -12.010 1.00 0.69 H new ATOM 888 N SER A 53 8.734 -7.641 -7.822 1.00 0.85 N ATOM 889 CA SER A 53 7.982 -8.748 -7.281 1.00 1.06 C ATOM 890 C SER A 53 8.778 -10.038 -7.437 1.00 1.29 C ATOM 891 O SER A 53 8.243 -11.060 -7.878 1.00 1.96 O ATOM 892 CB SER A 53 6.652 -8.828 -8.024 1.00 1.21 C ATOM 893 OG SER A 53 6.848 -8.728 -9.426 1.00 1.67 O ATOM 0 H SER A 53 8.500 -7.416 -8.789 1.00 0.85 H new ATOM 0 HA SER A 53 7.793 -8.602 -6.217 1.00 1.06 H new ATOM 0 HB2 SER A 53 6.155 -9.769 -7.788 1.00 1.21 H new ATOM 0 HB3 SER A 53 5.994 -8.027 -7.687 1.00 1.21 H new ATOM 0 HG SER A 53 7.434 -9.453 -9.727 1.00 1.67 H new ATOM 899 N GLU A 54 10.060 -9.962 -7.059 1.00 1.17 N ATOM 900 CA GLU A 54 11.014 -11.061 -7.207 1.00 1.35 C ATOM 901 C GLU A 54 11.413 -11.219 -8.669 1.00 1.52 C ATOM 902 O GLU A 54 10.571 -11.497 -9.525 1.00 2.38 O ATOM 903 CB GLU A 54 10.441 -12.378 -6.671 1.00 1.52 C ATOM 904 CG GLU A 54 10.066 -12.338 -5.199 1.00 1.95 C ATOM 905 CD GLU A 54 9.206 -13.515 -4.797 1.00 2.29 C ATOM 906 OE1 GLU A 54 9.727 -14.648 -4.747 1.00 2.47 O ATOM 907 OE2 GLU A 54 7.997 -13.320 -4.541 1.00 2.89 O ATOM 0 H GLU A 54 10.465 -9.126 -6.638 1.00 1.17 H new ATOM 0 HA GLU A 54 11.898 -10.816 -6.618 1.00 1.35 H new ATOM 0 HB2 GLU A 54 9.558 -12.641 -7.253 1.00 1.52 H new ATOM 0 HB3 GLU A 54 11.173 -13.170 -6.827 1.00 1.52 H new ATOM 0 HG2 GLU A 54 10.973 -12.330 -4.595 1.00 1.95 H new ATOM 0 HG3 GLU A 54 9.533 -11.411 -4.987 1.00 1.95 H new ATOM 914 N LEU A 55 12.692 -11.010 -8.956 1.00 1.27 N ATOM 915 CA LEU A 55 13.213 -11.194 -10.305 1.00 1.43 C ATOM 916 C LEU A 55 13.080 -12.650 -10.727 1.00 2.04 C ATOM 917 O LEU A 55 13.953 -13.461 -10.348 1.00 2.28 O ATOM 918 CB LEU A 55 14.685 -10.774 -10.387 1.00 1.60 C ATOM 919 CG LEU A 55 14.952 -9.300 -10.710 1.00 1.53 C ATOM 920 CD1 LEU A 55 14.341 -8.929 -12.053 1.00 2.27 C ATOM 921 CD2 LEU A 55 14.423 -8.396 -9.610 1.00 1.11 C ATOM 922 OXT LEU A 55 12.102 -12.986 -11.419 1.00 2.65 O ATOM 0 H LEU A 55 13.388 -10.713 -8.272 1.00 1.27 H new ATOM 0 HA LEU A 55 12.630 -10.565 -10.977 1.00 1.43 H new ATOM 0 HB2 LEU A 55 15.161 -11.008 -9.435 1.00 1.60 H new ATOM 0 HB3 LEU A 55 15.174 -11.385 -11.146 1.00 1.60 H new ATOM 0 HG LEU A 55 16.031 -9.157 -10.771 1.00 1.53 H new ATOM 0 HD11 LEU A 55 14.541 -7.879 -12.266 1.00 2.27 H new ATOM 0 HD12 LEU A 55 14.780 -9.548 -12.836 1.00 2.27 H new ATOM 0 HD13 LEU A 55 13.264 -9.094 -12.021 1.00 2.27 H new ATOM 0 HD21 LEU A 55 14.626 -7.356 -9.865 1.00 1.11 H new ATOM 0 HD22 LEU A 55 13.348 -8.541 -9.506 1.00 1.11 H new ATOM 0 HD23 LEU A 55 14.915 -8.642 -8.669 1.00 1.11 H new TER 934 LEU A 55 ATOM 935 N MET B 1 -10.776 -7.674 -11.044 1.00 3.94 N ATOM 936 CA MET B 1 -9.453 -8.341 -11.107 1.00 3.42 C ATOM 937 C MET B 1 -8.489 -7.660 -10.146 1.00 2.74 C ATOM 938 O MET B 1 -8.823 -6.633 -9.556 1.00 3.34 O ATOM 939 CB MET B 1 -8.883 -8.291 -12.530 1.00 3.88 C ATOM 940 CG MET B 1 -9.686 -9.085 -13.545 1.00 4.32 C ATOM 941 SD MET B 1 -8.920 -9.106 -15.180 1.00 5.25 S ATOM 942 CE MET B 1 -8.908 -7.358 -15.580 1.00 6.17 C ATOM 0 H1 MET B 1 -11.498 -8.362 -10.749 1.00 3.94 H new ATOM 0 H2 MET B 1 -10.739 -6.894 -10.357 1.00 3.94 H new ATOM 0 H3 MET B 1 -11.020 -7.298 -11.982 1.00 3.94 H new ATOM 0 HA MET B 1 -9.580 -9.385 -10.822 1.00 3.42 H new ATOM 0 HB2 MET B 1 -8.833 -7.252 -12.854 1.00 3.88 H new ATOM 0 HB3 MET B 1 -7.861 -8.669 -12.514 1.00 3.88 H new ATOM 0 HG2 MET B 1 -9.801 -10.109 -13.190 1.00 4.32 H new ATOM 0 HG3 MET B 1 -10.687 -8.660 -13.623 1.00 4.32 H new ATOM 0 HE1 MET B 1 -8.718 -7.230 -16.646 1.00 6.17 H new ATOM 0 HE2 MET B 1 -9.874 -6.921 -15.329 1.00 6.17 H new ATOM 0 HE3 MET B 1 -8.125 -6.859 -15.009 1.00 6.17 H new ATOM 954 N LYS B 2 -7.296 -8.223 -9.989 1.00 1.78 N ATOM 955 CA LYS B 2 -6.312 -7.655 -9.080 1.00 1.13 C ATOM 956 C LYS B 2 -4.904 -7.773 -9.677 1.00 0.88 C ATOM 957 O LYS B 2 -4.761 -8.199 -10.825 1.00 1.16 O ATOM 958 CB LYS B 2 -6.407 -8.332 -7.698 1.00 0.55 C ATOM 959 CG LYS B 2 -5.553 -9.576 -7.515 1.00 1.01 C ATOM 960 CD LYS B 2 -5.909 -10.694 -8.481 1.00 1.83 C ATOM 961 CE LYS B 2 -4.999 -11.891 -8.277 1.00 2.68 C ATOM 962 NZ LYS B 2 -5.150 -12.900 -9.356 1.00 3.61 N ATOM 0 H LYS B 2 -6.990 -9.065 -10.476 1.00 1.78 H new ATOM 0 HA LYS B 2 -6.523 -6.594 -8.942 1.00 1.13 H new ATOM 0 HB2 LYS B 2 -6.125 -7.604 -6.937 1.00 0.55 H new ATOM 0 HB3 LYS B 2 -7.448 -8.598 -7.514 1.00 0.55 H new ATOM 0 HG2 LYS B 2 -4.504 -9.311 -7.647 1.00 1.01 H new ATOM 0 HG3 LYS B 2 -5.665 -9.938 -6.493 1.00 1.01 H new ATOM 0 HD2 LYS B 2 -6.947 -10.991 -8.334 1.00 1.83 H new ATOM 0 HD3 LYS B 2 -5.822 -10.336 -9.507 1.00 1.83 H new ATOM 0 HE2 LYS B 2 -3.963 -11.555 -8.238 1.00 2.68 H new ATOM 0 HE3 LYS B 2 -5.220 -12.354 -7.315 1.00 2.68 H new ATOM 0 HZ1 LYS B 2 -4.510 -13.700 -9.176 1.00 3.61 H new ATOM 0 HZ2 LYS B 2 -6.132 -13.241 -9.377 1.00 3.61 H new ATOM 0 HZ3 LYS B 2 -4.914 -12.467 -10.272 1.00 3.61 H new ATOM 976 N ALA B 3 -3.885 -7.421 -8.883 1.00 0.51 N ATOM 977 CA ALA B 3 -2.492 -7.342 -9.341 1.00 0.33 C ATOM 978 C ALA B 3 -2.326 -6.310 -10.448 1.00 0.42 C ATOM 979 O ALA B 3 -2.710 -6.534 -11.593 1.00 0.86 O ATOM 980 CB ALA B 3 -1.960 -8.693 -9.791 1.00 0.48 C ATOM 0 H ALA B 3 -4.005 -7.182 -7.899 1.00 0.51 H new ATOM 0 HA ALA B 3 -1.901 -7.023 -8.483 1.00 0.33 H new ATOM 0 HB1 ALA B 3 -0.927 -8.586 -10.121 1.00 0.48 H new ATOM 0 HB2 ALA B 3 -2.004 -9.397 -8.960 1.00 0.48 H new ATOM 0 HB3 ALA B 3 -2.567 -9.067 -10.615 1.00 0.48 H new ATOM 986 N THR B 4 -1.744 -5.177 -10.099 1.00 0.24 N ATOM 987 CA THR B 4 -1.634 -4.075 -11.033 1.00 0.26 C ATOM 988 C THR B 4 -0.180 -3.779 -11.392 1.00 0.30 C ATOM 989 O THR B 4 0.138 -3.505 -12.550 1.00 0.43 O ATOM 990 CB THR B 4 -2.321 -2.823 -10.468 1.00 0.26 C ATOM 991 OG1 THR B 4 -1.847 -2.569 -9.144 1.00 0.27 O ATOM 992 CG2 THR B 4 -3.832 -3.000 -10.428 1.00 0.26 C ATOM 0 H THR B 4 -1.342 -4.998 -9.179 1.00 0.24 H new ATOM 0 HA THR B 4 -2.141 -4.369 -11.952 1.00 0.26 H new ATOM 0 HB THR B 4 -2.083 -1.983 -11.120 1.00 0.26 H new ATOM 0 HG1 THR B 4 -0.872 -2.471 -9.159 1.00 0.27 H new ATOM 0 HG21 THR B 4 -4.293 -2.099 -10.024 1.00 0.26 H new ATOM 0 HG22 THR B 4 -4.204 -3.177 -11.437 1.00 0.26 H new ATOM 0 HG23 THR B 4 -4.082 -3.851 -9.794 1.00 0.26 H new ATOM 1000 N GLY B 5 0.692 -3.856 -10.399 1.00 0.23 N ATOM 1001 CA GLY B 5 2.105 -3.651 -10.628 1.00 0.25 C ATOM 1002 C GLY B 5 2.432 -2.221 -11.011 1.00 0.26 C ATOM 1003 O GLY B 5 3.204 -1.982 -11.941 1.00 0.33 O ATOM 0 H GLY B 5 0.443 -4.059 -9.431 1.00 0.23 H new ATOM 0 HA2 GLY B 5 2.658 -3.917 -9.727 1.00 0.25 H new ATOM 0 HA3 GLY B 5 2.442 -4.321 -11.419 1.00 0.25 H new ATOM 1007 N ILE B 6 1.858 -1.272 -10.288 1.00 0.21 N ATOM 1008 CA ILE B 6 2.132 0.135 -10.532 1.00 0.22 C ATOM 1009 C ILE B 6 3.083 0.666 -9.467 1.00 0.19 C ATOM 1010 O ILE B 6 2.709 0.867 -8.316 1.00 0.16 O ATOM 1011 CB ILE B 6 0.834 0.992 -10.598 1.00 0.23 C ATOM 1012 CG1 ILE B 6 1.145 2.487 -10.434 1.00 0.26 C ATOM 1013 CG2 ILE B 6 -0.185 0.543 -9.562 1.00 0.21 C ATOM 1014 CD1 ILE B 6 2.041 3.056 -11.515 1.00 0.30 C ATOM 0 H ILE B 6 1.201 -1.450 -9.529 1.00 0.21 H new ATOM 0 HA ILE B 6 2.604 0.216 -11.511 1.00 0.22 H new ATOM 0 HB ILE B 6 0.398 0.840 -11.586 1.00 0.23 H new ATOM 0 HG12 ILE B 6 0.207 3.043 -10.425 1.00 0.26 H new ATOM 0 HG13 ILE B 6 1.619 2.644 -9.465 1.00 0.26 H new ATOM 0 HG21 ILE B 6 -1.078 1.163 -9.637 1.00 0.21 H new ATOM 0 HG22 ILE B 6 -0.451 -0.499 -9.741 1.00 0.21 H new ATOM 0 HG23 ILE B 6 0.243 0.642 -8.564 1.00 0.21 H new ATOM 0 HD11 ILE B 6 2.212 4.116 -11.326 1.00 0.30 H new ATOM 0 HD12 ILE B 6 2.995 2.529 -11.512 1.00 0.30 H new ATOM 0 HD13 ILE B 6 1.562 2.934 -12.486 1.00 0.30 H new ATOM 1026 N VAL B 7 4.324 0.858 -9.863 1.00 0.24 N ATOM 1027 CA VAL B 7 5.346 1.350 -8.964 1.00 0.22 C ATOM 1028 C VAL B 7 5.170 2.837 -8.705 1.00 0.24 C ATOM 1029 O VAL B 7 5.002 3.635 -9.632 1.00 0.27 O ATOM 1030 CB VAL B 7 6.748 1.058 -9.527 1.00 0.23 C ATOM 1031 CG1 VAL B 7 7.806 1.898 -8.826 1.00 0.24 C ATOM 1032 CG2 VAL B 7 7.049 -0.427 -9.390 1.00 0.23 C ATOM 0 H VAL B 7 4.651 0.678 -10.812 1.00 0.24 H new ATOM 0 HA VAL B 7 5.242 0.827 -8.013 1.00 0.22 H new ATOM 0 HB VAL B 7 6.769 1.328 -10.583 1.00 0.23 H new ATOM 0 HG11 VAL B 7 8.787 1.671 -9.244 1.00 0.24 H new ATOM 0 HG12 VAL B 7 7.586 2.956 -8.971 1.00 0.24 H new ATOM 0 HG13 VAL B 7 7.804 1.670 -7.760 1.00 0.24 H new ATOM 0 HG21 VAL B 7 8.042 -0.635 -9.788 1.00 0.23 H new ATOM 0 HG22 VAL B 7 7.014 -0.710 -8.338 1.00 0.23 H new ATOM 0 HG23 VAL B 7 6.307 -1.001 -9.945 1.00 0.23 H new ATOM 1042 N ARG B 8 5.212 3.201 -7.438 1.00 0.23 N ATOM 1043 CA ARG B 8 5.096 4.563 -7.002 1.00 0.25 C ATOM 1044 C ARG B 8 6.267 4.830 -6.077 1.00 0.23 C ATOM 1045 O ARG B 8 6.384 4.202 -5.026 1.00 0.26 O ATOM 1046 CB ARG B 8 3.763 4.773 -6.255 1.00 0.29 C ATOM 1047 CG ARG B 8 3.809 5.777 -5.095 1.00 0.27 C ATOM 1048 CD ARG B 8 4.336 7.137 -5.514 1.00 0.24 C ATOM 1049 NE ARG B 8 3.448 7.824 -6.448 1.00 0.99 N ATOM 1050 CZ ARG B 8 3.367 9.150 -6.554 1.00 0.92 C ATOM 1051 NH1 ARG B 8 4.067 9.936 -5.737 1.00 0.53 N ATOM 1052 NH2 ARG B 8 2.571 9.683 -7.468 1.00 1.69 N ATOM 0 H ARG B 8 5.331 2.537 -6.673 1.00 0.23 H new ATOM 0 HA ARG B 8 5.108 5.247 -7.851 1.00 0.25 H new ATOM 0 HB2 ARG B 8 3.013 5.106 -6.972 1.00 0.29 H new ATOM 0 HB3 ARG B 8 3.428 3.811 -5.867 1.00 0.29 H new ATOM 0 HG2 ARG B 8 2.807 5.893 -4.681 1.00 0.27 H new ATOM 0 HG3 ARG B 8 4.439 5.378 -4.300 1.00 0.27 H new ATOM 0 HD2 ARG B 8 4.474 7.757 -4.628 1.00 0.24 H new ATOM 0 HD3 ARG B 8 5.317 7.016 -5.974 1.00 0.24 H new ATOM 0 HE ARG B 8 2.856 7.256 -7.054 1.00 0.99 H new ATOM 0 HH11 ARG B 8 4.670 9.524 -5.025 1.00 0.53 H new ATOM 0 HH12 ARG B 8 4.000 10.950 -5.824 1.00 0.53 H new ATOM 0 HH21 ARG B 8 2.026 9.080 -8.084 1.00 1.69 H new ATOM 0 HH22 ARG B 8 2.503 10.697 -7.556 1.00 1.69 H new ATOM 1066 N ARG B 9 7.143 5.727 -6.461 1.00 0.20 N ATOM 1067 CA ARG B 9 8.190 6.129 -5.561 1.00 0.19 C ATOM 1068 C ARG B 9 7.600 7.094 -4.566 1.00 0.20 C ATOM 1069 O ARG B 9 7.380 8.253 -4.908 1.00 0.21 O ATOM 1070 CB ARG B 9 9.336 6.780 -6.315 1.00 0.18 C ATOM 1071 CG ARG B 9 10.581 6.922 -5.484 1.00 0.24 C ATOM 1072 CD ARG B 9 11.800 7.066 -6.372 1.00 0.62 C ATOM 1073 NE ARG B 9 11.755 8.295 -7.163 1.00 1.35 N ATOM 1074 CZ ARG B 9 12.164 8.389 -8.429 1.00 1.74 C ATOM 1075 NH1 ARG B 9 12.694 7.335 -9.040 1.00 1.51 N ATOM 1076 NH2 ARG B 9 12.056 9.541 -9.077 1.00 2.71 N ATOM 0 H ARG B 9 7.151 6.184 -7.373 1.00 0.20 H new ATOM 0 HA ARG B 9 8.594 5.255 -5.050 1.00 0.19 H new ATOM 0 HB2 ARG B 9 9.563 6.188 -7.201 1.00 0.18 H new ATOM 0 HB3 ARG B 9 9.023 7.765 -6.661 1.00 0.18 H new ATOM 0 HG2 ARG B 9 10.493 7.792 -4.833 1.00 0.24 H new ATOM 0 HG3 ARG B 9 10.695 6.051 -4.838 1.00 0.24 H new ATOM 0 HD2 ARG B 9 12.700 7.063 -5.757 1.00 0.62 H new ATOM 0 HD3 ARG B 9 11.867 6.207 -7.039 1.00 0.62 H new ATOM 0 HE ARG B 9 11.387 9.135 -6.717 1.00 1.35 H new ATOM 0 HH11 ARG B 9 12.789 6.451 -8.541 1.00 1.51 H new ATOM 0 HH12 ARG B 9 13.006 7.410 -10.008 1.00 1.51 H new ATOM 0 HH21 ARG B 9 11.660 10.355 -8.607 1.00 2.71 H new ATOM 0 HH22 ARG B 9 12.369 9.613 -10.045 1.00 2.71 H new ATOM 1090 N ILE B 10 7.352 6.569 -3.356 1.00 0.22 N ATOM 1091 CA ILE B 10 6.674 7.276 -2.249 1.00 0.25 C ATOM 1092 C ILE B 10 6.442 8.764 -2.513 1.00 0.30 C ATOM 1093 O ILE B 10 5.508 9.113 -3.246 1.00 0.34 O ATOM 1094 CB ILE B 10 7.424 7.077 -0.903 1.00 0.23 C ATOM 1095 CG1 ILE B 10 8.924 6.827 -1.134 1.00 0.22 C ATOM 1096 CG2 ILE B 10 6.799 5.925 -0.142 1.00 0.21 C ATOM 1097 CD1 ILE B 10 9.574 7.842 -2.037 1.00 0.23 C ATOM 0 H ILE B 10 7.623 5.617 -3.110 1.00 0.22 H new ATOM 0 HA ILE B 10 5.687 6.818 -2.180 1.00 0.25 H new ATOM 0 HB ILE B 10 7.332 7.989 -0.313 1.00 0.23 H new ATOM 0 HG12 ILE B 10 9.436 6.829 -0.172 1.00 0.22 H new ATOM 0 HG13 ILE B 10 9.056 5.834 -1.564 1.00 0.22 H new ATOM 0 HG21 ILE B 10 7.325 5.785 0.802 1.00 0.21 H new ATOM 0 HG22 ILE B 10 5.750 6.146 0.056 1.00 0.21 H new ATOM 0 HG23 ILE B 10 6.872 5.014 -0.736 1.00 0.21 H new ATOM 0 HD11 ILE B 10 10.631 7.601 -2.154 1.00 0.23 H new ATOM 0 HD12 ILE B 10 9.088 7.825 -3.013 1.00 0.23 H new ATOM 0 HD13 ILE B 10 9.474 8.835 -1.599 1.00 0.23 H new ATOM 1109 N ASP B 11 7.298 9.616 -1.935 1.00 0.32 N ATOM 1110 CA ASP B 11 7.268 11.053 -2.161 1.00 0.39 C ATOM 1111 C ASP B 11 8.088 11.725 -1.083 1.00 0.40 C ATOM 1112 O ASP B 11 8.897 11.070 -0.441 1.00 0.42 O ATOM 1113 CB ASP B 11 5.831 11.613 -2.183 1.00 0.43 C ATOM 1114 CG ASP B 11 5.209 11.813 -0.809 1.00 0.33 C ATOM 1115 OD1 ASP B 11 4.938 10.823 -0.102 1.00 1.08 O ATOM 1116 OD2 ASP B 11 4.991 12.982 -0.433 1.00 1.18 O ATOM 0 H ASP B 11 8.033 9.318 -1.294 1.00 0.32 H new ATOM 0 HA ASP B 11 7.692 11.260 -3.143 1.00 0.39 H new ATOM 0 HB2 ASP B 11 5.835 12.568 -2.708 1.00 0.43 H new ATOM 0 HB3 ASP B 11 5.200 10.936 -2.758 1.00 0.43 H new ATOM 1121 N ASP B 12 7.878 13.013 -0.881 1.00 0.44 N ATOM 1122 CA ASP B 12 8.647 13.778 0.086 1.00 0.47 C ATOM 1123 C ASP B 12 8.190 13.449 1.505 1.00 0.43 C ATOM 1124 O ASP B 12 8.866 13.772 2.482 1.00 0.63 O ATOM 1125 CB ASP B 12 8.476 15.269 -0.202 1.00 0.58 C ATOM 1126 CG ASP B 12 9.457 16.138 0.558 1.00 1.42 C ATOM 1127 OD1 ASP B 12 10.614 16.265 0.103 1.00 1.78 O ATOM 1128 OD2 ASP B 12 9.066 16.727 1.588 1.00 2.39 O ATOM 0 H ASP B 12 7.174 13.557 -1.379 1.00 0.44 H new ATOM 0 HA ASP B 12 9.702 13.516 0.001 1.00 0.47 H new ATOM 0 HB2 ASP B 12 8.599 15.443 -1.271 1.00 0.58 H new ATOM 0 HB3 ASP B 12 7.460 15.568 0.055 1.00 0.58 H new ATOM 1133 N LEU B 13 7.038 12.801 1.605 1.00 0.34 N ATOM 1134 CA LEU B 13 6.483 12.413 2.890 1.00 0.28 C ATOM 1135 C LEU B 13 6.647 10.907 3.113 1.00 0.23 C ATOM 1136 O LEU B 13 7.308 10.484 4.061 1.00 0.25 O ATOM 1137 CB LEU B 13 5.004 12.819 2.959 1.00 0.27 C ATOM 1138 CG LEU B 13 4.387 12.887 4.362 1.00 0.29 C ATOM 1139 CD1 LEU B 13 4.148 11.498 4.931 1.00 0.32 C ATOM 1140 CD2 LEU B 13 5.281 13.695 5.287 1.00 0.40 C ATOM 0 H LEU B 13 6.467 12.532 0.804 1.00 0.34 H new ATOM 0 HA LEU B 13 7.025 12.929 3.683 1.00 0.28 H new ATOM 0 HB2 LEU B 13 4.894 13.796 2.488 1.00 0.27 H new ATOM 0 HB3 LEU B 13 4.426 12.112 2.364 1.00 0.27 H new ATOM 0 HG LEU B 13 3.419 13.382 4.282 1.00 0.29 H new ATOM 0 HD11 LEU B 13 3.710 11.583 5.926 1.00 0.32 H new ATOM 0 HD12 LEU B 13 3.466 10.950 4.280 1.00 0.32 H new ATOM 0 HD13 LEU B 13 5.096 10.963 4.996 1.00 0.32 H new ATOM 0 HD21 LEU B 13 4.834 13.737 6.280 1.00 0.40 H new ATOM 0 HD22 LEU B 13 6.261 13.222 5.350 1.00 0.40 H new ATOM 0 HD23 LEU B 13 5.390 14.706 4.895 1.00 0.40 H new ATOM 1152 N GLY B 14 6.047 10.105 2.240 1.00 0.21 N ATOM 1153 CA GLY B 14 6.085 8.667 2.405 1.00 0.18 C ATOM 1154 C GLY B 14 4.765 8.015 2.068 1.00 0.17 C ATOM 1155 O GLY B 14 4.522 6.863 2.416 1.00 0.20 O ATOM 0 H GLY B 14 5.534 10.428 1.420 1.00 0.21 H new ATOM 0 HA2 GLY B 14 6.866 8.251 1.768 1.00 0.18 H new ATOM 0 HA3 GLY B 14 6.353 8.429 3.434 1.00 0.18 H new ATOM 1159 N ARG B 15 3.906 8.744 1.380 1.00 0.18 N ATOM 1160 CA ARG B 15 2.641 8.189 0.944 1.00 0.20 C ATOM 1161 C ARG B 15 2.854 7.356 -0.286 1.00 0.18 C ATOM 1162 O ARG B 15 3.785 7.586 -1.054 1.00 0.20 O ATOM 1163 CB ARG B 15 1.649 9.279 0.577 1.00 0.29 C ATOM 1164 CG ARG B 15 1.554 10.419 1.556 1.00 0.24 C ATOM 1165 CD ARG B 15 1.723 11.732 0.827 1.00 0.42 C ATOM 1166 NE ARG B 15 1.352 12.877 1.663 1.00 0.52 N ATOM 1167 CZ ARG B 15 1.913 14.084 1.587 1.00 0.51 C ATOM 1168 NH1 ARG B 15 2.958 14.295 0.801 1.00 0.87 N ATOM 1169 NH2 ARG B 15 1.443 15.075 2.334 1.00 0.90 N ATOM 0 H ARG B 15 4.061 9.716 1.113 1.00 0.18 H new ATOM 0 HA ARG B 15 2.248 7.596 1.770 1.00 0.20 H new ATOM 0 HB2 ARG B 15 1.921 9.681 -0.399 1.00 0.29 H new ATOM 0 HB3 ARG B 15 0.662 8.829 0.472 1.00 0.29 H new ATOM 0 HG2 ARG B 15 0.590 10.395 2.064 1.00 0.24 H new ATOM 0 HG3 ARG B 15 2.321 10.317 2.324 1.00 0.24 H new ATOM 0 HD2 ARG B 15 2.760 11.838 0.507 1.00 0.42 H new ATOM 0 HD3 ARG B 15 1.110 11.728 -0.074 1.00 0.42 H new ATOM 0 HE ARG B 15 0.612 12.741 2.352 1.00 0.52 H new ATOM 0 HH11 ARG B 15 3.341 13.530 0.246 1.00 0.87 H new ATOM 0 HH12 ARG B 15 3.379 15.223 0.751 1.00 0.87 H new ATOM 0 HH21 ARG B 15 0.656 14.911 2.962 1.00 0.90 H new ATOM 0 HH22 ARG B 15 1.868 16.000 2.280 1.00 0.90 H new ATOM 1183 N VAL B 16 1.986 6.400 -0.491 1.00 0.18 N ATOM 1184 CA VAL B 16 1.943 5.750 -1.759 1.00 0.19 C ATOM 1185 C VAL B 16 0.657 6.163 -2.423 1.00 0.17 C ATOM 1186 O VAL B 16 -0.440 5.903 -1.928 1.00 0.20 O ATOM 1187 CB VAL B 16 2.140 4.215 -1.678 1.00 0.27 C ATOM 1188 CG1 VAL B 16 2.733 3.820 -0.340 1.00 1.15 C ATOM 1189 CG2 VAL B 16 0.878 3.420 -1.981 1.00 1.27 C ATOM 0 H VAL B 16 1.312 6.063 0.197 1.00 0.18 H new ATOM 0 HA VAL B 16 2.790 6.066 -2.367 1.00 0.19 H new ATOM 0 HB VAL B 16 2.846 3.956 -2.467 1.00 0.27 H new ATOM 0 HG11 VAL B 16 2.863 2.738 -0.305 1.00 1.15 H new ATOM 0 HG12 VAL B 16 3.700 4.306 -0.213 1.00 1.15 H new ATOM 0 HG13 VAL B 16 2.063 4.131 0.461 1.00 1.15 H new ATOM 0 HG21 VAL B 16 1.093 2.354 -1.905 1.00 1.27 H new ATOM 0 HG22 VAL B 16 0.100 3.685 -1.265 1.00 1.27 H new ATOM 0 HG23 VAL B 16 0.536 3.650 -2.990 1.00 1.27 H new ATOM 1199 N VAL B 17 0.806 6.929 -3.478 1.00 0.18 N ATOM 1200 CA VAL B 17 -0.334 7.508 -4.131 1.00 0.19 C ATOM 1201 C VAL B 17 -1.088 6.434 -4.888 1.00 0.19 C ATOM 1202 O VAL B 17 -0.689 6.031 -5.978 1.00 0.22 O ATOM 1203 CB VAL B 17 0.061 8.660 -5.075 1.00 0.23 C ATOM 1204 CG1 VAL B 17 -1.169 9.246 -5.745 1.00 0.27 C ATOM 1205 CG2 VAL B 17 0.829 9.731 -4.309 1.00 0.25 C ATOM 0 H VAL B 17 1.705 7.163 -3.898 1.00 0.18 H new ATOM 0 HA VAL B 17 -0.980 7.934 -3.363 1.00 0.19 H new ATOM 0 HB VAL B 17 0.712 8.265 -5.855 1.00 0.23 H new ATOM 0 HG11 VAL B 17 -0.870 10.058 -6.408 1.00 0.27 H new ATOM 0 HG12 VAL B 17 -1.672 8.471 -6.324 1.00 0.27 H new ATOM 0 HG13 VAL B 17 -1.849 9.630 -4.985 1.00 0.27 H new ATOM 0 HG21 VAL B 17 1.102 10.539 -4.988 1.00 0.25 H new ATOM 0 HG22 VAL B 17 0.203 10.126 -3.509 1.00 0.25 H new ATOM 0 HG23 VAL B 17 1.732 9.296 -3.882 1.00 0.25 H new ATOM 1215 N ILE B 18 -2.146 5.942 -4.266 1.00 0.19 N ATOM 1216 CA ILE B 18 -2.971 4.916 -4.857 1.00 0.20 C ATOM 1217 C ILE B 18 -4.029 5.537 -5.753 1.00 0.18 C ATOM 1218 O ILE B 18 -4.921 6.252 -5.290 1.00 0.18 O ATOM 1219 CB ILE B 18 -3.625 4.018 -3.776 1.00 0.24 C ATOM 1220 CG1 ILE B 18 -2.616 2.977 -3.283 1.00 0.39 C ATOM 1221 CG2 ILE B 18 -4.887 3.345 -4.309 1.00 0.25 C ATOM 1222 CD1 ILE B 18 -3.203 1.980 -2.310 1.00 0.82 C ATOM 0 H ILE B 18 -2.452 6.245 -3.341 1.00 0.19 H new ATOM 0 HA ILE B 18 -2.328 4.280 -5.465 1.00 0.20 H new ATOM 0 HB ILE B 18 -3.920 4.646 -2.935 1.00 0.24 H new ATOM 0 HG12 ILE B 18 -2.212 2.440 -4.141 1.00 0.39 H new ATOM 0 HG13 ILE B 18 -1.781 3.490 -2.806 1.00 0.39 H new ATOM 0 HG21 ILE B 18 -5.324 2.722 -3.529 1.00 0.25 H new ATOM 0 HG22 ILE B 18 -5.606 4.107 -4.610 1.00 0.25 H new ATOM 0 HG23 ILE B 18 -4.633 2.725 -5.169 1.00 0.25 H new ATOM 0 HD11 ILE B 18 -2.432 1.273 -2.003 1.00 0.82 H new ATOM 0 HD12 ILE B 18 -3.582 2.506 -1.434 1.00 0.82 H new ATOM 0 HD13 ILE B 18 -4.019 1.440 -2.790 1.00 0.82 H new ATOM 1234 N PRO B 19 -3.901 5.314 -7.064 1.00 0.21 N ATOM 1235 CA PRO B 19 -4.900 5.727 -8.039 1.00 0.23 C ATOM 1236 C PRO B 19 -6.299 5.286 -7.653 1.00 0.21 C ATOM 1237 O PRO B 19 -6.503 4.202 -7.095 1.00 0.21 O ATOM 1238 CB PRO B 19 -4.459 5.003 -9.300 1.00 0.28 C ATOM 1239 CG PRO B 19 -2.986 4.950 -9.171 1.00 0.30 C ATOM 1240 CD PRO B 19 -2.741 4.671 -7.717 1.00 0.27 C ATOM 0 HA PRO B 19 -4.956 6.811 -8.136 1.00 0.23 H new ATOM 0 HB2 PRO B 19 -4.893 4.005 -9.362 1.00 0.28 H new ATOM 0 HB3 PRO B 19 -4.764 5.540 -10.198 1.00 0.28 H new ATOM 0 HG2 PRO B 19 -2.561 4.169 -9.801 1.00 0.30 H new ATOM 0 HG3 PRO B 19 -2.528 5.891 -9.477 1.00 0.30 H new ATOM 0 HD2 PRO B 19 -2.701 3.601 -7.511 1.00 0.27 H new ATOM 0 HD3 PRO B 19 -1.797 5.096 -7.376 1.00 0.27 H new ATOM 1248 N LYS B 20 -7.265 6.116 -7.983 1.00 0.23 N ATOM 1249 CA LYS B 20 -8.652 5.828 -7.683 1.00 0.23 C ATOM 1250 C LYS B 20 -9.127 4.562 -8.380 1.00 0.21 C ATOM 1251 O LYS B 20 -10.150 4.021 -8.017 1.00 0.22 O ATOM 1252 CB LYS B 20 -9.566 6.998 -8.052 1.00 0.28 C ATOM 1253 CG LYS B 20 -9.413 7.483 -9.488 1.00 0.39 C ATOM 1254 CD LYS B 20 -8.185 8.361 -9.653 1.00 0.53 C ATOM 1255 CE LYS B 20 -8.372 9.726 -9.007 1.00 0.90 C ATOM 1256 NZ LYS B 20 -7.208 10.615 -9.257 1.00 1.77 N ATOM 0 H LYS B 20 -7.114 7.003 -8.463 1.00 0.23 H new ATOM 0 HA LYS B 20 -8.709 5.672 -6.606 1.00 0.23 H new ATOM 0 HB2 LYS B 20 -10.602 6.700 -7.890 1.00 0.28 H new ATOM 0 HB3 LYS B 20 -9.364 7.829 -7.376 1.00 0.28 H new ATOM 0 HG2 LYS B 20 -9.340 6.625 -10.157 1.00 0.39 H new ATOM 0 HG3 LYS B 20 -10.302 8.041 -9.781 1.00 0.39 H new ATOM 0 HD2 LYS B 20 -7.322 7.865 -9.210 1.00 0.53 H new ATOM 0 HD3 LYS B 20 -7.969 8.488 -10.714 1.00 0.53 H new ATOM 0 HE2 LYS B 20 -9.277 10.192 -9.397 1.00 0.90 H new ATOM 0 HE3 LYS B 20 -8.513 9.604 -7.933 1.00 0.90 H new ATOM 0 HZ1 LYS B 20 -7.371 11.536 -8.802 1.00 1.77 H new ATOM 0 HZ2 LYS B 20 -6.349 10.181 -8.863 1.00 1.77 H new ATOM 0 HZ3 LYS B 20 -7.089 10.751 -10.281 1.00 1.77 H new ATOM 1270 N GLU B 21 -8.378 4.087 -9.371 1.00 0.21 N ATOM 1271 CA GLU B 21 -8.760 2.887 -10.112 1.00 0.20 C ATOM 1272 C GLU B 21 -8.761 1.638 -9.223 1.00 0.20 C ATOM 1273 O GLU B 21 -9.528 0.696 -9.459 1.00 0.20 O ATOM 1274 CB GLU B 21 -7.845 2.685 -11.319 1.00 0.23 C ATOM 1275 CG GLU B 21 -6.372 2.603 -10.976 1.00 0.47 C ATOM 1276 CD GLU B 21 -5.496 2.618 -12.207 1.00 1.08 C ATOM 1277 OE1 GLU B 21 -5.393 1.577 -12.886 1.00 1.53 O ATOM 1278 OE2 GLU B 21 -4.920 3.685 -12.514 1.00 1.92 O ATOM 0 H GLU B 21 -7.504 4.513 -9.680 1.00 0.21 H new ATOM 0 HA GLU B 21 -9.781 3.036 -10.465 1.00 0.20 H new ATOM 0 HB2 GLU B 21 -8.138 1.770 -11.834 1.00 0.23 H new ATOM 0 HB3 GLU B 21 -7.998 3.507 -12.018 1.00 0.23 H new ATOM 0 HG2 GLU B 21 -6.104 3.440 -10.332 1.00 0.47 H new ATOM 0 HG3 GLU B 21 -6.183 1.691 -10.409 1.00 0.47 H new ATOM 1285 N ILE B 22 -7.969 1.646 -8.154 1.00 0.22 N ATOM 1286 CA ILE B 22 -7.898 0.469 -7.304 1.00 0.25 C ATOM 1287 C ILE B 22 -8.988 0.596 -6.252 1.00 0.24 C ATOM 1288 O ILE B 22 -9.745 -0.336 -6.010 1.00 0.24 O ATOM 1289 CB ILE B 22 -6.517 0.263 -6.624 1.00 0.32 C ATOM 1290 CG1 ILE B 22 -5.393 0.252 -7.661 1.00 0.28 C ATOM 1291 CG2 ILE B 22 -6.500 -1.044 -5.832 1.00 0.44 C ATOM 1292 CD1 ILE B 22 -4.857 1.625 -7.980 1.00 0.25 C ATOM 0 H ILE B 22 -7.385 2.430 -7.864 1.00 0.22 H new ATOM 0 HA ILE B 22 -8.040 -0.409 -7.933 1.00 0.25 H new ATOM 0 HB ILE B 22 -6.353 1.097 -5.941 1.00 0.32 H new ATOM 0 HG12 ILE B 22 -4.578 -0.372 -7.295 1.00 0.28 H new ATOM 0 HG13 ILE B 22 -5.760 -0.209 -8.578 1.00 0.28 H new ATOM 0 HG21 ILE B 22 -5.525 -1.172 -5.362 1.00 0.44 H new ATOM 0 HG22 ILE B 22 -7.272 -1.014 -5.063 1.00 0.44 H new ATOM 0 HG23 ILE B 22 -6.691 -1.880 -6.505 1.00 0.44 H new ATOM 0 HD11 ILE B 22 -4.063 1.542 -8.722 1.00 0.25 H new ATOM 0 HD12 ILE B 22 -5.660 2.246 -8.376 1.00 0.25 H new ATOM 0 HD13 ILE B 22 -4.460 2.080 -7.073 1.00 0.25 H new ATOM 1304 N ARG B 23 -9.091 1.800 -5.687 1.00 0.24 N ATOM 1305 CA ARG B 23 -10.156 2.151 -4.748 1.00 0.23 C ATOM 1306 C ARG B 23 -11.508 1.981 -5.426 1.00 0.22 C ATOM 1307 O ARG B 23 -12.511 1.649 -4.795 1.00 0.23 O ATOM 1308 CB ARG B 23 -9.919 3.595 -4.249 1.00 0.26 C ATOM 1309 CG ARG B 23 -11.164 4.457 -4.061 1.00 0.50 C ATOM 1310 CD ARG B 23 -11.618 5.090 -5.368 1.00 0.35 C ATOM 1311 NE ARG B 23 -11.851 6.532 -5.257 1.00 0.85 N ATOM 1312 CZ ARG B 23 -12.632 7.227 -6.086 1.00 0.95 C ATOM 1313 NH1 ARG B 23 -13.352 6.609 -7.016 1.00 1.36 N ATOM 1314 NH2 ARG B 23 -12.711 8.544 -5.974 1.00 1.40 N ATOM 0 H ARG B 23 -8.436 2.561 -5.869 1.00 0.24 H new ATOM 0 HA ARG B 23 -10.148 1.491 -3.881 1.00 0.23 H new ATOM 0 HB2 ARG B 23 -9.390 3.546 -3.297 1.00 0.26 H new ATOM 0 HB3 ARG B 23 -9.258 4.097 -4.956 1.00 0.26 H new ATOM 0 HG2 ARG B 23 -11.970 3.847 -3.654 1.00 0.50 H new ATOM 0 HG3 ARG B 23 -10.957 5.240 -3.331 1.00 0.50 H new ATOM 0 HD2 ARG B 23 -10.865 4.908 -6.134 1.00 0.35 H new ATOM 0 HD3 ARG B 23 -12.535 4.604 -5.701 1.00 0.35 H new ATOM 0 HE ARG B 23 -11.388 7.035 -4.500 1.00 0.85 H new ATOM 0 HH11 ARG B 23 -13.311 5.593 -7.101 1.00 1.36 H new ATOM 0 HH12 ARG B 23 -13.946 7.150 -7.645 1.00 1.36 H new ATOM 0 HH21 ARG B 23 -12.175 9.028 -5.254 1.00 1.40 H new ATOM 0 HH22 ARG B 23 -13.308 9.075 -6.608 1.00 1.40 H new ATOM 1328 N ARG B 24 -11.506 2.203 -6.725 1.00 0.22 N ATOM 1329 CA ARG B 24 -12.682 2.035 -7.551 1.00 0.25 C ATOM 1330 C ARG B 24 -13.072 0.575 -7.638 1.00 0.26 C ATOM 1331 O ARG B 24 -14.234 0.236 -7.419 1.00 0.28 O ATOM 1332 CB ARG B 24 -12.439 2.601 -8.945 1.00 0.29 C ATOM 1333 CG ARG B 24 -13.519 2.257 -9.944 1.00 0.42 C ATOM 1334 CD ARG B 24 -13.300 3.005 -11.248 1.00 0.55 C ATOM 1335 NE ARG B 24 -14.340 2.718 -12.230 1.00 1.47 N ATOM 1336 CZ ARG B 24 -15.206 3.622 -12.682 1.00 2.06 C ATOM 1337 NH1 ARG B 24 -15.171 4.870 -12.233 1.00 1.83 N ATOM 1338 NH2 ARG B 24 -16.104 3.283 -13.596 1.00 3.19 N ATOM 0 H ARG B 24 -10.680 2.508 -7.240 1.00 0.22 H new ATOM 0 HA ARG B 24 -13.503 2.583 -7.090 1.00 0.25 H new ATOM 0 HB2 ARG B 24 -12.354 3.685 -8.876 1.00 0.29 H new ATOM 0 HB3 ARG B 24 -11.484 2.229 -9.316 1.00 0.29 H new ATOM 0 HG2 ARG B 24 -13.521 1.183 -10.131 1.00 0.42 H new ATOM 0 HG3 ARG B 24 -14.496 2.511 -9.533 1.00 0.42 H new ATOM 0 HD2 ARG B 24 -13.275 4.077 -11.050 1.00 0.55 H new ATOM 0 HD3 ARG B 24 -12.328 2.735 -11.661 1.00 0.55 H new ATOM 0 HE ARG B 24 -14.408 1.767 -12.592 1.00 1.47 H new ATOM 0 HH11 ARG B 24 -14.477 5.142 -11.537 1.00 1.83 H new ATOM 0 HH12 ARG B 24 -15.838 5.557 -12.584 1.00 1.83 H new ATOM 0 HH21 ARG B 24 -16.132 2.328 -13.954 1.00 3.19 H new ATOM 0 HH22 ARG B 24 -16.767 3.977 -13.941 1.00 3.19 H new ATOM 1352 N THR B 25 -12.117 -0.305 -7.955 1.00 0.26 N ATOM 1353 CA THR B 25 -12.396 -1.731 -7.983 1.00 0.29 C ATOM 1354 C THR B 25 -12.727 -2.233 -6.571 1.00 0.28 C ATOM 1355 O THR B 25 -13.431 -3.227 -6.392 1.00 0.33 O ATOM 1356 CB THR B 25 -11.183 -2.510 -8.540 1.00 0.32 C ATOM 1357 OG1 THR B 25 -10.769 -1.940 -9.794 1.00 0.35 O ATOM 1358 CG2 THR B 25 -11.516 -3.981 -8.741 1.00 0.40 C ATOM 0 H THR B 25 -11.158 -0.052 -8.192 1.00 0.26 H new ATOM 0 HA THR B 25 -13.253 -1.900 -8.635 1.00 0.29 H new ATOM 0 HB THR B 25 -10.374 -2.435 -7.813 1.00 0.32 H new ATOM 0 HG1 THR B 25 -10.320 -1.084 -9.632 1.00 0.35 H new ATOM 0 HG21 THR B 25 -10.642 -4.501 -9.134 1.00 0.40 H new ATOM 0 HG22 THR B 25 -11.803 -4.423 -7.787 1.00 0.40 H new ATOM 0 HG23 THR B 25 -12.341 -4.074 -9.447 1.00 0.40 H new ATOM 1366 N LEU B 26 -12.205 -1.522 -5.576 1.00 0.26 N ATOM 1367 CA LEU B 26 -12.534 -1.764 -4.177 1.00 0.26 C ATOM 1368 C LEU B 26 -14.001 -1.441 -3.901 1.00 0.26 C ATOM 1369 O LEU B 26 -14.557 -1.879 -2.892 1.00 0.29 O ATOM 1370 CB LEU B 26 -11.645 -0.897 -3.281 1.00 0.24 C ATOM 1371 CG LEU B 26 -10.525 -1.641 -2.550 1.00 0.27 C ATOM 1372 CD1 LEU B 26 -11.072 -2.896 -1.902 1.00 0.33 C ATOM 1373 CD2 LEU B 26 -9.387 -1.983 -3.497 1.00 0.27 C ATOM 0 H LEU B 26 -11.541 -0.761 -5.718 1.00 0.26 H new ATOM 0 HA LEU B 26 -12.362 -2.818 -3.960 1.00 0.26 H new ATOM 0 HB2 LEU B 26 -11.198 -0.112 -3.892 1.00 0.24 H new ATOM 0 HB3 LEU B 26 -12.275 -0.405 -2.540 1.00 0.24 H new ATOM 0 HG LEU B 26 -10.128 -0.987 -1.774 1.00 0.27 H new ATOM 0 HD11 LEU B 26 -10.268 -3.418 -1.384 1.00 0.33 H new ATOM 0 HD12 LEU B 26 -11.849 -2.627 -1.187 1.00 0.33 H new ATOM 0 HD13 LEU B 26 -11.493 -3.547 -2.668 1.00 0.33 H new ATOM 0 HD21 LEU B 26 -8.605 -2.511 -2.951 1.00 0.27 H new ATOM 0 HD22 LEU B 26 -9.761 -2.618 -4.300 1.00 0.27 H new ATOM 0 HD23 LEU B 26 -8.978 -1.066 -3.920 1.00 0.27 H new ATOM 1385 N ARG B 27 -14.616 -0.682 -4.815 1.00 0.27 N ATOM 1386 CA ARG B 27 -15.973 -0.172 -4.645 1.00 0.32 C ATOM 1387 C ARG B 27 -16.016 0.825 -3.490 1.00 0.31 C ATOM 1388 O ARG B 27 -17.051 1.025 -2.851 1.00 0.34 O ATOM 1389 CB ARG B 27 -16.966 -1.316 -4.418 1.00 0.37 C ATOM 1390 CG ARG B 27 -17.491 -1.957 -5.700 1.00 0.75 C ATOM 1391 CD ARG B 27 -16.401 -2.687 -6.471 1.00 1.00 C ATOM 1392 NE ARG B 27 -16.909 -3.290 -7.705 1.00 1.79 N ATOM 1393 CZ ARG B 27 -16.283 -4.249 -8.389 1.00 2.41 C ATOM 1394 NH1 ARG B 27 -15.107 -4.712 -7.982 1.00 2.67 N ATOM 1395 NH2 ARG B 27 -16.833 -4.730 -9.496 1.00 3.28 N ATOM 0 H ARG B 27 -14.181 -0.406 -5.695 1.00 0.27 H new ATOM 0 HA ARG B 27 -16.267 0.342 -5.560 1.00 0.32 H new ATOM 0 HB2 ARG B 27 -16.485 -2.084 -3.812 1.00 0.37 H new ATOM 0 HB3 ARG B 27 -17.811 -0.939 -3.842 1.00 0.37 H new ATOM 0 HG2 ARG B 27 -18.289 -2.657 -5.453 1.00 0.75 H new ATOM 0 HG3 ARG B 27 -17.928 -1.187 -6.335 1.00 0.75 H new ATOM 0 HD2 ARG B 27 -15.599 -1.989 -6.712 1.00 1.00 H new ATOM 0 HD3 ARG B 27 -15.969 -3.463 -5.840 1.00 1.00 H new ATOM 0 HE ARG B 27 -17.802 -2.954 -8.066 1.00 1.79 H new ATOM 0 HH11 ARG B 27 -14.674 -4.334 -7.139 1.00 2.67 H new ATOM 0 HH12 ARG B 27 -14.637 -5.445 -8.512 1.00 2.67 H new ATOM 0 HH21 ARG B 27 -17.729 -4.367 -9.820 1.00 3.28 H new ATOM 0 HH22 ARG B 27 -16.360 -5.463 -10.024 1.00 3.28 H new ATOM 1409 N ILE B 28 -14.878 1.459 -3.244 1.00 0.29 N ATOM 1410 CA ILE B 28 -14.745 2.431 -2.168 1.00 0.30 C ATOM 1411 C ILE B 28 -14.349 3.796 -2.750 1.00 0.30 C ATOM 1412 O ILE B 28 -14.422 3.997 -3.961 1.00 0.33 O ATOM 1413 CB ILE B 28 -13.712 1.943 -1.122 1.00 0.31 C ATOM 1414 CG1 ILE B 28 -13.858 0.429 -0.930 1.00 0.34 C ATOM 1415 CG2 ILE B 28 -13.928 2.644 0.213 1.00 0.34 C ATOM 1416 CD1 ILE B 28 -12.894 -0.171 0.066 1.00 0.37 C ATOM 0 H ILE B 28 -14.024 1.315 -3.783 1.00 0.29 H new ATOM 0 HA ILE B 28 -15.703 2.539 -1.659 1.00 0.30 H new ATOM 0 HB ILE B 28 -12.711 2.178 -1.483 1.00 0.31 H new ATOM 0 HG12 ILE B 28 -14.876 0.213 -0.607 1.00 0.34 H new ATOM 0 HG13 ILE B 28 -13.718 -0.062 -1.893 1.00 0.34 H new ATOM 0 HG21 ILE B 28 -13.193 2.288 0.934 1.00 0.34 H new ATOM 0 HG22 ILE B 28 -13.815 3.720 0.081 1.00 0.34 H new ATOM 0 HG23 ILE B 28 -14.931 2.427 0.580 1.00 0.34 H new ATOM 0 HD11 ILE B 28 -13.068 -1.245 0.139 1.00 0.37 H new ATOM 0 HD12 ILE B 28 -11.871 0.010 -0.264 1.00 0.37 H new ATOM 0 HD13 ILE B 28 -13.047 0.289 1.043 1.00 0.37 H new ATOM 1428 N ARG B 29 -13.944 4.727 -1.896 1.00 0.28 N ATOM 1429 CA ARG B 29 -13.624 6.086 -2.324 1.00 0.30 C ATOM 1430 C ARG B 29 -12.624 6.731 -1.380 1.00 0.27 C ATOM 1431 O ARG B 29 -11.885 6.032 -0.688 1.00 0.25 O ATOM 1432 CB ARG B 29 -14.907 6.932 -2.433 1.00 0.33 C ATOM 1433 CG ARG B 29 -15.917 6.725 -1.304 1.00 0.57 C ATOM 1434 CD ARG B 29 -15.285 6.869 0.073 1.00 0.59 C ATOM 1435 NE ARG B 29 -16.274 6.831 1.152 1.00 1.03 N ATOM 1436 CZ ARG B 29 -16.342 5.876 2.081 1.00 1.47 C ATOM 1437 NH1 ARG B 29 -15.547 4.816 2.012 1.00 2.15 N ATOM 1438 NH2 ARG B 29 -17.226 5.969 3.064 1.00 1.99 N ATOM 0 H ARG B 29 -13.828 4.566 -0.896 1.00 0.28 H new ATOM 0 HA ARG B 29 -13.164 6.036 -3.311 1.00 0.30 H new ATOM 0 HB2 ARG B 29 -14.628 7.985 -2.462 1.00 0.33 H new ATOM 0 HB3 ARG B 29 -15.394 6.705 -3.382 1.00 0.33 H new ATOM 0 HG2 ARG B 29 -16.726 7.448 -1.407 1.00 0.57 H new ATOM 0 HG3 ARG B 29 -16.362 5.734 -1.395 1.00 0.57 H new ATOM 0 HD2 ARG B 29 -14.560 6.069 0.221 1.00 0.59 H new ATOM 0 HD3 ARG B 29 -14.736 7.810 0.121 1.00 0.59 H new ATOM 0 HE ARG B 29 -16.958 7.586 1.196 1.00 1.03 H new ATOM 0 HH11 ARG B 29 -14.879 4.728 1.246 1.00 2.15 H new ATOM 0 HH12 ARG B 29 -15.603 4.089 2.725 1.00 2.15 H new ATOM 0 HH21 ARG B 29 -17.855 6.771 3.110 1.00 1.99 H new ATOM 0 HH22 ARG B 29 -17.278 5.239 3.774 1.00 1.99 H new ATOM 1452 N GLU B 30 -12.626 8.060 -1.339 1.00 0.30 N ATOM 1453 CA GLU B 30 -11.710 8.823 -0.498 1.00 0.31 C ATOM 1454 C GLU B 30 -12.091 8.746 0.978 1.00 0.30 C ATOM 1455 O GLU B 30 -12.002 9.719 1.729 1.00 0.36 O ATOM 1456 CB GLU B 30 -11.657 10.267 -0.968 1.00 0.39 C ATOM 1457 CG GLU B 30 -10.729 10.459 -2.151 1.00 0.44 C ATOM 1458 CD GLU B 30 -11.245 9.825 -3.424 1.00 0.55 C ATOM 1459 OE1 GLU B 30 -10.976 8.629 -3.662 1.00 1.08 O ATOM 1460 OE2 GLU B 30 -11.949 10.517 -4.186 1.00 1.18 O ATOM 0 H GLU B 30 -13.263 8.638 -1.888 1.00 0.30 H new ATOM 0 HA GLU B 30 -10.719 8.380 -0.594 1.00 0.31 H new ATOM 0 HB2 GLU B 30 -12.660 10.594 -1.241 1.00 0.39 H new ATOM 0 HB3 GLU B 30 -11.328 10.902 -0.145 1.00 0.39 H new ATOM 0 HG2 GLU B 30 -10.581 11.526 -2.319 1.00 0.44 H new ATOM 0 HG3 GLU B 30 -9.754 10.035 -1.912 1.00 0.44 H new ATOM 1467 N GLY B 31 -12.504 7.551 1.371 1.00 0.26 N ATOM 1468 CA GLY B 31 -12.764 7.232 2.753 1.00 0.26 C ATOM 1469 C GLY B 31 -12.531 5.754 3.005 1.00 0.27 C ATOM 1470 O GLY B 31 -13.134 5.157 3.894 1.00 0.35 O ATOM 0 H GLY B 31 -12.667 6.775 0.730 1.00 0.26 H new ATOM 0 HA2 GLY B 31 -12.116 7.825 3.398 1.00 0.26 H new ATOM 0 HA3 GLY B 31 -13.791 7.494 3.007 1.00 0.26 H new ATOM 1474 N ASP B 32 -11.661 5.167 2.191 1.00 0.27 N ATOM 1475 CA ASP B 32 -11.271 3.768 2.339 1.00 0.29 C ATOM 1476 C ASP B 32 -10.200 3.640 3.407 1.00 0.26 C ATOM 1477 O ASP B 32 -9.140 4.262 3.325 1.00 0.29 O ATOM 1478 CB ASP B 32 -10.760 3.223 1.011 1.00 0.35 C ATOM 1479 CG ASP B 32 -10.274 1.787 1.098 1.00 0.41 C ATOM 1480 OD1 ASP B 32 -10.803 1.023 1.931 1.00 1.07 O ATOM 1481 OD2 ASP B 32 -9.374 1.424 0.318 1.00 1.29 O ATOM 0 H ASP B 32 -11.207 5.645 1.412 1.00 0.27 H new ATOM 0 HA ASP B 32 -12.142 3.187 2.642 1.00 0.29 H new ATOM 0 HB2 ASP B 32 -11.557 3.285 0.270 1.00 0.35 H new ATOM 0 HB3 ASP B 32 -9.945 3.854 0.657 1.00 0.35 H new ATOM 1486 N PRO B 33 -10.490 2.856 4.437 1.00 0.21 N ATOM 1487 CA PRO B 33 -9.604 2.655 5.567 1.00 0.24 C ATOM 1488 C PRO B 33 -8.610 1.540 5.359 1.00 0.41 C ATOM 1489 O PRO B 33 -8.728 0.503 5.959 1.00 1.10 O ATOM 1490 CB PRO B 33 -10.534 2.230 6.695 1.00 0.19 C ATOM 1491 CG PRO B 33 -11.894 2.029 6.080 1.00 0.12 C ATOM 1492 CD PRO B 33 -11.724 2.099 4.584 1.00 0.20 C ATOM 0 HA PRO B 33 -9.025 3.560 5.748 1.00 0.24 H new ATOM 0 HB2 PRO B 33 -10.181 1.311 7.163 1.00 0.19 H new ATOM 0 HB3 PRO B 33 -10.570 2.991 7.475 1.00 0.19 H new ATOM 0 HG2 PRO B 33 -12.311 1.066 6.375 1.00 0.12 H new ATOM 0 HG3 PRO B 33 -12.588 2.795 6.424 1.00 0.12 H new ATOM 0 HD2 PRO B 33 -11.646 1.107 4.139 1.00 0.20 H new ATOM 0 HD3 PRO B 33 -12.565 2.599 4.104 1.00 0.20 H new ATOM 1500 N LEU B 34 -7.637 1.720 4.538 1.00 0.25 N ATOM 1501 CA LEU B 34 -6.750 0.615 4.298 1.00 0.19 C ATOM 1502 C LEU B 34 -5.868 0.338 5.508 1.00 0.19 C ATOM 1503 O LEU B 34 -5.516 1.226 6.255 1.00 0.22 O ATOM 1504 CB LEU B 34 -5.880 0.812 3.052 1.00 0.19 C ATOM 1505 CG LEU B 34 -6.600 1.282 1.785 1.00 0.27 C ATOM 1506 CD1 LEU B 34 -6.694 2.801 1.744 1.00 0.32 C ATOM 1507 CD2 LEU B 34 -5.895 0.757 0.544 1.00 0.44 C ATOM 0 H LEU B 34 -7.431 2.582 4.034 1.00 0.25 H new ATOM 0 HA LEU B 34 -7.390 -0.249 4.119 1.00 0.19 H new ATOM 0 HB2 LEU B 34 -5.101 1.536 3.291 1.00 0.19 H new ATOM 0 HB3 LEU B 34 -5.381 -0.132 2.831 1.00 0.19 H new ATOM 0 HG LEU B 34 -7.613 0.881 1.803 1.00 0.27 H new ATOM 0 HD11 LEU B 34 -7.209 3.109 0.834 1.00 0.32 H new ATOM 0 HD12 LEU B 34 -7.249 3.155 2.613 1.00 0.32 H new ATOM 0 HD13 LEU B 34 -5.691 3.228 1.755 1.00 0.32 H new ATOM 0 HD21 LEU B 34 -6.421 1.101 -0.346 1.00 0.44 H new ATOM 0 HD22 LEU B 34 -4.869 1.126 0.525 1.00 0.44 H new ATOM 0 HD23 LEU B 34 -5.889 -0.333 0.563 1.00 0.44 H new ATOM 1519 N GLU B 35 -5.484 -0.908 5.623 1.00 0.18 N ATOM 1520 CA GLU B 35 -4.678 -1.374 6.736 1.00 0.17 C ATOM 1521 C GLU B 35 -3.311 -1.667 6.221 1.00 0.13 C ATOM 1522 O GLU B 35 -3.153 -2.565 5.411 1.00 0.12 O ATOM 1523 CB GLU B 35 -5.253 -2.623 7.408 1.00 0.20 C ATOM 1524 CG GLU B 35 -4.392 -3.154 8.547 1.00 0.21 C ATOM 1525 CD GLU B 35 -4.998 -4.366 9.236 1.00 0.28 C ATOM 1526 OE1 GLU B 35 -4.990 -5.461 8.636 1.00 1.10 O ATOM 1527 OE2 GLU B 35 -5.477 -4.226 10.380 1.00 1.09 O ATOM 0 H GLU B 35 -5.720 -1.635 4.948 1.00 0.18 H new ATOM 0 HA GLU B 35 -4.663 -0.593 7.496 1.00 0.17 H new ATOM 0 HB2 GLU B 35 -6.247 -2.394 7.792 1.00 0.20 H new ATOM 0 HB3 GLU B 35 -5.373 -3.406 6.659 1.00 0.20 H new ATOM 0 HG2 GLU B 35 -3.408 -3.418 8.159 1.00 0.21 H new ATOM 0 HG3 GLU B 35 -4.243 -2.363 9.281 1.00 0.21 H new ATOM 1534 N ILE B 36 -2.352 -0.888 6.675 1.00 0.12 N ATOM 1535 CA ILE B 36 -0.988 -0.981 6.220 1.00 0.11 C ATOM 1536 C ILE B 36 -0.226 -1.989 7.063 1.00 0.11 C ATOM 1537 O ILE B 36 0.007 -1.763 8.252 1.00 0.14 O ATOM 1538 CB ILE B 36 -0.316 0.397 6.315 1.00 0.13 C ATOM 1539 CG1 ILE B 36 -1.085 1.387 5.443 1.00 0.15 C ATOM 1540 CG2 ILE B 36 1.151 0.330 5.915 1.00 0.17 C ATOM 1541 CD1 ILE B 36 -0.400 2.716 5.290 1.00 0.62 C ATOM 0 H ILE B 36 -2.503 -0.165 7.379 1.00 0.12 H new ATOM 0 HA ILE B 36 -0.980 -1.313 5.182 1.00 0.11 H new ATOM 0 HB ILE B 36 -0.342 0.736 7.351 1.00 0.13 H new ATOM 0 HG12 ILE B 36 -1.234 0.949 4.456 1.00 0.15 H new ATOM 0 HG13 ILE B 36 -2.074 1.545 5.874 1.00 0.15 H new ATOM 0 HG21 ILE B 36 1.595 1.322 5.994 1.00 0.17 H new ATOM 0 HG22 ILE B 36 1.678 -0.357 6.577 1.00 0.17 H new ATOM 0 HG23 ILE B 36 1.232 -0.023 4.887 1.00 0.17 H new ATOM 0 HD11 ILE B 36 -1.005 3.366 4.658 1.00 0.62 H new ATOM 0 HD12 ILE B 36 -0.275 3.176 6.270 1.00 0.62 H new ATOM 0 HD13 ILE B 36 0.578 2.571 4.831 1.00 0.62 H new ATOM 1553 N PHE B 37 0.110 -3.114 6.466 1.00 0.10 N ATOM 1554 CA PHE B 37 0.935 -4.107 7.129 1.00 0.11 C ATOM 1555 C PHE B 37 1.741 -4.870 6.095 1.00 0.10 C ATOM 1556 O PHE B 37 1.201 -5.351 5.111 1.00 0.10 O ATOM 1557 CB PHE B 37 0.089 -5.048 8.011 1.00 0.12 C ATOM 1558 CG PHE B 37 -0.327 -6.349 7.373 1.00 0.21 C ATOM 1559 CD1 PHE B 37 -1.475 -6.431 6.607 1.00 1.09 C ATOM 1560 CD2 PHE B 37 0.439 -7.491 7.550 1.00 1.16 C ATOM 1561 CE1 PHE B 37 -1.851 -7.629 6.030 1.00 1.14 C ATOM 1562 CE2 PHE B 37 0.069 -8.688 6.976 1.00 1.20 C ATOM 1563 CZ PHE B 37 -1.077 -8.758 6.214 1.00 0.49 C ATOM 0 H PHE B 37 -0.176 -3.365 5.520 1.00 0.10 H new ATOM 0 HA PHE B 37 1.628 -3.599 7.800 1.00 0.11 H new ATOM 0 HB2 PHE B 37 0.654 -5.273 8.915 1.00 0.12 H new ATOM 0 HB3 PHE B 37 -0.809 -4.514 8.321 1.00 0.12 H new ATOM 0 HD1 PHE B 37 -2.083 -5.551 6.458 1.00 1.09 H new ATOM 0 HD2 PHE B 37 1.338 -7.442 8.146 1.00 1.16 H new ATOM 0 HE1 PHE B 37 -2.751 -7.683 5.435 1.00 1.14 H new ATOM 0 HE2 PHE B 37 0.676 -9.569 7.123 1.00 1.20 H new ATOM 0 HZ PHE B 37 -1.369 -9.694 5.761 1.00 0.49 H new ATOM 1573 N VAL B 38 3.034 -4.966 6.310 1.00 0.10 N ATOM 1574 CA VAL B 38 3.898 -5.652 5.363 1.00 0.10 C ATOM 1575 C VAL B 38 3.807 -7.158 5.562 1.00 0.13 C ATOM 1576 O VAL B 38 3.671 -7.631 6.687 1.00 0.20 O ATOM 1577 CB VAL B 38 5.371 -5.156 5.470 1.00 0.13 C ATOM 1578 CG1 VAL B 38 5.767 -4.909 6.921 1.00 0.18 C ATOM 1579 CG2 VAL B 38 6.345 -6.138 4.819 1.00 0.17 C ATOM 0 H VAL B 38 3.512 -4.582 7.125 1.00 0.10 H new ATOM 0 HA VAL B 38 3.553 -5.416 4.356 1.00 0.10 H new ATOM 0 HB VAL B 38 5.428 -4.211 4.929 1.00 0.13 H new ATOM 0 HG11 VAL B 38 6.800 -4.564 6.963 1.00 0.18 H new ATOM 0 HG12 VAL B 38 5.113 -4.151 7.352 1.00 0.18 H new ATOM 0 HG13 VAL B 38 5.671 -5.836 7.487 1.00 0.18 H new ATOM 0 HG21 VAL B 38 7.362 -5.758 4.913 1.00 0.17 H new ATOM 0 HG22 VAL B 38 6.272 -7.106 5.315 1.00 0.17 H new ATOM 0 HG23 VAL B 38 6.097 -6.251 3.764 1.00 0.17 H new ATOM 1589 N ASP B 39 3.840 -7.891 4.456 1.00 0.14 N ATOM 1590 CA ASP B 39 3.657 -9.340 4.477 1.00 0.19 C ATOM 1591 C ASP B 39 4.969 -10.072 4.699 1.00 0.42 C ATOM 1592 O ASP B 39 5.049 -10.990 5.514 1.00 1.05 O ATOM 1593 CB ASP B 39 3.054 -9.822 3.160 1.00 0.26 C ATOM 1594 CG ASP B 39 2.705 -11.296 3.194 1.00 0.32 C ATOM 1595 OD1 ASP B 39 1.875 -11.698 4.032 1.00 1.14 O ATOM 1596 OD2 ASP B 39 3.279 -12.067 2.395 1.00 1.13 O ATOM 0 H ASP B 39 3.993 -7.503 3.525 1.00 0.14 H new ATOM 0 HA ASP B 39 2.984 -9.560 5.305 1.00 0.19 H new ATOM 0 HB2 ASP B 39 2.157 -9.243 2.940 1.00 0.26 H new ATOM 0 HB3 ASP B 39 3.760 -9.636 2.350 1.00 0.26 H new ATOM 1601 N ARG B 40 5.997 -9.678 3.961 1.00 0.46 N ATOM 1602 CA ARG B 40 7.272 -10.370 4.027 1.00 0.54 C ATOM 1603 C ARG B 40 8.456 -9.411 4.061 1.00 0.52 C ATOM 1604 O ARG B 40 8.760 -8.834 5.102 1.00 0.59 O ATOM 1605 CB ARG B 40 7.402 -11.369 2.875 1.00 0.65 C ATOM 1606 CG ARG B 40 6.781 -10.886 1.578 1.00 0.75 C ATOM 1607 CD ARG B 40 5.915 -11.966 0.952 1.00 0.77 C ATOM 1608 NE ARG B 40 6.697 -13.116 0.484 1.00 1.29 N ATOM 1609 CZ ARG B 40 6.630 -14.338 1.019 1.00 2.04 C ATOM 1610 NH1 ARG B 40 5.849 -14.565 2.070 1.00 2.59 N ATOM 1611 NH2 ARG B 40 7.347 -15.334 0.505 1.00 2.71 N ATOM 0 H ARG B 40 5.972 -8.889 3.315 1.00 0.46 H new ATOM 0 HA ARG B 40 7.292 -10.919 4.968 1.00 0.54 H new ATOM 0 HB2 ARG B 40 8.458 -11.580 2.706 1.00 0.65 H new ATOM 0 HB3 ARG B 40 6.932 -12.309 3.165 1.00 0.65 H new ATOM 0 HG2 ARG B 40 6.179 -9.997 1.768 1.00 0.75 H new ATOM 0 HG3 ARG B 40 7.567 -10.596 0.881 1.00 0.75 H new ATOM 0 HD2 ARG B 40 5.179 -12.304 1.681 1.00 0.77 H new ATOM 0 HD3 ARG B 40 5.362 -11.542 0.114 1.00 0.77 H new ATOM 0 HE ARG B 40 7.333 -12.973 -0.301 1.00 1.29 H new ATOM 0 HH11 ARG B 40 5.299 -13.805 2.470 1.00 2.59 H new ATOM 0 HH12 ARG B 40 5.800 -15.499 2.477 1.00 2.59 H new ATOM 0 HH21 ARG B 40 7.950 -15.166 -0.300 1.00 2.71 H new ATOM 0 HH22 ARG B 40 7.293 -16.266 0.916 1.00 2.71 H new ATOM 1625 N ASP B 41 9.110 -9.231 2.921 1.00 0.53 N ATOM 1626 CA ASP B 41 10.326 -8.431 2.863 1.00 0.56 C ATOM 1627 C ASP B 41 10.014 -6.946 2.915 1.00 0.48 C ATOM 1628 O ASP B 41 10.212 -6.290 3.937 1.00 0.59 O ATOM 1629 CB ASP B 41 11.118 -8.751 1.595 1.00 0.59 C ATOM 1630 CG ASP B 41 12.379 -7.915 1.482 1.00 0.62 C ATOM 1631 OD1 ASP B 41 13.372 -8.240 2.165 1.00 1.18 O ATOM 1632 OD2 ASP B 41 12.380 -6.930 0.714 1.00 1.32 O ATOM 0 H ASP B 41 8.820 -9.627 2.027 1.00 0.53 H new ATOM 0 HA ASP B 41 10.929 -8.684 3.735 1.00 0.56 H new ATOM 0 HB2 ASP B 41 11.383 -9.808 1.591 1.00 0.59 H new ATOM 0 HB3 ASP B 41 10.489 -8.577 0.722 1.00 0.59 H new ATOM 1637 N GLY B 42 9.517 -6.427 1.812 1.00 0.34 N ATOM 1638 CA GLY B 42 9.204 -5.020 1.732 1.00 0.26 C ATOM 1639 C GLY B 42 7.880 -4.789 1.055 1.00 0.18 C ATOM 1640 O GLY B 42 7.650 -3.738 0.467 1.00 0.17 O ATOM 0 H GLY B 42 9.322 -6.958 0.963 1.00 0.34 H new ATOM 0 HA2 GLY B 42 9.181 -4.593 2.735 1.00 0.26 H new ATOM 0 HA3 GLY B 42 9.990 -4.502 1.183 1.00 0.26 H new ATOM 1644 N GLU B 43 7.019 -5.792 1.118 1.00 0.15 N ATOM 1645 CA GLU B 43 5.704 -5.691 0.520 1.00 0.12 C ATOM 1646 C GLU B 43 4.705 -5.236 1.556 1.00 0.09 C ATOM 1647 O GLU B 43 4.374 -5.990 2.466 1.00 0.09 O ATOM 1648 CB GLU B 43 5.246 -7.030 -0.044 1.00 0.16 C ATOM 1649 CG GLU B 43 6.374 -7.905 -0.549 1.00 0.57 C ATOM 1650 CD GLU B 43 5.909 -8.900 -1.584 1.00 1.17 C ATOM 1651 OE1 GLU B 43 5.277 -9.904 -1.206 1.00 1.65 O ATOM 1652 OE2 GLU B 43 6.169 -8.669 -2.783 1.00 2.07 O ATOM 0 H GLU B 43 7.210 -6.683 1.577 1.00 0.15 H new ATOM 0 HA GLU B 43 5.765 -4.968 -0.294 1.00 0.12 H new ATOM 0 HB2 GLU B 43 4.699 -7.570 0.729 1.00 0.16 H new ATOM 0 HB3 GLU B 43 4.547 -6.849 -0.861 1.00 0.16 H new ATOM 0 HG2 GLU B 43 7.154 -7.276 -0.978 1.00 0.57 H new ATOM 0 HG3 GLU B 43 6.820 -8.439 0.290 1.00 0.57 H new ATOM 1659 N VAL B 44 4.241 -4.014 1.434 1.00 0.08 N ATOM 1660 CA VAL B 44 3.246 -3.501 2.348 1.00 0.07 C ATOM 1661 C VAL B 44 1.863 -3.823 1.824 1.00 0.07 C ATOM 1662 O VAL B 44 1.559 -3.571 0.670 1.00 0.08 O ATOM 1663 CB VAL B 44 3.343 -1.983 2.541 1.00 0.09 C ATOM 1664 CG1 VAL B 44 2.817 -1.606 3.911 1.00 0.10 C ATOM 1665 CG2 VAL B 44 4.769 -1.489 2.351 1.00 0.13 C ATOM 0 H VAL B 44 4.536 -3.357 0.712 1.00 0.08 H new ATOM 0 HA VAL B 44 3.429 -3.978 3.311 1.00 0.07 H new ATOM 0 HB VAL B 44 2.730 -1.499 1.781 1.00 0.09 H new ATOM 0 HG11 VAL B 44 2.888 -0.526 4.044 1.00 0.10 H new ATOM 0 HG12 VAL B 44 1.775 -1.915 3.998 1.00 0.10 H new ATOM 0 HG13 VAL B 44 3.409 -2.105 4.678 1.00 0.10 H new ATOM 0 HG21 VAL B 44 4.802 -0.409 2.495 1.00 0.13 H new ATOM 0 HG22 VAL B 44 5.421 -1.972 3.078 1.00 0.13 H new ATOM 0 HG23 VAL B 44 5.107 -1.731 1.343 1.00 0.13 H new ATOM 1675 N ILE B 45 1.035 -4.365 2.680 1.00 0.07 N ATOM 1676 CA ILE B 45 -0.300 -4.779 2.305 1.00 0.08 C ATOM 1677 C ILE B 45 -1.291 -3.834 2.947 1.00 0.09 C ATOM 1678 O ILE B 45 -1.307 -3.698 4.163 1.00 0.11 O ATOM 1679 CB ILE B 45 -0.600 -6.219 2.766 1.00 0.10 C ATOM 1680 CG1 ILE B 45 0.136 -7.245 1.893 1.00 0.10 C ATOM 1681 CG2 ILE B 45 -2.103 -6.491 2.749 1.00 0.12 C ATOM 1682 CD1 ILE B 45 1.641 -7.144 1.918 1.00 0.09 C ATOM 0 H ILE B 45 1.264 -4.534 3.659 1.00 0.07 H new ATOM 0 HA ILE B 45 -0.380 -4.753 1.218 1.00 0.08 H new ATOM 0 HB ILE B 45 -0.239 -6.321 3.789 1.00 0.10 H new ATOM 0 HG12 ILE B 45 -0.151 -8.246 2.216 1.00 0.10 H new ATOM 0 HG13 ILE B 45 -0.203 -7.133 0.863 1.00 0.10 H new ATOM 0 HG21 ILE B 45 -2.292 -7.513 3.078 1.00 0.12 H new ATOM 0 HG22 ILE B 45 -2.606 -5.795 3.420 1.00 0.12 H new ATOM 0 HG23 ILE B 45 -2.485 -6.359 1.737 1.00 0.12 H new ATOM 0 HD11 ILE B 45 2.068 -7.910 1.271 1.00 0.09 H new ATOM 0 HD12 ILE B 45 1.945 -6.159 1.564 1.00 0.09 H new ATOM 0 HD13 ILE B 45 1.999 -7.290 2.937 1.00 0.09 H new ATOM 1694 N LEU B 46 -2.058 -3.150 2.125 1.00 0.09 N ATOM 1695 CA LEU B 46 -3.083 -2.224 2.588 1.00 0.10 C ATOM 1696 C LEU B 46 -4.462 -2.785 2.282 1.00 0.11 C ATOM 1697 O LEU B 46 -4.790 -2.984 1.121 1.00 0.11 O ATOM 1698 CB LEU B 46 -2.922 -0.893 1.856 1.00 0.11 C ATOM 1699 CG LEU B 46 -1.512 -0.618 1.357 1.00 0.10 C ATOM 1700 CD1 LEU B 46 -1.557 0.417 0.255 1.00 0.15 C ATOM 1701 CD2 LEU B 46 -0.615 -0.154 2.493 1.00 0.13 C ATOM 0 H LEU B 46 -1.992 -3.218 1.109 1.00 0.09 H new ATOM 0 HA LEU B 46 -2.977 -2.080 3.663 1.00 0.10 H new ATOM 0 HB2 LEU B 46 -3.605 -0.874 1.007 1.00 0.11 H new ATOM 0 HB3 LEU B 46 -3.222 -0.086 2.524 1.00 0.11 H new ATOM 0 HG LEU B 46 -1.093 -1.543 0.960 1.00 0.10 H new ATOM 0 HD11 LEU B 46 -0.546 0.613 -0.102 1.00 0.15 H new ATOM 0 HD12 LEU B 46 -2.167 0.045 -0.569 1.00 0.15 H new ATOM 0 HD13 LEU B 46 -1.991 1.340 0.640 1.00 0.15 H new ATOM 0 HD21 LEU B 46 0.388 0.036 2.110 1.00 0.13 H new ATOM 0 HD22 LEU B 46 -1.019 0.762 2.924 1.00 0.13 H new ATOM 0 HD23 LEU B 46 -0.570 -0.927 3.260 1.00 0.13 H new ATOM 1713 N LYS B 47 -5.278 -3.044 3.294 1.00 0.12 N ATOM 1714 CA LYS B 47 -6.633 -3.529 3.012 1.00 0.16 C ATOM 1715 C LYS B 47 -7.699 -2.725 3.746 1.00 0.14 C ATOM 1716 O LYS B 47 -7.481 -2.273 4.851 1.00 0.14 O ATOM 1717 CB LYS B 47 -6.771 -5.040 3.275 1.00 0.22 C ATOM 1718 CG LYS B 47 -7.292 -5.451 4.647 1.00 0.24 C ATOM 1719 CD LYS B 47 -6.312 -5.153 5.765 1.00 0.40 C ATOM 1720 CE LYS B 47 -4.951 -5.797 5.546 1.00 0.52 C ATOM 1721 NZ LYS B 47 -5.008 -7.277 5.643 1.00 0.95 N ATOM 0 H LYS B 47 -5.045 -2.934 4.281 1.00 0.12 H new ATOM 0 HA LYS B 47 -6.803 -3.374 1.947 1.00 0.16 H new ATOM 0 HB2 LYS B 47 -7.436 -5.458 2.519 1.00 0.22 H new ATOM 0 HB3 LYS B 47 -5.794 -5.501 3.130 1.00 0.22 H new ATOM 0 HG2 LYS B 47 -8.229 -4.931 4.845 1.00 0.24 H new ATOM 0 HG3 LYS B 47 -7.514 -6.518 4.641 1.00 0.24 H new ATOM 0 HD2 LYS B 47 -6.188 -4.074 5.854 1.00 0.40 H new ATOM 0 HD3 LYS B 47 -6.727 -5.505 6.709 1.00 0.40 H new ATOM 0 HE2 LYS B 47 -4.571 -5.513 4.565 1.00 0.52 H new ATOM 0 HE3 LYS B 47 -4.247 -5.413 6.284 1.00 0.52 H new ATOM 0 HZ1 LYS B 47 -4.167 -7.624 6.147 1.00 0.95 H new ATOM 0 HZ2 LYS B 47 -5.864 -7.558 6.162 1.00 0.95 H new ATOM 0 HZ3 LYS B 47 -5.033 -7.687 4.687 1.00 0.95 H new ATOM 1735 N LYS B 48 -8.854 -2.621 3.104 1.00 0.17 N ATOM 1736 CA LYS B 48 -9.966 -1.704 3.456 1.00 0.17 C ATOM 1737 C LYS B 48 -10.375 -1.600 4.945 1.00 0.13 C ATOM 1738 O LYS B 48 -11.242 -0.794 5.259 1.00 0.16 O ATOM 1739 CB LYS B 48 -11.177 -2.143 2.661 1.00 0.22 C ATOM 1740 CG LYS B 48 -11.316 -3.652 2.655 1.00 0.24 C ATOM 1741 CD LYS B 48 -11.620 -4.206 1.275 1.00 0.35 C ATOM 1742 CE LYS B 48 -13.075 -4.025 0.899 1.00 0.43 C ATOM 1743 NZ LYS B 48 -13.413 -4.803 -0.323 1.00 0.64 N ATOM 0 H LYS B 48 -9.066 -3.192 2.286 1.00 0.17 H new ATOM 0 HA LYS B 48 -9.593 -0.708 3.219 1.00 0.17 H new ATOM 0 HB2 LYS B 48 -12.075 -1.695 3.086 1.00 0.22 H new ATOM 0 HB3 LYS B 48 -11.093 -1.780 1.637 1.00 0.22 H new ATOM 0 HG2 LYS B 48 -10.394 -4.099 3.027 1.00 0.24 H new ATOM 0 HG3 LYS B 48 -12.111 -3.942 3.342 1.00 0.24 H new ATOM 0 HD2 LYS B 48 -10.990 -3.708 0.538 1.00 0.35 H new ATOM 0 HD3 LYS B 48 -11.367 -5.266 1.246 1.00 0.35 H new ATOM 0 HE2 LYS B 48 -13.710 -4.345 1.725 1.00 0.43 H new ATOM 0 HE3 LYS B 48 -13.281 -2.968 0.730 1.00 0.43 H new ATOM 0 HZ1 LYS B 48 -14.403 -5.119 -0.271 1.00 0.64 H new ATOM 0 HZ2 LYS B 48 -13.284 -4.203 -1.163 1.00 0.64 H new ATOM 0 HZ3 LYS B 48 -12.789 -5.632 -0.391 1.00 0.64 H new ATOM 1757 N TYR B 49 -9.812 -2.419 5.838 1.00 0.13 N ATOM 1758 CA TYR B 49 -10.077 -2.349 7.292 1.00 0.15 C ATOM 1759 C TYR B 49 -11.502 -2.758 7.667 1.00 0.18 C ATOM 1760 O TYR B 49 -11.729 -3.338 8.723 1.00 0.25 O ATOM 1761 CB TYR B 49 -9.834 -0.964 7.853 1.00 0.19 C ATOM 1762 CG TYR B 49 -10.092 -0.838 9.342 1.00 0.31 C ATOM 1763 CD1 TYR B 49 -9.549 -1.748 10.243 1.00 1.18 C ATOM 1764 CD2 TYR B 49 -10.879 0.190 9.842 1.00 1.14 C ATOM 1765 CE1 TYR B 49 -9.784 -1.635 11.599 1.00 1.26 C ATOM 1766 CE2 TYR B 49 -11.119 0.310 11.197 1.00 1.19 C ATOM 1767 CZ TYR B 49 -10.569 -0.604 12.071 1.00 0.62 C ATOM 1768 OH TYR B 49 -10.810 -0.487 13.421 1.00 0.79 O ATOM 0 H TYR B 49 -9.155 -3.155 5.579 1.00 0.13 H new ATOM 0 HA TYR B 49 -9.375 -3.060 7.727 1.00 0.15 H new ATOM 0 HB2 TYR B 49 -8.802 -0.679 7.650 1.00 0.19 H new ATOM 0 HB3 TYR B 49 -10.471 -0.254 7.325 1.00 0.19 H new ATOM 0 HD1 TYR B 49 -8.934 -2.556 9.876 1.00 1.18 H new ATOM 0 HD2 TYR B 49 -11.311 0.908 9.160 1.00 1.14 H new ATOM 0 HE1 TYR B 49 -9.356 -2.350 12.286 1.00 1.26 H new ATOM 0 HE2 TYR B 49 -11.734 1.115 11.570 1.00 1.19 H new ATOM 0 HH TYR B 49 -11.380 0.293 13.585 1.00 0.79 H new ATOM 1778 N SER B 50 -12.456 -2.412 6.821 1.00 0.20 N ATOM 1779 CA SER B 50 -13.861 -2.680 7.074 1.00 0.28 C ATOM 1780 C SER B 50 -14.093 -4.175 7.374 1.00 0.29 C ATOM 1781 O SER B 50 -14.785 -4.510 8.337 1.00 0.35 O ATOM 1782 CB SER B 50 -14.697 -2.174 5.886 1.00 0.39 C ATOM 1783 OG SER B 50 -16.087 -2.179 6.181 1.00 1.22 O ATOM 0 H SER B 50 -12.278 -1.936 5.937 1.00 0.20 H new ATOM 0 HA SER B 50 -14.185 -2.140 7.964 1.00 0.28 H new ATOM 0 HB2 SER B 50 -14.384 -1.163 5.625 1.00 0.39 H new ATOM 0 HB3 SER B 50 -14.508 -2.801 5.015 1.00 0.39 H new ATOM 0 HG SER B 50 -16.587 -1.850 5.405 1.00 1.22 H new ATOM 1789 N PRO B 51 -13.539 -5.101 6.559 1.00 0.34 N ATOM 1790 CA PRO B 51 -13.442 -6.512 6.927 1.00 0.43 C ATOM 1791 C PRO B 51 -12.092 -6.845 7.558 1.00 0.45 C ATOM 1792 O PRO B 51 -11.794 -8.003 7.847 1.00 0.56 O ATOM 1793 CB PRO B 51 -13.567 -7.205 5.586 1.00 0.52 C ATOM 1794 CG PRO B 51 -12.892 -6.280 4.628 1.00 0.47 C ATOM 1795 CD PRO B 51 -13.047 -4.883 5.186 1.00 0.41 C ATOM 0 HA PRO B 51 -14.190 -6.807 7.663 1.00 0.43 H new ATOM 0 HB2 PRO B 51 -13.088 -8.184 5.598 1.00 0.52 H new ATOM 0 HB3 PRO B 51 -14.611 -7.364 5.316 1.00 0.52 H new ATOM 0 HG2 PRO B 51 -11.839 -6.538 4.519 1.00 0.47 H new ATOM 0 HG3 PRO B 51 -13.342 -6.353 3.638 1.00 0.47 H new ATOM 0 HD2 PRO B 51 -12.100 -4.344 5.182 1.00 0.41 H new ATOM 0 HD3 PRO B 51 -13.751 -4.294 4.598 1.00 0.41 H new ATOM 1803 N ILE B 52 -11.295 -5.800 7.770 1.00 0.37 N ATOM 1804 CA ILE B 52 -9.938 -5.903 8.312 1.00 0.45 C ATOM 1805 C ILE B 52 -9.140 -6.967 7.563 1.00 0.57 C ATOM 1806 O ILE B 52 -9.329 -7.160 6.362 1.00 0.57 O ATOM 1807 CB ILE B 52 -9.951 -6.222 9.825 1.00 0.60 C ATOM 1808 CG1 ILE B 52 -11.296 -5.837 10.443 1.00 0.50 C ATOM 1809 CG2 ILE B 52 -8.822 -5.474 10.533 1.00 0.73 C ATOM 1810 CD1 ILE B 52 -11.369 -6.045 11.940 1.00 0.70 C ATOM 0 H ILE B 52 -11.577 -4.841 7.567 1.00 0.37 H new ATOM 0 HA ILE B 52 -9.459 -4.934 8.175 1.00 0.45 H new ATOM 0 HB ILE B 52 -9.801 -7.294 9.951 1.00 0.60 H new ATOM 0 HG12 ILE B 52 -11.499 -4.789 10.222 1.00 0.50 H new ATOM 0 HG13 ILE B 52 -12.083 -6.421 9.967 1.00 0.50 H new ATOM 0 HG21 ILE B 52 -8.842 -5.707 11.598 1.00 0.73 H new ATOM 0 HG22 ILE B 52 -7.864 -5.779 10.113 1.00 0.73 H new ATOM 0 HG23 ILE B 52 -8.953 -4.401 10.394 1.00 0.73 H new ATOM 0 HD11 ILE B 52 -12.354 -5.749 12.301 1.00 0.70 H new ATOM 0 HD12 ILE B 52 -11.200 -7.097 12.170 1.00 0.70 H new ATOM 0 HD13 ILE B 52 -10.606 -5.439 12.429 1.00 0.70 H new ATOM 1822 N SER B 53 -8.254 -7.649 8.264 1.00 0.78 N ATOM 1823 CA SER B 53 -7.491 -8.733 7.685 1.00 0.95 C ATOM 1824 C SER B 53 -8.306 -10.027 7.754 1.00 1.16 C ATOM 1825 O SER B 53 -7.751 -11.116 7.931 1.00 1.86 O ATOM 1826 CB SER B 53 -6.171 -8.870 8.445 1.00 1.08 C ATOM 1827 OG SER B 53 -6.395 -9.046 9.834 1.00 1.48 O ATOM 0 H SER B 53 -8.045 -7.467 9.246 1.00 0.78 H new ATOM 0 HA SER B 53 -7.272 -8.527 6.637 1.00 0.95 H new ATOM 0 HB2 SER B 53 -5.610 -9.719 8.054 1.00 1.08 H new ATOM 0 HB3 SER B 53 -5.561 -7.982 8.282 1.00 1.08 H new ATOM 0 HG SER B 53 -5.535 -9.133 10.296 1.00 1.48 H new ATOM 1833 N GLU B 54 -9.625 -9.872 7.571 1.00 1.07 N ATOM 1834 CA GLU B 54 -10.615 -10.930 7.761 1.00 1.27 C ATOM 1835 C GLU B 54 -10.859 -11.160 9.251 1.00 1.46 C ATOM 1836 O GLU B 54 -9.941 -11.509 9.992 1.00 2.29 O ATOM 1837 CB GLU B 54 -10.206 -12.236 7.072 1.00 1.47 C ATOM 1838 CG GLU B 54 -11.231 -13.350 7.217 1.00 1.75 C ATOM 1839 CD GLU B 54 -12.540 -13.046 6.516 1.00 2.00 C ATOM 1840 OE1 GLU B 54 -13.399 -12.361 7.113 1.00 2.62 O ATOM 1841 OE2 GLU B 54 -12.726 -13.508 5.373 1.00 2.41 O ATOM 0 H GLU B 54 -10.038 -8.986 7.280 1.00 1.07 H new ATOM 0 HA GLU B 54 -11.543 -10.600 7.293 1.00 1.27 H new ATOM 0 HB2 GLU B 54 -10.041 -12.041 6.012 1.00 1.47 H new ATOM 0 HB3 GLU B 54 -9.255 -12.573 7.486 1.00 1.47 H new ATOM 0 HG2 GLU B 54 -10.815 -14.273 6.814 1.00 1.75 H new ATOM 0 HG3 GLU B 54 -11.424 -13.523 8.276 1.00 1.75 H new ATOM 1848 N LEU B 55 -12.097 -10.939 9.682 1.00 1.27 N ATOM 1849 CA LEU B 55 -12.480 -11.120 11.079 1.00 1.44 C ATOM 1850 C LEU B 55 -12.261 -12.564 11.516 1.00 2.03 C ATOM 1851 O LEU B 55 -13.057 -13.432 11.107 1.00 2.28 O ATOM 1852 CB LEU B 55 -13.946 -10.729 11.300 1.00 1.59 C ATOM 1853 CG LEU B 55 -14.216 -9.241 11.551 1.00 1.50 C ATOM 1854 CD1 LEU B 55 -13.448 -8.762 12.772 1.00 2.31 C ATOM 1855 CD2 LEU B 55 -13.860 -8.404 10.331 1.00 0.94 C ATOM 1856 OXT LEU B 55 -11.301 -12.825 12.272 1.00 2.64 O ATOM 0 H LEU B 55 -12.859 -10.631 9.078 1.00 1.27 H new ATOM 0 HA LEU B 55 -11.849 -10.468 11.683 1.00 1.44 H new ATOM 0 HB2 LEU B 55 -14.519 -11.039 10.426 1.00 1.59 H new ATOM 0 HB3 LEU B 55 -14.328 -11.295 12.150 1.00 1.59 H new ATOM 0 HG LEU B 55 -15.282 -9.118 11.740 1.00 1.50 H new ATOM 0 HD11 LEU B 55 -13.650 -7.704 12.937 1.00 2.31 H new ATOM 0 HD12 LEU B 55 -13.762 -9.332 13.646 1.00 2.31 H new ATOM 0 HD13 LEU B 55 -12.380 -8.906 12.610 1.00 2.31 H new ATOM 0 HD21 LEU B 55 -14.062 -7.353 10.539 1.00 0.94 H new ATOM 0 HD22 LEU B 55 -12.803 -8.531 10.099 1.00 0.94 H new ATOM 0 HD23 LEU B 55 -14.460 -8.727 9.480 1.00 0.94 H new TER 1868 LEU B 55