USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 920 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 3 MET CE :methyl 139:sc= -0.14 (180deg=-0.943) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -174:sc= 1.34 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0776 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 86:sc= 1.22 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot -80:sc= -3.71! USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 154:sc= 0.0119 (180deg=-0.652) USER MOD Single : A 49 LYS NZ :NH3+ 156:sc= 0.131 (180deg=0.0239) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : B 3 MET CE :methyl -154:sc= -0.155 (180deg=-1.31!) USER MOD Single : B 4 LYS NZ :NH3+ 151:sc= -0.0852 (180deg=-0.805) USER MOD Single : B 5 SER OG : rot 179:sc= 0.119 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.0514 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 THR OG1 : rot 96:sc= 1.21 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 TYR OH : rot -79:sc= -3.81! USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 153:sc= 0.0439 (180deg=-0.665) USER MOD Single : B 49 LYS NZ :NH3+ 157:sc= 0.131 (180deg=0.0225) USER MOD Single : B 50 TYR OH : rot 180:sc= -0.0735 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 2 13.015 -17.365 31.255 1.00 8.91 N ATOM 2 CA PHE A 2 11.726 -16.919 30.654 1.00 8.45 C ATOM 3 C PHE A 2 10.550 -17.606 31.354 1.00 7.63 C ATOM 4 O PHE A 2 10.698 -18.653 31.953 1.00 7.72 O ATOM 5 CB PHE A 2 11.803 -17.350 29.189 1.00 8.96 C ATOM 6 CG PHE A 2 11.792 -18.858 29.107 1.00 9.49 C ATOM 7 CD1 PHE A 2 12.985 -19.575 29.251 1.00 9.97 C ATOM 8 CD2 PHE A 2 10.588 -19.539 28.885 1.00 9.80 C ATOM 9 CE1 PHE A 2 12.974 -20.974 29.176 1.00 10.72 C ATOM 10 CE2 PHE A 2 10.578 -20.936 28.808 1.00 10.54 C ATOM 11 CZ PHE A 2 11.772 -21.653 28.954 1.00 10.99 C ATOM 0 HA PHE A 2 11.572 -15.845 30.756 1.00 8.45 H new ATOM 0 HB2 PHE A 2 10.961 -16.939 28.633 1.00 8.96 H new ATOM 0 HB3 PHE A 2 12.710 -16.957 28.730 1.00 8.96 H new ATOM 0 HD1 PHE A 2 13.914 -19.050 29.420 1.00 9.97 H new ATOM 0 HD2 PHE A 2 9.667 -18.986 28.773 1.00 9.80 H new ATOM 0 HE1 PHE A 2 13.894 -21.528 29.290 1.00 10.72 H new ATOM 0 HE2 PHE A 2 9.650 -21.461 28.636 1.00 10.54 H new ATOM 0 HZ PHE A 2 11.764 -22.731 28.895 1.00 10.99 H new ATOM 21 N MET A 3 9.382 -17.032 31.271 1.00 7.11 N ATOM 22 CA MET A 3 8.194 -17.659 31.921 1.00 6.57 C ATOM 23 C MET A 3 6.992 -17.623 30.973 1.00 5.78 C ATOM 24 O MET A 3 6.966 -16.875 30.016 1.00 5.66 O ATOM 25 CB MET A 3 7.926 -16.809 33.162 1.00 6.89 C ATOM 26 CG MET A 3 9.123 -16.898 34.109 1.00 7.83 C ATOM 27 SD MET A 3 8.720 -16.077 35.671 1.00 8.58 S ATOM 28 CE MET A 3 7.588 -17.339 36.304 1.00 8.76 C ATOM 0 H MET A 3 9.197 -16.156 30.782 1.00 7.11 H new ATOM 0 HA MET A 3 8.366 -18.705 32.175 1.00 6.57 H new ATOM 0 HB2 MET A 3 7.752 -15.772 32.875 1.00 6.89 H new ATOM 0 HB3 MET A 3 7.024 -17.156 33.666 1.00 6.89 H new ATOM 0 HG2 MET A 3 9.380 -17.942 34.290 1.00 7.83 H new ATOM 0 HG3 MET A 3 9.996 -16.429 33.654 1.00 7.83 H new ATOM 0 HE1 MET A 3 7.764 -17.484 37.370 1.00 8.76 H new ATOM 0 HE2 MET A 3 6.559 -17.016 36.147 1.00 8.76 H new ATOM 0 HE3 MET A 3 7.758 -18.278 35.777 1.00 8.76 H new ATOM 38 N LYS A 4 5.989 -18.413 31.242 1.00 5.58 N ATOM 39 CA LYS A 4 4.782 -18.410 30.366 1.00 5.16 C ATOM 40 C LYS A 4 3.790 -17.343 30.837 1.00 4.32 C ATOM 41 O LYS A 4 3.721 -17.019 32.006 1.00 4.43 O ATOM 42 CB LYS A 4 4.179 -19.807 30.515 1.00 5.73 C ATOM 43 CG LYS A 4 5.153 -20.847 29.960 1.00 6.53 C ATOM 44 CD LYS A 4 4.501 -22.230 29.997 1.00 7.41 C ATOM 45 CE LYS A 4 5.514 -23.285 29.548 1.00 8.29 C ATOM 46 NZ LYS A 4 5.815 -24.076 30.774 1.00 8.85 N ATOM 0 H LYS A 4 5.952 -19.060 32.030 1.00 5.58 H new ATOM 0 HA LYS A 4 5.026 -18.181 29.328 1.00 5.16 H new ATOM 0 HB2 LYS A 4 3.969 -20.014 31.564 1.00 5.73 H new ATOM 0 HB3 LYS A 4 3.229 -19.863 29.983 1.00 5.73 H new ATOM 0 HG2 LYS A 4 5.430 -20.591 28.937 1.00 6.53 H new ATOM 0 HG3 LYS A 4 6.071 -20.851 30.548 1.00 6.53 H new ATOM 0 HD2 LYS A 4 4.152 -22.452 31.005 1.00 7.41 H new ATOM 0 HD3 LYS A 4 3.627 -22.249 29.346 1.00 7.41 H new ATOM 0 HE2 LYS A 4 5.103 -23.917 28.761 1.00 8.29 H new ATOM 0 HE3 LYS A 4 6.415 -22.821 29.146 1.00 8.29 H new ATOM 0 HZ1 LYS A 4 6.504 -24.821 30.546 1.00 8.85 H new ATOM 0 HZ2 LYS A 4 6.211 -23.449 31.503 1.00 8.85 H new ATOM 0 HZ3 LYS A 4 4.940 -24.511 31.130 1.00 8.85 H new ATOM 60 N SER A 5 3.037 -16.779 29.933 1.00 3.84 N ATOM 61 CA SER A 5 2.066 -15.718 30.326 1.00 3.10 C ATOM 62 C SER A 5 0.962 -16.308 31.207 1.00 2.34 C ATOM 63 O SER A 5 0.768 -17.507 31.257 1.00 2.87 O ATOM 64 CB SER A 5 1.483 -15.207 29.009 1.00 3.66 C ATOM 65 OG SER A 5 0.589 -16.180 28.483 1.00 4.20 O ATOM 0 H SER A 5 3.052 -17.007 28.939 1.00 3.84 H new ATOM 0 HA SER A 5 2.538 -14.921 30.901 1.00 3.10 H new ATOM 0 HB2 SER A 5 0.959 -14.265 29.171 1.00 3.66 H new ATOM 0 HB3 SER A 5 2.283 -15.008 28.296 1.00 3.66 H new ATOM 0 HG SER A 5 0.286 -15.899 27.594 1.00 4.20 H new ATOM 71 N THR A 6 0.240 -15.476 31.909 1.00 1.82 N ATOM 72 CA THR A 6 -0.847 -15.992 32.791 1.00 1.98 C ATOM 73 C THR A 6 -1.910 -16.708 31.955 1.00 1.52 C ATOM 74 O THR A 6 -2.454 -17.717 32.360 1.00 2.20 O ATOM 75 CB THR A 6 -1.437 -14.749 33.460 1.00 2.86 C ATOM 76 OG1 THR A 6 -2.031 -13.919 32.471 1.00 3.36 O ATOM 77 CG2 THR A 6 -0.328 -13.979 34.177 1.00 3.77 C ATOM 0 H THR A 6 0.356 -14.463 31.910 1.00 1.82 H new ATOM 0 HA THR A 6 -0.480 -16.713 33.522 1.00 1.98 H new ATOM 0 HB THR A 6 -2.194 -15.049 34.185 1.00 2.86 H new ATOM 0 HG1 THR A 6 -2.411 -13.123 32.897 1.00 3.36 H new ATOM 0 HG21 THR A 6 -0.749 -13.094 34.653 1.00 3.77 H new ATOM 0 HG22 THR A 6 0.127 -14.617 34.935 1.00 3.77 H new ATOM 0 HG23 THR A 6 0.430 -13.676 33.455 1.00 3.77 H new ATOM 85 N GLY A 7 -2.179 -16.222 30.775 1.00 0.83 N ATOM 86 CA GLY A 7 -3.170 -16.907 29.897 1.00 0.46 C ATOM 87 C GLY A 7 -4.577 -16.733 30.475 1.00 0.43 C ATOM 88 O GLY A 7 -5.353 -17.667 30.528 1.00 0.49 O ATOM 0 H GLY A 7 -1.756 -15.382 30.381 1.00 0.83 H new ATOM 0 HA2 GLY A 7 -3.126 -16.492 28.890 1.00 0.46 H new ATOM 0 HA3 GLY A 7 -2.928 -17.967 29.816 1.00 0.46 H new ATOM 92 N ILE A 8 -4.924 -15.543 30.883 1.00 0.37 N ATOM 93 CA ILE A 8 -6.299 -15.317 31.427 1.00 0.37 C ATOM 94 C ILE A 8 -7.046 -14.306 30.556 1.00 0.32 C ATOM 95 O ILE A 8 -6.490 -13.323 30.127 1.00 0.30 O ATOM 96 CB ILE A 8 -6.090 -14.757 32.830 1.00 0.40 C ATOM 97 CG1 ILE A 8 -5.197 -15.707 33.633 1.00 0.45 C ATOM 98 CG2 ILE A 8 -7.441 -14.615 33.530 1.00 0.43 C ATOM 99 CD1 ILE A 8 -4.895 -15.091 35.001 1.00 1.36 C ATOM 0 H ILE A 8 -4.321 -14.720 30.865 1.00 0.37 H new ATOM 0 HA ILE A 8 -6.891 -16.232 31.441 1.00 0.37 H new ATOM 0 HB ILE A 8 -5.612 -13.780 32.762 1.00 0.40 H new ATOM 0 HG12 ILE A 8 -5.692 -16.670 33.757 1.00 0.45 H new ATOM 0 HG13 ILE A 8 -4.268 -15.893 33.093 1.00 0.45 H new ATOM 0 HG21 ILE A 8 -7.291 -14.215 34.533 1.00 0.43 H new ATOM 0 HG22 ILE A 8 -8.077 -13.937 32.960 1.00 0.43 H new ATOM 0 HG23 ILE A 8 -7.920 -15.592 33.597 1.00 0.43 H new ATOM 0 HD11 ILE A 8 -4.259 -15.767 35.572 1.00 1.36 H new ATOM 0 HD12 ILE A 8 -4.382 -14.139 34.866 1.00 1.36 H new ATOM 0 HD13 ILE A 8 -5.828 -14.928 35.540 1.00 1.36 H new ATOM 111 N VAL A 9 -8.273 -14.582 30.222 1.00 0.32 N ATOM 112 CA VAL A 9 -9.009 -13.674 29.292 1.00 0.29 C ATOM 113 C VAL A 9 -10.184 -12.998 30.004 1.00 0.32 C ATOM 114 O VAL A 9 -10.862 -13.594 30.818 1.00 0.37 O ATOM 115 CB VAL A 9 -9.508 -14.573 28.162 1.00 0.29 C ATOM 116 CG1 VAL A 9 -10.355 -13.751 27.190 1.00 0.27 C ATOM 117 CG2 VAL A 9 -8.307 -15.162 27.412 1.00 0.30 C ATOM 0 H VAL A 9 -8.800 -15.392 30.549 1.00 0.32 H new ATOM 0 HA VAL A 9 -8.370 -12.872 28.922 1.00 0.29 H new ATOM 0 HB VAL A 9 -10.111 -15.379 28.580 1.00 0.29 H new ATOM 0 HG11 VAL A 9 -10.710 -14.393 26.384 1.00 0.27 H new ATOM 0 HG12 VAL A 9 -11.208 -13.327 27.720 1.00 0.27 H new ATOM 0 HG13 VAL A 9 -9.751 -12.946 26.772 1.00 0.27 H new ATOM 0 HG21 VAL A 9 -8.661 -15.804 26.605 1.00 0.30 H new ATOM 0 HG22 VAL A 9 -7.706 -14.354 26.995 1.00 0.30 H new ATOM 0 HG23 VAL A 9 -7.699 -15.748 28.102 1.00 0.30 H new ATOM 127 N ARG A 10 -10.458 -11.768 29.658 1.00 0.31 N ATOM 128 CA ARG A 10 -11.621 -11.053 30.257 1.00 0.36 C ATOM 129 C ARG A 10 -12.474 -10.433 29.148 1.00 0.31 C ATOM 130 O ARG A 10 -12.026 -10.273 28.031 1.00 0.27 O ATOM 131 CB ARG A 10 -11.008 -9.965 31.140 1.00 0.40 C ATOM 132 CG ARG A 10 -12.119 -9.240 31.902 1.00 0.73 C ATOM 133 CD ARG A 10 -11.512 -8.107 32.733 1.00 0.86 C ATOM 134 NE ARG A 10 -12.651 -7.556 33.520 1.00 1.13 N ATOM 135 CZ ARG A 10 -13.566 -6.833 32.933 1.00 1.36 C ATOM 136 NH1 ARG A 10 -13.488 -6.588 31.652 1.00 1.61 N ATOM 137 NH2 ARG A 10 -14.562 -6.354 33.627 1.00 1.91 N ATOM 0 H ARG A 10 -9.922 -11.225 28.981 1.00 0.31 H new ATOM 0 HA ARG A 10 -12.270 -11.716 30.829 1.00 0.36 H new ATOM 0 HB2 ARG A 10 -10.300 -10.407 31.841 1.00 0.40 H new ATOM 0 HB3 ARG A 10 -10.450 -9.256 30.528 1.00 0.40 H new ATOM 0 HG2 ARG A 10 -12.853 -8.840 31.203 1.00 0.73 H new ATOM 0 HG3 ARG A 10 -12.646 -9.940 32.551 1.00 0.73 H new ATOM 0 HD2 ARG A 10 -10.722 -8.476 33.387 1.00 0.86 H new ATOM 0 HD3 ARG A 10 -11.067 -7.344 32.095 1.00 0.86 H new ATOM 0 HE ARG A 10 -12.716 -7.744 34.520 1.00 1.13 H new ATOM 0 HH11 ARG A 10 -12.711 -6.962 31.108 1.00 1.61 H new ATOM 0 HH12 ARG A 10 -14.204 -6.023 31.196 1.00 1.61 H new ATOM 0 HH21 ARG A 10 -14.625 -6.545 34.627 1.00 1.91 H new ATOM 0 HH22 ARG A 10 -15.277 -5.789 33.169 1.00 1.91 H new ATOM 151 N LYS A 11 -13.704 -10.107 29.432 1.00 0.32 N ATOM 152 CA LYS A 11 -14.581 -9.526 28.374 1.00 0.29 C ATOM 153 C LYS A 11 -14.368 -8.012 28.279 1.00 0.26 C ATOM 154 O LYS A 11 -14.092 -7.351 29.259 1.00 0.27 O ATOM 155 CB LYS A 11 -16.008 -9.844 28.822 1.00 0.33 C ATOM 156 CG LYS A 11 -16.217 -11.360 28.825 1.00 1.02 C ATOM 157 CD LYS A 11 -17.678 -11.673 29.158 1.00 1.03 C ATOM 158 CE LYS A 11 -17.861 -13.187 29.276 1.00 1.81 C ATOM 159 NZ LYS A 11 -18.985 -13.511 28.353 1.00 2.21 N ATOM 0 H LYS A 11 -14.140 -10.217 30.348 1.00 0.32 H new ATOM 0 HA LYS A 11 -14.364 -9.936 27.388 1.00 0.29 H new ATOM 0 HB2 LYS A 11 -16.186 -9.440 29.819 1.00 0.33 H new ATOM 0 HB3 LYS A 11 -16.725 -9.369 28.152 1.00 0.33 H new ATOM 0 HG2 LYS A 11 -15.958 -11.776 27.851 1.00 1.02 H new ATOM 0 HG3 LYS A 11 -15.558 -11.827 29.557 1.00 1.02 H new ATOM 0 HD2 LYS A 11 -17.961 -11.188 30.092 1.00 1.03 H new ATOM 0 HD3 LYS A 11 -18.332 -11.276 28.382 1.00 1.03 H new ATOM 0 HE2 LYS A 11 -16.952 -13.718 28.993 1.00 1.81 H new ATOM 0 HE3 LYS A 11 -18.094 -13.478 30.300 1.00 1.81 H new ATOM 0 HZ1 LYS A 11 -19.171 -14.534 28.378 1.00 2.21 H new ATOM 0 HZ2 LYS A 11 -19.838 -12.996 28.651 1.00 2.21 H new ATOM 0 HZ3 LYS A 11 -18.731 -13.229 27.385 1.00 2.21 H new ATOM 173 N VAL A 12 -14.510 -7.458 27.104 1.00 0.22 N ATOM 174 CA VAL A 12 -14.332 -5.984 26.947 1.00 0.21 C ATOM 175 C VAL A 12 -15.614 -5.260 27.360 1.00 0.20 C ATOM 176 O VAL A 12 -16.692 -5.597 26.916 1.00 0.20 O ATOM 177 CB VAL A 12 -14.068 -5.764 25.455 1.00 0.20 C ATOM 178 CG1 VAL A 12 -13.538 -4.345 25.235 1.00 0.28 C ATOM 179 CG2 VAL A 12 -13.038 -6.778 24.952 1.00 0.28 C ATOM 0 H VAL A 12 -14.741 -7.961 26.247 1.00 0.22 H new ATOM 0 HA VAL A 12 -13.521 -5.602 27.566 1.00 0.21 H new ATOM 0 HB VAL A 12 -14.999 -5.897 24.903 1.00 0.20 H new ATOM 0 HG11 VAL A 12 -13.350 -4.187 24.173 1.00 0.28 H new ATOM 0 HG12 VAL A 12 -14.276 -3.623 25.584 1.00 0.28 H new ATOM 0 HG13 VAL A 12 -12.610 -4.213 25.791 1.00 0.28 H new ATOM 0 HG21 VAL A 12 -12.856 -6.615 23.890 1.00 0.28 H new ATOM 0 HG22 VAL A 12 -12.106 -6.654 25.503 1.00 0.28 H new ATOM 0 HG23 VAL A 12 -13.418 -7.788 25.104 1.00 0.28 H new ATOM 189 N ASP A 13 -15.512 -4.272 28.203 1.00 0.20 N ATOM 190 CA ASP A 13 -16.738 -3.545 28.635 1.00 0.21 C ATOM 191 C ASP A 13 -17.091 -2.457 27.609 1.00 0.22 C ATOM 192 O ASP A 13 -16.552 -2.421 26.522 1.00 0.22 O ATOM 193 CB ASP A 13 -16.399 -2.950 30.009 1.00 0.21 C ATOM 194 CG ASP A 13 -15.801 -1.550 29.857 1.00 0.32 C ATOM 195 OD1 ASP A 13 -14.605 -1.451 29.649 1.00 0.26 O ATOM 196 OD2 ASP A 13 -16.552 -0.596 29.949 1.00 0.55 O ATOM 0 H ASP A 13 -14.639 -3.937 28.610 1.00 0.20 H new ATOM 0 HA ASP A 13 -17.610 -4.196 28.702 1.00 0.21 H new ATOM 0 HB2 ASP A 13 -17.299 -2.902 30.623 1.00 0.21 H new ATOM 0 HB3 ASP A 13 -15.693 -3.598 30.528 1.00 0.21 H new ATOM 201 N GLU A 14 -18.086 -1.665 27.893 1.00 0.23 N ATOM 202 CA GLU A 14 -18.585 -0.699 26.871 1.00 0.26 C ATOM 203 C GLU A 14 -17.466 0.221 26.365 1.00 0.26 C ATOM 204 O GLU A 14 -17.462 0.619 25.217 1.00 0.29 O ATOM 205 CB GLU A 14 -19.657 0.117 27.593 1.00 0.28 C ATOM 206 CG GLU A 14 -20.812 -0.800 27.999 1.00 1.22 C ATOM 207 CD GLU A 14 -21.914 0.029 28.662 1.00 1.57 C ATOM 208 OE1 GLU A 14 -21.673 1.196 28.925 1.00 1.99 O ATOM 209 OE2 GLU A 14 -22.979 -0.517 28.896 1.00 2.19 O ATOM 0 H GLU A 14 -18.576 -1.643 28.787 1.00 0.23 H new ATOM 0 HA GLU A 14 -18.970 -1.215 25.992 1.00 0.26 H new ATOM 0 HB2 GLU A 14 -19.232 0.595 28.475 1.00 0.28 H new ATOM 0 HB3 GLU A 14 -20.022 0.913 26.943 1.00 0.28 H new ATOM 0 HG2 GLU A 14 -21.207 -1.315 27.123 1.00 1.22 H new ATOM 0 HG3 GLU A 14 -20.456 -1.568 28.686 1.00 1.22 H new ATOM 216 N LEU A 15 -16.593 0.661 27.227 1.00 0.23 N ATOM 217 CA LEU A 15 -15.580 1.671 26.795 1.00 0.24 C ATOM 218 C LEU A 15 -14.347 1.001 26.175 1.00 0.22 C ATOM 219 O LEU A 15 -13.441 1.670 25.718 1.00 0.24 O ATOM 220 CB LEU A 15 -15.194 2.424 28.067 1.00 0.28 C ATOM 221 CG LEU A 15 -14.066 3.408 27.747 1.00 0.38 C ATOM 222 CD1 LEU A 15 -14.415 4.198 26.483 1.00 1.28 C ATOM 223 CD2 LEU A 15 -13.892 4.379 28.917 1.00 1.38 C ATOM 0 H LEU A 15 -16.534 0.370 28.203 1.00 0.23 H new ATOM 0 HA LEU A 15 -15.984 2.333 26.029 1.00 0.24 H new ATOM 0 HB2 LEU A 15 -16.057 2.958 28.464 1.00 0.28 H new ATOM 0 HB3 LEU A 15 -14.873 1.722 28.836 1.00 0.28 H new ATOM 0 HG LEU A 15 -13.140 2.856 27.586 1.00 0.38 H new ATOM 0 HD11 LEU A 15 -13.610 4.898 26.258 1.00 1.28 H new ATOM 0 HD12 LEU A 15 -14.542 3.510 25.647 1.00 1.28 H new ATOM 0 HD13 LEU A 15 -15.341 4.750 26.643 1.00 1.28 H new ATOM 0 HD21 LEU A 15 -13.089 5.081 28.691 1.00 1.38 H new ATOM 0 HD22 LEU A 15 -14.820 4.928 29.075 1.00 1.38 H new ATOM 0 HD23 LEU A 15 -13.643 3.821 29.819 1.00 1.38 H new ATOM 235 N GLY A 16 -14.272 -0.301 26.186 1.00 0.21 N ATOM 236 CA GLY A 16 -13.058 -0.963 25.629 1.00 0.19 C ATOM 237 C GLY A 16 -11.929 -0.925 26.663 1.00 0.20 C ATOM 238 O GLY A 16 -10.814 -0.533 26.368 1.00 0.20 O ATOM 0 H GLY A 16 -14.988 -0.929 26.551 1.00 0.21 H new ATOM 0 HA2 GLY A 16 -13.285 -1.995 25.362 1.00 0.19 H new ATOM 0 HA3 GLY A 16 -12.744 -0.459 24.715 1.00 0.19 H new ATOM 242 N ARG A 17 -12.220 -1.263 27.889 1.00 0.24 N ATOM 243 CA ARG A 17 -11.179 -1.183 28.950 1.00 0.26 C ATOM 244 C ARG A 17 -10.871 -2.582 29.489 1.00 0.26 C ATOM 245 O ARG A 17 -11.691 -3.476 29.431 1.00 0.26 O ATOM 246 CB ARG A 17 -11.796 -0.307 30.039 1.00 0.28 C ATOM 247 CG ARG A 17 -11.965 1.118 29.509 1.00 0.28 C ATOM 248 CD ARG A 17 -12.538 2.011 30.610 1.00 0.29 C ATOM 249 NE ARG A 17 -13.926 1.518 30.822 1.00 0.57 N ATOM 250 CZ ARG A 17 -14.789 2.255 31.474 1.00 0.79 C ATOM 251 NH1 ARG A 17 -14.422 3.404 31.975 1.00 0.73 N ATOM 252 NH2 ARG A 17 -16.018 1.844 31.626 1.00 1.15 N ATOM 0 H ARG A 17 -13.134 -1.591 28.201 1.00 0.24 H new ATOM 0 HA ARG A 17 -10.239 -0.772 28.583 1.00 0.26 H new ATOM 0 HB2 ARG A 17 -12.762 -0.711 30.342 1.00 0.28 H new ATOM 0 HB3 ARG A 17 -11.159 -0.305 30.924 1.00 0.28 H new ATOM 0 HG2 ARG A 17 -11.004 1.508 29.174 1.00 0.28 H new ATOM 0 HG3 ARG A 17 -12.629 1.119 28.644 1.00 0.28 H new ATOM 0 HD2 ARG A 17 -11.949 1.938 31.524 1.00 0.29 H new ATOM 0 HD3 ARG A 17 -12.533 3.059 30.311 1.00 0.29 H new ATOM 0 HE ARG A 17 -14.205 0.606 30.459 1.00 0.57 H new ATOM 0 HH11 ARG A 17 -13.462 3.728 31.858 1.00 0.73 H new ATOM 0 HH12 ARG A 17 -15.096 3.977 32.483 1.00 0.73 H new ATOM 0 HH21 ARG A 17 -16.308 0.947 31.236 1.00 1.15 H new ATOM 0 HH22 ARG A 17 -16.689 2.420 32.134 1.00 1.15 H new ATOM 266 N VAL A 18 -9.696 -2.774 30.020 1.00 0.26 N ATOM 267 CA VAL A 18 -9.335 -4.111 30.573 1.00 0.25 C ATOM 268 C VAL A 18 -8.905 -3.970 32.034 1.00 0.24 C ATOM 269 O VAL A 18 -8.475 -2.918 32.462 1.00 0.24 O ATOM 270 CB VAL A 18 -8.169 -4.595 29.712 1.00 0.26 C ATOM 271 CG1 VAL A 18 -8.601 -4.639 28.246 1.00 0.28 C ATOM 272 CG2 VAL A 18 -6.990 -3.633 29.867 1.00 0.26 C ATOM 0 H VAL A 18 -8.969 -2.063 30.095 1.00 0.26 H new ATOM 0 HA VAL A 18 -10.170 -4.811 30.551 1.00 0.25 H new ATOM 0 HB VAL A 18 -7.870 -5.593 30.032 1.00 0.26 H new ATOM 0 HG11 VAL A 18 -7.769 -4.984 27.632 1.00 0.28 H new ATOM 0 HG12 VAL A 18 -9.442 -5.323 28.135 1.00 0.28 H new ATOM 0 HG13 VAL A 18 -8.900 -3.641 27.925 1.00 0.28 H new ATOM 0 HG21 VAL A 18 -6.157 -3.976 29.254 1.00 0.26 H new ATOM 0 HG22 VAL A 18 -7.290 -2.635 29.546 1.00 0.26 H new ATOM 0 HG23 VAL A 18 -6.682 -3.601 30.912 1.00 0.26 H new ATOM 282 N VAL A 19 -9.095 -4.992 32.821 1.00 0.22 N ATOM 283 CA VAL A 19 -8.786 -4.875 34.273 1.00 0.21 C ATOM 284 C VAL A 19 -7.606 -5.773 34.646 1.00 0.22 C ATOM 285 O VAL A 19 -7.574 -6.941 34.314 1.00 0.23 O ATOM 286 CB VAL A 19 -10.056 -5.344 34.983 1.00 0.22 C ATOM 287 CG1 VAL A 19 -9.935 -5.072 36.484 1.00 0.23 C ATOM 288 CG2 VAL A 19 -11.262 -4.587 34.421 1.00 0.24 C ATOM 0 H VAL A 19 -9.450 -5.901 32.523 1.00 0.22 H new ATOM 0 HA VAL A 19 -8.508 -3.859 34.552 1.00 0.21 H new ATOM 0 HB VAL A 19 -10.189 -6.413 34.820 1.00 0.22 H new ATOM 0 HG11 VAL A 19 -10.841 -5.407 36.989 1.00 0.23 H new ATOM 0 HG12 VAL A 19 -9.077 -5.612 36.884 1.00 0.23 H new ATOM 0 HG13 VAL A 19 -9.801 -4.003 36.650 1.00 0.23 H new ATOM 0 HG21 VAL A 19 -12.168 -4.920 34.926 1.00 0.24 H new ATOM 0 HG22 VAL A 19 -11.128 -3.518 34.584 1.00 0.24 H new ATOM 0 HG23 VAL A 19 -11.349 -4.783 33.352 1.00 0.24 H new ATOM 298 N ILE A 20 -6.683 -5.262 35.414 1.00 0.22 N ATOM 299 CA ILE A 20 -5.564 -6.117 35.900 1.00 0.24 C ATOM 300 C ILE A 20 -6.014 -6.892 37.144 1.00 0.24 C ATOM 301 O ILE A 20 -6.587 -6.324 38.046 1.00 0.23 O ATOM 302 CB ILE A 20 -4.444 -5.126 36.239 1.00 0.23 C ATOM 303 CG1 ILE A 20 -3.658 -4.798 34.967 1.00 0.29 C ATOM 304 CG2 ILE A 20 -3.498 -5.732 37.278 1.00 0.24 C ATOM 305 CD1 ILE A 20 -4.598 -4.182 33.931 1.00 1.38 C ATOM 0 H ILE A 20 -6.656 -4.291 35.725 1.00 0.22 H new ATOM 0 HA ILE A 20 -5.239 -6.857 35.169 1.00 0.24 H new ATOM 0 HB ILE A 20 -4.885 -4.217 36.649 1.00 0.23 H new ATOM 0 HG12 ILE A 20 -2.848 -4.105 35.196 1.00 0.29 H new ATOM 0 HG13 ILE A 20 -3.200 -5.702 34.566 1.00 0.29 H new ATOM 0 HG21 ILE A 20 -2.707 -5.019 37.510 1.00 0.24 H new ATOM 0 HG22 ILE A 20 -4.055 -5.964 38.186 1.00 0.24 H new ATOM 0 HG23 ILE A 20 -3.057 -6.646 36.879 1.00 0.24 H new ATOM 0 HD11 ILE A 20 -4.038 -3.948 33.025 1.00 1.38 H new ATOM 0 HD12 ILE A 20 -5.393 -4.890 33.694 1.00 1.38 H new ATOM 0 HD13 ILE A 20 -5.034 -3.268 34.334 1.00 1.38 H new ATOM 317 N PRO A 21 -5.695 -8.157 37.171 1.00 0.28 N ATOM 318 CA PRO A 21 -6.028 -8.999 38.348 1.00 0.30 C ATOM 319 C PRO A 21 -5.377 -8.421 39.608 1.00 0.28 C ATOM 320 O PRO A 21 -4.286 -7.896 39.566 1.00 0.27 O ATOM 321 CB PRO A 21 -5.444 -10.372 38.009 1.00 0.35 C ATOM 322 CG PRO A 21 -4.542 -10.158 36.833 1.00 0.35 C ATOM 323 CD PRO A 21 -5.006 -8.913 36.127 1.00 0.32 C ATOM 0 HA PRO A 21 -7.099 -9.048 38.547 1.00 0.30 H new ATOM 0 HB2 PRO A 21 -4.892 -10.781 38.855 1.00 0.35 H new ATOM 0 HB3 PRO A 21 -6.234 -11.084 37.770 1.00 0.35 H new ATOM 0 HG2 PRO A 21 -3.507 -10.051 37.158 1.00 0.35 H new ATOM 0 HG3 PRO A 21 -4.578 -11.016 36.161 1.00 0.35 H new ATOM 0 HD2 PRO A 21 -4.168 -8.352 35.713 1.00 0.32 H new ATOM 0 HD3 PRO A 21 -5.673 -9.148 35.297 1.00 0.32 H new ATOM 331 N ILE A 22 -6.046 -8.496 40.726 1.00 0.30 N ATOM 332 CA ILE A 22 -5.464 -7.921 41.976 1.00 0.30 C ATOM 333 C ILE A 22 -4.081 -8.512 42.241 1.00 0.32 C ATOM 334 O ILE A 22 -3.200 -7.845 42.744 1.00 0.32 O ATOM 335 CB ILE A 22 -6.439 -8.318 43.085 1.00 0.35 C ATOM 336 CG1 ILE A 22 -6.101 -7.547 44.364 1.00 0.41 C ATOM 337 CG2 ILE A 22 -6.325 -9.820 43.352 1.00 0.42 C ATOM 338 CD1 ILE A 22 -6.342 -6.054 44.140 1.00 1.11 C ATOM 0 H ILE A 22 -6.965 -8.927 40.830 1.00 0.30 H new ATOM 0 HA ILE A 22 -5.337 -6.840 41.911 1.00 0.30 H new ATOM 0 HB ILE A 22 -7.456 -8.080 42.775 1.00 0.35 H new ATOM 0 HG12 ILE A 22 -6.715 -7.905 45.190 1.00 0.41 H new ATOM 0 HG13 ILE A 22 -5.061 -7.720 44.642 1.00 0.41 H new ATOM 0 HG21 ILE A 22 -7.020 -10.103 44.143 1.00 0.42 H new ATOM 0 HG22 ILE A 22 -6.566 -10.371 42.443 1.00 0.42 H new ATOM 0 HG23 ILE A 22 -5.307 -10.058 43.661 1.00 0.42 H new ATOM 0 HD11 ILE A 22 -6.101 -5.506 45.051 1.00 1.11 H new ATOM 0 HD12 ILE A 22 -5.709 -5.701 43.326 1.00 1.11 H new ATOM 0 HD13 ILE A 22 -7.388 -5.889 43.883 1.00 1.11 H new ATOM 350 N GLU A 23 -3.872 -9.746 41.886 1.00 0.36 N ATOM 351 CA GLU A 23 -2.530 -10.352 42.102 1.00 0.40 C ATOM 352 C GLU A 23 -1.465 -9.534 41.368 1.00 0.37 C ATOM 353 O GLU A 23 -0.363 -9.350 41.846 1.00 0.39 O ATOM 354 CB GLU A 23 -2.630 -11.755 41.500 1.00 0.44 C ATOM 355 CG GLU A 23 -1.344 -12.531 41.796 1.00 1.22 C ATOM 356 CD GLU A 23 -1.403 -13.897 41.109 1.00 1.62 C ATOM 357 OE1 GLU A 23 -2.389 -14.161 40.441 1.00 2.01 O ATOM 358 OE2 GLU A 23 -0.460 -14.656 41.262 1.00 2.37 O ATOM 0 H GLU A 23 -4.566 -10.359 41.458 1.00 0.36 H new ATOM 0 HA GLU A 23 -2.250 -10.378 43.155 1.00 0.40 H new ATOM 0 HB2 GLU A 23 -3.489 -12.281 41.917 1.00 0.44 H new ATOM 0 HB3 GLU A 23 -2.788 -11.690 40.424 1.00 0.44 H new ATOM 0 HG2 GLU A 23 -0.479 -11.971 41.441 1.00 1.22 H new ATOM 0 HG3 GLU A 23 -1.223 -12.658 42.872 1.00 1.22 H new ATOM 365 N LEU A 24 -1.806 -9.005 40.227 1.00 0.34 N ATOM 366 CA LEU A 24 -0.841 -8.166 39.465 1.00 0.33 C ATOM 367 C LEU A 24 -0.831 -6.734 40.001 1.00 0.29 C ATOM 368 O LEU A 24 0.190 -6.082 40.016 1.00 0.29 O ATOM 369 CB LEU A 24 -1.333 -8.200 38.019 1.00 0.33 C ATOM 370 CG LEU A 24 -1.202 -9.621 37.467 1.00 0.94 C ATOM 371 CD1 LEU A 24 -1.556 -9.626 35.978 1.00 1.41 C ATOM 372 CD2 LEU A 24 0.238 -10.104 37.647 1.00 1.75 C ATOM 0 H LEU A 24 -2.719 -9.119 39.786 1.00 0.34 H new ATOM 0 HA LEU A 24 0.180 -8.537 39.554 1.00 0.33 H new ATOM 0 HB2 LEU A 24 -2.372 -7.874 37.970 1.00 0.33 H new ATOM 0 HB3 LEU A 24 -0.752 -7.507 37.410 1.00 0.33 H new ATOM 0 HG LEU A 24 -1.881 -10.283 38.004 1.00 0.94 H new ATOM 0 HD11 LEU A 24 -1.463 -10.638 35.585 1.00 1.41 H new ATOM 0 HD12 LEU A 24 -2.581 -9.279 35.847 1.00 1.41 H new ATOM 0 HD13 LEU A 24 -0.877 -8.964 35.440 1.00 1.41 H new ATOM 0 HD21 LEU A 24 0.334 -11.116 37.254 1.00 1.75 H new ATOM 0 HD22 LEU A 24 0.914 -9.440 37.108 1.00 1.75 H new ATOM 0 HD23 LEU A 24 0.493 -10.100 38.707 1.00 1.75 H new ATOM 384 N ARG A 25 -1.934 -6.267 40.523 1.00 0.25 N ATOM 385 CA ARG A 25 -1.923 -4.908 41.138 1.00 0.23 C ATOM 386 C ARG A 25 -0.872 -4.869 42.243 1.00 0.25 C ATOM 387 O ARG A 25 -0.134 -3.914 42.380 1.00 0.25 O ATOM 388 CB ARG A 25 -3.317 -4.701 41.742 1.00 0.22 C ATOM 389 CG ARG A 25 -4.397 -4.781 40.661 1.00 0.21 C ATOM 390 CD ARG A 25 -5.740 -4.352 41.267 1.00 0.22 C ATOM 391 NE ARG A 25 -6.777 -4.913 40.363 1.00 0.23 N ATOM 392 CZ ARG A 25 -8.003 -5.066 40.787 1.00 0.26 C ATOM 393 NH1 ARG A 25 -8.330 -4.704 41.998 1.00 0.30 N ATOM 394 NH2 ARG A 25 -8.905 -5.578 39.995 1.00 0.27 N ATOM 0 H ARG A 25 -2.828 -6.758 40.551 1.00 0.25 H new ATOM 0 HA ARG A 25 -1.688 -4.133 40.409 1.00 0.23 H new ATOM 0 HB2 ARG A 25 -3.503 -5.457 42.505 1.00 0.22 H new ATOM 0 HB3 ARG A 25 -3.363 -3.731 42.237 1.00 0.22 H new ATOM 0 HG2 ARG A 25 -4.139 -4.135 39.822 1.00 0.21 H new ATOM 0 HG3 ARG A 25 -4.466 -5.797 40.272 1.00 0.21 H new ATOM 0 HD2 ARG A 25 -5.854 -4.735 42.281 1.00 0.22 H new ATOM 0 HD3 ARG A 25 -5.816 -3.266 41.326 1.00 0.22 H new ATOM 0 HE ARG A 25 -6.531 -5.179 39.410 1.00 0.23 H new ATOM 0 HH11 ARG A 25 -7.627 -4.300 42.617 1.00 0.30 H new ATOM 0 HH12 ARG A 25 -9.288 -4.825 42.325 1.00 0.30 H new ATOM 0 HH21 ARG A 25 -8.652 -5.858 39.047 1.00 0.27 H new ATOM 0 HH22 ARG A 25 -9.863 -5.699 40.324 1.00 0.27 H new ATOM 408 N ARG A 26 -0.827 -5.888 43.055 1.00 0.29 N ATOM 409 CA ARG A 26 0.148 -5.894 44.185 1.00 0.33 C ATOM 410 C ARG A 26 1.575 -6.112 43.670 1.00 0.35 C ATOM 411 O ARG A 26 2.497 -5.419 44.053 1.00 0.35 O ATOM 412 CB ARG A 26 -0.281 -7.066 45.068 1.00 0.37 C ATOM 413 CG ARG A 26 -1.673 -6.791 45.640 1.00 1.07 C ATOM 414 CD ARG A 26 -2.057 -7.912 46.611 1.00 1.25 C ATOM 415 NE ARG A 26 -3.490 -7.666 46.933 1.00 1.85 N ATOM 416 CZ ARG A 26 -3.826 -6.682 47.724 1.00 2.32 C ATOM 417 NH1 ARG A 26 -2.908 -5.907 48.235 1.00 2.40 N ATOM 418 NH2 ARG A 26 -5.083 -6.473 48.004 1.00 3.26 N ATOM 0 H ARG A 26 -1.420 -6.715 42.987 1.00 0.29 H new ATOM 0 HA ARG A 26 0.151 -4.947 44.725 1.00 0.33 H new ATOM 0 HB2 ARG A 26 -0.291 -7.988 44.487 1.00 0.37 H new ATOM 0 HB3 ARG A 26 0.435 -7.207 45.878 1.00 0.37 H new ATOM 0 HG2 ARG A 26 -1.683 -5.830 46.155 1.00 1.07 H new ATOM 0 HG3 ARG A 26 -2.403 -6.728 44.833 1.00 1.07 H new ATOM 0 HD2 ARG A 26 -1.917 -8.893 46.157 1.00 1.25 H new ATOM 0 HD3 ARG A 26 -1.440 -7.885 47.509 1.00 1.25 H new ATOM 0 HE ARG A 26 -4.211 -8.267 46.535 1.00 1.85 H new ATOM 0 HH11 ARG A 26 -1.925 -6.069 48.017 1.00 2.40 H new ATOM 0 HH12 ARG A 26 -3.174 -5.140 48.852 1.00 2.40 H new ATOM 0 HH21 ARG A 26 -5.802 -7.077 47.606 1.00 3.26 H new ATOM 0 HH22 ARG A 26 -5.347 -5.705 48.621 1.00 3.26 H new ATOM 432 N THR A 27 1.767 -7.084 42.821 1.00 0.37 N ATOM 433 CA THR A 27 3.139 -7.373 42.310 1.00 0.41 C ATOM 434 C THR A 27 3.685 -6.194 41.500 1.00 0.39 C ATOM 435 O THR A 27 4.879 -5.971 41.447 1.00 0.42 O ATOM 436 CB THR A 27 2.977 -8.606 41.417 1.00 0.44 C ATOM 437 OG1 THR A 27 2.356 -9.647 42.158 1.00 0.61 O ATOM 438 CG2 THR A 27 4.350 -9.070 40.930 1.00 0.77 C ATOM 0 H THR A 27 1.033 -7.692 42.458 1.00 0.37 H new ATOM 0 HA THR A 27 3.845 -7.540 43.123 1.00 0.41 H new ATOM 0 HB THR A 27 2.357 -8.353 40.557 1.00 0.44 H new ATOM 0 HG1 THR A 27 1.382 -9.545 42.112 1.00 0.61 H new ATOM 0 HG21 THR A 27 4.233 -9.948 40.294 1.00 0.77 H new ATOM 0 HG22 THR A 27 4.823 -8.270 40.361 1.00 0.77 H new ATOM 0 HG23 THR A 27 4.974 -9.323 41.787 1.00 0.77 H new ATOM 446 N LEU A 28 2.835 -5.469 40.831 1.00 0.35 N ATOM 447 CA LEU A 28 3.327 -4.349 39.979 1.00 0.34 C ATOM 448 C LEU A 28 3.448 -3.059 40.798 1.00 0.32 C ATOM 449 O LEU A 28 3.926 -2.052 40.312 1.00 0.33 O ATOM 450 CB LEU A 28 2.273 -4.197 38.879 1.00 0.32 C ATOM 451 CG LEU A 28 2.791 -3.241 37.804 1.00 0.44 C ATOM 452 CD1 LEU A 28 3.891 -3.932 36.993 1.00 0.70 C ATOM 453 CD2 LEU A 28 1.641 -2.852 36.872 1.00 1.05 C ATOM 0 H LEU A 28 1.824 -5.601 40.836 1.00 0.35 H new ATOM 0 HA LEU A 28 4.318 -4.549 39.571 1.00 0.34 H new ATOM 0 HB2 LEU A 28 2.049 -5.169 38.439 1.00 0.32 H new ATOM 0 HB3 LEU A 28 1.343 -3.816 39.302 1.00 0.32 H new ATOM 0 HG LEU A 28 3.196 -2.347 38.278 1.00 0.44 H new ATOM 0 HD11 LEU A 28 4.260 -3.251 36.227 1.00 0.70 H new ATOM 0 HD12 LEU A 28 4.710 -4.212 37.655 1.00 0.70 H new ATOM 0 HD13 LEU A 28 3.486 -4.826 36.519 1.00 0.70 H new ATOM 0 HD21 LEU A 28 2.009 -2.170 36.105 1.00 1.05 H new ATOM 0 HD22 LEU A 28 1.238 -3.747 36.399 1.00 1.05 H new ATOM 0 HD23 LEU A 28 0.856 -2.361 37.448 1.00 1.05 H new ATOM 465 N GLY A 29 3.038 -3.081 42.036 1.00 0.32 N ATOM 466 CA GLY A 29 3.151 -1.854 42.876 1.00 0.32 C ATOM 467 C GLY A 29 2.244 -0.761 42.313 1.00 0.29 C ATOM 468 O GLY A 29 2.621 0.391 42.230 1.00 0.29 O ATOM 0 H GLY A 29 2.631 -3.892 42.502 1.00 0.32 H new ATOM 0 HA2 GLY A 29 2.871 -2.079 43.905 1.00 0.32 H new ATOM 0 HA3 GLY A 29 4.185 -1.508 42.895 1.00 0.32 H new ATOM 472 N ILE A 30 1.061 -1.116 41.901 1.00 0.27 N ATOM 473 CA ILE A 30 0.140 -0.099 41.313 1.00 0.24 C ATOM 474 C ILE A 30 -1.111 0.059 42.177 1.00 0.23 C ATOM 475 O ILE A 30 -1.637 -0.893 42.716 1.00 0.26 O ATOM 476 CB ILE A 30 -0.225 -0.636 39.932 1.00 0.26 C ATOM 477 CG1 ILE A 30 1.049 -0.824 39.105 1.00 0.41 C ATOM 478 CG2 ILE A 30 -1.147 0.360 39.224 1.00 0.33 C ATOM 479 CD1 ILE A 30 1.886 0.459 39.162 1.00 0.29 C ATOM 0 H ILE A 30 0.690 -2.065 41.945 1.00 0.27 H new ATOM 0 HA ILE A 30 0.606 0.885 41.256 1.00 0.24 H new ATOM 0 HB ILE A 30 -0.736 -1.593 40.039 1.00 0.26 H new ATOM 0 HG12 ILE A 30 1.625 -1.665 39.491 1.00 0.41 H new ATOM 0 HG13 ILE A 30 0.794 -1.059 38.072 1.00 0.41 H new ATOM 0 HG21 ILE A 30 -1.408 -0.023 38.238 1.00 0.33 H new ATOM 0 HG22 ILE A 30 -2.055 0.497 39.812 1.00 0.33 H new ATOM 0 HG23 ILE A 30 -0.636 1.317 39.118 1.00 0.33 H new ATOM 0 HD11 ILE A 30 2.794 0.327 38.574 1.00 0.29 H new ATOM 0 HD12 ILE A 30 1.308 1.289 38.756 1.00 0.29 H new ATOM 0 HD13 ILE A 30 2.152 0.674 40.197 1.00 0.29 H new ATOM 491 N ALA A 31 -1.560 1.269 42.342 1.00 0.22 N ATOM 492 CA ALA A 31 -2.745 1.528 43.209 1.00 0.23 C ATOM 493 C ALA A 31 -3.617 2.622 42.591 1.00 0.20 C ATOM 494 O ALA A 31 -3.214 3.310 41.674 1.00 0.18 O ATOM 495 CB ALA A 31 -2.163 2.007 44.538 1.00 0.23 C ATOM 0 H ALA A 31 -1.154 2.099 41.910 1.00 0.22 H new ATOM 0 HA ALA A 31 -3.371 0.644 43.329 1.00 0.23 H new ATOM 0 HB1 ALA A 31 -2.974 2.220 45.235 1.00 0.23 H new ATOM 0 HB2 ALA A 31 -1.521 1.231 44.955 1.00 0.23 H new ATOM 0 HB3 ALA A 31 -1.578 2.912 44.374 1.00 0.23 H new ATOM 501 N GLU A 32 -4.813 2.790 43.083 1.00 0.22 N ATOM 502 CA GLU A 32 -5.710 3.838 42.517 1.00 0.21 C ATOM 503 C GLU A 32 -5.005 5.200 42.504 1.00 0.19 C ATOM 504 O GLU A 32 -4.248 5.526 43.395 1.00 0.20 O ATOM 505 CB GLU A 32 -6.914 3.872 43.459 1.00 0.25 C ATOM 506 CG GLU A 32 -7.966 4.835 42.906 1.00 0.27 C ATOM 507 CD GLU A 32 -9.122 4.955 43.902 1.00 0.32 C ATOM 508 OE1 GLU A 32 -9.059 4.307 44.933 1.00 1.12 O ATOM 509 OE2 GLU A 32 -10.050 5.693 43.615 1.00 1.13 O ATOM 0 H GLU A 32 -5.208 2.248 43.851 1.00 0.22 H new ATOM 0 HA GLU A 32 -5.996 3.622 41.488 1.00 0.21 H new ATOM 0 HB2 GLU A 32 -7.338 2.873 43.561 1.00 0.25 H new ATOM 0 HB3 GLU A 32 -6.602 4.189 44.454 1.00 0.25 H new ATOM 0 HG2 GLU A 32 -7.521 5.814 42.729 1.00 0.27 H new ATOM 0 HG3 GLU A 32 -8.335 4.475 41.946 1.00 0.27 H new ATOM 516 N LYS A 33 -5.302 6.012 41.521 1.00 0.19 N ATOM 517 CA LYS A 33 -4.721 7.391 41.452 1.00 0.20 C ATOM 518 C LYS A 33 -3.245 7.353 41.034 1.00 0.18 C ATOM 519 O LYS A 33 -2.653 8.374 40.747 1.00 0.21 O ATOM 520 CB LYS A 33 -4.860 7.972 42.863 1.00 0.23 C ATOM 521 CG LYS A 33 -4.712 9.494 42.803 1.00 0.29 C ATOM 522 CD LYS A 33 -4.785 10.072 44.218 1.00 0.87 C ATOM 523 CE LYS A 33 -4.799 11.600 44.145 1.00 1.35 C ATOM 524 NZ LYS A 33 -6.174 11.992 44.558 1.00 1.88 N ATOM 0 H LYS A 33 -5.930 5.776 40.753 1.00 0.19 H new ATOM 0 HA LYS A 33 -5.238 7.997 40.708 1.00 0.20 H new ATOM 0 HB2 LYS A 33 -5.830 7.706 43.284 1.00 0.23 H new ATOM 0 HB3 LYS A 33 -4.101 7.547 43.520 1.00 0.23 H new ATOM 0 HG2 LYS A 33 -3.762 9.759 42.339 1.00 0.29 H new ATOM 0 HG3 LYS A 33 -5.500 9.922 42.183 1.00 0.29 H new ATOM 0 HD2 LYS A 33 -5.682 9.713 44.723 1.00 0.87 H new ATOM 0 HD3 LYS A 33 -3.931 9.733 44.805 1.00 0.87 H new ATOM 0 HE2 LYS A 33 -4.049 12.034 44.807 1.00 1.35 H new ATOM 0 HE3 LYS A 33 -4.575 11.949 43.137 1.00 1.35 H new ATOM 0 HZ1 LYS A 33 -6.262 13.028 44.533 1.00 1.88 H new ATOM 0 HZ2 LYS A 33 -6.866 11.570 43.906 1.00 1.88 H new ATOM 0 HZ3 LYS A 33 -6.357 11.652 45.524 1.00 1.88 H new ATOM 538 N ASP A 34 -2.674 6.186 40.889 1.00 0.16 N ATOM 539 CA ASP A 34 -1.278 6.111 40.367 1.00 0.16 C ATOM 540 C ASP A 34 -1.274 6.328 38.853 1.00 0.19 C ATOM 541 O ASP A 34 -2.311 6.360 38.223 1.00 0.20 O ATOM 542 CB ASP A 34 -0.793 4.707 40.714 1.00 0.17 C ATOM 543 CG ASP A 34 -0.505 4.631 42.213 1.00 0.18 C ATOM 544 OD1 ASP A 34 -0.568 5.661 42.864 1.00 1.10 O ATOM 545 OD2 ASP A 34 -0.227 3.543 42.684 1.00 1.08 O ATOM 0 H ASP A 34 -3.109 5.290 41.107 1.00 0.16 H new ATOM 0 HA ASP A 34 -0.633 6.875 40.800 1.00 0.16 H new ATOM 0 HB2 ASP A 34 -1.548 3.970 40.439 1.00 0.17 H new ATOM 0 HB3 ASP A 34 0.107 4.469 40.146 1.00 0.17 H new ATOM 550 N ALA A 35 -0.125 6.559 38.277 1.00 0.22 N ATOM 551 CA ALA A 35 -0.078 6.872 36.820 1.00 0.28 C ATOM 552 C ALA A 35 0.396 5.655 36.018 1.00 0.20 C ATOM 553 O ALA A 35 1.434 5.084 36.289 1.00 0.16 O ATOM 554 CB ALA A 35 0.924 8.020 36.696 1.00 0.36 C ATOM 0 H ALA A 35 0.779 6.545 38.750 1.00 0.22 H new ATOM 0 HA ALA A 35 -1.060 7.138 36.428 1.00 0.28 H new ATOM 0 HB1 ALA A 35 1.017 8.311 35.650 1.00 0.36 H new ATOM 0 HB2 ALA A 35 0.575 8.872 37.280 1.00 0.36 H new ATOM 0 HB3 ALA A 35 1.896 7.697 37.070 1.00 0.36 H new ATOM 560 N LEU A 36 -0.308 5.323 34.970 1.00 0.24 N ATOM 561 CA LEU A 36 0.146 4.223 34.069 1.00 0.21 C ATOM 562 C LEU A 36 0.621 4.819 32.743 1.00 0.20 C ATOM 563 O LEU A 36 -0.012 5.703 32.203 1.00 0.23 O ATOM 564 CB LEU A 36 -1.094 3.364 33.830 1.00 0.34 C ATOM 565 CG LEU A 36 -1.783 3.054 35.157 1.00 0.45 C ATOM 566 CD1 LEU A 36 -3.215 2.595 34.880 1.00 0.55 C ATOM 567 CD2 LEU A 36 -1.023 1.940 35.881 1.00 0.56 C ATOM 0 H LEU A 36 -1.184 5.769 34.697 1.00 0.24 H new ATOM 0 HA LEU A 36 0.967 3.648 34.497 1.00 0.21 H new ATOM 0 HB2 LEU A 36 -1.784 3.885 33.166 1.00 0.34 H new ATOM 0 HB3 LEU A 36 -0.812 2.436 33.332 1.00 0.34 H new ATOM 0 HG LEU A 36 -1.795 3.947 35.782 1.00 0.45 H new ATOM 0 HD11 LEU A 36 -3.714 2.371 35.823 1.00 0.55 H new ATOM 0 HD12 LEU A 36 -3.757 3.386 34.361 1.00 0.55 H new ATOM 0 HD13 LEU A 36 -3.196 1.700 34.258 1.00 0.55 H new ATOM 0 HD21 LEU A 36 -1.516 1.720 36.828 1.00 0.56 H new ATOM 0 HD22 LEU A 36 -1.012 1.044 35.260 1.00 0.56 H new ATOM 0 HD23 LEU A 36 0.001 2.262 36.071 1.00 0.56 H new ATOM 579 N GLU A 37 1.632 4.258 32.142 1.00 0.19 N ATOM 580 CA GLU A 37 2.012 4.721 30.779 1.00 0.21 C ATOM 581 C GLU A 37 1.641 3.652 29.751 1.00 0.19 C ATOM 582 O GLU A 37 1.719 2.468 30.015 1.00 0.20 O ATOM 583 CB GLU A 37 3.524 4.940 30.826 1.00 0.25 C ATOM 584 CG GLU A 37 3.996 5.534 29.497 1.00 0.26 C ATOM 585 CD GLU A 37 5.517 5.701 29.524 1.00 0.37 C ATOM 586 OE1 GLU A 37 6.110 5.385 30.542 1.00 1.17 O ATOM 587 OE2 GLU A 37 6.062 6.145 28.527 1.00 1.08 O ATOM 0 H GLU A 37 2.205 3.508 32.529 1.00 0.19 H new ATOM 0 HA GLU A 37 1.494 5.635 30.490 1.00 0.21 H new ATOM 0 HB2 GLU A 37 3.780 5.610 31.647 1.00 0.25 H new ATOM 0 HB3 GLU A 37 4.033 3.995 31.015 1.00 0.25 H new ATOM 0 HG2 GLU A 37 3.706 4.883 28.672 1.00 0.26 H new ATOM 0 HG3 GLU A 37 3.517 6.498 29.327 1.00 0.26 H new ATOM 594 N ILE A 38 1.112 4.067 28.635 1.00 0.21 N ATOM 595 CA ILE A 38 0.582 3.089 27.646 1.00 0.20 C ATOM 596 C ILE A 38 1.499 3.014 26.427 1.00 0.20 C ATOM 597 O ILE A 38 1.902 4.020 25.872 1.00 0.24 O ATOM 598 CB ILE A 38 -0.790 3.633 27.249 1.00 0.26 C ATOM 599 CG1 ILE A 38 -1.657 3.792 28.500 1.00 0.80 C ATOM 600 CG2 ILE A 38 -1.467 2.659 26.281 1.00 0.73 C ATOM 601 CD1 ILE A 38 -2.982 4.458 28.124 1.00 0.84 C ATOM 0 H ILE A 38 1.024 5.046 28.364 1.00 0.21 H new ATOM 0 HA ILE A 38 0.521 2.081 28.057 1.00 0.20 H new ATOM 0 HB ILE A 38 -0.669 4.602 26.764 1.00 0.26 H new ATOM 0 HG12 ILE A 38 -1.843 2.818 28.952 1.00 0.80 H new ATOM 0 HG13 ILE A 38 -1.134 4.394 29.243 1.00 0.80 H new ATOM 0 HG21 ILE A 38 -2.445 3.048 25.999 1.00 0.73 H new ATOM 0 HG22 ILE A 38 -0.851 2.545 25.389 1.00 0.73 H new ATOM 0 HG23 ILE A 38 -1.588 1.690 26.765 1.00 0.73 H new ATOM 0 HD11 ILE A 38 -3.599 4.571 29.016 1.00 0.84 H new ATOM 0 HD12 ILE A 38 -2.786 5.439 27.692 1.00 0.84 H new ATOM 0 HD13 ILE A 38 -3.507 3.839 27.396 1.00 0.84 H new ATOM 613 N TYR A 39 1.841 1.821 26.034 1.00 0.19 N ATOM 614 CA TYR A 39 2.755 1.619 24.876 1.00 0.21 C ATOM 615 C TYR A 39 2.038 0.832 23.775 1.00 0.20 C ATOM 616 O TYR A 39 1.172 0.027 24.047 1.00 0.20 O ATOM 617 CB TYR A 39 3.901 0.783 25.442 1.00 0.24 C ATOM 618 CG TYR A 39 4.851 1.645 26.225 1.00 0.28 C ATOM 619 CD1 TYR A 39 4.450 2.222 27.435 1.00 0.32 C ATOM 620 CD2 TYR A 39 6.142 1.846 25.745 1.00 0.31 C ATOM 621 CE1 TYR A 39 5.349 3.009 28.165 1.00 0.37 C ATOM 622 CE2 TYR A 39 7.042 2.631 26.470 1.00 0.36 C ATOM 623 CZ TYR A 39 6.648 3.215 27.681 1.00 0.39 C ATOM 624 OH TYR A 39 7.537 3.994 28.393 1.00 0.45 O ATOM 0 H TYR A 39 1.519 0.959 26.475 1.00 0.19 H new ATOM 0 HA TYR A 39 3.092 2.559 24.440 1.00 0.21 H new ATOM 0 HB2 TYR A 39 3.502 -0.003 26.083 1.00 0.24 H new ATOM 0 HB3 TYR A 39 4.435 0.291 24.629 1.00 0.24 H new ATOM 0 HD1 TYR A 39 3.448 2.061 27.805 1.00 0.32 H new ATOM 0 HD2 TYR A 39 6.448 1.395 24.812 1.00 0.31 H new ATOM 0 HE1 TYR A 39 5.042 3.456 29.099 1.00 0.37 H new ATOM 0 HE2 TYR A 39 8.043 2.788 26.096 1.00 0.36 H new ATOM 0 HH TYR A 39 7.348 4.941 28.227 1.00 0.45 H new ATOM 634 N VAL A 40 2.479 0.953 22.553 1.00 0.21 N ATOM 635 CA VAL A 40 1.910 0.088 21.477 1.00 0.22 C ATOM 636 C VAL A 40 3.029 -0.566 20.662 1.00 0.22 C ATOM 637 O VAL A 40 3.907 0.100 20.149 1.00 0.23 O ATOM 638 CB VAL A 40 1.088 1.030 20.600 1.00 0.25 C ATOM 639 CG1 VAL A 40 0.580 0.267 19.375 1.00 0.27 C ATOM 640 CG2 VAL A 40 -0.105 1.554 21.402 1.00 0.27 C ATOM 0 H VAL A 40 3.202 1.607 22.253 1.00 0.21 H new ATOM 0 HA VAL A 40 1.305 -0.723 21.884 1.00 0.22 H new ATOM 0 HB VAL A 40 1.708 1.866 20.278 1.00 0.25 H new ATOM 0 HG11 VAL A 40 -0.007 0.937 18.747 1.00 0.27 H new ATOM 0 HG12 VAL A 40 1.428 -0.114 18.806 1.00 0.27 H new ATOM 0 HG13 VAL A 40 -0.043 -0.567 19.698 1.00 0.27 H new ATOM 0 HG21 VAL A 40 -0.695 2.227 20.779 1.00 0.27 H new ATOM 0 HG22 VAL A 40 -0.726 0.716 21.720 1.00 0.27 H new ATOM 0 HG23 VAL A 40 0.254 2.092 22.279 1.00 0.27 H new ATOM 650 N ASP A 41 2.999 -1.866 20.528 1.00 0.21 N ATOM 651 CA ASP A 41 4.052 -2.559 19.731 1.00 0.22 C ATOM 652 C ASP A 41 3.474 -3.796 19.033 1.00 0.25 C ATOM 653 O ASP A 41 2.732 -4.555 19.615 1.00 0.27 O ATOM 654 CB ASP A 41 5.116 -2.964 20.750 1.00 0.20 C ATOM 655 CG ASP A 41 4.522 -3.960 21.748 1.00 1.01 C ATOM 656 OD1 ASP A 41 3.308 -4.062 21.802 1.00 1.69 O ATOM 657 OD2 ASP A 41 5.292 -4.602 22.443 1.00 1.77 O ATOM 0 H ASP A 41 2.291 -2.477 20.936 1.00 0.21 H new ATOM 0 HA ASP A 41 4.458 -1.921 18.946 1.00 0.22 H new ATOM 0 HB2 ASP A 41 5.970 -3.410 20.241 1.00 0.20 H new ATOM 0 HB3 ASP A 41 5.484 -2.083 21.276 1.00 0.20 H new ATOM 662 N ASP A 42 3.901 -4.062 17.829 1.00 0.27 N ATOM 663 CA ASP A 42 3.478 -5.319 17.142 1.00 0.33 C ATOM 664 C ASP A 42 1.978 -5.584 17.339 1.00 0.33 C ATOM 665 O ASP A 42 1.566 -6.704 17.563 1.00 0.37 O ATOM 666 CB ASP A 42 4.309 -6.416 17.802 1.00 0.38 C ATOM 667 CG ASP A 42 3.920 -7.775 17.217 1.00 0.45 C ATOM 668 OD1 ASP A 42 3.167 -7.792 16.257 1.00 1.22 O ATOM 669 OD2 ASP A 42 4.386 -8.777 17.737 1.00 1.14 O ATOM 0 H ASP A 42 4.526 -3.463 17.289 1.00 0.27 H new ATOM 0 HA ASP A 42 3.635 -5.267 16.065 1.00 0.33 H new ATOM 0 HB2 ASP A 42 5.371 -6.229 17.640 1.00 0.38 H new ATOM 0 HB3 ASP A 42 4.145 -6.412 18.880 1.00 0.38 H new ATOM 674 N GLU A 43 1.156 -4.582 17.181 1.00 0.30 N ATOM 675 CA GLU A 43 -0.321 -4.800 17.269 1.00 0.31 C ATOM 676 C GLU A 43 -0.706 -5.332 18.653 1.00 0.30 C ATOM 677 O GLU A 43 -1.836 -5.708 18.894 1.00 0.31 O ATOM 678 CB GLU A 43 -0.637 -5.834 16.187 1.00 0.35 C ATOM 679 CG GLU A 43 -2.153 -5.986 16.048 1.00 1.17 C ATOM 680 CD GLU A 43 -2.466 -7.087 15.034 1.00 1.34 C ATOM 681 OE1 GLU A 43 -1.529 -7.678 14.523 1.00 1.68 O ATOM 682 OE2 GLU A 43 -3.637 -7.321 14.785 1.00 1.93 O ATOM 0 H GLU A 43 1.441 -3.621 16.995 1.00 0.30 H new ATOM 0 HA GLU A 43 -0.879 -3.875 17.124 1.00 0.31 H new ATOM 0 HB2 GLU A 43 -0.204 -5.524 15.236 1.00 0.35 H new ATOM 0 HB3 GLU A 43 -0.187 -6.793 16.444 1.00 0.35 H new ATOM 0 HG2 GLU A 43 -2.594 -6.231 17.014 1.00 1.17 H new ATOM 0 HG3 GLU A 43 -2.595 -5.044 15.725 1.00 1.17 H new ATOM 689 N LYS A 44 0.203 -5.288 19.585 1.00 0.29 N ATOM 690 CA LYS A 44 -0.132 -5.702 20.977 1.00 0.30 C ATOM 691 C LYS A 44 -0.039 -4.493 21.909 1.00 0.27 C ATOM 692 O LYS A 44 0.665 -3.542 21.636 1.00 0.26 O ATOM 693 CB LYS A 44 0.921 -6.749 21.349 1.00 0.34 C ATOM 694 CG LYS A 44 0.824 -7.935 20.389 1.00 1.29 C ATOM 695 CD LYS A 44 1.706 -9.077 20.898 1.00 1.23 C ATOM 696 CE LYS A 44 3.172 -8.638 20.880 1.00 1.90 C ATOM 697 NZ LYS A 44 3.933 -9.817 21.378 1.00 2.01 N ATOM 0 H LYS A 44 1.166 -4.983 19.444 1.00 0.29 H new ATOM 0 HA LYS A 44 -1.143 -6.101 21.062 1.00 0.30 H new ATOM 0 HB2 LYS A 44 1.918 -6.310 21.302 1.00 0.34 H new ATOM 0 HB3 LYS A 44 0.769 -7.085 22.375 1.00 0.34 H new ATOM 0 HG2 LYS A 44 -0.211 -8.268 20.309 1.00 1.29 H new ATOM 0 HG3 LYS A 44 1.140 -7.635 19.390 1.00 1.29 H new ATOM 0 HD2 LYS A 44 1.411 -9.355 21.910 1.00 1.23 H new ATOM 0 HD3 LYS A 44 1.572 -9.960 20.273 1.00 1.23 H new ATOM 0 HE2 LYS A 44 3.488 -8.360 19.875 1.00 1.90 H new ATOM 0 HE3 LYS A 44 3.331 -7.768 21.517 1.00 1.90 H new ATOM 0 HZ1 LYS A 44 4.948 -9.593 21.394 1.00 2.01 H new ATOM 0 HZ2 LYS A 44 3.615 -10.054 22.339 1.00 2.01 H new ATOM 0 HZ3 LYS A 44 3.768 -10.628 20.748 1.00 2.01 H new ATOM 711 N ILE A 45 -0.761 -4.508 22.994 1.00 0.28 N ATOM 712 CA ILE A 45 -0.726 -3.342 23.920 1.00 0.27 C ATOM 713 C ILE A 45 0.299 -3.582 25.031 1.00 0.27 C ATOM 714 O ILE A 45 0.282 -4.598 25.696 1.00 0.29 O ATOM 715 CB ILE A 45 -2.137 -3.266 24.501 1.00 0.30 C ATOM 716 CG1 ILE A 45 -3.149 -3.155 23.358 1.00 0.34 C ATOM 717 CG2 ILE A 45 -2.253 -2.038 25.404 1.00 0.29 C ATOM 718 CD1 ILE A 45 -4.561 -3.350 23.908 1.00 1.25 C ATOM 0 H ILE A 45 -1.372 -5.274 23.279 1.00 0.28 H new ATOM 0 HA ILE A 45 -0.438 -2.419 23.417 1.00 0.27 H new ATOM 0 HB ILE A 45 -2.340 -4.164 25.084 1.00 0.30 H new ATOM 0 HG12 ILE A 45 -3.066 -2.180 22.878 1.00 0.34 H new ATOM 0 HG13 ILE A 45 -2.937 -3.905 22.596 1.00 0.34 H new ATOM 0 HG21 ILE A 45 -3.260 -1.985 25.818 1.00 0.29 H new ATOM 0 HG22 ILE A 45 -1.530 -2.114 26.216 1.00 0.29 H new ATOM 0 HG23 ILE A 45 -2.052 -1.138 24.822 1.00 0.29 H new ATOM 0 HD11 ILE A 45 -5.282 -3.271 23.095 1.00 1.25 H new ATOM 0 HD12 ILE A 45 -4.639 -4.335 24.368 1.00 1.25 H new ATOM 0 HD13 ILE A 45 -4.770 -2.583 24.654 1.00 1.25 H new ATOM 730 N ILE A 46 1.164 -2.630 25.256 1.00 0.26 N ATOM 731 CA ILE A 46 2.172 -2.762 26.347 1.00 0.29 C ATOM 732 C ILE A 46 1.889 -1.732 27.445 1.00 0.29 C ATOM 733 O ILE A 46 1.852 -0.548 27.198 1.00 0.31 O ATOM 734 CB ILE A 46 3.520 -2.480 25.670 1.00 0.32 C ATOM 735 CG1 ILE A 46 3.767 -3.523 24.580 1.00 0.44 C ATOM 736 CG2 ILE A 46 4.648 -2.535 26.704 1.00 0.37 C ATOM 737 CD1 ILE A 46 3.520 -4.918 25.146 1.00 0.50 C ATOM 0 H ILE A 46 1.216 -1.760 24.726 1.00 0.26 H new ATOM 0 HA ILE A 46 2.154 -3.743 26.821 1.00 0.29 H new ATOM 0 HB ILE A 46 3.498 -1.485 25.225 1.00 0.32 H new ATOM 0 HG12 ILE A 46 3.107 -3.341 23.731 1.00 0.44 H new ATOM 0 HG13 ILE A 46 4.790 -3.444 24.211 1.00 0.44 H new ATOM 0 HG21 ILE A 46 5.601 -2.334 26.214 1.00 0.37 H new ATOM 0 HG22 ILE A 46 4.471 -1.786 27.476 1.00 0.37 H new ATOM 0 HG23 ILE A 46 4.676 -3.525 27.159 1.00 0.37 H new ATOM 0 HD11 ILE A 46 3.696 -5.662 24.369 1.00 0.50 H new ATOM 0 HD12 ILE A 46 4.198 -5.097 25.981 1.00 0.50 H new ATOM 0 HD13 ILE A 46 2.489 -4.993 25.493 1.00 0.50 H new ATOM 749 N LEU A 47 1.675 -2.170 28.652 1.00 0.28 N ATOM 750 CA LEU A 47 1.387 -1.197 29.749 1.00 0.29 C ATOM 751 C LEU A 47 2.406 -1.355 30.878 1.00 0.31 C ATOM 752 O LEU A 47 2.700 -2.450 31.310 1.00 0.39 O ATOM 753 CB LEU A 47 -0.011 -1.550 30.245 1.00 0.34 C ATOM 754 CG LEU A 47 -0.996 -1.516 29.074 1.00 0.90 C ATOM 755 CD1 LEU A 47 -0.888 -2.817 28.275 1.00 1.66 C ATOM 756 CD2 LEU A 47 -2.421 -1.365 29.610 1.00 1.24 C ATOM 0 H LEU A 47 1.686 -3.152 28.929 1.00 0.28 H new ATOM 0 HA LEU A 47 1.447 -0.165 29.404 1.00 0.29 H new ATOM 0 HB2 LEU A 47 -0.007 -2.540 30.701 1.00 0.34 H new ATOM 0 HB3 LEU A 47 -0.323 -0.845 31.016 1.00 0.34 H new ATOM 0 HG LEU A 47 -0.759 -0.672 28.426 1.00 0.90 H new ATOM 0 HD11 LEU A 47 -1.590 -2.791 27.442 1.00 1.66 H new ATOM 0 HD12 LEU A 47 0.127 -2.925 27.892 1.00 1.66 H new ATOM 0 HD13 LEU A 47 -1.124 -3.662 28.922 1.00 1.66 H new ATOM 0 HD21 LEU A 47 -3.123 -1.341 28.776 1.00 1.24 H new ATOM 0 HD22 LEU A 47 -2.657 -2.209 30.259 1.00 1.24 H new ATOM 0 HD23 LEU A 47 -2.500 -0.438 30.178 1.00 1.24 H new ATOM 768 N LYS A 48 2.930 -0.269 31.372 1.00 0.29 N ATOM 769 CA LYS A 48 3.913 -0.362 32.491 1.00 0.35 C ATOM 770 C LYS A 48 3.698 0.779 33.487 1.00 0.28 C ATOM 771 O LYS A 48 3.094 1.783 33.172 1.00 0.25 O ATOM 772 CB LYS A 48 5.289 -0.245 31.834 1.00 0.47 C ATOM 773 CG LYS A 48 5.479 1.162 31.260 1.00 0.65 C ATOM 774 CD LYS A 48 6.871 1.264 30.632 1.00 0.85 C ATOM 775 CE LYS A 48 7.315 2.728 30.606 1.00 1.54 C ATOM 776 NZ LYS A 48 7.584 3.074 32.030 1.00 1.74 N ATOM 0 H LYS A 48 2.722 0.677 31.052 1.00 0.29 H new ATOM 0 HA LYS A 48 3.807 -1.293 33.047 1.00 0.35 H new ATOM 0 HB2 LYS A 48 6.069 -0.456 32.565 1.00 0.47 H new ATOM 0 HB3 LYS A 48 5.386 -0.986 31.041 1.00 0.47 H new ATOM 0 HG2 LYS A 48 4.713 1.369 30.512 1.00 0.65 H new ATOM 0 HG3 LYS A 48 5.366 1.907 32.047 1.00 0.65 H new ATOM 0 HD2 LYS A 48 7.583 0.667 31.202 1.00 0.85 H new ATOM 0 HD3 LYS A 48 6.855 0.860 29.620 1.00 0.85 H new ATOM 0 HE2 LYS A 48 8.206 2.859 29.993 1.00 1.54 H new ATOM 0 HE3 LYS A 48 6.540 3.368 30.184 1.00 1.54 H new ATOM 0 HZ1 LYS A 48 8.277 3.848 32.074 1.00 1.74 H new ATOM 0 HZ2 LYS A 48 6.700 3.375 32.487 1.00 1.74 H new ATOM 0 HZ3 LYS A 48 7.963 2.241 32.524 1.00 1.74 H new ATOM 790 N LYS A 49 4.227 0.652 34.673 1.00 0.28 N ATOM 791 CA LYS A 49 4.093 1.757 35.665 1.00 0.25 C ATOM 792 C LYS A 49 4.705 3.039 35.105 1.00 0.22 C ATOM 793 O LYS A 49 5.630 3.006 34.318 1.00 0.24 O ATOM 794 CB LYS A 49 4.867 1.290 36.895 1.00 0.29 C ATOM 795 CG LYS A 49 4.718 2.318 38.017 1.00 0.30 C ATOM 796 CD LYS A 49 5.552 1.883 39.224 1.00 0.54 C ATOM 797 CE LYS A 49 5.277 2.822 40.401 1.00 1.08 C ATOM 798 NZ LYS A 49 5.388 1.962 41.612 1.00 1.65 N ATOM 0 H LYS A 49 4.744 -0.165 34.997 1.00 0.28 H new ATOM 0 HA LYS A 49 3.051 1.974 35.901 1.00 0.25 H new ATOM 0 HB2 LYS A 49 4.494 0.320 37.225 1.00 0.29 H new ATOM 0 HB3 LYS A 49 5.920 1.159 36.646 1.00 0.29 H new ATOM 0 HG2 LYS A 49 5.044 3.299 37.671 1.00 0.30 H new ATOM 0 HG3 LYS A 49 3.670 2.412 38.301 1.00 0.30 H new ATOM 0 HD2 LYS A 49 5.306 0.857 39.498 1.00 0.54 H new ATOM 0 HD3 LYS A 49 6.612 1.900 38.972 1.00 0.54 H new ATOM 0 HE2 LYS A 49 5.997 3.640 40.430 1.00 1.08 H new ATOM 0 HE3 LYS A 49 4.287 3.271 40.325 1.00 1.08 H new ATOM 0 HZ1 LYS A 49 5.619 2.552 42.437 1.00 1.65 H new ATOM 0 HZ2 LYS A 49 4.484 1.475 41.776 1.00 1.65 H new ATOM 0 HZ3 LYS A 49 6.139 1.257 41.470 1.00 1.65 H new ATOM 812 N TYR A 50 4.152 4.165 35.451 1.00 0.20 N ATOM 813 CA TYR A 50 4.653 5.445 34.877 1.00 0.21 C ATOM 814 C TYR A 50 5.474 6.214 35.913 1.00 0.22 C ATOM 815 O TYR A 50 4.945 6.749 36.866 1.00 0.22 O ATOM 816 CB TYR A 50 3.393 6.226 34.509 1.00 0.20 C ATOM 817 CG TYR A 50 3.779 7.549 33.894 1.00 0.23 C ATOM 818 CD1 TYR A 50 4.893 7.633 33.052 1.00 0.26 C ATOM 819 CD2 TYR A 50 3.024 8.693 34.172 1.00 0.24 C ATOM 820 CE1 TYR A 50 5.251 8.863 32.488 1.00 0.30 C ATOM 821 CE2 TYR A 50 3.381 9.921 33.610 1.00 0.28 C ATOM 822 CZ TYR A 50 4.496 10.008 32.767 1.00 0.30 C ATOM 823 OH TYR A 50 4.849 11.221 32.210 1.00 0.35 O ATOM 0 H TYR A 50 3.375 4.256 36.106 1.00 0.20 H new ATOM 0 HA TYR A 50 5.305 5.283 34.019 1.00 0.21 H new ATOM 0 HB2 TYR A 50 2.788 5.651 33.808 1.00 0.20 H new ATOM 0 HB3 TYR A 50 2.783 6.391 35.397 1.00 0.20 H new ATOM 0 HD1 TYR A 50 5.476 6.750 32.837 1.00 0.26 H new ATOM 0 HD2 TYR A 50 2.164 8.627 34.822 1.00 0.24 H new ATOM 0 HE1 TYR A 50 6.110 8.929 31.837 1.00 0.30 H new ATOM 0 HE2 TYR A 50 2.797 10.804 33.826 1.00 0.28 H new ATOM 0 HH TYR A 50 4.220 11.912 32.505 1.00 0.35 H new ATOM 833 N LYS A 51 6.743 6.383 35.659 1.00 0.25 N ATOM 834 CA LYS A 51 7.569 7.252 36.542 1.00 0.29 C ATOM 835 C LYS A 51 7.736 8.629 35.893 1.00 0.32 C ATOM 836 O LYS A 51 8.208 8.732 34.778 1.00 0.35 O ATOM 837 CB LYS A 51 8.918 6.541 36.652 1.00 0.33 C ATOM 838 CG LYS A 51 9.261 6.321 38.127 1.00 1.43 C ATOM 839 CD LYS A 51 10.719 5.879 38.253 1.00 1.91 C ATOM 840 CE LYS A 51 10.802 4.354 38.152 1.00 2.76 C ATOM 841 NZ LYS A 51 12.208 4.022 38.512 1.00 3.21 N ATOM 0 H LYS A 51 7.243 5.957 34.878 1.00 0.25 H new ATOM 0 HA LYS A 51 7.116 7.407 37.521 1.00 0.29 H new ATOM 0 HB2 LYS A 51 8.881 5.585 36.130 1.00 0.33 H new ATOM 0 HB3 LYS A 51 9.695 7.136 36.172 1.00 0.33 H new ATOM 0 HG2 LYS A 51 9.099 7.240 38.690 1.00 1.43 H new ATOM 0 HG3 LYS A 51 8.603 5.565 38.555 1.00 1.43 H new ATOM 0 HD2 LYS A 51 11.319 6.339 37.467 1.00 1.91 H new ATOM 0 HD3 LYS A 51 11.130 6.214 39.205 1.00 1.91 H new ATOM 0 HE2 LYS A 51 10.097 3.874 38.831 1.00 2.76 H new ATOM 0 HE3 LYS A 51 10.560 4.011 37.146 1.00 2.76 H new ATOM 0 HZ1 LYS A 51 12.344 2.992 38.466 1.00 3.21 H new ATOM 0 HZ2 LYS A 51 12.856 4.487 37.845 1.00 3.21 H new ATOM 0 HZ3 LYS A 51 12.407 4.355 39.477 1.00 3.21 H new ATOM 855 N PRO A 52 7.329 9.643 36.605 1.00 0.33 N ATOM 856 CA PRO A 52 7.426 11.024 36.072 1.00 0.39 C ATOM 857 C PRO A 52 8.894 11.404 35.851 1.00 0.46 C ATOM 858 O PRO A 52 9.766 11.010 36.599 1.00 0.48 O ATOM 859 CB PRO A 52 6.797 11.891 37.164 1.00 0.41 C ATOM 860 CG PRO A 52 6.774 11.039 38.396 1.00 0.40 C ATOM 861 CD PRO A 52 6.751 9.602 37.950 1.00 0.33 C ATOM 0 HA PRO A 52 6.928 11.144 35.110 1.00 0.39 H new ATOM 0 HB2 PRO A 52 7.378 12.799 37.327 1.00 0.41 H new ATOM 0 HB3 PRO A 52 5.791 12.203 36.885 1.00 0.41 H new ATOM 0 HG2 PRO A 52 7.650 11.235 39.014 1.00 0.40 H new ATOM 0 HG3 PRO A 52 5.898 11.266 39.003 1.00 0.40 H new ATOM 0 HD2 PRO A 52 7.335 8.967 38.617 1.00 0.33 H new ATOM 0 HD3 PRO A 52 5.737 9.204 37.937 1.00 0.33 H new ATOM 869 N ASN A 53 9.171 12.166 34.828 1.00 0.61 N ATOM 870 CA ASN A 53 10.582 12.568 34.562 1.00 0.71 C ATOM 871 C ASN A 53 10.840 13.978 35.100 1.00 1.19 C ATOM 872 O ASN A 53 10.421 14.924 34.454 1.00 1.61 O ATOM 873 CB ASN A 53 10.721 12.543 33.040 1.00 1.36 C ATOM 874 CG ASN A 53 10.539 11.110 32.534 1.00 1.76 C ATOM 875 OD1 ASN A 53 10.635 10.168 33.295 1.00 2.14 O ATOM 876 ND2 ASN A 53 10.279 10.905 31.272 1.00 2.41 N ATOM 877 OXT ASN A 53 11.452 14.087 36.150 1.00 1.98 O ATOM 0 H ASN A 53 8.484 12.527 34.166 1.00 0.61 H new ATOM 0 HA ASN A 53 11.298 11.906 35.048 1.00 0.71 H new ATOM 0 HB2 ASN A 53 9.977 13.198 32.586 1.00 1.36 H new ATOM 0 HB3 ASN A 53 11.700 12.922 32.747 1.00 1.36 H new ATOM 0 HD21 ASN A 53 10.156 9.954 30.925 1.00 2.41 H new ATOM 0 HD22 ASN A 53 10.198 11.696 30.633 1.00 2.41 H new TER 884 ASN A 53 ATOM 885 N PHE B 2 12.752 2.055 14.350 1.00 9.08 N ATOM 886 CA PHE B 2 11.793 2.261 13.226 1.00 8.67 C ATOM 887 C PHE B 2 10.388 2.520 13.777 1.00 7.72 C ATOM 888 O PHE B 2 9.663 3.360 13.283 1.00 7.64 O ATOM 889 CB PHE B 2 11.831 0.958 12.426 1.00 9.22 C ATOM 890 CG PHE B 2 11.081 1.140 11.129 1.00 10.46 C ATOM 891 CD1 PHE B 2 11.701 1.776 10.046 1.00 10.87 C ATOM 892 CD2 PHE B 2 9.766 0.674 11.006 1.00 10.89 C ATOM 893 CE1 PHE B 2 11.007 1.946 8.842 1.00 11.64 C ATOM 894 CE2 PHE B 2 9.073 0.845 9.802 1.00 11.66 C ATOM 895 CZ PHE B 2 9.693 1.480 8.720 1.00 11.60 C ATOM 0 HA PHE B 2 12.055 3.120 12.608 1.00 8.67 H new ATOM 0 HB2 PHE B 2 12.864 0.673 12.224 1.00 9.22 H new ATOM 0 HB3 PHE B 2 11.385 0.150 13.006 1.00 9.22 H new ATOM 0 HD1 PHE B 2 12.715 2.136 10.140 1.00 10.87 H new ATOM 0 HD2 PHE B 2 9.287 0.183 11.840 1.00 10.89 H new ATOM 0 HE1 PHE B 2 11.486 2.437 8.007 1.00 11.64 H new ATOM 0 HE2 PHE B 2 8.059 0.486 9.708 1.00 11.66 H new ATOM 0 HZ PHE B 2 9.158 1.610 7.791 1.00 11.60 H new ATOM 905 N MET B 3 10.009 1.824 14.815 1.00 7.25 N ATOM 906 CA MET B 3 8.662 2.053 15.415 1.00 6.59 C ATOM 907 C MET B 3 8.805 2.584 16.844 1.00 5.73 C ATOM 908 O MET B 3 9.693 2.193 17.576 1.00 5.45 O ATOM 909 CB MET B 3 7.989 0.681 15.421 1.00 6.98 C ATOM 910 CG MET B 3 7.949 0.124 13.997 1.00 7.76 C ATOM 911 SD MET B 3 7.155 1.325 12.900 1.00 8.62 S ATOM 912 CE MET B 3 5.533 1.330 13.703 1.00 8.70 C ATOM 0 H MET B 3 10.573 1.108 15.273 1.00 7.25 H new ATOM 0 HA MET B 3 8.082 2.788 14.857 1.00 6.59 H new ATOM 0 HB2 MET B 3 8.535 -0.000 16.074 1.00 6.98 H new ATOM 0 HB3 MET B 3 6.978 0.762 15.819 1.00 6.98 H new ATOM 0 HG2 MET B 3 8.960 -0.088 13.650 1.00 7.76 H new ATOM 0 HG3 MET B 3 7.401 -0.818 13.979 1.00 7.76 H new ATOM 0 HE1 MET B 3 4.769 1.613 12.979 1.00 8.70 H new ATOM 0 HE2 MET B 3 5.315 0.334 14.089 1.00 8.70 H new ATOM 0 HE3 MET B 3 5.536 2.045 14.525 1.00 8.70 H new ATOM 922 N LYS B 4 7.930 3.462 17.252 1.00 5.69 N ATOM 923 CA LYS B 4 8.009 4.005 18.640 1.00 5.34 C ATOM 924 C LYS B 4 6.669 3.818 19.358 1.00 4.61 C ATOM 925 O LYS B 4 5.619 3.840 18.748 1.00 4.72 O ATOM 926 CB LYS B 4 8.321 5.492 18.467 1.00 6.20 C ATOM 927 CG LYS B 4 9.678 5.653 17.779 1.00 6.74 C ATOM 928 CD LYS B 4 10.046 7.138 17.717 1.00 7.81 C ATOM 929 CE LYS B 4 11.337 7.311 16.916 1.00 8.51 C ATOM 930 NZ LYS B 4 10.957 7.024 15.505 1.00 9.17 N ATOM 0 H LYS B 4 7.164 3.827 16.686 1.00 5.69 H new ATOM 0 HA LYS B 4 8.764 3.497 19.240 1.00 5.34 H new ATOM 0 HB2 LYS B 4 7.542 5.971 17.874 1.00 6.20 H new ATOM 0 HB3 LYS B 4 8.333 5.987 19.438 1.00 6.20 H new ATOM 0 HG2 LYS B 4 10.442 5.100 18.325 1.00 6.74 H new ATOM 0 HG3 LYS B 4 9.640 5.235 16.773 1.00 6.74 H new ATOM 0 HD2 LYS B 4 9.239 7.704 17.253 1.00 7.81 H new ATOM 0 HD3 LYS B 4 10.175 7.534 18.724 1.00 7.81 H new ATOM 0 HE2 LYS B 4 11.734 8.321 17.020 1.00 8.51 H new ATOM 0 HE3 LYS B 4 12.111 6.627 17.263 1.00 8.51 H new ATOM 0 HZ1 LYS B 4 11.574 7.561 14.863 1.00 9.17 H new ATOM 0 HZ2 LYS B 4 11.063 6.007 15.317 1.00 9.17 H new ATOM 0 HZ3 LYS B 4 9.968 7.303 15.348 1.00 9.17 H new ATOM 944 N SER B 5 6.696 3.648 20.652 1.00 4.27 N ATOM 945 CA SER B 5 5.421 3.478 21.407 1.00 3.86 C ATOM 946 C SER B 5 4.619 4.782 21.384 1.00 2.80 C ATOM 947 O SER B 5 5.146 5.840 21.105 1.00 3.02 O ATOM 948 CB SER B 5 5.850 3.136 22.834 1.00 4.70 C ATOM 949 OG SER B 5 6.350 4.308 23.467 1.00 5.20 O ATOM 0 H SER B 5 7.544 3.619 21.218 1.00 4.27 H new ATOM 0 HA SER B 5 4.784 2.705 20.978 1.00 3.86 H new ATOM 0 HB2 SER B 5 5.004 2.738 23.395 1.00 4.70 H new ATOM 0 HB3 SER B 5 6.616 2.361 22.820 1.00 4.70 H new ATOM 0 HG SER B 5 6.604 4.098 24.390 1.00 5.20 H new ATOM 955 N THR B 6 3.344 4.712 21.656 1.00 2.20 N ATOM 956 CA THR B 6 2.510 5.949 21.625 1.00 1.59 C ATOM 957 C THR B 6 2.957 6.916 22.723 1.00 1.19 C ATOM 958 O THR B 6 2.984 8.116 22.534 1.00 1.95 O ATOM 959 CB THR B 6 1.080 5.471 21.880 1.00 2.29 C ATOM 960 OG1 THR B 6 0.994 4.917 23.186 1.00 2.98 O ATOM 961 CG2 THR B 6 0.705 4.408 20.847 1.00 2.91 C ATOM 0 H THR B 6 2.845 3.856 21.897 1.00 2.20 H new ATOM 0 HA THR B 6 2.598 6.482 20.678 1.00 1.59 H new ATOM 0 HB THR B 6 0.394 6.314 21.797 1.00 2.29 H new ATOM 0 HG1 THR B 6 0.078 4.611 23.352 1.00 2.98 H new ATOM 0 HG21 THR B 6 -0.314 4.067 21.029 1.00 2.91 H new ATOM 0 HG22 THR B 6 0.772 4.834 19.846 1.00 2.91 H new ATOM 0 HG23 THR B 6 1.390 3.564 20.929 1.00 2.91 H new ATOM 969 N GLY B 7 3.350 6.402 23.858 1.00 0.83 N ATOM 970 CA GLY B 7 3.843 7.292 24.946 1.00 0.45 C ATOM 971 C GLY B 7 2.675 8.096 25.522 1.00 0.43 C ATOM 972 O GLY B 7 2.783 9.284 25.751 1.00 0.49 O ATOM 0 H GLY B 7 3.351 5.406 24.077 1.00 0.83 H new ATOM 0 HA2 GLY B 7 4.311 6.698 25.731 1.00 0.45 H new ATOM 0 HA3 GLY B 7 4.606 7.967 24.559 1.00 0.45 H new ATOM 976 N ILE B 8 1.568 7.456 25.785 1.00 0.37 N ATOM 977 CA ILE B 8 0.408 8.193 26.376 1.00 0.37 C ATOM 978 C ILE B 8 0.069 7.615 27.751 1.00 0.32 C ATOM 979 O ILE B 8 0.077 6.421 27.943 1.00 0.30 O ATOM 980 CB ILE B 8 -0.748 7.971 25.405 1.00 0.40 C ATOM 981 CG1 ILE B 8 -0.326 8.406 24.001 1.00 0.45 C ATOM 982 CG2 ILE B 8 -1.954 8.799 25.852 1.00 0.43 C ATOM 983 CD1 ILE B 8 -1.443 8.080 23.007 1.00 1.36 C ATOM 0 H ILE B 8 1.414 6.461 25.619 1.00 0.37 H new ATOM 0 HA ILE B 8 0.621 9.253 26.514 1.00 0.37 H new ATOM 0 HB ILE B 8 -1.015 6.914 25.394 1.00 0.40 H new ATOM 0 HG12 ILE B 8 -0.114 9.475 23.988 1.00 0.45 H new ATOM 0 HG13 ILE B 8 0.593 7.896 23.712 1.00 0.45 H new ATOM 0 HG21 ILE B 8 -2.781 8.641 25.159 1.00 0.43 H new ATOM 0 HG22 ILE B 8 -2.256 8.491 26.853 1.00 0.43 H new ATOM 0 HG23 ILE B 8 -1.686 9.856 25.863 1.00 0.43 H new ATOM 0 HD11 ILE B 8 -1.142 8.390 22.006 1.00 1.36 H new ATOM 0 HD12 ILE B 8 -1.633 7.007 23.012 1.00 1.36 H new ATOM 0 HD13 ILE B 8 -2.351 8.611 23.293 1.00 1.36 H new ATOM 995 N VAL B 9 -0.146 8.451 28.727 1.00 0.32 N ATOM 996 CA VAL B 9 -0.384 7.930 30.106 1.00 0.29 C ATOM 997 C VAL B 9 -1.811 8.241 30.569 1.00 0.32 C ATOM 998 O VAL B 9 -2.355 9.291 30.292 1.00 0.37 O ATOM 999 CB VAL B 9 0.636 8.650 30.987 1.00 0.30 C ATOM 1000 CG1 VAL B 9 0.421 8.249 32.448 1.00 0.27 C ATOM 1001 CG2 VAL B 9 2.050 8.249 30.558 1.00 0.30 C ATOM 0 H VAL B 9 -0.168 9.466 28.633 1.00 0.32 H new ATOM 0 HA VAL B 9 -0.273 6.847 30.153 1.00 0.29 H new ATOM 0 HB VAL B 9 0.511 9.728 30.881 1.00 0.30 H new ATOM 0 HG11 VAL B 9 1.148 8.762 33.077 1.00 0.27 H new ATOM 0 HG12 VAL B 9 -0.587 8.527 32.757 1.00 0.27 H new ATOM 0 HG13 VAL B 9 0.548 7.171 32.552 1.00 0.27 H new ATOM 0 HG21 VAL B 9 2.780 8.761 31.185 1.00 0.30 H new ATOM 0 HG22 VAL B 9 2.171 7.171 30.667 1.00 0.30 H new ATOM 0 HG23 VAL B 9 2.207 8.528 29.516 1.00 0.30 H new ATOM 1011 N ARG B 10 -2.397 7.346 31.319 1.00 0.31 N ATOM 1012 CA ARG B 10 -3.764 7.590 31.863 1.00 0.36 C ATOM 1013 C ARG B 10 -3.776 7.319 33.369 1.00 0.31 C ATOM 1014 O ARG B 10 -2.897 6.670 33.896 1.00 0.28 O ATOM 1015 CB ARG B 10 -4.668 6.599 31.129 1.00 0.40 C ATOM 1016 CG ARG B 10 -6.125 6.846 31.526 1.00 0.74 C ATOM 1017 CD ARG B 10 -7.024 5.812 30.846 1.00 0.87 C ATOM 1018 NE ARG B 10 -8.413 6.218 31.198 1.00 1.14 N ATOM 1019 CZ ARG B 10 -8.865 6.028 32.409 1.00 1.37 C ATOM 1020 NH1 ARG B 10 -8.102 5.482 33.317 1.00 1.62 N ATOM 1021 NH2 ARG B 10 -10.083 6.386 32.712 1.00 1.92 N ATOM 0 H ARG B 10 -1.984 6.450 31.580 1.00 0.31 H new ATOM 0 HA ARG B 10 -4.094 8.619 31.718 1.00 0.36 H new ATOM 0 HB2 ARG B 10 -4.550 6.712 30.051 1.00 0.40 H new ATOM 0 HB3 ARG B 10 -4.381 5.577 31.376 1.00 0.40 H new ATOM 0 HG2 ARG B 10 -6.234 6.781 32.609 1.00 0.74 H new ATOM 0 HG3 ARG B 10 -6.426 7.852 31.235 1.00 0.74 H new ATOM 0 HD2 ARG B 10 -6.875 5.809 29.766 1.00 0.87 H new ATOM 0 HD3 ARG B 10 -6.805 4.805 31.201 1.00 0.87 H new ATOM 0 HE ARG B 10 -9.013 6.645 30.492 1.00 1.14 H new ATOM 0 HH11 ARG B 10 -7.150 5.202 33.082 1.00 1.62 H new ATOM 0 HH12 ARG B 10 -8.458 5.335 34.261 1.00 1.62 H new ATOM 0 HH21 ARG B 10 -10.680 6.813 32.004 1.00 1.92 H new ATOM 0 HH22 ARG B 10 -10.438 6.239 33.657 1.00 1.92 H new ATOM 1035 N LYS B 11 -4.747 7.833 34.075 1.00 0.33 N ATOM 1036 CA LYS B 11 -4.783 7.621 35.551 1.00 0.30 C ATOM 1037 C LYS B 11 -5.463 6.288 35.881 1.00 0.26 C ATOM 1038 O LYS B 11 -6.357 5.848 35.187 1.00 0.28 O ATOM 1039 CB LYS B 11 -5.600 8.791 36.100 1.00 0.34 C ATOM 1040 CG LYS B 11 -4.857 10.103 35.834 1.00 1.03 C ATOM 1041 CD LYS B 11 -5.615 11.261 36.487 1.00 1.03 C ATOM 1042 CE LYS B 11 -4.937 12.584 36.124 1.00 1.81 C ATOM 1043 NZ LYS B 11 -4.680 13.255 37.429 1.00 2.21 N ATOM 0 H LYS B 11 -5.514 8.388 33.696 1.00 0.33 H new ATOM 0 HA LYS B 11 -3.784 7.582 35.986 1.00 0.30 H new ATOM 0 HB2 LYS B 11 -6.582 8.815 35.628 1.00 0.34 H new ATOM 0 HB3 LYS B 11 -5.763 8.664 37.170 1.00 0.34 H new ATOM 0 HG2 LYS B 11 -3.844 10.047 36.233 1.00 1.03 H new ATOM 0 HG3 LYS B 11 -4.768 10.272 34.761 1.00 1.03 H new ATOM 0 HD2 LYS B 11 -6.652 11.267 36.150 1.00 1.03 H new ATOM 0 HD3 LYS B 11 -5.632 11.134 37.569 1.00 1.03 H new ATOM 0 HE2 LYS B 11 -4.009 12.415 35.577 1.00 1.81 H new ATOM 0 HE3 LYS B 11 -5.577 13.194 35.486 1.00 1.81 H new ATOM 0 HZ1 LYS B 11 -4.216 14.171 37.263 1.00 2.21 H new ATOM 0 HZ2 LYS B 11 -5.582 13.409 37.924 1.00 2.21 H new ATOM 0 HZ3 LYS B 11 -4.063 12.655 38.012 1.00 2.21 H new ATOM 1057 N VAL B 12 -5.049 5.649 36.943 1.00 0.23 N ATOM 1058 CA VAL B 12 -5.680 4.351 37.325 1.00 0.22 C ATOM 1059 C VAL B 12 -6.983 4.613 38.080 1.00 0.20 C ATOM 1060 O VAL B 12 -7.018 5.382 39.017 1.00 0.20 O ATOM 1061 CB VAL B 12 -4.671 3.667 38.252 1.00 0.21 C ATOM 1062 CG1 VAL B 12 -5.057 2.199 38.432 1.00 0.29 C ATOM 1063 CG2 VAL B 12 -3.265 3.754 37.654 1.00 0.29 C ATOM 0 H VAL B 12 -4.303 5.968 37.561 1.00 0.23 H new ATOM 0 HA VAL B 12 -5.916 3.738 36.455 1.00 0.22 H new ATOM 0 HB VAL B 12 -4.679 4.170 39.219 1.00 0.21 H new ATOM 0 HG11 VAL B 12 -4.339 1.712 39.092 1.00 0.29 H new ATOM 0 HG12 VAL B 12 -6.053 2.136 38.870 1.00 0.29 H new ATOM 0 HG13 VAL B 12 -5.055 1.701 37.463 1.00 0.29 H new ATOM 0 HG21 VAL B 12 -2.555 3.265 38.321 1.00 0.29 H new ATOM 0 HG22 VAL B 12 -3.251 3.259 36.683 1.00 0.29 H new ATOM 0 HG23 VAL B 12 -2.986 4.800 37.532 1.00 0.29 H new ATOM 1073 N ASP B 13 -8.053 3.981 37.686 1.00 0.21 N ATOM 1074 CA ASP B 13 -9.341 4.212 38.397 1.00 0.21 C ATOM 1075 C ASP B 13 -9.431 3.309 39.633 1.00 0.22 C ATOM 1076 O ASP B 13 -8.456 2.715 40.049 1.00 0.23 O ATOM 1077 CB ASP B 13 -10.436 3.887 37.368 1.00 0.22 C ATOM 1078 CG ASP B 13 -10.827 2.409 37.449 1.00 0.32 C ATOM 1079 OD1 ASP B 13 -10.163 1.599 36.826 1.00 0.27 O ATOM 1080 OD2 ASP B 13 -11.785 2.108 38.137 1.00 0.55 O ATOM 0 H ASP B 13 -8.092 3.320 36.910 1.00 0.21 H new ATOM 0 HA ASP B 13 -9.441 5.234 38.762 1.00 0.21 H new ATOM 0 HB2 ASP B 13 -11.311 4.511 37.550 1.00 0.22 H new ATOM 0 HB3 ASP B 13 -10.081 4.121 36.364 1.00 0.22 H new ATOM 1085 N GLU B 14 -10.548 3.320 40.305 1.00 0.23 N ATOM 1086 CA GLU B 14 -10.641 2.602 41.610 1.00 0.26 C ATOM 1087 C GLU B 14 -10.271 1.120 41.466 1.00 0.26 C ATOM 1088 O GLU B 14 -9.718 0.526 42.371 1.00 0.30 O ATOM 1089 CB GLU B 14 -12.103 2.746 42.033 1.00 0.28 C ATOM 1090 CG GLU B 14 -12.424 4.222 42.274 1.00 1.22 C ATOM 1091 CD GLU B 14 -13.867 4.358 42.763 1.00 1.57 C ATOM 1092 OE1 GLU B 14 -14.579 3.368 42.729 1.00 1.99 O ATOM 1093 OE2 GLU B 14 -14.236 5.450 43.161 1.00 2.19 O ATOM 0 H GLU B 14 -11.401 3.794 40.009 1.00 0.23 H new ATOM 0 HA GLU B 14 -9.949 3.016 42.343 1.00 0.26 H new ATOM 0 HB2 GLU B 14 -12.757 2.343 41.260 1.00 0.28 H new ATOM 0 HB3 GLU B 14 -12.288 2.170 42.940 1.00 0.28 H new ATOM 0 HG2 GLU B 14 -11.738 4.638 43.012 1.00 1.22 H new ATOM 0 HG3 GLU B 14 -12.286 4.790 41.354 1.00 1.22 H new ATOM 1100 N LEU B 15 -10.674 0.485 40.401 1.00 0.23 N ATOM 1101 CA LEU B 15 -10.456 -0.990 40.299 1.00 0.25 C ATOM 1102 C LEU B 15 -9.067 -1.316 39.734 1.00 0.23 C ATOM 1103 O LEU B 15 -8.693 -2.468 39.631 1.00 0.25 O ATOM 1104 CB LEU B 15 -11.545 -1.495 39.355 1.00 0.28 C ATOM 1105 CG LEU B 15 -11.333 -2.987 39.091 1.00 0.38 C ATOM 1106 CD1 LEU B 15 -11.086 -3.714 40.416 1.00 1.28 C ATOM 1107 CD2 LEU B 15 -12.578 -3.567 38.417 1.00 1.39 C ATOM 0 H LEU B 15 -11.141 0.916 39.603 1.00 0.23 H new ATOM 0 HA LEU B 15 -10.505 -1.464 41.279 1.00 0.25 H new ATOM 0 HB2 LEU B 15 -12.529 -1.328 39.794 1.00 0.28 H new ATOM 0 HB3 LEU B 15 -11.515 -0.940 38.417 1.00 0.28 H new ATOM 0 HG LEU B 15 -10.470 -3.119 38.439 1.00 0.38 H new ATOM 0 HD11 LEU B 15 -10.935 -4.777 40.225 1.00 1.28 H new ATOM 0 HD12 LEU B 15 -10.199 -3.302 40.897 1.00 1.28 H new ATOM 0 HD13 LEU B 15 -11.948 -3.581 41.070 1.00 1.28 H new ATOM 0 HD21 LEU B 15 -12.428 -4.630 38.228 1.00 1.39 H new ATOM 0 HD22 LEU B 15 -13.441 -3.432 39.069 1.00 1.39 H new ATOM 0 HD23 LEU B 15 -12.754 -3.052 37.472 1.00 1.39 H new ATOM 1119 N GLY B 16 -8.313 -0.334 39.331 1.00 0.21 N ATOM 1120 CA GLY B 16 -6.978 -0.632 38.736 1.00 0.20 C ATOM 1121 C GLY B 16 -7.151 -1.064 37.276 1.00 0.21 C ATOM 1122 O GLY B 16 -6.629 -2.077 36.847 1.00 0.21 O ATOM 0 H GLY B 16 -8.558 0.655 39.386 1.00 0.21 H new ATOM 0 HA2 GLY B 16 -6.339 0.249 38.792 1.00 0.20 H new ATOM 0 HA3 GLY B 16 -6.484 -1.421 39.303 1.00 0.20 H new ATOM 1126 N ARG B 17 -7.925 -0.335 36.523 1.00 0.24 N ATOM 1127 CA ARG B 17 -8.179 -0.732 35.111 1.00 0.27 C ATOM 1128 C ARG B 17 -7.613 0.322 34.157 1.00 0.26 C ATOM 1129 O ARG B 17 -7.472 1.477 34.505 1.00 0.26 O ATOM 1130 CB ARG B 17 -9.702 -0.806 34.993 1.00 0.29 C ATOM 1131 CG ARG B 17 -10.222 -1.957 35.857 1.00 0.29 C ATOM 1132 CD ARG B 17 -11.740 -2.068 35.703 1.00 0.29 C ATOM 1133 NE ARG B 17 -12.280 -0.839 36.347 1.00 0.57 N ATOM 1134 CZ ARG B 17 -13.549 -0.769 36.659 1.00 0.79 C ATOM 1135 NH1 ARG B 17 -14.350 -1.759 36.371 1.00 0.73 N ATOM 1136 NH2 ARG B 17 -14.018 0.291 37.260 1.00 1.14 N ATOM 0 H ARG B 17 -8.393 0.520 36.825 1.00 0.24 H new ATOM 0 HA ARG B 17 -7.704 -1.678 34.852 1.00 0.27 H new ATOM 0 HB2 ARG B 17 -10.149 0.135 35.314 1.00 0.29 H new ATOM 0 HB3 ARG B 17 -9.991 -0.958 33.953 1.00 0.29 H new ATOM 0 HG2 ARG B 17 -9.747 -2.892 35.560 1.00 0.29 H new ATOM 0 HG3 ARG B 17 -9.964 -1.786 36.902 1.00 0.29 H new ATOM 0 HD2 ARG B 17 -12.028 -2.123 34.653 1.00 0.29 H new ATOM 0 HD3 ARG B 17 -12.122 -2.968 36.186 1.00 0.29 H new ATOM 0 HE ARG B 17 -11.661 -0.052 36.545 1.00 0.57 H new ATOM 0 HH11 ARG B 17 -13.987 -2.589 35.902 1.00 0.73 H new ATOM 0 HH12 ARG B 17 -15.339 -1.703 36.615 1.00 0.73 H new ATOM 0 HH21 ARG B 17 -13.395 1.066 37.487 1.00 1.14 H new ATOM 0 HH22 ARG B 17 -15.007 0.344 37.502 1.00 1.14 H new ATOM 1150 N VAL B 18 -7.295 -0.068 32.954 1.00 0.26 N ATOM 1151 CA VAL B 18 -6.745 0.911 31.973 1.00 0.26 C ATOM 1152 C VAL B 18 -7.598 0.908 30.704 1.00 0.24 C ATOM 1153 O VAL B 18 -8.266 -0.060 30.401 1.00 0.25 O ATOM 1154 CB VAL B 18 -5.329 0.419 31.671 1.00 0.26 C ATOM 1155 CG1 VAL B 18 -4.527 0.345 32.971 1.00 0.28 C ATOM 1156 CG2 VAL B 18 -5.399 -0.972 31.036 1.00 0.26 C ATOM 0 H VAL B 18 -7.392 -1.022 32.607 1.00 0.26 H new ATOM 0 HA VAL B 18 -6.744 1.931 32.357 1.00 0.26 H new ATOM 0 HB VAL B 18 -4.842 1.110 30.983 1.00 0.26 H new ATOM 0 HG11 VAL B 18 -3.518 -0.006 32.756 1.00 0.28 H new ATOM 0 HG12 VAL B 18 -4.478 1.335 33.425 1.00 0.28 H new ATOM 0 HG13 VAL B 18 -5.013 -0.347 33.659 1.00 0.28 H new ATOM 0 HG21 VAL B 18 -4.390 -1.324 30.820 1.00 0.26 H new ATOM 0 HG22 VAL B 18 -5.885 -1.663 31.725 1.00 0.26 H new ATOM 0 HG23 VAL B 18 -5.972 -0.921 30.110 1.00 0.26 H new ATOM 1166 N VAL B 19 -7.650 2.009 30.010 1.00 0.23 N ATOM 1167 CA VAL B 19 -8.543 2.092 28.819 1.00 0.22 C ATOM 1168 C VAL B 19 -7.721 2.217 27.537 1.00 0.22 C ATOM 1169 O VAL B 19 -6.829 3.036 27.436 1.00 0.24 O ATOM 1170 CB VAL B 19 -9.375 3.355 29.043 1.00 0.22 C ATOM 1171 CG1 VAL B 19 -10.479 3.435 27.987 1.00 0.23 C ATOM 1172 CG2 VAL B 19 -10.002 3.312 30.437 1.00 0.24 C ATOM 0 H VAL B 19 -7.115 2.853 30.214 1.00 0.23 H new ATOM 0 HA VAL B 19 -9.162 1.202 28.708 1.00 0.22 H new ATOM 0 HB VAL B 19 -8.733 4.232 28.961 1.00 0.22 H new ATOM 0 HG11 VAL B 19 -11.072 4.336 28.148 1.00 0.23 H new ATOM 0 HG12 VAL B 19 -10.031 3.468 26.994 1.00 0.23 H new ATOM 0 HG13 VAL B 19 -11.122 2.559 28.066 1.00 0.23 H new ATOM 0 HG21 VAL B 19 -10.595 4.212 30.597 1.00 0.24 H new ATOM 0 HG22 VAL B 19 -10.644 2.435 30.520 1.00 0.24 H new ATOM 0 HG23 VAL B 19 -9.214 3.258 31.189 1.00 0.24 H new ATOM 1182 N ILE B 20 -8.076 1.475 26.524 1.00 0.22 N ATOM 1183 CA ILE B 20 -7.383 1.627 25.213 1.00 0.24 C ATOM 1184 C ILE B 20 -8.005 2.792 24.435 1.00 0.24 C ATOM 1185 O ILE B 20 -9.208 2.891 24.338 1.00 0.23 O ATOM 1186 CB ILE B 20 -7.621 0.292 24.496 1.00 0.23 C ATOM 1187 CG1 ILE B 20 -6.567 -0.720 24.951 1.00 0.29 C ATOM 1188 CG2 ILE B 20 -7.520 0.480 22.981 1.00 0.25 C ATOM 1189 CD1 ILE B 20 -6.670 -0.920 26.463 1.00 1.38 C ATOM 0 H ILE B 20 -8.814 0.772 26.547 1.00 0.22 H new ATOM 0 HA ILE B 20 -6.320 1.847 25.312 1.00 0.24 H new ATOM 0 HB ILE B 20 -8.618 -0.072 24.743 1.00 0.23 H new ATOM 0 HG12 ILE B 20 -6.714 -1.670 24.437 1.00 0.29 H new ATOM 0 HG13 ILE B 20 -5.570 -0.366 24.688 1.00 0.29 H new ATOM 0 HG21 ILE B 20 -7.691 -0.475 22.484 1.00 0.25 H new ATOM 0 HG22 ILE B 20 -8.270 1.199 22.653 1.00 0.25 H new ATOM 0 HG23 ILE B 20 -6.527 0.849 22.726 1.00 0.25 H new ATOM 0 HD11 ILE B 20 -5.919 -1.641 26.787 1.00 1.38 H new ATOM 0 HD12 ILE B 20 -6.501 0.031 26.968 1.00 1.38 H new ATOM 0 HD13 ILE B 20 -7.663 -1.293 26.714 1.00 1.38 H new ATOM 1201 N PRO B 21 -7.162 3.612 23.869 1.00 0.28 N ATOM 1202 CA PRO B 21 -7.648 4.746 23.045 1.00 0.30 C ATOM 1203 C PRO B 21 -8.502 4.227 21.883 1.00 0.28 C ATOM 1204 O PRO B 21 -8.239 3.180 21.330 1.00 0.27 O ATOM 1205 CB PRO B 21 -6.370 5.412 22.527 1.00 0.35 C ATOM 1206 CG PRO B 21 -5.259 4.445 22.807 1.00 0.36 C ATOM 1207 CD PRO B 21 -5.704 3.560 23.940 1.00 0.32 C ATOM 0 HA PRO B 21 -8.275 5.439 23.606 1.00 0.30 H new ATOM 0 HB2 PRO B 21 -6.444 5.623 21.460 1.00 0.35 H new ATOM 0 HB3 PRO B 21 -6.195 6.364 23.029 1.00 0.35 H new ATOM 0 HG2 PRO B 21 -5.036 3.850 21.921 1.00 0.36 H new ATOM 0 HG3 PRO B 21 -4.345 4.977 23.072 1.00 0.36 H new ATOM 0 HD2 PRO B 21 -5.334 2.542 23.822 1.00 0.32 H new ATOM 0 HD3 PRO B 21 -5.337 3.923 24.900 1.00 0.32 H new ATOM 1215 N ILE B 22 -9.538 4.936 21.526 1.00 0.30 N ATOM 1216 CA ILE B 22 -10.420 4.456 20.423 1.00 0.30 C ATOM 1217 C ILE B 22 -9.599 4.196 19.160 1.00 0.33 C ATOM 1218 O ILE B 22 -9.882 3.292 18.400 1.00 0.32 O ATOM 1219 CB ILE B 22 -11.416 5.591 20.189 1.00 0.36 C ATOM 1220 CG1 ILE B 22 -12.543 5.102 19.275 1.00 0.41 C ATOM 1221 CG2 ILE B 22 -10.701 6.770 19.525 1.00 0.43 C ATOM 1222 CD1 ILE B 22 -13.344 4.011 19.988 1.00 1.11 C ATOM 0 H ILE B 22 -9.812 5.823 21.948 1.00 0.30 H new ATOM 0 HA ILE B 22 -10.919 3.520 20.674 1.00 0.30 H new ATOM 0 HB ILE B 22 -11.833 5.909 21.145 1.00 0.36 H new ATOM 0 HG12 ILE B 22 -13.197 5.933 19.010 1.00 0.41 H new ATOM 0 HG13 ILE B 22 -12.128 4.714 18.345 1.00 0.41 H new ATOM 0 HG21 ILE B 22 -11.412 7.579 19.358 1.00 0.43 H new ATOM 0 HG22 ILE B 22 -9.898 7.120 20.173 1.00 0.43 H new ATOM 0 HG23 ILE B 22 -10.284 6.451 18.570 1.00 0.43 H new ATOM 0 HD11 ILE B 22 -14.146 3.664 19.336 1.00 1.11 H new ATOM 0 HD12 ILE B 22 -12.686 3.176 20.230 1.00 1.11 H new ATOM 0 HD13 ILE B 22 -13.771 4.415 20.906 1.00 1.11 H new ATOM 1234 N GLU B 23 -8.568 4.961 18.939 1.00 0.36 N ATOM 1235 CA GLU B 23 -7.721 4.725 17.736 1.00 0.40 C ATOM 1236 C GLU B 23 -7.173 3.297 17.763 1.00 0.37 C ATOM 1237 O GLU B 23 -7.062 2.642 16.745 1.00 0.39 O ATOM 1238 CB GLU B 23 -6.583 5.740 17.850 1.00 0.44 C ATOM 1239 CG GLU B 23 -5.726 5.688 16.584 1.00 1.22 C ATOM 1240 CD GLU B 23 -4.530 6.630 16.738 1.00 1.62 C ATOM 1241 OE1 GLU B 23 -4.411 7.237 17.790 1.00 2.00 O ATOM 1242 OE2 GLU B 23 -3.753 6.725 15.804 1.00 2.37 O ATOM 0 H GLU B 23 -8.275 5.735 19.535 1.00 0.36 H new ATOM 0 HA GLU B 23 -8.274 4.840 16.804 1.00 0.40 H new ATOM 0 HB2 GLU B 23 -6.988 6.743 17.987 1.00 0.44 H new ATOM 0 HB3 GLU B 23 -5.972 5.521 18.725 1.00 0.44 H new ATOM 0 HG2 GLU B 23 -5.380 4.670 16.408 1.00 1.22 H new ATOM 0 HG3 GLU B 23 -6.321 5.977 15.717 1.00 1.22 H new ATOM 1249 N LEU B 24 -6.856 2.805 18.928 1.00 0.34 N ATOM 1250 CA LEU B 24 -6.348 1.410 19.042 1.00 0.33 C ATOM 1251 C LEU B 24 -7.507 0.411 19.036 1.00 0.29 C ATOM 1252 O LEU B 24 -7.385 -0.683 18.524 1.00 0.30 O ATOM 1253 CB LEU B 24 -5.596 1.366 20.371 1.00 0.33 C ATOM 1254 CG LEU B 24 -4.368 2.275 20.290 1.00 0.93 C ATOM 1255 CD1 LEU B 24 -3.533 2.122 21.564 1.00 1.41 C ATOM 1256 CD2 LEU B 24 -3.521 1.878 19.078 1.00 1.75 C ATOM 0 H LEU B 24 -6.927 3.312 19.810 1.00 0.34 H new ATOM 0 HA LEU B 24 -5.705 1.139 18.205 1.00 0.33 H new ATOM 0 HB2 LEU B 24 -6.249 1.689 21.182 1.00 0.33 H new ATOM 0 HB3 LEU B 24 -5.291 0.344 20.596 1.00 0.33 H new ATOM 0 HG LEU B 24 -4.690 3.311 20.188 1.00 0.93 H new ATOM 0 HD11 LEU B 24 -2.658 2.770 21.506 1.00 1.41 H new ATOM 0 HD12 LEU B 24 -4.134 2.401 22.429 1.00 1.41 H new ATOM 0 HD13 LEU B 24 -3.211 1.086 21.666 1.00 1.41 H new ATOM 0 HD21 LEU B 24 -2.645 2.525 19.018 1.00 1.75 H new ATOM 0 HD22 LEU B 24 -3.200 0.841 19.182 1.00 1.75 H new ATOM 0 HD23 LEU B 24 -4.113 1.985 18.169 1.00 1.75 H new ATOM 1268 N ARG B 25 -8.653 0.794 19.532 1.00 0.26 N ATOM 1269 CA ARG B 25 -9.820 -0.130 19.459 1.00 0.23 C ATOM 1270 C ARG B 25 -10.078 -0.495 17.998 1.00 0.26 C ATOM 1271 O ARG B 25 -10.346 -1.632 17.667 1.00 0.25 O ATOM 1272 CB ARG B 25 -11.016 0.651 20.013 1.00 0.22 C ATOM 1273 CG ARG B 25 -10.769 1.061 21.467 1.00 0.21 C ATOM 1274 CD ARG B 25 -12.067 1.634 22.048 1.00 0.22 C ATOM 1275 NE ARG B 25 -11.650 2.447 23.221 1.00 0.23 N ATOM 1276 CZ ARG B 25 -12.442 3.370 23.698 1.00 0.26 C ATOM 1277 NH1 ARG B 25 -13.619 3.565 23.164 1.00 0.30 N ATOM 1278 NH2 ARG B 25 -12.060 4.096 24.713 1.00 0.27 N ATOM 0 H ARG B 25 -8.830 1.694 19.978 1.00 0.26 H new ATOM 0 HA ARG B 25 -9.649 -1.048 20.021 1.00 0.23 H new ATOM 0 HB2 ARG B 25 -11.190 1.538 19.405 1.00 0.22 H new ATOM 0 HB3 ARG B 25 -11.916 0.040 19.950 1.00 0.22 H new ATOM 0 HG2 ARG B 25 -10.442 0.201 22.051 1.00 0.21 H new ATOM 0 HG3 ARG B 25 -9.972 1.803 21.519 1.00 0.21 H new ATOM 0 HD2 ARG B 25 -12.590 2.245 21.313 1.00 0.22 H new ATOM 0 HD3 ARG B 25 -12.750 0.838 22.345 1.00 0.22 H new ATOM 0 HE ARG B 25 -10.742 2.283 23.655 1.00 0.23 H new ATOM 0 HH11 ARG B 25 -13.921 2.996 22.373 1.00 0.30 H new ATOM 0 HH12 ARG B 25 -14.236 4.286 23.538 1.00 0.30 H new ATOM 0 HH21 ARG B 25 -11.143 3.943 25.133 1.00 0.27 H new ATOM 0 HH22 ARG B 25 -12.678 4.817 25.086 1.00 0.27 H new ATOM 1292 N ARG B 26 -10.033 0.475 17.126 1.00 0.29 N ATOM 1293 CA ARG B 26 -10.316 0.199 15.688 1.00 0.33 C ATOM 1294 C ARG B 26 -9.156 -0.568 15.047 1.00 0.35 C ATOM 1295 O ARG B 26 -9.355 -1.539 14.347 1.00 0.35 O ATOM 1296 CB ARG B 26 -10.466 1.579 15.046 1.00 0.37 C ATOM 1297 CG ARG B 26 -11.679 2.295 15.644 1.00 1.07 C ATOM 1298 CD ARG B 26 -11.892 3.628 14.923 1.00 1.25 C ATOM 1299 NE ARG B 26 -12.941 4.329 15.714 1.00 1.86 N ATOM 1300 CZ ARG B 26 -14.186 3.938 15.647 1.00 2.33 C ATOM 1301 NH1 ARG B 26 -14.517 2.929 14.886 1.00 2.42 N ATOM 1302 NH2 ARG B 26 -15.101 4.557 16.342 1.00 3.27 N ATOM 0 H ARG B 26 -9.813 1.446 17.347 1.00 0.29 H new ATOM 0 HA ARG B 26 -11.206 -0.416 15.556 1.00 0.33 H new ATOM 0 HB2 ARG B 26 -9.565 2.169 15.213 1.00 0.37 H new ATOM 0 HB3 ARG B 26 -10.586 1.478 13.967 1.00 0.37 H new ATOM 0 HG2 ARG B 26 -12.567 1.671 15.547 1.00 1.07 H new ATOM 0 HG3 ARG B 26 -11.525 2.466 16.709 1.00 1.07 H new ATOM 0 HD2 ARG B 26 -10.970 4.209 14.887 1.00 1.25 H new ATOM 0 HD3 ARG B 26 -12.212 3.473 13.893 1.00 1.25 H new ATOM 0 HE ARG B 26 -12.687 5.117 16.310 1.00 1.86 H new ATOM 0 HH11 ARG B 26 -13.803 2.444 14.342 1.00 2.42 H new ATOM 0 HH12 ARG B 26 -15.490 2.626 14.836 1.00 2.42 H new ATOM 0 HH21 ARG B 26 -14.844 5.345 16.936 1.00 3.27 H new ATOM 0 HH22 ARG B 26 -16.073 4.253 16.291 1.00 3.27 H new ATOM 1316 N THR B 27 -7.949 -0.117 15.253 1.00 0.37 N ATOM 1317 CA THR B 27 -6.777 -0.791 14.621 1.00 0.41 C ATOM 1318 C THR B 27 -6.631 -2.227 15.135 1.00 0.39 C ATOM 1319 O THR B 27 -6.140 -3.095 14.441 1.00 0.42 O ATOM 1320 CB THR B 27 -5.569 0.052 15.026 1.00 0.44 C ATOM 1321 OG1 THR B 27 -5.786 1.403 14.642 1.00 0.61 O ATOM 1322 CG2 THR B 27 -4.315 -0.483 14.330 1.00 0.77 C ATOM 0 H THR B 27 -7.722 0.691 15.833 1.00 0.37 H new ATOM 0 HA THR B 27 -6.883 -0.861 13.538 1.00 0.41 H new ATOM 0 HB THR B 27 -5.433 -0.002 16.106 1.00 0.44 H new ATOM 0 HG1 THR B 27 -6.139 1.907 15.405 1.00 0.61 H new ATOM 0 HG21 THR B 27 -3.454 0.119 14.619 1.00 0.77 H new ATOM 0 HG22 THR B 27 -4.149 -1.519 14.625 1.00 0.77 H new ATOM 0 HG23 THR B 27 -4.448 -0.430 13.249 1.00 0.77 H new ATOM 1330 N LEU B 28 -6.991 -2.472 16.365 1.00 0.35 N ATOM 1331 CA LEU B 28 -6.805 -3.839 16.933 1.00 0.35 C ATOM 1332 C LEU B 28 -8.017 -4.725 16.620 1.00 0.33 C ATOM 1333 O LEU B 28 -8.021 -5.905 16.909 1.00 0.33 O ATOM 1334 CB LEU B 28 -6.664 -3.624 18.440 1.00 0.33 C ATOM 1335 CG LEU B 28 -6.221 -4.930 19.101 1.00 0.44 C ATOM 1336 CD1 LEU B 28 -4.757 -5.209 18.753 1.00 0.70 C ATOM 1337 CD2 LEU B 28 -6.368 -4.806 20.619 1.00 1.05 C ATOM 0 H LEU B 28 -7.404 -1.789 17.000 1.00 0.35 H new ATOM 0 HA LEU B 28 -5.937 -4.345 16.510 1.00 0.35 H new ATOM 0 HB2 LEU B 28 -5.936 -2.838 18.640 1.00 0.33 H new ATOM 0 HB3 LEU B 28 -7.613 -3.294 18.862 1.00 0.33 H new ATOM 0 HG LEU B 28 -6.842 -5.749 18.739 1.00 0.44 H new ATOM 0 HD11 LEU B 28 -4.442 -6.140 19.224 1.00 0.70 H new ATOM 0 HD12 LEU B 28 -4.650 -5.296 17.672 1.00 0.70 H new ATOM 0 HD13 LEU B 28 -4.135 -4.390 19.115 1.00 0.70 H new ATOM 0 HD21 LEU B 28 -6.053 -5.736 21.092 1.00 1.05 H new ATOM 0 HD22 LEU B 28 -5.746 -3.987 20.979 1.00 1.05 H new ATOM 0 HD23 LEU B 28 -7.410 -4.607 20.869 1.00 1.05 H new ATOM 1349 N GLY B 29 -9.039 -4.174 16.025 1.00 0.32 N ATOM 1350 CA GLY B 29 -10.234 -4.999 15.687 1.00 0.32 C ATOM 1351 C GLY B 29 -10.906 -5.477 16.973 1.00 0.29 C ATOM 1352 O GLY B 29 -11.312 -6.617 17.087 1.00 0.29 O ATOM 0 H GLY B 29 -9.099 -3.191 15.759 1.00 0.32 H new ATOM 0 HA2 GLY B 29 -10.936 -4.414 15.093 1.00 0.32 H new ATOM 0 HA3 GLY B 29 -9.938 -5.854 15.080 1.00 0.32 H new ATOM 1356 N ILE B 30 -11.003 -4.624 17.955 1.00 0.27 N ATOM 1357 CA ILE B 30 -11.621 -5.042 19.245 1.00 0.24 C ATOM 1358 C ILE B 30 -12.898 -4.246 19.516 1.00 0.23 C ATOM 1359 O ILE B 30 -12.985 -3.067 19.235 1.00 0.26 O ATOM 1360 CB ILE B 30 -10.568 -4.745 20.311 1.00 0.27 C ATOM 1361 CG1 ILE B 30 -9.291 -5.523 19.992 1.00 0.41 C ATOM 1362 CG2 ILE B 30 -11.096 -5.174 21.681 1.00 0.33 C ATOM 1363 CD1 ILE B 30 -9.638 -6.992 19.738 1.00 0.30 C ATOM 0 H ILE B 30 -10.682 -3.657 17.920 1.00 0.27 H new ATOM 0 HA ILE B 30 -11.905 -6.094 19.235 1.00 0.24 H new ATOM 0 HB ILE B 30 -10.352 -3.677 20.323 1.00 0.27 H new ATOM 0 HG12 ILE B 30 -8.802 -5.097 19.116 1.00 0.41 H new ATOM 0 HG13 ILE B 30 -8.587 -5.443 20.820 1.00 0.41 H new ATOM 0 HG21 ILE B 30 -10.345 -4.963 22.443 1.00 0.33 H new ATOM 0 HG22 ILE B 30 -12.009 -4.623 21.908 1.00 0.33 H new ATOM 0 HG23 ILE B 30 -11.311 -6.243 21.670 1.00 0.33 H new ATOM 0 HD11 ILE B 30 -8.728 -7.547 19.511 1.00 0.30 H new ATOM 0 HD12 ILE B 30 -10.108 -7.414 20.627 1.00 0.30 H new ATOM 0 HD13 ILE B 30 -10.326 -7.063 18.896 1.00 0.30 H new ATOM 1375 N ALA B 31 -13.906 -4.902 20.017 1.00 0.22 N ATOM 1376 CA ALA B 31 -15.206 -4.221 20.268 1.00 0.23 C ATOM 1377 C ALA B 31 -15.824 -4.733 21.573 1.00 0.20 C ATOM 1378 O ALA B 31 -15.393 -5.724 22.128 1.00 0.19 O ATOM 1379 CB ALA B 31 -16.086 -4.603 19.079 1.00 0.23 C ATOM 0 H ALA B 31 -13.885 -5.891 20.266 1.00 0.22 H new ATOM 0 HA ALA B 31 -15.096 -3.141 20.367 1.00 0.23 H new ATOM 0 HB1 ALA B 31 -17.066 -4.139 19.188 1.00 0.23 H new ATOM 0 HB2 ALA B 31 -15.621 -4.256 18.156 1.00 0.23 H new ATOM 0 HB3 ALA B 31 -16.199 -5.687 19.043 1.00 0.23 H new ATOM 1385 N GLU B 32 -16.827 -4.066 22.066 1.00 0.22 N ATOM 1386 CA GLU B 32 -17.468 -4.515 23.335 1.00 0.21 C ATOM 1387 C GLU B 32 -17.876 -5.989 23.240 1.00 0.19 C ATOM 1388 O GLU B 32 -18.291 -6.461 22.202 1.00 0.20 O ATOM 1389 CB GLU B 32 -18.704 -3.628 23.487 1.00 0.25 C ATOM 1390 CG GLU B 32 -19.380 -3.919 24.828 1.00 0.27 C ATOM 1391 CD GLU B 32 -20.676 -3.115 24.932 1.00 0.32 C ATOM 1392 OE1 GLU B 32 -20.978 -2.391 23.997 1.00 1.12 O ATOM 1393 OE2 GLU B 32 -21.346 -3.235 25.945 1.00 1.13 O ATOM 0 H GLU B 32 -17.232 -3.229 21.647 1.00 0.22 H new ATOM 0 HA GLU B 32 -16.793 -4.431 24.187 1.00 0.21 H new ATOM 0 HB2 GLU B 32 -18.419 -2.577 23.432 1.00 0.25 H new ATOM 0 HB3 GLU B 32 -19.400 -3.813 22.669 1.00 0.25 H new ATOM 0 HG2 GLU B 32 -19.593 -4.984 24.916 1.00 0.27 H new ATOM 0 HG3 GLU B 32 -18.711 -3.658 25.648 1.00 0.27 H new ATOM 1400 N LYS B 33 -17.813 -6.696 24.339 1.00 0.19 N ATOM 1401 CA LYS B 33 -18.256 -8.127 24.368 1.00 0.20 C ATOM 1402 C LYS B 33 -17.235 -9.038 23.674 1.00 0.18 C ATOM 1403 O LYS B 33 -17.326 -10.247 23.752 1.00 0.21 O ATOM 1404 CB LYS B 33 -19.596 -8.163 23.630 1.00 0.23 C ATOM 1405 CG LYS B 33 -20.333 -9.456 23.980 1.00 0.29 C ATOM 1406 CD LYS B 33 -21.643 -9.528 23.194 1.00 0.86 C ATOM 1407 CE LYS B 33 -22.454 -10.739 23.660 1.00 1.35 C ATOM 1408 NZ LYS B 33 -23.619 -10.163 24.389 1.00 1.88 N ATOM 0 H LYS B 33 -17.469 -6.340 25.231 1.00 0.19 H new ATOM 0 HA LYS B 33 -18.348 -8.490 25.392 1.00 0.20 H new ATOM 0 HB2 LYS B 33 -20.201 -7.300 23.909 1.00 0.23 H new ATOM 0 HB3 LYS B 33 -19.433 -8.104 22.554 1.00 0.23 H new ATOM 0 HG2 LYS B 33 -19.708 -10.318 23.745 1.00 0.29 H new ATOM 0 HG3 LYS B 33 -20.537 -9.492 25.050 1.00 0.29 H new ATOM 0 HD2 LYS B 33 -22.218 -8.614 23.341 1.00 0.86 H new ATOM 0 HD3 LYS B 33 -21.435 -9.605 22.127 1.00 0.86 H new ATOM 0 HE2 LYS B 33 -22.778 -11.346 22.815 1.00 1.35 H new ATOM 0 HE3 LYS B 33 -21.862 -11.385 24.309 1.00 1.35 H new ATOM 0 HZ1 LYS B 33 -24.224 -10.933 24.740 1.00 1.88 H new ATOM 0 HZ2 LYS B 33 -23.280 -9.595 25.192 1.00 1.88 H new ATOM 0 HZ3 LYS B 33 -24.167 -9.558 23.745 1.00 1.88 H new ATOM 1422 N ASP B 34 -16.212 -8.481 23.085 1.00 0.16 N ATOM 1423 CA ASP B 34 -15.140 -9.343 22.503 1.00 0.16 C ATOM 1424 C ASP B 34 -14.238 -9.880 23.615 1.00 0.19 C ATOM 1425 O ASP B 34 -14.335 -9.466 24.753 1.00 0.20 O ATOM 1426 CB ASP B 34 -14.355 -8.433 21.563 1.00 0.17 C ATOM 1427 CG ASP B 34 -15.182 -8.174 20.305 1.00 0.18 C ATOM 1428 OD1 ASP B 34 -16.225 -8.790 20.166 1.00 1.10 O ATOM 1429 OD2 ASP B 34 -14.756 -7.364 19.502 1.00 1.09 O ATOM 0 H ASP B 34 -16.071 -7.476 22.981 1.00 0.16 H new ATOM 0 HA ASP B 34 -15.546 -10.207 21.977 1.00 0.16 H new ATOM 0 HB2 ASP B 34 -14.123 -7.491 22.060 1.00 0.17 H new ATOM 0 HB3 ASP B 34 -13.405 -8.897 21.299 1.00 0.17 H new ATOM 1434 N ALA B 35 -13.426 -10.857 23.317 1.00 0.22 N ATOM 1435 CA ALA B 35 -12.595 -11.481 24.386 1.00 0.28 C ATOM 1436 C ALA B 35 -11.145 -10.989 24.308 1.00 0.20 C ATOM 1437 O ALA B 35 -10.507 -11.066 23.277 1.00 0.16 O ATOM 1438 CB ALA B 35 -12.667 -12.982 24.112 1.00 0.36 C ATOM 0 H ALA B 35 -13.302 -11.249 22.384 1.00 0.22 H new ATOM 0 HA ALA B 35 -12.954 -11.225 25.383 1.00 0.28 H new ATOM 0 HB1 ALA B 35 -12.079 -13.517 24.858 1.00 0.36 H new ATOM 0 HB2 ALA B 35 -13.705 -13.312 24.164 1.00 0.36 H new ATOM 0 HB3 ALA B 35 -12.269 -13.190 23.119 1.00 0.36 H new ATOM 1444 N LEU B 36 -10.596 -10.580 25.419 1.00 0.24 N ATOM 1445 CA LEU B 36 -9.156 -10.193 25.453 1.00 0.21 C ATOM 1446 C LEU B 36 -8.365 -11.250 26.225 1.00 0.19 C ATOM 1447 O LEU B 36 -8.800 -11.713 27.257 1.00 0.23 O ATOM 1448 CB LEU B 36 -9.116 -8.869 26.215 1.00 0.34 C ATOM 1449 CG LEU B 36 -10.170 -7.912 25.663 1.00 0.45 C ATOM 1450 CD1 LEU B 36 -10.418 -6.809 26.690 1.00 0.55 C ATOM 1451 CD2 LEU B 36 -9.666 -7.294 24.356 1.00 0.56 C ATOM 0 H LEU B 36 -11.086 -10.497 26.310 1.00 0.24 H new ATOM 0 HA LEU B 36 -8.726 -10.107 24.455 1.00 0.21 H new ATOM 0 HB2 LEU B 36 -9.294 -9.046 27.276 1.00 0.34 H new ATOM 0 HB3 LEU B 36 -8.126 -8.421 26.129 1.00 0.34 H new ATOM 0 HG LEU B 36 -11.097 -8.452 25.468 1.00 0.45 H new ATOM 0 HD11 LEU B 36 -11.169 -6.118 26.308 1.00 0.55 H new ATOM 0 HD12 LEU B 36 -10.772 -7.252 27.621 1.00 0.55 H new ATOM 0 HD13 LEU B 36 -9.490 -6.269 26.875 1.00 0.55 H new ATOM 0 HD21 LEU B 36 -10.419 -6.611 23.962 1.00 0.56 H new ATOM 0 HD22 LEU B 36 -8.743 -6.747 24.545 1.00 0.56 H new ATOM 0 HD23 LEU B 36 -9.477 -8.084 23.629 1.00 0.56 H new ATOM 1463 N GLU B 37 -7.160 -11.533 25.822 1.00 0.18 N ATOM 1464 CA GLU B 37 -6.314 -12.440 26.647 1.00 0.20 C ATOM 1465 C GLU B 37 -5.204 -11.638 27.328 1.00 0.18 C ATOM 1466 O GLU B 37 -4.684 -10.687 26.778 1.00 0.19 O ATOM 1467 CB GLU B 37 -5.739 -13.465 25.670 1.00 0.24 C ATOM 1468 CG GLU B 37 -4.942 -14.519 26.442 1.00 0.26 C ATOM 1469 CD GLU B 37 -4.317 -15.509 25.459 1.00 0.36 C ATOM 1470 OE1 GLU B 37 -4.538 -15.352 24.269 1.00 1.17 O ATOM 1471 OE2 GLU B 37 -3.628 -16.409 25.911 1.00 1.07 O ATOM 0 H GLU B 37 -6.727 -11.181 24.968 1.00 0.18 H new ATOM 0 HA GLU B 37 -6.880 -12.930 27.439 1.00 0.20 H new ATOM 0 HB2 GLU B 37 -6.544 -13.941 25.111 1.00 0.24 H new ATOM 0 HB3 GLU B 37 -5.096 -12.969 24.943 1.00 0.24 H new ATOM 0 HG2 GLU B 37 -4.164 -14.039 27.035 1.00 0.26 H new ATOM 0 HG3 GLU B 37 -5.595 -15.045 27.139 1.00 0.26 H new ATOM 1478 N ILE B 38 -4.940 -11.932 28.569 1.00 0.20 N ATOM 1479 CA ILE B 38 -3.986 -11.100 29.351 1.00 0.20 C ATOM 1480 C ILE B 38 -2.678 -11.858 29.573 1.00 0.19 C ATOM 1481 O ILE B 38 -2.672 -13.013 29.961 1.00 0.23 O ATOM 1482 CB ILE B 38 -4.687 -10.843 30.685 1.00 0.25 C ATOM 1483 CG1 ILE B 38 -6.039 -10.172 30.428 1.00 0.80 C ATOM 1484 CG2 ILE B 38 -3.821 -9.926 31.550 1.00 0.73 C ATOM 1485 CD1 ILE B 38 -6.799 -10.032 31.748 1.00 0.84 C ATOM 0 H ILE B 38 -5.346 -12.717 29.078 1.00 0.20 H new ATOM 0 HA ILE B 38 -3.731 -10.173 28.837 1.00 0.20 H new ATOM 0 HB ILE B 38 -4.841 -11.790 31.202 1.00 0.25 H new ATOM 0 HG12 ILE B 38 -5.890 -9.191 29.976 1.00 0.80 H new ATOM 0 HG13 ILE B 38 -6.622 -10.763 29.722 1.00 0.80 H new ATOM 0 HG21 ILE B 38 -4.322 -9.743 32.501 1.00 0.73 H new ATOM 0 HG22 ILE B 38 -2.857 -10.402 31.733 1.00 0.73 H new ATOM 0 HG23 ILE B 38 -3.666 -8.979 31.034 1.00 0.73 H new ATOM 0 HD11 ILE B 38 -7.761 -9.554 31.565 1.00 0.84 H new ATOM 0 HD12 ILE B 38 -6.960 -11.019 32.181 1.00 0.84 H new ATOM 0 HD13 ILE B 38 -6.217 -9.423 32.440 1.00 0.84 H new ATOM 1497 N TYR B 39 -1.581 -11.208 29.303 1.00 0.18 N ATOM 1498 CA TYR B 39 -0.246 -11.852 29.452 1.00 0.20 C ATOM 1499 C TYR B 39 0.587 -11.091 30.489 1.00 0.20 C ATOM 1500 O TYR B 39 0.433 -9.899 30.659 1.00 0.19 O ATOM 1501 CB TYR B 39 0.396 -11.711 28.074 1.00 0.23 C ATOM 1502 CG TYR B 39 -0.152 -12.741 27.125 1.00 0.28 C ATOM 1503 CD1 TYR B 39 -1.485 -12.673 26.701 1.00 0.31 C ATOM 1504 CD2 TYR B 39 0.684 -13.754 26.655 1.00 0.31 C ATOM 1505 CE1 TYR B 39 -1.979 -13.628 25.805 1.00 0.37 C ATOM 1506 CE2 TYR B 39 0.191 -14.709 25.762 1.00 0.36 C ATOM 1507 CZ TYR B 39 -1.140 -14.647 25.335 1.00 0.39 C ATOM 1508 OH TYR B 39 -1.624 -15.591 24.453 1.00 0.45 O ATOM 0 H TYR B 39 -1.553 -10.241 28.980 1.00 0.18 H new ATOM 0 HA TYR B 39 -0.315 -12.888 29.783 1.00 0.20 H new ATOM 0 HB2 TYR B 39 0.210 -10.711 27.681 1.00 0.23 H new ATOM 0 HB3 TYR B 39 1.477 -11.824 28.157 1.00 0.23 H new ATOM 0 HD1 TYR B 39 -2.130 -11.886 27.064 1.00 0.31 H new ATOM 0 HD2 TYR B 39 1.712 -13.800 26.981 1.00 0.31 H new ATOM 0 HE1 TYR B 39 -3.007 -13.579 25.476 1.00 0.37 H new ATOM 0 HE2 TYR B 39 0.838 -15.495 25.401 1.00 0.36 H new ATOM 0 HH TYR B 39 -2.146 -16.259 24.943 1.00 0.45 H new ATOM 1518 N VAL B 40 1.556 -11.732 31.083 1.00 0.21 N ATOM 1519 CA VAL B 40 2.487 -10.988 31.982 1.00 0.21 C ATOM 1520 C VAL B 40 3.942 -11.309 31.630 1.00 0.21 C ATOM 1521 O VAL B 40 4.341 -12.455 31.584 1.00 0.23 O ATOM 1522 CB VAL B 40 2.154 -11.474 33.392 1.00 0.24 C ATOM 1523 CG1 VAL B 40 3.157 -10.880 34.383 1.00 0.26 C ATOM 1524 CG2 VAL B 40 0.742 -11.016 33.763 1.00 0.26 C ATOM 0 H VAL B 40 1.744 -12.730 30.987 1.00 0.21 H new ATOM 0 HA VAL B 40 2.373 -9.908 31.887 1.00 0.21 H new ATOM 0 HB VAL B 40 2.207 -12.562 33.427 1.00 0.24 H new ATOM 0 HG11 VAL B 40 2.922 -11.225 35.390 1.00 0.26 H new ATOM 0 HG12 VAL B 40 4.165 -11.199 34.116 1.00 0.26 H new ATOM 0 HG13 VAL B 40 3.100 -9.792 34.350 1.00 0.26 H new ATOM 0 HG21 VAL B 40 0.500 -11.361 34.768 1.00 0.26 H new ATOM 0 HG22 VAL B 40 0.692 -9.928 33.731 1.00 0.26 H new ATOM 0 HG23 VAL B 40 0.026 -11.433 33.055 1.00 0.26 H new ATOM 1534 N ASP B 41 4.744 -10.301 31.404 1.00 0.21 N ATOM 1535 CA ASP B 41 6.179 -10.551 31.077 1.00 0.21 C ATOM 1536 C ASP B 41 7.059 -9.417 31.617 1.00 0.24 C ATOM 1537 O ASP B 41 6.731 -8.254 31.501 1.00 0.26 O ATOM 1538 CB ASP B 41 6.234 -10.593 29.549 1.00 0.19 C ATOM 1539 CG ASP B 41 5.830 -9.231 28.980 1.00 1.00 C ATOM 1540 OD1 ASP B 41 5.262 -8.446 29.720 1.00 1.68 O ATOM 1541 OD2 ASP B 41 6.094 -8.997 27.812 1.00 1.77 O ATOM 0 H ASP B 41 4.469 -9.319 31.432 1.00 0.21 H new ATOM 0 HA ASP B 41 6.548 -11.473 31.526 1.00 0.21 H new ATOM 0 HB2 ASP B 41 7.240 -10.852 29.219 1.00 0.19 H new ATOM 0 HB3 ASP B 41 5.566 -11.368 29.173 1.00 0.19 H new ATOM 1546 N ASP B 42 8.225 -9.743 32.105 1.00 0.27 N ATOM 1547 CA ASP B 42 9.184 -8.681 32.531 1.00 0.32 C ATOM 1548 C ASP B 42 8.471 -7.571 33.316 1.00 0.32 C ATOM 1549 O ASP B 42 8.746 -6.401 33.135 1.00 0.37 O ATOM 1550 CB ASP B 42 9.754 -8.129 31.224 1.00 0.37 C ATOM 1551 CG ASP B 42 10.721 -6.984 31.529 1.00 0.45 C ATOM 1552 OD1 ASP B 42 11.010 -6.774 32.696 1.00 1.21 O ATOM 1553 OD2 ASP B 42 11.155 -6.337 30.592 1.00 1.14 O ATOM 0 H ASP B 42 8.556 -10.700 32.228 1.00 0.27 H new ATOM 0 HA ASP B 42 9.956 -9.073 33.193 1.00 0.32 H new ATOM 0 HB2 ASP B 42 10.270 -8.919 30.678 1.00 0.37 H new ATOM 0 HB3 ASP B 42 8.946 -7.775 30.584 1.00 0.37 H new ATOM 1558 N GLU B 43 7.622 -7.929 34.243 1.00 0.29 N ATOM 1559 CA GLU B 43 6.967 -6.895 35.102 1.00 0.30 C ATOM 1560 C GLU B 43 6.148 -5.924 34.247 1.00 0.29 C ATOM 1561 O GLU B 43 5.647 -4.927 34.730 1.00 0.30 O ATOM 1562 CB GLU B 43 8.121 -6.163 35.791 1.00 0.34 C ATOM 1563 CG GLU B 43 7.564 -5.215 36.855 1.00 1.17 C ATOM 1564 CD GLU B 43 8.710 -4.416 37.478 1.00 1.34 C ATOM 1565 OE1 GLU B 43 9.838 -4.608 37.056 1.00 1.68 O ATOM 1566 OE2 GLU B 43 8.440 -3.626 38.368 1.00 1.92 O ATOM 0 H GLU B 43 7.353 -8.892 34.444 1.00 0.29 H new ATOM 0 HA GLU B 43 6.276 -7.338 35.820 1.00 0.30 H new ATOM 0 HB2 GLU B 43 8.799 -6.882 36.250 1.00 0.34 H new ATOM 0 HB3 GLU B 43 8.700 -5.602 35.057 1.00 0.34 H new ATOM 0 HG2 GLU B 43 6.836 -4.538 36.409 1.00 1.17 H new ATOM 0 HG3 GLU B 43 7.042 -5.783 37.625 1.00 1.17 H new ATOM 1573 N LYS B 44 5.935 -6.251 33.004 1.00 0.29 N ATOM 1574 CA LYS B 44 5.067 -5.399 32.144 1.00 0.30 C ATOM 1575 C LYS B 44 3.809 -6.176 31.754 1.00 0.27 C ATOM 1576 O LYS B 44 3.802 -7.390 31.731 1.00 0.26 O ATOM 1577 CB LYS B 44 5.910 -5.084 30.906 1.00 0.34 C ATOM 1578 CG LYS B 44 7.172 -4.329 31.326 1.00 1.29 C ATOM 1579 CD LYS B 44 7.895 -3.811 30.081 1.00 1.23 C ATOM 1580 CE LYS B 44 8.372 -4.995 29.237 1.00 1.90 C ATOM 1581 NZ LYS B 44 9.064 -4.382 28.070 1.00 2.00 N ATOM 0 H LYS B 44 6.325 -7.074 32.545 1.00 0.29 H new ATOM 0 HA LYS B 44 4.744 -4.489 32.650 1.00 0.30 H new ATOM 0 HB2 LYS B 44 6.180 -6.007 30.392 1.00 0.34 H new ATOM 0 HB3 LYS B 44 5.332 -4.485 30.202 1.00 0.34 H new ATOM 0 HG2 LYS B 44 6.910 -3.497 31.980 1.00 1.29 H new ATOM 0 HG3 LYS B 44 7.830 -4.987 31.894 1.00 1.29 H new ATOM 0 HD2 LYS B 44 7.226 -3.180 29.496 1.00 1.23 H new ATOM 0 HD3 LYS B 44 8.744 -3.193 30.372 1.00 1.23 H new ATOM 0 HE2 LYS B 44 9.047 -5.637 29.803 1.00 1.90 H new ATOM 0 HE3 LYS B 44 7.534 -5.615 28.918 1.00 1.90 H new ATOM 0 HZ1 LYS B 44 9.420 -5.132 27.444 1.00 2.00 H new ATOM 0 HZ2 LYS B 44 8.396 -3.782 27.546 1.00 2.00 H new ATOM 0 HZ3 LYS B 44 9.861 -3.803 28.404 1.00 2.00 H new ATOM 1595 N ILE B 45 2.739 -5.492 31.470 1.00 0.28 N ATOM 1596 CA ILE B 45 1.480 -6.201 31.111 1.00 0.26 C ATOM 1597 C ILE B 45 1.361 -6.331 29.591 1.00 0.26 C ATOM 1598 O ILE B 45 1.473 -5.361 28.867 1.00 0.29 O ATOM 1599 CB ILE B 45 0.362 -5.319 31.663 1.00 0.29 C ATOM 1600 CG1 ILE B 45 0.578 -5.105 33.162 1.00 0.33 C ATOM 1601 CG2 ILE B 45 -0.988 -6.000 31.435 1.00 0.28 C ATOM 1602 CD1 ILE B 45 -0.369 -4.016 33.666 1.00 1.24 C ATOM 0 H ILE B 45 2.680 -4.474 31.471 1.00 0.28 H new ATOM 0 HA ILE B 45 1.443 -7.211 31.519 1.00 0.26 H new ATOM 0 HB ILE B 45 0.372 -4.357 31.151 1.00 0.29 H new ATOM 0 HG12 ILE B 45 0.399 -6.035 33.702 1.00 0.33 H new ATOM 0 HG13 ILE B 45 1.612 -4.819 33.354 1.00 0.33 H new ATOM 0 HG21 ILE B 45 -1.785 -5.369 31.829 1.00 0.28 H new ATOM 0 HG22 ILE B 45 -1.142 -6.154 30.367 1.00 0.28 H new ATOM 0 HG23 ILE B 45 -1.001 -6.963 31.946 1.00 0.28 H new ATOM 0 HD11 ILE B 45 -0.214 -3.865 34.734 1.00 1.24 H new ATOM 0 HD12 ILE B 45 -0.169 -3.085 33.135 1.00 1.24 H new ATOM 0 HD13 ILE B 45 -1.401 -4.320 33.489 1.00 1.24 H new ATOM 1614 N ILE B 46 1.098 -7.516 29.113 1.00 0.26 N ATOM 1615 CA ILE B 46 0.926 -7.721 27.646 1.00 0.29 C ATOM 1616 C ILE B 46 -0.525 -8.107 27.342 1.00 0.28 C ATOM 1617 O ILE B 46 -1.038 -9.078 27.854 1.00 0.31 O ATOM 1618 CB ILE B 46 1.877 -8.872 27.300 1.00 0.32 C ATOM 1619 CG1 ILE B 46 3.314 -8.458 27.619 1.00 0.44 C ATOM 1620 CG2 ILE B 46 1.760 -9.220 25.814 1.00 0.37 C ATOM 1621 CD1 ILE B 46 3.593 -7.084 27.015 1.00 0.50 C ATOM 0 H ILE B 46 0.994 -8.358 29.680 1.00 0.26 H new ATOM 0 HA ILE B 46 1.145 -6.824 27.066 1.00 0.29 H new ATOM 0 HB ILE B 46 1.609 -9.748 27.891 1.00 0.32 H new ATOM 0 HG12 ILE B 46 3.465 -8.430 28.698 1.00 0.44 H new ATOM 0 HG13 ILE B 46 4.013 -9.192 27.218 1.00 0.44 H new ATOM 0 HG21 ILE B 46 2.439 -10.039 25.577 1.00 0.37 H new ATOM 0 HG22 ILE B 46 0.737 -9.521 25.590 1.00 0.37 H new ATOM 0 HG23 ILE B 46 2.020 -8.348 25.214 1.00 0.37 H new ATOM 0 HD11 ILE B 46 4.617 -6.788 27.242 1.00 0.50 H new ATOM 0 HD12 ILE B 46 3.459 -7.128 25.934 1.00 0.50 H new ATOM 0 HD13 ILE B 46 2.902 -6.354 27.437 1.00 0.50 H new ATOM 1633 N LEU B 47 -1.198 -7.348 26.523 1.00 0.28 N ATOM 1634 CA LEU B 47 -2.619 -7.683 26.206 1.00 0.29 C ATOM 1635 C LEU B 47 -2.796 -7.868 24.699 1.00 0.31 C ATOM 1636 O LEU B 47 -2.335 -7.068 23.910 1.00 0.38 O ATOM 1637 CB LEU B 47 -3.431 -6.485 26.695 1.00 0.34 C ATOM 1638 CG LEU B 47 -3.140 -6.239 28.175 1.00 0.90 C ATOM 1639 CD1 LEU B 47 -1.825 -5.471 28.317 1.00 1.66 C ATOM 1640 CD2 LEU B 47 -4.277 -5.417 28.787 1.00 1.23 C ATOM 0 H LEU B 47 -0.831 -6.516 26.061 1.00 0.28 H new ATOM 0 HA LEU B 47 -2.937 -8.611 26.681 1.00 0.29 H new ATOM 0 HB2 LEU B 47 -3.178 -5.599 26.112 1.00 0.34 H new ATOM 0 HB3 LEU B 47 -4.495 -6.670 26.549 1.00 0.34 H new ATOM 0 HG LEU B 47 -3.060 -7.195 28.693 1.00 0.90 H new ATOM 0 HD11 LEU B 47 -1.618 -5.296 29.373 1.00 1.66 H new ATOM 0 HD12 LEU B 47 -1.014 -6.054 27.880 1.00 1.66 H new ATOM 0 HD13 LEU B 47 -1.904 -4.515 27.799 1.00 1.66 H new ATOM 0 HD21 LEU B 47 -4.071 -5.241 29.843 1.00 1.23 H new ATOM 0 HD22 LEU B 47 -4.356 -4.462 28.268 1.00 1.23 H new ATOM 0 HD23 LEU B 47 -5.215 -5.963 28.687 1.00 1.23 H new ATOM 1652 N LYS B 48 -3.480 -8.901 24.293 1.00 0.28 N ATOM 1653 CA LYS B 48 -3.706 -9.115 22.836 1.00 0.34 C ATOM 1654 C LYS B 48 -5.119 -9.648 22.587 1.00 0.27 C ATOM 1655 O LYS B 48 -5.760 -10.170 23.476 1.00 0.24 O ATOM 1656 CB LYS B 48 -2.660 -10.147 22.412 1.00 0.47 C ATOM 1657 CG LYS B 48 -2.974 -11.501 23.052 1.00 0.65 C ATOM 1658 CD LYS B 48 -1.928 -12.525 22.605 1.00 0.85 C ATOM 1659 CE LYS B 48 -2.514 -13.935 22.716 1.00 1.54 C ATOM 1660 NZ LYS B 48 -3.535 -14.018 21.634 1.00 1.74 N ATOM 0 H LYS B 48 -3.892 -9.605 24.905 1.00 0.28 H new ATOM 0 HA LYS B 48 -3.614 -8.189 22.269 1.00 0.34 H new ATOM 0 HB2 LYS B 48 -2.650 -10.242 21.326 1.00 0.47 H new ATOM 0 HB3 LYS B 48 -1.666 -9.815 22.712 1.00 0.47 H new ATOM 0 HG2 LYS B 48 -2.972 -11.412 24.138 1.00 0.65 H new ATOM 0 HG3 LYS B 48 -3.971 -11.831 22.761 1.00 0.65 H new ATOM 0 HD2 LYS B 48 -1.624 -12.326 21.577 1.00 0.85 H new ATOM 0 HD3 LYS B 48 -1.034 -12.441 23.223 1.00 0.85 H new ATOM 0 HE2 LYS B 48 -1.742 -14.694 22.588 1.00 1.54 H new ATOM 0 HE3 LYS B 48 -2.963 -14.099 23.695 1.00 1.54 H new ATOM 0 HZ1 LYS B 48 -3.647 -15.009 21.338 1.00 1.74 H new ATOM 0 HZ2 LYS B 48 -4.444 -13.657 21.986 1.00 1.74 H new ATOM 0 HZ3 LYS B 48 -3.227 -13.447 20.821 1.00 1.74 H new ATOM 1674 N LYS B 49 -5.590 -9.564 21.373 1.00 0.28 N ATOM 1675 CA LYS B 49 -6.939 -10.116 21.061 1.00 0.25 C ATOM 1676 C LYS B 49 -6.982 -11.608 21.388 1.00 0.22 C ATOM 1677 O LYS B 49 -5.985 -12.298 21.316 1.00 0.24 O ATOM 1678 CB LYS B 49 -7.129 -9.892 19.562 1.00 0.28 C ATOM 1679 CG LYS B 49 -8.533 -10.342 19.153 1.00 0.30 C ATOM 1680 CD LYS B 49 -8.699 -10.185 17.640 1.00 0.54 C ATOM 1681 CE LYS B 49 -10.148 -10.482 17.250 1.00 1.08 C ATOM 1682 NZ LYS B 49 -10.430 -9.577 16.102 1.00 1.65 N ATOM 0 H LYS B 49 -5.101 -9.138 20.586 1.00 0.28 H new ATOM 0 HA LYS B 49 -7.725 -9.636 21.644 1.00 0.25 H new ATOM 0 HB2 LYS B 49 -6.988 -8.839 19.320 1.00 0.28 H new ATOM 0 HB3 LYS B 49 -6.379 -10.451 19.002 1.00 0.28 H new ATOM 0 HG2 LYS B 49 -8.692 -11.381 19.441 1.00 0.30 H new ATOM 0 HG3 LYS B 49 -9.283 -9.748 19.675 1.00 0.30 H new ATOM 0 HD2 LYS B 49 -8.430 -9.173 17.337 1.00 0.54 H new ATOM 0 HD3 LYS B 49 -8.025 -10.863 17.117 1.00 0.54 H new ATOM 0 HE2 LYS B 49 -10.275 -11.527 16.969 1.00 1.08 H new ATOM 0 HE3 LYS B 49 -10.828 -10.290 18.080 1.00 1.08 H new ATOM 0 HZ1 LYS B 49 -11.214 -9.964 15.539 1.00 1.65 H new ATOM 0 HZ2 LYS B 49 -10.691 -8.636 16.458 1.00 1.65 H new ATOM 0 HZ3 LYS B 49 -9.582 -9.498 15.506 1.00 1.65 H new ATOM 1696 N TYR B 50 -8.112 -12.094 21.815 1.00 0.20 N ATOM 1697 CA TYR B 50 -8.196 -13.525 22.224 1.00 0.22 C ATOM 1698 C TYR B 50 -8.927 -14.347 21.159 1.00 0.25 C ATOM 1699 O TYR B 50 -10.123 -14.229 20.983 1.00 0.20 O ATOM 1700 CB TYR B 50 -8.992 -13.508 23.527 1.00 0.22 C ATOM 1701 CG TYR B 50 -9.133 -14.917 24.050 1.00 0.30 C ATOM 1702 CD1 TYR B 50 -8.073 -15.820 23.921 1.00 0.38 C ATOM 1703 CD2 TYR B 50 -10.326 -15.318 24.661 1.00 0.41 C ATOM 1704 CE1 TYR B 50 -8.206 -17.127 24.405 1.00 0.48 C ATOM 1705 CE2 TYR B 50 -10.458 -16.624 25.145 1.00 0.52 C ATOM 1706 CZ TYR B 50 -9.398 -17.529 25.017 1.00 0.53 C ATOM 1707 OH TYR B 50 -9.530 -18.817 25.495 1.00 0.65 O ATOM 0 H TYR B 50 -8.980 -11.565 21.899 1.00 0.20 H new ATOM 0 HA TYR B 50 -7.212 -13.978 22.346 1.00 0.22 H new ATOM 0 HB2 TYR B 50 -8.488 -12.884 24.265 1.00 0.22 H new ATOM 0 HB3 TYR B 50 -9.976 -13.071 23.358 1.00 0.22 H new ATOM 0 HD1 TYR B 50 -7.153 -15.510 23.449 1.00 0.38 H new ATOM 0 HD2 TYR B 50 -11.144 -14.620 24.759 1.00 0.41 H new ATOM 0 HE1 TYR B 50 -7.388 -17.825 24.306 1.00 0.48 H new ATOM 0 HE2 TYR B 50 -11.378 -16.934 25.618 1.00 0.52 H new ATOM 0 HH TYR B 50 -10.419 -18.929 25.891 1.00 0.65 H new ATOM 1717 N LYS B 51 -8.226 -15.221 20.488 1.00 0.38 N ATOM 1718 CA LYS B 51 -8.893 -16.092 19.477 1.00 0.44 C ATOM 1719 C LYS B 51 -8.574 -17.564 19.752 1.00 1.25 C ATOM 1720 O LYS B 51 -7.754 -18.158 19.081 1.00 2.08 O ATOM 1721 CB LYS B 51 -8.306 -15.659 18.133 1.00 1.27 C ATOM 1722 CG LYS B 51 -6.782 -15.581 18.244 1.00 2.06 C ATOM 1723 CD LYS B 51 -6.188 -15.218 16.881 1.00 2.71 C ATOM 1724 CE LYS B 51 -4.694 -14.923 17.036 1.00 3.57 C ATOM 1725 NZ LYS B 51 -4.400 -13.884 16.010 1.00 4.35 N ATOM 0 H LYS B 51 -7.223 -15.370 20.596 1.00 0.38 H new ATOM 0 HA LYS B 51 -9.978 -15.993 19.500 1.00 0.44 H new ATOM 0 HB2 LYS B 51 -8.589 -16.368 17.355 1.00 1.27 H new ATOM 0 HB3 LYS B 51 -8.710 -14.689 17.843 1.00 1.27 H new ATOM 0 HG2 LYS B 51 -6.499 -14.835 18.986 1.00 2.06 H new ATOM 0 HG3 LYS B 51 -6.382 -16.536 18.584 1.00 2.06 H new ATOM 0 HD2 LYS B 51 -6.336 -16.038 16.178 1.00 2.71 H new ATOM 0 HD3 LYS B 51 -6.700 -14.348 16.469 1.00 2.71 H new ATOM 0 HE2 LYS B 51 -4.464 -14.564 18.039 1.00 3.57 H new ATOM 0 HE3 LYS B 51 -4.095 -15.819 16.873 1.00 3.57 H new ATOM 0 HZ1 LYS B 51 -3.393 -13.628 16.053 1.00 4.35 H new ATOM 0 HZ2 LYS B 51 -4.622 -14.257 15.065 1.00 4.35 H new ATOM 0 HZ3 LYS B 51 -4.979 -13.040 16.194 1.00 4.35 H new ATOM 1739 N PRO B 52 -9.242 -18.105 20.735 1.00 1.79 N ATOM 1740 CA PRO B 52 -9.034 -19.526 21.105 1.00 2.79 C ATOM 1741 C PRO B 52 -9.382 -20.441 19.928 1.00 2.90 C ATOM 1742 O PRO B 52 -10.299 -20.178 19.176 1.00 3.05 O ATOM 1743 CB PRO B 52 -9.996 -19.754 22.274 1.00 3.58 C ATOM 1744 CG PRO B 52 -10.946 -18.597 22.251 1.00 3.28 C ATOM 1745 CD PRO B 52 -10.241 -17.452 21.579 1.00 2.28 C ATOM 0 HA PRO B 52 -8.000 -19.746 21.370 1.00 2.79 H new ATOM 0 HB2 PRO B 52 -10.528 -20.699 22.164 1.00 3.58 H new ATOM 0 HB3 PRO B 52 -9.458 -19.799 23.221 1.00 3.58 H new ATOM 0 HG2 PRO B 52 -11.856 -18.858 21.711 1.00 3.28 H new ATOM 0 HG3 PRO B 52 -11.243 -18.324 23.263 1.00 3.28 H new ATOM 0 HD2 PRO B 52 -10.931 -16.849 20.989 1.00 2.28 H new ATOM 0 HD3 PRO B 52 -9.777 -16.786 22.306 1.00 2.28 H new ATOM 1753 N ASN B 53 -8.664 -21.520 19.770 1.00 3.43 N ATOM 1754 CA ASN B 53 -8.964 -22.457 18.648 1.00 4.01 C ATOM 1755 C ASN B 53 -10.084 -23.420 19.050 1.00 4.61 C ATOM 1756 O ASN B 53 -11.168 -22.947 19.348 1.00 5.09 O ATOM 1757 CB ASN B 53 -7.661 -23.219 18.408 1.00 4.59 C ATOM 1758 CG ASN B 53 -6.586 -22.250 17.913 1.00 5.20 C ATOM 1759 OD1 ASN B 53 -6.890 -21.155 17.482 1.00 5.34 O ATOM 1760 ND2 ASN B 53 -5.332 -22.610 17.952 1.00 5.97 N ATOM 1761 OXT ASN B 53 -9.837 -24.615 19.052 1.00 4.97 O ATOM 0 H ASN B 53 -7.884 -21.793 20.368 1.00 3.43 H new ATOM 0 HA ASN B 53 -9.300 -21.935 17.752 1.00 4.01 H new ATOM 0 HB2 ASN B 53 -7.334 -23.701 19.329 1.00 4.59 H new ATOM 0 HB3 ASN B 53 -7.819 -24.009 17.674 1.00 4.59 H new ATOM 0 HD21 ASN B 53 -4.608 -21.973 17.621 1.00 5.97 H new ATOM 0 HD22 ASN B 53 -5.076 -23.529 18.314 1.00 5.97 H new TER 1768 ASN B 53