USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=15 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 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 155:sc= 1.8 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.124 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 91:sc= 0.913 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= -0.326 USER MOD Single : A 44 LYS NZ :NH3+ 138:sc= 0.665 (180deg=-0.224) USER MOD Single : A 48 LYS NZ :NH3+ 147:sc= -0.623 (180deg=-1.06) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.0874 K(o=-0.087,f=-1.5!) USER MOD Single : B 3 MET CE :methyl 146:sc= -0.168 (180deg=-0.986) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot -146:sc= 0.266 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.111 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 THR OG1 : rot 92:sc= 0.877 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 TYR OH : rot 180:sc= -0.294 USER MOD Single : B 44 LYS NZ :NH3+ 136:sc= 0.656 (180deg=-0.244) USER MOD Single : B 48 LYS NZ :NH3+ 146:sc= -0.344 (180deg=-0.876) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc= -0.268 K(o=-0.27,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 2 8.192 -22.871 26.060 1.00 8.91 N ATOM 2 CA PHE A 2 9.446 -22.070 26.160 1.00 8.45 C ATOM 3 C PHE A 2 9.191 -20.781 26.947 1.00 7.63 C ATOM 4 O PHE A 2 10.028 -20.329 27.703 1.00 7.72 O ATOM 5 CB PHE A 2 9.828 -21.750 24.715 1.00 8.96 C ATOM 6 CG PHE A 2 10.196 -23.027 23.997 1.00 9.49 C ATOM 7 CD1 PHE A 2 11.498 -23.534 24.093 1.00 9.80 C ATOM 8 CD2 PHE A 2 9.236 -23.702 23.234 1.00 9.97 C ATOM 9 CE1 PHE A 2 11.839 -24.717 23.428 1.00 10.54 C ATOM 10 CE2 PHE A 2 9.577 -24.885 22.568 1.00 10.72 C ATOM 11 CZ PHE A 2 10.878 -25.393 22.665 1.00 10.99 C ATOM 0 HA PHE A 2 10.238 -22.607 26.681 1.00 8.45 H new ATOM 0 HB2 PHE A 2 8.996 -21.261 24.207 1.00 8.96 H new ATOM 0 HB3 PHE A 2 10.667 -21.054 24.695 1.00 8.96 H new ATOM 0 HD1 PHE A 2 12.239 -23.012 24.680 1.00 9.80 H new ATOM 0 HD2 PHE A 2 8.232 -23.310 23.159 1.00 9.97 H new ATOM 0 HE1 PHE A 2 12.843 -25.109 23.503 1.00 10.54 H new ATOM 0 HE2 PHE A 2 8.836 -25.406 21.979 1.00 10.72 H new ATOM 0 HZ PHE A 2 11.141 -26.306 22.152 1.00 10.99 H new ATOM 21 N MET A 3 8.038 -20.193 26.781 1.00 7.11 N ATOM 22 CA MET A 3 7.728 -18.939 27.527 1.00 6.57 C ATOM 23 C MET A 3 6.514 -19.153 28.436 1.00 5.78 C ATOM 24 O MET A 3 5.627 -19.925 28.130 1.00 5.66 O ATOM 25 CB MET A 3 7.413 -17.903 26.447 1.00 6.89 C ATOM 26 CG MET A 3 8.663 -17.649 25.604 1.00 7.83 C ATOM 27 SD MET A 3 8.327 -16.331 24.409 1.00 8.58 S ATOM 28 CE MET A 3 9.906 -16.414 23.529 1.00 8.76 C ATOM 0 H MET A 3 7.298 -20.525 26.163 1.00 7.11 H new ATOM 0 HA MET A 3 8.553 -18.623 28.166 1.00 6.57 H new ATOM 0 HB2 MET A 3 6.600 -18.258 25.814 1.00 6.89 H new ATOM 0 HB3 MET A 3 7.076 -16.974 26.907 1.00 6.89 H new ATOM 0 HG2 MET A 3 9.497 -17.368 26.247 1.00 7.83 H new ATOM 0 HG3 MET A 3 8.955 -18.561 25.083 1.00 7.83 H new ATOM 0 HE1 MET A 3 9.918 -15.671 22.732 1.00 8.76 H new ATOM 0 HE2 MET A 3 10.721 -16.213 24.224 1.00 8.76 H new ATOM 0 HE3 MET A 3 10.032 -17.408 23.100 1.00 8.76 H new ATOM 38 N LYS A 4 6.476 -18.487 29.558 1.00 5.58 N ATOM 39 CA LYS A 4 5.326 -18.666 30.490 1.00 5.16 C ATOM 40 C LYS A 4 4.366 -17.478 30.387 1.00 4.32 C ATOM 41 O LYS A 4 4.778 -16.335 30.358 1.00 4.43 O ATOM 42 CB LYS A 4 5.953 -18.730 31.883 1.00 5.73 C ATOM 43 CG LYS A 4 6.850 -19.966 31.983 1.00 6.53 C ATOM 44 CD LYS A 4 7.387 -20.094 33.410 1.00 7.41 C ATOM 45 CE LYS A 4 8.380 -21.255 33.480 1.00 8.29 C ATOM 46 NZ LYS A 4 8.676 -21.421 34.930 1.00 8.85 N ATOM 0 H LYS A 4 7.190 -17.828 29.869 1.00 5.58 H new ATOM 0 HA LYS A 4 4.746 -19.560 30.261 1.00 5.16 H new ATOM 0 HB2 LYS A 4 6.536 -17.829 32.073 1.00 5.73 H new ATOM 0 HB3 LYS A 4 5.173 -18.771 32.643 1.00 5.73 H new ATOM 0 HG2 LYS A 4 6.287 -20.860 31.714 1.00 6.53 H new ATOM 0 HG3 LYS A 4 7.677 -19.886 31.278 1.00 6.53 H new ATOM 0 HD2 LYS A 4 7.874 -19.166 33.711 1.00 7.41 H new ATOM 0 HD3 LYS A 4 6.565 -20.263 34.105 1.00 7.41 H new ATOM 0 HE2 LYS A 4 7.954 -22.165 33.057 1.00 8.29 H new ATOM 0 HE3 LYS A 4 9.286 -21.035 32.915 1.00 8.29 H new ATOM 0 HZ1 LYS A 4 9.352 -22.201 35.059 1.00 8.85 H new ATOM 0 HZ2 LYS A 4 9.087 -20.541 35.303 1.00 8.85 H new ATOM 0 HZ3 LYS A 4 7.796 -21.637 35.441 1.00 8.85 H new ATOM 60 N SER A 5 3.087 -17.738 30.366 1.00 3.84 N ATOM 61 CA SER A 5 2.098 -16.625 30.305 1.00 3.10 C ATOM 62 C SER A 5 0.934 -16.905 31.259 1.00 2.34 C ATOM 63 O SER A 5 0.535 -18.037 31.447 1.00 2.87 O ATOM 64 CB SER A 5 1.612 -16.604 28.857 1.00 3.66 C ATOM 65 OG SER A 5 0.747 -15.492 28.666 1.00 4.20 O ATOM 0 H SER A 5 2.684 -18.675 30.389 1.00 3.84 H new ATOM 0 HA SER A 5 2.531 -15.669 30.601 1.00 3.10 H new ATOM 0 HB2 SER A 5 2.462 -16.539 28.177 1.00 3.66 H new ATOM 0 HB3 SER A 5 1.088 -17.531 28.624 1.00 3.66 H new ATOM 0 HG SER A 5 0.752 -15.232 27.721 1.00 4.20 H new ATOM 71 N THR A 6 0.388 -15.888 31.869 1.00 1.82 N ATOM 72 CA THR A 6 -0.743 -16.110 32.813 1.00 1.98 C ATOM 73 C THR A 6 -1.943 -16.695 32.066 1.00 1.52 C ATOM 74 O THR A 6 -2.596 -17.605 32.538 1.00 2.20 O ATOM 75 CB THR A 6 -1.079 -14.725 33.367 1.00 2.86 C ATOM 76 OG1 THR A 6 -1.532 -13.891 32.309 1.00 3.36 O ATOM 77 CG2 THR A 6 0.169 -14.111 34.004 1.00 3.77 C ATOM 0 H THR A 6 0.676 -14.916 31.755 1.00 1.82 H new ATOM 0 HA THR A 6 -0.487 -16.812 33.606 1.00 1.98 H new ATOM 0 HB THR A 6 -1.861 -14.815 34.121 1.00 2.86 H new ATOM 0 HG1 THR A 6 -1.750 -13.003 32.662 1.00 3.36 H new ATOM 0 HG21 THR A 6 -0.072 -13.124 34.398 1.00 3.77 H new ATOM 0 HG22 THR A 6 0.516 -14.751 34.815 1.00 3.77 H new ATOM 0 HG23 THR A 6 0.954 -14.020 33.253 1.00 3.77 H new ATOM 85 N GLY A 7 -2.196 -16.230 30.873 1.00 0.83 N ATOM 86 CA GLY A 7 -3.302 -16.819 30.068 1.00 0.46 C ATOM 87 C GLY A 7 -4.646 -16.482 30.714 1.00 0.43 C ATOM 88 O GLY A 7 -5.505 -17.331 30.856 1.00 0.49 O ATOM 0 H GLY A 7 -1.686 -15.470 30.423 1.00 0.83 H new ATOM 0 HA2 GLY A 7 -3.270 -16.431 29.050 1.00 0.46 H new ATOM 0 HA3 GLY A 7 -3.180 -17.900 30.002 1.00 0.46 H new ATOM 92 N ILE A 8 -4.846 -15.251 31.101 1.00 0.37 N ATOM 93 CA ILE A 8 -6.151 -14.877 31.725 1.00 0.37 C ATOM 94 C ILE A 8 -6.906 -13.906 30.817 1.00 0.32 C ATOM 95 O ILE A 8 -6.334 -12.990 30.273 1.00 0.30 O ATOM 96 CB ILE A 8 -5.786 -14.196 33.041 1.00 0.40 C ATOM 97 CG1 ILE A 8 -4.819 -15.086 33.828 1.00 0.45 C ATOM 98 CG2 ILE A 8 -7.053 -13.969 33.867 1.00 0.43 C ATOM 99 CD1 ILE A 8 -5.352 -16.519 33.858 1.00 1.36 C ATOM 0 H ILE A 8 -4.169 -14.493 31.014 1.00 0.37 H new ATOM 0 HA ILE A 8 -6.795 -15.742 31.880 1.00 0.37 H new ATOM 0 HB ILE A 8 -5.310 -13.238 32.832 1.00 0.40 H new ATOM 0 HG12 ILE A 8 -3.831 -15.064 33.367 1.00 0.45 H new ATOM 0 HG13 ILE A 8 -4.705 -14.708 34.844 1.00 0.45 H new ATOM 0 HG21 ILE A 8 -6.792 -13.483 34.807 1.00 0.43 H new ATOM 0 HG22 ILE A 8 -7.742 -13.335 33.309 1.00 0.43 H new ATOM 0 HG23 ILE A 8 -7.529 -14.928 34.074 1.00 0.43 H new ATOM 0 HD11 ILE A 8 -4.663 -17.152 34.418 1.00 1.36 H new ATOM 0 HD12 ILE A 8 -6.330 -16.533 34.338 1.00 1.36 H new ATOM 0 HD13 ILE A 8 -5.443 -16.895 32.839 1.00 1.36 H new ATOM 111 N VAL A 9 -8.160 -14.149 30.578 1.00 0.32 N ATOM 112 CA VAL A 9 -8.912 -13.287 29.617 1.00 0.29 C ATOM 113 C VAL A 9 -10.069 -12.567 30.317 1.00 0.32 C ATOM 114 O VAL A 9 -10.736 -13.119 31.171 1.00 0.37 O ATOM 115 CB VAL A 9 -9.437 -14.242 28.546 1.00 0.29 C ATOM 116 CG1 VAL A 9 -10.278 -13.462 27.533 1.00 0.27 C ATOM 117 CG2 VAL A 9 -8.255 -14.898 27.824 1.00 0.30 C ATOM 0 H VAL A 9 -8.700 -14.903 31.002 1.00 0.32 H new ATOM 0 HA VAL A 9 -8.279 -12.508 29.192 1.00 0.29 H new ATOM 0 HB VAL A 9 -10.051 -15.010 29.016 1.00 0.29 H new ATOM 0 HG11 VAL A 9 -10.652 -14.144 26.769 1.00 0.27 H new ATOM 0 HG12 VAL A 9 -11.119 -12.992 28.043 1.00 0.27 H new ATOM 0 HG13 VAL A 9 -9.663 -12.694 27.064 1.00 0.27 H new ATOM 0 HG21 VAL A 9 -8.628 -15.580 27.060 1.00 0.30 H new ATOM 0 HG22 VAL A 9 -7.642 -14.128 27.355 1.00 0.30 H new ATOM 0 HG23 VAL A 9 -7.653 -15.454 28.543 1.00 0.30 H new ATOM 127 N ARG A 10 -10.337 -11.353 29.920 1.00 0.31 N ATOM 128 CA ARG A 10 -11.480 -10.599 30.511 1.00 0.36 C ATOM 129 C ARG A 10 -12.367 -10.047 29.391 1.00 0.31 C ATOM 130 O ARG A 10 -11.954 -9.951 28.255 1.00 0.27 O ATOM 131 CB ARG A 10 -10.840 -9.460 31.305 1.00 0.40 C ATOM 132 CG ARG A 10 -11.928 -8.668 32.031 1.00 0.73 C ATOM 133 CD ARG A 10 -12.482 -9.502 33.189 1.00 0.86 C ATOM 134 NE ARG A 10 -13.570 -8.671 33.774 1.00 1.13 N ATOM 135 CZ ARG A 10 -14.267 -9.119 34.784 1.00 1.36 C ATOM 136 NH1 ARG A 10 -14.011 -10.297 35.287 1.00 1.61 N ATOM 137 NH2 ARG A 10 -15.219 -8.387 35.293 1.00 1.91 N ATOM 0 H ARG A 10 -9.810 -10.848 29.207 1.00 0.31 H new ATOM 0 HA ARG A 10 -12.111 -11.223 31.144 1.00 0.36 H new ATOM 0 HB2 ARG A 10 -10.126 -9.861 32.025 1.00 0.40 H new ATOM 0 HB3 ARG A 10 -10.284 -8.804 30.636 1.00 0.40 H new ATOM 0 HG2 ARG A 10 -11.520 -7.730 32.407 1.00 0.73 H new ATOM 0 HG3 ARG A 10 -12.729 -8.411 31.338 1.00 0.73 H new ATOM 0 HD2 ARG A 10 -12.863 -10.461 32.838 1.00 0.86 H new ATOM 0 HD3 ARG A 10 -11.709 -9.717 33.927 1.00 0.86 H new ATOM 0 HE ARG A 10 -13.772 -7.750 33.385 1.00 1.13 H new ATOM 0 HH11 ARG A 10 -13.265 -10.869 34.891 1.00 1.61 H new ATOM 0 HH12 ARG A 10 -14.557 -10.644 36.076 1.00 1.61 H new ATOM 0 HH21 ARG A 10 -15.418 -7.466 34.902 1.00 1.91 H new ATOM 0 HH22 ARG A 10 -15.764 -8.735 36.082 1.00 1.91 H new ATOM 151 N LYS A 11 -13.589 -9.706 29.696 1.00 0.32 N ATOM 152 CA LYS A 11 -14.498 -9.186 28.633 1.00 0.29 C ATOM 153 C LYS A 11 -14.288 -7.681 28.444 1.00 0.26 C ATOM 154 O LYS A 11 -14.001 -6.962 29.381 1.00 0.27 O ATOM 155 CB LYS A 11 -15.910 -9.470 29.147 1.00 0.33 C ATOM 156 CG LYS A 11 -16.119 -10.981 29.264 1.00 1.02 C ATOM 157 CD LYS A 11 -17.565 -11.267 29.668 1.00 1.03 C ATOM 158 CE LYS A 11 -17.742 -12.769 29.910 1.00 1.81 C ATOM 159 NZ LYS A 11 -19.087 -12.901 30.536 1.00 2.21 N ATOM 0 H LYS A 11 -13.997 -9.764 30.629 1.00 0.32 H new ATOM 0 HA LYS A 11 -14.313 -9.655 27.666 1.00 0.29 H new ATOM 0 HB2 LYS A 11 -16.057 -8.996 30.118 1.00 0.33 H new ATOM 0 HB3 LYS A 11 -16.648 -9.042 28.468 1.00 0.33 H new ATOM 0 HG2 LYS A 11 -15.894 -11.464 28.313 1.00 1.02 H new ATOM 0 HG3 LYS A 11 -15.435 -11.397 30.003 1.00 1.02 H new ATOM 0 HD2 LYS A 11 -17.818 -10.710 30.570 1.00 1.03 H new ATOM 0 HD3 LYS A 11 -18.245 -10.932 28.885 1.00 1.03 H new ATOM 0 HE2 LYS A 11 -17.684 -13.329 28.977 1.00 1.81 H new ATOM 0 HE3 LYS A 11 -16.962 -13.158 30.564 1.00 1.81 H new ATOM 0 HZ1 LYS A 11 -19.282 -13.904 30.732 1.00 2.21 H new ATOM 0 HZ2 LYS A 11 -19.110 -12.363 31.426 1.00 2.21 H new ATOM 0 HZ3 LYS A 11 -19.810 -12.529 29.888 1.00 2.21 H new ATOM 173 N VAL A 12 -14.441 -7.197 27.240 1.00 0.22 N ATOM 174 CA VAL A 12 -14.263 -5.735 26.997 1.00 0.21 C ATOM 175 C VAL A 12 -15.548 -4.990 27.362 1.00 0.20 C ATOM 176 O VAL A 12 -16.619 -5.326 26.901 1.00 0.20 O ATOM 177 CB VAL A 12 -13.993 -5.605 25.496 1.00 0.20 C ATOM 178 CG1 VAL A 12 -13.416 -4.221 25.199 1.00 0.28 C ATOM 179 CG2 VAL A 12 -13.000 -6.680 25.052 1.00 0.28 C ATOM 0 H VAL A 12 -14.681 -7.749 26.416 1.00 0.22 H new ATOM 0 HA VAL A 12 -13.455 -5.314 27.595 1.00 0.21 H new ATOM 0 HB VAL A 12 -14.928 -5.734 24.951 1.00 0.20 H new ATOM 0 HG11 VAL A 12 -13.224 -4.129 24.130 1.00 0.28 H new ATOM 0 HG12 VAL A 12 -14.129 -3.456 25.507 1.00 0.28 H new ATOM 0 HG13 VAL A 12 -12.483 -4.090 25.748 1.00 0.28 H new ATOM 0 HG21 VAL A 12 -12.812 -6.582 23.983 1.00 0.28 H new ATOM 0 HG22 VAL A 12 -12.064 -6.559 25.598 1.00 0.28 H new ATOM 0 HG23 VAL A 12 -13.415 -7.666 25.259 1.00 0.28 H new ATOM 189 N ASP A 13 -15.454 -3.981 28.182 1.00 0.20 N ATOM 190 CA ASP A 13 -16.680 -3.227 28.565 1.00 0.21 C ATOM 191 C ASP A 13 -16.980 -2.146 27.517 1.00 0.22 C ATOM 192 O ASP A 13 -16.400 -2.127 26.450 1.00 0.22 O ATOM 193 CB ASP A 13 -16.369 -2.621 29.941 1.00 0.21 C ATOM 194 CG ASP A 13 -15.739 -1.237 29.790 1.00 0.32 C ATOM 195 OD1 ASP A 13 -14.542 -1.167 29.584 1.00 0.26 O ATOM 196 OD2 ASP A 13 -16.468 -0.266 29.879 1.00 0.55 O ATOM 0 H ASP A 13 -14.586 -3.647 28.602 1.00 0.20 H new ATOM 0 HA ASP A 13 -17.566 -3.860 28.612 1.00 0.21 H new ATOM 0 HB2 ASP A 13 -17.285 -2.547 30.527 1.00 0.21 H new ATOM 0 HB3 ASP A 13 -15.692 -3.277 30.488 1.00 0.21 H new ATOM 201 N GLU A 14 -17.969 -1.332 27.758 1.00 0.23 N ATOM 202 CA GLU A 14 -18.411 -0.363 26.712 1.00 0.26 C ATOM 203 C GLU A 14 -17.258 0.542 26.257 1.00 0.26 C ATOM 204 O GLU A 14 -17.190 0.931 25.108 1.00 0.29 O ATOM 205 CB GLU A 14 -19.506 0.466 27.383 1.00 0.28 C ATOM 206 CG GLU A 14 -20.690 -0.437 27.733 1.00 1.22 C ATOM 207 CD GLU A 14 -21.812 0.405 28.345 1.00 1.57 C ATOM 208 OE1 GLU A 14 -21.569 1.567 28.622 1.00 2.19 O ATOM 209 OE2 GLU A 14 -22.894 -0.128 28.525 1.00 1.99 O ATOM 0 H GLU A 14 -18.492 -1.294 28.633 1.00 0.23 H new ATOM 0 HA GLU A 14 -18.762 -0.876 25.817 1.00 0.26 H new ATOM 0 HB2 GLU A 14 -19.117 0.939 28.285 1.00 0.28 H new ATOM 0 HB3 GLU A 14 -19.830 1.266 26.718 1.00 0.28 H new ATOM 0 HG2 GLU A 14 -21.049 -0.946 26.839 1.00 1.22 H new ATOM 0 HG3 GLU A 14 -20.377 -1.210 28.435 1.00 1.22 H new ATOM 216 N LEU A 15 -16.419 0.970 27.157 1.00 0.23 N ATOM 217 CA LEU A 15 -15.361 1.952 26.770 1.00 0.24 C ATOM 218 C LEU A 15 -14.145 1.254 26.151 1.00 0.22 C ATOM 219 O LEU A 15 -13.219 1.900 25.704 1.00 0.24 O ATOM 220 CB LEU A 15 -14.967 2.654 28.069 1.00 0.28 C ATOM 221 CG LEU A 15 -13.791 3.595 27.795 1.00 0.38 C ATOM 222 CD1 LEU A 15 -14.094 4.447 26.560 1.00 1.28 C ATOM 223 CD2 LEU A 15 -13.582 4.511 29.003 1.00 1.38 C ATOM 0 H LEU A 15 -16.417 0.687 28.137 1.00 0.23 H new ATOM 0 HA LEU A 15 -15.728 2.650 26.017 1.00 0.24 H new ATOM 0 HB2 LEU A 15 -15.813 3.216 28.464 1.00 0.28 H new ATOM 0 HB3 LEU A 15 -14.692 1.919 28.825 1.00 0.28 H new ATOM 0 HG LEU A 15 -12.890 3.008 27.620 1.00 0.38 H new ATOM 0 HD11 LEU A 15 -13.256 5.117 26.366 1.00 1.28 H new ATOM 0 HD12 LEU A 15 -14.247 3.797 25.698 1.00 1.28 H new ATOM 0 HD13 LEU A 15 -14.995 5.035 26.736 1.00 1.28 H new ATOM 0 HD21 LEU A 15 -12.745 5.182 28.810 1.00 1.38 H new ATOM 0 HD22 LEU A 15 -14.485 5.097 29.176 1.00 1.38 H new ATOM 0 HD23 LEU A 15 -13.367 3.907 29.885 1.00 1.38 H new ATOM 235 N GLY A 16 -14.107 -0.050 26.155 1.00 0.21 N ATOM 236 CA GLY A 16 -12.908 -0.744 25.603 1.00 0.19 C ATOM 237 C GLY A 16 -11.790 -0.751 26.649 1.00 0.20 C ATOM 238 O GLY A 16 -10.659 -0.398 26.369 1.00 0.20 O ATOM 0 H GLY A 16 -14.843 -0.659 26.511 1.00 0.21 H new ATOM 0 HA2 GLY A 16 -13.164 -1.766 25.323 1.00 0.19 H new ATOM 0 HA3 GLY A 16 -12.569 -0.241 24.697 1.00 0.19 H new ATOM 242 N ARG A 17 -12.105 -1.094 27.868 1.00 0.24 N ATOM 243 CA ARG A 17 -11.072 -1.065 28.938 1.00 0.26 C ATOM 244 C ARG A 17 -10.792 -2.487 29.435 1.00 0.26 C ATOM 245 O ARG A 17 -11.627 -3.364 29.339 1.00 0.26 O ATOM 246 CB ARG A 17 -11.681 -0.211 30.051 1.00 0.28 C ATOM 247 CG ARG A 17 -11.824 1.232 29.562 1.00 0.28 C ATOM 248 CD ARG A 17 -12.368 2.107 30.693 1.00 0.29 C ATOM 249 NE ARG A 17 -13.787 1.693 30.850 1.00 0.57 N ATOM 250 CZ ARG A 17 -14.626 2.466 31.492 1.00 0.79 C ATOM 251 NH1 ARG A 17 -14.210 3.580 32.030 1.00 0.73 N ATOM 252 NH2 ARG A 17 -15.881 2.125 31.598 1.00 1.15 N ATOM 0 H ARG A 17 -13.033 -1.393 28.168 1.00 0.24 H new ATOM 0 HA ARG A 17 -10.122 -0.659 28.591 1.00 0.26 H new ATOM 0 HB2 ARG A 17 -12.655 -0.608 30.338 1.00 0.28 H new ATOM 0 HB3 ARG A 17 -11.049 -0.245 30.938 1.00 0.28 H new ATOM 0 HG2 ARG A 17 -10.858 1.611 29.228 1.00 0.28 H new ATOM 0 HG3 ARG A 17 -12.495 1.271 28.704 1.00 0.28 H new ATOM 0 HD2 ARG A 17 -11.808 1.954 31.615 1.00 0.29 H new ATOM 0 HD3 ARG A 17 -12.291 3.166 30.445 1.00 0.29 H new ATOM 0 HE ARG A 17 -14.107 0.807 30.458 1.00 0.57 H new ATOM 0 HH11 ARG A 17 -13.230 3.850 31.951 1.00 0.73 H new ATOM 0 HH12 ARG A 17 -14.865 4.181 32.530 1.00 0.73 H new ATOM 0 HH21 ARG A 17 -16.210 1.255 31.180 1.00 1.15 H new ATOM 0 HH22 ARG A 17 -16.533 2.729 32.099 1.00 1.15 H new ATOM 266 N VAL A 18 -9.623 -2.720 29.961 1.00 0.26 N ATOM 267 CA VAL A 18 -9.283 -4.084 30.458 1.00 0.25 C ATOM 268 C VAL A 18 -8.874 -4.012 31.931 1.00 0.24 C ATOM 269 O VAL A 18 -8.459 -2.978 32.413 1.00 0.24 O ATOM 270 CB VAL A 18 -8.107 -4.540 29.597 1.00 0.26 C ATOM 271 CG1 VAL A 18 -8.491 -4.453 28.119 1.00 0.28 C ATOM 272 CG2 VAL A 18 -6.901 -3.637 29.863 1.00 0.26 C ATOM 0 H VAL A 18 -8.886 -2.024 30.069 1.00 0.26 H new ATOM 0 HA VAL A 18 -10.124 -4.774 30.390 1.00 0.25 H new ATOM 0 HB VAL A 18 -7.853 -5.570 29.846 1.00 0.26 H new ATOM 0 HG11 VAL A 18 -7.651 -4.779 27.505 1.00 0.28 H new ATOM 0 HG12 VAL A 18 -9.351 -5.095 27.928 1.00 0.28 H new ATOM 0 HG13 VAL A 18 -8.745 -3.423 27.869 1.00 0.28 H new ATOM 0 HG21 VAL A 18 -6.061 -3.962 29.249 1.00 0.26 H new ATOM 0 HG22 VAL A 18 -7.156 -2.607 29.614 1.00 0.26 H new ATOM 0 HG23 VAL A 18 -6.626 -3.698 30.916 1.00 0.26 H new ATOM 282 N VAL A 19 -9.080 -5.066 32.668 1.00 0.22 N ATOM 283 CA VAL A 19 -8.805 -5.006 34.132 1.00 0.21 C ATOM 284 C VAL A 19 -7.638 -5.921 34.502 1.00 0.22 C ATOM 285 O VAL A 19 -7.616 -7.086 34.159 1.00 0.23 O ATOM 286 CB VAL A 19 -10.095 -5.497 34.791 1.00 0.22 C ATOM 287 CG1 VAL A 19 -10.024 -5.253 36.300 1.00 0.23 C ATOM 288 CG2 VAL A 19 -11.287 -4.739 34.205 1.00 0.24 C ATOM 0 H VAL A 19 -9.425 -5.962 32.324 1.00 0.22 H new ATOM 0 HA VAL A 19 -8.529 -4.002 34.455 1.00 0.21 H new ATOM 0 HB VAL A 19 -10.216 -6.564 34.603 1.00 0.22 H new ATOM 0 HG11 VAL A 19 -10.944 -5.603 36.769 1.00 0.23 H new ATOM 0 HG12 VAL A 19 -9.175 -5.795 36.717 1.00 0.23 H new ATOM 0 HG13 VAL A 19 -9.903 -4.187 36.491 1.00 0.23 H new ATOM 0 HG21 VAL A 19 -12.207 -5.088 34.674 1.00 0.24 H new ATOM 0 HG22 VAL A 19 -11.167 -3.672 34.392 1.00 0.24 H new ATOM 0 HG23 VAL A 19 -11.338 -4.916 33.131 1.00 0.24 H new ATOM 298 N ILE A 20 -6.717 -5.428 35.287 1.00 0.22 N ATOM 299 CA ILE A 20 -5.614 -6.300 35.778 1.00 0.24 C ATOM 300 C ILE A 20 -6.073 -7.045 37.038 1.00 0.24 C ATOM 301 O ILE A 20 -6.648 -6.453 37.924 1.00 0.23 O ATOM 302 CB ILE A 20 -4.471 -5.326 36.093 1.00 0.23 C ATOM 303 CG1 ILE A 20 -3.649 -5.086 34.824 1.00 0.29 C ATOM 304 CG2 ILE A 20 -3.563 -5.904 37.183 1.00 0.24 C ATOM 305 CD1 ILE A 20 -2.867 -6.353 34.474 1.00 1.38 C ATOM 0 H ILE A 20 -6.682 -4.461 35.608 1.00 0.22 H new ATOM 0 HA ILE A 20 -5.309 -7.059 35.058 1.00 0.24 H new ATOM 0 HB ILE A 20 -4.894 -4.386 36.448 1.00 0.23 H new ATOM 0 HG12 ILE A 20 -4.306 -4.812 33.999 1.00 0.29 H new ATOM 0 HG13 ILE A 20 -2.963 -4.253 34.975 1.00 0.29 H new ATOM 0 HG21 ILE A 20 -2.757 -5.202 37.395 1.00 0.24 H new ATOM 0 HG22 ILE A 20 -4.145 -6.074 38.089 1.00 0.24 H new ATOM 0 HG23 ILE A 20 -3.140 -6.849 36.841 1.00 0.24 H new ATOM 0 HD11 ILE A 20 -2.282 -6.182 33.570 1.00 1.38 H new ATOM 0 HD12 ILE A 20 -2.198 -6.607 35.297 1.00 1.38 H new ATOM 0 HD13 ILE A 20 -3.563 -7.175 34.305 1.00 1.38 H new ATOM 317 N PRO A 21 -5.751 -8.308 37.102 1.00 0.28 N ATOM 318 CA PRO A 21 -6.083 -9.112 38.305 1.00 0.30 C ATOM 319 C PRO A 21 -5.428 -8.495 39.543 1.00 0.28 C ATOM 320 O PRO A 21 -4.329 -7.989 39.485 1.00 0.27 O ATOM 321 CB PRO A 21 -5.500 -10.496 38.007 1.00 0.35 C ATOM 322 CG PRO A 21 -4.599 -10.319 36.823 1.00 0.35 C ATOM 323 CD PRO A 21 -5.059 -9.093 36.082 1.00 0.32 C ATOM 0 HA PRO A 21 -7.153 -9.154 38.508 1.00 0.30 H new ATOM 0 HB2 PRO A 21 -4.947 -10.879 38.864 1.00 0.35 H new ATOM 0 HB3 PRO A 21 -6.291 -11.214 37.791 1.00 0.35 H new ATOM 0 HG2 PRO A 21 -3.563 -10.207 37.143 1.00 0.35 H new ATOM 0 HG3 PRO A 21 -4.640 -11.195 36.176 1.00 0.35 H new ATOM 0 HD2 PRO A 21 -4.219 -8.544 35.656 1.00 0.32 H new ATOM 0 HD3 PRO A 21 -5.723 -9.350 35.256 1.00 0.32 H new ATOM 331 N ILE A 22 -6.110 -8.493 40.656 1.00 0.30 N ATOM 332 CA ILE A 22 -5.534 -7.855 41.877 1.00 0.30 C ATOM 333 C ILE A 22 -4.172 -8.464 42.204 1.00 0.32 C ATOM 334 O ILE A 22 -3.287 -7.794 42.697 1.00 0.32 O ATOM 335 CB ILE A 22 -6.543 -8.144 42.990 1.00 0.35 C ATOM 336 CG1 ILE A 22 -6.261 -7.229 44.184 1.00 0.41 C ATOM 337 CG2 ILE A 22 -6.423 -9.604 43.428 1.00 0.42 C ATOM 338 CD1 ILE A 22 -4.888 -7.561 44.771 1.00 1.11 C ATOM 0 H ILE A 22 -7.037 -8.903 40.774 1.00 0.30 H new ATOM 0 HA ILE A 22 -5.372 -6.785 41.746 1.00 0.30 H new ATOM 0 HB ILE A 22 -7.551 -7.960 42.619 1.00 0.35 H new ATOM 0 HG12 ILE A 22 -6.291 -6.185 43.871 1.00 0.41 H new ATOM 0 HG13 ILE A 22 -7.033 -7.356 44.943 1.00 0.41 H new ATOM 0 HG21 ILE A 22 -7.143 -9.806 44.221 1.00 0.42 H new ATOM 0 HG22 ILE A 22 -6.626 -10.256 42.579 1.00 0.42 H new ATOM 0 HG23 ILE A 22 -5.415 -9.791 43.797 1.00 0.42 H new ATOM 0 HD11 ILE A 22 -4.688 -6.909 45.621 1.00 1.11 H new ATOM 0 HD12 ILE A 22 -4.874 -8.600 45.100 1.00 1.11 H new ATOM 0 HD13 ILE A 22 -4.121 -7.411 44.011 1.00 1.11 H new ATOM 350 N GLU A 23 -3.980 -9.716 41.909 1.00 0.36 N ATOM 351 CA GLU A 23 -2.654 -10.337 42.181 1.00 0.40 C ATOM 352 C GLU A 23 -1.561 -9.577 41.424 1.00 0.37 C ATOM 353 O GLU A 23 -0.471 -9.368 41.919 1.00 0.39 O ATOM 354 CB GLU A 23 -2.773 -11.766 41.649 1.00 0.44 C ATOM 355 CG GLU A 23 -3.827 -12.526 42.458 1.00 1.22 C ATOM 356 CD GLU A 23 -3.898 -13.974 41.973 1.00 1.62 C ATOM 357 OE1 GLU A 23 -3.280 -14.272 40.963 1.00 2.37 O ATOM 358 OE2 GLU A 23 -4.568 -14.763 42.620 1.00 2.01 O ATOM 0 H GLU A 23 -4.677 -10.334 41.494 1.00 0.36 H new ATOM 0 HA GLU A 23 -2.391 -10.315 43.239 1.00 0.40 H new ATOM 0 HB2 GLU A 23 -3.050 -11.751 40.595 1.00 0.44 H new ATOM 0 HB3 GLU A 23 -1.810 -12.273 41.719 1.00 0.44 H new ATOM 0 HG2 GLU A 23 -3.576 -12.499 43.518 1.00 1.22 H new ATOM 0 HG3 GLU A 23 -4.800 -12.047 42.348 1.00 1.22 H new ATOM 365 N LEU A 24 -1.875 -9.101 40.251 1.00 0.34 N ATOM 366 CA LEU A 24 -0.893 -8.291 39.478 1.00 0.33 C ATOM 367 C LEU A 24 -0.889 -6.843 39.968 1.00 0.29 C ATOM 368 O LEU A 24 0.131 -6.188 39.968 1.00 0.29 O ATOM 369 CB LEU A 24 -1.363 -8.369 38.026 1.00 0.33 C ATOM 370 CG LEU A 24 -1.259 -9.812 37.532 1.00 0.94 C ATOM 371 CD1 LEU A 24 -1.559 -9.864 36.032 1.00 1.41 C ATOM 372 CD2 LEU A 24 0.157 -10.334 37.784 1.00 1.75 C ATOM 0 H LEU A 24 -2.775 -9.239 39.792 1.00 0.34 H new ATOM 0 HA LEU A 24 0.125 -8.663 39.595 1.00 0.33 H new ATOM 0 HB2 LEU A 24 -2.393 -8.020 37.947 1.00 0.33 H new ATOM 0 HB3 LEU A 24 -0.756 -7.715 37.401 1.00 0.33 H new ATOM 0 HG LEU A 24 -1.979 -10.431 38.068 1.00 0.94 H new ATOM 0 HD11 LEU A 24 -1.484 -10.893 35.682 1.00 1.41 H new ATOM 0 HD12 LEU A 24 -2.567 -9.491 35.849 1.00 1.41 H new ATOM 0 HD13 LEU A 24 -0.840 -9.245 35.495 1.00 1.41 H new ATOM 0 HD21 LEU A 24 0.233 -11.363 37.432 1.00 1.75 H new ATOM 0 HD22 LEU A 24 0.875 -9.713 37.248 1.00 1.75 H new ATOM 0 HD23 LEU A 24 0.373 -10.298 38.852 1.00 1.75 H new ATOM 384 N ARG A 25 -1.994 -6.364 40.473 1.00 0.25 N ATOM 385 CA ARG A 25 -1.991 -4.989 41.050 1.00 0.23 C ATOM 386 C ARG A 25 -0.929 -4.913 42.144 1.00 0.25 C ATOM 387 O ARG A 25 -0.196 -3.950 42.250 1.00 0.25 O ATOM 388 CB ARG A 25 -3.379 -4.781 41.665 1.00 0.22 C ATOM 389 CG ARG A 25 -4.473 -4.935 40.606 1.00 0.21 C ATOM 390 CD ARG A 25 -5.821 -4.542 41.225 1.00 0.22 C ATOM 391 NE ARG A 25 -6.852 -5.169 40.358 1.00 0.23 N ATOM 392 CZ ARG A 25 -8.063 -5.359 40.811 1.00 0.26 C ATOM 393 NH1 ARG A 25 -8.377 -4.992 42.025 1.00 0.30 N ATOM 394 NH2 ARG A 25 -8.962 -5.915 40.048 1.00 0.27 N ATOM 0 H ARG A 25 -2.886 -6.857 40.511 1.00 0.25 H new ATOM 0 HA ARG A 25 -1.773 -4.231 40.298 1.00 0.23 H new ATOM 0 HB2 ARG A 25 -3.538 -5.503 42.466 1.00 0.22 H new ATOM 0 HB3 ARG A 25 -3.438 -3.789 42.113 1.00 0.22 H new ATOM 0 HG2 ARG A 25 -4.255 -4.304 39.744 1.00 0.21 H new ATOM 0 HG3 ARG A 25 -4.508 -5.964 40.247 1.00 0.21 H new ATOM 0 HD2 ARG A 25 -5.901 -4.900 42.252 1.00 0.22 H new ATOM 0 HD3 ARG A 25 -5.939 -3.459 41.255 1.00 0.22 H new ATOM 0 HE ARG A 25 -6.614 -5.452 39.407 1.00 0.23 H new ATOM 0 HH11 ARG A 25 -7.676 -4.555 42.623 1.00 0.30 H new ATOM 0 HH12 ARG A 25 -9.323 -5.142 42.374 1.00 0.30 H new ATOM 0 HH21 ARG A 25 -8.720 -6.201 39.099 1.00 0.27 H new ATOM 0 HH22 ARG A 25 -9.908 -6.064 40.400 1.00 0.27 H new ATOM 408 N ARG A 26 -0.871 -5.910 42.981 1.00 0.29 N ATOM 409 CA ARG A 26 0.114 -5.887 44.102 1.00 0.33 C ATOM 410 C ARG A 26 1.539 -6.099 43.577 1.00 0.35 C ATOM 411 O ARG A 26 2.453 -5.380 43.928 1.00 0.35 O ATOM 412 CB ARG A 26 -0.295 -7.048 45.008 1.00 0.37 C ATOM 413 CG ARG A 26 0.576 -7.047 46.265 1.00 1.07 C ATOM 414 CD ARG A 26 0.203 -8.241 47.147 1.00 1.25 C ATOM 415 NE ARG A 26 1.013 -8.070 48.387 1.00 1.85 N ATOM 416 CZ ARG A 26 1.104 -9.047 49.250 1.00 2.32 C ATOM 417 NH1 ARG A 26 0.486 -10.177 49.032 1.00 2.40 N ATOM 418 NH2 ARG A 26 1.813 -8.892 50.334 1.00 3.26 N ATOM 0 H ARG A 26 -1.462 -6.740 42.939 1.00 0.29 H new ATOM 0 HA ARG A 26 0.112 -4.931 44.626 1.00 0.33 H new ATOM 0 HB2 ARG A 26 -1.346 -6.957 45.281 1.00 0.37 H new ATOM 0 HB3 ARG A 26 -0.185 -7.994 44.477 1.00 0.37 H new ATOM 0 HG2 ARG A 26 1.629 -7.100 45.990 1.00 1.07 H new ATOM 0 HG3 ARG A 26 0.436 -6.117 46.816 1.00 1.07 H new ATOM 0 HD2 ARG A 26 -0.864 -8.249 47.370 1.00 1.25 H new ATOM 0 HD3 ARG A 26 0.433 -9.185 46.652 1.00 1.25 H new ATOM 0 HE ARG A 26 1.497 -7.189 48.562 1.00 1.85 H new ATOM 0 HH11 ARG A 26 -0.070 -10.299 48.186 1.00 2.40 H new ATOM 0 HH12 ARG A 26 0.560 -10.937 49.708 1.00 2.40 H new ATOM 0 HH21 ARG A 26 2.295 -8.010 50.506 1.00 3.26 H new ATOM 0 HH22 ARG A 26 1.886 -9.653 51.009 1.00 3.26 H new ATOM 432 N THR A 27 1.738 -7.100 42.766 1.00 0.37 N ATOM 433 CA THR A 27 3.110 -7.394 42.258 1.00 0.41 C ATOM 434 C THR A 27 3.640 -6.241 41.402 1.00 0.39 C ATOM 435 O THR A 27 4.831 -6.012 41.326 1.00 0.42 O ATOM 436 CB THR A 27 2.957 -8.660 41.414 1.00 0.44 C ATOM 437 OG1 THR A 27 2.351 -9.680 42.195 1.00 0.61 O ATOM 438 CG2 THR A 27 4.333 -9.128 40.937 1.00 0.77 C ATOM 0 H THR A 27 1.009 -7.730 42.431 1.00 0.37 H new ATOM 0 HA THR A 27 3.822 -7.523 43.073 1.00 0.41 H new ATOM 0 HB THR A 27 2.330 -8.445 40.549 1.00 0.44 H new ATOM 0 HG1 THR A 27 1.378 -9.637 42.091 1.00 0.61 H new ATOM 0 HG21 THR A 27 4.222 -10.030 40.336 1.00 0.77 H new ATOM 0 HG22 THR A 27 4.795 -8.345 40.335 1.00 0.77 H new ATOM 0 HG23 THR A 27 4.964 -9.342 41.800 1.00 0.77 H new ATOM 446 N LEU A 28 2.777 -5.541 40.721 1.00 0.35 N ATOM 447 CA LEU A 28 3.253 -4.444 39.829 1.00 0.34 C ATOM 448 C LEU A 28 3.387 -3.132 40.608 1.00 0.32 C ATOM 449 O LEU A 28 3.861 -2.142 40.087 1.00 0.33 O ATOM 450 CB LEU A 28 2.180 -4.325 38.744 1.00 0.32 C ATOM 451 CG LEU A 28 2.671 -3.386 37.642 1.00 0.44 C ATOM 452 CD1 LEU A 28 3.763 -4.084 36.826 1.00 0.70 C ATOM 453 CD2 LEU A 28 1.502 -3.023 36.724 1.00 1.05 C ATOM 0 H LEU A 28 1.767 -5.679 40.742 1.00 0.35 H new ATOM 0 HA LEU A 28 4.237 -4.654 39.410 1.00 0.34 H new ATOM 0 HB2 LEU A 28 1.959 -5.308 38.327 1.00 0.32 H new ATOM 0 HB3 LEU A 28 1.253 -3.945 39.174 1.00 0.32 H new ATOM 0 HG LEU A 28 3.076 -2.479 38.091 1.00 0.44 H new ATOM 0 HD11 LEU A 28 4.114 -3.415 36.040 1.00 0.70 H new ATOM 0 HD12 LEU A 28 4.596 -4.344 37.480 1.00 0.70 H new ATOM 0 HD13 LEU A 28 3.358 -4.991 36.377 1.00 0.70 H new ATOM 0 HD21 LEU A 28 1.851 -2.353 35.938 1.00 1.05 H new ATOM 0 HD22 LEU A 28 1.097 -3.930 36.275 1.00 1.05 H new ATOM 0 HD23 LEU A 28 0.724 -2.527 37.304 1.00 1.05 H new ATOM 465 N GLY A 29 2.998 -3.118 41.853 1.00 0.32 N ATOM 466 CA GLY A 29 3.132 -1.869 42.656 1.00 0.32 C ATOM 467 C GLY A 29 2.205 -0.793 42.094 1.00 0.29 C ATOM 468 O GLY A 29 2.568 0.361 41.990 1.00 0.29 O ATOM 0 H GLY A 29 2.595 -3.914 42.348 1.00 0.32 H new ATOM 0 HA2 GLY A 29 2.884 -2.067 43.699 1.00 0.32 H new ATOM 0 HA3 GLY A 29 4.165 -1.520 42.634 1.00 0.32 H new ATOM 472 N ILE A 30 1.016 -1.164 41.719 1.00 0.27 N ATOM 473 CA ILE A 30 0.067 -0.161 41.148 1.00 0.24 C ATOM 474 C ILE A 30 -1.160 -0.008 42.047 1.00 0.23 C ATOM 475 O ILE A 30 -1.668 -0.964 42.599 1.00 0.26 O ATOM 476 CB ILE A 30 -0.333 -0.712 39.783 1.00 0.26 C ATOM 477 CG1 ILE A 30 0.919 -0.892 38.920 1.00 0.41 C ATOM 478 CG2 ILE A 30 -1.287 0.266 39.095 1.00 0.33 C ATOM 479 CD1 ILE A 30 1.718 0.415 38.903 1.00 0.29 C ATOM 0 H ILE A 30 0.656 -2.116 41.781 1.00 0.27 H new ATOM 0 HA ILE A 30 0.522 0.826 41.068 1.00 0.24 H new ATOM 0 HB ILE A 30 -0.830 -1.674 39.912 1.00 0.26 H new ATOM 0 HG12 ILE A 30 1.533 -1.701 39.315 1.00 0.41 H new ATOM 0 HG13 ILE A 30 0.637 -1.172 37.905 1.00 0.41 H new ATOM 0 HG21 ILE A 30 -1.572 -0.129 38.120 1.00 0.33 H new ATOM 0 HG22 ILE A 30 -2.179 0.397 39.708 1.00 0.33 H new ATOM 0 HG23 ILE A 30 -0.791 1.228 38.966 1.00 0.33 H new ATOM 0 HD11 ILE A 30 2.610 0.288 38.289 1.00 0.29 H new ATOM 0 HD12 ILE A 30 1.102 1.213 38.488 1.00 0.29 H new ATOM 0 HD13 ILE A 30 2.012 0.675 39.920 1.00 0.29 H new ATOM 491 N ALA A 31 -1.610 1.200 42.226 1.00 0.22 N ATOM 492 CA ALA A 31 -2.771 1.452 43.124 1.00 0.23 C ATOM 493 C ALA A 31 -3.671 2.537 42.529 1.00 0.20 C ATOM 494 O ALA A 31 -3.296 3.232 41.606 1.00 0.18 O ATOM 495 CB ALA A 31 -2.157 1.938 44.435 1.00 0.23 C ATOM 0 H ALA A 31 -1.220 2.033 41.785 1.00 0.22 H new ATOM 0 HA ALA A 31 -3.386 0.563 43.262 1.00 0.23 H new ATOM 0 HB1 ALA A 31 -2.950 2.146 45.153 1.00 0.23 H new ATOM 0 HB2 ALA A 31 -1.498 1.168 44.836 1.00 0.23 H new ATOM 0 HB3 ALA A 31 -1.584 2.847 44.253 1.00 0.23 H new ATOM 501 N GLU A 32 -4.858 2.686 43.046 1.00 0.22 N ATOM 502 CA GLU A 32 -5.780 3.723 42.502 1.00 0.21 C ATOM 503 C GLU A 32 -5.097 5.096 42.484 1.00 0.19 C ATOM 504 O GLU A 32 -4.325 5.426 43.361 1.00 0.20 O ATOM 505 CB GLU A 32 -6.970 3.734 43.463 1.00 0.25 C ATOM 506 CG GLU A 32 -8.052 4.671 42.927 1.00 0.27 C ATOM 507 CD GLU A 32 -9.196 4.764 43.939 1.00 0.32 C ATOM 508 OE1 GLU A 32 -9.093 4.132 44.978 1.00 1.13 O ATOM 509 OE2 GLU A 32 -10.154 5.465 43.658 1.00 1.12 O ATOM 0 H GLU A 32 -5.230 2.136 43.820 1.00 0.22 H new ATOM 0 HA GLU A 32 -6.079 3.507 41.476 1.00 0.21 H new ATOM 0 HB2 GLU A 32 -7.370 2.726 43.574 1.00 0.25 H new ATOM 0 HB3 GLU A 32 -6.649 4.061 44.452 1.00 0.25 H new ATOM 0 HG2 GLU A 32 -7.633 5.660 42.744 1.00 0.27 H new ATOM 0 HG3 GLU A 32 -8.427 4.302 41.972 1.00 0.27 H new ATOM 516 N LYS A 33 -5.421 5.908 41.510 1.00 0.19 N ATOM 517 CA LYS A 33 -4.857 7.295 41.432 1.00 0.20 C ATOM 518 C LYS A 33 -3.394 7.271 40.970 1.00 0.18 C ATOM 519 O LYS A 33 -2.820 8.299 40.670 1.00 0.21 O ATOM 520 CB LYS A 33 -4.960 7.867 42.849 1.00 0.23 C ATOM 521 CG LYS A 33 -4.824 9.390 42.793 1.00 0.29 C ATOM 522 CD LYS A 33 -6.112 9.998 42.235 1.00 0.87 C ATOM 523 CE LYS A 33 -5.997 11.524 42.231 1.00 1.35 C ATOM 524 NZ LYS A 33 -7.355 12.012 42.596 1.00 1.88 N ATOM 0 H LYS A 33 -6.061 5.667 40.754 1.00 0.19 H new ATOM 0 HA LYS A 33 -5.402 7.902 40.709 1.00 0.20 H new ATOM 0 HB2 LYS A 33 -5.916 7.592 43.295 1.00 0.23 H new ATOM 0 HB3 LYS A 33 -4.179 7.444 43.481 1.00 0.23 H new ATOM 0 HG2 LYS A 33 -4.625 9.785 43.789 1.00 0.29 H new ATOM 0 HG3 LYS A 33 -3.977 9.667 42.165 1.00 0.29 H new ATOM 0 HD2 LYS A 33 -6.290 9.634 41.223 1.00 0.87 H new ATOM 0 HD3 LYS A 33 -6.964 9.689 42.840 1.00 0.87 H new ATOM 0 HE2 LYS A 33 -5.249 11.866 42.947 1.00 1.35 H new ATOM 0 HE3 LYS A 33 -5.694 11.895 41.252 1.00 1.35 H new ATOM 0 HZ1 LYS A 33 -7.357 13.052 42.614 1.00 1.88 H new ATOM 0 HZ2 LYS A 33 -8.045 11.677 41.894 1.00 1.88 H new ATOM 0 HZ3 LYS A 33 -7.614 11.649 43.536 1.00 1.88 H new ATOM 538 N ASP A 34 -2.818 6.110 40.803 1.00 0.16 N ATOM 539 CA ASP A 34 -1.438 6.047 40.241 1.00 0.16 C ATOM 540 C ASP A 34 -1.479 6.260 38.726 1.00 0.19 C ATOM 541 O ASP A 34 -2.534 6.272 38.124 1.00 0.20 O ATOM 542 CB ASP A 34 -0.929 4.650 40.578 1.00 0.17 C ATOM 543 CG ASP A 34 -0.599 4.580 42.068 1.00 0.18 C ATOM 544 OD1 ASP A 34 -0.648 5.612 42.717 1.00 1.10 O ATOM 545 OD2 ASP A 34 -0.302 3.495 42.534 1.00 1.08 O ATOM 0 H ASP A 34 -3.240 5.209 41.030 1.00 0.16 H new ATOM 0 HA ASP A 34 -0.788 6.819 40.653 1.00 0.16 H new ATOM 0 HB2 ASP A 34 -1.683 3.905 40.325 1.00 0.17 H new ATOM 0 HB3 ASP A 34 -0.043 4.420 39.986 1.00 0.17 H new ATOM 550 N ALA A 35 -0.349 6.498 38.117 1.00 0.22 N ATOM 551 CA ALA A 35 -0.344 6.791 36.655 1.00 0.28 C ATOM 552 C ALA A 35 0.178 5.588 35.862 1.00 0.20 C ATOM 553 O ALA A 35 1.236 5.060 36.139 1.00 0.16 O ATOM 554 CB ALA A 35 0.598 7.987 36.499 1.00 0.36 C ATOM 0 H ALA A 35 0.567 6.502 38.566 1.00 0.22 H new ATOM 0 HA ALA A 35 -1.344 7.001 36.276 1.00 0.28 H new ATOM 0 HB1 ALA A 35 0.658 8.268 35.448 1.00 0.36 H new ATOM 0 HB2 ALA A 35 0.217 8.828 37.078 1.00 0.36 H new ATOM 0 HB3 ALA A 35 1.591 7.718 36.860 1.00 0.36 H new ATOM 560 N LEU A 36 -0.522 5.208 34.828 1.00 0.24 N ATOM 561 CA LEU A 36 -0.034 4.103 33.951 1.00 0.21 C ATOM 562 C LEU A 36 0.407 4.677 32.603 1.00 0.20 C ATOM 563 O LEU A 36 -0.283 5.490 32.023 1.00 0.23 O ATOM 564 CB LEU A 36 -1.244 3.192 33.749 1.00 0.34 C ATOM 565 CG LEU A 36 -1.899 2.887 35.094 1.00 0.45 C ATOM 566 CD1 LEU A 36 -3.310 2.351 34.850 1.00 0.55 C ATOM 567 CD2 LEU A 36 -1.075 1.833 35.837 1.00 0.56 C ATOM 0 H LEU A 36 -1.415 5.616 34.551 1.00 0.24 H new ATOM 0 HA LEU A 36 0.814 3.573 34.385 1.00 0.21 H new ATOM 0 HB2 LEU A 36 -1.964 3.671 33.085 1.00 0.34 H new ATOM 0 HB3 LEU A 36 -0.935 2.264 33.267 1.00 0.34 H new ATOM 0 HG LEU A 36 -1.947 3.795 35.695 1.00 0.45 H new ATOM 0 HD11 LEU A 36 -3.786 2.130 35.806 1.00 0.55 H new ATOM 0 HD12 LEU A 36 -3.896 3.099 34.317 1.00 0.55 H new ATOM 0 HD13 LEU A 36 -3.255 1.441 34.253 1.00 0.55 H new ATOM 0 HD21 LEU A 36 -1.543 1.616 36.797 1.00 0.56 H new ATOM 0 HD22 LEU A 36 -1.028 0.921 35.241 1.00 0.56 H new ATOM 0 HD23 LEU A 36 -0.066 2.210 36.002 1.00 0.56 H new ATOM 579 N GLU A 37 1.461 4.164 32.031 1.00 0.19 N ATOM 580 CA GLU A 37 1.822 4.593 30.652 1.00 0.21 C ATOM 581 C GLU A 37 1.536 3.460 29.666 1.00 0.19 C ATOM 582 O GLU A 37 1.667 2.295 29.988 1.00 0.20 O ATOM 583 CB GLU A 37 3.317 4.912 30.700 1.00 0.25 C ATOM 584 CG GLU A 37 3.763 5.476 29.349 1.00 0.26 C ATOM 585 CD GLU A 37 5.274 5.707 29.367 1.00 0.37 C ATOM 586 OE1 GLU A 37 5.888 5.408 30.377 1.00 1.17 O ATOM 587 OE2 GLU A 37 5.793 6.182 28.368 1.00 1.08 O ATOM 0 H GLU A 37 2.082 3.474 32.454 1.00 0.19 H new ATOM 0 HA GLU A 37 1.245 5.457 30.323 1.00 0.21 H new ATOM 0 HB2 GLU A 37 3.520 5.633 31.492 1.00 0.25 H new ATOM 0 HB3 GLU A 37 3.884 4.011 30.935 1.00 0.25 H new ATOM 0 HG2 GLU A 37 3.500 4.784 28.549 1.00 0.26 H new ATOM 0 HG3 GLU A 37 3.244 6.412 29.144 1.00 0.26 H new ATOM 594 N ILE A 38 1.021 3.791 28.517 1.00 0.21 N ATOM 595 CA ILE A 38 0.574 2.740 27.561 1.00 0.20 C ATOM 596 C ILE A 38 1.473 2.722 26.324 1.00 0.20 C ATOM 597 O ILE A 38 1.799 3.752 25.760 1.00 0.24 O ATOM 598 CB ILE A 38 -0.853 3.133 27.180 1.00 0.26 C ATOM 599 CG1 ILE A 38 -1.691 3.311 28.449 1.00 0.80 C ATOM 600 CG2 ILE A 38 -1.471 2.035 26.312 1.00 0.73 C ATOM 601 CD1 ILE A 38 -1.474 2.116 29.378 1.00 0.84 C ATOM 0 H ILE A 38 0.889 4.750 28.196 1.00 0.21 H new ATOM 0 HA ILE A 38 0.622 1.742 27.998 1.00 0.20 H new ATOM 0 HB ILE A 38 -0.834 4.070 26.623 1.00 0.26 H new ATOM 0 HG12 ILE A 38 -1.410 4.234 28.956 1.00 0.80 H new ATOM 0 HG13 ILE A 38 -2.747 3.397 28.191 1.00 0.80 H new ATOM 0 HG21 ILE A 38 -2.489 2.315 26.040 1.00 0.73 H new ATOM 0 HG22 ILE A 38 -0.876 1.908 25.408 1.00 0.73 H new ATOM 0 HG23 ILE A 38 -1.489 1.098 26.869 1.00 0.73 H new ATOM 0 HD11 ILE A 38 -2.071 2.244 30.281 1.00 0.84 H new ATOM 0 HD12 ILE A 38 -1.776 1.200 28.870 1.00 0.84 H new ATOM 0 HD13 ILE A 38 -0.420 2.051 29.646 1.00 0.84 H new ATOM 613 N TYR A 39 1.881 1.551 25.920 1.00 0.19 N ATOM 614 CA TYR A 39 2.778 1.407 24.739 1.00 0.21 C ATOM 615 C TYR A 39 2.056 0.652 23.621 1.00 0.20 C ATOM 616 O TYR A 39 1.146 -0.112 23.870 1.00 0.20 O ATOM 617 CB TYR A 39 3.942 0.567 25.251 1.00 0.24 C ATOM 618 CG TYR A 39 4.903 1.422 26.028 1.00 0.28 C ATOM 619 CD1 TYR A 39 4.465 2.131 27.150 1.00 0.32 C ATOM 620 CD2 TYR A 39 6.236 1.489 25.632 1.00 0.31 C ATOM 621 CE1 TYR A 39 5.368 2.913 27.879 1.00 0.37 C ATOM 622 CE2 TYR A 39 7.143 2.270 26.356 1.00 0.36 C ATOM 623 CZ TYR A 39 6.709 2.982 27.482 1.00 0.39 C ATOM 624 OH TYR A 39 7.603 3.754 28.198 1.00 0.45 O ATOM 0 H TYR A 39 1.625 0.671 26.368 1.00 0.19 H new ATOM 0 HA TYR A 39 3.093 2.369 24.335 1.00 0.21 H new ATOM 0 HB2 TYR A 39 3.567 -0.238 25.884 1.00 0.24 H new ATOM 0 HB3 TYR A 39 4.458 0.099 24.412 1.00 0.24 H new ATOM 0 HD1 TYR A 39 3.430 2.075 27.454 1.00 0.32 H new ATOM 0 HD2 TYR A 39 6.570 0.938 24.765 1.00 0.31 H new ATOM 0 HE1 TYR A 39 5.031 3.462 28.746 1.00 0.37 H new ATOM 0 HE2 TYR A 39 8.177 2.324 26.047 1.00 0.36 H new ATOM 0 HH TYR A 39 8.491 3.690 27.789 1.00 0.45 H new ATOM 634 N VAL A 40 2.541 0.746 22.414 1.00 0.21 N ATOM 635 CA VAL A 40 1.963 -0.095 21.325 1.00 0.22 C ATOM 636 C VAL A 40 3.069 -0.759 20.502 1.00 0.22 C ATOM 637 O VAL A 40 3.879 -0.098 19.883 1.00 0.23 O ATOM 638 CB VAL A 40 1.163 0.874 20.456 1.00 0.25 C ATOM 639 CG1 VAL A 40 0.584 0.122 19.256 1.00 0.27 C ATOM 640 CG2 VAL A 40 0.020 1.469 21.283 1.00 0.27 C ATOM 0 H VAL A 40 3.305 1.362 22.135 1.00 0.21 H new ATOM 0 HA VAL A 40 1.345 -0.900 21.722 1.00 0.22 H new ATOM 0 HB VAL A 40 1.815 1.673 20.104 1.00 0.25 H new ATOM 0 HG11 VAL A 40 0.013 0.812 18.635 1.00 0.27 H new ATOM 0 HG12 VAL A 40 1.396 -0.307 18.669 1.00 0.27 H new ATOM 0 HG13 VAL A 40 -0.070 -0.676 19.608 1.00 0.27 H new ATOM 0 HG21 VAL A 40 -0.553 2.161 20.666 1.00 0.27 H new ATOM 0 HG22 VAL A 40 -0.632 0.668 21.632 1.00 0.27 H new ATOM 0 HG23 VAL A 40 0.431 2.002 22.141 1.00 0.27 H new ATOM 650 N ASP A 41 3.066 -2.063 20.435 1.00 0.21 N ATOM 651 CA ASP A 41 4.065 -2.771 19.584 1.00 0.22 C ATOM 652 C ASP A 41 3.454 -4.054 19.010 1.00 0.25 C ATOM 653 O ASP A 41 2.652 -4.699 19.647 1.00 0.27 O ATOM 654 CB ASP A 41 5.229 -3.099 20.521 1.00 0.20 C ATOM 655 CG ASP A 41 4.854 -4.282 21.415 1.00 1.01 C ATOM 656 OD1 ASP A 41 3.708 -4.347 21.829 1.00 1.69 O ATOM 657 OD2 ASP A 41 5.719 -5.103 21.672 1.00 1.77 O ATOM 0 H ASP A 41 2.414 -2.669 20.933 1.00 0.21 H new ATOM 0 HA ASP A 41 4.388 -2.166 18.736 1.00 0.22 H new ATOM 0 HB2 ASP A 41 6.120 -3.338 19.940 1.00 0.20 H new ATOM 0 HB3 ASP A 41 5.471 -2.230 21.133 1.00 0.20 H new ATOM 662 N ASP A 42 3.923 -4.493 17.876 1.00 0.27 N ATOM 663 CA ASP A 42 3.474 -5.812 17.339 1.00 0.33 C ATOM 664 C ASP A 42 1.957 -5.993 17.499 1.00 0.33 C ATOM 665 O ASP A 42 1.487 -7.061 17.836 1.00 0.37 O ATOM 666 CB ASP A 42 4.228 -6.844 18.173 1.00 0.38 C ATOM 667 CG ASP A 42 3.813 -8.253 17.743 1.00 0.45 C ATOM 668 OD1 ASP A 42 3.099 -8.365 16.760 1.00 1.14 O ATOM 669 OD2 ASP A 42 4.218 -9.197 18.403 1.00 1.22 O ATOM 0 H ASP A 42 4.599 -3.996 17.295 1.00 0.27 H new ATOM 0 HA ASP A 42 3.678 -5.906 16.272 1.00 0.33 H new ATOM 0 HB2 ASP A 42 5.303 -6.715 18.045 1.00 0.38 H new ATOM 0 HB3 ASP A 42 4.014 -6.698 19.232 1.00 0.38 H new ATOM 674 N GLU A 43 1.186 -4.992 17.171 1.00 0.30 N ATOM 675 CA GLU A 43 -0.300 -5.149 17.205 1.00 0.31 C ATOM 676 C GLU A 43 -0.763 -5.579 18.599 1.00 0.30 C ATOM 677 O GLU A 43 -1.892 -5.988 18.791 1.00 0.31 O ATOM 678 CB GLU A 43 -0.608 -6.239 16.178 1.00 0.35 C ATOM 679 CG GLU A 43 -0.161 -5.774 14.790 1.00 1.17 C ATOM 680 CD GLU A 43 -0.536 -6.833 13.751 1.00 1.34 C ATOM 681 OE1 GLU A 43 -0.949 -7.909 14.153 1.00 1.68 O ATOM 682 OE2 GLU A 43 -0.404 -6.550 12.572 1.00 1.93 O ATOM 0 H GLU A 43 1.519 -4.072 16.881 1.00 0.30 H new ATOM 0 HA GLU A 43 -0.815 -4.216 16.978 1.00 0.31 H new ATOM 0 HB2 GLU A 43 -0.095 -7.162 16.447 1.00 0.35 H new ATOM 0 HB3 GLU A 43 -1.676 -6.458 16.173 1.00 0.35 H new ATOM 0 HG2 GLU A 43 -0.634 -4.824 14.543 1.00 1.17 H new ATOM 0 HG3 GLU A 43 0.916 -5.606 14.781 1.00 1.17 H new ATOM 689 N LYS A 44 0.072 -5.417 19.583 1.00 0.29 N ATOM 690 CA LYS A 44 -0.343 -5.733 20.980 1.00 0.30 C ATOM 691 C LYS A 44 -0.010 -4.557 21.900 1.00 0.27 C ATOM 692 O LYS A 44 0.728 -3.664 21.536 1.00 0.26 O ATOM 693 CB LYS A 44 0.462 -6.975 21.369 1.00 0.34 C ATOM 694 CG LYS A 44 1.935 -6.766 21.015 1.00 1.29 C ATOM 695 CD LYS A 44 2.752 -7.963 21.504 1.00 1.23 C ATOM 696 CE LYS A 44 2.413 -9.193 20.659 1.00 1.90 C ATOM 697 NZ LYS A 44 3.525 -10.153 20.913 1.00 2.01 N ATOM 0 H LYS A 44 1.029 -5.078 19.482 1.00 0.29 H new ATOM 0 HA LYS A 44 -1.415 -5.910 21.065 1.00 0.30 H new ATOM 0 HB2 LYS A 44 0.358 -7.168 22.437 1.00 0.34 H new ATOM 0 HB3 LYS A 44 0.073 -7.850 20.848 1.00 0.34 H new ATOM 0 HG2 LYS A 44 2.048 -6.651 19.937 1.00 1.29 H new ATOM 0 HG3 LYS A 44 2.304 -5.849 21.474 1.00 1.29 H new ATOM 0 HD2 LYS A 44 3.817 -7.743 21.433 1.00 1.23 H new ATOM 0 HD3 LYS A 44 2.536 -8.159 22.554 1.00 1.23 H new ATOM 0 HE2 LYS A 44 1.451 -9.617 20.948 1.00 1.90 H new ATOM 0 HE3 LYS A 44 2.345 -8.939 19.601 1.00 1.90 H new ATOM 0 HZ1 LYS A 44 3.137 -11.111 21.026 1.00 2.01 H new ATOM 0 HZ2 LYS A 44 4.185 -10.140 20.110 1.00 2.01 H new ATOM 0 HZ3 LYS A 44 4.029 -9.879 21.780 1.00 2.01 H new ATOM 711 N ILE A 45 -0.648 -4.480 23.035 1.00 0.28 N ATOM 712 CA ILE A 45 -0.474 -3.280 23.904 1.00 0.27 C ATOM 713 C ILE A 45 0.432 -3.605 25.098 1.00 0.27 C ATOM 714 O ILE A 45 0.229 -4.580 25.791 1.00 0.29 O ATOM 715 CB ILE A 45 -1.884 -2.949 24.388 1.00 0.30 C ATOM 716 CG1 ILE A 45 -2.808 -2.778 23.181 1.00 0.34 C ATOM 717 CG2 ILE A 45 -1.856 -1.648 25.194 1.00 0.29 C ATOM 718 CD1 ILE A 45 -4.263 -2.779 23.649 1.00 1.25 C ATOM 0 H ILE A 45 -1.280 -5.193 23.398 1.00 0.28 H new ATOM 0 HA ILE A 45 -0.008 -2.451 23.372 1.00 0.27 H new ATOM 0 HB ILE A 45 -2.251 -3.759 25.018 1.00 0.30 H new ATOM 0 HG12 ILE A 45 -2.581 -1.845 22.665 1.00 0.34 H new ATOM 0 HG13 ILE A 45 -2.644 -3.585 22.467 1.00 0.34 H new ATOM 0 HG21 ILE A 45 -2.863 -1.412 25.539 1.00 0.29 H new ATOM 0 HG22 ILE A 45 -1.196 -1.767 26.053 1.00 0.29 H new ATOM 0 HG23 ILE A 45 -1.489 -0.838 24.564 1.00 0.29 H new ATOM 0 HD11 ILE A 45 -4.922 -2.657 22.789 1.00 1.25 H new ATOM 0 HD12 ILE A 45 -4.485 -3.724 24.145 1.00 1.25 H new ATOM 0 HD13 ILE A 45 -4.421 -1.957 24.347 1.00 1.25 H new ATOM 730 N ILE A 46 1.382 -2.755 25.378 1.00 0.26 N ATOM 731 CA ILE A 46 2.251 -2.965 26.573 1.00 0.29 C ATOM 732 C ILE A 46 1.982 -1.882 27.622 1.00 0.29 C ATOM 733 O ILE A 46 2.165 -0.710 27.376 1.00 0.31 O ATOM 734 CB ILE A 46 3.679 -2.851 26.039 1.00 0.32 C ATOM 735 CG1 ILE A 46 3.985 -4.060 25.155 1.00 0.44 C ATOM 736 CG2 ILE A 46 4.671 -2.798 27.203 1.00 0.37 C ATOM 737 CD1 ILE A 46 5.067 -3.681 24.149 1.00 0.50 C ATOM 0 H ILE A 46 1.595 -1.922 24.830 1.00 0.26 H new ATOM 0 HA ILE A 46 2.068 -3.924 27.057 1.00 0.29 H new ATOM 0 HB ILE A 46 3.773 -1.936 25.454 1.00 0.32 H new ATOM 0 HG12 ILE A 46 4.317 -4.899 25.767 1.00 0.44 H new ATOM 0 HG13 ILE A 46 3.084 -4.383 24.634 1.00 0.44 H new ATOM 0 HG21 ILE A 46 5.686 -2.717 26.813 1.00 0.37 H new ATOM 0 HG22 ILE A 46 4.452 -1.932 27.828 1.00 0.37 H new ATOM 0 HG23 ILE A 46 4.583 -3.707 27.798 1.00 0.37 H new ATOM 0 HD11 ILE A 46 5.291 -4.539 23.515 1.00 0.50 H new ATOM 0 HD12 ILE A 46 4.716 -2.855 23.531 1.00 0.50 H new ATOM 0 HD13 ILE A 46 5.969 -3.378 24.681 1.00 0.50 H new ATOM 749 N LEU A 47 1.575 -2.268 28.800 1.00 0.28 N ATOM 750 CA LEU A 47 1.330 -1.258 29.870 1.00 0.29 C ATOM 751 C LEU A 47 2.400 -1.376 30.956 1.00 0.31 C ATOM 752 O LEU A 47 2.748 -2.458 31.383 1.00 0.39 O ATOM 753 CB LEU A 47 -0.042 -1.598 30.444 1.00 0.34 C ATOM 754 CG LEU A 47 -1.098 -1.528 29.338 1.00 0.90 C ATOM 755 CD1 LEU A 47 -1.016 -2.782 28.466 1.00 1.66 C ATOM 756 CD2 LEU A 47 -2.489 -1.441 29.971 1.00 1.24 C ATOM 0 H LEU A 47 1.402 -3.237 29.068 1.00 0.28 H new ATOM 0 HA LEU A 47 1.367 -0.239 29.485 1.00 0.29 H new ATOM 0 HB2 LEU A 47 -0.026 -2.596 30.882 1.00 0.34 H new ATOM 0 HB3 LEU A 47 -0.294 -0.903 31.245 1.00 0.34 H new ATOM 0 HG LEU A 47 -0.918 -0.647 28.722 1.00 0.90 H new ATOM 0 HD11 LEU A 47 -1.769 -2.728 27.680 1.00 1.66 H new ATOM 0 HD12 LEU A 47 -0.026 -2.848 28.016 1.00 1.66 H new ATOM 0 HD13 LEU A 47 -1.195 -3.665 29.080 1.00 1.66 H new ATOM 0 HD21 LEU A 47 -3.244 -1.391 29.186 1.00 1.24 H new ATOM 0 HD22 LEU A 47 -2.664 -2.323 30.587 1.00 1.24 H new ATOM 0 HD23 LEU A 47 -2.551 -0.547 30.591 1.00 1.24 H new ATOM 768 N LYS A 48 2.927 -0.270 31.396 1.00 0.29 N ATOM 769 CA LYS A 48 3.986 -0.310 32.446 1.00 0.35 C ATOM 770 C LYS A 48 3.792 0.838 33.440 1.00 0.28 C ATOM 771 O LYS A 48 3.125 1.811 33.152 1.00 0.25 O ATOM 772 CB LYS A 48 5.303 -0.143 31.687 1.00 0.47 C ATOM 773 CG LYS A 48 5.295 1.184 30.925 1.00 0.65 C ATOM 774 CD LYS A 48 6.608 1.339 30.157 1.00 0.85 C ATOM 775 CE LYS A 48 6.664 0.305 29.030 1.00 1.54 C ATOM 776 NZ LYS A 48 7.580 -0.758 29.527 1.00 1.74 N ATOM 0 H LYS A 48 2.671 0.664 31.075 1.00 0.29 H new ATOM 0 HA LYS A 48 3.960 -1.235 33.021 1.00 0.35 H new ATOM 0 HB2 LYS A 48 6.141 -0.168 32.384 1.00 0.47 H new ATOM 0 HB3 LYS A 48 5.441 -0.971 30.992 1.00 0.47 H new ATOM 0 HG2 LYS A 48 4.452 1.214 30.235 1.00 0.65 H new ATOM 0 HG3 LYS A 48 5.168 2.014 31.620 1.00 0.65 H new ATOM 0 HD2 LYS A 48 6.685 2.346 29.746 1.00 0.85 H new ATOM 0 HD3 LYS A 48 7.454 1.205 30.831 1.00 0.85 H new ATOM 0 HE2 LYS A 48 5.674 -0.097 28.813 1.00 1.54 H new ATOM 0 HE3 LYS A 48 7.037 0.748 28.107 1.00 1.54 H new ATOM 0 HZ1 LYS A 48 7.274 -1.681 29.158 1.00 1.74 H new ATOM 0 HZ2 LYS A 48 8.549 -0.560 29.204 1.00 1.74 H new ATOM 0 HZ3 LYS A 48 7.558 -0.777 30.567 1.00 1.74 H new ATOM 790 N LYS A 49 4.404 0.755 34.589 1.00 0.28 N ATOM 791 CA LYS A 49 4.289 1.872 35.571 1.00 0.25 C ATOM 792 C LYS A 49 4.786 3.173 34.944 1.00 0.22 C ATOM 793 O LYS A 49 5.646 3.174 34.087 1.00 0.24 O ATOM 794 CB LYS A 49 5.180 1.470 36.743 1.00 0.29 C ATOM 795 CG LYS A 49 5.070 2.517 37.854 1.00 0.30 C ATOM 796 CD LYS A 49 6.013 2.148 39.000 1.00 0.54 C ATOM 797 CE LYS A 49 5.795 3.109 40.171 1.00 1.08 C ATOM 798 NZ LYS A 49 5.134 2.289 41.224 1.00 1.65 N ATOM 0 H LYS A 49 4.976 -0.034 34.890 1.00 0.28 H new ATOM 0 HA LYS A 49 3.259 2.040 35.885 1.00 0.25 H new ATOM 0 HB2 LYS A 49 4.882 0.492 37.121 1.00 0.29 H new ATOM 0 HB3 LYS A 49 6.215 1.383 36.413 1.00 0.29 H new ATOM 0 HG2 LYS A 49 5.323 3.503 37.465 1.00 0.30 H new ATOM 0 HG3 LYS A 49 4.044 2.571 38.217 1.00 0.30 H new ATOM 0 HD2 LYS A 49 5.830 1.122 39.319 1.00 0.54 H new ATOM 0 HD3 LYS A 49 7.048 2.198 38.663 1.00 0.54 H new ATOM 0 HE2 LYS A 49 6.740 3.520 40.526 1.00 1.08 H new ATOM 0 HE3 LYS A 49 5.171 3.953 39.878 1.00 1.08 H new ATOM 0 HZ1 LYS A 49 4.952 2.880 42.060 1.00 1.65 H new ATOM 0 HZ2 LYS A 49 4.234 1.917 40.860 1.00 1.65 H new ATOM 0 HZ3 LYS A 49 5.754 1.497 41.488 1.00 1.65 H new ATOM 812 N TYR A 50 4.196 4.273 35.311 1.00 0.20 N ATOM 813 CA TYR A 50 4.576 5.566 34.672 1.00 0.21 C ATOM 814 C TYR A 50 5.413 6.416 35.630 1.00 0.22 C ATOM 815 O TYR A 50 4.932 6.880 36.645 1.00 0.22 O ATOM 816 CB TYR A 50 3.249 6.258 34.368 1.00 0.20 C ATOM 817 CG TYR A 50 3.511 7.583 33.694 1.00 0.23 C ATOM 818 CD1 TYR A 50 4.602 7.725 32.829 1.00 0.26 C ATOM 819 CD2 TYR A 50 2.666 8.670 33.938 1.00 0.24 C ATOM 820 CE1 TYR A 50 4.846 8.955 32.208 1.00 0.30 C ATOM 821 CE2 TYR A 50 2.910 9.900 33.319 1.00 0.28 C ATOM 822 CZ TYR A 50 4.000 10.044 32.453 1.00 0.30 C ATOM 823 OH TYR A 50 4.242 11.257 31.841 1.00 0.35 O ATOM 0 H TYR A 50 3.469 4.336 36.023 1.00 0.20 H new ATOM 0 HA TYR A 50 5.180 5.418 33.777 1.00 0.21 H new ATOM 0 HB2 TYR A 50 2.637 5.626 33.724 1.00 0.20 H new ATOM 0 HB3 TYR A 50 2.688 6.412 35.290 1.00 0.20 H new ATOM 0 HD1 TYR A 50 5.255 6.886 32.641 1.00 0.26 H new ATOM 0 HD2 TYR A 50 1.824 8.560 34.605 1.00 0.24 H new ATOM 0 HE1 TYR A 50 5.687 9.065 31.539 1.00 0.30 H new ATOM 0 HE2 TYR A 50 2.257 10.739 33.509 1.00 0.28 H new ATOM 0 HH TYR A 50 3.561 11.905 32.118 1.00 0.35 H new ATOM 833 N LYS A 51 6.615 6.741 35.240 1.00 0.25 N ATOM 834 CA LYS A 51 7.421 7.702 36.042 1.00 0.29 C ATOM 835 C LYS A 51 7.342 9.091 35.404 1.00 0.32 C ATOM 836 O LYS A 51 7.664 9.257 34.245 1.00 0.35 O ATOM 837 CB LYS A 51 8.852 7.165 35.988 1.00 0.33 C ATOM 838 CG LYS A 51 9.322 7.107 34.533 1.00 1.43 C ATOM 839 CD LYS A 51 10.465 8.102 34.325 1.00 1.91 C ATOM 840 CE LYS A 51 11.212 7.760 33.035 1.00 2.76 C ATOM 841 NZ LYS A 51 11.671 9.072 32.497 1.00 3.21 N ATOM 0 H LYS A 51 7.073 6.383 34.402 1.00 0.25 H new ATOM 0 HA LYS A 51 7.066 7.794 37.068 1.00 0.29 H new ATOM 0 HB2 LYS A 51 9.514 7.806 36.570 1.00 0.33 H new ATOM 0 HB3 LYS A 51 8.896 6.172 36.435 1.00 0.33 H new ATOM 0 HG2 LYS A 51 9.655 6.098 34.287 1.00 1.43 H new ATOM 0 HG3 LYS A 51 8.495 7.342 33.863 1.00 1.43 H new ATOM 0 HD2 LYS A 51 10.072 9.117 34.272 1.00 1.91 H new ATOM 0 HD3 LYS A 51 11.149 8.069 35.173 1.00 1.91 H new ATOM 0 HE2 LYS A 51 12.055 7.097 33.231 1.00 2.76 H new ATOM 0 HE3 LYS A 51 10.561 7.248 32.326 1.00 2.76 H new ATOM 0 HZ1 LYS A 51 12.193 8.920 31.610 1.00 3.21 H new ATOM 0 HZ2 LYS A 51 10.847 9.680 32.314 1.00 3.21 H new ATOM 0 HZ3 LYS A 51 12.294 9.533 33.191 1.00 3.21 H new ATOM 855 N PRO A 52 6.894 10.043 36.175 1.00 0.33 N ATOM 856 CA PRO A 52 6.748 11.425 35.659 1.00 0.39 C ATOM 857 C PRO A 52 8.120 12.009 35.309 1.00 0.46 C ATOM 858 O PRO A 52 9.112 11.715 35.946 1.00 0.48 O ATOM 859 CB PRO A 52 6.110 12.192 36.818 1.00 0.41 C ATOM 860 CG PRO A 52 6.345 11.352 38.036 1.00 0.40 C ATOM 861 CD PRO A 52 6.486 9.925 37.577 1.00 0.33 C ATOM 0 HA PRO A 52 6.150 11.476 34.749 1.00 0.39 H new ATOM 0 HB2 PRO A 52 6.560 13.179 36.930 1.00 0.41 H new ATOM 0 HB3 PRO A 52 5.044 12.345 36.647 1.00 0.41 H new ATOM 0 HG2 PRO A 52 7.244 11.678 38.559 1.00 0.40 H new ATOM 0 HG3 PRO A 52 5.515 11.450 38.736 1.00 0.40 H new ATOM 0 HD2 PRO A 52 7.230 9.388 38.165 1.00 0.33 H new ATOM 0 HD3 PRO A 52 5.547 9.379 37.675 1.00 0.33 H new ATOM 869 N ASN A 53 8.184 12.837 34.301 1.00 0.61 N ATOM 870 CA ASN A 53 9.491 13.440 33.914 1.00 0.71 C ATOM 871 C ASN A 53 10.113 14.167 35.110 1.00 1.19 C ATOM 872 O ASN A 53 11.203 13.787 35.507 1.00 1.61 O ATOM 873 CB ASN A 53 9.155 14.432 32.800 1.00 1.36 C ATOM 874 CG ASN A 53 8.600 13.674 31.592 1.00 1.76 C ATOM 875 OD1 ASN A 53 8.770 12.475 31.482 1.00 2.14 O ATOM 876 ND2 ASN A 53 7.940 14.327 30.675 1.00 2.41 N ATOM 877 OXT ASN A 53 9.489 15.090 35.608 1.00 1.98 O ATOM 0 H ASN A 53 7.388 13.121 33.730 1.00 0.61 H new ATOM 0 HA ASN A 53 10.212 12.690 33.588 1.00 0.71 H new ATOM 0 HB2 ASN A 53 8.424 15.159 33.154 1.00 1.36 H new ATOM 0 HB3 ASN A 53 10.047 14.990 32.514 1.00 1.36 H new ATOM 0 HD21 ASN A 53 7.566 13.832 29.865 1.00 2.41 H new ATOM 0 HD22 ASN A 53 7.798 15.333 30.768 1.00 2.41 H new TER 884 ASN A 53 ATOM 885 N PHE B 2 15.013 2.547 21.125 1.00 9.08 N ATOM 886 CA PHE B 2 15.231 2.377 19.660 1.00 8.67 C ATOM 887 C PHE B 2 13.892 2.419 18.918 1.00 7.72 C ATOM 888 O PHE B 2 13.777 3.001 17.857 1.00 7.64 O ATOM 889 CB PHE B 2 15.884 1.003 19.512 1.00 9.22 C ATOM 890 CG PHE B 2 16.278 0.784 18.071 1.00 10.46 C ATOM 891 CD1 PHE B 2 17.504 1.268 17.600 1.00 10.89 C ATOM 892 CD2 PHE B 2 15.417 0.099 17.206 1.00 10.87 C ATOM 893 CE1 PHE B 2 17.869 1.066 16.263 1.00 11.66 C ATOM 894 CE2 PHE B 2 15.781 -0.103 15.870 1.00 11.64 C ATOM 895 CZ PHE B 2 17.008 0.381 15.398 1.00 11.60 C ATOM 0 HA PHE B 2 15.851 3.169 19.240 1.00 8.67 H new ATOM 0 HB2 PHE B 2 16.762 0.935 20.154 1.00 9.22 H new ATOM 0 HB3 PHE B 2 15.193 0.224 19.833 1.00 9.22 H new ATOM 0 HD1 PHE B 2 18.168 1.797 18.267 1.00 10.89 H new ATOM 0 HD2 PHE B 2 14.471 -0.274 17.570 1.00 10.87 H new ATOM 0 HE1 PHE B 2 18.815 1.439 15.899 1.00 11.66 H new ATOM 0 HE2 PHE B 2 15.116 -0.632 15.203 1.00 11.64 H new ATOM 0 HZ PHE B 2 17.289 0.226 14.367 1.00 11.60 H new ATOM 905 N MET B 3 12.880 1.807 19.469 1.00 7.25 N ATOM 906 CA MET B 3 11.549 1.812 18.795 1.00 6.59 C ATOM 907 C MET B 3 10.673 2.931 19.366 1.00 5.73 C ATOM 908 O MET B 3 10.797 3.303 20.515 1.00 5.45 O ATOM 909 CB MET B 3 10.943 0.444 19.105 1.00 6.98 C ATOM 910 CG MET B 3 11.790 -0.650 18.451 1.00 7.76 C ATOM 911 SD MET B 3 10.965 -2.250 18.644 1.00 8.62 S ATOM 912 CE MET B 3 9.637 -1.965 17.448 1.00 8.70 C ATOM 0 H MET B 3 12.916 1.304 20.356 1.00 7.25 H new ATOM 0 HA MET B 3 11.629 1.987 17.722 1.00 6.59 H new ATOM 0 HB2 MET B 3 10.900 0.289 20.183 1.00 6.98 H new ATOM 0 HB3 MET B 3 9.919 0.396 18.735 1.00 6.98 H new ATOM 0 HG2 MET B 3 11.935 -0.429 17.394 1.00 7.76 H new ATOM 0 HG3 MET B 3 12.779 -0.681 18.909 1.00 7.76 H new ATOM 0 HE1 MET B 3 9.386 -2.903 16.953 1.00 8.70 H new ATOM 0 HE2 MET B 3 8.758 -1.581 17.965 1.00 8.70 H new ATOM 0 HE3 MET B 3 9.966 -1.239 16.705 1.00 8.70 H new ATOM 922 N LYS B 4 9.807 3.487 18.564 1.00 5.69 N ATOM 923 CA LYS B 4 8.946 4.601 19.054 1.00 5.34 C ATOM 924 C LYS B 4 7.674 4.047 19.702 1.00 4.61 C ATOM 925 O LYS B 4 7.104 3.075 19.245 1.00 4.72 O ATOM 926 CB LYS B 4 8.602 5.415 17.807 1.00 6.20 C ATOM 927 CG LYS B 4 9.879 6.025 17.226 1.00 6.74 C ATOM 928 CD LYS B 4 9.522 6.935 16.049 1.00 7.81 C ATOM 929 CE LYS B 4 10.805 7.452 15.395 1.00 8.51 C ATOM 930 NZ LYS B 4 10.988 8.825 15.941 1.00 9.17 N ATOM 0 H LYS B 4 9.658 3.219 17.591 1.00 5.69 H new ATOM 0 HA LYS B 4 9.447 5.205 19.810 1.00 5.34 H new ATOM 0 HB2 LYS B 4 8.121 4.778 17.065 1.00 6.20 H new ATOM 0 HB3 LYS B 4 7.892 6.203 18.059 1.00 6.20 H new ATOM 0 HG2 LYS B 4 10.404 6.594 17.993 1.00 6.74 H new ATOM 0 HG3 LYS B 4 10.554 5.235 16.897 1.00 6.74 H new ATOM 0 HD2 LYS B 4 8.925 6.387 15.320 1.00 7.81 H new ATOM 0 HD3 LYS B 4 8.914 7.772 16.394 1.00 7.81 H new ATOM 0 HE2 LYS B 4 11.656 6.815 15.636 1.00 8.51 H new ATOM 0 HE3 LYS B 4 10.716 7.468 14.309 1.00 8.51 H new ATOM 0 HZ1 LYS B 4 11.849 9.247 15.539 1.00 9.17 H new ATOM 0 HZ2 LYS B 4 10.166 9.411 15.690 1.00 9.17 H new ATOM 0 HZ3 LYS B 4 11.077 8.778 16.976 1.00 9.17 H new ATOM 944 N SER B 5 7.223 4.663 20.760 1.00 4.27 N ATOM 945 CA SER B 5 5.983 4.180 21.435 1.00 3.86 C ATOM 946 C SER B 5 4.937 5.298 21.474 1.00 2.80 C ATOM 947 O SER B 5 5.265 6.467 21.452 1.00 3.02 O ATOM 948 CB SER B 5 6.423 3.808 22.850 1.00 4.70 C ATOM 949 OG SER B 5 7.439 2.817 22.780 1.00 5.20 O ATOM 0 H SER B 5 7.659 5.480 21.187 1.00 4.27 H new ATOM 0 HA SER B 5 5.529 3.336 20.915 1.00 3.86 H new ATOM 0 HB2 SER B 5 6.795 4.690 23.371 1.00 4.70 H new ATOM 0 HB3 SER B 5 5.573 3.434 23.421 1.00 4.70 H new ATOM 0 HG SER B 5 7.358 2.211 23.546 1.00 5.20 H new ATOM 955 N THR B 6 3.680 4.949 21.525 1.00 2.20 N ATOM 956 CA THR B 6 2.621 5.999 21.556 1.00 1.59 C ATOM 957 C THR B 6 2.868 6.958 22.723 1.00 1.19 C ATOM 958 O THR B 6 2.742 8.159 22.588 1.00 1.95 O ATOM 959 CB THR B 6 1.310 5.236 21.756 1.00 2.29 C ATOM 960 OG1 THR B 6 1.334 4.580 23.017 1.00 2.98 O ATOM 961 CG2 THR B 6 1.143 4.202 20.643 1.00 2.91 C ATOM 0 H THR B 6 3.341 3.987 21.546 1.00 2.20 H new ATOM 0 HA THR B 6 2.606 6.600 20.646 1.00 1.59 H new ATOM 0 HB THR B 6 0.474 5.935 21.725 1.00 2.29 H new ATOM 0 HG1 THR B 6 0.494 4.092 23.148 1.00 2.98 H new ATOM 0 HG21 THR B 6 0.209 3.660 20.787 1.00 2.91 H new ATOM 0 HG22 THR B 6 1.124 4.707 19.677 1.00 2.91 H new ATOM 0 HG23 THR B 6 1.977 3.501 20.670 1.00 2.91 H new ATOM 969 N GLY B 7 3.286 6.444 23.847 1.00 0.83 N ATOM 970 CA GLY B 7 3.619 7.337 24.993 1.00 0.45 C ATOM 971 C GLY B 7 2.343 7.995 25.520 1.00 0.43 C ATOM 972 O GLY B 7 2.307 9.184 25.768 1.00 0.49 O ATOM 0 H GLY B 7 3.411 5.447 24.021 1.00 0.83 H new ATOM 0 HA2 GLY B 7 4.099 6.764 25.786 1.00 0.45 H new ATOM 0 HA3 GLY B 7 4.330 8.101 24.677 1.00 0.45 H new ATOM 976 N ILE B 8 1.298 7.235 25.708 1.00 0.37 N ATOM 977 CA ILE B 8 0.036 7.834 26.236 1.00 0.37 C ATOM 978 C ILE B 8 -0.263 7.278 27.628 1.00 0.32 C ATOM 979 O ILE B 8 -0.134 6.101 27.869 1.00 0.30 O ATOM 980 CB ILE B 8 -1.052 7.412 25.250 1.00 0.40 C ATOM 981 CG1 ILE B 8 -0.614 7.758 23.824 1.00 0.45 C ATOM 982 CG2 ILE B 8 -2.349 8.156 25.575 1.00 0.43 C ATOM 983 CD1 ILE B 8 -0.090 9.194 23.783 1.00 1.36 C ATOM 0 H ILE B 8 1.262 6.233 25.521 1.00 0.37 H new ATOM 0 HA ILE B 8 0.101 8.918 26.328 1.00 0.37 H new ATOM 0 HB ILE B 8 -1.216 6.337 25.330 1.00 0.40 H new ATOM 0 HG12 ILE B 8 0.162 7.067 23.493 1.00 0.45 H new ATOM 0 HG13 ILE B 8 -1.453 7.647 23.138 1.00 0.45 H new ATOM 0 HG21 ILE B 8 -3.126 7.856 24.872 1.00 0.43 H new ATOM 0 HG22 ILE B 8 -2.664 7.913 26.590 1.00 0.43 H new ATOM 0 HG23 ILE B 8 -2.182 9.230 25.495 1.00 0.43 H new ATOM 0 HD11 ILE B 8 0.221 9.439 22.768 1.00 1.36 H new ATOM 0 HD12 ILE B 8 -0.879 9.878 24.096 1.00 1.36 H new ATOM 0 HD13 ILE B 8 0.762 9.290 24.457 1.00 1.36 H new ATOM 995 N VAL B 9 -0.577 8.126 28.568 1.00 0.32 N ATOM 996 CA VAL B 9 -0.778 7.639 29.963 1.00 0.29 C ATOM 997 C VAL B 9 -2.212 7.902 30.433 1.00 0.32 C ATOM 998 O VAL B 9 -2.800 8.922 30.134 1.00 0.37 O ATOM 999 CB VAL B 9 0.220 8.427 30.811 1.00 0.30 C ATOM 1000 CG1 VAL B 9 0.056 8.042 32.283 1.00 0.27 C ATOM 1001 CG2 VAL B 9 1.645 8.096 30.358 1.00 0.30 C ATOM 0 H VAL B 9 -0.703 9.129 28.433 1.00 0.32 H new ATOM 0 HA VAL B 9 -0.621 6.563 30.041 1.00 0.29 H new ATOM 0 HB VAL B 9 0.035 9.494 30.690 1.00 0.30 H new ATOM 0 HG11 VAL B 9 0.768 8.604 32.888 1.00 0.27 H new ATOM 0 HG12 VAL B 9 -0.958 8.273 32.609 1.00 0.27 H new ATOM 0 HG13 VAL B 9 0.242 6.975 32.403 1.00 0.27 H new ATOM 0 HG21 VAL B 9 2.358 8.657 30.962 1.00 0.30 H new ATOM 0 HG22 VAL B 9 1.827 7.028 30.480 1.00 0.30 H new ATOM 0 HG23 VAL B 9 1.765 8.367 29.309 1.00 0.30 H new ATOM 1011 N ARG B 10 -2.755 7.003 31.205 1.00 0.31 N ATOM 1012 CA ARG B 10 -4.129 7.203 31.751 1.00 0.36 C ATOM 1013 C ARG B 10 -4.118 6.998 33.268 1.00 0.31 C ATOM 1014 O ARG B 10 -3.208 6.410 33.814 1.00 0.28 O ATOM 1015 CB ARG B 10 -4.988 6.137 31.070 1.00 0.40 C ATOM 1016 CG ARG B 10 -6.448 6.311 31.495 1.00 0.74 C ATOM 1017 CD ARG B 10 -7.028 7.563 30.833 1.00 0.87 C ATOM 1018 NE ARG B 10 -8.415 7.672 31.366 1.00 1.14 N ATOM 1019 CZ ARG B 10 -9.181 8.666 31.004 1.00 1.37 C ATOM 1020 NH1 ARG B 10 -8.735 9.571 30.173 1.00 1.62 N ATOM 1021 NH2 ARG B 10 -10.394 8.757 31.475 1.00 1.92 N ATOM 0 H ARG B 10 -2.304 6.132 31.484 1.00 0.31 H new ATOM 0 HA ARG B 10 -4.510 8.207 31.564 1.00 0.36 H new ATOM 0 HB2 ARG B 10 -4.901 6.222 29.987 1.00 0.40 H new ATOM 0 HB3 ARG B 10 -4.635 5.142 31.341 1.00 0.40 H new ATOM 0 HG2 ARG B 10 -7.028 5.434 31.209 1.00 0.74 H new ATOM 0 HG3 ARG B 10 -6.514 6.397 32.580 1.00 0.74 H new ATOM 0 HD2 ARG B 10 -6.440 8.448 31.078 1.00 0.87 H new ATOM 0 HD3 ARG B 10 -7.028 7.471 29.747 1.00 0.87 H new ATOM 0 HE ARG B 10 -8.767 6.969 32.015 1.00 1.14 H new ATOM 0 HH11 ARG B 10 -7.786 9.502 29.805 1.00 1.62 H new ATOM 0 HH12 ARG B 10 -9.336 10.346 29.892 1.00 1.62 H new ATOM 0 HH21 ARG B 10 -10.743 8.053 32.125 1.00 1.92 H new ATOM 0 HH22 ARG B 10 -10.994 9.533 31.193 1.00 1.92 H new ATOM 1035 N LYS B 11 -5.104 7.500 33.958 1.00 0.33 N ATOM 1036 CA LYS B 11 -5.123 7.349 35.442 1.00 0.30 C ATOM 1037 C LYS B 11 -5.738 6.000 35.831 1.00 0.26 C ATOM 1038 O LYS B 11 -6.630 5.501 35.174 1.00 0.28 O ATOM 1039 CB LYS B 11 -5.995 8.499 35.947 1.00 0.34 C ATOM 1040 CG LYS B 11 -5.329 9.833 35.607 1.00 1.03 C ATOM 1041 CD LYS B 11 -6.143 10.979 36.211 1.00 1.03 C ATOM 1042 CE LYS B 11 -5.551 12.318 35.764 1.00 1.81 C ATOM 1043 NZ LYS B 11 -6.550 13.339 36.186 1.00 2.21 N ATOM 0 H LYS B 11 -5.895 8.007 33.561 1.00 0.33 H new ATOM 0 HA LYS B 11 -4.121 7.377 35.871 1.00 0.30 H new ATOM 0 HB2 LYS B 11 -6.983 8.447 35.490 1.00 0.34 H new ATOM 0 HB3 LYS B 11 -6.137 8.416 37.025 1.00 0.34 H new ATOM 0 HG2 LYS B 11 -4.311 9.852 35.995 1.00 1.03 H new ATOM 0 HG3 LYS B 11 -5.260 9.952 34.526 1.00 1.03 H new ATOM 0 HD2 LYS B 11 -7.184 10.906 35.895 1.00 1.03 H new ATOM 0 HD3 LYS B 11 -6.135 10.911 37.299 1.00 1.03 H new ATOM 0 HE2 LYS B 11 -4.582 12.497 36.230 1.00 1.81 H new ATOM 0 HE3 LYS B 11 -5.395 12.340 34.686 1.00 1.81 H new ATOM 0 HZ1 LYS B 11 -6.215 14.285 35.914 1.00 2.21 H new ATOM 0 HZ2 LYS B 11 -7.460 13.147 35.721 1.00 2.21 H new ATOM 0 HZ3 LYS B 11 -6.673 13.299 37.218 1.00 2.21 H new ATOM 1057 N VAL B 12 -5.275 5.411 36.902 1.00 0.23 N ATOM 1058 CA VAL B 12 -5.842 4.103 37.336 1.00 0.22 C ATOM 1059 C VAL B 12 -7.129 4.335 38.131 1.00 0.20 C ATOM 1060 O VAL B 12 -7.150 5.095 39.077 1.00 0.20 O ATOM 1061 CB VAL B 12 -4.778 3.480 38.242 1.00 0.21 C ATOM 1062 CG1 VAL B 12 -5.072 1.992 38.430 1.00 0.29 C ATOM 1063 CG2 VAL B 12 -3.393 3.650 37.614 1.00 0.29 C ATOM 0 H VAL B 12 -4.530 5.779 37.493 1.00 0.23 H new ATOM 0 HA VAL B 12 -6.084 3.461 36.489 1.00 0.22 H new ATOM 0 HB VAL B 12 -4.797 3.981 39.210 1.00 0.21 H new ATOM 0 HG11 VAL B 12 -4.313 1.550 39.076 1.00 0.29 H new ATOM 0 HG12 VAL B 12 -6.054 1.870 38.888 1.00 0.29 H new ATOM 0 HG13 VAL B 12 -5.059 1.493 37.461 1.00 0.29 H new ATOM 0 HG21 VAL B 12 -2.641 3.204 38.265 1.00 0.29 H new ATOM 0 HG22 VAL B 12 -3.371 3.156 36.643 1.00 0.29 H new ATOM 0 HG23 VAL B 12 -3.179 4.711 37.487 1.00 0.29 H new ATOM 1073 N ASP B 13 -8.198 3.689 37.761 1.00 0.21 N ATOM 1074 CA ASP B 13 -9.470 3.886 38.509 1.00 0.21 C ATOM 1075 C ASP B 13 -9.518 2.950 39.724 1.00 0.22 C ATOM 1076 O ASP B 13 -8.529 2.350 40.092 1.00 0.23 O ATOM 1077 CB ASP B 13 -10.586 3.574 37.500 1.00 0.22 C ATOM 1078 CG ASP B 13 -10.953 2.090 37.548 1.00 0.32 C ATOM 1079 OD1 ASP B 13 -10.272 1.304 36.914 1.00 0.27 O ATOM 1080 OD2 ASP B 13 -11.910 1.761 38.225 1.00 0.55 O ATOM 0 H ASP B 13 -8.247 3.037 36.978 1.00 0.21 H new ATOM 0 HA ASP B 13 -9.574 4.897 38.902 1.00 0.21 H new ATOM 0 HB2 ASP B 13 -11.465 4.179 37.722 1.00 0.22 H new ATOM 0 HB3 ASP B 13 -10.261 3.842 36.495 1.00 0.22 H new ATOM 1085 N GLU B 14 -10.618 2.930 40.425 1.00 0.23 N ATOM 1086 CA GLU B 14 -10.670 2.167 41.706 1.00 0.26 C ATOM 1087 C GLU B 14 -10.312 0.689 41.497 1.00 0.26 C ATOM 1088 O GLU B 14 -9.726 0.064 42.357 1.00 0.30 O ATOM 1089 CB GLU B 14 -12.118 2.301 42.181 1.00 0.28 C ATOM 1090 CG GLU B 14 -12.421 3.769 42.487 1.00 1.22 C ATOM 1091 CD GLU B 14 -13.848 3.894 43.026 1.00 1.57 C ATOM 1092 OE1 GLU B 14 -14.567 2.909 42.977 1.00 2.19 O ATOM 1093 OE2 GLU B 14 -14.196 4.971 43.480 1.00 1.99 O ATOM 0 H GLU B 14 -11.482 3.408 40.168 1.00 0.23 H new ATOM 0 HA GLU B 14 -9.952 2.552 42.430 1.00 0.26 H new ATOM 0 HB2 GLU B 14 -12.799 1.930 41.415 1.00 0.28 H new ATOM 0 HB3 GLU B 14 -12.278 1.692 43.071 1.00 0.28 H new ATOM 0 HG2 GLU B 14 -11.710 4.153 43.218 1.00 1.22 H new ATOM 0 HG3 GLU B 14 -12.308 4.370 41.585 1.00 1.22 H new ATOM 1100 N LEU B 15 -10.748 0.096 40.421 1.00 0.23 N ATOM 1101 CA LEU B 15 -10.526 -1.371 40.247 1.00 0.25 C ATOM 1102 C LEU B 15 -9.128 -1.666 39.688 1.00 0.23 C ATOM 1103 O LEU B 15 -8.739 -2.808 39.555 1.00 0.25 O ATOM 1104 CB LEU B 15 -11.599 -1.830 39.261 1.00 0.28 C ATOM 1105 CG LEU B 15 -11.371 -3.303 38.919 1.00 0.38 C ATOM 1106 CD1 LEU B 15 -11.160 -4.102 40.208 1.00 1.28 C ATOM 1107 CD2 LEU B 15 -12.594 -3.847 38.176 1.00 1.39 C ATOM 0 H LEU B 15 -11.245 0.557 39.659 1.00 0.23 H new ATOM 0 HA LEU B 15 -10.590 -1.894 41.201 1.00 0.25 H new ATOM 0 HB2 LEU B 15 -12.590 -1.694 39.694 1.00 0.28 H new ATOM 0 HB3 LEU B 15 -11.561 -1.224 38.356 1.00 0.28 H new ATOM 0 HG LEU B 15 -10.488 -3.397 38.287 1.00 0.38 H new ATOM 0 HD11 LEU B 15 -10.998 -5.152 39.963 1.00 1.28 H new ATOM 0 HD12 LEU B 15 -10.290 -3.714 40.738 1.00 1.28 H new ATOM 0 HD13 LEU B 15 -12.042 -4.010 40.842 1.00 1.28 H new ATOM 0 HD21 LEU B 15 -12.434 -4.897 37.931 1.00 1.39 H new ATOM 0 HD22 LEU B 15 -13.476 -3.753 38.809 1.00 1.39 H new ATOM 0 HD23 LEU B 15 -12.744 -3.279 37.258 1.00 1.39 H new ATOM 1119 N GLY B 16 -8.385 -0.662 39.316 1.00 0.21 N ATOM 1120 CA GLY B 16 -7.042 -0.925 38.723 1.00 0.20 C ATOM 1121 C GLY B 16 -7.200 -1.307 37.248 1.00 0.21 C ATOM 1122 O GLY B 16 -6.660 -2.296 36.786 1.00 0.21 O ATOM 0 H GLY B 16 -8.645 0.321 39.395 1.00 0.21 H new ATOM 0 HA2 GLY B 16 -6.413 -0.040 38.815 1.00 0.20 H new ATOM 0 HA3 GLY B 16 -6.544 -1.728 39.266 1.00 0.20 H new ATOM 1126 N ARG B 17 -7.977 -0.559 36.514 1.00 0.24 N ATOM 1127 CA ARG B 17 -8.211 -0.905 35.086 1.00 0.27 C ATOM 1128 C ARG B 17 -7.613 0.174 34.179 1.00 0.26 C ATOM 1129 O ARG B 17 -7.462 1.314 34.571 1.00 0.26 O ATOM 1130 CB ARG B 17 -9.732 -0.959 34.938 1.00 0.29 C ATOM 1131 CG ARG B 17 -10.281 -2.131 35.754 1.00 0.29 C ATOM 1132 CD ARG B 17 -11.793 -2.235 35.554 1.00 0.29 C ATOM 1133 NE ARG B 17 -12.357 -1.065 36.279 1.00 0.57 N ATOM 1134 CZ ARG B 17 -13.628 -1.038 36.590 1.00 0.79 C ATOM 1135 NH1 ARG B 17 -14.412 -2.019 36.231 1.00 0.73 N ATOM 1136 NH2 ARG B 17 -14.117 -0.032 37.263 1.00 1.14 N ATOM 0 H ARG B 17 -8.460 0.277 36.843 1.00 0.24 H new ATOM 0 HA ARG B 17 -7.744 -1.848 34.803 1.00 0.27 H new ATOM 0 HB2 ARG B 17 -10.175 -0.024 35.281 1.00 0.29 H new ATOM 0 HB3 ARG B 17 -10.002 -1.074 33.888 1.00 0.29 H new ATOM 0 HG2 ARG B 17 -9.799 -3.059 35.446 1.00 0.29 H new ATOM 0 HG3 ARG B 17 -10.053 -1.989 36.810 1.00 0.29 H new ATOM 0 HD2 ARG B 17 -12.054 -2.208 34.496 1.00 0.29 H new ATOM 0 HD3 ARG B 17 -12.181 -3.172 35.954 1.00 0.29 H new ATOM 0 HE ARG B 17 -11.753 -0.284 36.534 1.00 0.57 H new ATOM 0 HH11 ARG B 17 -14.034 -2.808 35.707 1.00 0.73 H new ATOM 0 HH12 ARG B 17 -15.402 -1.996 36.475 1.00 0.73 H new ATOM 0 HH21 ARG B 17 -13.508 0.735 37.548 1.00 1.14 H new ATOM 0 HH22 ARG B 17 -15.108 -0.013 37.504 1.00 1.14 H new ATOM 1150 N VAL B 18 -7.268 -0.179 32.973 1.00 0.26 N ATOM 1151 CA VAL B 18 -6.674 0.822 32.041 1.00 0.26 C ATOM 1152 C VAL B 18 -7.505 0.893 30.759 1.00 0.24 C ATOM 1153 O VAL B 18 -8.207 -0.037 30.418 1.00 0.25 O ATOM 1154 CB VAL B 18 -5.268 0.302 31.742 1.00 0.26 C ATOM 1155 CG1 VAL B 18 -4.511 0.091 33.054 1.00 0.28 C ATOM 1156 CG2 VAL B 18 -5.368 -1.028 30.991 1.00 0.26 C ATOM 0 H VAL B 18 -7.371 -1.119 32.591 1.00 0.26 H new ATOM 0 HA VAL B 18 -6.651 1.825 32.466 1.00 0.26 H new ATOM 0 HB VAL B 18 -4.734 1.028 31.129 1.00 0.26 H new ATOM 0 HG11 VAL B 18 -3.509 -0.280 32.840 1.00 0.28 H new ATOM 0 HG12 VAL B 18 -4.441 1.038 33.590 1.00 0.28 H new ATOM 0 HG13 VAL B 18 -5.043 -0.635 33.668 1.00 0.28 H new ATOM 0 HG21 VAL B 18 -4.366 -1.401 30.777 1.00 0.26 H new ATOM 0 HG22 VAL B 18 -5.902 -1.753 31.605 1.00 0.26 H new ATOM 0 HG23 VAL B 18 -5.907 -0.878 30.056 1.00 0.26 H new ATOM 1166 N VAL B 19 -7.511 2.019 30.102 1.00 0.23 N ATOM 1167 CA VAL B 19 -8.394 2.174 28.911 1.00 0.22 C ATOM 1168 C VAL B 19 -7.563 2.320 27.636 1.00 0.22 C ATOM 1169 O VAL B 19 -6.670 3.139 27.555 1.00 0.24 O ATOM 1170 CB VAL B 19 -9.187 3.453 29.178 1.00 0.22 C ATOM 1171 CG1 VAL B 19 -10.303 3.589 28.141 1.00 0.23 C ATOM 1172 CG2 VAL B 19 -9.795 3.391 30.581 1.00 0.24 C ATOM 0 H VAL B 19 -6.946 2.835 30.336 1.00 0.23 H new ATOM 0 HA VAL B 19 -9.039 1.308 28.765 1.00 0.22 H new ATOM 0 HB VAL B 19 -8.523 4.314 29.108 1.00 0.22 H new ATOM 0 HG11 VAL B 19 -10.868 4.501 28.332 1.00 0.23 H new ATOM 0 HG12 VAL B 19 -9.868 3.634 27.142 1.00 0.23 H new ATOM 0 HG13 VAL B 19 -10.969 2.729 28.208 1.00 0.23 H new ATOM 0 HG21 VAL B 19 -10.361 4.303 30.773 1.00 0.24 H new ATOM 0 HG22 VAL B 19 -10.459 2.530 30.652 1.00 0.24 H new ATOM 0 HG23 VAL B 19 -8.998 3.296 31.319 1.00 0.24 H new ATOM 1182 N ILE B 20 -7.920 1.602 26.606 1.00 0.22 N ATOM 1183 CA ILE B 20 -7.227 1.781 25.299 1.00 0.24 C ATOM 1184 C ILE B 20 -7.878 2.933 24.528 1.00 0.24 C ATOM 1185 O ILE B 20 -9.083 3.013 24.446 1.00 0.23 O ATOM 1186 CB ILE B 20 -7.428 0.442 24.575 1.00 0.23 C ATOM 1187 CG1 ILE B 20 -6.311 -0.524 24.980 1.00 0.29 C ATOM 1188 CG2 ILE B 20 -7.391 0.646 23.058 1.00 0.25 C ATOM 1189 CD1 ILE B 20 -4.986 -0.058 24.371 1.00 1.38 C ATOM 0 H ILE B 20 -8.660 0.900 26.613 1.00 0.22 H new ATOM 0 HA ILE B 20 -6.171 2.029 25.400 1.00 0.24 H new ATOM 0 HB ILE B 20 -8.398 0.031 24.854 1.00 0.23 H new ATOM 0 HG12 ILE B 20 -6.229 -0.567 26.066 1.00 0.29 H new ATOM 0 HG13 ILE B 20 -6.546 -1.532 24.638 1.00 0.29 H new ATOM 0 HG21 ILE B 20 -7.535 -0.312 22.558 1.00 0.25 H new ATOM 0 HG22 ILE B 20 -8.186 1.332 22.764 1.00 0.25 H new ATOM 0 HG23 ILE B 20 -6.426 1.064 22.770 1.00 0.25 H new ATOM 0 HD11 ILE B 20 -4.191 -0.746 24.659 1.00 1.38 H new ATOM 0 HD12 ILE B 20 -5.072 -0.038 23.285 1.00 1.38 H new ATOM 0 HD13 ILE B 20 -4.750 0.942 24.735 1.00 1.38 H new ATOM 1201 N PRO B 21 -7.058 3.759 23.936 1.00 0.28 N ATOM 1202 CA PRO B 21 -7.577 4.873 23.105 1.00 0.30 C ATOM 1203 C PRO B 21 -8.436 4.320 21.964 1.00 0.28 C ATOM 1204 O PRO B 21 -8.148 3.280 21.410 1.00 0.27 O ATOM 1205 CB PRO B 21 -6.320 5.558 22.562 1.00 0.35 C ATOM 1206 CG PRO B 21 -5.186 4.618 22.837 1.00 0.36 C ATOM 1207 CD PRO B 21 -5.597 3.734 23.983 1.00 0.32 C ATOM 0 HA PRO B 21 -8.210 5.562 23.664 1.00 0.30 H new ATOM 0 HB2 PRO B 21 -6.413 5.755 21.494 1.00 0.35 H new ATOM 0 HB3 PRO B 21 -6.157 6.519 23.050 1.00 0.35 H new ATOM 0 HG2 PRO B 21 -4.961 4.020 21.954 1.00 0.36 H new ATOM 0 HG3 PRO B 21 -4.281 5.172 23.086 1.00 0.36 H new ATOM 0 HD2 PRO B 21 -5.210 2.722 23.866 1.00 0.32 H new ATOM 0 HD3 PRO B 21 -5.221 4.111 24.934 1.00 0.32 H new ATOM 1215 N ILE B 22 -9.514 4.979 21.641 1.00 0.30 N ATOM 1216 CA ILE B 22 -10.414 4.447 20.575 1.00 0.30 C ATOM 1217 C ILE B 22 -9.633 4.233 19.276 1.00 0.33 C ATOM 1218 O ILE B 22 -9.910 3.324 18.520 1.00 0.32 O ATOM 1219 CB ILE B 22 -11.489 5.520 20.389 1.00 0.36 C ATOM 1220 CG1 ILE B 22 -12.666 4.931 19.606 1.00 0.41 C ATOM 1221 CG2 ILE B 22 -10.906 6.706 19.618 1.00 0.43 C ATOM 1222 CD1 ILE B 22 -12.208 4.557 18.196 1.00 1.11 C ATOM 0 H ILE B 22 -9.811 5.858 22.065 1.00 0.30 H new ATOM 0 HA ILE B 22 -10.845 3.483 20.844 1.00 0.30 H new ATOM 0 HB ILE B 22 -11.833 5.860 21.366 1.00 0.36 H new ATOM 0 HG12 ILE B 22 -13.053 4.051 20.119 1.00 0.41 H new ATOM 0 HG13 ILE B 22 -13.480 5.654 19.555 1.00 0.41 H new ATOM 0 HG21 ILE B 22 -11.674 7.468 19.487 1.00 0.43 H new ATOM 0 HG22 ILE B 22 -10.069 7.126 20.175 1.00 0.43 H new ATOM 0 HG23 ILE B 22 -10.559 6.370 18.641 1.00 0.43 H new ATOM 0 HD11 ILE B 22 -13.047 4.138 17.640 1.00 1.11 H new ATOM 0 HD12 ILE B 22 -11.842 5.447 17.684 1.00 1.11 H new ATOM 0 HD13 ILE B 22 -11.408 3.819 18.257 1.00 1.11 H new ATOM 1234 N GLU B 23 -8.638 5.035 19.026 1.00 0.36 N ATOM 1235 CA GLU B 23 -7.828 4.836 17.793 1.00 0.40 C ATOM 1236 C GLU B 23 -7.219 3.432 17.798 1.00 0.37 C ATOM 1237 O GLU B 23 -7.139 2.772 16.781 1.00 0.39 O ATOM 1238 CB GLU B 23 -6.730 5.899 17.865 1.00 0.44 C ATOM 1239 CG GLU B 23 -7.361 7.291 17.803 1.00 1.22 C ATOM 1240 CD GLU B 23 -6.258 8.351 17.808 1.00 1.62 C ATOM 1241 OE1 GLU B 23 -5.115 7.987 18.026 1.00 2.37 O ATOM 1242 OE2 GLU B 23 -6.577 9.509 17.594 1.00 2.00 O ATOM 0 H GLU B 23 -8.351 5.815 19.617 1.00 0.36 H new ATOM 0 HA GLU B 23 -8.420 4.928 16.883 1.00 0.40 H new ATOM 0 HB2 GLU B 23 -6.161 5.787 18.788 1.00 0.44 H new ATOM 0 HB3 GLU B 23 -6.029 5.769 17.041 1.00 0.44 H new ATOM 0 HG2 GLU B 23 -7.968 7.387 16.903 1.00 1.22 H new ATOM 0 HG3 GLU B 23 -8.026 7.439 18.654 1.00 1.22 H new ATOM 1249 N LEU B 24 -6.842 2.953 18.952 1.00 0.34 N ATOM 1250 CA LEU B 24 -6.303 1.568 19.052 1.00 0.33 C ATOM 1251 C LEU B 24 -7.443 0.550 19.081 1.00 0.29 C ATOM 1252 O LEU B 24 -7.313 -0.548 18.578 1.00 0.30 O ATOM 1253 CB LEU B 24 -5.514 1.541 20.359 1.00 0.33 C ATOM 1254 CG LEU B 24 -4.323 2.496 20.255 1.00 0.93 C ATOM 1255 CD1 LEU B 24 -3.434 2.339 21.490 1.00 1.41 C ATOM 1256 CD2 LEU B 24 -3.514 2.162 19.000 1.00 1.75 C ATOM 0 H LEU B 24 -6.885 3.464 19.834 1.00 0.34 H new ATOM 0 HA LEU B 24 -5.678 1.308 18.198 1.00 0.33 H new ATOM 0 HB2 LEU B 24 -6.156 1.833 21.190 1.00 0.33 H new ATOM 0 HB3 LEU B 24 -5.166 0.529 20.565 1.00 0.33 H new ATOM 0 HG LEU B 24 -4.683 3.523 20.195 1.00 0.93 H new ATOM 0 HD11 LEU B 24 -2.585 3.019 21.416 1.00 1.41 H new ATOM 0 HD12 LEU B 24 -4.010 2.573 22.385 1.00 1.41 H new ATOM 0 HD13 LEU B 24 -3.072 1.313 21.550 1.00 1.41 H new ATOM 0 HD21 LEU B 24 -2.665 2.841 18.923 1.00 1.75 H new ATOM 0 HD22 LEU B 24 -3.153 1.135 19.062 1.00 1.75 H new ATOM 0 HD23 LEU B 24 -4.147 2.272 18.119 1.00 1.75 H new ATOM 1268 N ARG B 25 -8.588 0.922 19.592 1.00 0.26 N ATOM 1269 CA ARG B 25 -9.741 -0.019 19.550 1.00 0.23 C ATOM 1270 C ARG B 25 -10.006 -0.417 18.098 1.00 0.26 C ATOM 1271 O ARG B 25 -10.259 -1.564 17.791 1.00 0.25 O ATOM 1272 CB ARG B 25 -10.943 0.761 20.092 1.00 0.22 C ATOM 1273 CG ARG B 25 -10.680 1.238 21.522 1.00 0.21 C ATOM 1274 CD ARG B 25 -11.970 1.846 22.087 1.00 0.22 C ATOM 1275 NE ARG B 25 -11.538 2.712 23.217 1.00 0.23 N ATOM 1276 CZ ARG B 25 -12.322 3.661 23.654 1.00 0.26 C ATOM 1277 NH1 ARG B 25 -13.494 3.848 23.110 1.00 0.30 N ATOM 1278 NH2 ARG B 25 -11.934 4.423 24.639 1.00 0.27 N ATOM 0 H ARG B 25 -8.771 1.825 20.030 1.00 0.26 H new ATOM 0 HA ARG B 25 -9.553 -0.921 20.132 1.00 0.23 H new ATOM 0 HB2 ARG B 25 -11.146 1.618 19.449 1.00 0.22 H new ATOM 0 HB3 ARG B 25 -11.831 0.130 20.072 1.00 0.22 H new ATOM 0 HG2 ARG B 25 -10.352 0.405 22.143 1.00 0.21 H new ATOM 0 HG3 ARG B 25 -9.879 1.977 21.532 1.00 0.21 H new ATOM 0 HD2 ARG B 25 -12.497 2.424 21.328 1.00 0.22 H new ATOM 0 HD3 ARG B 25 -12.654 1.069 22.427 1.00 0.22 H new ATOM 0 HE ARG B 25 -10.627 2.564 23.652 1.00 0.23 H new ATOM 0 HH11 ARG B 25 -13.800 3.252 22.341 1.00 0.30 H new ATOM 0 HH12 ARG B 25 -14.103 4.590 23.454 1.00 0.30 H new ATOM 0 HH21 ARG B 25 -11.020 4.277 25.067 1.00 0.27 H new ATOM 0 HH22 ARG B 25 -12.545 5.165 24.981 1.00 0.27 H new ATOM 1292 N ARG B 26 -9.981 0.538 17.209 1.00 0.29 N ATOM 1293 CA ARG B 26 -10.267 0.235 15.777 1.00 0.33 C ATOM 1294 C ARG B 26 -9.104 -0.537 15.146 1.00 0.35 C ATOM 1295 O ARG B 26 -9.298 -1.532 14.477 1.00 0.35 O ATOM 1296 CB ARG B 26 -10.426 1.602 15.111 1.00 0.37 C ATOM 1297 CG ARG B 26 -10.847 1.414 13.653 1.00 1.07 C ATOM 1298 CD ARG B 26 -10.952 2.780 12.971 1.00 1.25 C ATOM 1299 NE ARG B 26 -11.487 2.490 11.612 1.00 1.86 N ATOM 1300 CZ ARG B 26 -11.477 3.416 10.690 1.00 2.33 C ATOM 1301 NH1 ARG B 26 -10.998 4.601 10.956 1.00 2.42 N ATOM 1302 NH2 ARG B 26 -11.946 3.156 9.502 1.00 3.27 N ATOM 0 H ARG B 26 -9.775 1.516 17.412 1.00 0.29 H new ATOM 0 HA ARG B 26 -11.154 -0.387 15.659 1.00 0.33 H new ATOM 0 HB2 ARG B 26 -11.172 2.193 15.643 1.00 0.37 H new ATOM 0 HB3 ARG B 26 -9.487 2.154 15.161 1.00 0.37 H new ATOM 0 HG2 ARG B 26 -10.121 0.790 13.131 1.00 1.07 H new ATOM 0 HG3 ARG B 26 -11.805 0.897 13.604 1.00 1.07 H new ATOM 0 HD2 ARG B 26 -11.615 3.447 13.522 1.00 1.25 H new ATOM 0 HD3 ARG B 26 -9.980 3.270 12.917 1.00 1.25 H new ATOM 0 HE ARG B 26 -11.862 1.566 11.400 1.00 1.86 H new ATOM 0 HH11 ARG B 26 -10.630 4.806 11.885 1.00 2.42 H new ATOM 0 HH12 ARG B 26 -10.991 5.322 10.235 1.00 2.42 H new ATOM 0 HH21 ARG B 26 -12.320 2.231 9.293 1.00 3.27 H new ATOM 0 HH22 ARG B 26 -11.939 3.878 8.782 1.00 3.27 H new ATOM 1316 N THR B 27 -7.903 -0.059 15.316 1.00 0.37 N ATOM 1317 CA THR B 27 -6.730 -0.730 14.680 1.00 0.41 C ATOM 1318 C THR B 27 -6.549 -2.150 15.228 1.00 0.39 C ATOM 1319 O THR B 27 -6.047 -3.023 14.550 1.00 0.42 O ATOM 1320 CB THR B 27 -5.529 0.144 15.042 1.00 0.44 C ATOM 1321 OG1 THR B 27 -5.779 1.481 14.629 1.00 0.61 O ATOM 1322 CG2 THR B 27 -4.280 -0.385 14.337 1.00 0.77 C ATOM 0 H THR B 27 -7.681 0.769 15.869 1.00 0.37 H new ATOM 0 HA THR B 27 -6.855 -0.830 13.602 1.00 0.41 H new ATOM 0 HB THR B 27 -5.371 0.119 16.120 1.00 0.44 H new ATOM 0 HG1 THR B 27 -6.191 1.979 15.365 1.00 0.61 H new ATOM 0 HG21 THR B 27 -3.424 0.239 14.596 1.00 0.77 H new ATOM 0 HG22 THR B 27 -4.090 -1.411 14.654 1.00 0.77 H new ATOM 0 HG23 THR B 27 -4.433 -0.361 13.258 1.00 0.77 H new ATOM 1330 N LEU B 28 -6.896 -2.373 16.465 1.00 0.35 N ATOM 1331 CA LEU B 28 -6.679 -3.723 17.063 1.00 0.35 C ATOM 1332 C LEU B 28 -7.871 -4.643 16.771 1.00 0.33 C ATOM 1333 O LEU B 28 -7.847 -5.818 17.079 1.00 0.33 O ATOM 1334 CB LEU B 28 -6.542 -3.475 18.565 1.00 0.33 C ATOM 1335 CG LEU B 28 -6.088 -4.761 19.255 1.00 0.44 C ATOM 1336 CD1 LEU B 28 -4.620 -5.032 18.917 1.00 0.70 C ATOM 1337 CD2 LEU B 28 -6.241 -4.608 20.770 1.00 1.05 C ATOM 0 H LEU B 28 -7.319 -1.683 17.086 1.00 0.35 H new ATOM 0 HA LEU B 28 -5.799 -4.216 16.649 1.00 0.35 H new ATOM 0 HB2 LEU B 28 -5.822 -2.678 18.748 1.00 0.33 H new ATOM 0 HB3 LEU B 28 -7.495 -3.145 18.978 1.00 0.33 H new ATOM 0 HG LEU B 28 -6.700 -5.594 18.909 1.00 0.44 H new ATOM 0 HD11 LEU B 28 -4.297 -5.949 19.409 1.00 0.70 H new ATOM 0 HD12 LEU B 28 -4.509 -5.141 17.838 1.00 0.70 H new ATOM 0 HD13 LEU B 28 -4.007 -4.199 19.263 1.00 0.70 H new ATOM 0 HD21 LEU B 28 -5.917 -5.525 21.263 1.00 1.05 H new ATOM 0 HD22 LEU B 28 -5.629 -3.775 21.115 1.00 1.05 H new ATOM 0 HD23 LEU B 28 -7.286 -4.415 21.013 1.00 1.05 H new ATOM 1349 N GLY B 29 -8.906 -4.127 16.165 1.00 0.32 N ATOM 1350 CA GLY B 29 -10.078 -4.989 15.839 1.00 0.32 C ATOM 1351 C GLY B 29 -10.756 -5.444 17.132 1.00 0.29 C ATOM 1352 O GLY B 29 -11.156 -6.584 17.266 1.00 0.29 O ATOM 0 H GLY B 29 -8.991 -3.151 15.883 1.00 0.32 H new ATOM 0 HA2 GLY B 29 -10.786 -4.438 15.220 1.00 0.32 H new ATOM 0 HA3 GLY B 29 -9.756 -5.855 15.261 1.00 0.32 H new ATOM 1356 N ILE B 30 -10.873 -4.568 18.091 1.00 0.27 N ATOM 1357 CA ILE B 30 -11.510 -4.960 19.380 1.00 0.24 C ATOM 1358 C ILE B 30 -12.796 -4.162 19.610 1.00 0.23 C ATOM 1359 O ILE B 30 -12.878 -2.988 19.310 1.00 0.26 O ATOM 1360 CB ILE B 30 -10.477 -4.632 20.457 1.00 0.27 C ATOM 1361 CG1 ILE B 30 -9.191 -5.413 20.181 1.00 0.41 C ATOM 1362 CG2 ILE B 30 -11.028 -5.028 21.829 1.00 0.33 C ATOM 1363 CD1 ILE B 30 -9.523 -6.896 20.004 1.00 0.30 C ATOM 0 H ILE B 30 -10.556 -3.600 18.039 1.00 0.27 H new ATOM 0 HA ILE B 30 -11.788 -6.014 19.390 1.00 0.24 H new ATOM 0 HB ILE B 30 -10.265 -3.563 20.445 1.00 0.27 H new ATOM 0 HG12 ILE B 30 -8.705 -5.029 19.284 1.00 0.41 H new ATOM 0 HG13 ILE B 30 -8.489 -5.282 21.005 1.00 0.41 H new ATOM 0 HG21 ILE B 30 -10.292 -4.794 22.598 1.00 0.33 H new ATOM 0 HG22 ILE B 30 -11.946 -4.475 22.026 1.00 0.33 H new ATOM 0 HG23 ILE B 30 -11.239 -6.097 21.842 1.00 0.33 H new ATOM 0 HD11 ILE B 30 -8.607 -7.453 19.807 1.00 0.30 H new ATOM 0 HD12 ILE B 30 -9.990 -7.275 20.913 1.00 0.30 H new ATOM 0 HD13 ILE B 30 -10.209 -7.018 19.166 1.00 0.30 H new ATOM 1375 N ALA B 31 -13.812 -4.813 20.098 1.00 0.22 N ATOM 1376 CA ALA B 31 -15.120 -4.131 20.309 1.00 0.23 C ATOM 1377 C ALA B 31 -15.763 -4.619 21.609 1.00 0.20 C ATOM 1378 O ALA B 31 -15.348 -5.603 22.188 1.00 0.19 O ATOM 1379 CB ALA B 31 -15.974 -4.539 19.109 1.00 0.23 C ATOM 0 H ALA B 31 -13.794 -5.798 20.363 1.00 0.22 H new ATOM 0 HA ALA B 31 -15.015 -3.049 20.389 1.00 0.23 H new ATOM 0 HB1 ALA B 31 -16.958 -4.077 19.189 1.00 0.23 H new ATOM 0 HB2 ALA B 31 -15.491 -4.209 18.189 1.00 0.23 H new ATOM 0 HB3 ALA B 31 -16.083 -5.623 19.092 1.00 0.23 H new ATOM 1385 N GLU B 32 -16.770 -3.937 22.076 1.00 0.22 N ATOM 1386 CA GLU B 32 -17.434 -4.360 23.342 1.00 0.21 C ATOM 1387 C GLU B 32 -17.857 -5.831 23.261 1.00 0.19 C ATOM 1388 O GLU B 32 -18.256 -6.314 22.222 1.00 0.20 O ATOM 1389 CB GLU B 32 -18.661 -3.457 23.463 1.00 0.25 C ATOM 1390 CG GLU B 32 -19.351 -3.710 24.804 1.00 0.27 C ATOM 1391 CD GLU B 32 -20.638 -2.886 24.881 1.00 0.32 C ATOM 1392 OE1 GLU B 32 -20.933 -2.195 23.920 1.00 1.13 O ATOM 1393 OE2 GLU B 32 -21.308 -2.962 25.898 1.00 1.12 O ATOM 0 H GLU B 32 -17.163 -3.105 21.637 1.00 0.22 H new ATOM 0 HA GLU B 32 -16.771 -4.271 24.203 1.00 0.21 H new ATOM 0 HB2 GLU B 32 -18.365 -2.411 23.386 1.00 0.25 H new ATOM 0 HB3 GLU B 32 -19.352 -3.653 22.644 1.00 0.25 H new ATOM 0 HG2 GLU B 32 -19.579 -4.770 24.913 1.00 0.27 H new ATOM 0 HG3 GLU B 32 -18.685 -3.441 25.624 1.00 0.27 H new ATOM 1400 N LYS B 33 -17.817 -6.524 24.371 1.00 0.19 N ATOM 1401 CA LYS B 33 -18.266 -7.952 24.413 1.00 0.20 C ATOM 1402 C LYS B 33 -17.231 -8.878 23.761 1.00 0.18 C ATOM 1403 O LYS B 33 -17.326 -10.085 23.858 1.00 0.21 O ATOM 1404 CB LYS B 33 -19.588 -7.997 23.641 1.00 0.23 C ATOM 1405 CG LYS B 33 -20.335 -9.286 23.992 1.00 0.29 C ATOM 1406 CD LYS B 33 -20.926 -9.168 25.398 1.00 0.86 C ATOM 1407 CE LYS B 33 -21.722 -10.433 25.726 1.00 1.35 C ATOM 1408 NZ LYS B 33 -22.900 -9.957 26.502 1.00 1.88 N ATOM 0 H LYS B 33 -17.488 -6.156 25.264 1.00 0.19 H new ATOM 0 HA LYS B 33 -18.385 -8.296 25.440 1.00 0.20 H new ATOM 0 HB2 LYS B 33 -20.199 -7.130 23.892 1.00 0.23 H new ATOM 0 HB3 LYS B 33 -19.398 -7.954 22.569 1.00 0.23 H new ATOM 0 HG2 LYS B 33 -21.128 -9.468 23.267 1.00 0.29 H new ATOM 0 HG3 LYS B 33 -19.656 -10.137 23.942 1.00 0.29 H new ATOM 0 HD2 LYS B 33 -20.129 -9.028 26.128 1.00 0.86 H new ATOM 0 HD3 LYS B 33 -21.573 -8.293 25.460 1.00 0.86 H new ATOM 0 HE2 LYS B 33 -22.031 -10.951 24.818 1.00 1.35 H new ATOM 0 HE3 LYS B 33 -21.125 -11.136 26.307 1.00 1.35 H new ATOM 0 HZ1 LYS B 33 -23.495 -10.769 26.763 1.00 1.88 H new ATOM 0 HZ2 LYS B 33 -22.576 -9.474 27.364 1.00 1.88 H new ATOM 0 HZ3 LYS B 33 -23.454 -9.295 25.921 1.00 1.88 H new ATOM 1422 N ASP B 34 -16.192 -8.334 23.189 1.00 0.16 N ATOM 1423 CA ASP B 34 -15.108 -9.205 22.649 1.00 0.16 C ATOM 1424 C ASP B 34 -14.228 -9.717 23.790 1.00 0.19 C ATOM 1425 O ASP B 34 -14.341 -9.274 24.915 1.00 0.20 O ATOM 1426 CB ASP B 34 -14.304 -8.314 21.706 1.00 0.17 C ATOM 1427 CG ASP B 34 -15.106 -8.082 20.427 1.00 0.18 C ATOM 1428 OD1 ASP B 34 -16.143 -8.707 20.277 1.00 1.10 O ATOM 1429 OD2 ASP B 34 -14.667 -7.284 19.618 1.00 1.09 O ATOM 0 H ASP B 34 -16.046 -7.331 23.072 1.00 0.16 H new ATOM 0 HA ASP B 34 -15.503 -10.081 22.134 1.00 0.16 H new ATOM 0 HB2 ASP B 34 -14.082 -7.362 22.188 1.00 0.17 H new ATOM 0 HB3 ASP B 34 -13.349 -8.783 21.470 1.00 0.17 H new ATOM 1434 N ALA B 35 -13.406 -10.697 23.530 1.00 0.22 N ATOM 1435 CA ALA B 35 -12.585 -11.288 24.624 1.00 0.28 C ATOM 1436 C ALA B 35 -11.125 -10.833 24.515 1.00 0.20 C ATOM 1437 O ALA B 35 -10.501 -10.951 23.480 1.00 0.16 O ATOM 1438 CB ALA B 35 -12.691 -12.800 24.421 1.00 0.36 C ATOM 0 H ALA B 35 -13.268 -11.113 22.609 1.00 0.22 H new ATOM 0 HA ALA B 35 -12.934 -10.978 25.609 1.00 0.28 H new ATOM 0 HB1 ALA B 35 -12.112 -13.312 25.189 1.00 0.36 H new ATOM 0 HB2 ALA B 35 -13.735 -13.104 24.491 1.00 0.36 H new ATOM 0 HB3 ALA B 35 -12.302 -13.063 23.437 1.00 0.36 H new ATOM 1444 N LEU B 36 -10.556 -10.389 25.603 1.00 0.24 N ATOM 1445 CA LEU B 36 -9.113 -10.013 25.602 1.00 0.21 C ATOM 1446 C LEU B 36 -8.314 -11.042 26.404 1.00 0.19 C ATOM 1447 O LEU B 36 -8.713 -11.429 27.481 1.00 0.23 O ATOM 1448 CB LEU B 36 -9.055 -8.659 26.307 1.00 0.34 C ATOM 1449 CG LEU B 36 -10.105 -7.717 25.722 1.00 0.45 C ATOM 1450 CD1 LEU B 36 -10.324 -6.560 26.695 1.00 0.55 C ATOM 1451 CD2 LEU B 36 -9.614 -7.174 24.379 1.00 0.56 C ATOM 0 H LEU B 36 -11.032 -10.270 26.497 1.00 0.24 H new ATOM 0 HA LEU B 36 -8.697 -9.974 24.595 1.00 0.21 H new ATOM 0 HB2 LEU B 36 -9.227 -8.789 27.375 1.00 0.34 H new ATOM 0 HB3 LEU B 36 -8.062 -8.224 26.194 1.00 0.34 H new ATOM 0 HG LEU B 36 -11.041 -8.253 25.568 1.00 0.45 H new ATOM 0 HD11 LEU B 36 -11.072 -5.879 26.289 1.00 0.55 H new ATOM 0 HD12 LEU B 36 -10.670 -6.950 27.652 1.00 0.55 H new ATOM 0 HD13 LEU B 36 -9.386 -6.024 26.839 1.00 0.55 H new ATOM 0 HD21 LEU B 36 -10.364 -6.502 23.962 1.00 0.56 H new ATOM 0 HD22 LEU B 36 -8.681 -6.630 24.526 1.00 0.56 H new ATOM 0 HD23 LEU B 36 -9.447 -8.003 23.691 1.00 0.56 H new ATOM 1463 N GLU B 37 -7.135 -11.380 25.966 1.00 0.18 N ATOM 1464 CA GLU B 37 -6.270 -12.258 26.805 1.00 0.20 C ATOM 1465 C GLU B 37 -5.112 -11.445 27.387 1.00 0.18 C ATOM 1466 O GLU B 37 -4.614 -10.525 26.769 1.00 0.19 O ATOM 1467 CB GLU B 37 -5.760 -13.347 25.863 1.00 0.24 C ATOM 1468 CG GLU B 37 -4.947 -14.371 26.659 1.00 0.26 C ATOM 1469 CD GLU B 37 -4.355 -15.409 25.703 1.00 0.36 C ATOM 1470 OE1 GLU B 37 -4.568 -15.275 24.509 1.00 1.17 O ATOM 1471 OE2 GLU B 37 -3.698 -16.319 26.180 1.00 1.07 O ATOM 0 H GLU B 37 -6.734 -11.091 25.074 1.00 0.18 H new ATOM 0 HA GLU B 37 -6.809 -12.688 27.649 1.00 0.20 H new ATOM 0 HB2 GLU B 37 -6.599 -13.837 25.369 1.00 0.24 H new ATOM 0 HB3 GLU B 37 -5.143 -12.906 25.080 1.00 0.24 H new ATOM 0 HG2 GLU B 37 -4.149 -13.870 27.208 1.00 0.26 H new ATOM 0 HG3 GLU B 37 -5.582 -14.861 27.397 1.00 0.26 H new ATOM 1478 N ILE B 38 -4.775 -11.694 28.621 1.00 0.20 N ATOM 1479 CA ILE B 38 -3.763 -10.846 29.308 1.00 0.20 C ATOM 1480 C ILE B 38 -2.485 -11.646 29.571 1.00 0.19 C ATOM 1481 O ILE B 38 -2.525 -12.779 30.019 1.00 0.23 O ATOM 1482 CB ILE B 38 -4.419 -10.440 30.627 1.00 0.25 C ATOM 1483 CG1 ILE B 38 -5.778 -9.793 30.344 1.00 0.80 C ATOM 1484 CG2 ILE B 38 -3.522 -9.437 31.356 1.00 0.73 C ATOM 1485 CD1 ILE B 38 -5.628 -8.749 29.235 1.00 0.84 C ATOM 0 H ILE B 38 -5.159 -12.452 29.186 1.00 0.20 H new ATOM 0 HA ILE B 38 -3.476 -9.982 28.709 1.00 0.20 H new ATOM 0 HB ILE B 38 -4.558 -11.324 31.249 1.00 0.25 H new ATOM 0 HG12 ILE B 38 -6.499 -10.554 30.046 1.00 0.80 H new ATOM 0 HG13 ILE B 38 -6.165 -9.324 31.249 1.00 0.80 H new ATOM 0 HG21 ILE B 38 -3.990 -9.147 32.297 1.00 0.73 H new ATOM 0 HG22 ILE B 38 -2.554 -9.895 31.558 1.00 0.73 H new ATOM 0 HG23 ILE B 38 -3.383 -8.554 30.733 1.00 0.73 H new ATOM 0 HD11 ILE B 38 -6.596 -8.289 29.035 1.00 0.84 H new ATOM 0 HD12 ILE B 38 -4.920 -7.982 29.550 1.00 0.84 H new ATOM 0 HD13 ILE B 38 -5.261 -9.231 28.329 1.00 0.84 H new ATOM 1497 N TYR B 39 -1.361 -11.054 29.275 1.00 0.18 N ATOM 1498 CA TYR B 39 -0.052 -11.740 29.468 1.00 0.20 C ATOM 1499 C TYR B 39 0.772 -11.010 30.531 1.00 0.20 C ATOM 1500 O TYR B 39 0.588 -9.832 30.763 1.00 0.19 O ATOM 1501 CB TYR B 39 0.643 -11.619 28.115 1.00 0.23 C ATOM 1502 CG TYR B 39 0.107 -12.646 27.157 1.00 0.28 C ATOM 1503 CD1 TYR B 39 -1.258 -12.680 26.850 1.00 0.31 C ATOM 1504 CD2 TYR B 39 0.983 -13.557 26.563 1.00 0.31 C ATOM 1505 CE1 TYR B 39 -1.746 -13.630 25.946 1.00 0.37 C ATOM 1506 CE2 TYR B 39 0.496 -14.508 25.661 1.00 0.36 C ATOM 1507 CZ TYR B 39 -0.869 -14.544 25.351 1.00 0.39 C ATOM 1508 OH TYR B 39 -1.348 -15.481 24.458 1.00 0.45 O ATOM 0 H TYR B 39 -1.293 -10.107 28.901 1.00 0.18 H new ATOM 0 HA TYR B 39 -0.170 -12.773 29.795 1.00 0.20 H new ATOM 0 HB2 TYR B 39 0.491 -10.619 27.709 1.00 0.23 H new ATOM 0 HB3 TYR B 39 1.718 -11.753 28.238 1.00 0.23 H new ATOM 0 HD1 TYR B 39 -1.934 -11.974 27.310 1.00 0.31 H new ATOM 0 HD2 TYR B 39 2.036 -13.527 26.800 1.00 0.31 H new ATOM 0 HE1 TYR B 39 -2.799 -13.658 25.708 1.00 0.37 H new ATOM 0 HE2 TYR B 39 1.173 -15.215 25.203 1.00 0.36 H new ATOM 0 HH TYR B 39 -0.607 -16.037 24.138 1.00 0.45 H new ATOM 1518 N VAL B 40 1.766 -11.655 31.080 1.00 0.21 N ATOM 1519 CA VAL B 40 2.686 -10.932 32.005 1.00 0.21 C ATOM 1520 C VAL B 40 4.147 -11.240 31.663 1.00 0.21 C ATOM 1521 O VAL B 40 4.586 -12.371 31.734 1.00 0.23 O ATOM 1522 CB VAL B 40 2.339 -11.452 33.397 1.00 0.24 C ATOM 1523 CG1 VAL B 40 3.284 -10.825 34.424 1.00 0.26 C ATOM 1524 CG2 VAL B 40 0.896 -11.071 33.735 1.00 0.26 C ATOM 0 H VAL B 40 1.980 -12.641 30.930 1.00 0.21 H new ATOM 0 HA VAL B 40 2.571 -9.851 31.933 1.00 0.21 H new ATOM 0 HB VAL B 40 2.445 -12.537 33.419 1.00 0.24 H new ATOM 0 HG11 VAL B 40 3.037 -11.195 35.419 1.00 0.26 H new ATOM 0 HG12 VAL B 40 4.313 -11.092 34.182 1.00 0.26 H new ATOM 0 HG13 VAL B 40 3.176 -9.741 34.403 1.00 0.26 H new ATOM 0 HG21 VAL B 40 0.645 -11.441 34.729 1.00 0.26 H new ATOM 0 HG22 VAL B 40 0.792 -9.986 33.715 1.00 0.26 H new ATOM 0 HG23 VAL B 40 0.222 -11.514 33.002 1.00 0.26 H new ATOM 1534 N ASP B 41 4.921 -10.229 31.376 1.00 0.21 N ATOM 1535 CA ASP B 41 6.375 -10.449 31.123 1.00 0.21 C ATOM 1536 C ASP B 41 7.181 -9.232 31.589 1.00 0.24 C ATOM 1537 O ASP B 41 6.724 -8.112 31.508 1.00 0.26 O ATOM 1538 CB ASP B 41 6.495 -10.624 29.606 1.00 0.19 C ATOM 1539 CG ASP B 41 6.372 -9.262 28.918 1.00 1.00 C ATOM 1540 OD1 ASP B 41 5.575 -8.459 29.372 1.00 1.68 O ATOM 1541 OD2 ASP B 41 7.079 -9.047 27.946 1.00 1.77 O ATOM 0 H ASP B 41 4.610 -9.260 31.306 1.00 0.21 H new ATOM 0 HA ASP B 41 6.762 -11.313 31.663 1.00 0.21 H new ATOM 0 HB2 ASP B 41 7.452 -11.082 29.358 1.00 0.19 H new ATOM 0 HB3 ASP B 41 5.717 -11.296 29.245 1.00 0.19 H new ATOM 1546 N ASP B 42 8.417 -9.432 31.956 1.00 0.27 N ATOM 1547 CA ASP B 42 9.298 -8.272 32.284 1.00 0.32 C ATOM 1548 C ASP B 42 8.554 -7.230 33.131 1.00 0.32 C ATOM 1549 O ASP B 42 8.696 -6.041 32.928 1.00 0.37 O ATOM 1550 CB ASP B 42 9.679 -7.682 30.927 1.00 0.37 C ATOM 1551 CG ASP B 42 10.557 -6.447 31.134 1.00 0.45 C ATOM 1552 OD1 ASP B 42 10.933 -6.194 32.266 1.00 1.14 O ATOM 1553 OD2 ASP B 42 10.839 -5.775 30.155 1.00 1.21 O ATOM 0 H ASP B 42 8.856 -10.348 32.043 1.00 0.27 H new ATOM 0 HA ASP B 42 10.166 -8.575 32.869 1.00 0.32 H new ATOM 0 HB2 ASP B 42 10.212 -8.424 30.333 1.00 0.37 H new ATOM 0 HB3 ASP B 42 8.781 -7.413 30.371 1.00 0.37 H new ATOM 1558 N GLU B 43 7.841 -7.660 34.138 1.00 0.29 N ATOM 1559 CA GLU B 43 7.184 -6.682 35.060 1.00 0.30 C ATOM 1560 C GLU B 43 6.264 -5.740 34.279 1.00 0.29 C ATOM 1561 O GLU B 43 5.816 -4.731 34.787 1.00 0.30 O ATOM 1562 CB GLU B 43 8.335 -5.902 35.696 1.00 0.34 C ATOM 1563 CG GLU B 43 9.224 -6.860 36.492 1.00 1.17 C ATOM 1564 CD GLU B 43 10.332 -6.069 37.189 1.00 1.34 C ATOM 1565 OE1 GLU B 43 10.464 -4.891 36.900 1.00 1.68 O ATOM 1566 OE2 GLU B 43 11.030 -6.654 38.001 1.00 1.92 O ATOM 0 H GLU B 43 7.684 -8.642 34.363 1.00 0.29 H new ATOM 0 HA GLU B 43 6.563 -7.178 35.806 1.00 0.30 H new ATOM 0 HB2 GLU B 43 8.920 -5.403 34.924 1.00 0.34 H new ATOM 0 HB3 GLU B 43 7.943 -5.124 36.351 1.00 0.34 H new ATOM 0 HG2 GLU B 43 8.628 -7.398 37.229 1.00 1.17 H new ATOM 0 HG3 GLU B 43 9.659 -7.606 35.827 1.00 1.17 H new ATOM 1573 N LYS B 44 5.918 -6.103 33.076 1.00 0.29 N ATOM 1574 CA LYS B 44 4.955 -5.276 32.294 1.00 0.30 C ATOM 1575 C LYS B 44 3.839 -6.166 31.740 1.00 0.27 C ATOM 1576 O LYS B 44 3.944 -7.376 31.739 1.00 0.26 O ATOM 1577 CB LYS B 44 5.779 -4.662 31.160 1.00 0.34 C ATOM 1578 CG LYS B 44 6.615 -5.750 30.484 1.00 1.29 C ATOM 1579 CD LYS B 44 7.354 -5.154 29.284 1.00 1.23 C ATOM 1580 CE LYS B 44 8.445 -4.201 29.777 1.00 1.90 C ATOM 1581 NZ LYS B 44 9.351 -4.016 28.609 1.00 2.00 N ATOM 0 H LYS B 44 6.260 -6.937 32.599 1.00 0.29 H new ATOM 0 HA LYS B 44 4.478 -4.506 32.900 1.00 0.30 H new ATOM 0 HB2 LYS B 44 5.119 -4.191 30.431 1.00 0.34 H new ATOM 0 HB3 LYS B 44 6.430 -3.880 31.552 1.00 0.34 H new ATOM 0 HG2 LYS B 44 7.329 -6.168 31.193 1.00 1.29 H new ATOM 0 HG3 LYS B 44 5.972 -6.568 30.159 1.00 1.29 H new ATOM 0 HD2 LYS B 44 7.796 -5.950 28.684 1.00 1.23 H new ATOM 0 HD3 LYS B 44 6.654 -4.621 28.641 1.00 1.23 H new ATOM 0 HE2 LYS B 44 8.022 -3.251 30.103 1.00 1.90 H new ATOM 0 HE3 LYS B 44 8.980 -4.620 30.629 1.00 1.90 H new ATOM 0 HZ1 LYS B 44 9.595 -3.009 28.515 1.00 2.00 H new ATOM 0 HZ2 LYS B 44 10.219 -4.571 28.751 1.00 2.00 H new ATOM 0 HZ3 LYS B 44 8.872 -4.338 27.744 1.00 2.00 H new ATOM 1595 N ILE B 45 2.726 -5.586 31.388 1.00 0.28 N ATOM 1596 CA ILE B 45 1.554 -6.414 30.979 1.00 0.26 C ATOM 1597 C ILE B 45 1.374 -6.383 29.459 1.00 0.26 C ATOM 1598 O ILE B 45 1.356 -5.332 28.851 1.00 0.29 O ATOM 1599 CB ILE B 45 0.359 -5.756 31.667 1.00 0.29 C ATOM 1600 CG1 ILE B 45 0.627 -5.661 33.170 1.00 0.33 C ATOM 1601 CG2 ILE B 45 -0.896 -6.597 31.427 1.00 0.28 C ATOM 1602 CD1 ILE B 45 -0.395 -4.720 33.810 1.00 1.24 C ATOM 0 H ILE B 45 2.576 -4.577 31.365 1.00 0.28 H new ATOM 0 HA ILE B 45 1.673 -7.461 31.258 1.00 0.26 H new ATOM 0 HB ILE B 45 0.210 -4.757 31.258 1.00 0.29 H new ATOM 0 HG12 ILE B 45 0.563 -6.649 33.625 1.00 0.33 H new ATOM 0 HG13 ILE B 45 1.638 -5.293 33.348 1.00 0.33 H new ATOM 0 HG21 ILE B 45 -1.748 -6.127 31.918 1.00 0.28 H new ATOM 0 HG22 ILE B 45 -1.088 -6.667 30.356 1.00 0.28 H new ATOM 0 HG23 ILE B 45 -0.748 -7.597 31.835 1.00 0.28 H new ATOM 0 HD11 ILE B 45 -0.205 -4.651 34.881 1.00 1.24 H new ATOM 0 HD12 ILE B 45 -0.309 -3.730 33.362 1.00 1.24 H new ATOM 0 HD13 ILE B 45 -1.400 -5.107 33.644 1.00 1.24 H new ATOM 1614 N ILE B 46 1.169 -7.521 28.855 1.00 0.26 N ATOM 1615 CA ILE B 46 0.907 -7.557 27.386 1.00 0.29 C ATOM 1616 C ILE B 46 -0.534 -8.001 27.117 1.00 0.28 C ATOM 1617 O ILE B 46 -0.935 -9.088 27.475 1.00 0.31 O ATOM 1618 CB ILE B 46 1.897 -8.588 26.841 1.00 0.32 C ATOM 1619 CG1 ILE B 46 3.315 -8.029 26.939 1.00 0.44 C ATOM 1620 CG2 ILE B 46 1.567 -8.905 25.381 1.00 0.37 C ATOM 1621 CD1 ILE B 46 4.308 -9.187 27.017 1.00 0.50 C ATOM 0 H ILE B 46 1.171 -8.431 29.316 1.00 0.26 H new ATOM 0 HA ILE B 46 1.030 -6.581 26.916 1.00 0.29 H new ATOM 0 HB ILE B 46 1.825 -9.504 27.428 1.00 0.32 H new ATOM 0 HG12 ILE B 46 3.533 -7.405 26.072 1.00 0.44 H new ATOM 0 HG13 ILE B 46 3.408 -7.394 27.820 1.00 0.44 H new ATOM 0 HG21 ILE B 46 2.276 -9.640 24.999 1.00 0.37 H new ATOM 0 HG22 ILE B 46 0.556 -9.308 25.316 1.00 0.37 H new ATOM 0 HG23 ILE B 46 1.634 -7.994 24.787 1.00 0.37 H new ATOM 0 HD11 ILE B 46 5.322 -8.793 27.087 1.00 0.50 H new ATOM 0 HD12 ILE B 46 4.092 -9.792 27.897 1.00 0.50 H new ATOM 0 HD13 ILE B 46 4.219 -9.803 26.122 1.00 0.50 H new ATOM 1633 N LEU B 47 -1.306 -7.178 26.462 1.00 0.28 N ATOM 1634 CA LEU B 47 -2.709 -7.570 26.141 1.00 0.29 C ATOM 1635 C LEU B 47 -2.853 -7.822 24.640 1.00 0.31 C ATOM 1636 O LEU B 47 -2.367 -7.062 23.825 1.00 0.38 O ATOM 1637 CB LEU B 47 -3.569 -6.379 26.563 1.00 0.34 C ATOM 1638 CG LEU B 47 -3.379 -6.109 28.057 1.00 0.90 C ATOM 1639 CD1 LEU B 47 -2.052 -5.384 28.282 1.00 1.66 C ATOM 1640 CD2 LEU B 47 -4.528 -5.233 28.562 1.00 1.23 C ATOM 0 H LEU B 47 -1.027 -6.253 26.135 1.00 0.28 H new ATOM 0 HA LEU B 47 -3.005 -8.486 26.653 1.00 0.29 H new ATOM 0 HB2 LEU B 47 -3.293 -5.496 25.986 1.00 0.34 H new ATOM 0 HB3 LEU B 47 -4.619 -6.583 26.351 1.00 0.34 H new ATOM 0 HG LEU B 47 -3.372 -7.054 28.600 1.00 0.90 H new ATOM 0 HD11 LEU B 47 -1.918 -5.192 29.347 1.00 1.66 H new ATOM 0 HD12 LEU B 47 -1.232 -6.004 27.919 1.00 1.66 H new ATOM 0 HD13 LEU B 47 -2.058 -4.438 27.741 1.00 1.66 H new ATOM 0 HD21 LEU B 47 -4.396 -5.038 29.626 1.00 1.23 H new ATOM 0 HD22 LEU B 47 -4.532 -4.288 28.018 1.00 1.23 H new ATOM 0 HD23 LEU B 47 -5.475 -5.748 28.402 1.00 1.23 H new ATOM 1652 N LYS B 48 -3.511 -8.885 24.271 1.00 0.28 N ATOM 1653 CA LYS B 48 -3.681 -9.195 22.823 1.00 0.34 C ATOM 1654 C LYS B 48 -5.086 -9.744 22.560 1.00 0.27 C ATOM 1655 O LYS B 48 -5.760 -10.201 23.460 1.00 0.24 O ATOM 1656 CB LYS B 48 -2.623 -10.259 22.522 1.00 0.47 C ATOM 1657 CG LYS B 48 -2.861 -11.483 23.408 1.00 0.65 C ATOM 1658 CD LYS B 48 -1.793 -12.539 23.114 1.00 0.85 C ATOM 1659 CE LYS B 48 -0.430 -12.034 23.595 1.00 1.54 C ATOM 1660 NZ LYS B 48 0.275 -11.598 22.358 1.00 1.74 N ATOM 0 H LYS B 48 -3.940 -9.554 24.910 1.00 0.28 H new ATOM 0 HA LYS B 48 -3.564 -8.313 22.194 1.00 0.34 H new ATOM 0 HB2 LYS B 48 -2.668 -10.544 21.471 1.00 0.47 H new ATOM 0 HB3 LYS B 48 -1.626 -9.856 22.701 1.00 0.47 H new ATOM 0 HG2 LYS B 48 -2.826 -11.197 24.459 1.00 0.65 H new ATOM 0 HG3 LYS B 48 -3.854 -11.893 23.222 1.00 0.65 H new ATOM 0 HD2 LYS B 48 -2.044 -13.474 23.615 1.00 0.85 H new ATOM 0 HD3 LYS B 48 -1.758 -12.749 22.045 1.00 0.85 H new ATOM 0 HE2 LYS B 48 -0.540 -11.209 24.299 1.00 1.54 H new ATOM 0 HE3 LYS B 48 0.124 -12.820 24.109 1.00 1.54 H new ATOM 0 HZ1 LYS B 48 0.878 -10.778 22.573 1.00 1.74 H new ATOM 0 HZ2 LYS B 48 0.864 -12.377 22.001 1.00 1.74 H new ATOM 0 HZ3 LYS B 48 -0.424 -11.333 21.635 1.00 1.74 H new ATOM 1674 N LYS B 49 -5.513 -9.746 21.327 1.00 0.28 N ATOM 1675 CA LYS B 49 -6.853 -10.317 21.009 1.00 0.25 C ATOM 1676 C LYS B 49 -6.920 -11.776 21.461 1.00 0.22 C ATOM 1677 O LYS B 49 -5.927 -12.474 21.489 1.00 0.24 O ATOM 1678 CB LYS B 49 -6.982 -10.222 19.490 1.00 0.28 C ATOM 1679 CG LYS B 49 -8.368 -10.708 19.064 1.00 0.30 C ATOM 1680 CD LYS B 49 -8.474 -10.676 17.538 1.00 0.54 C ATOM 1681 CE LYS B 49 -9.904 -11.021 17.117 1.00 1.08 C ATOM 1682 NZ LYS B 49 -10.473 -9.743 16.605 1.00 1.65 N ATOM 0 H LYS B 49 -4.995 -9.379 20.529 1.00 0.28 H new ATOM 0 HA LYS B 49 -7.658 -9.785 21.516 1.00 0.25 H new ATOM 0 HB2 LYS B 49 -6.830 -9.193 19.165 1.00 0.28 H new ATOM 0 HB3 LYS B 49 -6.210 -10.824 19.011 1.00 0.28 H new ATOM 0 HG2 LYS B 49 -8.538 -11.721 19.430 1.00 0.30 H new ATOM 0 HG3 LYS B 49 -9.138 -10.076 19.506 1.00 0.30 H new ATOM 0 HD2 LYS B 49 -8.202 -9.689 17.165 1.00 0.54 H new ATOM 0 HD3 LYS B 49 -7.773 -11.386 17.099 1.00 0.54 H new ATOM 0 HE2 LYS B 49 -9.914 -11.794 16.348 1.00 1.08 H new ATOM 0 HE3 LYS B 49 -10.483 -11.402 17.959 1.00 1.08 H new ATOM 0 HZ1 LYS B 49 -11.454 -9.899 16.296 1.00 1.65 H new ATOM 0 HZ2 LYS B 49 -10.457 -9.028 17.361 1.00 1.65 H new ATOM 0 HZ3 LYS B 49 -9.906 -9.408 15.800 1.00 1.65 H new ATOM 1696 N TYR B 50 -8.070 -12.219 21.886 1.00 0.20 N ATOM 1697 CA TYR B 50 -8.177 -13.606 22.420 1.00 0.22 C ATOM 1698 C TYR B 50 -8.893 -14.515 21.418 1.00 0.25 C ATOM 1699 O TYR B 50 -10.065 -14.353 21.144 1.00 0.20 O ATOM 1700 CB TYR B 50 -9.002 -13.468 23.699 1.00 0.22 C ATOM 1701 CG TYR B 50 -9.166 -14.823 24.341 1.00 0.30 C ATOM 1702 CD1 TYR B 50 -8.135 -15.766 24.259 1.00 0.38 C ATOM 1703 CD2 TYR B 50 -10.350 -15.138 25.018 1.00 0.41 C ATOM 1704 CE1 TYR B 50 -8.289 -17.024 24.853 1.00 0.48 C ATOM 1705 CE2 TYR B 50 -10.503 -16.395 25.613 1.00 0.52 C ATOM 1706 CZ TYR B 50 -9.473 -17.339 25.531 1.00 0.53 C ATOM 1707 OH TYR B 50 -9.624 -18.578 26.117 1.00 0.65 O ATOM 0 H TYR B 50 -8.938 -11.683 21.887 1.00 0.20 H new ATOM 0 HA TYR B 50 -7.200 -14.052 22.604 1.00 0.22 H new ATOM 0 HB2 TYR B 50 -8.510 -12.784 24.390 1.00 0.22 H new ATOM 0 HB3 TYR B 50 -9.979 -13.042 23.470 1.00 0.22 H new ATOM 0 HD1 TYR B 50 -7.221 -15.523 23.738 1.00 0.38 H new ATOM 0 HD2 TYR B 50 -11.146 -14.410 25.081 1.00 0.41 H new ATOM 0 HE1 TYR B 50 -7.494 -17.752 24.788 1.00 0.48 H new ATOM 0 HE2 TYR B 50 -11.416 -16.637 26.136 1.00 0.52 H new ATOM 0 HH TYR B 50 -10.503 -18.632 26.547 1.00 0.65 H new ATOM 1717 N LYS B 51 -8.217 -15.517 20.927 1.00 0.38 N ATOM 1718 CA LYS B 51 -8.880 -16.485 20.006 1.00 0.44 C ATOM 1719 C LYS B 51 -8.977 -17.862 20.667 1.00 1.25 C ATOM 1720 O LYS B 51 -7.989 -18.556 20.804 1.00 2.08 O ATOM 1721 CB LYS B 51 -7.975 -16.543 18.774 1.00 1.27 C ATOM 1722 CG LYS B 51 -8.027 -15.203 18.038 1.00 2.06 C ATOM 1723 CD LYS B 51 -8.881 -15.347 16.775 1.00 2.71 C ATOM 1724 CE LYS B 51 -7.981 -15.701 15.589 1.00 3.57 C ATOM 1725 NZ LYS B 51 -8.566 -16.950 15.024 1.00 4.35 N ATOM 0 H LYS B 51 -7.234 -15.708 21.123 1.00 0.38 H new ATOM 0 HA LYS B 51 -9.896 -16.184 19.751 1.00 0.44 H new ATOM 0 HB2 LYS B 51 -6.951 -16.766 19.072 1.00 1.27 H new ATOM 0 HB3 LYS B 51 -8.296 -17.347 18.111 1.00 1.27 H new ATOM 0 HG2 LYS B 51 -8.446 -14.435 18.688 1.00 2.06 H new ATOM 0 HG3 LYS B 51 -7.019 -14.882 17.774 1.00 2.06 H new ATOM 0 HD2 LYS B 51 -9.634 -16.122 16.918 1.00 2.71 H new ATOM 0 HD3 LYS B 51 -9.415 -14.418 16.576 1.00 2.71 H new ATOM 0 HE2 LYS B 51 -7.969 -14.900 14.849 1.00 3.57 H new ATOM 0 HE3 LYS B 51 -6.950 -15.856 15.908 1.00 3.57 H new ATOM 0 HZ1 LYS B 51 -8.003 -17.257 14.205 1.00 4.35 H new ATOM 0 HZ2 LYS B 51 -8.558 -17.696 15.749 1.00 4.35 H new ATOM 0 HZ3 LYS B 51 -9.545 -16.770 14.723 1.00 4.35 H new ATOM 1739 N PRO B 52 -10.171 -18.208 21.061 1.00 1.79 N ATOM 1740 CA PRO B 52 -10.406 -19.514 21.725 1.00 2.79 C ATOM 1741 C PRO B 52 -9.904 -20.658 20.840 1.00 2.90 C ATOM 1742 O PRO B 52 -9.978 -20.597 19.628 1.00 3.05 O ATOM 1743 CB PRO B 52 -11.924 -19.580 21.888 1.00 3.58 C ATOM 1744 CG PRO B 52 -12.404 -18.167 21.769 1.00 3.28 C ATOM 1745 CD PRO B 52 -11.401 -17.422 20.928 1.00 2.28 C ATOM 0 HA PRO B 52 -9.881 -19.607 22.676 1.00 2.79 H new ATOM 0 HB2 PRO B 52 -12.373 -20.212 21.122 1.00 3.58 H new ATOM 0 HB3 PRO B 52 -12.196 -20.006 22.853 1.00 3.58 H new ATOM 0 HG2 PRO B 52 -13.391 -18.134 21.308 1.00 3.28 H new ATOM 0 HG3 PRO B 52 -12.496 -17.708 22.754 1.00 3.28 H new ATOM 0 HD2 PRO B 52 -11.722 -17.357 19.888 1.00 2.28 H new ATOM 0 HD3 PRO B 52 -11.262 -16.401 21.283 1.00 2.28 H new ATOM 1753 N ASN B 53 -9.391 -21.699 21.435 1.00 3.43 N ATOM 1754 CA ASN B 53 -8.880 -22.844 20.626 1.00 4.01 C ATOM 1755 C ASN B 53 -9.625 -24.129 21.001 1.00 4.61 C ATOM 1756 O ASN B 53 -10.825 -24.057 21.202 1.00 5.09 O ATOM 1757 CB ASN B 53 -7.399 -22.957 20.991 1.00 4.59 C ATOM 1758 CG ASN B 53 -6.666 -21.688 20.549 1.00 5.20 C ATOM 1759 OD1 ASN B 53 -7.168 -20.935 19.739 1.00 5.34 O ATOM 1760 ND2 ASN B 53 -5.493 -21.419 21.052 1.00 5.97 N ATOM 1761 OXT ASN B 53 -8.980 -25.162 21.078 1.00 4.97 O ATOM 0 H ASN B 53 -9.303 -21.808 22.445 1.00 3.43 H new ATOM 0 HA ASN B 53 -9.026 -22.692 19.556 1.00 4.01 H new ATOM 0 HB2 ASN B 53 -7.288 -23.098 22.066 1.00 4.59 H new ATOM 0 HB3 ASN B 53 -6.960 -23.830 20.508 1.00 4.59 H new ATOM 0 HD21 ASN B 53 -4.996 -20.576 20.765 1.00 5.97 H new ATOM 0 HD22 ASN B 53 -5.072 -22.052 21.732 1.00 5.97 H new TER 1768 ASN B 53