USER MOD reduce.3.24.130724 H: found=0, std=0, add=735, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 162 TYR OH : rot -97:sc= 0.263 USER MOD Set 1.2: A 216 GLN : amide:sc= -0.0777 K(o=0.18,f=-2.5) USER MOD Set 2.1: A 185 GLN : amide:sc= -0.19 K(o=-0.21,f=1.9) USER MOD Set 2.2: A 189 THR OG1 : rot -140:sc= -0.0199 USER MOD Set 3.1: A 159 GLN : amide:sc= 0.243 K(o=0.48,f=1.8) USER MOD Set 3.2: A 161 TYR OH : rot 180:sc= 0.235 USER MOD Set 4.1: A 152 ASN : amide:sc= -23.9! C(o=-33!,f=-37!) USER MOD Set 4.2: A 153 MET CE :methyl -170:sc= -8.76! (180deg=-7.22!) USER MOD Set 5.1: A 134 SER OG : rot 150:sc= -1.2 USER MOD Set 5.2: A 215 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 133 MET CE :methyl -115:sc= -4.82! (180deg=-10.8!) USER MOD Set 6.2: A 212 MET CE :methyl 159:sc= -6.79! (180deg=-9.01!) USER MOD Set 6.3: A 219 GLN : amide:sc= -1.33 K(o=-13,f=-19!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl -152:sc= -2.53! (180deg=-4.08!) USER MOD Single : A 131 SER OG : rot 180:sc= 0.0152 USER MOD Single : A 139 HIS : no HE2:sc= -1.29 K(o=-1.3,f=-4.5!) USER MOD Single : A 142 ASN : amide:sc= -0.866 K(o=-0.87,f=-0.095) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot -155:sc= 1.32 USER MOD Single : A 149 TYR OH : rot 30:sc= -0.175 USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -27:sc= 0.743 USER MOD Single : A 158 ASN : amide:sc= -0.248! C(o=-0.25!,f=-8.6!) USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN : amide:sc= -7! C(o=-7!,f=-15!) USER MOD Single : A 172 ASN : amide:sc= -4.9! C(o=-4.9!,f=-2.6!) USER MOD Single : A 173 ASN : amide:sc=-0.00465 K(o=-0.0047,f=-0.91) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 180 ASN : amide:sc= -0.994 K(o=-0.99,f=-3.2!) USER MOD Single : A 182 THR OG1 : rot -85:sc= -4.89! USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 HIS : no HE2:sc= -4.9! C(o=-4.9!,f=-5.1!) USER MOD Single : A 187 THR OG1 : rot 77:sc= 0.922 USER MOD Single : A 190 THR OG1 : rot 103:sc= 1.19 USER MOD Single : A 196 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.7!) USER MOD Single : A 198 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -130:sc= -10.8! (180deg=-17.9!) USER MOD Single : A 211 GLN : amide:sc= -2.56! K(o=-2.6!,f=-0.87) USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 218 GLN : amide:sc= -2.66! K(o=-2.7!,f=-0.073) USER MOD Single : A 221 SER OG : rot -83:sc= 0.674 USER MOD Single : A 222 GLN : amide:sc= -0.498 K(o=-0.5,f=-1) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 9.653 -10.391 3.028 1.00 0.57 N ATOM 35 CA TYR A 127 9.293 -9.131 2.395 1.00 0.44 C ATOM 36 C TYR A 127 8.842 -8.190 3.470 1.00 0.40 C ATOM 37 O TYR A 127 7.678 -8.204 3.875 1.00 0.60 O ATOM 38 CB TYR A 127 8.177 -9.292 1.356 1.00 0.46 C ATOM 39 CG TYR A 127 8.493 -10.271 0.246 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.212 -9.880 -0.877 1.00 1.10 C ATOM 41 CD2 TYR A 127 8.077 -11.596 0.330 1.00 1.09 C ATOM 42 CE1 TYR A 127 9.507 -10.782 -1.885 1.00 1.26 C ATOM 43 CE2 TYR A 127 8.366 -12.500 -0.672 1.00 1.30 C ATOM 44 CZ TYR A 127 9.081 -12.091 -1.777 1.00 1.17 C ATOM 45 OH TYR A 127 9.379 -12.996 -2.772 1.00 1.41 O ATOM 0 HA TYR A 127 10.165 -8.748 1.865 1.00 0.44 H new ATOM 0 HB2 TYR A 127 7.269 -9.618 1.863 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.964 -8.318 0.915 1.00 0.46 H new ATOM 0 HD1 TYR A 127 9.546 -8.857 -0.965 1.00 1.10 H new ATOM 0 HD2 TYR A 127 7.518 -11.923 1.194 1.00 1.09 H new ATOM 0 HE1 TYR A 127 10.068 -10.463 -2.751 1.00 1.26 H new ATOM 0 HE2 TYR A 127 8.033 -13.524 -0.591 1.00 1.30 H new ATOM 0 HH TYR A 127 9.007 -13.872 -2.540 1.00 1.41 H new ATOM 55 N MET A 128 9.808 -7.441 3.949 1.00 0.42 N ATOM 56 CA MET A 128 9.636 -6.443 4.983 1.00 0.37 C ATOM 57 C MET A 128 8.296 -5.739 4.883 1.00 0.31 C ATOM 58 O MET A 128 8.024 -5.019 3.917 1.00 0.30 O ATOM 59 CB MET A 128 10.774 -5.443 4.846 1.00 0.45 C ATOM 60 CG MET A 128 11.222 -4.840 6.143 1.00 0.90 C ATOM 61 SD MET A 128 10.189 -3.466 6.679 1.00 1.18 S ATOM 62 CE MET A 128 10.035 -2.569 5.139 1.00 0.45 C ATOM 0 H MET A 128 10.770 -7.511 3.618 1.00 0.42 H new ATOM 0 HA MET A 128 9.654 -6.927 5.959 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.624 -5.939 4.376 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.461 -4.643 4.175 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.220 -5.610 6.914 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.251 -4.494 6.040 1.00 0.90 H new ATOM 0 HE1 MET A 128 9.884 -1.510 5.348 1.00 0.45 H new ATOM 0 HE2 MET A 128 10.944 -2.697 4.551 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.183 -2.953 4.578 1.00 0.45 H new ATOM 72 N LEU A 129 7.440 -6.000 5.864 1.00 0.32 N ATOM 73 CA LEU A 129 6.189 -5.287 5.976 1.00 0.28 C ATOM 74 C LEU A 129 6.486 -3.806 5.979 1.00 0.26 C ATOM 75 O LEU A 129 7.192 -3.327 6.860 1.00 0.30 O ATOM 76 CB LEU A 129 5.437 -5.684 7.261 1.00 0.33 C ATOM 77 CG LEU A 129 4.083 -5.000 7.497 1.00 0.35 C ATOM 78 CD1 LEU A 129 3.134 -5.950 8.207 1.00 0.87 C ATOM 79 CD2 LEU A 129 4.258 -3.740 8.327 1.00 0.80 C ATOM 0 H LEU A 129 7.596 -6.701 6.589 1.00 0.32 H new ATOM 0 HA LEU A 129 5.549 -5.542 5.131 1.00 0.28 H new ATOM 0 HB2 LEU A 129 5.277 -6.762 7.244 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.081 -5.470 8.114 1.00 0.33 H new ATOM 0 HG LEU A 129 3.664 -4.728 6.528 1.00 0.35 H new ATOM 0 HD11 LEU A 129 2.177 -5.454 8.369 1.00 0.87 H new ATOM 0 HD12 LEU A 129 2.983 -6.839 7.594 1.00 0.87 H new ATOM 0 HD13 LEU A 129 3.560 -6.239 9.168 1.00 0.87 H new ATOM 0 HD21 LEU A 129 3.287 -3.270 8.483 1.00 0.80 H new ATOM 0 HD22 LEU A 129 4.696 -3.997 9.291 1.00 0.80 H new ATOM 0 HD23 LEU A 129 4.916 -3.047 7.803 1.00 0.80 H new ATOM 91 N GLY A 130 6.000 -3.114 4.955 1.00 0.23 N ATOM 92 CA GLY A 130 6.058 -1.676 4.924 1.00 0.25 C ATOM 93 C GLY A 130 5.371 -1.114 6.136 1.00 0.21 C ATOM 94 O GLY A 130 4.180 -0.813 6.076 1.00 0.20 O ATOM 0 H GLY A 130 5.562 -3.537 4.137 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.096 -1.345 4.897 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.581 -1.303 4.018 1.00 0.25 H new ATOM 98 N SER A 131 6.131 -1.108 7.233 1.00 0.26 N ATOM 99 CA SER A 131 5.715 -0.657 8.569 1.00 0.31 C ATOM 100 C SER A 131 4.605 0.378 8.548 1.00 0.23 C ATOM 101 O SER A 131 4.859 1.583 8.575 1.00 0.29 O ATOM 102 CB SER A 131 6.928 -0.107 9.319 1.00 0.53 C ATOM 103 OG SER A 131 7.993 -1.047 9.316 1.00 1.41 O ATOM 0 H SER A 131 7.098 -1.432 7.217 1.00 0.26 H new ATOM 0 HA SER A 131 5.306 -1.528 9.081 1.00 0.31 H new ATOM 0 HB2 SER A 131 7.257 0.823 8.855 1.00 0.53 H new ATOM 0 HB3 SER A 131 6.649 0.130 10.346 1.00 0.53 H new ATOM 0 HG SER A 131 8.760 -0.674 9.800 1.00 1.41 H new ATOM 109 N ALA A 132 3.374 -0.125 8.482 1.00 0.23 N ATOM 110 CA ALA A 132 2.172 0.702 8.481 1.00 0.24 C ATOM 111 C ALA A 132 2.241 1.823 7.442 1.00 0.21 C ATOM 112 O ALA A 132 1.545 2.837 7.554 1.00 0.31 O ATOM 113 CB ALA A 132 1.907 1.246 9.871 1.00 0.33 C ATOM 0 H ALA A 132 3.183 -1.125 8.427 1.00 0.23 H new ATOM 0 HA ALA A 132 1.333 0.068 8.193 1.00 0.24 H new ATOM 0 HB1 ALA A 132 1.007 1.861 9.856 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.768 0.418 10.566 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.755 1.851 10.193 1.00 0.33 H new ATOM 119 N MET A 133 3.041 1.592 6.403 1.00 0.16 N ATOM 120 CA MET A 133 3.168 2.512 5.280 1.00 0.21 C ATOM 121 C MET A 133 3.467 3.932 5.749 1.00 0.29 C ATOM 122 O MET A 133 3.948 4.147 6.861 1.00 0.55 O ATOM 123 CB MET A 133 1.890 2.466 4.432 1.00 0.20 C ATOM 124 CG MET A 133 1.783 1.197 3.597 1.00 0.26 C ATOM 125 SD MET A 133 0.162 0.947 2.846 1.00 0.41 S ATOM 126 CE MET A 133 -0.142 2.519 2.055 1.00 0.22 C ATOM 0 H MET A 133 3.621 0.757 6.318 1.00 0.16 H new ATOM 0 HA MET A 133 4.013 2.197 4.667 1.00 0.21 H new ATOM 0 HB2 MET A 133 1.022 2.539 5.087 1.00 0.20 H new ATOM 0 HB3 MET A 133 1.866 3.333 3.772 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.536 1.228 2.809 1.00 0.26 H new ATOM 0 HG3 MET A 133 2.016 0.339 4.227 1.00 0.26 H new ATOM 0 HE1 MET A 133 -0.995 3.005 2.528 1.00 0.22 H new ATOM 0 HE2 MET A 133 0.739 3.153 2.155 1.00 0.22 H new ATOM 0 HE3 MET A 133 -0.355 2.359 0.998 1.00 0.22 H new ATOM 136 N SER A 134 3.215 4.895 4.889 1.00 0.47 N ATOM 137 CA SER A 134 3.374 6.286 5.253 1.00 0.56 C ATOM 138 C SER A 134 2.033 6.869 5.673 1.00 0.61 C ATOM 139 O SER A 134 1.935 8.057 5.990 1.00 0.74 O ATOM 140 CB SER A 134 3.946 7.063 4.069 1.00 0.65 C ATOM 141 OG SER A 134 3.171 6.844 2.899 1.00 1.52 O ATOM 0 H SER A 134 2.899 4.740 3.932 1.00 0.47 H new ATOM 0 HA SER A 134 4.064 6.364 6.093 1.00 0.56 H new ATOM 0 HB2 SER A 134 3.967 8.127 4.303 1.00 0.65 H new ATOM 0 HB3 SER A 134 4.977 6.756 3.891 1.00 0.65 H new ATOM 0 HG SER A 134 3.212 7.638 2.326 1.00 1.52 H new ATOM 147 N ARG A 135 1.014 6.005 5.702 1.00 0.61 N ATOM 148 CA ARG A 135 -0.371 6.434 5.892 1.00 0.76 C ATOM 149 C ARG A 135 -0.711 7.557 4.927 1.00 0.75 C ATOM 150 O ARG A 135 -1.018 8.674 5.342 1.00 1.14 O ATOM 151 CB ARG A 135 -0.589 6.899 7.315 1.00 1.01 C ATOM 152 CG ARG A 135 -1.530 6.019 8.103 1.00 0.98 C ATOM 153 CD ARG A 135 -2.907 5.977 7.465 1.00 1.57 C ATOM 154 NE ARG A 135 -3.853 5.253 8.314 1.00 2.57 N ATOM 155 CZ ARG A 135 -4.672 5.832 9.197 1.00 3.27 C ATOM 156 NH1 ARG A 135 -4.671 7.151 9.362 1.00 3.37 N ATOM 157 NH2 ARG A 135 -5.483 5.080 9.932 1.00 4.17 N ATOM 0 H ARG A 135 1.126 4.997 5.595 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.024 5.584 5.694 1.00 0.76 H new ATOM 0 HB2 ARG A 135 0.373 6.938 7.827 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -0.983 7.915 7.300 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -1.123 5.009 8.163 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -1.611 6.391 9.124 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -3.266 6.993 7.297 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -2.846 5.496 6.489 1.00 1.57 H new ATOM 0 HE ARG A 135 -3.890 4.237 8.226 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -4.040 7.733 8.811 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -5.301 7.581 10.039 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -5.479 4.066 9.821 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -6.110 5.516 10.608 1.00 4.17 H new ATOM 171 N PRO A 136 -0.623 7.274 3.624 1.00 0.54 N ATOM 172 CA PRO A 136 -0.934 8.231 2.567 1.00 0.50 C ATOM 173 C PRO A 136 -2.249 8.958 2.786 1.00 0.51 C ATOM 174 O PRO A 136 -2.275 10.186 2.886 1.00 0.57 O ATOM 175 CB PRO A 136 -1.041 7.349 1.316 1.00 0.55 C ATOM 176 CG PRO A 136 -1.037 5.953 1.829 1.00 0.62 C ATOM 177 CD PRO A 136 -0.209 5.992 3.051 1.00 0.59 C ATOM 0 HA PRO A 136 -0.180 9.016 2.511 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -1.953 7.562 0.759 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -0.206 7.523 0.638 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -2.048 5.612 2.049 1.00 0.62 H new ATOM 0 HG3 PRO A 136 -0.621 5.264 1.093 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -0.417 5.155 3.718 1.00 0.59 H new ATOM 0 HD3 PRO A 136 0.858 5.964 2.828 1.00 0.59 H new ATOM 185 N LEU A 137 -3.330 8.180 2.881 1.00 0.50 N ATOM 186 CA LEU A 137 -4.678 8.727 2.903 1.00 0.54 C ATOM 187 C LEU A 137 -4.842 9.677 1.734 1.00 0.58 C ATOM 188 O LEU A 137 -4.816 10.898 1.881 1.00 0.99 O ATOM 189 CB LEU A 137 -4.976 9.407 4.234 1.00 0.59 C ATOM 190 CG LEU A 137 -4.906 8.473 5.438 1.00 0.64 C ATOM 191 CD1 LEU A 137 -5.155 9.241 6.719 1.00 0.97 C ATOM 192 CD2 LEU A 137 -5.910 7.335 5.291 1.00 0.90 C ATOM 0 H LEU A 137 -3.291 7.163 2.944 1.00 0.50 H new ATOM 0 HA LEU A 137 -5.401 7.918 2.802 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.269 10.224 4.379 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -5.971 9.851 4.189 1.00 0.59 H new ATOM 0 HG LEU A 137 -3.905 8.043 5.484 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -5.101 8.560 7.568 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -4.399 10.019 6.830 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -6.144 9.698 6.683 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -5.846 6.679 6.159 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -6.917 7.745 5.220 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -5.686 6.766 4.389 1.00 0.90 H new ATOM 204 N ILE A 138 -4.968 9.070 0.564 1.00 0.55 N ATOM 205 CA ILE A 138 -4.919 9.766 -0.715 1.00 0.64 C ATOM 206 C ILE A 138 -5.947 10.883 -0.824 1.00 0.61 C ATOM 207 O ILE A 138 -5.785 11.775 -1.650 1.00 1.10 O ATOM 208 CB ILE A 138 -5.149 8.772 -1.873 1.00 0.91 C ATOM 209 CG1 ILE A 138 -4.310 7.518 -1.668 1.00 1.07 C ATOM 210 CG2 ILE A 138 -4.797 9.413 -3.207 1.00 1.17 C ATOM 211 CD1 ILE A 138 -2.831 7.760 -1.821 1.00 0.63 C ATOM 0 H ILE A 138 -5.109 8.064 0.474 1.00 0.55 H new ATOM 0 HA ILE A 138 -3.927 10.214 -0.780 1.00 0.64 H new ATOM 0 HB ILE A 138 -6.204 8.498 -1.882 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -4.505 7.117 -0.673 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -4.623 6.758 -2.384 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -4.966 8.696 -4.011 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -5.424 10.291 -3.366 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -3.749 9.712 -3.202 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -2.291 6.826 -1.662 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.625 8.132 -2.825 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -2.505 8.497 -1.087 1.00 0.63 H new ATOM 223 N HIS A 139 -6.994 10.823 0.014 1.00 0.40 N ATOM 224 CA HIS A 139 -8.150 11.743 -0.012 1.00 0.41 C ATOM 225 C HIS A 139 -8.886 11.735 -1.353 1.00 0.46 C ATOM 226 O HIS A 139 -10.075 12.035 -1.394 1.00 0.82 O ATOM 227 CB HIS A 139 -7.851 13.187 0.486 1.00 0.53 C ATOM 228 CG HIS A 139 -6.492 13.742 0.177 1.00 0.65 C ATOM 229 ND1 HIS A 139 -5.374 13.405 0.902 1.00 0.86 N ATOM 230 CD2 HIS A 139 -6.067 14.585 -0.792 1.00 1.13 C ATOM 231 CE1 HIS A 139 -4.321 14.006 0.394 1.00 1.07 C ATOM 232 NE2 HIS A 139 -4.706 14.732 -0.639 1.00 1.28 N ATOM 0 H HIS A 139 -7.065 10.118 0.747 1.00 0.40 H new ATOM 0 HA HIS A 139 -8.831 11.329 0.732 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -8.597 13.856 0.056 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -7.989 13.209 1.567 1.00 0.53 H new ATOM 0 HD1 HIS A 139 -5.363 12.783 1.711 1.00 0.86 H new ATOM 0 HD2 HIS A 139 -6.681 15.055 -1.546 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -3.309 13.920 0.761 1.00 1.07 H new ATOM 241 N PHE A 140 -8.181 11.398 -2.433 1.00 0.45 N ATOM 242 CA PHE A 140 -8.788 11.081 -3.727 1.00 0.41 C ATOM 243 C PHE A 140 -9.309 12.321 -4.447 1.00 0.46 C ATOM 244 O PHE A 140 -9.319 12.380 -5.678 1.00 0.64 O ATOM 245 CB PHE A 140 -9.916 10.059 -3.532 1.00 0.38 C ATOM 246 CG PHE A 140 -10.677 9.745 -4.787 1.00 0.70 C ATOM 247 CD1 PHE A 140 -10.142 8.892 -5.729 1.00 0.74 C ATOM 248 CD2 PHE A 140 -11.922 10.303 -5.020 1.00 1.23 C ATOM 249 CE1 PHE A 140 -10.833 8.595 -6.887 1.00 1.19 C ATOM 250 CE2 PHE A 140 -12.620 10.011 -6.177 1.00 1.74 C ATOM 251 CZ PHE A 140 -12.073 9.155 -7.112 1.00 1.70 C ATOM 0 H PHE A 140 -7.163 11.337 -2.435 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.010 10.654 -4.360 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -9.492 9.136 -3.135 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -10.611 10.438 -2.783 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -9.171 8.451 -5.559 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -12.352 10.973 -4.291 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -10.403 7.925 -7.616 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -13.591 10.451 -6.349 1.00 1.74 H new ATOM 0 HZ PHE A 140 -12.615 8.925 -8.017 1.00 1.70 H new ATOM 261 N GLY A 141 -9.697 13.313 -3.681 1.00 0.47 N ATOM 262 CA GLY A 141 -10.450 14.414 -4.214 1.00 0.53 C ATOM 263 C GLY A 141 -11.874 14.328 -3.730 1.00 0.48 C ATOM 264 O GLY A 141 -12.718 15.156 -4.075 1.00 0.54 O ATOM 0 H GLY A 141 -9.500 13.376 -2.682 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -10.005 15.359 -3.901 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -10.423 14.394 -5.303 1.00 0.53 H new ATOM 268 N ASN A 142 -12.133 13.304 -2.921 1.00 0.41 N ATOM 269 CA ASN A 142 -13.432 13.105 -2.326 1.00 0.45 C ATOM 270 C ASN A 142 -13.231 12.597 -0.920 1.00 0.47 C ATOM 271 O ASN A 142 -12.770 11.484 -0.745 1.00 0.46 O ATOM 272 CB ASN A 142 -14.239 12.067 -3.104 1.00 0.48 C ATOM 273 CG ASN A 142 -15.680 12.486 -3.348 1.00 1.22 C ATOM 274 OD1 ASN A 142 -16.299 12.063 -4.324 1.00 1.71 O ATOM 275 ND2 ASN A 142 -16.227 13.332 -2.483 1.00 1.88 N ATOM 0 H ASN A 142 -11.444 12.596 -2.666 1.00 0.41 H new ATOM 0 HA ASN A 142 -13.976 14.050 -2.337 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -13.754 11.884 -4.063 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -14.230 11.125 -2.557 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -17.187 13.650 -2.618 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -15.687 13.664 -1.684 1.00 1.88 H new ATOM 282 N ASP A 143 -13.547 13.410 0.070 1.00 0.54 N ATOM 283 CA ASP A 143 -13.464 12.993 1.465 1.00 0.57 C ATOM 284 C ASP A 143 -14.308 11.750 1.711 1.00 0.52 C ATOM 285 O ASP A 143 -14.098 11.044 2.680 1.00 0.52 O ATOM 286 CB ASP A 143 -13.895 14.111 2.412 1.00 0.72 C ATOM 287 CG ASP A 143 -15.394 14.325 2.450 1.00 1.04 C ATOM 288 OD1 ASP A 143 -15.970 14.713 1.412 1.00 1.14 O ATOM 289 OD2 ASP A 143 -16.011 14.083 3.512 1.00 1.39 O ATOM 0 H ASP A 143 -13.866 14.370 -0.063 1.00 0.54 H new ATOM 0 HA ASP A 143 -12.420 12.757 1.669 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -13.543 13.881 3.418 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -13.411 15.040 2.110 1.00 0.72 H new ATOM 294 N TYR A 144 -15.262 11.505 0.825 1.00 0.53 N ATOM 295 CA TYR A 144 -16.021 10.264 0.831 1.00 0.55 C ATOM 296 C TYR A 144 -15.058 9.094 0.658 1.00 0.45 C ATOM 297 O TYR A 144 -15.098 8.120 1.403 1.00 0.47 O ATOM 298 CB TYR A 144 -17.044 10.296 -0.307 1.00 0.63 C ATOM 299 CG TYR A 144 -18.113 9.225 -0.230 1.00 0.82 C ATOM 300 CD1 TYR A 144 -17.818 7.894 -0.494 1.00 0.90 C ATOM 301 CD2 TYR A 144 -19.423 9.554 0.095 1.00 1.15 C ATOM 302 CE1 TYR A 144 -18.795 6.922 -0.435 1.00 1.19 C ATOM 303 CE2 TYR A 144 -20.407 8.585 0.153 1.00 1.41 C ATOM 304 CZ TYR A 144 -20.086 7.272 -0.113 1.00 1.40 C ATOM 305 OH TYR A 144 -21.064 6.303 -0.061 1.00 1.70 O ATOM 0 H TYR A 144 -15.530 12.156 0.087 1.00 0.53 H new ATOM 0 HA TYR A 144 -16.553 10.147 1.775 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -17.528 11.273 -0.315 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -16.516 10.195 -1.255 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -16.806 7.615 -0.750 1.00 0.90 H new ATOM 0 HD2 TYR A 144 -19.676 10.583 0.306 1.00 1.15 H new ATOM 0 HE1 TYR A 144 -18.548 5.891 -0.641 1.00 1.19 H new ATOM 0 HE2 TYR A 144 -21.422 8.856 0.405 1.00 1.41 H new ATOM 0 HH TYR A 144 -21.920 6.715 0.181 1.00 1.70 H new ATOM 315 N GLU A 145 -14.167 9.226 -0.319 1.00 0.39 N ATOM 316 CA GLU A 145 -13.120 8.246 -0.547 1.00 0.34 C ATOM 317 C GLU A 145 -11.961 8.447 0.400 1.00 0.33 C ATOM 318 O GLU A 145 -11.274 7.494 0.749 1.00 0.34 O ATOM 319 CB GLU A 145 -12.582 8.310 -1.945 1.00 0.34 C ATOM 320 CG GLU A 145 -13.238 7.344 -2.914 1.00 0.43 C ATOM 321 CD GLU A 145 -14.672 7.698 -3.236 1.00 1.12 C ATOM 322 OE1 GLU A 145 -15.571 7.300 -2.478 1.00 2.20 O ATOM 323 OE2 GLU A 145 -14.902 8.371 -4.262 1.00 1.23 O ATOM 0 H GLU A 145 -14.153 10.011 -0.970 1.00 0.39 H new ATOM 0 HA GLU A 145 -13.583 7.274 -0.378 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -12.706 9.325 -2.323 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -11.511 8.108 -1.919 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -12.661 7.320 -3.838 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -13.205 6.339 -2.492 1.00 0.43 H new ATOM 330 N ASP A 146 -11.715 9.691 0.790 1.00 0.37 N ATOM 331 CA ASP A 146 -10.677 9.965 1.762 1.00 0.45 C ATOM 332 C ASP A 146 -10.952 9.148 2.990 1.00 0.45 C ATOM 333 O ASP A 146 -10.107 8.416 3.509 1.00 0.49 O ATOM 334 CB ASP A 146 -10.614 11.439 2.146 1.00 0.56 C ATOM 335 CG ASP A 146 -9.677 11.688 3.315 1.00 1.11 C ATOM 336 OD1 ASP A 146 -8.447 11.628 3.119 1.00 1.44 O ATOM 337 OD2 ASP A 146 -10.164 11.932 4.442 1.00 1.40 O ATOM 0 H ASP A 146 -12.215 10.513 0.451 1.00 0.37 H new ATOM 0 HA ASP A 146 -9.717 9.704 1.316 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -10.283 12.023 1.287 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -11.614 11.789 2.403 1.00 0.56 H new ATOM 342 N ARG A 147 -12.186 9.269 3.395 1.00 0.47 N ATOM 343 CA ARG A 147 -12.751 8.489 4.453 1.00 0.52 C ATOM 344 C ARG A 147 -12.723 7.014 4.082 1.00 0.50 C ATOM 345 O ARG A 147 -12.447 6.164 4.912 1.00 0.54 O ATOM 346 CB ARG A 147 -14.183 8.987 4.687 1.00 0.57 C ATOM 347 CG ARG A 147 -15.104 7.988 5.368 1.00 0.66 C ATOM 348 CD ARG A 147 -15.688 7.015 4.365 1.00 0.69 C ATOM 349 NE ARG A 147 -17.024 7.406 3.934 1.00 1.11 N ATOM 350 CZ ARG A 147 -17.979 6.538 3.612 1.00 1.15 C ATOM 351 NH1 ARG A 147 -17.737 5.233 3.653 1.00 1.34 N ATOM 352 NH2 ARG A 147 -19.182 6.971 3.267 1.00 1.94 N ATOM 0 H ARG A 147 -12.842 9.933 2.984 1.00 0.47 H new ATOM 0 HA ARG A 147 -12.176 8.599 5.372 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -14.143 9.893 5.292 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -14.618 9.264 3.726 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -14.551 7.440 6.131 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -15.909 8.518 5.876 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -15.032 6.953 3.497 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -15.727 6.020 4.807 1.00 0.69 H new ATOM 0 HE ARG A 147 -17.239 8.401 3.876 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -16.817 4.894 3.932 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -18.472 4.570 3.405 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -19.378 7.972 3.248 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -19.913 6.304 3.020 1.00 1.94 H new ATOM 366 N TYR A 148 -12.989 6.736 2.817 1.00 0.45 N ATOM 367 CA TYR A 148 -13.149 5.373 2.336 1.00 0.46 C ATOM 368 C TYR A 148 -11.865 4.572 2.475 1.00 0.44 C ATOM 369 O TYR A 148 -11.897 3.359 2.570 1.00 0.57 O ATOM 370 CB TYR A 148 -13.623 5.394 0.884 1.00 0.47 C ATOM 371 CG TYR A 148 -14.195 4.092 0.397 1.00 0.49 C ATOM 372 CD1 TYR A 148 -15.314 3.539 0.999 1.00 0.71 C ATOM 373 CD2 TYR A 148 -13.624 3.424 -0.675 1.00 0.38 C ATOM 374 CE1 TYR A 148 -15.847 2.351 0.546 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.153 2.238 -1.134 1.00 0.43 C ATOM 376 CZ TYR A 148 -15.265 1.705 -0.521 1.00 0.60 C ATOM 377 OH TYR A 148 -15.797 0.523 -0.978 1.00 0.68 O ATOM 0 H TYR A 148 -13.100 7.448 2.095 1.00 0.45 H new ATOM 0 HA TYR A 148 -13.900 4.879 2.952 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -14.378 6.172 0.773 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -12.784 5.670 0.245 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -15.775 4.045 1.834 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -12.752 3.840 -1.157 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -16.717 1.929 1.026 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -13.698 1.729 -1.971 1.00 0.43 H new ATOM 0 HH TYR A 148 -15.101 0.005 -1.433 1.00 0.68 H new ATOM 387 N TYR A 149 -10.752 5.271 2.481 1.00 0.41 N ATOM 388 CA TYR A 149 -9.441 4.687 2.682 1.00 0.43 C ATOM 389 C TYR A 149 -9.055 4.797 4.142 1.00 0.41 C ATOM 390 O TYR A 149 -8.473 3.888 4.706 1.00 0.40 O ATOM 391 CB TYR A 149 -8.392 5.458 1.913 1.00 0.54 C ATOM 392 CG TYR A 149 -8.762 5.800 0.489 1.00 0.67 C ATOM 393 CD1 TYR A 149 -9.585 4.961 -0.253 1.00 1.40 C ATOM 394 CD2 TYR A 149 -8.286 6.952 -0.117 1.00 0.97 C ATOM 395 CE1 TYR A 149 -9.922 5.265 -1.558 1.00 2.09 C ATOM 396 CE2 TYR A 149 -8.619 7.260 -1.420 1.00 1.54 C ATOM 397 CZ TYR A 149 -9.453 6.441 -2.125 1.00 2.08 C ATOM 398 OH TYR A 149 -9.761 6.734 -3.434 1.00 2.82 O ATOM 0 H TYR A 149 -10.730 6.281 2.344 1.00 0.41 H new ATOM 0 HA TYR A 149 -9.487 3.650 2.349 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.178 6.383 2.448 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -7.471 4.876 1.903 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -9.967 4.057 0.198 1.00 1.40 H new ATOM 0 HD2 TYR A 149 -7.644 7.619 0.439 1.00 0.97 H new ATOM 0 HE1 TYR A 149 -10.544 4.594 -2.131 1.00 2.09 H new ATOM 0 HE2 TYR A 149 -8.219 8.150 -1.883 1.00 1.54 H new ATOM 0 HH TYR A 149 -10.628 6.339 -3.662 1.00 2.82 H new ATOM 408 N ARG A 150 -9.368 5.940 4.752 1.00 0.45 N ATOM 409 CA ARG A 150 -9.055 6.159 6.162 1.00 0.48 C ATOM 410 C ARG A 150 -9.779 5.118 6.991 1.00 0.50 C ATOM 411 O ARG A 150 -9.422 4.821 8.131 1.00 0.60 O ATOM 412 CB ARG A 150 -9.455 7.576 6.605 1.00 0.56 C ATOM 413 CG ARG A 150 -10.869 7.679 7.167 1.00 0.59 C ATOM 414 CD ARG A 150 -11.340 9.121 7.289 1.00 1.15 C ATOM 415 NE ARG A 150 -10.496 9.929 8.163 1.00 1.83 N ATOM 416 CZ ARG A 150 -10.959 10.901 8.949 1.00 2.65 C ATOM 417 NH1 ARG A 150 -12.268 11.105 9.053 1.00 2.97 N ATOM 418 NH2 ARG A 150 -10.116 11.655 9.642 1.00 3.59 N ATOM 0 H ARG A 150 -9.835 6.723 4.295 1.00 0.45 H new ATOM 0 HA ARG A 150 -7.979 6.064 6.309 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -8.750 7.921 7.361 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -9.365 8.250 5.753 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -11.554 7.129 6.522 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -10.903 7.204 8.148 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -11.364 9.574 6.298 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -12.361 9.132 7.669 1.00 1.15 H new ATOM 0 HE ARG A 150 -9.494 9.739 8.173 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -12.919 10.518 8.531 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -12.622 11.849 9.655 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -9.111 11.492 9.574 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -10.472 12.398 10.243 1.00 3.59 H new ATOM 432 N GLU A 151 -10.800 4.568 6.369 1.00 0.44 N ATOM 433 CA GLU A 151 -11.612 3.549 6.947 1.00 0.48 C ATOM 434 C GLU A 151 -11.119 2.214 6.457 1.00 0.44 C ATOM 435 O GLU A 151 -11.292 1.181 7.102 1.00 0.50 O ATOM 436 CB GLU A 151 -13.060 3.787 6.527 1.00 0.54 C ATOM 437 CG GLU A 151 -13.528 2.944 5.346 1.00 0.49 C ATOM 438 CD GLU A 151 -15.037 2.896 5.225 1.00 0.60 C ATOM 439 OE1 GLU A 151 -15.640 3.902 4.801 1.00 0.73 O ATOM 440 OE2 GLU A 151 -15.632 1.851 5.570 1.00 0.83 O ATOM 0 H GLU A 151 -11.085 4.832 5.426 1.00 0.44 H new ATOM 0 HA GLU A 151 -11.556 3.566 8.035 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -13.709 3.586 7.379 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -13.182 4.840 6.275 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -13.106 3.349 4.426 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -13.144 1.930 5.454 1.00 0.49 H new ATOM 447 N ASN A 152 -10.469 2.250 5.307 1.00 0.40 N ATOM 448 CA ASN A 152 -10.116 1.038 4.644 1.00 0.43 C ATOM 449 C ASN A 152 -8.690 0.643 4.949 1.00 0.37 C ATOM 450 O ASN A 152 -8.225 -0.408 4.524 1.00 0.36 O ATOM 451 CB ASN A 152 -10.398 1.083 3.137 1.00 0.62 C ATOM 452 CG ASN A 152 -9.261 1.551 2.246 1.00 0.67 C ATOM 453 OD1 ASN A 152 -8.100 1.379 2.523 1.00 1.69 O ATOM 454 ND2 ASN A 152 -9.614 2.111 1.124 1.00 0.48 N ATOM 0 H ASN A 152 -10.183 3.104 4.828 1.00 0.40 H new ATOM 0 HA ASN A 152 -10.764 0.257 5.043 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -10.693 0.084 2.816 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -11.253 1.738 2.970 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -8.902 2.414 0.459 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -10.602 2.247 0.910 1.00 0.48 H new ATOM 461 N MET A 153 -7.997 1.485 5.693 1.00 0.35 N ATOM 462 CA MET A 153 -6.567 1.324 5.911 1.00 0.34 C ATOM 463 C MET A 153 -6.238 0.066 6.691 1.00 0.33 C ATOM 464 O MET A 153 -5.081 -0.193 7.018 1.00 0.36 O ATOM 465 CB MET A 153 -5.950 2.547 6.590 1.00 0.36 C ATOM 466 CG MET A 153 -4.813 3.193 5.819 1.00 0.69 C ATOM 467 SD MET A 153 -5.340 4.165 4.404 1.00 0.61 S ATOM 468 CE MET A 153 -5.950 2.863 3.357 1.00 0.34 C ATOM 0 H MET A 153 -8.404 2.295 6.161 1.00 0.35 H new ATOM 0 HA MET A 153 -6.124 1.225 4.920 1.00 0.34 H new ATOM 0 HB2 MET A 153 -6.731 3.290 6.750 1.00 0.36 H new ATOM 0 HB3 MET A 153 -5.584 2.254 7.574 1.00 0.36 H new ATOM 0 HG2 MET A 153 -4.249 3.834 6.496 1.00 0.69 H new ATOM 0 HG3 MET A 153 -4.132 2.413 5.477 1.00 0.69 H new ATOM 0 HE1 MET A 153 -6.155 3.261 2.363 1.00 0.34 H new ATOM 0 HE2 MET A 153 -5.202 2.074 3.285 1.00 0.34 H new ATOM 0 HE3 MET A 153 -6.868 2.455 3.781 1.00 0.34 H new ATOM 478 N TYR A 154 -7.254 -0.683 7.024 1.00 0.33 N ATOM 479 CA TYR A 154 -7.081 -1.949 7.689 1.00 0.36 C ATOM 480 C TYR A 154 -7.333 -3.099 6.723 1.00 0.34 C ATOM 481 O TYR A 154 -7.362 -4.262 7.127 1.00 0.39 O ATOM 482 CB TYR A 154 -8.052 -2.032 8.860 1.00 0.47 C ATOM 483 CG TYR A 154 -7.913 -0.906 9.863 1.00 0.60 C ATOM 484 CD1 TYR A 154 -8.441 0.351 9.606 1.00 0.68 C ATOM 485 CD2 TYR A 154 -7.244 -1.104 11.066 1.00 0.76 C ATOM 486 CE1 TYR A 154 -8.305 1.379 10.519 1.00 0.83 C ATOM 487 CE2 TYR A 154 -7.108 -0.084 11.983 1.00 0.92 C ATOM 488 CZ TYR A 154 -7.680 1.162 11.702 1.00 0.95 C ATOM 489 OH TYR A 154 -7.501 2.175 12.614 1.00 1.10 O ATOM 0 H TYR A 154 -8.226 -0.434 6.842 1.00 0.33 H new ATOM 0 HA TYR A 154 -6.056 -2.026 8.052 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -9.071 -2.035 8.473 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -7.903 -2.982 9.374 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -8.966 0.528 8.679 1.00 0.68 H new ATOM 0 HD2 TYR A 154 -6.824 -2.074 11.286 1.00 0.76 H new ATOM 0 HE1 TYR A 154 -8.698 2.358 10.289 1.00 0.83 H new ATOM 0 HE2 TYR A 154 -6.568 -0.244 12.905 1.00 0.92 H new ATOM 0 HH TYR A 154 -7.034 1.827 13.402 1.00 1.10 H new ATOM 499 N ARG A 155 -7.498 -2.779 5.445 1.00 0.30 N ATOM 500 CA ARG A 155 -7.870 -3.788 4.468 1.00 0.31 C ATOM 501 C ARG A 155 -7.412 -3.427 3.050 1.00 0.25 C ATOM 502 O ARG A 155 -6.924 -4.279 2.320 1.00 0.26 O ATOM 503 CB ARG A 155 -9.371 -4.013 4.544 1.00 0.41 C ATOM 504 CG ARG A 155 -10.213 -2.924 3.930 1.00 0.60 C ATOM 505 CD ARG A 155 -10.714 -1.935 4.968 1.00 0.43 C ATOM 506 NE ARG A 155 -11.096 -2.554 6.236 1.00 0.95 N ATOM 507 CZ ARG A 155 -12.091 -3.442 6.391 1.00 1.23 C ATOM 508 NH1 ARG A 155 -12.802 -3.853 5.348 1.00 1.36 N ATOM 509 NH2 ARG A 155 -12.372 -3.907 7.601 1.00 1.92 N ATOM 0 H ARG A 155 -7.381 -1.839 5.067 1.00 0.30 H new ATOM 0 HA ARG A 155 -7.355 -4.718 4.709 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.607 -4.955 4.050 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -9.654 -4.123 5.591 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -9.628 -2.394 3.178 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -11.064 -3.371 3.415 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -9.937 -1.194 5.156 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -11.573 -1.400 4.562 1.00 0.43 H new ATOM 0 HE ARG A 155 -10.566 -2.291 7.067 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -12.595 -3.494 4.416 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -13.555 -4.528 5.479 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -11.833 -3.590 8.407 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -13.127 -4.582 7.725 1.00 1.92 H new ATOM 523 N TYR A 156 -7.565 -2.171 2.659 1.00 0.26 N ATOM 524 CA TYR A 156 -6.987 -1.675 1.419 1.00 0.24 C ATOM 525 C TYR A 156 -5.912 -0.712 1.869 1.00 0.24 C ATOM 526 O TYR A 156 -5.833 0.434 1.434 1.00 0.29 O ATOM 527 CB TYR A 156 -8.071 -0.986 0.580 1.00 0.28 C ATOM 528 CG TYR A 156 -9.411 -1.699 0.628 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.492 -3.082 0.599 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.594 -0.984 0.679 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.714 -3.731 0.619 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.820 -1.622 0.701 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.857 -3.020 0.759 1.00 0.56 C ATOM 534 OH TYR A 156 -13.095 -3.629 0.686 1.00 0.65 O ATOM 0 H TYR A 156 -8.088 -1.472 3.187 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.574 -2.459 0.785 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.199 0.037 0.933 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.736 -0.926 -0.456 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.584 -3.665 0.560 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.559 0.095 0.702 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.756 -4.806 0.523 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.736 -1.050 0.674 1.00 0.49 H new ATOM 0 HH TYR A 156 -13.032 -4.432 0.127 1.00 0.65 H new ATOM 544 N PRO A 157 -5.013 -1.246 2.704 1.00 0.21 N ATOM 545 CA PRO A 157 -4.660 -0.627 3.960 1.00 0.22 C ATOM 546 C PRO A 157 -3.402 0.214 3.985 1.00 0.23 C ATOM 547 O PRO A 157 -2.843 0.581 2.956 1.00 0.25 O ATOM 548 CB PRO A 157 -4.442 -1.892 4.759 1.00 0.21 C ATOM 549 CG PRO A 157 -3.590 -2.693 3.850 1.00 0.21 C ATOM 550 CD PRO A 157 -4.159 -2.445 2.476 1.00 0.22 C ATOM 0 HA PRO A 157 -5.405 0.096 4.291 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -3.948 -1.693 5.710 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.381 -2.397 4.987 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.547 -2.383 3.909 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.622 -3.752 4.107 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.378 -2.255 1.740 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.738 -3.295 2.115 1.00 0.22 H new ATOM 558 N ASN A 158 -2.981 0.511 5.211 1.00 0.24 N ATOM 559 CA ASN A 158 -1.728 1.179 5.459 1.00 0.27 C ATOM 560 C ASN A 158 -0.678 0.169 5.855 1.00 0.32 C ATOM 561 O ASN A 158 0.014 0.336 6.833 1.00 0.57 O ATOM 562 CB ASN A 158 -1.854 2.284 6.529 1.00 0.29 C ATOM 563 CG ASN A 158 -2.489 1.844 7.856 1.00 1.07 C ATOM 564 OD1 ASN A 158 -3.274 2.590 8.441 1.00 1.56 O ATOM 565 ND2 ASN A 158 -2.132 0.677 8.367 1.00 1.86 N ATOM 0 H ASN A 158 -3.508 0.290 6.056 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.426 1.671 4.534 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -0.860 2.682 6.735 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -2.445 3.101 6.116 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -2.509 0.377 9.266 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -1.480 0.077 7.862 1.00 1.86 H new ATOM 572 N GLN A 159 -0.598 -0.912 5.117 1.00 0.22 N ATOM 573 CA GLN A 159 0.545 -1.799 5.242 1.00 0.23 C ATOM 574 C GLN A 159 0.792 -2.575 3.971 1.00 0.21 C ATOM 575 O GLN A 159 -0.135 -2.946 3.248 1.00 0.24 O ATOM 576 CB GLN A 159 0.419 -2.748 6.427 1.00 0.25 C ATOM 577 CG GLN A 159 -0.811 -3.639 6.396 1.00 0.25 C ATOM 578 CD GLN A 159 -0.958 -4.452 7.664 1.00 0.42 C ATOM 579 OE1 GLN A 159 -1.601 -4.025 8.621 1.00 0.87 O ATOM 580 NE2 GLN A 159 -0.351 -5.624 7.687 1.00 0.63 N ATOM 0 H GLN A 159 -1.297 -1.200 4.432 1.00 0.22 H new ATOM 0 HA GLN A 159 1.407 -1.157 5.425 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.307 -3.379 6.467 1.00 0.25 H new ATOM 0 HB3 GLN A 159 0.403 -2.161 7.345 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.700 -3.024 6.255 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -0.750 -4.311 5.540 1.00 0.25 H new ATOM 0 HE21 GLN A 159 0.173 -5.943 6.872 1.00 0.63 H new ATOM 0 HE22 GLN A 159 -0.406 -6.211 8.520 1.00 0.63 H new ATOM 589 N VAL A 160 2.061 -2.820 3.717 1.00 0.20 N ATOM 590 CA VAL A 160 2.497 -3.482 2.516 1.00 0.18 C ATOM 591 C VAL A 160 3.633 -4.404 2.839 1.00 0.20 C ATOM 592 O VAL A 160 4.093 -4.436 3.968 1.00 0.26 O ATOM 593 CB VAL A 160 2.923 -2.525 1.413 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.713 -2.081 0.614 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.664 -1.345 1.994 1.00 0.23 C ATOM 0 H VAL A 160 2.821 -2.561 4.346 1.00 0.20 H new ATOM 0 HA VAL A 160 1.638 -4.035 2.136 1.00 0.18 H new ATOM 0 HB VAL A 160 3.604 -3.042 0.737 1.00 0.20 H new ATOM 0 HG11 VAL A 160 2.028 -1.396 -0.173 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.233 -2.951 0.167 1.00 0.22 H new ATOM 0 HG13 VAL A 160 1.007 -1.576 1.273 1.00 0.22 H new ATOM 0 HG21 VAL A 160 3.961 -0.671 1.191 1.00 0.23 H new ATOM 0 HG22 VAL A 160 3.015 -0.815 2.691 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.552 -1.696 2.520 1.00 0.23 H new ATOM 605 N TYR A 161 4.029 -5.212 1.891 1.00 0.20 N ATOM 606 CA TYR A 161 5.104 -6.147 2.128 1.00 0.24 C ATOM 607 C TYR A 161 6.082 -6.148 0.963 1.00 0.31 C ATOM 608 O TYR A 161 5.861 -6.780 -0.056 1.00 0.62 O ATOM 609 CB TYR A 161 4.510 -7.525 2.299 1.00 0.26 C ATOM 610 CG TYR A 161 3.389 -7.609 3.316 1.00 0.60 C ATOM 611 CD1 TYR A 161 2.079 -7.291 2.980 1.00 1.05 C ATOM 612 CD2 TYR A 161 3.650 -8.007 4.623 1.00 0.71 C ATOM 613 CE1 TYR A 161 1.064 -7.370 3.916 1.00 1.60 C ATOM 614 CE2 TYR A 161 2.645 -8.092 5.561 1.00 1.25 C ATOM 615 CZ TYR A 161 1.310 -7.755 5.159 1.00 1.70 C ATOM 616 OH TYR A 161 0.347 -7.851 6.142 1.00 2.25 O ATOM 0 H TYR A 161 3.629 -5.244 0.953 1.00 0.20 H new ATOM 0 HA TYR A 161 5.648 -5.855 3.026 1.00 0.24 H new ATOM 0 HB2 TYR A 161 4.134 -7.866 1.335 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.302 -8.213 2.594 1.00 0.26 H new ATOM 0 HD1 TYR A 161 1.850 -6.977 1.972 1.00 1.05 H new ATOM 0 HD2 TYR A 161 4.662 -8.255 4.908 1.00 0.71 H new ATOM 0 HE1 TYR A 161 0.055 -7.114 3.629 1.00 1.60 H new ATOM 0 HE2 TYR A 161 2.857 -8.404 6.573 1.00 1.25 H new ATOM 0 HH TYR A 161 0.761 -8.155 6.977 1.00 2.25 H new ATOM 626 N TYR A 162 7.185 -5.486 1.142 1.00 0.27 N ATOM 627 CA TYR A 162 8.139 -5.301 0.070 1.00 0.35 C ATOM 628 C TYR A 162 9.524 -5.527 0.591 1.00 0.41 C ATOM 629 O TYR A 162 9.743 -5.651 1.790 1.00 0.46 O ATOM 630 CB TYR A 162 8.006 -3.900 -0.554 1.00 0.41 C ATOM 631 CG TYR A 162 8.643 -2.795 0.260 1.00 0.47 C ATOM 632 CD1 TYR A 162 8.296 -2.598 1.588 1.00 0.62 C ATOM 633 CD2 TYR A 162 9.606 -1.960 -0.297 1.00 0.79 C ATOM 634 CE1 TYR A 162 8.892 -1.611 2.339 1.00 0.78 C ATOM 635 CE2 TYR A 162 10.204 -0.965 0.450 1.00 0.92 C ATOM 636 CZ TYR A 162 9.845 -0.797 1.767 1.00 0.83 C ATOM 637 OH TYR A 162 10.443 0.185 2.521 1.00 1.03 O ATOM 0 H TYR A 162 7.456 -5.058 2.027 1.00 0.27 H new ATOM 0 HA TYR A 162 7.933 -6.027 -0.716 1.00 0.35 H new ATOM 0 HB2 TYR A 162 8.458 -3.912 -1.546 1.00 0.41 H new ATOM 0 HB3 TYR A 162 6.948 -3.673 -0.688 1.00 0.41 H new ATOM 0 HD1 TYR A 162 7.546 -3.230 2.040 1.00 0.62 H new ATOM 0 HD2 TYR A 162 9.890 -2.092 -1.330 1.00 0.79 H new ATOM 0 HE1 TYR A 162 8.614 -1.475 3.374 1.00 0.78 H new ATOM 0 HE2 TYR A 162 10.949 -0.323 0.003 1.00 0.92 H new ATOM 0 HH TYR A 162 9.989 1.039 2.365 1.00 1.03 H new ATOM 647 N ARG A 163 10.458 -5.575 -0.306 1.00 0.49 N ATOM 648 CA ARG A 163 11.814 -5.797 0.072 1.00 0.56 C ATOM 649 C ARG A 163 12.443 -4.422 0.175 1.00 0.60 C ATOM 650 O ARG A 163 12.144 -3.556 -0.645 1.00 0.68 O ATOM 651 CB ARG A 163 12.503 -6.644 -0.992 1.00 0.71 C ATOM 652 CG ARG A 163 13.826 -7.179 -0.538 1.00 0.89 C ATOM 653 CD ARG A 163 13.689 -8.546 0.105 1.00 1.18 C ATOM 654 NE ARG A 163 14.991 -9.166 0.337 1.00 1.82 N ATOM 655 CZ ARG A 163 15.175 -10.481 0.456 1.00 2.23 C ATOM 656 NH1 ARG A 163 14.134 -11.304 0.438 1.00 2.21 N ATOM 657 NH2 ARG A 163 16.397 -10.974 0.622 1.00 3.01 N ATOM 0 H ARG A 163 10.304 -5.463 -1.308 1.00 0.49 H new ATOM 0 HA ARG A 163 11.903 -6.333 1.017 1.00 0.56 H new ATOM 0 HB2 ARG A 163 11.854 -7.476 -1.265 1.00 0.71 H new ATOM 0 HB3 ARG A 163 12.647 -6.044 -1.891 1.00 0.71 H new ATOM 0 HG2 ARG A 163 14.504 -7.244 -1.389 1.00 0.89 H new ATOM 0 HG3 ARG A 163 14.274 -6.486 0.174 1.00 0.89 H new ATOM 0 HD2 ARG A 163 13.157 -8.451 1.052 1.00 1.18 H new ATOM 0 HD3 ARG A 163 13.088 -9.191 -0.536 1.00 1.18 H new ATOM 0 HE ARG A 163 15.806 -8.558 0.412 1.00 1.82 H new ATOM 0 HH11 ARG A 163 13.191 -10.931 0.333 1.00 2.21 H new ATOM 0 HH12 ARG A 163 14.277 -12.310 0.529 1.00 2.21 H new ATOM 0 HH21 ARG A 163 17.200 -10.346 0.659 1.00 3.01 H new ATOM 0 HH22 ARG A 163 16.533 -11.981 0.713 1.00 3.01 H new ATOM 671 N PRO A 164 13.323 -4.176 1.152 1.00 0.61 N ATOM 672 CA PRO A 164 13.632 -2.835 1.570 1.00 0.66 C ATOM 673 C PRO A 164 14.827 -2.299 0.836 1.00 0.65 C ATOM 674 O PRO A 164 15.868 -2.943 0.708 1.00 0.73 O ATOM 675 CB PRO A 164 13.953 -3.002 3.065 1.00 0.72 C ATOM 676 CG PRO A 164 13.976 -4.483 3.316 1.00 0.71 C ATOM 677 CD PRO A 164 14.059 -5.129 1.964 1.00 0.62 C ATOM 0 HA PRO A 164 12.822 -2.133 1.373 1.00 0.66 H new ATOM 0 HB2 PRO A 164 14.913 -2.549 3.312 1.00 0.72 H new ATOM 0 HB3 PRO A 164 13.201 -2.512 3.683 1.00 0.72 H new ATOM 0 HG2 PRO A 164 14.829 -4.761 3.935 1.00 0.71 H new ATOM 0 HG3 PRO A 164 13.080 -4.803 3.847 1.00 0.71 H new ATOM 0 HD2 PRO A 164 15.089 -5.248 1.627 1.00 0.62 H new ATOM 0 HD3 PRO A 164 13.603 -6.119 1.952 1.00 0.62 H new ATOM 685 N VAL A 165 14.627 -1.112 0.341 1.00 0.60 N ATOM 686 CA VAL A 165 15.522 -0.491 -0.576 1.00 0.63 C ATOM 687 C VAL A 165 16.318 0.585 0.132 1.00 0.59 C ATOM 688 O VAL A 165 15.852 1.177 1.086 1.00 0.62 O ATOM 689 CB VAL A 165 14.711 0.072 -1.781 1.00 0.72 C ATOM 690 CG1 VAL A 165 13.302 0.496 -1.398 1.00 0.63 C ATOM 691 CG2 VAL A 165 15.398 1.252 -2.419 1.00 0.82 C ATOM 0 H VAL A 165 13.815 -0.540 0.573 1.00 0.60 H new ATOM 0 HA VAL A 165 16.235 -1.219 -0.963 1.00 0.63 H new ATOM 0 HB VAL A 165 14.652 -0.753 -2.491 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.786 0.880 -2.278 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.758 -0.362 -1.004 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.351 1.275 -0.637 1.00 0.63 H new ATOM 0 HG21 VAL A 165 14.799 1.614 -3.255 1.00 0.82 H new ATOM 0 HG22 VAL A 165 15.512 2.048 -1.683 1.00 0.82 H new ATOM 0 HG23 VAL A 165 16.380 0.949 -2.781 1.00 0.82 H new ATOM 701 N ASP A 166 17.550 0.759 -0.273 1.00 0.68 N ATOM 702 CA ASP A 166 18.322 1.905 0.165 1.00 0.72 C ATOM 703 C ASP A 166 17.574 3.169 -0.189 1.00 0.94 C ATOM 704 O ASP A 166 17.139 3.929 0.674 1.00 1.54 O ATOM 705 CB ASP A 166 19.651 1.926 -0.562 1.00 1.14 C ATOM 706 CG ASP A 166 20.683 0.987 0.021 1.00 1.67 C ATOM 707 OD1 ASP A 166 21.421 1.404 0.937 1.00 2.37 O ATOM 708 OD2 ASP A 166 20.771 -0.168 -0.447 1.00 2.09 O ATOM 0 H ASP A 166 18.043 0.127 -0.903 1.00 0.68 H new ATOM 0 HA ASP A 166 18.481 1.842 1.241 1.00 0.72 H new ATOM 0 HB2 ASP A 166 19.486 1.665 -1.607 1.00 1.14 H new ATOM 0 HB3 ASP A 166 20.047 2.941 -0.545 1.00 1.14 H new ATOM 762 N ASN A 170 14.168 3.575 -7.907 1.00 0.82 N ATOM 763 CA ASN A 170 13.360 2.742 -8.790 1.00 0.65 C ATOM 764 C ASN A 170 12.457 1.816 -8.004 1.00 0.56 C ATOM 765 O ASN A 170 12.025 0.808 -8.519 1.00 0.77 O ATOM 766 CB ASN A 170 14.251 1.897 -9.714 1.00 0.84 C ATOM 767 CG ASN A 170 14.959 2.696 -10.793 1.00 1.23 C ATOM 768 OD1 ASN A 170 14.422 2.901 -11.878 1.00 1.94 O ATOM 769 ND2 ASN A 170 16.177 3.133 -10.512 1.00 1.70 N ATOM 0 HA ASN A 170 12.747 3.416 -9.388 1.00 0.65 H new ATOM 0 HB2 ASN A 170 14.998 1.382 -9.109 1.00 0.84 H new ATOM 0 HB3 ASN A 170 13.640 1.129 -10.188 1.00 0.84 H new ATOM 0 HD21 ASN A 170 16.703 3.660 -11.209 1.00 1.70 H new ATOM 0 HD22 ASN A 170 16.589 2.942 -9.599 1.00 1.70 H new ATOM 776 N GLN A 171 12.140 2.157 -6.768 1.00 0.41 N ATOM 777 CA GLN A 171 11.342 1.270 -5.939 1.00 0.37 C ATOM 778 C GLN A 171 9.883 1.442 -6.241 1.00 0.29 C ATOM 779 O GLN A 171 9.051 0.727 -5.706 1.00 0.34 O ATOM 780 CB GLN A 171 11.662 1.371 -4.441 1.00 0.57 C ATOM 781 CG GLN A 171 11.749 2.770 -3.874 1.00 1.32 C ATOM 782 CD GLN A 171 13.067 3.500 -4.199 1.00 2.56 C ATOM 783 OE1 GLN A 171 13.706 3.278 -5.221 1.00 3.22 O ATOM 784 NE2 GLN A 171 13.500 4.359 -3.311 1.00 3.29 N ATOM 0 H GLN A 171 12.418 3.030 -6.320 1.00 0.41 H new ATOM 0 HA GLN A 171 11.620 0.249 -6.202 1.00 0.37 H new ATOM 0 HB2 GLN A 171 10.898 0.824 -3.889 1.00 0.57 H new ATOM 0 HB3 GLN A 171 12.611 0.867 -4.258 1.00 0.57 H new ATOM 0 HG2 GLN A 171 10.916 3.359 -4.258 1.00 1.32 H new ATOM 0 HG3 GLN A 171 11.631 2.720 -2.792 1.00 1.32 H new ATOM 0 HE21 GLN A 171 12.958 4.534 -2.465 1.00 3.29 H new ATOM 0 HE22 GLN A 171 14.379 4.853 -3.465 1.00 3.29 H new ATOM 793 N ASN A 172 9.607 2.385 -7.140 1.00 0.35 N ATOM 794 CA ASN A 172 8.413 2.347 -7.981 1.00 0.42 C ATOM 795 C ASN A 172 8.259 0.938 -8.568 1.00 0.42 C ATOM 796 O ASN A 172 7.154 0.457 -8.845 1.00 0.48 O ATOM 797 CB ASN A 172 8.565 3.390 -9.104 1.00 0.47 C ATOM 798 CG ASN A 172 7.702 3.106 -10.327 1.00 0.54 C ATOM 799 OD1 ASN A 172 8.109 2.377 -11.229 1.00 1.24 O ATOM 800 ND2 ASN A 172 6.523 3.704 -10.382 1.00 1.02 N ATOM 0 H ASN A 172 10.204 3.195 -7.305 1.00 0.35 H new ATOM 0 HA ASN A 172 7.524 2.582 -7.396 1.00 0.42 H new ATOM 0 HB2 ASN A 172 8.309 4.374 -8.711 1.00 0.47 H new ATOM 0 HB3 ASN A 172 9.610 3.431 -9.410 1.00 0.47 H new ATOM 0 HD21 ASN A 172 5.919 3.567 -11.192 1.00 1.02 H new ATOM 0 HD22 ASN A 172 6.218 4.302 -9.614 1.00 1.02 H new ATOM 807 N ASN A 173 9.395 0.271 -8.699 1.00 0.40 N ATOM 808 CA ASN A 173 9.450 -1.091 -9.224 1.00 0.50 C ATOM 809 C ASN A 173 9.022 -2.079 -8.148 1.00 0.44 C ATOM 810 O ASN A 173 8.178 -2.964 -8.386 1.00 0.46 O ATOM 811 CB ASN A 173 10.865 -1.427 -9.685 1.00 0.63 C ATOM 812 CG ASN A 173 10.939 -2.715 -10.482 1.00 0.77 C ATOM 813 OD1 ASN A 173 9.980 -3.111 -11.146 1.00 1.33 O ATOM 814 ND2 ASN A 173 12.084 -3.372 -10.434 1.00 1.44 N ATOM 0 H ASN A 173 10.305 0.655 -8.446 1.00 0.40 H new ATOM 0 HA ASN A 173 8.772 -1.161 -10.075 1.00 0.50 H new ATOM 0 HB2 ASN A 173 11.247 -0.607 -10.294 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.515 -1.507 -8.814 1.00 0.63 H new ATOM 0 HD21 ASN A 173 12.197 -4.239 -10.959 1.00 1.44 H new ATOM 0 HD22 ASN A 173 12.856 -3.012 -9.872 1.00 1.44 H new ATOM 821 N PHE A 174 9.568 -1.891 -6.939 1.00 0.42 N ATOM 822 CA PHE A 174 9.210 -2.728 -5.821 1.00 0.42 C ATOM 823 C PHE A 174 7.732 -2.600 -5.594 1.00 0.33 C ATOM 824 O PHE A 174 7.095 -3.525 -5.143 1.00 0.34 O ATOM 825 CB PHE A 174 9.966 -2.326 -4.556 1.00 0.49 C ATOM 826 CG PHE A 174 11.325 -2.947 -4.431 1.00 0.60 C ATOM 827 CD1 PHE A 174 11.466 -4.302 -4.185 1.00 1.03 C ATOM 828 CD2 PHE A 174 12.468 -2.172 -4.565 1.00 1.56 C ATOM 829 CE1 PHE A 174 12.720 -4.874 -4.078 1.00 1.38 C ATOM 830 CE2 PHE A 174 13.722 -2.738 -4.458 1.00 1.90 C ATOM 831 CZ PHE A 174 13.841 -4.101 -4.187 1.00 1.53 C ATOM 0 H PHE A 174 10.254 -1.167 -6.726 1.00 0.42 H new ATOM 0 HA PHE A 174 9.478 -3.760 -6.048 1.00 0.42 H new ATOM 0 HB2 PHE A 174 10.071 -1.241 -4.538 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.370 -2.603 -3.686 1.00 0.49 H new ATOM 0 HD1 PHE A 174 10.586 -4.919 -4.075 1.00 1.03 H new ATOM 0 HD2 PHE A 174 12.375 -1.113 -4.755 1.00 1.56 H new ATOM 0 HE1 PHE A 174 12.814 -5.936 -3.908 1.00 1.38 H new ATOM 0 HE2 PHE A 174 14.605 -2.130 -4.583 1.00 1.90 H new ATOM 0 HZ PHE A 174 14.818 -4.545 -4.064 1.00 1.53 H new ATOM 841 N VAL A 175 7.210 -1.432 -5.935 1.00 0.29 N ATOM 842 CA VAL A 175 5.787 -1.164 -5.855 1.00 0.25 C ATOM 843 C VAL A 175 4.981 -2.127 -6.665 1.00 0.25 C ATOM 844 O VAL A 175 4.162 -2.824 -6.119 1.00 0.28 O ATOM 845 CB VAL A 175 5.424 0.197 -6.384 1.00 0.26 C ATOM 846 CG1 VAL A 175 3.971 0.478 -6.074 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.319 1.230 -5.804 1.00 0.33 C ATOM 0 H VAL A 175 7.763 -0.645 -6.275 1.00 0.29 H new ATOM 0 HA VAL A 175 5.562 -1.248 -4.792 1.00 0.25 H new ATOM 0 HB VAL A 175 5.557 0.223 -7.465 1.00 0.26 H new ATOM 0 HG11 VAL A 175 3.702 1.463 -6.455 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.345 -0.278 -6.548 1.00 0.26 H new ATOM 0 HG13 VAL A 175 3.817 0.452 -4.995 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.045 2.210 -6.195 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.218 1.231 -4.719 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.352 1.008 -6.072 1.00 0.33 H new ATOM 857 N HIS A 176 5.170 -2.101 -7.979 1.00 0.27 N ATOM 858 CA HIS A 176 4.469 -3.021 -8.878 1.00 0.33 C ATOM 859 C HIS A 176 4.368 -4.409 -8.253 1.00 0.28 C ATOM 860 O HIS A 176 3.334 -5.054 -8.322 1.00 0.29 O ATOM 861 CB HIS A 176 5.176 -3.094 -10.239 1.00 0.41 C ATOM 862 CG HIS A 176 5.087 -1.817 -11.023 1.00 1.16 C ATOM 863 ND1 HIS A 176 6.187 -1.150 -11.524 1.00 2.23 N ATOM 864 CD2 HIS A 176 4.011 -1.082 -11.389 1.00 1.62 C ATOM 865 CE1 HIS A 176 5.787 -0.062 -12.157 1.00 2.89 C ATOM 866 NE2 HIS A 176 4.471 0.003 -12.088 1.00 2.52 N ATOM 0 H HIS A 176 5.802 -1.454 -8.450 1.00 0.27 H new ATOM 0 HA HIS A 176 3.460 -2.640 -9.036 1.00 0.33 H new ATOM 0 HB2 HIS A 176 6.225 -3.344 -10.083 1.00 0.41 H new ATOM 0 HB3 HIS A 176 4.739 -3.903 -10.825 1.00 0.41 H new ATOM 0 HD2 HIS A 176 2.978 -1.309 -11.170 1.00 1.62 H new ATOM 0 HE1 HIS A 176 6.429 0.654 -12.648 1.00 2.89 H new ATOM 0 HE2 HIS A 176 3.891 0.740 -12.489 1.00 2.52 H new ATOM 875 N ASP A 177 5.427 -4.804 -7.565 1.00 0.26 N ATOM 876 CA ASP A 177 5.499 -6.103 -6.889 1.00 0.27 C ATOM 877 C ASP A 177 4.853 -6.042 -5.499 1.00 0.24 C ATOM 878 O ASP A 177 4.262 -7.002 -5.019 1.00 0.31 O ATOM 879 CB ASP A 177 6.970 -6.515 -6.780 1.00 0.36 C ATOM 880 CG ASP A 177 7.171 -7.918 -6.250 1.00 0.49 C ATOM 881 OD1 ASP A 177 7.245 -8.094 -5.021 1.00 0.64 O ATOM 882 OD2 ASP A 177 7.291 -8.851 -7.074 1.00 0.66 O ATOM 0 H ASP A 177 6.267 -4.236 -7.455 1.00 0.26 H new ATOM 0 HA ASP A 177 4.947 -6.842 -7.470 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.434 -6.438 -7.763 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.488 -5.812 -6.127 1.00 0.36 H new ATOM 887 N CYS A 178 4.962 -4.883 -4.899 1.00 0.26 N ATOM 888 CA CYS A 178 4.456 -4.580 -3.566 1.00 0.29 C ATOM 889 C CYS A 178 2.939 -4.480 -3.552 1.00 0.27 C ATOM 890 O CYS A 178 2.277 -4.990 -2.661 1.00 0.32 O ATOM 891 CB CYS A 178 5.092 -3.267 -3.111 1.00 0.41 C ATOM 892 SG CYS A 178 4.116 -2.261 -1.958 1.00 0.64 S ATOM 0 H CYS A 178 5.424 -4.086 -5.337 1.00 0.26 H new ATOM 0 HA CYS A 178 4.720 -5.387 -2.882 1.00 0.29 H new ATOM 0 HB2 CYS A 178 6.049 -3.495 -2.642 1.00 0.41 H new ATOM 0 HB3 CYS A 178 5.305 -2.665 -3.995 1.00 0.41 H new ATOM 897 N VAL A 179 2.377 -3.815 -4.529 1.00 0.23 N ATOM 898 CA VAL A 179 0.947 -3.829 -4.677 1.00 0.20 C ATOM 899 C VAL A 179 0.552 -5.233 -5.083 1.00 0.21 C ATOM 900 O VAL A 179 -0.398 -5.800 -4.557 1.00 0.28 O ATOM 901 CB VAL A 179 0.437 -2.800 -5.726 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.624 -1.909 -5.145 1.00 0.67 C ATOM 903 CG2 VAL A 179 1.533 -1.911 -6.236 1.00 0.57 C ATOM 0 H VAL A 179 2.881 -3.265 -5.224 1.00 0.23 H new ATOM 0 HA VAL A 179 0.490 -3.540 -3.731 1.00 0.20 H new ATOM 0 HB VAL A 179 0.037 -3.396 -6.546 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -0.960 -1.201 -5.903 1.00 0.67 H new ATOM 0 HG12 VAL A 179 -1.468 -2.515 -4.815 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.215 -1.363 -4.295 1.00 0.67 H new ATOM 0 HG21 VAL A 179 1.124 -1.211 -6.965 1.00 0.57 H new ATOM 0 HG22 VAL A 179 1.968 -1.356 -5.405 1.00 0.57 H new ATOM 0 HG23 VAL A 179 2.304 -2.519 -6.709 1.00 0.57 H new ATOM 913 N ASN A 180 1.339 -5.832 -5.956 1.00 0.23 N ATOM 914 CA ASN A 180 1.080 -7.196 -6.374 1.00 0.24 C ATOM 915 C ASN A 180 1.037 -8.146 -5.199 1.00 0.25 C ATOM 916 O ASN A 180 0.314 -9.132 -5.229 1.00 0.26 O ATOM 917 CB ASN A 180 2.114 -7.691 -7.375 1.00 0.25 C ATOM 918 CG ASN A 180 1.735 -7.364 -8.808 1.00 0.48 C ATOM 919 OD1 ASN A 180 0.573 -7.074 -9.105 1.00 1.17 O ATOM 920 ND2 ASN A 180 2.695 -7.450 -9.717 1.00 1.33 N ATOM 0 H ASN A 180 2.157 -5.400 -6.387 1.00 0.23 H new ATOM 0 HA ASN A 180 0.102 -7.181 -6.855 1.00 0.24 H new ATOM 0 HB2 ASN A 180 3.081 -7.242 -7.146 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.230 -8.770 -7.270 1.00 0.25 H new ATOM 0 HD21 ASN A 180 2.484 -7.274 -10.699 1.00 1.33 H new ATOM 0 HD22 ASN A 180 3.645 -7.692 -9.434 1.00 1.33 H new ATOM 927 N ILE A 181 1.808 -7.871 -4.167 1.00 0.28 N ATOM 928 CA ILE A 181 1.763 -8.720 -3.008 1.00 0.29 C ATOM 929 C ILE A 181 0.649 -8.313 -2.050 1.00 0.27 C ATOM 930 O ILE A 181 -0.086 -9.155 -1.596 1.00 0.36 O ATOM 931 CB ILE A 181 3.127 -8.835 -2.262 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.741 -7.505 -1.822 1.00 0.42 C ATOM 933 CG2 ILE A 181 4.133 -9.589 -3.102 1.00 0.52 C ATOM 934 CD1 ILE A 181 3.022 -6.858 -0.677 1.00 0.77 C ATOM 0 H ILE A 181 2.456 -7.085 -4.111 1.00 0.28 H new ATOM 0 HA ILE A 181 1.540 -9.716 -3.390 1.00 0.29 H new ATOM 0 HB ILE A 181 2.892 -9.380 -1.348 1.00 0.34 H new ATOM 0 HG12 ILE A 181 4.781 -7.671 -1.539 1.00 0.42 H new ATOM 0 HG13 ILE A 181 3.747 -6.820 -2.670 1.00 0.42 H new ATOM 0 HG21 ILE A 181 5.078 -9.658 -2.563 1.00 0.52 H new ATOM 0 HG22 ILE A 181 3.758 -10.592 -3.306 1.00 0.52 H new ATOM 0 HG23 ILE A 181 4.290 -9.061 -4.043 1.00 0.52 H new ATOM 0 HD11 ILE A 181 3.515 -5.920 -0.421 1.00 0.77 H new ATOM 0 HD12 ILE A 181 1.989 -6.659 -0.962 1.00 0.77 H new ATOM 0 HD13 ILE A 181 3.039 -7.524 0.186 1.00 0.77 H new ATOM 946 N THR A 182 0.481 -7.020 -1.832 1.00 0.27 N ATOM 947 CA THR A 182 -0.272 -6.492 -0.690 1.00 0.24 C ATOM 948 C THR A 182 -1.744 -6.440 -0.916 1.00 0.26 C ATOM 949 O THR A 182 -2.542 -6.704 -0.011 1.00 0.30 O ATOM 950 CB THR A 182 0.254 -5.094 -0.354 1.00 0.22 C ATOM 951 OG1 THR A 182 0.845 -5.106 0.942 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.843 -4.046 -0.422 1.00 0.30 C ATOM 0 H THR A 182 0.863 -6.297 -2.442 1.00 0.27 H new ATOM 0 HA THR A 182 -0.119 -7.180 0.142 1.00 0.24 H new ATOM 0 HB THR A 182 1.004 -4.827 -1.098 1.00 0.22 H new ATOM 0 HG1 THR A 182 0.150 -4.969 1.620 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.428 -3.068 -0.177 1.00 0.30 H new ATOM 0 HG22 THR A 182 -1.260 -4.021 -1.429 1.00 0.30 H new ATOM 0 HG23 THR A 182 -1.629 -4.295 0.291 1.00 0.30 H new ATOM 960 N VAL A 183 -2.101 -6.100 -2.103 1.00 0.26 N ATOM 961 CA VAL A 183 -3.468 -5.956 -2.431 1.00 0.28 C ATOM 962 C VAL A 183 -4.011 -7.353 -2.503 1.00 0.29 C ATOM 963 O VAL A 183 -5.127 -7.632 -2.111 1.00 0.32 O ATOM 964 CB VAL A 183 -3.559 -5.198 -3.749 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.495 -4.141 -3.756 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.388 -6.138 -4.919 1.00 0.29 C ATOM 0 H VAL A 183 -1.454 -5.915 -2.870 1.00 0.26 H new ATOM 0 HA VAL A 183 -4.049 -5.386 -1.706 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.541 -4.736 -3.845 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.541 -3.584 -4.692 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.654 -3.459 -2.920 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.516 -4.610 -3.661 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.456 -5.576 -5.850 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.413 -6.622 -4.858 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.171 -6.896 -4.894 1.00 0.29 H new ATOM 976 N LYS A 184 -3.101 -8.230 -2.891 1.00 0.30 N ATOM 977 CA LYS A 184 -3.306 -9.650 -2.952 1.00 0.32 C ATOM 978 C LYS A 184 -3.344 -10.243 -1.567 1.00 0.32 C ATOM 979 O LYS A 184 -4.208 -11.033 -1.228 1.00 0.38 O ATOM 980 CB LYS A 184 -2.150 -10.245 -3.713 1.00 0.34 C ATOM 981 CG LYS A 184 -2.508 -10.596 -5.127 1.00 0.37 C ATOM 982 CD LYS A 184 -3.058 -9.403 -5.867 1.00 1.01 C ATOM 983 CE LYS A 184 -2.148 -8.999 -7.011 1.00 1.37 C ATOM 984 NZ LYS A 184 -2.848 -8.181 -8.036 1.00 2.14 N ATOM 0 H LYS A 184 -2.164 -7.951 -3.182 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.256 -9.865 -3.442 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.320 -9.538 -3.717 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -1.803 -11.140 -3.197 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.626 -10.972 -5.645 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.245 -11.399 -5.129 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -4.050 -9.637 -6.253 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -3.174 -8.566 -5.178 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -1.303 -8.435 -6.616 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -1.742 -9.895 -7.481 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -2.182 -7.932 -8.795 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -3.639 -8.726 -8.434 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -3.213 -7.312 -7.597 1.00 2.14 H new ATOM 998 N GLN A 185 -2.374 -9.848 -0.784 1.00 0.31 N ATOM 999 CA GLN A 185 -2.302 -10.168 0.622 1.00 0.39 C ATOM 1000 C GLN A 185 -3.641 -9.966 1.290 1.00 0.38 C ATOM 1001 O GLN A 185 -3.988 -10.654 2.241 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.250 -9.267 1.239 1.00 0.56 C ATOM 1003 CG GLN A 185 0.129 -9.830 1.080 1.00 1.32 C ATOM 1004 CD GLN A 185 0.534 -10.743 2.227 1.00 1.75 C ATOM 1005 OE1 GLN A 185 1.118 -10.306 3.212 1.00 2.11 O ATOM 1006 NE2 GLN A 185 0.223 -12.027 2.105 1.00 2.02 N ATOM 0 H GLN A 185 -1.592 -9.281 -1.112 1.00 0.31 H new ATOM 0 HA GLN A 185 -2.034 -11.216 0.759 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -1.296 -8.283 0.773 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -1.466 -9.129 2.298 1.00 0.56 H new ATOM 0 HG2 GLN A 185 0.183 -10.386 0.144 1.00 1.32 H new ATOM 0 HG3 GLN A 185 0.844 -9.010 1.005 1.00 1.32 H new ATOM 0 HE21 GLN A 185 -0.264 -12.357 1.271 1.00 2.02 H new ATOM 0 HE22 GLN A 185 0.470 -12.684 2.845 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.374 -9.009 0.769 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.682 -8.682 1.260 1.00 0.44 C ATOM 1017 C HIS A 186 -6.810 -9.309 0.432 1.00 0.51 C ATOM 1018 O HIS A 186 -7.847 -9.681 0.965 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.786 -7.175 1.321 1.00 0.49 C ATOM 1020 CG HIS A 186 -5.151 -6.642 2.561 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -3.851 -6.189 2.601 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -5.623 -6.543 3.823 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -3.552 -5.840 3.837 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -4.608 -6.043 4.595 1.00 0.91 N ATOM 0 H HIS A 186 -4.071 -8.433 -0.016 1.00 0.36 H new ATOM 0 HA HIS A 186 -5.809 -9.108 2.255 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -5.305 -6.739 0.446 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.834 -6.878 1.289 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -3.220 -6.132 1.802 1.00 0.73 H new ATOM 0 HD2 HIS A 186 -6.614 -6.808 4.160 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -2.601 -5.453 4.171 1.00 0.65 H new ATOM 1033 N THR A 187 -6.592 -9.475 -0.850 1.00 0.48 N ATOM 1034 CA THR A 187 -7.660 -9.875 -1.757 1.00 0.59 C ATOM 1035 C THR A 187 -7.493 -11.329 -2.169 1.00 0.62 C ATOM 1036 O THR A 187 -8.183 -11.827 -3.058 1.00 0.80 O ATOM 1037 CB THR A 187 -7.710 -8.971 -3.017 1.00 0.72 C ATOM 1038 OG1 THR A 187 -8.933 -9.180 -3.735 1.00 0.89 O ATOM 1039 CG2 THR A 187 -6.532 -9.242 -3.939 1.00 0.75 C ATOM 0 H THR A 187 -5.685 -9.341 -1.297 1.00 0.48 H new ATOM 0 HA THR A 187 -8.602 -9.760 -1.221 1.00 0.59 H new ATOM 0 HB THR A 187 -7.657 -7.936 -2.680 1.00 0.72 H new ATOM 0 HG1 THR A 187 -9.666 -8.723 -3.273 1.00 0.89 H new ATOM 0 HG21 THR A 187 -6.596 -8.593 -4.812 1.00 0.75 H new ATOM 0 HG22 THR A 187 -5.601 -9.044 -3.408 1.00 0.75 H new ATOM 0 HG23 THR A 187 -6.553 -10.284 -4.259 1.00 0.75 H new ATOM 1047 N VAL A 188 -6.569 -12.014 -1.513 1.00 0.55 N ATOM 1048 CA VAL A 188 -6.282 -13.406 -1.846 1.00 0.63 C ATOM 1049 C VAL A 188 -5.790 -14.152 -0.618 1.00 0.66 C ATOM 1050 O VAL A 188 -6.193 -15.284 -0.357 1.00 0.78 O ATOM 1051 CB VAL A 188 -5.265 -13.572 -3.030 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -5.296 -12.370 -3.954 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -3.839 -13.833 -2.561 1.00 0.84 C ATOM 0 H VAL A 188 -6.007 -11.634 -0.751 1.00 0.55 H new ATOM 0 HA VAL A 188 -7.222 -13.838 -2.188 1.00 0.63 H new ATOM 0 HB VAL A 188 -5.590 -14.455 -3.580 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -4.581 -12.515 -4.764 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -6.297 -12.257 -4.370 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -5.032 -11.473 -3.393 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -3.185 -13.938 -3.427 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -3.499 -12.998 -1.949 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -3.812 -14.750 -1.972 1.00 0.84 H new ATOM 1063 N THR A 189 -4.930 -13.502 0.146 1.00 0.65 N ATOM 1064 CA THR A 189 -4.465 -14.052 1.396 1.00 0.79 C ATOM 1065 C THR A 189 -5.387 -13.569 2.497 1.00 0.83 C ATOM 1066 O THR A 189 -5.325 -14.020 3.637 1.00 1.04 O ATOM 1067 CB THR A 189 -3.016 -13.614 1.690 1.00 0.88 C ATOM 1068 OG1 THR A 189 -2.228 -13.714 0.496 1.00 0.90 O ATOM 1069 CG2 THR A 189 -2.389 -14.474 2.778 1.00 1.12 C ATOM 0 H THR A 189 -4.541 -12.588 -0.084 1.00 0.65 H new ATOM 0 HA THR A 189 -4.475 -15.141 1.340 1.00 0.79 H new ATOM 0 HB THR A 189 -3.040 -12.581 2.037 1.00 0.88 H new ATOM 0 HG1 THR A 189 -1.340 -14.064 0.718 1.00 0.90 H new ATOM 0 HG21 THR A 189 -1.368 -14.140 2.962 1.00 1.12 H new ATOM 0 HG22 THR A 189 -2.972 -14.383 3.695 1.00 1.12 H new ATOM 0 HG23 THR A 189 -2.378 -15.516 2.457 1.00 1.12 H new ATOM 1077 N THR A 190 -6.270 -12.652 2.128 1.00 0.73 N ATOM 1078 CA THR A 190 -7.146 -12.047 3.090 1.00 0.76 C ATOM 1079 C THR A 190 -8.624 -12.122 2.682 1.00 0.80 C ATOM 1080 O THR A 190 -9.514 -11.952 3.522 1.00 1.06 O ATOM 1081 CB THR A 190 -6.698 -10.603 3.412 1.00 0.90 C ATOM 1082 OG1 THR A 190 -5.588 -10.621 4.315 1.00 1.00 O ATOM 1083 CG2 THR A 190 -7.811 -9.750 3.980 1.00 0.93 C ATOM 0 H THR A 190 -6.390 -12.320 1.171 1.00 0.73 H new ATOM 0 HA THR A 190 -7.067 -12.631 4.007 1.00 0.76 H new ATOM 0 HB THR A 190 -6.402 -10.149 2.466 1.00 0.90 H new ATOM 0 HG1 THR A 190 -4.761 -10.446 3.820 1.00 1.00 H new ATOM 0 HG21 THR A 190 -7.433 -8.748 4.185 1.00 0.93 H new ATOM 0 HG22 THR A 190 -8.627 -9.690 3.260 1.00 0.93 H new ATOM 0 HG23 THR A 190 -8.176 -10.197 4.905 1.00 0.93 H new ATOM 1141 N GLY A 194 -13.231 -12.943 4.679 1.00 0.89 N ATOM 1142 CA GLY A 194 -14.526 -12.484 4.252 1.00 0.84 C ATOM 1143 C GLY A 194 -14.400 -11.120 3.635 1.00 0.70 C ATOM 1144 O GLY A 194 -15.304 -10.293 3.733 1.00 0.98 O ATOM 0 HA2 GLY A 194 -14.951 -13.182 3.531 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -15.208 -12.448 5.101 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.265 -10.891 2.984 1.00 0.54 N ATOM 1149 CA GLU A 195 -12.951 -9.572 2.455 1.00 0.62 C ATOM 1150 C GLU A 195 -13.214 -9.559 0.960 1.00 0.62 C ATOM 1151 O GLU A 195 -12.974 -10.552 0.275 1.00 0.88 O ATOM 1152 CB GLU A 195 -11.488 -9.223 2.766 1.00 0.91 C ATOM 1153 CG GLU A 195 -11.130 -7.770 2.561 1.00 1.17 C ATOM 1154 CD GLU A 195 -11.831 -6.846 3.535 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -11.361 -6.720 4.684 1.00 2.30 O ATOM 1156 OE2 GLU A 195 -12.858 -6.247 3.151 1.00 1.98 O ATOM 0 H GLU A 195 -12.551 -11.599 2.811 1.00 0.54 H new ATOM 0 HA GLU A 195 -13.584 -8.819 2.925 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -11.276 -9.493 3.800 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -10.841 -9.835 2.138 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -10.052 -7.649 2.665 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -11.387 -7.478 1.543 1.00 1.17 H new ATOM 1163 N ASN A 196 -13.747 -8.453 0.471 1.00 0.61 N ATOM 1164 CA ASN A 196 -14.092 -8.334 -0.933 1.00 0.66 C ATOM 1165 C ASN A 196 -13.505 -7.068 -1.481 1.00 0.54 C ATOM 1166 O ASN A 196 -13.518 -6.033 -0.819 1.00 0.57 O ATOM 1167 CB ASN A 196 -15.590 -8.256 -1.148 1.00 0.92 C ATOM 1168 CG ASN A 196 -15.998 -8.742 -2.525 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -15.337 -9.595 -3.116 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -17.084 -8.200 -3.046 1.00 2.16 N ATOM 0 H ASN A 196 -13.950 -7.623 1.028 1.00 0.61 H new ATOM 0 HA ASN A 196 -13.701 -9.220 -1.434 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -16.096 -8.853 -0.389 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -15.921 -7.226 -1.015 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -17.403 -8.486 -3.972 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -17.604 -7.496 -2.523 1.00 2.16 H new ATOM 1177 N PHE A 197 -12.997 -7.143 -2.679 1.00 0.51 N ATOM 1178 CA PHE A 197 -12.427 -5.997 -3.301 1.00 0.42 C ATOM 1179 C PHE A 197 -13.055 -5.766 -4.657 1.00 0.43 C ATOM 1180 O PHE A 197 -13.156 -6.688 -5.467 1.00 0.47 O ATOM 1181 CB PHE A 197 -10.934 -6.202 -3.466 1.00 0.55 C ATOM 1182 CG PHE A 197 -10.204 -6.485 -2.187 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -10.465 -7.632 -1.462 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -9.259 -5.602 -1.709 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -9.806 -7.887 -0.290 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -8.593 -5.857 -0.529 1.00 2.99 C ATOM 1187 CZ PHE A 197 -8.869 -6.997 0.179 1.00 3.21 C ATOM 0 H PHE A 197 -12.969 -7.994 -3.241 1.00 0.51 H new ATOM 0 HA PHE A 197 -12.614 -5.126 -2.673 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -10.767 -7.029 -4.156 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.506 -5.311 -3.926 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -11.199 -8.337 -1.825 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -9.038 -4.702 -2.264 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -10.022 -8.787 0.266 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -7.855 -5.159 -0.163 1.00 2.99 H new ATOM 0 HZ PHE A 197 -8.351 -7.196 1.105 1.00 3.21 H new ATOM 1197 N THR A 198 -13.471 -4.546 -4.901 1.00 0.47 N ATOM 1198 CA THR A 198 -13.880 -4.160 -6.226 1.00 0.50 C ATOM 1199 C THR A 198 -12.739 -3.374 -6.843 1.00 0.48 C ATOM 1200 O THR A 198 -11.819 -2.991 -6.132 1.00 0.45 O ATOM 1201 CB THR A 198 -15.180 -3.322 -6.216 1.00 0.54 C ATOM 1202 OG1 THR A 198 -15.695 -3.203 -7.547 1.00 0.61 O ATOM 1203 CG2 THR A 198 -14.937 -1.932 -5.638 1.00 0.49 C ATOM 0 H THR A 198 -13.534 -3.807 -4.200 1.00 0.47 H new ATOM 0 HA THR A 198 -14.101 -5.052 -6.812 1.00 0.50 H new ATOM 0 HB THR A 198 -15.906 -3.835 -5.585 1.00 0.54 H new ATOM 0 HG1 THR A 198 -16.519 -2.673 -7.533 1.00 0.61 H new ATOM 0 HG21 THR A 198 -15.869 -1.367 -5.644 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.574 -2.022 -4.614 1.00 0.49 H new ATOM 0 HG23 THR A 198 -14.193 -1.412 -6.242 1.00 0.49 H new ATOM 1211 N GLU A 199 -12.763 -3.157 -8.148 1.00 0.51 N ATOM 1212 CA GLU A 199 -11.685 -2.426 -8.806 1.00 0.50 C ATOM 1213 C GLU A 199 -11.546 -1.022 -8.237 1.00 0.44 C ATOM 1214 O GLU A 199 -10.583 -0.355 -8.514 1.00 0.43 O ATOM 1215 CB GLU A 199 -11.899 -2.314 -10.304 1.00 0.53 C ATOM 1216 CG GLU A 199 -10.612 -2.020 -11.056 1.00 0.54 C ATOM 1217 CD GLU A 199 -10.861 -1.582 -12.484 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -11.324 -0.442 -12.691 1.00 0.62 O ATOM 1219 OE2 GLU A 199 -10.597 -2.376 -13.409 1.00 0.76 O ATOM 0 H GLU A 199 -13.508 -3.472 -8.770 1.00 0.51 H new ATOM 0 HA GLU A 199 -10.776 -2.998 -8.619 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -12.329 -3.244 -10.677 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -12.623 -1.524 -10.506 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -10.059 -1.241 -10.532 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -9.984 -2.911 -11.057 1.00 0.54 H new ATOM 1226 N THR A 200 -12.527 -0.576 -7.477 1.00 0.44 N ATOM 1227 CA THR A 200 -12.439 0.673 -6.751 1.00 0.38 C ATOM 1228 C THR A 200 -11.681 0.462 -5.458 1.00 0.33 C ATOM 1229 O THR A 200 -10.788 1.220 -5.141 1.00 0.28 O ATOM 1230 CB THR A 200 -13.824 1.230 -6.407 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.593 1.416 -7.602 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.699 2.543 -5.658 1.00 0.45 C ATOM 0 H THR A 200 -13.409 -1.072 -7.346 1.00 0.44 H new ATOM 0 HA THR A 200 -11.922 1.385 -7.394 1.00 0.38 H new ATOM 0 HB THR A 200 -14.335 0.512 -5.766 1.00 0.42 H new ATOM 0 HG1 THR A 200 -15.477 1.771 -7.370 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.693 2.923 -5.422 1.00 0.45 H new ATOM 0 HG22 THR A 200 -13.143 2.383 -4.734 1.00 0.45 H new ATOM 0 HG23 THR A 200 -13.171 3.267 -6.279 1.00 0.45 H new ATOM 1240 N ASP A 201 -12.007 -0.615 -4.752 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.361 -0.931 -3.476 1.00 0.34 C ATOM 1242 C ASP A 201 -9.944 -1.280 -3.785 1.00 0.31 C ATOM 1243 O ASP A 201 -9.011 -1.136 -2.993 1.00 0.28 O ATOM 1244 CB ASP A 201 -12.009 -2.126 -2.764 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.466 -1.922 -2.417 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.773 -0.934 -1.722 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -14.309 -2.733 -2.843 1.00 0.50 O ATOM 0 H ASP A 201 -12.717 -1.288 -5.040 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.454 -0.071 -2.813 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -11.918 -3.007 -3.400 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -11.454 -2.334 -1.849 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.806 -1.735 -4.987 1.00 0.35 N ATOM 1253 CA ILE A 202 -8.551 -2.104 -5.502 1.00 0.36 C ATOM 1254 C ILE A 202 -7.873 -0.948 -6.080 1.00 0.33 C ATOM 1255 O ILE A 202 -6.684 -0.789 -5.889 1.00 0.34 O ATOM 1256 CB ILE A 202 -8.719 -3.176 -6.562 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -7.828 -4.334 -6.257 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -8.370 -2.672 -7.957 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -7.396 -4.344 -4.836 1.00 0.59 C ATOM 0 H ILE A 202 -10.580 -1.858 -5.640 1.00 0.35 H new ATOM 0 HA ILE A 202 -7.946 -2.495 -4.684 1.00 0.36 H new ATOM 0 HB ILE A 202 -9.769 -3.469 -6.548 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -8.351 -5.263 -6.484 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -6.951 -4.296 -6.903 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -8.507 -3.477 -8.679 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -9.022 -1.837 -8.216 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -7.332 -2.341 -7.975 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -6.749 -5.203 -4.658 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -6.850 -3.427 -4.615 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -8.272 -4.409 -4.190 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.635 -0.108 -6.756 1.00 0.33 N ATOM 1272 CA LYS A 203 -8.034 1.008 -7.387 1.00 0.33 C ATOM 1273 C LYS A 203 -7.407 1.824 -6.314 1.00 0.28 C ATOM 1274 O LYS A 203 -6.479 2.570 -6.529 1.00 0.32 O ATOM 1275 CB LYS A 203 -9.015 1.823 -8.192 1.00 0.33 C ATOM 1276 CG LYS A 203 -9.873 2.766 -7.381 1.00 0.29 C ATOM 1277 CD LYS A 203 -10.825 3.549 -8.269 1.00 0.34 C ATOM 1278 CE LYS A 203 -11.425 4.737 -7.533 1.00 1.13 C ATOM 1279 NZ LYS A 203 -12.505 5.392 -8.315 1.00 1.93 N ATOM 0 H LYS A 203 -9.645 -0.189 -6.870 1.00 0.33 H new ATOM 0 HA LYS A 203 -7.291 0.666 -8.108 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.463 2.402 -8.932 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.666 1.143 -8.741 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.443 2.200 -6.644 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.236 3.457 -6.829 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -10.294 3.899 -9.154 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.624 2.893 -8.615 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -11.823 4.405 -6.574 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -10.641 5.464 -7.319 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -12.885 6.196 -7.776 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -12.121 5.732 -9.220 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -13.266 4.707 -8.498 1.00 1.93 H new ATOM 1293 N ILE A 204 -7.939 1.553 -5.141 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.504 2.054 -3.895 1.00 0.22 C ATOM 1295 C ILE A 204 -6.124 1.542 -3.609 1.00 0.22 C ATOM 1296 O ILE A 204 -5.200 2.298 -3.520 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.433 1.557 -2.807 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -9.764 2.282 -2.847 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -7.757 1.627 -1.477 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.629 2.057 -1.644 1.00 0.30 C ATOM 0 H ILE A 204 -8.742 0.931 -5.049 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.503 3.144 -3.923 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.665 0.507 -2.986 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.578 3.351 -2.951 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -10.310 1.965 -3.736 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.436 1.267 -0.704 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -6.861 1.006 -1.491 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.480 2.659 -1.264 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.560 2.612 -1.756 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -10.850 0.994 -1.548 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.107 2.401 -0.751 1.00 0.30 H new ATOM 1312 N MET A 205 -5.970 0.244 -3.507 1.00 0.21 N ATOM 1313 CA MET A 205 -4.670 -0.298 -3.196 1.00 0.21 C ATOM 1314 C MET A 205 -3.692 0.045 -4.273 1.00 0.22 C ATOM 1315 O MET A 205 -2.497 0.053 -4.070 1.00 0.26 O ATOM 1316 CB MET A 205 -4.712 -1.794 -2.990 1.00 0.22 C ATOM 1317 CG MET A 205 -4.480 -2.157 -1.544 1.00 0.27 C ATOM 1318 SD MET A 205 -5.393 -3.625 -1.067 1.00 0.32 S ATOM 1319 CE MET A 205 -6.990 -3.166 -1.721 1.00 0.42 C ATOM 0 H MET A 205 -6.712 -0.445 -3.632 1.00 0.21 H new ATOM 0 HA MET A 205 -4.348 0.154 -2.258 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.679 -2.180 -3.313 1.00 0.22 H new ATOM 0 HB3 MET A 205 -3.954 -2.270 -3.612 1.00 0.22 H new ATOM 0 HG2 MET A 205 -3.415 -2.322 -1.378 1.00 0.27 H new ATOM 0 HG3 MET A 205 -4.777 -1.323 -0.908 1.00 0.27 H new ATOM 0 HE1 MET A 205 -7.751 -3.307 -0.954 1.00 0.42 H new ATOM 0 HE2 MET A 205 -6.971 -2.120 -2.026 1.00 0.42 H new ATOM 0 HE3 MET A 205 -7.224 -3.791 -2.583 1.00 0.42 H new ATOM 1329 N GLU A 206 -4.210 0.408 -5.396 1.00 0.23 N ATOM 1330 CA GLU A 206 -3.377 0.717 -6.498 1.00 0.28 C ATOM 1331 C GLU A 206 -3.069 2.194 -6.447 1.00 0.30 C ATOM 1332 O GLU A 206 -2.050 2.643 -6.895 1.00 0.38 O ATOM 1333 CB GLU A 206 -4.042 0.284 -7.781 1.00 0.32 C ATOM 1334 CG GLU A 206 -4.575 -1.121 -7.635 1.00 0.34 C ATOM 1335 CD GLU A 206 -4.887 -1.803 -8.953 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -5.053 -1.091 -9.967 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -4.976 -3.047 -8.982 1.00 0.90 O ATOM 0 H GLU A 206 -5.211 0.497 -5.572 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.432 0.175 -6.454 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -4.855 0.967 -8.028 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -3.328 0.328 -8.604 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -3.845 -1.721 -7.091 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -5.480 -1.094 -7.029 1.00 0.34 H new ATOM 1344 N ARG A 207 -3.932 2.940 -5.807 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.732 4.362 -5.687 1.00 0.30 C ATOM 1346 C ARG A 207 -3.071 4.711 -4.378 1.00 0.31 C ATOM 1347 O ARG A 207 -2.404 5.734 -4.244 1.00 0.40 O ATOM 1348 CB ARG A 207 -5.065 5.079 -5.849 1.00 0.33 C ATOM 1349 CG ARG A 207 -6.159 4.682 -4.875 1.00 0.38 C ATOM 1350 CD ARG A 207 -6.447 5.752 -3.859 1.00 0.84 C ATOM 1351 NE ARG A 207 -6.596 7.078 -4.489 1.00 1.28 N ATOM 1352 CZ ARG A 207 -7.294 7.329 -5.614 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -8.115 6.417 -6.128 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -7.198 8.515 -6.200 1.00 2.55 N ATOM 0 H ARG A 207 -4.779 2.588 -5.361 1.00 0.26 H new ATOM 0 HA ARG A 207 -3.060 4.694 -6.479 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.892 6.151 -5.752 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.428 4.905 -6.862 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -7.070 4.459 -5.430 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.867 3.767 -4.360 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -7.359 5.503 -3.316 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -5.640 5.786 -3.127 1.00 0.84 H new ATOM 0 HE ARG A 207 -6.134 7.867 -4.037 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -8.223 5.512 -5.670 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -8.636 6.623 -6.980 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -6.597 9.235 -5.799 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -7.725 8.707 -7.052 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.273 3.848 -3.420 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.770 4.048 -2.098 1.00 0.31 C ATOM 1370 C VAL A 208 -1.483 3.308 -1.897 1.00 0.34 C ATOM 1371 O VAL A 208 -0.537 3.840 -1.339 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.793 3.609 -1.042 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.409 4.126 0.313 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -5.163 4.105 -1.420 1.00 0.80 C ATOM 0 H VAL A 208 -3.796 2.981 -3.541 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.585 5.115 -1.978 1.00 0.31 H new ATOM 0 HB VAL A 208 -3.807 2.520 -1.001 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.147 3.804 1.048 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -2.429 3.735 0.587 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -3.372 5.215 0.290 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -5.885 3.790 -0.666 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -5.152 5.193 -1.480 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -5.445 3.691 -2.388 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.458 2.092 -2.384 1.00 0.28 N ATOM 1385 CA VAL A 209 -0.338 1.211 -2.195 1.00 0.31 C ATOM 1386 C VAL A 209 0.644 1.308 -3.357 1.00 0.29 C ATOM 1387 O VAL A 209 1.851 1.159 -3.151 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.813 -0.236 -1.981 1.00 0.38 C ATOM 1389 CG1 VAL A 209 0.294 -1.222 -2.241 1.00 0.89 C ATOM 1390 CG2 VAL A 209 -1.375 -0.414 -0.588 1.00 0.88 C ATOM 0 H VAL A 209 -2.220 1.685 -2.926 1.00 0.28 H new ATOM 0 HA VAL A 209 0.191 1.526 -1.296 1.00 0.31 H new ATOM 0 HB VAL A 209 -1.608 -0.434 -2.700 1.00 0.38 H new ATOM 0 HG11 VAL A 209 -0.076 -2.235 -2.081 1.00 0.89 H new ATOM 0 HG12 VAL A 209 0.638 -1.120 -3.270 1.00 0.89 H new ATOM 0 HG13 VAL A 209 1.123 -1.026 -1.561 1.00 0.89 H new ATOM 0 HG21 VAL A 209 -1.705 -1.445 -0.458 1.00 0.88 H new ATOM 0 HG22 VAL A 209 -0.604 -0.184 0.147 1.00 0.88 H new ATOM 0 HG23 VAL A 209 -2.221 0.258 -0.448 1.00 0.88 H new ATOM 1400 N GLU A 210 0.175 1.595 -4.576 1.00 0.28 N ATOM 1401 CA GLU A 210 1.126 1.857 -5.634 1.00 0.29 C ATOM 1402 C GLU A 210 1.838 3.150 -5.319 1.00 0.24 C ATOM 1403 O GLU A 210 3.057 3.255 -5.417 1.00 0.25 O ATOM 1404 CB GLU A 210 0.466 1.950 -6.991 1.00 0.34 C ATOM 1405 CG GLU A 210 1.450 2.161 -8.123 1.00 0.63 C ATOM 1406 CD GLU A 210 0.789 2.562 -9.423 1.00 0.87 C ATOM 1407 OE1 GLU A 210 0.405 3.741 -9.560 1.00 1.62 O ATOM 1408 OE2 GLU A 210 0.676 1.702 -10.323 1.00 1.16 O ATOM 0 H GLU A 210 -0.810 1.648 -4.837 1.00 0.28 H new ATOM 0 HA GLU A 210 1.828 1.025 -5.682 1.00 0.29 H new ATOM 0 HB2 GLU A 210 -0.099 1.036 -7.176 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.250 2.772 -6.983 1.00 0.34 H new ATOM 0 HG2 GLU A 210 2.165 2.931 -7.835 1.00 0.63 H new ATOM 0 HG3 GLU A 210 2.016 1.243 -8.279 1.00 0.63 H new ATOM 1415 N GLN A 211 1.068 4.126 -4.882 1.00 0.23 N ATOM 1416 CA GLN A 211 1.640 5.378 -4.461 1.00 0.23 C ATOM 1417 C GLN A 211 2.313 5.206 -3.113 1.00 0.22 C ATOM 1418 O GLN A 211 3.115 6.036 -2.705 1.00 0.25 O ATOM 1419 CB GLN A 211 0.581 6.465 -4.379 1.00 0.29 C ATOM 1420 CG GLN A 211 1.140 7.853 -4.120 1.00 0.34 C ATOM 1421 CD GLN A 211 0.164 8.958 -4.479 1.00 0.79 C ATOM 1422 OE1 GLN A 211 0.567 10.065 -4.829 1.00 1.49 O ATOM 1423 NE2 GLN A 211 -1.126 8.659 -4.424 1.00 1.68 N ATOM 0 H GLN A 211 0.052 4.073 -4.811 1.00 0.23 H new ATOM 0 HA GLN A 211 2.380 5.683 -5.201 1.00 0.23 H new ATOM 0 HB2 GLN A 211 0.017 6.480 -5.312 1.00 0.29 H new ATOM 0 HB3 GLN A 211 -0.122 6.214 -3.585 1.00 0.29 H new ATOM 0 HG2 GLN A 211 1.409 7.940 -3.067 1.00 0.34 H new ATOM 0 HG3 GLN A 211 2.057 7.983 -4.695 1.00 0.34 H new ATOM 0 HE21 GLN A 211 -1.422 7.729 -4.128 1.00 1.68 H new ATOM 0 HE22 GLN A 211 -1.823 9.359 -4.677 1.00 1.68 H new ATOM 1432 N MET A 212 1.985 4.129 -2.413 1.00 0.27 N ATOM 1433 CA MET A 212 2.644 3.846 -1.156 1.00 0.32 C ATOM 1434 C MET A 212 4.045 3.384 -1.421 1.00 0.25 C ATOM 1435 O MET A 212 4.994 3.943 -0.910 1.00 0.22 O ATOM 1436 CB MET A 212 1.880 2.825 -0.297 1.00 0.48 C ATOM 1437 CG MET A 212 2.506 1.431 -0.107 1.00 1.72 C ATOM 1438 SD MET A 212 4.121 1.435 0.719 1.00 1.89 S ATOM 1439 CE MET A 212 3.973 2.863 1.767 1.00 0.30 C ATOM 0 H MET A 212 1.277 3.449 -2.692 1.00 0.27 H new ATOM 0 HA MET A 212 2.665 4.769 -0.577 1.00 0.32 H new ATOM 0 HB2 MET A 212 1.732 3.263 0.690 1.00 0.48 H new ATOM 0 HB3 MET A 212 0.892 2.691 -0.737 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.818 0.814 0.471 1.00 1.72 H new ATOM 0 HG3 MET A 212 2.613 0.959 -1.084 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.693 2.792 2.583 1.00 0.30 H new ATOM 0 HE2 MET A 212 4.171 3.763 1.185 1.00 0.30 H new ATOM 0 HE3 MET A 212 2.964 2.911 2.177 1.00 0.30 H new ATOM 1449 N CYS A 213 4.198 2.362 -2.214 1.00 0.27 N ATOM 1450 CA CYS A 213 5.506 1.834 -2.405 1.00 0.24 C ATOM 1451 C CYS A 213 6.297 2.776 -3.314 1.00 0.23 C ATOM 1452 O CYS A 213 7.528 2.748 -3.350 1.00 0.25 O ATOM 1453 CB CYS A 213 5.434 0.376 -2.862 1.00 0.27 C ATOM 1454 SG CYS A 213 5.421 -0.790 -1.450 1.00 0.68 S ATOM 0 H CYS A 213 3.450 1.892 -2.724 1.00 0.27 H new ATOM 0 HA CYS A 213 6.060 1.792 -1.467 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.536 0.229 -3.461 1.00 0.27 H new ATOM 0 HB3 CYS A 213 6.286 0.156 -3.505 1.00 0.27 H new ATOM 1459 N ILE A 214 5.570 3.637 -4.042 1.00 0.23 N ATOM 1460 CA ILE A 214 6.181 4.776 -4.725 1.00 0.24 C ATOM 1461 C ILE A 214 6.599 5.784 -3.682 1.00 0.25 C ATOM 1462 O ILE A 214 7.618 6.447 -3.800 1.00 0.30 O ATOM 1463 CB ILE A 214 5.198 5.494 -5.684 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.506 5.197 -7.145 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.248 7.000 -5.464 1.00 0.26 C ATOM 1466 CD1 ILE A 214 5.515 3.740 -7.463 1.00 0.34 C ATOM 0 H ILE A 214 4.561 3.562 -4.170 1.00 0.23 H new ATOM 0 HA ILE A 214 7.019 4.395 -5.308 1.00 0.24 H new ATOM 0 HB ILE A 214 4.201 5.115 -5.459 1.00 0.24 H new ATOM 0 HG12 ILE A 214 4.767 5.694 -7.773 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.477 5.623 -7.398 1.00 0.30 H new ATOM 0 HG21 ILE A 214 4.552 7.490 -6.145 1.00 0.26 H new ATOM 0 HG22 ILE A 214 4.969 7.227 -4.435 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.258 7.362 -5.655 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.741 3.600 -8.520 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.274 3.241 -6.860 1.00 0.34 H new ATOM 0 HD13 ILE A 214 4.537 3.313 -7.241 1.00 0.34 H new ATOM 1478 N THR A 215 5.757 5.945 -2.689 1.00 0.25 N ATOM 1479 CA THR A 215 6.091 6.784 -1.588 1.00 0.27 C ATOM 1480 C THR A 215 7.406 6.290 -1.032 1.00 0.26 C ATOM 1481 O THR A 215 8.265 7.080 -0.760 1.00 0.33 O ATOM 1482 CB THR A 215 5.003 6.786 -0.495 1.00 0.29 C ATOM 1483 OG1 THR A 215 4.571 8.124 -0.218 1.00 0.37 O ATOM 1484 CG2 THR A 215 5.539 6.143 0.764 1.00 0.31 C ATOM 0 H THR A 215 4.840 5.502 -2.631 1.00 0.25 H new ATOM 0 HA THR A 215 6.170 7.816 -1.930 1.00 0.27 H new ATOM 0 HB THR A 215 4.147 6.214 -0.853 1.00 0.29 H new ATOM 0 HG1 THR A 215 3.880 8.107 0.476 1.00 0.37 H new ATOM 0 HG21 THR A 215 4.766 6.147 1.532 1.00 0.31 H new ATOM 0 HG22 THR A 215 5.833 5.115 0.551 1.00 0.31 H new ATOM 0 HG23 THR A 215 6.405 6.702 1.118 1.00 0.31 H new ATOM 1492 N GLN A 216 7.549 4.965 -0.898 1.00 0.23 N ATOM 1493 CA GLN A 216 8.818 4.371 -0.485 1.00 0.25 C ATOM 1494 C GLN A 216 9.950 4.876 -1.360 1.00 0.31 C ATOM 1495 O GLN A 216 10.996 5.237 -0.842 1.00 0.39 O ATOM 1496 CB GLN A 216 8.788 2.852 -0.524 1.00 0.25 C ATOM 1497 CG GLN A 216 7.586 2.242 0.186 1.00 0.28 C ATOM 1498 CD GLN A 216 7.855 1.914 1.638 1.00 0.88 C ATOM 1499 OE1 GLN A 216 8.725 2.502 2.276 1.00 1.69 O ATOM 1500 NE2 GLN A 216 7.084 0.988 2.184 1.00 1.58 N ATOM 0 H GLN A 216 6.803 4.291 -1.070 1.00 0.23 H new ATOM 0 HA GLN A 216 8.984 4.675 0.549 1.00 0.25 H new ATOM 0 HB2 GLN A 216 8.789 2.525 -1.564 1.00 0.25 H new ATOM 0 HB3 GLN A 216 9.701 2.468 -0.068 1.00 0.25 H new ATOM 0 HG2 GLN A 216 6.747 2.935 0.126 1.00 0.28 H new ATOM 0 HG3 GLN A 216 7.287 1.333 -0.336 1.00 0.28 H new ATOM 0 HE21 GLN A 216 6.372 0.521 1.622 1.00 1.58 H new ATOM 0 HE22 GLN A 216 7.202 0.741 3.167 1.00 1.58 H new ATOM 1509 N TYR A 217 9.709 4.943 -2.677 1.00 0.38 N ATOM 1510 CA TYR A 217 10.676 5.514 -3.624 1.00 0.49 C ATOM 1511 C TYR A 217 11.304 6.785 -3.034 1.00 0.49 C ATOM 1512 O TYR A 217 12.491 7.051 -3.211 1.00 0.57 O ATOM 1513 CB TYR A 217 9.987 5.785 -4.974 1.00 0.73 C ATOM 1514 CG TYR A 217 10.686 6.762 -5.896 1.00 0.85 C ATOM 1515 CD1 TYR A 217 11.958 6.481 -6.380 1.00 0.97 C ATOM 1516 CD2 TYR A 217 10.096 7.964 -6.261 1.00 1.07 C ATOM 1517 CE1 TYR A 217 12.625 7.369 -7.199 1.00 1.18 C ATOM 1518 CE2 TYR A 217 10.756 8.854 -7.088 1.00 1.29 C ATOM 1519 CZ TYR A 217 11.915 8.556 -7.627 1.00 1.31 C ATOM 1520 OH TYR A 217 12.679 9.445 -8.364 1.00 1.56 O ATOM 0 H TYR A 217 8.849 4.607 -3.111 1.00 0.38 H new ATOM 0 HA TYR A 217 11.482 4.802 -3.800 1.00 0.49 H new ATOM 0 HB2 TYR A 217 9.877 4.836 -5.499 1.00 0.73 H new ATOM 0 HB3 TYR A 217 8.982 6.158 -4.777 1.00 0.73 H new ATOM 0 HD1 TYR A 217 12.434 5.550 -6.110 1.00 0.97 H new ATOM 0 HD2 TYR A 217 9.110 8.207 -5.895 1.00 1.07 H new ATOM 0 HE1 TYR A 217 13.643 7.185 -7.510 1.00 1.18 H new ATOM 0 HE2 TYR A 217 10.308 9.815 -7.295 1.00 1.29 H new ATOM 0 HH TYR A 217 12.131 10.217 -8.616 1.00 1.56 H new ATOM 1530 N GLN A 218 10.479 7.576 -2.353 1.00 0.46 N ATOM 1531 CA GLN A 218 10.971 8.715 -1.563 1.00 0.51 C ATOM 1532 C GLN A 218 11.062 8.434 -0.035 1.00 0.50 C ATOM 1533 O GLN A 218 11.775 9.135 0.680 1.00 0.61 O ATOM 1534 CB GLN A 218 10.105 9.958 -1.836 1.00 0.53 C ATOM 1535 CG GLN A 218 8.616 9.765 -1.620 1.00 0.48 C ATOM 1536 CD GLN A 218 8.111 10.440 -0.360 1.00 0.72 C ATOM 1537 OE1 GLN A 218 7.729 11.611 -0.371 1.00 1.31 O ATOM 1538 NE2 GLN A 218 8.091 9.703 0.736 1.00 1.52 N ATOM 0 H GLN A 218 9.467 7.454 -2.329 1.00 0.46 H new ATOM 0 HA GLN A 218 11.995 8.895 -1.890 1.00 0.51 H new ATOM 0 HB2 GLN A 218 10.448 10.769 -1.193 1.00 0.53 H new ATOM 0 HB3 GLN A 218 10.269 10.277 -2.865 1.00 0.53 H new ATOM 0 HG2 GLN A 218 8.075 10.160 -2.480 1.00 0.48 H new ATOM 0 HG3 GLN A 218 8.397 8.699 -1.568 1.00 0.48 H new ATOM 0 HE21 GLN A 218 8.415 8.736 0.707 1.00 1.52 H new ATOM 0 HE22 GLN A 218 7.751 10.100 1.612 1.00 1.52 H new ATOM 1547 N GLN A 219 10.335 7.431 0.460 1.00 0.40 N ATOM 1548 CA GLN A 219 10.102 7.269 1.899 1.00 0.41 C ATOM 1549 C GLN A 219 10.995 6.226 2.540 1.00 0.39 C ATOM 1550 O GLN A 219 11.271 6.301 3.735 1.00 0.46 O ATOM 1551 CB GLN A 219 8.647 6.939 2.240 1.00 0.45 C ATOM 1552 CG GLN A 219 8.396 5.456 2.394 1.00 0.44 C ATOM 1553 CD GLN A 219 7.470 5.122 3.551 1.00 0.81 C ATOM 1554 OE1 GLN A 219 6.256 5.020 3.399 1.00 1.64 O ATOM 1555 NE2 GLN A 219 8.051 4.952 4.728 1.00 1.26 N ATOM 0 H GLN A 219 9.895 6.714 -0.117 1.00 0.40 H new ATOM 0 HA GLN A 219 10.351 8.246 2.312 1.00 0.41 H new ATOM 0 HB2 GLN A 219 8.373 7.446 3.165 1.00 0.45 H new ATOM 0 HB3 GLN A 219 7.998 7.332 1.457 1.00 0.45 H new ATOM 0 HG2 GLN A 219 7.966 5.069 1.470 1.00 0.44 H new ATOM 0 HG3 GLN A 219 9.348 4.946 2.541 1.00 0.44 H new ATOM 0 HE21 GLN A 219 9.063 5.045 4.815 1.00 1.26 H new ATOM 0 HE22 GLN A 219 7.487 4.728 5.548 1.00 1.26 H new ATOM 1564 N GLU A 220 11.401 5.213 1.807 1.00 0.35 N ATOM 1565 CA GLU A 220 12.267 4.236 2.410 1.00 0.39 C ATOM 1566 C GLU A 220 13.643 4.809 2.459 1.00 0.48 C ATOM 1567 O GLU A 220 14.474 4.408 3.260 1.00 0.55 O ATOM 1568 CB GLU A 220 12.313 2.916 1.684 1.00 0.50 C ATOM 1569 CG GLU A 220 13.558 2.785 0.855 1.00 1.11 C ATOM 1570 CD GLU A 220 13.410 3.492 -0.458 1.00 2.32 C ATOM 1571 OE1 GLU A 220 12.480 3.166 -1.216 1.00 2.80 O ATOM 1572 OE2 GLU A 220 14.255 4.343 -0.754 1.00 3.07 O ATOM 0 H GLU A 220 11.155 5.050 0.831 1.00 0.35 H new ATOM 0 HA GLU A 220 11.866 4.022 3.401 1.00 0.39 H new ATOM 0 HB2 GLU A 220 12.269 2.101 2.406 1.00 0.50 H new ATOM 0 HB3 GLU A 220 11.437 2.822 1.043 1.00 0.50 H new ATOM 0 HG2 GLU A 220 14.407 3.198 1.400 1.00 1.11 H new ATOM 0 HG3 GLU A 220 13.774 1.731 0.681 1.00 1.11 H new ATOM 1579 N SER A 221 13.870 5.781 1.607 1.00 0.52 N ATOM 1580 CA SER A 221 15.126 6.452 1.585 1.00 0.63 C ATOM 1581 C SER A 221 15.305 7.173 2.922 1.00 0.68 C ATOM 1582 O SER A 221 16.345 7.757 3.235 1.00 0.81 O ATOM 1583 CB SER A 221 15.169 7.411 0.416 1.00 0.70 C ATOM 1584 OG SER A 221 14.650 8.688 0.755 1.00 0.86 O ATOM 0 H SER A 221 13.193 6.117 0.923 1.00 0.52 H new ATOM 0 HA SER A 221 15.946 5.746 1.455 1.00 0.63 H new ATOM 0 HB2 SER A 221 16.198 7.518 0.073 1.00 0.70 H new ATOM 0 HB3 SER A 221 14.597 6.996 -0.414 1.00 0.70 H new ATOM 0 HG SER A 221 13.673 8.675 0.679 1.00 0.86 H new ATOM 1590 N GLN A 222 14.214 7.144 3.675 1.00 0.62 N ATOM 1591 CA GLN A 222 14.158 7.569 5.048 1.00 0.66 C ATOM 1592 C GLN A 222 14.306 6.362 5.977 1.00 0.60 C ATOM 1593 O GLN A 222 15.303 6.219 6.680 1.00 0.63 O ATOM 1594 CB GLN A 222 12.799 8.227 5.283 1.00 0.71 C ATOM 1595 CG GLN A 222 12.310 9.034 4.093 1.00 0.88 C ATOM 1596 CD GLN A 222 11.007 9.763 4.364 1.00 0.95 C ATOM 1597 OE1 GLN A 222 10.188 9.323 5.174 1.00 1.36 O ATOM 1598 NE2 GLN A 222 10.801 10.873 3.674 1.00 1.60 N ATOM 0 H GLN A 222 13.316 6.810 3.324 1.00 0.62 H new ATOM 0 HA GLN A 222 14.966 8.270 5.256 1.00 0.66 H new ATOM 0 HB2 GLN A 222 12.065 7.456 5.517 1.00 0.71 H new ATOM 0 HB3 GLN A 222 12.864 8.879 6.154 1.00 0.71 H new ATOM 0 HG2 GLN A 222 13.074 9.760 3.815 1.00 0.88 H new ATOM 0 HG3 GLN A 222 12.177 8.368 3.240 1.00 0.88 H new ATOM 0 HE21 GLN A 222 11.506 11.201 3.014 1.00 1.60 H new ATOM 0 HE22 GLN A 222 9.937 11.400 3.802 1.00 1.60 H new ATOM 1607 N ALA A 223 13.315 5.469 5.934 1.00 0.56 N ATOM 1608 CA ALA A 223 13.234 4.370 6.893 1.00 0.54 C ATOM 1609 C ALA A 223 14.101 3.192 6.514 1.00 0.53 C ATOM 1610 O ALA A 223 14.714 2.575 7.374 1.00 0.60 O ATOM 1611 CB ALA A 223 11.812 3.886 7.050 1.00 0.59 C ATOM 0 H ALA A 223 12.561 5.487 5.247 1.00 0.56 H new ATOM 0 HA ALA A 223 13.600 4.778 7.835 1.00 0.54 H new ATOM 0 HB1 ALA A 223 11.783 3.068 7.770 1.00 0.59 H new ATOM 0 HB2 ALA A 223 11.186 4.705 7.406 1.00 0.59 H new ATOM 0 HB3 ALA A 223 11.439 3.536 6.088 1.00 0.59 H new ATOM 1617 N ALA A 224 14.160 2.858 5.239 1.00 0.54 N ATOM 1618 CA ALA A 224 14.951 1.723 4.823 1.00 0.64 C ATOM 1619 C ALA A 224 16.374 2.171 4.616 1.00 0.74 C ATOM 1620 O ALA A 224 17.257 1.385 4.298 1.00 0.89 O ATOM 1621 CB ALA A 224 14.414 1.059 3.581 1.00 0.77 C ATOM 0 H ALA A 224 13.677 3.349 4.487 1.00 0.54 H new ATOM 0 HA ALA A 224 14.903 0.971 5.611 1.00 0.64 H new ATOM 0 HB1 ALA A 224 15.049 0.213 3.317 1.00 0.77 H new ATOM 0 HB2 ALA A 224 13.399 0.707 3.767 1.00 0.77 H new ATOM 0 HB3 ALA A 224 14.405 1.776 2.760 1.00 0.77 H new ATOM 1627 N TYR A 225 16.569 3.460 4.785 1.00 0.72 N ATOM 1628 CA TYR A 225 17.888 4.022 4.816 1.00 0.85 C ATOM 1629 C TYR A 225 18.400 3.858 6.215 1.00 0.89 C ATOM 1630 O TYR A 225 19.518 3.414 6.466 1.00 1.06 O ATOM 1631 CB TYR A 225 17.846 5.498 4.436 1.00 0.85 C ATOM 1632 CG TYR A 225 19.212 6.129 4.352 1.00 0.97 C ATOM 1633 CD1 TYR A 225 19.921 6.103 3.161 1.00 1.21 C ATOM 1634 CD2 TYR A 225 19.793 6.744 5.456 1.00 0.95 C ATOM 1635 CE1 TYR A 225 21.174 6.669 3.065 1.00 1.36 C ATOM 1636 CE2 TYR A 225 21.051 7.313 5.367 1.00 1.11 C ATOM 1637 CZ TYR A 225 21.735 7.274 4.168 1.00 1.29 C ATOM 1638 OH TYR A 225 22.989 7.833 4.072 1.00 1.47 O ATOM 0 H TYR A 225 15.818 4.140 4.904 1.00 0.72 H new ATOM 0 HA TYR A 225 18.540 3.519 4.102 1.00 0.85 H new ATOM 0 HB2 TYR A 225 17.344 5.605 3.474 1.00 0.85 H new ATOM 0 HB3 TYR A 225 17.248 6.038 5.170 1.00 0.85 H new ATOM 0 HD1 TYR A 225 19.484 5.631 2.293 1.00 1.21 H new ATOM 0 HD2 TYR A 225 19.256 6.778 6.393 1.00 0.95 H new ATOM 0 HE1 TYR A 225 21.713 6.638 2.130 1.00 1.36 H new ATOM 0 HE2 TYR A 225 21.496 7.785 6.231 1.00 1.11 H new ATOM 0 HH TYR A 225 23.241 8.220 4.936 1.00 1.47 H new ATOM 1648 N GLN A 226 17.523 4.228 7.110 1.00 0.77 N ATOM 1649 CA GLN A 226 17.667 3.990 8.517 1.00 0.84 C ATOM 1650 C GLN A 226 17.902 2.499 8.822 1.00 0.88 C ATOM 1651 O GLN A 226 18.884 2.138 9.470 1.00 0.96 O ATOM 1652 CB GLN A 226 16.388 4.480 9.178 1.00 0.81 C ATOM 1653 CG GLN A 226 15.900 3.571 10.255 1.00 1.19 C ATOM 1654 CD GLN A 226 14.626 4.062 10.913 1.00 1.90 C ATOM 1655 OE1 GLN A 226 13.520 3.737 10.481 1.00 2.75 O ATOM 1656 NE2 GLN A 226 14.774 4.849 11.964 1.00 2.24 N ATOM 0 H GLN A 226 16.662 4.719 6.869 1.00 0.77 H new ATOM 0 HA GLN A 226 18.538 4.520 8.902 1.00 0.84 H new ATOM 0 HB2 GLN A 226 16.560 5.471 9.598 1.00 0.81 H new ATOM 0 HB3 GLN A 226 15.612 4.585 8.420 1.00 0.81 H new ATOM 0 HG2 GLN A 226 15.727 2.580 9.835 1.00 1.19 H new ATOM 0 HG3 GLN A 226 16.676 3.465 11.013 1.00 1.19 H new ATOM 0 HE21 GLN A 226 15.709 5.094 12.290 1.00 2.24 H new ATOM 0 HE22 GLN A 226 13.953 5.211 12.449 1.00 2.24 H new