USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 819 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 187 HIS : no HE2:sc= -1.38 K(o=-2.9,f=-6.9!) USER MOD Set 1.2: A 206 MET CE :methyl -167:sc= -1.53 (180deg=-2.54) USER MOD Set 2.1: A 171 ASN : amide:sc= 0.481 K(o=0.47,f=2) USER MOD Set 2.2: A 174 THR OG1 : rot -160:sc=-0.00961 USER MOD Set 3.1: A 162 TYR OH : rot 180:sc= 0.171 USER MOD Set 3.2: A 186 GLN : amide:sc= 0.0238 K(o=0.19,f=-2.6!) USER MOD Set 4.1: A 150 TYR OH : rot -171:sc= 1.3 USER MOD Set 4.2: A 154 MET CE :methyl 176:sc= -0.64 (180deg=-0.676) USER MOD Single : A 128 TYR OH : rot -152:sc= 1.27 USER MOD Single : A 129 MET CE :methyl -170:sc= -0.29 (180deg=-0.482) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 179:sc= -1.85 (180deg=-1.89) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -171:sc= 0 (180deg=-0.027) USER MOD Single : A 140 HIS : no HD1:sc= -0.0083 X(o=-0.0083,f=0) USER MOD Single : A 143 ASN : amide:sc= 0.0067 X(o=0.0067,f=-0.078) USER MOD Single : A 149 TYR OH : rot -11:sc= 1.24 USER MOD Single : A 153 ASN : amide:sc= 1.43 K(o=1.4,f=-3.2!) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 9:sc= 1.06 USER MOD Single : A 159 ASN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 160 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.13) USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0.843 K(o=0.84,f=-3.9!) USER MOD Single : A 169 TYR OH : rot 149:sc= 0.164 USER MOD Single : A 170 ASN : amide:sc= -1.06 K(o=-1.1,f=-0.042) USER MOD Single : A 172 GLN : amide:sc= -0.38 K(o=-0.38,f=-2.8) USER MOD Single : A 173 ASN : amide:sc= -0.49 X(o=-0.49,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 72:sc= 0.831 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 180:sc= -0.0386 USER MOD Single : A 192 THR OG1 : rot 72:sc= 0.886 USER MOD Single : A 193 THR OG1 : rot 63:sc= 0.568 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 THR OG1 : rot 60:sc= 1.41 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 163:sc= -1.96 (180deg=-2.16) USER MOD Single : A 212 GLN : amide:sc= -1.02 K(o=-1,f=-0.26) USER MOD Single : A 213 MET CE :methyl 177:sc= 0 (180deg=-0.0109) USER MOD Single : A 216 THR OG1 : rot 82:sc= 0.118 USER MOD Single : A 217 GLN : amide:sc= -1.12 K(o=-1.1,f=0.32) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 44:sc= 1.4 USER MOD Single : A 223 GLN : amide:sc= -0.285 K(o=-0.29,f=-1.1) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N LEU A 125 6.003 -13.506 -0.229 1.00 0.00 N ATOM 48 CA LEU A 125 6.430 -12.251 0.328 1.00 0.00 C ATOM 49 C LEU A 125 7.957 -12.254 0.507 1.00 0.00 C ATOM 50 O LEU A 125 8.481 -12.636 1.553 1.00 0.00 O ATOM 51 CB LEU A 125 5.630 -12.016 1.615 1.00 0.00 C ATOM 52 CG LEU A 125 4.841 -10.706 1.662 1.00 0.00 C ATOM 53 CD1 LEU A 125 3.399 -10.945 1.195 1.00 0.00 C ATOM 54 CD2 LEU A 125 4.880 -10.221 3.104 1.00 0.00 C ATOM 0 HA LEU A 125 6.226 -11.410 -0.335 1.00 0.00 H new ATOM 0 HB2 LEU A 125 4.935 -12.845 1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.318 -12.038 2.460 1.00 0.00 H new ATOM 0 HG LEU A 125 5.272 -9.956 0.999 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.845 -10.007 1.232 1.00 0.00 H new ATOM 0 HD12 LEU A 125 3.406 -11.323 0.173 1.00 0.00 H new ATOM 0 HD13 LEU A 125 2.921 -11.675 1.849 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.328 -9.285 3.188 1.00 0.00 H new ATOM 0 HD22 LEU A 125 4.425 -10.970 3.752 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.915 -10.060 3.406 1.00 0.00 H new ATOM 66 N GLY A 126 8.703 -11.832 -0.515 1.00 0.00 N ATOM 67 CA GLY A 126 10.157 -11.802 -0.488 1.00 0.00 C ATOM 68 C GLY A 126 10.715 -10.686 0.390 1.00 0.00 C ATOM 69 O GLY A 126 11.302 -9.733 -0.125 1.00 0.00 O ATOM 0 H GLY A 126 8.305 -11.499 -1.393 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.528 -12.761 -0.126 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.531 -11.678 -1.504 1.00 0.00 H new ATOM 73 N GLY A 127 10.555 -10.809 1.710 1.00 0.00 N ATOM 74 CA GLY A 127 11.012 -9.848 2.700 1.00 0.00 C ATOM 75 C GLY A 127 10.415 -8.476 2.422 1.00 0.00 C ATOM 76 O GLY A 127 11.149 -7.493 2.294 1.00 0.00 O ATOM 0 H GLY A 127 10.085 -11.613 2.127 1.00 0.00 H new ATOM 0 HA2 GLY A 127 10.726 -10.181 3.698 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.100 -9.788 2.683 1.00 0.00 H new ATOM 80 N TYR A 128 9.092 -8.423 2.262 1.00 0.00 N ATOM 81 CA TYR A 128 8.383 -7.160 2.186 1.00 0.00 C ATOM 82 C TYR A 128 8.349 -6.588 3.599 1.00 0.00 C ATOM 83 O TYR A 128 7.742 -7.170 4.508 1.00 0.00 O ATOM 84 CB TYR A 128 6.991 -7.319 1.567 1.00 0.00 C ATOM 85 CG TYR A 128 7.042 -7.526 0.066 1.00 0.00 C ATOM 86 CD1 TYR A 128 7.255 -8.827 -0.398 1.00 0.00 C ATOM 87 CD2 TYR A 128 6.901 -6.465 -0.860 1.00 0.00 C ATOM 88 CE1 TYR A 128 7.282 -9.092 -1.767 1.00 0.00 C ATOM 89 CE2 TYR A 128 7.020 -6.706 -2.249 1.00 0.00 C ATOM 90 CZ TYR A 128 7.201 -8.042 -2.697 1.00 0.00 C ATOM 91 OH TYR A 128 7.267 -8.389 -4.007 1.00 0.00 O ATOM 0 H TYR A 128 8.495 -9.246 2.183 1.00 0.00 H new ATOM 0 HA TYR A 128 8.895 -6.466 1.520 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.486 -8.167 2.030 1.00 0.00 H new ATOM 0 HB3 TYR A 128 6.395 -6.433 1.788 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.400 -9.632 0.308 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.701 -5.465 -0.504 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.366 -10.111 -2.115 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.974 -5.890 -2.955 1.00 0.00 H new ATOM 0 HH TYR A 128 7.641 -7.645 -4.524 1.00 0.00 H new ATOM 101 N MET A 129 9.055 -5.478 3.769 1.00 0.00 N ATOM 102 CA MET A 129 8.999 -4.618 4.932 1.00 0.00 C ATOM 103 C MET A 129 7.667 -3.883 4.944 1.00 0.00 C ATOM 104 O MET A 129 6.896 -3.981 3.989 1.00 0.00 O ATOM 105 CB MET A 129 10.163 -3.620 4.869 1.00 0.00 C ATOM 106 CG MET A 129 11.524 -4.305 5.030 1.00 0.00 C ATOM 107 SD MET A 129 12.890 -3.416 4.248 1.00 0.00 S ATOM 108 CE MET A 129 12.568 -3.844 2.520 1.00 0.00 C ATOM 0 H MET A 129 9.711 -5.142 3.064 1.00 0.00 H new ATOM 0 HA MET A 129 9.084 -5.207 5.845 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.135 -3.092 3.916 1.00 0.00 H new ATOM 0 HB3 MET A 129 10.040 -2.872 5.652 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.739 -4.419 6.093 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.467 -5.308 4.607 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.411 -3.531 1.904 1.00 0.00 H new ATOM 0 HE2 MET A 129 12.434 -4.922 2.431 1.00 0.00 H new ATOM 0 HE3 MET A 129 11.664 -3.337 2.182 1.00 0.00 H new ATOM 118 N LEU A 130 7.396 -3.138 6.014 1.00 0.00 N ATOM 119 CA LEU A 130 6.140 -2.444 6.237 1.00 0.00 C ATOM 120 C LEU A 130 6.456 -1.049 6.769 1.00 0.00 C ATOM 121 O LEU A 130 7.185 -0.934 7.758 1.00 0.00 O ATOM 122 CB LEU A 130 5.299 -3.292 7.204 1.00 0.00 C ATOM 123 CG LEU A 130 3.839 -2.838 7.352 1.00 0.00 C ATOM 124 CD1 LEU A 130 3.088 -2.863 6.012 1.00 0.00 C ATOM 125 CD2 LEU A 130 3.138 -3.774 8.339 1.00 0.00 C ATOM 0 H LEU A 130 8.068 -3.000 6.769 1.00 0.00 H new ATOM 0 HA LEU A 130 5.559 -2.316 5.324 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.311 -4.327 6.862 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.772 -3.275 8.186 1.00 0.00 H new ATOM 0 HG LEU A 130 3.835 -1.809 7.712 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.060 -2.534 6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.581 -2.195 5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.089 -3.877 5.613 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.099 -3.466 8.457 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.173 -4.795 7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.642 -3.728 9.305 1.00 0.00 H new ATOM 137 N GLY A 131 5.989 -0.004 6.081 1.00 0.00 N ATOM 138 CA GLY A 131 6.285 1.384 6.426 1.00 0.00 C ATOM 139 C GLY A 131 5.789 1.717 7.830 1.00 0.00 C ATOM 140 O GLY A 131 4.751 1.218 8.251 1.00 0.00 O ATOM 0 H GLY A 131 5.389 -0.101 5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.360 1.556 6.366 1.00 0.00 H new ATOM 0 HA3 GLY A 131 5.815 2.050 5.703 1.00 0.00 H new ATOM 144 N SER A 132 6.506 2.587 8.540 1.00 0.00 N ATOM 145 CA SER A 132 6.367 2.833 9.975 1.00 0.00 C ATOM 146 C SER A 132 4.948 3.166 10.451 1.00 0.00 C ATOM 147 O SER A 132 4.557 2.800 11.554 1.00 0.00 O ATOM 148 CB SER A 132 7.265 4.018 10.320 1.00 0.00 C ATOM 149 OG SER A 132 8.633 3.736 10.082 1.00 0.00 O ATOM 0 H SER A 132 7.230 3.164 8.113 1.00 0.00 H new ATOM 0 HA SER A 132 6.640 1.904 10.476 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.965 4.884 9.729 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.127 4.284 11.368 1.00 0.00 H new ATOM 0 HG SER A 132 9.174 4.520 10.314 1.00 0.00 H new ATOM 155 N ALA A 133 4.213 3.891 9.624 1.00 0.00 N ATOM 156 CA ALA A 133 2.908 4.535 9.761 1.00 0.00 C ATOM 157 C ALA A 133 2.900 5.693 8.769 1.00 0.00 C ATOM 158 O ALA A 133 3.863 6.459 8.708 1.00 0.00 O ATOM 159 CB ALA A 133 2.619 5.046 11.184 1.00 0.00 C ATOM 0 H ALA A 133 4.577 4.071 8.688 1.00 0.00 H new ATOM 0 HA ALA A 133 2.124 3.806 9.559 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.634 5.512 11.210 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.644 4.210 11.883 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.374 5.779 11.468 1.00 0.00 H new ATOM 165 N MET A 134 1.834 5.828 7.987 1.00 0.00 N ATOM 166 CA MET A 134 1.643 6.845 6.958 1.00 0.00 C ATOM 167 C MET A 134 0.233 7.432 7.117 1.00 0.00 C ATOM 168 O MET A 134 -0.562 6.950 7.934 1.00 0.00 O ATOM 169 CB MET A 134 1.899 6.212 5.575 1.00 0.00 C ATOM 170 CG MET A 134 3.377 5.828 5.369 1.00 0.00 C ATOM 171 SD MET A 134 3.689 4.267 4.506 1.00 0.00 S ATOM 172 CE MET A 134 3.217 4.782 2.846 1.00 0.00 C ATOM 0 H MET A 134 1.036 5.196 8.058 1.00 0.00 H new ATOM 0 HA MET A 134 2.349 7.669 7.058 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.277 5.324 5.464 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.596 6.912 4.796 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.864 6.629 4.813 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.857 5.780 6.346 1.00 0.00 H new ATOM 0 HE1 MET A 134 3.358 3.952 2.154 1.00 0.00 H new ATOM 0 HE2 MET A 134 2.170 5.084 2.843 1.00 0.00 H new ATOM 0 HE3 MET A 134 3.838 5.623 2.536 1.00 0.00 H new ATOM 182 N SER A 135 -0.061 8.523 6.411 1.00 0.00 N ATOM 183 CA SER A 135 -1.339 9.233 6.467 1.00 0.00 C ATOM 184 C SER A 135 -2.349 8.537 5.543 1.00 0.00 C ATOM 185 O SER A 135 -2.075 7.463 5.010 1.00 0.00 O ATOM 186 CB SER A 135 -1.113 10.709 6.081 1.00 0.00 C ATOM 187 OG SER A 135 -1.686 11.580 7.032 1.00 0.00 O ATOM 0 H SER A 135 0.603 8.950 5.765 1.00 0.00 H new ATOM 0 HA SER A 135 -1.750 9.212 7.476 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.044 10.907 6.001 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.547 10.901 5.100 1.00 0.00 H new ATOM 0 HG SER A 135 -1.526 12.509 6.763 1.00 0.00 H new ATOM 193 N ARG A 136 -3.518 9.142 5.327 1.00 0.00 N ATOM 194 CA ARG A 136 -4.449 8.752 4.273 1.00 0.00 C ATOM 195 C ARG A 136 -4.516 9.933 3.298 1.00 0.00 C ATOM 196 O ARG A 136 -5.102 10.952 3.669 1.00 0.00 O ATOM 197 CB ARG A 136 -5.830 8.382 4.849 1.00 0.00 C ATOM 198 CG ARG A 136 -5.769 7.464 6.079 1.00 0.00 C ATOM 199 CD ARG A 136 -7.174 7.017 6.496 1.00 0.00 C ATOM 200 NE ARG A 136 -7.168 6.392 7.826 1.00 0.00 N ATOM 201 CZ ARG A 136 -6.939 5.105 8.111 1.00 0.00 C ATOM 202 NH1 ARG A 136 -6.683 4.224 7.155 1.00 0.00 N ATOM 203 NH2 ARG A 136 -6.965 4.705 9.371 1.00 0.00 N ATOM 0 H ARG A 136 -3.847 9.927 5.888 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.110 7.855 3.756 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.357 9.297 5.118 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.417 7.892 4.072 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.156 6.591 5.856 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.289 7.988 6.906 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.844 7.877 6.500 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.565 6.311 5.763 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.359 7.006 8.618 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.658 4.522 6.180 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.511 3.247 7.394 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.158 5.375 10.115 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.792 3.726 9.599 1.00 0.00 H new ATOM 217 N PRO A 137 -3.880 9.878 2.112 1.00 0.00 N ATOM 218 CA PRO A 137 -3.933 10.982 1.158 1.00 0.00 C ATOM 219 C PRO A 137 -5.360 11.169 0.639 1.00 0.00 C ATOM 220 O PRO A 137 -6.056 10.179 0.387 1.00 0.00 O ATOM 221 CB PRO A 137 -2.957 10.611 0.037 1.00 0.00 C ATOM 222 CG PRO A 137 -2.844 9.089 0.115 1.00 0.00 C ATOM 223 CD PRO A 137 -3.068 8.786 1.596 1.00 0.00 C ATOM 0 HA PRO A 137 -3.652 11.933 1.611 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.330 10.932 -0.936 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -1.988 11.089 0.180 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.590 8.599 -0.511 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -1.867 8.742 -0.222 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.573 7.829 1.726 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.119 8.720 2.128 1.00 0.00 H new ATOM 231 N MET A 138 -5.799 12.414 0.438 1.00 0.00 N ATOM 232 CA MET A 138 -7.082 12.704 -0.188 1.00 0.00 C ATOM 233 C MET A 138 -6.921 12.558 -1.696 1.00 0.00 C ATOM 234 O MET A 138 -6.656 13.513 -2.420 1.00 0.00 O ATOM 235 CB MET A 138 -7.592 14.095 0.227 1.00 0.00 C ATOM 236 CG MET A 138 -9.086 14.255 -0.070 1.00 0.00 C ATOM 237 SD MET A 138 -10.127 13.227 1.004 1.00 0.00 S ATOM 238 CE MET A 138 -11.734 13.261 0.165 1.00 0.00 C ATOM 0 H MET A 138 -5.272 13.245 0.706 1.00 0.00 H new ATOM 0 HA MET A 138 -7.841 11.998 0.149 1.00 0.00 H new ATOM 0 HB2 MET A 138 -7.413 14.247 1.291 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.030 14.863 -0.304 1.00 0.00 H new ATOM 0 HG2 MET A 138 -9.367 15.301 0.052 1.00 0.00 H new ATOM 0 HG3 MET A 138 -9.275 13.994 -1.111 1.00 0.00 H new ATOM 0 HE1 MET A 138 -12.488 12.804 0.805 1.00 0.00 H new ATOM 0 HE2 MET A 138 -12.013 14.294 -0.045 1.00 0.00 H new ATOM 0 HE3 MET A 138 -11.668 12.706 -0.771 1.00 0.00 H new ATOM 248 N ILE A 139 -7.045 11.316 -2.149 1.00 0.00 N ATOM 249 CA ILE A 139 -7.059 10.942 -3.552 1.00 0.00 C ATOM 250 C ILE A 139 -8.186 11.736 -4.187 1.00 0.00 C ATOM 251 O ILE A 139 -9.340 11.610 -3.772 1.00 0.00 O ATOM 252 CB ILE A 139 -7.310 9.430 -3.703 1.00 0.00 C ATOM 253 CG1 ILE A 139 -6.238 8.596 -2.960 1.00 0.00 C ATOM 254 CG2 ILE A 139 -7.465 8.996 -5.173 1.00 0.00 C ATOM 255 CD1 ILE A 139 -5.011 8.302 -3.825 1.00 0.00 C ATOM 0 H ILE A 139 -7.142 10.515 -1.524 1.00 0.00 H new ATOM 0 HA ILE A 139 -6.104 11.156 -4.032 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.268 9.225 -3.225 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -5.925 9.131 -2.063 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -6.679 7.655 -2.632 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.640 7.921 -5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.310 9.520 -5.620 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.555 9.239 -5.722 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -4.294 7.715 -3.252 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -5.315 7.741 -4.709 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -4.549 9.240 -4.132 1.00 0.00 H new ATOM 267 N HIS A 140 -7.842 12.537 -5.186 1.00 0.00 N ATOM 268 CA HIS A 140 -8.818 13.132 -6.068 1.00 0.00 C ATOM 269 C HIS A 140 -9.206 12.035 -7.044 1.00 0.00 C ATOM 270 O HIS A 140 -8.540 11.838 -8.062 1.00 0.00 O ATOM 271 CB HIS A 140 -8.215 14.368 -6.740 1.00 0.00 C ATOM 272 CG HIS A 140 -7.844 15.403 -5.715 1.00 0.00 C ATOM 273 ND1 HIS A 140 -8.708 16.313 -5.154 1.00 0.00 N ATOM 274 CD2 HIS A 140 -6.644 15.504 -5.067 1.00 0.00 C ATOM 275 CE1 HIS A 140 -8.044 16.942 -4.171 1.00 0.00 C ATOM 276 NE2 HIS A 140 -6.766 16.525 -4.117 1.00 0.00 N ATOM 0 H HIS A 140 -6.877 12.788 -5.402 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.709 13.490 -5.553 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -7.332 14.083 -7.312 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.930 14.789 -7.447 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -5.764 14.906 -5.254 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.477 17.682 -3.514 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -6.032 16.882 -3.505 1.00 0.00 H new ATOM 284 N PHE A 141 -10.231 11.256 -6.709 1.00 0.00 N ATOM 285 CA PHE A 141 -10.796 10.327 -7.669 1.00 0.00 C ATOM 286 C PHE A 141 -11.542 11.128 -8.738 1.00 0.00 C ATOM 287 O PHE A 141 -11.684 10.693 -9.886 1.00 0.00 O ATOM 288 CB PHE A 141 -11.767 9.378 -6.992 1.00 0.00 C ATOM 289 CG PHE A 141 -11.110 8.361 -6.083 1.00 0.00 C ATOM 290 CD1 PHE A 141 -10.888 8.663 -4.733 1.00 0.00 C ATOM 291 CD2 PHE A 141 -10.747 7.099 -6.586 1.00 0.00 C ATOM 292 CE1 PHE A 141 -10.327 7.695 -3.886 1.00 0.00 C ATOM 293 CE2 PHE A 141 -10.183 6.130 -5.733 1.00 0.00 C ATOM 294 CZ PHE A 141 -9.967 6.432 -4.374 1.00 0.00 C ATOM 0 H PHE A 141 -10.678 11.252 -5.792 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.992 9.741 -8.115 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.481 9.961 -6.410 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.335 8.850 -7.758 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.148 9.637 -4.346 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.901 6.872 -7.630 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.170 7.927 -2.843 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.917 5.158 -6.120 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.528 5.697 -3.715 1.00 0.00 H new ATOM 304 N GLY A 142 -12.077 12.287 -8.333 1.00 0.00 N ATOM 305 CA GLY A 142 -12.911 13.159 -9.134 1.00 0.00 C ATOM 306 C GLY A 142 -14.352 12.678 -9.081 1.00 0.00 C ATOM 307 O GLY A 142 -15.259 13.468 -8.812 1.00 0.00 O ATOM 0 H GLY A 142 -11.926 12.649 -7.391 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -12.845 14.182 -8.764 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.558 13.169 -10.165 1.00 0.00 H new ATOM 311 N ASN A 143 -14.564 11.379 -9.309 1.00 0.00 N ATOM 312 CA ASN A 143 -15.867 10.772 -9.367 1.00 0.00 C ATOM 313 C ASN A 143 -16.546 10.927 -8.024 1.00 0.00 C ATOM 314 O ASN A 143 -15.994 10.458 -7.036 1.00 0.00 O ATOM 315 CB ASN A 143 -15.688 9.288 -9.672 1.00 0.00 C ATOM 316 CG ASN A 143 -16.456 8.920 -10.902 1.00 0.00 C ATOM 317 OD1 ASN A 143 -16.294 9.498 -11.970 1.00 0.00 O ATOM 318 ND2 ASN A 143 -17.316 7.947 -10.766 1.00 0.00 N ATOM 0 H ASN A 143 -13.804 10.716 -9.460 1.00 0.00 H new ATOM 0 HA ASN A 143 -16.475 11.246 -10.138 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -14.631 9.063 -9.813 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -16.031 8.691 -8.827 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -17.877 7.647 -11.563 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -17.426 7.487 -9.863 1.00 0.00 H new ATOM 325 N ASP A 144 -17.745 11.500 -7.997 1.00 0.00 N ATOM 326 CA ASP A 144 -18.444 11.883 -6.768 1.00 0.00 C ATOM 327 C ASP A 144 -18.375 10.800 -5.711 1.00 0.00 C ATOM 328 O ASP A 144 -17.968 11.057 -4.576 1.00 0.00 O ATOM 329 CB ASP A 144 -19.929 12.162 -7.032 1.00 0.00 C ATOM 330 CG ASP A 144 -20.221 13.438 -7.797 1.00 0.00 C ATOM 331 OD1 ASP A 144 -19.618 14.491 -7.516 1.00 0.00 O ATOM 332 OD2 ASP A 144 -21.171 13.420 -8.611 1.00 0.00 O ATOM 0 H ASP A 144 -18.271 11.717 -8.844 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.940 12.782 -6.413 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.347 11.322 -7.586 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.450 12.204 -6.075 1.00 0.00 H new ATOM 337 N TRP A 145 -18.784 9.587 -6.088 1.00 0.00 N ATOM 338 CA TRP A 145 -18.796 8.498 -5.143 1.00 0.00 C ATOM 339 C TRP A 145 -17.435 7.860 -4.976 1.00 0.00 C ATOM 340 O TRP A 145 -17.227 7.280 -3.925 1.00 0.00 O ATOM 341 CB TRP A 145 -19.770 7.397 -5.507 1.00 0.00 C ATOM 342 CG TRP A 145 -19.324 6.540 -6.658 1.00 0.00 C ATOM 343 CD1 TRP A 145 -19.448 6.786 -7.984 1.00 0.00 C ATOM 344 CD2 TRP A 145 -18.504 5.343 -6.552 1.00 0.00 C ATOM 345 NE1 TRP A 145 -18.830 5.769 -8.691 1.00 0.00 N ATOM 346 CE2 TRP A 145 -18.168 4.891 -7.856 1.00 0.00 C ATOM 347 CE3 TRP A 145 -17.967 4.637 -5.463 1.00 0.00 C ATOM 348 CZ2 TRP A 145 -17.336 3.780 -8.060 1.00 0.00 C ATOM 349 CZ3 TRP A 145 -17.085 3.568 -5.654 1.00 0.00 C ATOM 350 CH2 TRP A 145 -16.772 3.130 -6.951 1.00 0.00 C ATOM 0 H TRP A 145 -19.104 9.348 -7.027 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.111 8.966 -4.210 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -19.927 6.762 -4.635 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.733 7.845 -5.753 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.948 7.638 -8.420 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.860 5.679 -9.707 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.240 4.925 -4.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.131 3.428 -9.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.643 3.077 -4.800 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.100 2.297 -7.095 1.00 0.00 H new ATOM 361 N GLU A 146 -16.536 7.891 -5.961 1.00 0.00 N ATOM 362 CA GLU A 146 -15.230 7.284 -5.742 1.00 0.00 C ATOM 363 C GLU A 146 -14.540 8.086 -4.629 1.00 0.00 C ATOM 364 O GLU A 146 -13.939 7.533 -3.715 1.00 0.00 O ATOM 365 CB GLU A 146 -14.363 7.274 -7.007 1.00 0.00 C ATOM 366 CG GLU A 146 -14.736 6.222 -8.061 1.00 0.00 C ATOM 367 CD GLU A 146 -13.582 5.971 -9.058 1.00 0.00 C ATOM 368 OE1 GLU A 146 -12.972 6.943 -9.572 1.00 0.00 O ATOM 369 OE2 GLU A 146 -13.269 4.791 -9.343 1.00 0.00 O ATOM 0 H GLU A 146 -16.680 8.311 -6.879 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.362 6.239 -5.461 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.416 8.260 -7.469 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.325 7.115 -6.713 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.997 5.287 -7.565 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.621 6.551 -8.605 1.00 0.00 H new ATOM 376 N ASP A 147 -14.715 9.408 -4.660 1.00 0.00 N ATOM 377 CA ASP A 147 -14.117 10.365 -3.755 1.00 0.00 C ATOM 378 C ASP A 147 -14.828 10.270 -2.405 1.00 0.00 C ATOM 379 O ASP A 147 -14.210 10.441 -1.352 1.00 0.00 O ATOM 380 CB ASP A 147 -14.290 11.749 -4.398 1.00 0.00 C ATOM 381 CG ASP A 147 -13.064 12.657 -4.300 1.00 0.00 C ATOM 382 OD1 ASP A 147 -12.247 12.633 -5.255 1.00 0.00 O ATOM 383 OD2 ASP A 147 -13.016 13.443 -3.325 1.00 0.00 O ATOM 0 H ASP A 147 -15.311 9.854 -5.358 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.058 10.175 -3.583 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.544 11.617 -5.450 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.135 12.250 -3.927 1.00 0.00 H new ATOM 388 N ARG A 148 -16.141 9.984 -2.423 1.00 0.00 N ATOM 389 CA ARG A 148 -16.959 9.905 -1.232 1.00 0.00 C ATOM 390 C ARG A 148 -16.825 8.564 -0.532 1.00 0.00 C ATOM 391 O ARG A 148 -16.591 8.531 0.670 1.00 0.00 O ATOM 392 CB ARG A 148 -18.433 10.149 -1.563 1.00 0.00 C ATOM 393 CG ARG A 148 -19.301 10.046 -0.307 1.00 0.00 C ATOM 394 CD ARG A 148 -20.772 10.296 -0.624 1.00 0.00 C ATOM 395 NE ARG A 148 -21.515 9.069 -0.965 1.00 0.00 N ATOM 396 CZ ARG A 148 -22.737 9.068 -1.510 1.00 0.00 C ATOM 397 NH1 ARG A 148 -23.319 10.208 -1.859 1.00 0.00 N ATOM 398 NH2 ARG A 148 -23.384 7.927 -1.705 1.00 0.00 N ATOM 0 H ARG A 148 -16.657 9.801 -3.284 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.599 10.683 -0.559 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.550 11.136 -2.011 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -18.769 9.422 -2.302 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.186 9.057 0.136 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -18.959 10.769 0.434 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.245 10.771 0.235 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -20.843 10.997 -1.455 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.072 8.170 -0.775 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -22.835 11.094 -1.712 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -24.251 10.199 -2.274 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.950 7.043 -1.439 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.315 7.933 -2.121 1.00 0.00 H new ATOM 412 N TYR A 149 -17.118 7.471 -1.233 1.00 0.00 N ATOM 413 CA TYR A 149 -17.150 6.130 -0.699 1.00 0.00 C ATOM 414 C TYR A 149 -15.815 5.831 -0.030 1.00 0.00 C ATOM 415 O TYR A 149 -15.786 5.170 1.005 1.00 0.00 O ATOM 416 CB TYR A 149 -17.517 5.135 -1.797 1.00 0.00 C ATOM 417 CG TYR A 149 -17.583 3.685 -1.375 1.00 0.00 C ATOM 418 CD1 TYR A 149 -16.430 2.899 -1.474 1.00 0.00 C ATOM 419 CD2 TYR A 149 -18.781 3.108 -0.929 1.00 0.00 C ATOM 420 CE1 TYR A 149 -16.459 1.525 -1.191 1.00 0.00 C ATOM 421 CE2 TYR A 149 -18.823 1.731 -0.630 1.00 0.00 C ATOM 422 CZ TYR A 149 -17.670 0.924 -0.790 1.00 0.00 C ATOM 423 OH TYR A 149 -17.741 -0.424 -0.592 1.00 0.00 O ATOM 0 H TYR A 149 -17.347 7.507 -2.226 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.923 6.035 0.064 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.485 5.418 -2.209 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.789 5.227 -2.603 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -15.500 3.359 -1.774 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -19.667 3.715 -0.815 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -15.561 0.932 -1.280 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -19.742 1.288 -0.276 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.928 -0.848 -0.936 1.00 0.00 H new ATOM 433 N TYR A 150 -14.740 6.408 -0.576 1.00 0.00 N ATOM 434 CA TYR A 150 -13.444 6.444 0.052 1.00 0.00 C ATOM 435 C TYR A 150 -13.500 7.097 1.433 1.00 0.00 C ATOM 436 O TYR A 150 -13.240 6.424 2.431 1.00 0.00 O ATOM 437 CB TYR A 150 -12.445 7.166 -0.871 1.00 0.00 C ATOM 438 CG TYR A 150 -11.073 7.413 -0.279 1.00 0.00 C ATOM 439 CD1 TYR A 150 -10.426 6.396 0.443 1.00 0.00 C ATOM 440 CD2 TYR A 150 -10.424 8.645 -0.490 1.00 0.00 C ATOM 441 CE1 TYR A 150 -9.152 6.619 0.988 1.00 0.00 C ATOM 442 CE2 TYR A 150 -9.122 8.848 0.001 1.00 0.00 C ATOM 443 CZ TYR A 150 -8.488 7.842 0.764 1.00 0.00 C ATOM 444 OH TYR A 150 -7.255 8.034 1.300 1.00 0.00 O ATOM 0 H TYR A 150 -14.762 6.869 -1.486 1.00 0.00 H new ATOM 0 HA TYR A 150 -13.106 5.419 0.207 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.328 6.579 -1.782 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.874 8.125 -1.163 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.910 5.440 0.579 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.927 9.434 -1.029 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.679 5.851 1.581 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.606 9.774 -0.205 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.988 8.969 1.180 1.00 0.00 H new ATOM 454 N ARG A 151 -13.828 8.393 1.510 1.00 0.00 N ATOM 455 CA ARG A 151 -13.829 9.131 2.777 1.00 0.00 C ATOM 456 C ARG A 151 -14.735 8.471 3.822 1.00 0.00 C ATOM 457 O ARG A 151 -14.424 8.523 5.007 1.00 0.00 O ATOM 458 CB ARG A 151 -14.114 10.633 2.540 1.00 0.00 C ATOM 459 CG ARG A 151 -15.585 11.064 2.464 1.00 0.00 C ATOM 460 CD ARG A 151 -15.719 12.587 2.550 1.00 0.00 C ATOM 461 NE ARG A 151 -16.913 13.062 1.833 1.00 0.00 N ATOM 462 CZ ARG A 151 -17.082 14.322 1.424 1.00 0.00 C ATOM 463 NH1 ARG A 151 -16.372 15.307 1.956 1.00 0.00 N ATOM 464 NH2 ARG A 151 -17.979 14.618 0.496 1.00 0.00 N ATOM 0 H ARG A 151 -14.098 8.955 0.702 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.830 9.083 3.210 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -13.637 11.198 3.341 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -13.627 10.927 1.610 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -16.023 10.710 1.531 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -16.145 10.600 3.276 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.776 12.890 3.595 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.830 13.056 2.130 1.00 0.00 H new ATOM 0 HE ARG A 151 -17.655 12.390 1.637 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.688 15.106 2.686 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.510 16.266 1.636 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -18.550 13.880 0.085 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -18.099 15.584 0.192 1.00 0.00 H new ATOM 478 N GLU A 152 -15.813 7.817 3.386 1.00 0.00 N ATOM 479 CA GLU A 152 -16.798 7.161 4.240 1.00 0.00 C ATOM 480 C GLU A 152 -16.345 5.782 4.749 1.00 0.00 C ATOM 481 O GLU A 152 -17.041 5.173 5.566 1.00 0.00 O ATOM 482 CB GLU A 152 -18.114 7.032 3.469 1.00 0.00 C ATOM 483 CG GLU A 152 -18.758 8.392 3.179 1.00 0.00 C ATOM 484 CD GLU A 152 -19.531 8.996 4.352 1.00 0.00 C ATOM 485 OE1 GLU A 152 -18.950 9.260 5.430 1.00 0.00 O ATOM 486 OE2 GLU A 152 -20.720 9.323 4.146 1.00 0.00 O ATOM 0 H GLU A 152 -16.030 7.728 2.393 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.926 7.782 5.126 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.931 6.512 2.529 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.809 6.419 4.043 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -17.978 9.091 2.877 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.435 8.285 2.332 1.00 0.00 H new ATOM 493 N ASN A 153 -15.218 5.241 4.268 1.00 0.00 N ATOM 494 CA ASN A 153 -14.761 3.890 4.625 1.00 0.00 C ATOM 495 C ASN A 153 -13.280 3.813 4.961 1.00 0.00 C ATOM 496 O ASN A 153 -12.851 2.801 5.509 1.00 0.00 O ATOM 497 CB ASN A 153 -15.062 2.898 3.494 1.00 0.00 C ATOM 498 CG ASN A 153 -16.544 2.589 3.404 1.00 0.00 C ATOM 499 OD1 ASN A 153 -17.114 1.941 4.285 1.00 0.00 O ATOM 500 ND2 ASN A 153 -17.206 3.074 2.371 1.00 0.00 N ATOM 0 H ASN A 153 -14.597 5.727 3.621 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.315 3.627 5.526 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.717 3.310 2.546 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -14.507 1.975 3.661 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -18.210 2.916 2.289 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.713 3.607 1.654 1.00 0.00 H new ATOM 507 N MET A 154 -12.497 4.852 4.673 1.00 0.00 N ATOM 508 CA MET A 154 -11.035 4.823 4.696 1.00 0.00 C ATOM 509 C MET A 154 -10.416 4.319 6.003 1.00 0.00 C ATOM 510 O MET A 154 -9.315 3.785 5.960 1.00 0.00 O ATOM 511 CB MET A 154 -10.481 6.211 4.351 1.00 0.00 C ATOM 512 CG MET A 154 -11.083 7.321 5.228 1.00 0.00 C ATOM 513 SD MET A 154 -10.195 8.899 5.333 1.00 0.00 S ATOM 514 CE MET A 154 -9.316 8.939 3.756 1.00 0.00 C ATOM 0 H MET A 154 -12.873 5.763 4.410 1.00 0.00 H new ATOM 0 HA MET A 154 -10.747 4.090 3.942 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.398 6.206 4.470 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.685 6.430 3.303 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.089 7.527 4.862 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.187 6.928 6.239 1.00 0.00 H new ATOM 0 HE1 MET A 154 -8.787 9.887 3.658 1.00 0.00 H new ATOM 0 HE2 MET A 154 -8.600 8.118 3.718 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.030 8.836 2.939 1.00 0.00 H new ATOM 524 N TYR A 155 -11.106 4.428 7.141 1.00 0.00 N ATOM 525 CA TYR A 155 -10.694 3.882 8.440 1.00 0.00 C ATOM 526 C TYR A 155 -10.390 2.382 8.355 1.00 0.00 C ATOM 527 O TYR A 155 -9.558 1.842 9.088 1.00 0.00 O ATOM 528 CB TYR A 155 -11.815 4.096 9.480 1.00 0.00 C ATOM 529 CG TYR A 155 -12.901 5.084 9.088 1.00 0.00 C ATOM 530 CD1 TYR A 155 -12.624 6.462 9.098 1.00 0.00 C ATOM 531 CD2 TYR A 155 -14.168 4.626 8.674 1.00 0.00 C ATOM 532 CE1 TYR A 155 -13.622 7.381 8.740 1.00 0.00 C ATOM 533 CE2 TYR A 155 -15.172 5.541 8.305 1.00 0.00 C ATOM 534 CZ TYR A 155 -14.903 6.932 8.357 1.00 0.00 C ATOM 535 OH TYR A 155 -15.861 7.868 8.127 1.00 0.00 O ATOM 0 H TYR A 155 -12.000 4.917 7.187 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.787 4.407 8.739 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.283 3.133 9.685 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -11.361 4.435 10.411 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -11.643 6.813 9.381 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.370 3.566 8.640 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -13.408 8.439 8.758 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -16.140 5.186 7.985 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.696 7.425 7.869 1.00 0.00 H new ATOM 545 N ARG A 156 -11.122 1.694 7.482 1.00 0.00 N ATOM 546 CA ARG A 156 -11.084 0.256 7.303 1.00 0.00 C ATOM 547 C ARG A 156 -9.887 -0.128 6.431 1.00 0.00 C ATOM 548 O ARG A 156 -9.405 -1.259 6.525 1.00 0.00 O ATOM 549 CB ARG A 156 -12.413 -0.194 6.663 1.00 0.00 C ATOM 550 CG ARG A 156 -13.661 0.275 7.452 1.00 0.00 C ATOM 551 CD ARG A 156 -14.942 0.187 6.618 1.00 0.00 C ATOM 552 NE ARG A 156 -15.352 -1.210 6.428 1.00 0.00 N ATOM 553 CZ ARG A 156 -16.188 -1.683 5.505 1.00 0.00 C ATOM 554 NH1 ARG A 156 -16.908 -0.870 4.743 1.00 0.00 N ATOM 555 NH2 ARG A 156 -16.274 -2.995 5.343 1.00 0.00 N ATOM 0 H ARG A 156 -11.785 2.150 6.855 1.00 0.00 H new ATOM 0 HA ARG A 156 -10.966 -0.245 8.264 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.468 0.193 5.646 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.424 -1.282 6.591 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.771 -0.334 8.349 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -13.514 1.304 7.782 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.741 0.740 7.112 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.782 0.658 5.648 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.953 -1.892 7.073 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.828 0.140 4.857 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.542 -1.255 4.043 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.707 -3.618 5.918 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -16.907 -3.382 4.643 1.00 0.00 H new ATOM 569 N TYR A 157 -9.405 0.784 5.587 1.00 0.00 N ATOM 570 CA TYR A 157 -8.203 0.593 4.796 1.00 0.00 C ATOM 571 C TYR A 157 -6.993 0.855 5.708 1.00 0.00 C ATOM 572 O TYR A 157 -7.137 1.453 6.782 1.00 0.00 O ATOM 573 CB TYR A 157 -8.251 1.523 3.567 1.00 0.00 C ATOM 574 CG TYR A 157 -9.494 1.434 2.686 1.00 0.00 C ATOM 575 CD1 TYR A 157 -10.331 0.300 2.686 1.00 0.00 C ATOM 576 CD2 TYR A 157 -9.799 2.506 1.827 1.00 0.00 C ATOM 577 CE1 TYR A 157 -11.491 0.267 1.895 1.00 0.00 C ATOM 578 CE2 TYR A 157 -10.950 2.473 1.019 1.00 0.00 C ATOM 579 CZ TYR A 157 -11.825 1.364 1.073 1.00 0.00 C ATOM 580 OH TYR A 157 -12.976 1.351 0.342 1.00 0.00 O ATOM 0 H TYR A 157 -9.851 1.689 5.436 1.00 0.00 H new ATOM 0 HA TYR A 157 -8.122 -0.424 4.413 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -8.154 2.551 3.915 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.379 1.313 2.947 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -10.078 -0.552 3.300 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.143 3.363 1.788 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -12.131 -0.603 1.916 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.166 3.297 0.355 1.00 0.00 H new ATOM 0 HH TYR A 157 -13.523 0.582 0.606 1.00 0.00 H new ATOM 590 N PRO A 158 -5.788 0.406 5.332 1.00 0.00 N ATOM 591 CA PRO A 158 -4.622 0.504 6.192 1.00 0.00 C ATOM 592 C PRO A 158 -4.056 1.920 6.228 1.00 0.00 C ATOM 593 O PRO A 158 -4.411 2.784 5.421 1.00 0.00 O ATOM 594 CB PRO A 158 -3.584 -0.461 5.621 1.00 0.00 C ATOM 595 CG PRO A 158 -4.167 -0.972 4.314 1.00 0.00 C ATOM 596 CD PRO A 158 -5.435 -0.178 4.055 1.00 0.00 C ATOM 0 HA PRO A 158 -4.891 0.254 7.218 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.632 0.043 5.454 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.393 -1.283 6.311 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -3.457 -0.842 3.498 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -4.386 -2.038 4.379 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.269 0.593 3.302 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -6.233 -0.821 3.683 1.00 0.00 H new ATOM 604 N ASN A 159 -3.091 2.113 7.125 1.00 0.00 N ATOM 605 CA ASN A 159 -2.254 3.300 7.210 1.00 0.00 C ATOM 606 C ASN A 159 -0.767 2.969 7.036 1.00 0.00 C ATOM 607 O ASN A 159 0.050 3.877 7.155 1.00 0.00 O ATOM 608 CB ASN A 159 -2.480 4.004 8.550 1.00 0.00 C ATOM 609 CG ASN A 159 -1.645 3.354 9.641 1.00 0.00 C ATOM 610 OD1 ASN A 159 -1.805 2.174 9.916 1.00 0.00 O ATOM 611 ND2 ASN A 159 -0.724 4.085 10.239 1.00 0.00 N ATOM 0 H ASN A 159 -2.865 1.419 7.837 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.540 3.963 6.394 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -2.217 5.058 8.462 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -3.536 3.960 8.817 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -0.124 3.667 10.950 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.612 5.068 9.990 1.00 0.00 H new ATOM 618 N GLN A 160 -0.393 1.712 6.782 1.00 0.00 N ATOM 619 CA GLN A 160 0.972 1.330 6.429 1.00 0.00 C ATOM 620 C GLN A 160 0.936 0.604 5.091 1.00 0.00 C ATOM 621 O GLN A 160 -0.089 0.018 4.724 1.00 0.00 O ATOM 622 CB GLN A 160 1.588 0.412 7.495 1.00 0.00 C ATOM 623 CG GLN A 160 1.583 0.980 8.913 1.00 0.00 C ATOM 624 CD GLN A 160 2.226 0.025 9.916 1.00 0.00 C ATOM 625 OE1 GLN A 160 1.965 -1.172 9.918 1.00 0.00 O ATOM 626 NE2 GLN A 160 3.077 0.535 10.787 1.00 0.00 N ATOM 0 H GLN A 160 -1.039 0.924 6.817 1.00 0.00 H new ATOM 0 HA GLN A 160 1.587 2.228 6.366 1.00 0.00 H new ATOM 0 HB2 GLN A 160 1.046 -0.534 7.496 1.00 0.00 H new ATOM 0 HB3 GLN A 160 2.617 0.190 7.212 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.117 1.930 8.924 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.557 1.187 9.217 1.00 0.00 H new ATOM 0 HE21 GLN A 160 3.284 1.534 10.773 1.00 0.00 H new ATOM 0 HE22 GLN A 160 3.527 -0.070 11.474 1.00 0.00 H new ATOM 635 N VAL A 161 2.052 0.591 4.373 1.00 0.00 N ATOM 636 CA VAL A 161 2.180 0.045 3.028 1.00 0.00 C ATOM 637 C VAL A 161 3.405 -0.861 3.072 1.00 0.00 C ATOM 638 O VAL A 161 4.415 -0.504 3.690 1.00 0.00 O ATOM 639 CB VAL A 161 2.237 1.218 2.015 1.00 0.00 C ATOM 640 CG1 VAL A 161 3.520 1.334 1.182 1.00 0.00 C ATOM 641 CG2 VAL A 161 1.023 1.204 1.087 1.00 0.00 C ATOM 0 H VAL A 161 2.928 0.976 4.726 1.00 0.00 H new ATOM 0 HA VAL A 161 1.336 -0.557 2.693 1.00 0.00 H new ATOM 0 HB VAL A 161 2.230 2.102 2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 161 3.442 2.190 0.511 1.00 0.00 H new ATOM 0 HG12 VAL A 161 4.374 1.470 1.846 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.657 0.425 0.596 1.00 0.00 H new ATOM 0 HG21 VAL A 161 1.090 2.037 0.388 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.000 0.266 0.532 1.00 0.00 H new ATOM 0 HG23 VAL A 161 0.112 1.299 1.678 1.00 0.00 H new ATOM 651 N TYR A 162 3.285 -2.066 2.519 1.00 0.00 N ATOM 652 CA TYR A 162 4.428 -2.966 2.448 1.00 0.00 C ATOM 653 C TYR A 162 5.388 -2.446 1.388 1.00 0.00 C ATOM 654 O TYR A 162 4.938 -1.758 0.478 1.00 0.00 O ATOM 655 CB TYR A 162 3.972 -4.378 2.081 1.00 0.00 C ATOM 656 CG TYR A 162 3.309 -5.114 3.214 1.00 0.00 C ATOM 657 CD1 TYR A 162 1.921 -5.001 3.384 1.00 0.00 C ATOM 658 CD2 TYR A 162 4.076 -5.866 4.125 1.00 0.00 C ATOM 659 CE1 TYR A 162 1.302 -5.577 4.501 1.00 0.00 C ATOM 660 CE2 TYR A 162 3.462 -6.427 5.258 1.00 0.00 C ATOM 661 CZ TYR A 162 2.080 -6.225 5.483 1.00 0.00 C ATOM 662 OH TYR A 162 1.486 -6.707 6.606 1.00 0.00 O ATOM 0 H TYR A 162 2.422 -2.435 2.120 1.00 0.00 H new ATOM 0 HA TYR A 162 4.922 -3.005 3.419 1.00 0.00 H new ATOM 0 HB2 TYR A 162 3.278 -4.320 1.242 1.00 0.00 H new ATOM 0 HB3 TYR A 162 4.834 -4.952 1.742 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.329 -4.470 2.653 1.00 0.00 H new ATOM 0 HD2 TYR A 162 5.132 -6.011 3.954 1.00 0.00 H new ATOM 0 HE1 TYR A 162 0.229 -5.525 4.610 1.00 0.00 H new ATOM 0 HE2 TYR A 162 4.044 -7.011 5.955 1.00 0.00 H new ATOM 0 HH TYR A 162 2.162 -7.125 7.180 1.00 0.00 H new ATOM 672 N TYR A 163 6.654 -2.856 1.382 1.00 0.00 N ATOM 673 CA TYR A 163 7.563 -2.601 0.269 1.00 0.00 C ATOM 674 C TYR A 163 8.727 -3.586 0.307 1.00 0.00 C ATOM 675 O TYR A 163 9.124 -4.045 1.375 1.00 0.00 O ATOM 676 CB TYR A 163 8.073 -1.150 0.354 1.00 0.00 C ATOM 677 CG TYR A 163 8.861 -0.807 1.608 1.00 0.00 C ATOM 678 CD1 TYR A 163 8.194 -0.506 2.813 1.00 0.00 C ATOM 679 CD2 TYR A 163 10.268 -0.775 1.567 1.00 0.00 C ATOM 680 CE1 TYR A 163 8.931 -0.159 3.960 1.00 0.00 C ATOM 681 CE2 TYR A 163 11.009 -0.455 2.715 1.00 0.00 C ATOM 682 CZ TYR A 163 10.343 -0.136 3.919 1.00 0.00 C ATOM 683 OH TYR A 163 11.051 0.197 5.031 1.00 0.00 O ATOM 0 H TYR A 163 7.079 -3.375 2.150 1.00 0.00 H new ATOM 0 HA TYR A 163 7.035 -2.737 -0.675 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.701 -0.952 -0.515 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.217 -0.478 0.288 1.00 0.00 H new ATOM 0 HD1 TYR A 163 7.115 -0.542 2.856 1.00 0.00 H new ATOM 0 HD2 TYR A 163 10.782 -0.999 0.644 1.00 0.00 H new ATOM 0 HE1 TYR A 163 8.415 0.091 4.875 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.088 -0.453 2.678 1.00 0.00 H new ATOM 0 HH TYR A 163 12.010 0.163 4.831 1.00 0.00 H new ATOM 693 N ARG A 164 9.304 -3.894 -0.856 1.00 0.00 N ATOM 694 CA ARG A 164 10.624 -4.518 -0.931 1.00 0.00 C ATOM 695 C ARG A 164 11.689 -3.446 -1.016 1.00 0.00 C ATOM 696 O ARG A 164 11.348 -2.302 -1.308 1.00 0.00 O ATOM 697 CB ARG A 164 10.709 -5.505 -2.109 1.00 0.00 C ATOM 698 CG ARG A 164 10.423 -6.924 -1.626 1.00 0.00 C ATOM 699 CD ARG A 164 10.524 -7.994 -2.719 1.00 0.00 C ATOM 700 NE ARG A 164 11.860 -8.599 -2.759 1.00 0.00 N ATOM 701 CZ ARG A 164 12.891 -8.273 -3.540 1.00 0.00 C ATOM 702 NH1 ARG A 164 12.789 -7.296 -4.441 1.00 0.00 N ATOM 703 NH2 ARG A 164 14.029 -8.932 -3.389 1.00 0.00 N ATOM 0 H ARG A 164 8.873 -3.719 -1.764 1.00 0.00 H new ATOM 0 HA ARG A 164 10.793 -5.099 -0.025 1.00 0.00 H new ATOM 0 HB2 ARG A 164 9.993 -5.224 -2.881 1.00 0.00 H new ATOM 0 HB3 ARG A 164 11.700 -5.459 -2.561 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.121 -7.171 -0.826 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.422 -6.954 -1.196 1.00 0.00 H new ATOM 0 HD2 ARG A 164 9.778 -8.769 -2.541 1.00 0.00 H new ATOM 0 HD3 ARG A 164 10.296 -7.549 -3.687 1.00 0.00 H new ATOM 0 HE ARG A 164 12.021 -9.366 -2.107 1.00 0.00 H new ATOM 0 HH11 ARG A 164 11.912 -6.784 -4.541 1.00 0.00 H new ATOM 0 HH12 ARG A 164 13.588 -7.060 -5.030 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.102 -9.669 -2.688 1.00 0.00 H new ATOM 0 HH22 ARG A 164 14.833 -8.702 -3.974 1.00 0.00 H new ATOM 717 N PRO A 165 12.950 -3.804 -0.749 1.00 0.00 N ATOM 718 CA PRO A 165 14.004 -2.826 -0.645 1.00 0.00 C ATOM 719 C PRO A 165 14.125 -2.044 -1.954 1.00 0.00 C ATOM 720 O PRO A 165 14.425 -2.639 -2.991 1.00 0.00 O ATOM 721 CB PRO A 165 15.254 -3.623 -0.266 1.00 0.00 C ATOM 722 CG PRO A 165 14.841 -5.057 0.027 1.00 0.00 C ATOM 723 CD PRO A 165 13.450 -5.166 -0.560 1.00 0.00 C ATOM 0 HA PRO A 165 13.821 -2.062 0.110 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.981 -3.596 -1.078 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.735 -3.181 0.607 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.525 -5.771 -0.432 1.00 0.00 H new ATOM 0 HG3 PRO A 165 14.839 -5.261 1.098 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.474 -5.702 -1.509 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.795 -5.727 0.106 1.00 0.00 H new ATOM 731 N VAL A 166 13.881 -0.724 -1.922 1.00 0.00 N ATOM 732 CA VAL A 166 14.204 0.210 -2.989 1.00 0.00 C ATOM 733 C VAL A 166 15.629 -0.068 -3.501 1.00 0.00 C ATOM 734 O VAL A 166 15.887 -0.074 -4.705 1.00 0.00 O ATOM 735 CB VAL A 166 14.093 1.650 -2.416 1.00 0.00 C ATOM 736 CG1 VAL A 166 12.719 2.285 -2.431 1.00 0.00 C ATOM 737 CG2 VAL A 166 14.719 1.847 -1.028 1.00 0.00 C ATOM 0 H VAL A 166 13.438 -0.272 -1.122 1.00 0.00 H new ATOM 0 HA VAL A 166 13.516 0.097 -3.827 1.00 0.00 H new ATOM 0 HB VAL A 166 14.694 2.182 -3.153 1.00 0.00 H new ATOM 0 HG11 VAL A 166 12.776 3.287 -2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 166 12.358 2.347 -3.458 1.00 0.00 H new ATOM 0 HG13 VAL A 166 12.032 1.679 -1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.591 2.883 -0.715 1.00 0.00 H new ATOM 0 HG22 VAL A 166 14.229 1.188 -0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 166 15.782 1.610 -1.071 1.00 0.00 H new ATOM 747 N ASP A 167 16.526 -0.368 -2.561 1.00 0.00 N ATOM 748 CA ASP A 167 17.931 -0.766 -2.602 1.00 0.00 C ATOM 749 C ASP A 167 18.187 -2.107 -3.293 1.00 0.00 C ATOM 750 O ASP A 167 19.124 -2.824 -2.941 1.00 0.00 O ATOM 751 CB ASP A 167 18.467 -0.743 -1.157 1.00 0.00 C ATOM 752 CG ASP A 167 17.645 -1.501 -0.114 1.00 0.00 C ATOM 753 OD1 ASP A 167 16.550 -0.981 0.209 1.00 0.00 O ATOM 754 OD2 ASP A 167 18.089 -2.528 0.457 1.00 0.00 O ATOM 0 H ASP A 167 16.225 -0.329 -1.587 1.00 0.00 H new ATOM 0 HA ASP A 167 18.472 -0.053 -3.224 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.477 -1.154 -1.161 1.00 0.00 H new ATOM 0 HB3 ASP A 167 18.547 0.296 -0.839 1.00 0.00 H new ATOM 759 N GLN A 168 17.368 -2.465 -4.280 1.00 0.00 N ATOM 760 CA GLN A 168 17.532 -3.695 -5.040 1.00 0.00 C ATOM 761 C GLN A 168 16.967 -3.614 -6.458 1.00 0.00 C ATOM 762 O GLN A 168 17.398 -4.359 -7.346 1.00 0.00 O ATOM 763 CB GLN A 168 16.847 -4.821 -4.253 1.00 0.00 C ATOM 764 CG GLN A 168 17.658 -6.106 -4.411 1.00 0.00 C ATOM 765 CD GLN A 168 17.062 -7.219 -3.571 1.00 0.00 C ATOM 766 OE1 GLN A 168 16.615 -8.235 -4.097 1.00 0.00 O ATOM 767 NE2 GLN A 168 16.999 -7.045 -2.263 1.00 0.00 N ATOM 0 H GLN A 168 16.568 -1.904 -4.574 1.00 0.00 H new ATOM 0 HA GLN A 168 18.598 -3.884 -5.163 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.771 -4.551 -3.200 1.00 0.00 H new ATOM 0 HB3 GLN A 168 15.831 -4.970 -4.618 1.00 0.00 H new ATOM 0 HG2 GLN A 168 17.677 -6.404 -5.459 1.00 0.00 H new ATOM 0 HG3 GLN A 168 18.691 -5.930 -4.111 1.00 0.00 H new ATOM 0 HE21 GLN A 168 17.375 -6.195 -1.843 1.00 0.00 H new ATOM 0 HE22 GLN A 168 16.574 -7.761 -1.673 1.00 0.00 H new ATOM 776 N TYR A 169 15.988 -2.740 -6.687 1.00 0.00 N ATOM 777 CA TYR A 169 15.389 -2.554 -7.998 1.00 0.00 C ATOM 778 C TYR A 169 16.284 -1.660 -8.858 1.00 0.00 C ATOM 779 O TYR A 169 17.368 -1.238 -8.451 1.00 0.00 O ATOM 780 CB TYR A 169 13.971 -1.996 -7.830 1.00 0.00 C ATOM 781 CG TYR A 169 13.000 -3.000 -7.247 1.00 0.00 C ATOM 782 CD1 TYR A 169 12.884 -3.113 -5.852 1.00 0.00 C ATOM 783 CD2 TYR A 169 12.147 -3.745 -8.087 1.00 0.00 C ATOM 784 CE1 TYR A 169 11.966 -4.013 -5.290 1.00 0.00 C ATOM 785 CE2 TYR A 169 11.169 -4.591 -7.534 1.00 0.00 C ATOM 786 CZ TYR A 169 11.095 -4.758 -6.124 1.00 0.00 C ATOM 787 OH TYR A 169 10.231 -5.638 -5.541 1.00 0.00 O ATOM 0 H TYR A 169 15.590 -2.142 -5.963 1.00 0.00 H new ATOM 0 HA TYR A 169 15.305 -3.507 -8.520 1.00 0.00 H new ATOM 0 HB2 TYR A 169 14.007 -1.118 -7.185 1.00 0.00 H new ATOM 0 HB3 TYR A 169 13.601 -1.664 -8.800 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.504 -2.505 -5.210 1.00 0.00 H new ATOM 0 HD2 TYR A 169 12.245 -3.666 -9.160 1.00 0.00 H new ATOM 0 HE1 TYR A 169 11.923 -4.139 -4.218 1.00 0.00 H new ATOM 0 HE2 TYR A 169 10.476 -5.112 -8.178 1.00 0.00 H new ATOM 0 HH TYR A 169 9.412 -5.695 -6.076 1.00 0.00 H new ATOM 797 N ASN A 170 15.843 -1.412 -10.087 1.00 0.00 N ATOM 798 CA ASN A 170 16.513 -0.560 -11.062 1.00 0.00 C ATOM 799 C ASN A 170 15.586 0.523 -11.592 1.00 0.00 C ATOM 800 O ASN A 170 16.012 1.316 -12.425 1.00 0.00 O ATOM 801 CB ASN A 170 17.054 -1.395 -12.232 1.00 0.00 C ATOM 802 CG ASN A 170 16.021 -2.311 -12.876 1.00 0.00 C ATOM 803 OD1 ASN A 170 16.193 -3.520 -12.862 1.00 0.00 O ATOM 804 ND2 ASN A 170 14.912 -1.814 -13.397 1.00 0.00 N ATOM 0 H ASN A 170 14.976 -1.814 -10.444 1.00 0.00 H new ATOM 0 HA ASN A 170 17.345 -0.077 -10.550 1.00 0.00 H new ATOM 0 HB2 ASN A 170 17.450 -0.721 -12.992 1.00 0.00 H new ATOM 0 HB3 ASN A 170 17.888 -2.000 -11.877 1.00 0.00 H new ATOM 0 HD21 ASN A 170 14.206 -2.440 -13.784 1.00 0.00 H new ATOM 0 HD22 ASN A 170 14.763 -0.805 -13.411 1.00 0.00 H new ATOM 811 N ASN A 171 14.315 0.551 -11.198 1.00 0.00 N ATOM 812 CA ASN A 171 13.412 1.645 -11.500 1.00 0.00 C ATOM 813 C ASN A 171 12.235 1.589 -10.536 1.00 0.00 C ATOM 814 O ASN A 171 11.730 0.508 -10.217 1.00 0.00 O ATOM 815 CB ASN A 171 12.925 1.643 -12.962 1.00 0.00 C ATOM 816 CG ASN A 171 12.415 0.332 -13.542 1.00 0.00 C ATOM 817 OD1 ASN A 171 12.476 0.117 -14.746 1.00 0.00 O ATOM 818 ND2 ASN A 171 11.917 -0.584 -12.738 1.00 0.00 N ATOM 0 H ASN A 171 13.884 -0.197 -10.654 1.00 0.00 H new ATOM 0 HA ASN A 171 13.961 2.578 -11.374 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.127 2.380 -13.049 1.00 0.00 H new ATOM 0 HB3 ASN A 171 13.747 1.988 -13.589 1.00 0.00 H new ATOM 0 HD21 ASN A 171 11.583 -1.470 -13.118 1.00 0.00 H new ATOM 0 HD22 ASN A 171 11.865 -0.408 -11.735 1.00 0.00 H new ATOM 825 N GLN A 172 11.773 2.762 -10.114 1.00 0.00 N ATOM 826 CA GLN A 172 10.705 2.921 -9.149 1.00 0.00 C ATOM 827 C GLN A 172 9.425 2.250 -9.634 1.00 0.00 C ATOM 828 O GLN A 172 8.766 1.597 -8.836 1.00 0.00 O ATOM 829 CB GLN A 172 10.507 4.419 -8.865 1.00 0.00 C ATOM 830 CG GLN A 172 9.313 4.746 -7.953 1.00 0.00 C ATOM 831 CD GLN A 172 8.057 5.081 -8.756 1.00 0.00 C ATOM 832 OE1 GLN A 172 7.213 4.240 -9.023 1.00 0.00 O ATOM 833 NE2 GLN A 172 7.921 6.314 -9.193 1.00 0.00 N ATOM 0 H GLN A 172 12.146 3.651 -10.448 1.00 0.00 H new ATOM 0 HA GLN A 172 10.974 2.426 -8.216 1.00 0.00 H new ATOM 0 HB2 GLN A 172 11.415 4.812 -8.407 1.00 0.00 H new ATOM 0 HB3 GLN A 172 10.377 4.941 -9.813 1.00 0.00 H new ATOM 0 HG2 GLN A 172 9.111 3.896 -7.301 1.00 0.00 H new ATOM 0 HG3 GLN A 172 9.568 5.588 -7.310 1.00 0.00 H new ATOM 0 HE21 GLN A 172 8.627 7.015 -8.969 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.109 6.569 -9.756 1.00 0.00 H new ATOM 842 N ASN A 173 9.085 2.392 -10.920 1.00 0.00 N ATOM 843 CA ASN A 173 7.747 2.070 -11.435 1.00 0.00 C ATOM 844 C ASN A 173 7.372 0.647 -11.101 1.00 0.00 C ATOM 845 O ASN A 173 6.322 0.365 -10.536 1.00 0.00 O ATOM 846 CB ASN A 173 7.682 2.203 -12.962 1.00 0.00 C ATOM 847 CG ASN A 173 7.479 3.645 -13.385 1.00 0.00 C ATOM 848 OD1 ASN A 173 6.542 3.955 -14.110 1.00 0.00 O ATOM 849 ND2 ASN A 173 8.287 4.568 -12.892 1.00 0.00 N ATOM 0 H ASN A 173 9.729 2.733 -11.634 1.00 0.00 H new ATOM 0 HA ASN A 173 7.061 2.775 -10.966 1.00 0.00 H new ATOM 0 HB2 ASN A 173 8.603 1.820 -13.401 1.00 0.00 H new ATOM 0 HB3 ASN A 173 6.866 1.591 -13.347 1.00 0.00 H new ATOM 0 HD21 ASN A 173 8.134 5.552 -13.114 1.00 0.00 H new ATOM 0 HD22 ASN A 173 9.064 4.297 -12.289 1.00 0.00 H new ATOM 856 N THR A 174 8.232 -0.260 -11.528 1.00 0.00 N ATOM 857 CA THR A 174 8.037 -1.694 -11.371 1.00 0.00 C ATOM 858 C THR A 174 7.938 -2.063 -9.891 1.00 0.00 C ATOM 859 O THR A 174 7.104 -2.867 -9.484 1.00 0.00 O ATOM 860 CB THR A 174 9.201 -2.419 -12.054 1.00 0.00 C ATOM 861 OG1 THR A 174 9.483 -1.791 -13.292 1.00 0.00 O ATOM 862 CG2 THR A 174 8.872 -3.858 -12.368 1.00 0.00 C ATOM 0 H THR A 174 9.102 -0.018 -12.003 1.00 0.00 H new ATOM 0 HA THR A 174 7.101 -1.999 -11.839 1.00 0.00 H new ATOM 0 HB THR A 174 10.045 -2.379 -11.365 1.00 0.00 H new ATOM 0 HG1 THR A 174 9.983 -2.408 -13.866 1.00 0.00 H new ATOM 0 HG21 THR A 174 9.728 -4.330 -12.851 1.00 0.00 H new ATOM 0 HG22 THR A 174 8.639 -4.388 -11.444 1.00 0.00 H new ATOM 0 HG23 THR A 174 8.011 -3.897 -13.036 1.00 0.00 H new ATOM 870 N PHE A 175 8.787 -1.448 -9.075 1.00 0.00 N ATOM 871 CA PHE A 175 8.848 -1.663 -7.646 1.00 0.00 C ATOM 872 C PHE A 175 7.565 -1.188 -6.957 1.00 0.00 C ATOM 873 O PHE A 175 6.977 -1.935 -6.183 1.00 0.00 O ATOM 874 CB PHE A 175 10.104 -0.952 -7.145 1.00 0.00 C ATOM 875 CG PHE A 175 10.013 -0.392 -5.758 1.00 0.00 C ATOM 876 CD1 PHE A 175 9.791 -1.227 -4.650 1.00 0.00 C ATOM 877 CD2 PHE A 175 10.136 0.992 -5.594 1.00 0.00 C ATOM 878 CE1 PHE A 175 9.684 -0.658 -3.373 1.00 0.00 C ATOM 879 CE2 PHE A 175 10.046 1.543 -4.320 1.00 0.00 C ATOM 880 CZ PHE A 175 9.814 0.728 -3.209 1.00 0.00 C ATOM 0 H PHE A 175 9.470 -0.767 -9.406 1.00 0.00 H new ATOM 0 HA PHE A 175 8.914 -2.724 -7.405 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.938 -1.653 -7.182 1.00 0.00 H new ATOM 0 HB3 PHE A 175 10.340 -0.140 -7.832 1.00 0.00 H new ATOM 0 HD1 PHE A 175 9.704 -2.296 -4.781 1.00 0.00 H new ATOM 0 HD2 PHE A 175 10.300 1.628 -6.451 1.00 0.00 H new ATOM 0 HE1 PHE A 175 9.501 -1.288 -2.515 1.00 0.00 H new ATOM 0 HE2 PHE A 175 10.156 2.609 -4.188 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.735 1.166 -2.225 1.00 0.00 H new ATOM 890 N VAL A 176 7.109 0.034 -7.224 1.00 0.00 N ATOM 891 CA VAL A 176 5.868 0.574 -6.684 1.00 0.00 C ATOM 892 C VAL A 176 4.693 -0.280 -7.178 1.00 0.00 C ATOM 893 O VAL A 176 3.811 -0.598 -6.391 1.00 0.00 O ATOM 894 CB VAL A 176 5.773 2.066 -7.044 1.00 0.00 C ATOM 895 CG1 VAL A 176 4.344 2.627 -7.009 1.00 0.00 C ATOM 896 CG2 VAL A 176 6.656 2.877 -6.069 1.00 0.00 C ATOM 0 H VAL A 176 7.602 0.687 -7.833 1.00 0.00 H new ATOM 0 HA VAL A 176 5.840 0.523 -5.596 1.00 0.00 H new ATOM 0 HB VAL A 176 6.118 2.159 -8.074 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.362 3.684 -7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.723 2.084 -7.721 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.932 2.511 -6.006 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.594 3.936 -6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.307 2.723 -5.048 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.691 2.544 -6.153 1.00 0.00 H new ATOM 906 N HIS A 177 4.674 -0.699 -8.441 1.00 0.00 N ATOM 907 CA HIS A 177 3.626 -1.557 -8.985 1.00 0.00 C ATOM 908 C HIS A 177 3.556 -2.869 -8.196 1.00 0.00 C ATOM 909 O HIS A 177 2.480 -3.343 -7.821 1.00 0.00 O ATOM 910 CB HIS A 177 3.939 -1.764 -10.473 1.00 0.00 C ATOM 911 CG HIS A 177 2.923 -2.480 -11.321 1.00 0.00 C ATOM 912 ND1 HIS A 177 3.051 -2.727 -12.672 1.00 0.00 N ATOM 913 CD2 HIS A 177 1.721 -2.987 -10.917 1.00 0.00 C ATOM 914 CE1 HIS A 177 1.937 -3.356 -13.076 1.00 0.00 C ATOM 915 NE2 HIS A 177 1.092 -3.524 -12.045 1.00 0.00 N ATOM 0 H HIS A 177 5.392 -0.450 -9.121 1.00 0.00 H new ATOM 0 HA HIS A 177 2.639 -1.103 -8.893 1.00 0.00 H new ATOM 0 HB2 HIS A 177 4.111 -0.783 -10.917 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.877 -2.314 -10.542 1.00 0.00 H new ATOM 0 HD2 HIS A 177 1.328 -2.975 -9.911 1.00 0.00 H new ATOM 0 HE1 HIS A 177 1.746 -3.682 -14.088 1.00 0.00 H new ATOM 0 HE2 HIS A 177 0.170 -3.959 -12.078 1.00 0.00 H new ATOM 923 N ASP A 178 4.706 -3.478 -7.922 1.00 0.00 N ATOM 924 CA ASP A 178 4.781 -4.699 -7.132 1.00 0.00 C ATOM 925 C ASP A 178 4.341 -4.446 -5.691 1.00 0.00 C ATOM 926 O ASP A 178 3.626 -5.253 -5.097 1.00 0.00 O ATOM 927 CB ASP A 178 6.240 -5.183 -7.149 1.00 0.00 C ATOM 928 CG ASP A 178 6.447 -6.600 -6.649 1.00 0.00 C ATOM 929 OD1 ASP A 178 5.708 -7.518 -7.083 1.00 0.00 O ATOM 930 OD2 ASP A 178 7.494 -6.830 -6.000 1.00 0.00 O ATOM 0 H ASP A 178 5.612 -3.137 -8.243 1.00 0.00 H new ATOM 0 HA ASP A 178 4.116 -5.451 -7.557 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.619 -5.114 -8.169 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.839 -4.507 -6.540 1.00 0.00 H new ATOM 935 N CYS A 179 4.749 -3.296 -5.152 1.00 0.00 N ATOM 936 CA CYS A 179 4.455 -2.818 -3.815 1.00 0.00 C ATOM 937 C CYS A 179 2.943 -2.701 -3.608 1.00 0.00 C ATOM 938 O CYS A 179 2.415 -3.153 -2.581 1.00 0.00 O ATOM 939 CB CYS A 179 5.199 -1.485 -3.589 1.00 0.00 C ATOM 940 SG CYS A 179 4.822 -0.445 -2.150 1.00 0.00 S ATOM 0 H CYS A 179 5.328 -2.639 -5.675 1.00 0.00 H new ATOM 0 HA CYS A 179 4.808 -3.530 -3.069 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.264 -1.715 -3.548 1.00 0.00 H new ATOM 0 HB3 CYS A 179 5.039 -0.874 -4.477 1.00 0.00 H new ATOM 945 N VAL A 180 2.246 -2.130 -4.591 1.00 0.00 N ATOM 946 CA VAL A 180 0.806 -1.960 -4.570 1.00 0.00 C ATOM 947 C VAL A 180 0.125 -3.320 -4.569 1.00 0.00 C ATOM 948 O VAL A 180 -0.778 -3.543 -3.754 1.00 0.00 O ATOM 949 CB VAL A 180 0.342 -1.071 -5.741 1.00 0.00 C ATOM 950 CG1 VAL A 180 -1.189 -0.966 -5.804 1.00 0.00 C ATOM 951 CG2 VAL A 180 0.872 0.361 -5.626 1.00 0.00 C ATOM 0 H VAL A 180 2.683 -1.768 -5.439 1.00 0.00 H new ATOM 0 HA VAL A 180 0.517 -1.445 -3.654 1.00 0.00 H new ATOM 0 HB VAL A 180 0.736 -1.552 -6.636 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.476 -0.331 -6.642 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.617 -1.960 -5.938 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.562 -0.533 -4.876 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.519 0.949 -6.473 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.513 0.808 -4.699 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.962 0.347 -5.624 1.00 0.00 H new ATOM 961 N ASN A 181 0.565 -4.230 -5.447 1.00 0.00 N ATOM 962 CA ASN A 181 -0.014 -5.564 -5.500 1.00 0.00 C ATOM 963 C ASN A 181 0.110 -6.237 -4.142 1.00 0.00 C ATOM 964 O ASN A 181 -0.881 -6.726 -3.616 1.00 0.00 O ATOM 965 CB ASN A 181 0.596 -6.439 -6.597 1.00 0.00 C ATOM 966 CG ASN A 181 -0.295 -7.665 -6.790 1.00 0.00 C ATOM 967 OD1 ASN A 181 -1.274 -7.618 -7.531 1.00 0.00 O ATOM 968 ND2 ASN A 181 0.003 -8.776 -6.133 1.00 0.00 N ATOM 0 H ASN A 181 1.312 -4.063 -6.121 1.00 0.00 H new ATOM 0 HA ASN A 181 -1.067 -5.447 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 181 0.676 -5.878 -7.528 1.00 0.00 H new ATOM 0 HB3 ASN A 181 1.605 -6.744 -6.321 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -0.583 -9.604 -6.240 1.00 0.00 H new ATOM 0 HD22 ASN A 181 0.818 -8.803 -5.521 1.00 0.00 H new ATOM 975 N ILE A 182 1.306 -6.234 -3.550 1.00 0.00 N ATOM 976 CA ILE A 182 1.542 -6.883 -2.265 1.00 0.00 C ATOM 977 C ILE A 182 0.696 -6.266 -1.166 1.00 0.00 C ATOM 978 O ILE A 182 0.275 -7.010 -0.290 1.00 0.00 O ATOM 979 CB ILE A 182 3.032 -6.858 -1.893 1.00 0.00 C ATOM 980 CG1 ILE A 182 3.768 -7.805 -2.867 1.00 0.00 C ATOM 981 CG2 ILE A 182 3.285 -7.179 -0.390 1.00 0.00 C ATOM 982 CD1 ILE A 182 3.847 -9.270 -2.437 1.00 0.00 C ATOM 0 H ILE A 182 2.131 -5.784 -3.947 1.00 0.00 H new ATOM 0 HA ILE A 182 1.240 -7.925 -2.368 1.00 0.00 H new ATOM 0 HB ILE A 182 3.432 -5.850 -2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 182 3.271 -7.757 -3.836 1.00 0.00 H new ATOM 0 HG13 ILE A 182 4.782 -7.432 -3.010 1.00 0.00 H new ATOM 0 HG21 ILE A 182 4.355 -7.147 -0.186 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.775 -6.442 0.230 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.902 -8.173 -0.161 1.00 0.00 H new ATOM 0 HD11 ILE A 182 4.384 -9.843 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.374 -9.342 -1.486 1.00 0.00 H new ATOM 0 HD13 ILE A 182 2.840 -9.671 -2.325 1.00 0.00 H new ATOM 994 N THR A 183 0.467 -4.954 -1.162 1.00 0.00 N ATOM 995 CA THR A 183 -0.290 -4.353 -0.076 1.00 0.00 C ATOM 996 C THR A 183 -1.732 -4.880 -0.126 1.00 0.00 C ATOM 997 O THR A 183 -2.154 -5.509 0.842 1.00 0.00 O ATOM 998 CB THR A 183 -0.114 -2.830 -0.091 1.00 0.00 C ATOM 999 OG1 THR A 183 1.270 -2.512 -0.024 1.00 0.00 O ATOM 1000 CG2 THR A 183 -0.802 -2.139 1.090 1.00 0.00 C ATOM 0 H THR A 183 0.787 -4.304 -1.880 1.00 0.00 H new ATOM 0 HA THR A 183 0.086 -4.647 0.904 1.00 0.00 H new ATOM 0 HB THR A 183 -0.571 -2.475 -1.015 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.699 -2.735 -0.877 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.642 -1.063 1.025 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.871 -2.350 1.062 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.383 -2.512 2.024 1.00 0.00 H new ATOM 1008 N ILE A 184 -2.446 -4.764 -1.260 1.00 0.00 N ATOM 1009 CA ILE A 184 -3.765 -5.401 -1.387 1.00 0.00 C ATOM 1010 C ILE A 184 -3.654 -6.887 -1.080 1.00 0.00 C ATOM 1011 O ILE A 184 -4.494 -7.409 -0.350 1.00 0.00 O ATOM 1012 CB ILE A 184 -4.431 -5.136 -2.759 1.00 0.00 C ATOM 1013 CG1 ILE A 184 -4.696 -3.619 -2.894 1.00 0.00 C ATOM 1014 CG2 ILE A 184 -5.734 -5.957 -2.920 1.00 0.00 C ATOM 1015 CD1 ILE A 184 -5.713 -3.240 -3.971 1.00 0.00 C ATOM 0 H ILE A 184 -2.139 -4.247 -2.084 1.00 0.00 H new ATOM 0 HA ILE A 184 -4.428 -4.944 -0.652 1.00 0.00 H new ATOM 0 HB ILE A 184 -3.762 -5.457 -3.557 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -5.045 -3.238 -1.934 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.753 -3.117 -3.112 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -6.177 -5.749 -3.894 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -5.506 -7.020 -2.845 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -6.437 -5.681 -2.134 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -5.834 -2.157 -3.992 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -5.360 -3.585 -4.943 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -6.672 -3.708 -3.747 1.00 0.00 H new ATOM 1027 N LYS A 185 -2.637 -7.576 -1.594 1.00 0.00 N ATOM 1028 CA LYS A 185 -2.514 -8.996 -1.425 1.00 0.00 C ATOM 1029 C LYS A 185 -2.396 -9.372 0.049 1.00 0.00 C ATOM 1030 O LYS A 185 -3.093 -10.272 0.493 1.00 0.00 O ATOM 1031 CB LYS A 185 -1.363 -9.494 -2.286 1.00 0.00 C ATOM 1032 CG LYS A 185 -1.363 -11.005 -2.219 1.00 0.00 C ATOM 1033 CD LYS A 185 -0.402 -11.605 -3.233 1.00 0.00 C ATOM 1034 CE LYS A 185 -0.609 -13.105 -3.118 1.00 0.00 C ATOM 1035 NZ LYS A 185 0.097 -13.831 -4.190 1.00 0.00 N ATOM 0 H LYS A 185 -1.884 -7.153 -2.136 1.00 0.00 H new ATOM 0 HA LYS A 185 -3.419 -9.499 -1.766 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -1.481 -9.156 -3.316 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -0.415 -9.095 -1.926 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -1.083 -11.326 -1.216 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -2.370 -11.379 -2.404 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.618 -11.251 -4.241 1.00 0.00 H new ATOM 0 HD3 LYS A 185 0.629 -11.329 -3.013 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.252 -13.449 -2.147 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.674 -13.331 -3.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -0.065 -14.853 -4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.262 -13.519 -5.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.116 -13.634 -4.130 1.00 0.00 H new ATOM 1049 N GLN A 186 -1.575 -8.673 0.829 1.00 0.00 N ATOM 1050 CA GLN A 186 -1.406 -8.894 2.257 1.00 0.00 C ATOM 1051 C GLN A 186 -2.746 -8.850 2.981 1.00 0.00 C ATOM 1052 O GLN A 186 -2.919 -9.560 3.978 1.00 0.00 O ATOM 1053 CB GLN A 186 -0.447 -7.839 2.843 1.00 0.00 C ATOM 1054 CG GLN A 186 0.994 -8.354 2.909 1.00 0.00 C ATOM 1055 CD GLN A 186 1.188 -9.443 3.955 1.00 0.00 C ATOM 1056 OE1 GLN A 186 1.613 -10.559 3.688 1.00 0.00 O ATOM 1057 NE2 GLN A 186 0.866 -9.160 5.196 1.00 0.00 N ATOM 0 H GLN A 186 -0.993 -7.915 0.471 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.978 -9.886 2.402 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -0.483 -6.937 2.233 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -0.780 -7.561 3.843 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.281 -8.741 1.931 1.00 0.00 H new ATOM 0 HG3 GLN A 186 1.662 -7.522 3.131 1.00 0.00 H new ATOM 0 HE21 GLN A 186 0.511 -8.234 5.432 1.00 0.00 H new ATOM 0 HE22 GLN A 186 0.971 -9.867 5.924 1.00 0.00 H new ATOM 1066 N HIS A 187 -3.684 -8.032 2.505 1.00 0.00 N ATOM 1067 CA HIS A 187 -4.994 -7.930 3.109 1.00 0.00 C ATOM 1068 C HIS A 187 -5.943 -8.966 2.496 1.00 0.00 C ATOM 1069 O HIS A 187 -6.687 -9.599 3.232 1.00 0.00 O ATOM 1070 CB HIS A 187 -5.543 -6.504 2.995 1.00 0.00 C ATOM 1071 CG HIS A 187 -4.530 -5.401 3.150 1.00 0.00 C ATOM 1072 ND1 HIS A 187 -3.397 -5.375 3.934 1.00 0.00 N ATOM 1073 CD2 HIS A 187 -4.572 -4.233 2.455 1.00 0.00 C ATOM 1074 CE1 HIS A 187 -2.746 -4.234 3.658 1.00 0.00 C ATOM 1075 NE2 HIS A 187 -3.421 -3.508 2.754 1.00 0.00 N ATOM 0 H HIS A 187 -3.550 -7.428 1.694 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.909 -8.150 4.173 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -6.025 -6.396 2.023 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -6.317 -6.371 3.751 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -3.107 -6.090 4.601 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.361 -3.921 1.787 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -1.807 -3.940 4.103 1.00 0.00 H new ATOM 1083 N THR A 188 -5.915 -9.225 1.187 1.00 0.00 N ATOM 1084 CA THR A 188 -6.733 -10.257 0.544 1.00 0.00 C ATOM 1085 C THR A 188 -6.224 -11.687 0.885 1.00 0.00 C ATOM 1086 O THR A 188 -6.724 -12.691 0.367 1.00 0.00 O ATOM 1087 CB THR A 188 -6.876 -9.932 -0.961 1.00 0.00 C ATOM 1088 OG1 THR A 188 -8.125 -10.362 -1.473 1.00 0.00 O ATOM 1089 CG2 THR A 188 -5.771 -10.523 -1.843 1.00 0.00 C ATOM 0 H THR A 188 -5.316 -8.718 0.535 1.00 0.00 H new ATOM 0 HA THR A 188 -7.746 -10.251 0.947 1.00 0.00 H new ATOM 0 HB THR A 188 -6.794 -8.846 -1.005 1.00 0.00 H new ATOM 0 HG1 THR A 188 -8.182 -10.139 -2.426 1.00 0.00 H new ATOM 0 HG21 THR A 188 -5.948 -10.247 -2.882 1.00 0.00 H new ATOM 0 HG22 THR A 188 -4.804 -10.134 -1.524 1.00 0.00 H new ATOM 0 HG23 THR A 188 -5.774 -11.609 -1.751 1.00 0.00 H new ATOM 1097 N VAL A 189 -5.223 -11.790 1.766 1.00 0.00 N ATOM 1098 CA VAL A 189 -4.651 -13.001 2.330 1.00 0.00 C ATOM 1099 C VAL A 189 -4.888 -12.931 3.846 1.00 0.00 C ATOM 1100 O VAL A 189 -5.856 -13.511 4.335 1.00 0.00 O ATOM 1101 CB VAL A 189 -3.173 -13.117 1.880 1.00 0.00 C ATOM 1102 CG1 VAL A 189 -2.418 -14.260 2.554 1.00 0.00 C ATOM 1103 CG2 VAL A 189 -3.042 -13.375 0.373 1.00 0.00 C ATOM 0 H VAL A 189 -4.760 -10.956 2.127 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.116 -13.922 1.977 1.00 0.00 H new ATOM 0 HB VAL A 189 -2.746 -12.156 2.166 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.390 -14.281 2.191 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.419 -14.110 3.634 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -2.905 -15.206 2.319 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -1.988 -13.448 0.107 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -3.546 -14.307 0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -3.499 -12.553 -0.178 1.00 0.00 H new ATOM 1113 N THR A 190 -4.080 -12.199 4.618 1.00 0.00 N ATOM 1114 CA THR A 190 -4.181 -12.227 6.067 1.00 0.00 C ATOM 1115 C THR A 190 -5.482 -11.581 6.557 1.00 0.00 C ATOM 1116 O THR A 190 -6.142 -12.149 7.430 1.00 0.00 O ATOM 1117 CB THR A 190 -2.958 -11.528 6.666 1.00 0.00 C ATOM 1118 OG1 THR A 190 -1.740 -12.100 6.207 1.00 0.00 O ATOM 1119 CG2 THR A 190 -3.040 -11.563 8.188 1.00 0.00 C ATOM 0 H THR A 190 -3.352 -11.583 4.258 1.00 0.00 H new ATOM 0 HA THR A 190 -4.204 -13.265 6.398 1.00 0.00 H new ATOM 0 HB THR A 190 -2.963 -10.491 6.332 1.00 0.00 H new ATOM 0 HG1 THR A 190 -0.983 -11.625 6.610 1.00 0.00 H new ATOM 0 HG21 THR A 190 -2.168 -11.065 8.611 1.00 0.00 H new ATOM 0 HG22 THR A 190 -3.945 -11.051 8.515 1.00 0.00 H new ATOM 0 HG23 THR A 190 -3.066 -12.599 8.527 1.00 0.00 H new ATOM 1127 N THR A 191 -5.832 -10.395 6.056 1.00 0.00 N ATOM 1128 CA THR A 191 -7.032 -9.676 6.459 1.00 0.00 C ATOM 1129 C THR A 191 -8.292 -10.321 5.877 1.00 0.00 C ATOM 1130 O THR A 191 -9.390 -10.039 6.339 1.00 0.00 O ATOM 1131 CB THR A 191 -6.862 -8.204 6.049 1.00 0.00 C ATOM 1132 OG1 THR A 191 -5.621 -7.704 6.527 1.00 0.00 O ATOM 1133 CG2 THR A 191 -7.991 -7.289 6.438 1.00 0.00 C ATOM 0 H THR A 191 -5.281 -9.905 5.351 1.00 0.00 H new ATOM 0 HA THR A 191 -7.163 -9.725 7.540 1.00 0.00 H new ATOM 0 HB THR A 191 -6.878 -8.207 4.959 1.00 0.00 H new ATOM 0 HG1 THR A 191 -5.521 -6.767 6.259 1.00 0.00 H new ATOM 0 HG21 THR A 191 -7.771 -6.276 6.102 1.00 0.00 H new ATOM 0 HG22 THR A 191 -8.915 -7.633 5.973 1.00 0.00 H new ATOM 0 HG23 THR A 191 -8.107 -7.295 7.522 1.00 0.00 H new ATOM 1141 N THR A 192 -8.146 -11.252 4.940 1.00 0.00 N ATOM 1142 CA THR A 192 -9.226 -11.948 4.276 1.00 0.00 C ATOM 1143 C THR A 192 -8.994 -13.440 4.476 1.00 0.00 C ATOM 1144 O THR A 192 -8.578 -14.193 3.597 1.00 0.00 O ATOM 1145 CB THR A 192 -9.311 -11.519 2.813 1.00 0.00 C ATOM 1146 OG1 THR A 192 -9.331 -10.109 2.707 1.00 0.00 O ATOM 1147 CG2 THR A 192 -10.595 -12.064 2.206 1.00 0.00 C ATOM 0 H THR A 192 -7.227 -11.550 4.613 1.00 0.00 H new ATOM 0 HA THR A 192 -10.198 -11.697 4.700 1.00 0.00 H new ATOM 0 HB THR A 192 -8.439 -11.908 2.287 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.444 -9.752 2.921 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.661 -11.761 1.161 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.594 -13.152 2.268 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.452 -11.670 2.753 1.00 0.00 H new ATOM 1155 N THR A 193 -9.277 -13.858 5.692 1.00 0.00 N ATOM 1156 CA THR A 193 -9.394 -15.224 6.138 1.00 0.00 C ATOM 1157 C THR A 193 -10.570 -15.177 7.104 1.00 0.00 C ATOM 1158 O THR A 193 -10.406 -15.113 8.323 1.00 0.00 O ATOM 1159 CB THR A 193 -8.068 -15.718 6.743 1.00 0.00 C ATOM 1160 OG1 THR A 193 -7.028 -15.690 5.771 1.00 0.00 O ATOM 1161 CG2 THR A 193 -8.144 -17.160 7.260 1.00 0.00 C ATOM 0 H THR A 193 -9.444 -13.197 6.451 1.00 0.00 H new ATOM 0 HA THR A 193 -9.582 -15.949 5.346 1.00 0.00 H new ATOM 0 HB THR A 193 -7.865 -15.043 7.574 1.00 0.00 H new ATOM 0 HG1 THR A 193 -6.876 -14.766 5.481 1.00 0.00 H new ATOM 0 HG21 THR A 193 -7.178 -17.449 7.674 1.00 0.00 H new ATOM 0 HG22 THR A 193 -8.907 -17.229 8.036 1.00 0.00 H new ATOM 0 HG23 THR A 193 -8.401 -17.828 6.438 1.00 0.00 H new ATOM 1169 N LYS A 194 -11.771 -15.203 6.519 1.00 0.00 N ATOM 1170 CA LYS A 194 -13.047 -15.381 7.206 1.00 0.00 C ATOM 1171 C LYS A 194 -13.479 -14.165 8.037 1.00 0.00 C ATOM 1172 O LYS A 194 -14.443 -14.285 8.798 1.00 0.00 O ATOM 1173 CB LYS A 194 -13.095 -16.699 7.997 1.00 0.00 C ATOM 1174 CG LYS A 194 -12.334 -17.830 7.297 1.00 0.00 C ATOM 1175 CD LYS A 194 -12.700 -19.219 7.809 1.00 0.00 C ATOM 1176 CE LYS A 194 -11.635 -20.191 7.285 1.00 0.00 C ATOM 1177 NZ LYS A 194 -11.512 -21.403 8.113 1.00 0.00 N ATOM 0 H LYS A 194 -11.882 -15.096 5.511 1.00 0.00 H new ATOM 0 HA LYS A 194 -13.800 -15.458 6.421 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -12.672 -16.540 8.989 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -14.134 -16.997 8.138 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -12.533 -17.782 6.226 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -11.264 -17.673 7.430 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -12.730 -19.232 8.899 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -13.691 -19.509 7.460 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -11.883 -20.478 6.263 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -10.672 -19.682 7.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -10.779 -22.023 7.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -11.248 -21.136 9.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -12.422 -21.907 8.128 1.00 0.00 H new ATOM 1191 N GLY A 195 -12.810 -13.019 7.910 1.00 0.00 N ATOM 1192 CA GLY A 195 -13.171 -11.748 8.520 1.00 0.00 C ATOM 1193 C GLY A 195 -13.456 -10.723 7.427 1.00 0.00 C ATOM 1194 O GLY A 195 -14.444 -10.868 6.699 1.00 0.00 O ATOM 0 H GLY A 195 -11.960 -12.953 7.350 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -14.049 -11.873 9.154 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -12.362 -11.397 9.161 1.00 0.00 H new ATOM 1198 N GLU A 196 -12.614 -9.693 7.333 1.00 0.00 N ATOM 1199 CA GLU A 196 -12.730 -8.590 6.380 1.00 0.00 C ATOM 1200 C GLU A 196 -12.686 -9.112 4.937 1.00 0.00 C ATOM 1201 O GLU A 196 -12.127 -10.176 4.668 1.00 0.00 O ATOM 1202 CB GLU A 196 -11.646 -7.557 6.715 1.00 0.00 C ATOM 1203 CG GLU A 196 -11.512 -6.361 5.768 1.00 0.00 C ATOM 1204 CD GLU A 196 -11.057 -5.124 6.545 1.00 0.00 C ATOM 1205 OE1 GLU A 196 -9.866 -5.011 6.915 1.00 0.00 O ATOM 1206 OE2 GLU A 196 -11.913 -4.292 6.928 1.00 0.00 O ATOM 0 H GLU A 196 -11.801 -9.601 7.943 1.00 0.00 H new ATOM 0 HA GLU A 196 -13.695 -8.091 6.463 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -11.839 -7.176 7.718 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.686 -8.072 6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.794 -6.590 4.980 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -12.467 -6.164 5.281 1.00 0.00 H new ATOM 1213 N ASN A 197 -13.313 -8.384 4.008 1.00 0.00 N ATOM 1214 CA ASN A 197 -13.358 -8.718 2.590 1.00 0.00 C ATOM 1215 C ASN A 197 -13.554 -7.445 1.782 1.00 0.00 C ATOM 1216 O ASN A 197 -14.634 -6.853 1.759 1.00 0.00 O ATOM 1217 CB ASN A 197 -14.450 -9.750 2.289 1.00 0.00 C ATOM 1218 CG ASN A 197 -14.003 -10.738 1.222 1.00 0.00 C ATOM 1219 OD1 ASN A 197 -13.967 -11.938 1.476 1.00 0.00 O ATOM 1220 ND2 ASN A 197 -13.672 -10.296 0.017 1.00 0.00 N ATOM 0 H ASN A 197 -13.815 -7.525 4.232 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.412 -9.177 2.304 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.705 -10.289 3.202 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.354 -9.239 1.958 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -13.385 -10.955 -0.707 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -13.704 -9.297 -0.186 1.00 0.00 H new ATOM 1227 N PHE A 198 -12.480 -7.001 1.145 1.00 0.00 N ATOM 1228 CA PHE A 198 -12.441 -5.842 0.280 1.00 0.00 C ATOM 1229 C PHE A 198 -13.114 -6.227 -1.018 1.00 0.00 C ATOM 1230 O PHE A 198 -12.578 -7.034 -1.783 1.00 0.00 O ATOM 1231 CB PHE A 198 -10.996 -5.403 0.043 1.00 0.00 C ATOM 1232 CG PHE A 198 -10.231 -5.305 1.333 1.00 0.00 C ATOM 1233 CD1 PHE A 198 -10.286 -4.124 2.093 1.00 0.00 C ATOM 1234 CD2 PHE A 198 -9.548 -6.437 1.812 1.00 0.00 C ATOM 1235 CE1 PHE A 198 -9.601 -4.056 3.313 1.00 0.00 C ATOM 1236 CE2 PHE A 198 -8.896 -6.383 3.044 1.00 0.00 C ATOM 1237 CZ PHE A 198 -8.900 -5.181 3.776 1.00 0.00 C ATOM 0 H PHE A 198 -11.574 -7.463 1.224 1.00 0.00 H new ATOM 0 HA PHE A 198 -12.960 -4.999 0.736 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.503 -6.114 -0.620 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.986 -4.437 -0.461 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -10.852 -3.275 1.739 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.528 -7.345 1.228 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.612 -3.145 3.893 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.393 -7.256 3.433 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.356 -5.123 4.707 1.00 0.00 H new ATOM 1247 N THR A 199 -14.301 -5.684 -1.224 1.00 0.00 N ATOM 1248 CA THR A 199 -15.019 -5.790 -2.470 1.00 0.00 C ATOM 1249 C THR A 199 -14.243 -5.060 -3.575 1.00 0.00 C ATOM 1250 O THR A 199 -13.476 -4.144 -3.294 1.00 0.00 O ATOM 1251 CB THR A 199 -16.444 -5.251 -2.220 1.00 0.00 C ATOM 1252 OG1 THR A 199 -16.563 -4.287 -1.174 1.00 0.00 O ATOM 1253 CG2 THR A 199 -17.280 -6.407 -1.679 1.00 0.00 C ATOM 0 H THR A 199 -14.797 -5.148 -0.512 1.00 0.00 H new ATOM 0 HA THR A 199 -15.111 -6.818 -2.820 1.00 0.00 H new ATOM 0 HB THR A 199 -16.743 -4.808 -3.170 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.003 -3.510 -1.380 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.297 -6.063 -1.490 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.300 -7.215 -2.411 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.841 -6.770 -0.750 1.00 0.00 H new ATOM 1261 N GLU A 200 -14.463 -5.412 -4.843 1.00 0.00 N ATOM 1262 CA GLU A 200 -13.784 -4.842 -6.012 1.00 0.00 C ATOM 1263 C GLU A 200 -13.811 -3.302 -6.015 1.00 0.00 C ATOM 1264 O GLU A 200 -12.847 -2.657 -6.421 1.00 0.00 O ATOM 1265 CB GLU A 200 -14.516 -5.376 -7.249 1.00 0.00 C ATOM 1266 CG GLU A 200 -13.807 -5.109 -8.579 1.00 0.00 C ATOM 1267 CD GLU A 200 -14.811 -5.113 -9.728 1.00 0.00 C ATOM 1268 OE1 GLU A 200 -15.360 -4.027 -10.036 1.00 0.00 O ATOM 1269 OE2 GLU A 200 -15.079 -6.178 -10.328 1.00 0.00 O ATOM 0 H GLU A 200 -15.144 -6.128 -5.095 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.733 -5.131 -5.999 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.654 -6.451 -7.136 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.510 -4.929 -7.287 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -13.295 -4.148 -8.539 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -13.045 -5.869 -8.751 1.00 0.00 H new ATOM 1276 N THR A 201 -14.910 -2.718 -5.538 1.00 0.00 N ATOM 1277 CA THR A 201 -15.096 -1.286 -5.363 1.00 0.00 C ATOM 1278 C THR A 201 -14.005 -0.723 -4.445 1.00 0.00 C ATOM 1279 O THR A 201 -13.318 0.223 -4.814 1.00 0.00 O ATOM 1280 CB THR A 201 -16.508 -1.107 -4.790 1.00 0.00 C ATOM 1281 OG1 THR A 201 -17.457 -1.561 -5.738 1.00 0.00 O ATOM 1282 CG2 THR A 201 -16.887 0.337 -4.495 1.00 0.00 C ATOM 0 H THR A 201 -15.727 -3.257 -5.252 1.00 0.00 H new ATOM 0 HA THR A 201 -15.007 -0.736 -6.300 1.00 0.00 H new ATOM 0 HB THR A 201 -16.509 -1.670 -3.856 1.00 0.00 H new ATOM 0 HG1 THR A 201 -18.361 -1.450 -5.375 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.900 0.373 -4.093 1.00 0.00 H new ATOM 0 HG22 THR A 201 -16.193 0.754 -3.766 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.841 0.920 -5.415 1.00 0.00 H new ATOM 1290 N ASP A 202 -13.848 -1.314 -3.264 1.00 0.00 N ATOM 1291 CA ASP A 202 -12.876 -0.966 -2.234 1.00 0.00 C ATOM 1292 C ASP A 202 -11.483 -1.206 -2.787 1.00 0.00 C ATOM 1293 O ASP A 202 -10.627 -0.343 -2.678 1.00 0.00 O ATOM 1294 CB ASP A 202 -13.139 -1.803 -0.957 1.00 0.00 C ATOM 1295 CG ASP A 202 -14.537 -1.506 -0.400 1.00 0.00 C ATOM 1296 OD1 ASP A 202 -15.540 -1.883 -1.057 1.00 0.00 O ATOM 1297 OD2 ASP A 202 -14.652 -0.859 0.664 1.00 0.00 O ATOM 0 H ASP A 202 -14.435 -2.100 -2.984 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.967 0.084 -1.958 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.050 -2.865 -1.186 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.385 -1.575 -0.204 1.00 0.00 H new ATOM 1302 N VAL A 203 -11.266 -2.334 -3.458 1.00 0.00 N ATOM 1303 CA VAL A 203 -10.014 -2.692 -4.110 1.00 0.00 C ATOM 1304 C VAL A 203 -9.564 -1.614 -5.112 1.00 0.00 C ATOM 1305 O VAL A 203 -8.382 -1.269 -5.104 1.00 0.00 O ATOM 1306 CB VAL A 203 -10.182 -4.107 -4.689 1.00 0.00 C ATOM 1307 CG1 VAL A 203 -9.193 -4.492 -5.784 1.00 0.00 C ATOM 1308 CG2 VAL A 203 -10.119 -5.141 -3.555 1.00 0.00 C ATOM 0 H VAL A 203 -11.985 -3.049 -3.565 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.187 -2.724 -3.401 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.158 -4.100 -5.174 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.400 -5.508 -6.121 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -9.293 -3.804 -6.623 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.177 -4.440 -5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.238 -6.142 -3.969 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.156 -5.069 -3.050 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.918 -4.946 -2.840 1.00 0.00 H new ATOM 1318 N LYS A 204 -10.462 -1.014 -5.909 1.00 0.00 N ATOM 1319 CA LYS A 204 -10.093 0.138 -6.748 1.00 0.00 C ATOM 1320 C LYS A 204 -9.537 1.291 -5.909 1.00 0.00 C ATOM 1321 O LYS A 204 -8.575 1.944 -6.320 1.00 0.00 O ATOM 1322 CB LYS A 204 -11.292 0.646 -7.569 1.00 0.00 C ATOM 1323 CG LYS A 204 -11.627 -0.273 -8.746 1.00 0.00 C ATOM 1324 CD LYS A 204 -12.799 0.242 -9.593 1.00 0.00 C ATOM 1325 CE LYS A 204 -14.153 -0.055 -8.930 1.00 0.00 C ATOM 1326 NZ LYS A 204 -15.292 0.109 -9.863 1.00 0.00 N ATOM 0 H LYS A 204 -11.437 -1.302 -5.990 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.317 -0.212 -7.429 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.163 0.731 -6.919 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.074 1.646 -7.944 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.746 -0.379 -9.380 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.868 -1.266 -8.367 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -12.695 1.317 -9.743 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -12.767 -0.222 -10.579 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -14.148 -1.074 -8.544 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -14.289 0.609 -8.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -16.181 -0.103 -9.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -15.316 1.088 -10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -15.180 -0.543 -10.666 1.00 0.00 H new ATOM 1340 N MET A 205 -10.134 1.552 -4.746 1.00 0.00 N ATOM 1341 CA MET A 205 -9.749 2.661 -3.883 1.00 0.00 C ATOM 1342 C MET A 205 -8.419 2.369 -3.226 1.00 0.00 C ATOM 1343 O MET A 205 -7.607 3.274 -3.021 1.00 0.00 O ATOM 1344 CB MET A 205 -10.791 2.886 -2.783 1.00 0.00 C ATOM 1345 CG MET A 205 -12.187 2.923 -3.366 1.00 0.00 C ATOM 1346 SD MET A 205 -13.222 4.140 -2.576 1.00 0.00 S ATOM 1347 CE MET A 205 -14.215 4.466 -4.035 1.00 0.00 C ATOM 0 H MET A 205 -10.904 0.994 -4.377 1.00 0.00 H new ATOM 0 HA MET A 205 -9.677 3.555 -4.503 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.722 2.090 -2.042 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.583 3.822 -2.265 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.127 3.139 -4.433 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.646 1.939 -3.265 1.00 0.00 H new ATOM 0 HE1 MET A 205 -15.134 4.974 -3.743 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.654 5.098 -4.723 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.461 3.524 -4.526 1.00 0.00 H new ATOM 1357 N MET A 206 -8.231 1.109 -2.852 1.00 0.00 N ATOM 1358 CA MET A 206 -7.040 0.616 -2.214 1.00 0.00 C ATOM 1359 C MET A 206 -5.897 0.780 -3.203 1.00 0.00 C ATOM 1360 O MET A 206 -4.903 1.378 -2.832 1.00 0.00 O ATOM 1361 CB MET A 206 -7.239 -0.839 -1.777 1.00 0.00 C ATOM 1362 CG MET A 206 -8.379 -0.997 -0.760 1.00 0.00 C ATOM 1363 SD MET A 206 -7.855 -1.474 0.905 1.00 0.00 S ATOM 1364 CE MET A 206 -7.614 -3.242 0.590 1.00 0.00 C ATOM 0 H MET A 206 -8.935 0.385 -2.995 1.00 0.00 H new ATOM 0 HA MET A 206 -6.809 1.175 -1.307 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.450 -1.452 -2.653 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.313 -1.214 -1.341 1.00 0.00 H new ATOM 0 HG2 MET A 206 -8.924 -0.055 -0.698 1.00 0.00 H new ATOM 0 HG3 MET A 206 -9.078 -1.745 -1.133 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.511 -3.770 1.538 1.00 0.00 H new ATOM 0 HE2 MET A 206 -8.473 -3.635 0.047 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.712 -3.386 -0.005 1.00 0.00 H new ATOM 1374 N GLU A 207 -6.038 0.360 -4.463 1.00 0.00 N ATOM 1375 CA GLU A 207 -4.996 0.558 -5.470 1.00 0.00 C ATOM 1376 C GLU A 207 -4.620 2.032 -5.578 1.00 0.00 C ATOM 1377 O GLU A 207 -3.435 2.345 -5.600 1.00 0.00 O ATOM 1378 CB GLU A 207 -5.437 -0.023 -6.824 1.00 0.00 C ATOM 1379 CG GLU A 207 -4.949 -1.470 -6.994 1.00 0.00 C ATOM 1380 CD GLU A 207 -3.758 -1.690 -7.929 1.00 0.00 C ATOM 1381 OE1 GLU A 207 -3.091 -0.745 -8.408 1.00 0.00 O ATOM 1382 OE2 GLU A 207 -3.451 -2.887 -8.146 1.00 0.00 O ATOM 0 H GLU A 207 -6.868 -0.121 -4.810 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.101 0.019 -5.158 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.524 0.008 -6.899 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.044 0.593 -7.632 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.685 -1.857 -6.010 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -5.783 -2.069 -7.359 1.00 0.00 H new ATOM 1389 N ARG A 208 -5.601 2.938 -5.567 1.00 0.00 N ATOM 1390 CA ARG A 208 -5.330 4.372 -5.603 1.00 0.00 C ATOM 1391 C ARG A 208 -4.491 4.817 -4.418 1.00 0.00 C ATOM 1392 O ARG A 208 -3.432 5.421 -4.593 1.00 0.00 O ATOM 1393 CB ARG A 208 -6.643 5.171 -5.669 1.00 0.00 C ATOM 1394 CG ARG A 208 -6.824 5.760 -7.071 1.00 0.00 C ATOM 1395 CD ARG A 208 -7.218 4.604 -7.978 1.00 0.00 C ATOM 1396 NE ARG A 208 -7.228 4.969 -9.395 1.00 0.00 N ATOM 1397 CZ ARG A 208 -7.706 4.212 -10.384 1.00 0.00 C ATOM 1398 NH1 ARG A 208 -8.573 3.233 -10.155 1.00 0.00 N ATOM 1399 NH2 ARG A 208 -7.290 4.438 -11.619 1.00 0.00 N ATOM 0 H ARG A 208 -6.592 2.700 -5.533 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.753 4.573 -6.506 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.486 4.524 -5.425 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.630 5.970 -4.928 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.593 6.532 -7.071 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.902 6.228 -7.417 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.524 3.777 -7.826 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.208 4.246 -7.693 1.00 0.00 H new ATOM 0 HE ARG A 208 -6.837 5.877 -9.647 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -8.890 3.044 -9.204 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -8.922 2.670 -10.930 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -6.615 5.181 -11.802 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -7.644 3.870 -12.388 1.00 0.00 H new ATOM 1413 N VAL A 209 -4.999 4.586 -3.209 1.00 0.00 N ATOM 1414 CA VAL A 209 -4.357 5.078 -2.003 1.00 0.00 C ATOM 1415 C VAL A 209 -2.966 4.455 -1.911 1.00 0.00 C ATOM 1416 O VAL A 209 -1.988 5.171 -1.725 1.00 0.00 O ATOM 1417 CB VAL A 209 -5.296 4.884 -0.794 1.00 0.00 C ATOM 1418 CG1 VAL A 209 -5.295 3.498 -0.156 1.00 0.00 C ATOM 1419 CG2 VAL A 209 -5.043 5.902 0.314 1.00 0.00 C ATOM 0 H VAL A 209 -5.856 4.059 -3.044 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.185 6.154 -2.019 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.275 5.030 -1.250 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.992 3.483 0.682 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.600 2.757 -0.895 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.293 3.263 0.201 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -5.731 5.720 1.140 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.017 5.806 0.669 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.200 6.908 -0.074 1.00 0.00 H new ATOM 1429 N VAL A 210 -2.872 3.144 -2.114 1.00 0.00 N ATOM 1430 CA VAL A 210 -1.655 2.366 -2.009 1.00 0.00 C ATOM 1431 C VAL A 210 -0.645 2.811 -3.075 1.00 0.00 C ATOM 1432 O VAL A 210 0.535 2.849 -2.759 1.00 0.00 O ATOM 1433 CB VAL A 210 -2.009 0.868 -2.053 1.00 0.00 C ATOM 1434 CG1 VAL A 210 -0.792 -0.044 -2.077 1.00 0.00 C ATOM 1435 CG2 VAL A 210 -2.822 0.435 -0.812 1.00 0.00 C ATOM 0 H VAL A 210 -3.681 2.576 -2.367 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.160 2.541 -1.054 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.579 0.763 -2.976 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -1.117 -1.084 -2.108 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -0.191 0.174 -2.960 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -0.194 0.123 -1.181 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -3.052 -0.628 -0.881 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.238 0.623 0.089 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.750 1.005 -0.768 1.00 0.00 H new ATOM 1445 N GLU A 211 -1.046 3.185 -4.293 1.00 0.00 N ATOM 1446 CA GLU A 211 -0.135 3.675 -5.331 1.00 0.00 C ATOM 1447 C GLU A 211 0.584 4.930 -4.842 1.00 0.00 C ATOM 1448 O GLU A 211 1.815 4.965 -4.768 1.00 0.00 O ATOM 1449 CB GLU A 211 -0.927 3.865 -6.637 1.00 0.00 C ATOM 1450 CG GLU A 211 -0.155 4.535 -7.783 1.00 0.00 C ATOM 1451 CD GLU A 211 -0.583 5.991 -7.980 1.00 0.00 C ATOM 1452 OE1 GLU A 211 -1.703 6.227 -8.491 1.00 0.00 O ATOM 1453 OE2 GLU A 211 0.207 6.922 -7.696 1.00 0.00 O ATOM 0 H GLU A 211 -2.022 3.156 -4.589 1.00 0.00 H new ATOM 0 HA GLU A 211 0.652 2.952 -5.544 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.274 2.889 -6.977 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.814 4.461 -6.421 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.914 4.495 -7.573 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.320 3.979 -8.706 1.00 0.00 H new ATOM 1460 N GLN A 212 -0.189 5.931 -4.428 1.00 0.00 N ATOM 1461 CA GLN A 212 0.340 7.162 -3.859 1.00 0.00 C ATOM 1462 C GLN A 212 1.196 6.912 -2.623 1.00 0.00 C ATOM 1463 O GLN A 212 2.194 7.596 -2.397 1.00 0.00 O ATOM 1464 CB GLN A 212 -0.812 8.064 -3.503 1.00 0.00 C ATOM 1465 CG GLN A 212 -1.531 8.511 -4.787 1.00 0.00 C ATOM 1466 CD GLN A 212 -1.967 9.948 -4.652 1.00 0.00 C ATOM 1467 OE1 GLN A 212 -1.876 10.743 -5.587 1.00 0.00 O ATOM 1468 NE2 GLN A 212 -2.381 10.330 -3.464 1.00 0.00 N ATOM 0 H GLN A 212 -1.207 5.908 -4.480 1.00 0.00 H new ATOM 0 HA GLN A 212 0.984 7.628 -4.605 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.508 7.541 -2.847 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.450 8.934 -2.955 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -0.867 8.402 -5.644 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.396 7.874 -4.971 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -2.448 9.652 -2.705 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -2.635 11.304 -3.301 1.00 0.00 H new ATOM 1477 N MET A 213 0.785 5.958 -1.798 1.00 0.00 N ATOM 1478 CA MET A 213 1.456 5.613 -0.564 1.00 0.00 C ATOM 1479 C MET A 213 2.771 4.897 -0.850 1.00 0.00 C ATOM 1480 O MET A 213 3.760 5.222 -0.205 1.00 0.00 O ATOM 1481 CB MET A 213 0.523 4.747 0.271 1.00 0.00 C ATOM 1482 CG MET A 213 -0.660 5.559 0.827 1.00 0.00 C ATOM 1483 SD MET A 213 -0.584 5.943 2.589 1.00 0.00 S ATOM 1484 CE MET A 213 -1.997 4.937 3.125 1.00 0.00 C ATOM 0 H MET A 213 -0.045 5.393 -1.978 1.00 0.00 H new ATOM 0 HA MET A 213 1.698 6.518 -0.007 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.146 3.925 -0.338 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.080 4.303 1.096 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.728 6.495 0.272 1.00 0.00 H new ATOM 0 HG3 MET A 213 -1.579 5.007 0.633 1.00 0.00 H new ATOM 0 HE1 MET A 213 -2.093 4.993 4.209 1.00 0.00 H new ATOM 0 HE2 MET A 213 -2.908 5.313 2.660 1.00 0.00 H new ATOM 0 HE3 MET A 213 -1.839 3.900 2.828 1.00 0.00 H new ATOM 1494 N CYS A 214 2.823 3.973 -1.811 1.00 0.00 N ATOM 1495 CA CYS A 214 4.030 3.271 -2.208 1.00 0.00 C ATOM 1496 C CYS A 214 5.042 4.281 -2.742 1.00 0.00 C ATOM 1497 O CYS A 214 6.217 4.192 -2.382 1.00 0.00 O ATOM 1498 CB CYS A 214 3.712 2.183 -3.248 1.00 0.00 C ATOM 1499 SG CYS A 214 3.119 0.603 -2.581 1.00 0.00 S ATOM 0 H CYS A 214 2.001 3.690 -2.345 1.00 0.00 H new ATOM 0 HA CYS A 214 4.461 2.767 -1.343 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.959 2.572 -3.934 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.611 1.994 -3.835 1.00 0.00 H new ATOM 1504 N VAL A 215 4.594 5.255 -3.544 1.00 0.00 N ATOM 1505 CA VAL A 215 5.381 6.370 -4.010 1.00 0.00 C ATOM 1506 C VAL A 215 5.872 7.193 -2.814 1.00 0.00 C ATOM 1507 O VAL A 215 7.071 7.409 -2.697 1.00 0.00 O ATOM 1508 CB VAL A 215 4.512 7.158 -5.009 1.00 0.00 C ATOM 1509 CG1 VAL A 215 5.069 8.551 -5.225 1.00 0.00 C ATOM 1510 CG2 VAL A 215 4.419 6.423 -6.352 1.00 0.00 C ATOM 0 H VAL A 215 3.635 5.275 -3.891 1.00 0.00 H new ATOM 0 HA VAL A 215 6.285 6.055 -4.531 1.00 0.00 H new ATOM 0 HB VAL A 215 3.512 7.240 -4.584 1.00 0.00 H new ATOM 0 HG11 VAL A 215 4.439 9.089 -5.934 1.00 0.00 H new ATOM 0 HG12 VAL A 215 5.087 9.087 -4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 215 6.082 8.480 -5.621 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.800 6.999 -7.040 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.418 6.306 -6.773 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.973 5.440 -6.199 1.00 0.00 H new ATOM 1520 N THR A 216 4.993 7.649 -1.919 1.00 0.00 N ATOM 1521 CA THR A 216 5.370 8.388 -0.716 1.00 0.00 C ATOM 1522 C THR A 216 6.433 7.641 0.067 1.00 0.00 C ATOM 1523 O THR A 216 7.423 8.256 0.436 1.00 0.00 O ATOM 1524 CB THR A 216 4.103 8.623 0.130 1.00 0.00 C ATOM 1525 OG1 THR A 216 3.324 9.675 -0.412 1.00 0.00 O ATOM 1526 CG2 THR A 216 4.379 8.917 1.612 1.00 0.00 C ATOM 0 H THR A 216 3.986 7.513 -2.012 1.00 0.00 H new ATOM 0 HA THR A 216 5.801 9.350 -0.991 1.00 0.00 H new ATOM 0 HB THR A 216 3.558 7.680 0.090 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.780 9.332 -1.151 1.00 0.00 H new ATOM 0 HG21 THR A 216 3.435 9.070 2.135 1.00 0.00 H new ATOM 0 HG22 THR A 216 4.908 8.075 2.058 1.00 0.00 H new ATOM 0 HG23 THR A 216 4.990 9.815 1.697 1.00 0.00 H new ATOM 1534 N GLN A 217 6.229 6.364 0.356 1.00 0.00 N ATOM 1535 CA GLN A 217 7.115 5.587 1.191 1.00 0.00 C ATOM 1536 C GLN A 217 8.517 5.571 0.554 1.00 0.00 C ATOM 1537 O GLN A 217 9.474 5.935 1.225 1.00 0.00 O ATOM 1538 CB GLN A 217 6.396 4.256 1.478 1.00 0.00 C ATOM 1539 CG GLN A 217 7.258 3.138 2.037 1.00 0.00 C ATOM 1540 CD GLN A 217 7.820 3.446 3.417 1.00 0.00 C ATOM 1541 OE1 GLN A 217 7.115 3.892 4.318 1.00 0.00 O ATOM 1542 NE2 GLN A 217 9.107 3.253 3.602 1.00 0.00 N ATOM 0 H GLN A 217 5.429 5.836 0.008 1.00 0.00 H new ATOM 0 HA GLN A 217 7.323 6.000 2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.586 4.449 2.181 1.00 0.00 H new ATOM 0 HB3 GLN A 217 5.939 3.907 0.552 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.667 2.224 2.088 1.00 0.00 H new ATOM 0 HG3 GLN A 217 8.083 2.946 1.351 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.681 2.882 2.845 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.532 3.474 4.503 1.00 0.00 H new ATOM 1551 N TYR A 218 8.627 5.327 -0.754 1.00 0.00 N ATOM 1552 CA TYR A 218 9.828 5.529 -1.584 1.00 0.00 C ATOM 1553 C TYR A 218 10.355 6.967 -1.563 1.00 0.00 C ATOM 1554 O TYR A 218 11.570 7.141 -1.555 1.00 0.00 O ATOM 1555 CB TYR A 218 9.454 5.116 -3.013 1.00 0.00 C ATOM 1556 CG TYR A 218 10.244 5.735 -4.160 1.00 0.00 C ATOM 1557 CD1 TYR A 218 9.842 6.970 -4.710 1.00 0.00 C ATOM 1558 CD2 TYR A 218 11.366 5.082 -4.701 1.00 0.00 C ATOM 1559 CE1 TYR A 218 10.584 7.575 -5.736 1.00 0.00 C ATOM 1560 CE2 TYR A 218 12.088 5.654 -5.761 1.00 0.00 C ATOM 1561 CZ TYR A 218 11.712 6.918 -6.275 1.00 0.00 C ATOM 1562 OH TYR A 218 12.402 7.469 -7.311 1.00 0.00 O ATOM 0 H TYR A 218 7.843 4.964 -1.296 1.00 0.00 H new ATOM 0 HA TYR A 218 10.640 4.924 -1.181 1.00 0.00 H new ATOM 0 HB2 TYR A 218 9.551 4.033 -3.085 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.401 5.352 -3.165 1.00 0.00 H new ATOM 0 HD1 TYR A 218 8.952 7.456 -4.337 1.00 0.00 H new ATOM 0 HD2 TYR A 218 11.676 4.130 -4.297 1.00 0.00 H new ATOM 0 HE1 TYR A 218 10.292 8.544 -6.114 1.00 0.00 H new ATOM 0 HE2 TYR A 218 12.931 5.129 -6.185 1.00 0.00 H new ATOM 0 HH TYR A 218 13.149 6.883 -7.555 1.00 0.00 H new ATOM 1572 N GLN A 219 9.520 8.010 -1.529 1.00 0.00 N ATOM 1573 CA GLN A 219 10.025 9.382 -1.466 1.00 0.00 C ATOM 1574 C GLN A 219 10.851 9.618 -0.190 1.00 0.00 C ATOM 1575 O GLN A 219 11.612 10.584 -0.138 1.00 0.00 O ATOM 1576 CB GLN A 219 8.907 10.436 -1.627 1.00 0.00 C ATOM 1577 CG GLN A 219 8.180 10.423 -2.988 1.00 0.00 C ATOM 1578 CD GLN A 219 7.931 11.835 -3.530 1.00 0.00 C ATOM 1579 OE1 GLN A 219 8.843 12.489 -4.038 1.00 0.00 O ATOM 1580 NE2 GLN A 219 6.711 12.344 -3.464 1.00 0.00 N ATOM 0 H GLN A 219 8.503 7.931 -1.544 1.00 0.00 H new ATOM 0 HA GLN A 219 10.690 9.510 -2.320 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.170 10.283 -0.839 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.338 11.425 -1.473 1.00 0.00 H new ATOM 0 HG2 GLN A 219 8.773 9.859 -3.708 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.227 9.904 -2.883 1.00 0.00 H new ATOM 0 HE21 GLN A 219 5.955 11.804 -3.044 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.527 13.277 -3.834 1.00 0.00 H new ATOM 1589 N LYS A 220 10.741 8.739 0.813 1.00 0.00 N ATOM 1590 CA LYS A 220 11.676 8.608 1.923 1.00 0.00 C ATOM 1591 C LYS A 220 12.664 7.508 1.577 1.00 0.00 C ATOM 1592 O LYS A 220 13.838 7.807 1.442 1.00 0.00 O ATOM 1593 CB LYS A 220 11.002 8.268 3.265 1.00 0.00 C ATOM 1594 CG LYS A 220 9.944 9.261 3.758 1.00 0.00 C ATOM 1595 CD LYS A 220 8.632 9.058 3.001 1.00 0.00 C ATOM 1596 CE LYS A 220 7.500 9.868 3.619 1.00 0.00 C ATOM 1597 NZ LYS A 220 7.366 11.185 2.969 1.00 0.00 N ATOM 0 H LYS A 220 9.967 8.077 0.871 1.00 0.00 H new ATOM 0 HA LYS A 220 12.161 9.575 2.056 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.536 7.286 3.176 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.777 8.186 4.027 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.779 9.126 4.827 1.00 0.00 H new ATOM 0 HG3 LYS A 220 10.299 10.282 3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 220 8.763 9.350 1.959 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.368 8.000 3.005 1.00 0.00 H new ATOM 0 HE2 LYS A 220 6.564 9.318 3.527 1.00 0.00 H new ATOM 0 HE3 LYS A 220 7.686 10.003 4.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 6.587 11.713 3.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.252 11.718 3.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.164 11.054 1.957 1.00 0.00 H new ATOM 1611 N GLU A 221 12.215 6.256 1.476 1.00 0.00 N ATOM 1612 CA GLU A 221 13.063 5.071 1.421 1.00 0.00 C ATOM 1613 C GLU A 221 14.114 5.190 0.339 1.00 0.00 C ATOM 1614 O GLU A 221 15.266 4.908 0.620 1.00 0.00 O ATOM 1615 CB GLU A 221 12.229 3.791 1.227 1.00 0.00 C ATOM 1616 CG GLU A 221 12.107 2.993 2.531 1.00 0.00 C ATOM 1617 CD GLU A 221 13.402 2.326 3.008 1.00 0.00 C ATOM 1618 OE1 GLU A 221 13.833 1.335 2.383 1.00 0.00 O ATOM 1619 OE2 GLU A 221 13.907 2.736 4.080 1.00 0.00 O ATOM 0 H GLU A 221 11.220 6.035 1.429 1.00 0.00 H new ATOM 0 HA GLU A 221 13.575 4.999 2.381 1.00 0.00 H new ATOM 0 HB2 GLU A 221 11.235 4.055 0.867 1.00 0.00 H new ATOM 0 HB3 GLU A 221 12.690 3.168 0.461 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.750 3.660 3.315 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.347 2.223 2.398 1.00 0.00 H new ATOM 1626 N SER A 222 13.752 5.605 -0.876 1.00 0.00 N ATOM 1627 CA SER A 222 14.740 5.893 -1.890 1.00 0.00 C ATOM 1628 C SER A 222 15.492 7.130 -1.458 1.00 0.00 C ATOM 1629 O SER A 222 16.663 6.999 -1.134 1.00 0.00 O ATOM 1630 CB SER A 222 14.107 6.015 -3.280 1.00 0.00 C ATOM 1631 OG SER A 222 14.972 6.589 -4.238 1.00 0.00 O ATOM 0 H SER A 222 12.786 5.745 -1.171 1.00 0.00 H new ATOM 0 HA SER A 222 15.447 5.069 -1.985 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.803 5.026 -3.622 1.00 0.00 H new ATOM 0 HB3 SER A 222 13.203 6.619 -3.208 1.00 0.00 H new ATOM 0 HG SER A 222 15.865 6.194 -4.151 1.00 0.00 H new ATOM 1637 N GLN A 223 14.867 8.309 -1.477 1.00 0.00 N ATOM 1638 CA GLN A 223 15.641 9.546 -1.500 1.00 0.00 C ATOM 1639 C GLN A 223 16.559 9.672 -0.283 1.00 0.00 C ATOM 1640 O GLN A 223 17.726 10.011 -0.432 1.00 0.00 O ATOM 1641 CB GLN A 223 14.759 10.792 -1.649 1.00 0.00 C ATOM 1642 CG GLN A 223 13.847 10.785 -2.886 1.00 0.00 C ATOM 1643 CD GLN A 223 14.566 10.572 -4.223 1.00 0.00 C ATOM 1644 OE1 GLN A 223 15.769 10.778 -4.368 1.00 0.00 O ATOM 1645 NE2 GLN A 223 13.828 10.144 -5.231 1.00 0.00 N ATOM 0 H GLN A 223 13.854 8.431 -1.477 1.00 0.00 H new ATOM 0 HA GLN A 223 16.270 9.487 -2.389 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.140 10.892 -0.758 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.400 11.672 -1.691 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.101 10.000 -2.763 1.00 0.00 H new ATOM 0 HG3 GLN A 223 13.309 11.732 -2.927 1.00 0.00 H new ATOM 0 HE21 GLN A 223 12.831 9.977 -5.098 1.00 0.00 H new ATOM 0 HE22 GLN A 223 14.255 9.981 -6.143 1.00 0.00 H new ATOM 1654 N ALA A 224 16.085 9.320 0.910 1.00 0.00 N ATOM 1655 CA ALA A 224 16.885 9.277 2.123 1.00 0.00 C ATOM 1656 C ALA A 224 18.076 8.329 1.960 1.00 0.00 C ATOM 1657 O ALA A 224 19.201 8.704 2.296 1.00 0.00 O ATOM 1658 CB ALA A 224 15.989 8.850 3.295 1.00 0.00 C ATOM 0 H ALA A 224 15.112 9.052 1.059 1.00 0.00 H new ATOM 0 HA ALA A 224 17.291 10.268 2.326 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.580 8.814 4.210 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.178 9.569 3.414 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.572 7.863 3.094 1.00 0.00 H new ATOM 1664 N TYR A 225 17.841 7.135 1.412 1.00 0.00 N ATOM 1665 CA TYR A 225 18.842 6.135 1.060 1.00 0.00 C ATOM 1666 C TYR A 225 19.570 6.453 -0.265 1.00 0.00 C ATOM 1667 O TYR A 225 20.290 5.599 -0.786 1.00 0.00 O ATOM 1668 CB TYR A 225 18.175 4.758 1.001 1.00 0.00 C ATOM 1669 CG TYR A 225 19.119 3.585 1.143 1.00 0.00 C ATOM 1670 CD1 TYR A 225 19.672 3.229 2.387 1.00 0.00 C ATOM 1671 CD2 TYR A 225 19.413 2.820 0.011 1.00 0.00 C ATOM 1672 CE1 TYR A 225 20.504 2.095 2.493 1.00 0.00 C ATOM 1673 CE2 TYR A 225 20.239 1.697 0.105 1.00 0.00 C ATOM 1674 CZ TYR A 225 20.779 1.309 1.347 1.00 0.00 C ATOM 1675 OH TYR A 225 21.554 0.190 1.411 1.00 0.00 O ATOM 0 H TYR A 225 16.894 6.826 1.191 1.00 0.00 H new ATOM 0 HA TYR A 225 19.610 6.144 1.833 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.425 4.700 1.790 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.646 4.667 0.052 1.00 0.00 H new ATOM 0 HD1 TYR A 225 19.459 3.825 3.262 1.00 0.00 H new ATOM 0 HD2 TYR A 225 18.998 3.100 -0.946 1.00 0.00 H new ATOM 0 HE1 TYR A 225 20.931 1.826 3.448 1.00 0.00 H new ATOM 0 HE2 TYR A 225 20.465 1.122 -0.781 1.00 0.00 H new ATOM 0 HH TYR A 225 21.624 -0.211 0.520 1.00 0.00 H new ATOM 1685 N TYR A 226 19.458 7.669 -0.809 1.00 0.00 N ATOM 1686 CA TYR A 226 20.056 8.058 -2.083 1.00 0.00 C ATOM 1687 C TYR A 226 20.883 9.323 -1.965 1.00 0.00 C ATOM 1688 O TYR A 226 22.069 9.325 -2.278 1.00 0.00 O ATOM 1689 CB TYR A 226 18.970 8.189 -3.161 1.00 0.00 C ATOM 1690 CG TYR A 226 18.913 7.044 -4.144 1.00 0.00 C ATOM 1691 CD1 TYR A 226 19.760 7.125 -5.262 1.00 0.00 C ATOM 1692 CD2 TYR A 226 17.980 5.986 -4.029 1.00 0.00 C ATOM 1693 CE1 TYR A 226 19.647 6.188 -6.297 1.00 0.00 C ATOM 1694 CE2 TYR A 226 17.870 5.050 -5.069 1.00 0.00 C ATOM 1695 CZ TYR A 226 18.689 5.160 -6.209 1.00 0.00 C ATOM 1696 OH TYR A 226 18.472 4.335 -7.258 1.00 0.00 O ATOM 0 H TYR A 226 18.937 8.424 -0.363 1.00 0.00 H new ATOM 0 HA TYR A 226 20.746 7.269 -2.383 1.00 0.00 H new ATOM 0 HB2 TYR A 226 18.000 8.278 -2.671 1.00 0.00 H new ATOM 0 HB3 TYR A 226 19.135 9.115 -3.712 1.00 0.00 H new ATOM 0 HD1 TYR A 226 20.499 7.910 -5.323 1.00 0.00 H new ATOM 0 HD2 TYR A 226 17.359 5.900 -3.150 1.00 0.00 H new ATOM 0 HE1 TYR A 226 20.293 6.254 -7.160 1.00 0.00 H new ATOM 0 HE2 TYR A 226 17.156 4.244 -4.995 1.00 0.00 H new ATOM 0 HH TYR A 226 17.778 3.683 -7.024 1.00 0.00 H new ATOM 1706 N ASP A 227 20.254 10.381 -1.481 1.00 0.00 N ATOM 1707 CA ASP A 227 20.696 11.769 -1.459 1.00 0.00 C ATOM 1708 C ASP A 227 22.119 11.938 -0.928 1.00 0.00 C ATOM 1709 O ASP A 227 22.838 12.839 -1.358 1.00 0.00 O ATOM 1710 CB ASP A 227 19.756 12.510 -0.508 1.00 0.00 C ATOM 1711 CG ASP A 227 18.400 12.928 -1.088 1.00 0.00 C ATOM 1712 OD1 ASP A 227 18.289 13.186 -2.310 1.00 0.00 O ATOM 1713 OD2 ASP A 227 17.427 13.046 -0.301 1.00 0.00 O ATOM 0 H ASP A 227 19.334 10.282 -1.053 1.00 0.00 H new ATOM 0 HA ASP A 227 20.682 12.151 -2.480 1.00 0.00 H new ATOM 0 HB2 ASP A 227 19.577 11.876 0.360 1.00 0.00 H new ATOM 0 HB3 ASP A 227 20.266 13.404 -0.150 1.00 0.00 H new ATOM 1718 N GLY A 228 22.528 11.080 0.013 1.00 0.00 N ATOM 1719 CA GLY A 228 23.919 10.957 0.428 1.00 0.00 C ATOM 1720 C GLY A 228 24.252 9.537 0.846 1.00 0.00 C ATOM 1721 O GLY A 228 24.735 9.326 1.961 1.00 0.00 O ATOM 0 H GLY A 228 21.896 10.451 0.507 1.00 0.00 H new ATOM 0 HA2 GLY A 228 24.572 11.259 -0.391 1.00 0.00 H new ATOM 0 HA3 GLY A 228 24.114 11.637 1.258 1.00 0.00 H new ATOM 1725 N ARG A 229 23.876 8.556 0.022 1.00 0.00 N ATOM 1726 CA ARG A 229 23.896 7.138 0.384 1.00 0.00 C ATOM 1727 C ARG A 229 24.216 6.294 -0.856 1.00 0.00 C ATOM 1728 O ARG A 229 25.395 6.108 -1.148 1.00 0.00 O ATOM 1729 CB ARG A 229 22.540 6.789 1.001 1.00 0.00 C ATOM 1730 CG ARG A 229 22.220 7.321 2.400 1.00 0.00 C ATOM 1731 CD ARG A 229 22.912 6.567 3.542 1.00 0.00 C ATOM 1732 NE ARG A 229 21.988 6.337 4.670 1.00 0.00 N ATOM 1733 CZ ARG A 229 21.234 7.266 5.272 1.00 0.00 C ATOM 1734 NH1 ARG A 229 21.596 8.546 5.268 1.00 0.00 N ATOM 1735 NH2 ARG A 229 20.091 6.926 5.849 1.00 0.00 N ATOM 0 H ARG A 229 23.545 8.727 -0.927 1.00 0.00 H new ATOM 0 HA ARG A 229 24.673 6.924 1.118 1.00 0.00 H new ATOM 0 HB2 ARG A 229 21.765 7.147 0.324 1.00 0.00 H new ATOM 0 HB3 ARG A 229 22.459 5.702 1.032 1.00 0.00 H new ATOM 0 HG2 ARG A 229 22.506 8.372 2.449 1.00 0.00 H new ATOM 0 HG3 ARG A 229 21.142 7.277 2.554 1.00 0.00 H new ATOM 0 HD2 ARG A 229 23.287 5.611 3.175 1.00 0.00 H new ATOM 0 HD3 ARG A 229 23.775 7.137 3.886 1.00 0.00 H new ATOM 0 HE ARG A 229 21.917 5.383 5.023 1.00 0.00 H new ATOM 0 HH11 ARG A 229 22.458 8.831 4.802 1.00 0.00 H new ATOM 0 HH12 ARG A 229 21.012 9.243 5.731 1.00 0.00 H new ATOM 0 HH21 ARG A 229 19.782 5.954 5.836 1.00 0.00 H new ATOM 0 HH22 ARG A 229 19.520 7.636 6.306 1.00 0.00 H new