USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 574 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 173 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 215 SER OG : rot -82:sc= 1.02 USER MOD Single : A 163 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 164 LYS NZ :NH3+ 170:sc= -0.0864 (180deg=-0.211) USER MOD Single : A 165 GLN : amide:sc= -0.331 K(o=-0.33,f=-0.88) USER MOD Single : A 167 THR OG1 : rot -170:sc= 0 USER MOD Single : A 176 THR OG1 : rot 180:sc= 0.0146 USER MOD Single : A 180 SER OG : rot -82:sc= -2.28! USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl 162:sc= -0.188 (180deg=-0.745) USER MOD Single : A 187 MET CE :methyl -147:sc= -0.297 (180deg=-1.27) USER MOD Single : A 194 CYS SG : rot -47:sc= -0.258 USER MOD Single : A 195 CYS SG : rot 95:sc= 0.0135 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ 147:sc= 1.22 (180deg=0.689) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot -160:sc= 0 USER MOD Single : A 218 THR OG1 : rot 102:sc= 1.29 USER MOD Single : A 223 HIS : no HD1:sc= -0.104 K(o=-0.1,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 65 N PRO A 155 14.419 1.401 -2.402 1.00 0.00 N ATOM 66 CA PRO A 155 13.395 0.515 -2.958 1.00 0.00 C ATOM 67 C PRO A 155 11.994 1.101 -2.819 1.00 0.00 C ATOM 68 O PRO A 155 11.757 1.973 -1.984 1.00 0.00 O ATOM 69 CB PRO A 155 13.539 -0.754 -2.123 1.00 0.00 C ATOM 70 CG PRO A 155 14.073 -0.273 -0.825 1.00 0.00 C ATOM 71 CD PRO A 155 15.001 0.858 -1.162 1.00 0.00 C ATOM 0 HA PRO A 155 13.526 0.349 -4.027 1.00 0.00 H new ATOM 0 HB2 PRO A 155 12.582 -1.260 -1.998 1.00 0.00 H new ATOM 0 HB3 PRO A 155 14.217 -1.466 -2.594 1.00 0.00 H new ATOM 0 HG2 PRO A 155 13.268 0.062 -0.171 1.00 0.00 H new ATOM 0 HG3 PRO A 155 14.600 -1.069 -0.299 1.00 0.00 H new ATOM 0 HD2 PRO A 155 15.032 1.605 -0.369 1.00 0.00 H new ATOM 0 HD3 PRO A 155 16.023 0.511 -1.313 1.00 0.00 H new ATOM 79 N ILE A 156 11.071 0.617 -3.632 1.00 0.00 N ATOM 80 CA ILE A 156 9.714 1.142 -3.655 1.00 0.00 C ATOM 81 C ILE A 156 8.691 0.015 -3.549 1.00 0.00 C ATOM 82 O ILE A 156 9.033 -1.156 -3.684 1.00 0.00 O ATOM 83 CB ILE A 156 9.460 1.982 -4.937 1.00 0.00 C ATOM 84 CG1 ILE A 156 10.127 1.351 -6.168 1.00 0.00 C ATOM 85 CG2 ILE A 156 9.934 3.413 -4.754 1.00 0.00 C ATOM 86 CD1 ILE A 156 9.478 0.065 -6.621 1.00 0.00 C ATOM 0 H ILE A 156 11.237 -0.144 -4.290 1.00 0.00 H new ATOM 0 HA ILE A 156 9.599 1.795 -2.790 1.00 0.00 H new ATOM 0 HB ILE A 156 8.383 1.993 -5.107 1.00 0.00 H new ATOM 0 HG12 ILE A 156 10.104 2.067 -6.989 1.00 0.00 H new ATOM 0 HG13 ILE A 156 11.176 1.158 -5.942 1.00 0.00 H new ATOM 0 HG21 ILE A 156 9.744 3.979 -5.666 1.00 0.00 H new ATOM 0 HG22 ILE A 156 9.396 3.871 -3.924 1.00 0.00 H new ATOM 0 HG23 ILE A 156 11.003 3.418 -4.540 1.00 0.00 H new ATOM 0 HD11 ILE A 156 10.004 -0.320 -7.494 1.00 0.00 H new ATOM 0 HD12 ILE A 156 9.524 -0.669 -5.817 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.436 0.255 -6.880 1.00 0.00 H new ATOM 98 N VAL A 157 7.443 0.374 -3.294 1.00 0.00 N ATOM 99 CA VAL A 157 6.377 -0.602 -3.113 1.00 0.00 C ATOM 100 C VAL A 157 5.197 -0.273 -4.025 1.00 0.00 C ATOM 101 O VAL A 157 4.681 0.845 -3.996 1.00 0.00 O ATOM 102 CB VAL A 157 5.896 -0.625 -1.649 1.00 0.00 C ATOM 103 CG1 VAL A 157 4.847 -1.697 -1.443 1.00 0.00 C ATOM 104 CG2 VAL A 157 7.061 -0.829 -0.699 1.00 0.00 C ATOM 0 H VAL A 157 7.140 1.344 -3.207 1.00 0.00 H new ATOM 0 HA VAL A 157 6.775 -1.584 -3.371 1.00 0.00 H new ATOM 0 HB VAL A 157 5.444 0.342 -1.430 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.523 -1.694 -0.402 1.00 0.00 H new ATOM 0 HG12 VAL A 157 3.992 -1.499 -2.090 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.269 -2.671 -1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.695 -0.841 0.328 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.550 -1.777 -0.922 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.776 -0.015 -0.820 1.00 0.00 H new ATOM 114 N ARG A 158 4.773 -1.250 -4.822 1.00 0.00 N ATOM 115 CA ARG A 158 3.788 -1.017 -5.877 1.00 0.00 C ATOM 116 C ARG A 158 2.380 -1.306 -5.409 1.00 0.00 C ATOM 117 O ARG A 158 1.895 -2.424 -5.516 1.00 0.00 O ATOM 118 CB ARG A 158 4.123 -1.873 -7.093 1.00 0.00 C ATOM 119 CG ARG A 158 5.438 -1.470 -7.703 1.00 0.00 C ATOM 120 CD ARG A 158 5.879 -2.383 -8.828 1.00 0.00 C ATOM 121 NE ARG A 158 6.104 -3.759 -8.372 1.00 0.00 N ATOM 122 CZ ARG A 158 7.194 -4.474 -8.660 1.00 0.00 C ATOM 123 NH1 ARG A 158 8.174 -3.941 -9.378 1.00 0.00 N ATOM 124 NH2 ARG A 158 7.304 -5.722 -8.226 1.00 0.00 N ATOM 0 H ARG A 158 5.097 -2.215 -4.758 1.00 0.00 H new ATOM 0 HA ARG A 158 3.832 0.038 -6.147 1.00 0.00 H new ATOM 0 HB2 ARG A 158 4.162 -2.923 -6.801 1.00 0.00 H new ATOM 0 HB3 ARG A 158 3.331 -1.778 -7.836 1.00 0.00 H new ATOM 0 HG2 ARG A 158 5.359 -0.451 -8.081 1.00 0.00 H new ATOM 0 HG3 ARG A 158 6.204 -1.464 -6.928 1.00 0.00 H new ATOM 0 HD2 ARG A 158 5.122 -2.382 -9.612 1.00 0.00 H new ATOM 0 HD3 ARG A 158 6.796 -1.994 -9.270 1.00 0.00 H new ATOM 0 HE ARG A 158 5.383 -4.197 -7.799 1.00 0.00 H new ATOM 0 HH11 ARG A 158 8.097 -2.981 -9.713 1.00 0.00 H new ATOM 0 HH12 ARG A 158 9.005 -4.492 -9.595 1.00 0.00 H new ATOM 0 HH21 ARG A 158 6.555 -6.137 -7.671 1.00 0.00 H new ATOM 0 HH22 ARG A 158 8.137 -6.267 -8.447 1.00 0.00 H new ATOM 138 N VAL A 159 1.725 -0.285 -4.909 1.00 0.00 N ATOM 139 CA VAL A 159 0.378 -0.421 -4.414 1.00 0.00 C ATOM 140 C VAL A 159 -0.634 -0.084 -5.490 1.00 0.00 C ATOM 141 O VAL A 159 -0.326 0.576 -6.480 1.00 0.00 O ATOM 142 CB VAL A 159 0.103 0.483 -3.208 1.00 0.00 C ATOM 143 CG1 VAL A 159 -1.048 -0.065 -2.394 1.00 0.00 C ATOM 144 CG2 VAL A 159 1.320 0.631 -2.339 1.00 0.00 C ATOM 0 H VAL A 159 2.109 0.657 -4.835 1.00 0.00 H new ATOM 0 HA VAL A 159 0.278 -1.462 -4.108 1.00 0.00 H new ATOM 0 HB VAL A 159 -0.161 1.470 -3.589 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -1.233 0.587 -1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -1.943 -0.112 -3.015 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -0.799 -1.065 -2.040 1.00 0.00 H new ATOM 0 HG21 VAL A 159 1.087 1.279 -1.494 1.00 0.00 H new ATOM 0 HG22 VAL A 159 1.626 -0.349 -1.972 1.00 0.00 H new ATOM 0 HG23 VAL A 159 2.131 1.070 -2.920 1.00 0.00 H new ATOM 154 N PHE A 160 -1.845 -0.524 -5.252 1.00 0.00 N ATOM 155 CA PHE A 160 -2.951 -0.328 -6.169 1.00 0.00 C ATOM 156 C PHE A 160 -4.106 0.347 -5.446 1.00 0.00 C ATOM 157 O PHE A 160 -4.778 -0.275 -4.634 1.00 0.00 O ATOM 158 CB PHE A 160 -3.404 -1.669 -6.748 1.00 0.00 C ATOM 159 CG PHE A 160 -2.471 -2.237 -7.781 1.00 0.00 C ATOM 160 CD1 PHE A 160 -1.287 -2.853 -7.408 1.00 0.00 C ATOM 161 CD2 PHE A 160 -2.784 -2.159 -9.128 1.00 0.00 C ATOM 162 CE1 PHE A 160 -0.433 -3.379 -8.357 1.00 0.00 C ATOM 163 CE2 PHE A 160 -1.934 -2.682 -10.083 1.00 0.00 C ATOM 164 CZ PHE A 160 -0.756 -3.293 -9.696 1.00 0.00 C ATOM 0 H PHE A 160 -2.098 -1.035 -4.406 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.622 0.311 -6.989 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -3.509 -2.387 -5.935 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -4.391 -1.546 -7.194 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -1.029 -2.923 -6.362 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.704 -1.684 -9.435 1.00 0.00 H new ATOM 0 HE1 PHE A 160 0.486 -3.857 -8.052 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -2.189 -2.614 -11.130 1.00 0.00 H new ATOM 0 HZ PHE A 160 -0.089 -3.703 -10.440 1.00 0.00 H new ATOM 174 N LEU A 161 -4.334 1.614 -5.741 1.00 0.00 N ATOM 175 CA LEU A 161 -5.350 2.387 -5.039 1.00 0.00 C ATOM 176 C LEU A 161 -6.724 2.102 -5.651 1.00 0.00 C ATOM 177 O LEU A 161 -6.811 1.500 -6.725 1.00 0.00 O ATOM 178 CB LEU A 161 -5.044 3.902 -5.103 1.00 0.00 C ATOM 179 CG LEU A 161 -3.644 4.348 -4.665 1.00 0.00 C ATOM 180 CD1 LEU A 161 -3.191 3.621 -3.410 1.00 0.00 C ATOM 181 CD2 LEU A 161 -2.652 4.168 -5.797 1.00 0.00 C ATOM 0 H LEU A 161 -3.831 2.132 -6.461 1.00 0.00 H new ATOM 0 HA LEU A 161 -5.347 2.089 -3.991 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.201 4.236 -6.129 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -5.775 4.422 -4.483 1.00 0.00 H new ATOM 0 HG LEU A 161 -3.691 5.409 -4.418 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -2.195 3.964 -3.131 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -3.887 3.829 -2.598 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.166 2.548 -3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -1.663 4.489 -5.469 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.615 3.117 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.963 4.768 -6.652 1.00 0.00 H new ATOM 193 N PRO A 162 -7.807 2.514 -4.971 1.00 0.00 N ATOM 194 CA PRO A 162 -9.183 2.341 -5.455 1.00 0.00 C ATOM 195 C PRO A 162 -9.380 2.779 -6.906 1.00 0.00 C ATOM 196 O PRO A 162 -8.726 3.712 -7.381 1.00 0.00 O ATOM 197 CB PRO A 162 -9.979 3.242 -4.515 1.00 0.00 C ATOM 198 CG PRO A 162 -9.224 3.166 -3.244 1.00 0.00 C ATOM 199 CD PRO A 162 -7.783 3.172 -3.654 1.00 0.00 C ATOM 0 HA PRO A 162 -9.484 1.294 -5.451 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -10.034 4.264 -4.889 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -11.004 2.891 -4.395 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -9.454 4.012 -2.596 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -9.474 2.262 -2.689 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -7.386 4.185 -3.717 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -7.160 2.629 -2.944 1.00 0.00 H new ATOM 207 N ASN A 163 -10.289 2.088 -7.595 1.00 0.00 N ATOM 208 CA ASN A 163 -10.644 2.392 -8.984 1.00 0.00 C ATOM 209 C ASN A 163 -9.500 2.052 -9.932 1.00 0.00 C ATOM 210 O ASN A 163 -9.284 2.735 -10.935 1.00 0.00 O ATOM 211 CB ASN A 163 -11.060 3.861 -9.158 1.00 0.00 C ATOM 212 CG ASN A 163 -12.281 4.228 -8.336 1.00 0.00 C ATOM 213 OD1 ASN A 163 -13.416 4.010 -8.756 1.00 0.00 O ATOM 214 ND2 ASN A 163 -12.058 4.816 -7.171 1.00 0.00 N ATOM 0 H ASN A 163 -10.803 1.298 -7.205 1.00 0.00 H new ATOM 0 HA ASN A 163 -11.501 1.768 -9.236 1.00 0.00 H new ATOM 0 HB2 ASN A 163 -10.229 4.505 -8.873 1.00 0.00 H new ATOM 0 HB3 ASN A 163 -11.265 4.053 -10.211 1.00 0.00 H new ATOM 0 HD21 ASN A 163 -12.843 5.105 -6.587 1.00 0.00 H new ATOM 0 HD22 ASN A 163 -11.101 4.980 -6.857 1.00 0.00 H new ATOM 221 N LYS A 164 -8.773 0.988 -9.596 1.00 0.00 N ATOM 222 CA LYS A 164 -7.690 0.471 -10.432 1.00 0.00 C ATOM 223 C LYS A 164 -6.573 1.490 -10.605 1.00 0.00 C ATOM 224 O LYS A 164 -6.043 1.675 -11.701 1.00 0.00 O ATOM 225 CB LYS A 164 -8.221 0.022 -11.797 1.00 0.00 C ATOM 226 CG LYS A 164 -9.118 -1.208 -11.741 1.00 0.00 C ATOM 227 CD LYS A 164 -8.332 -2.512 -11.869 1.00 0.00 C ATOM 228 CE LYS A 164 -7.422 -2.774 -10.676 1.00 0.00 C ATOM 229 NZ LYS A 164 -8.173 -2.843 -9.390 1.00 0.00 N ATOM 0 H LYS A 164 -8.918 0.459 -8.736 1.00 0.00 H new ATOM 0 HA LYS A 164 -7.271 -0.395 -9.918 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -8.778 0.844 -12.247 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -7.376 -0.187 -12.453 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -9.668 -1.210 -10.800 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -9.856 -1.152 -12.541 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -9.030 -3.342 -11.977 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -7.731 -2.481 -12.778 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -6.886 -3.710 -10.831 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -6.673 -1.984 -10.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -7.543 -3.188 -8.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -8.523 -1.896 -9.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -8.978 -3.493 -9.493 1.00 0.00 H new ATOM 243 N GLN A 165 -6.217 2.143 -9.516 1.00 0.00 N ATOM 244 CA GLN A 165 -5.112 3.078 -9.518 1.00 0.00 C ATOM 245 C GLN A 165 -3.857 2.388 -9.005 1.00 0.00 C ATOM 246 O GLN A 165 -3.938 1.300 -8.450 1.00 0.00 O ATOM 247 CB GLN A 165 -5.468 4.300 -8.672 1.00 0.00 C ATOM 248 CG GLN A 165 -6.435 5.241 -9.374 1.00 0.00 C ATOM 249 CD GLN A 165 -5.870 5.778 -10.675 1.00 0.00 C ATOM 250 OE1 GLN A 165 -4.661 5.969 -10.808 1.00 0.00 O ATOM 251 NE2 GLN A 165 -6.733 6.009 -11.650 1.00 0.00 N ATOM 0 H GLN A 165 -6.681 2.041 -8.614 1.00 0.00 H new ATOM 0 HA GLN A 165 -4.917 3.420 -10.534 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -5.908 3.969 -7.731 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -4.556 4.843 -8.424 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -7.369 4.716 -9.575 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -6.674 6.074 -8.712 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -7.728 5.838 -11.502 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -6.404 6.358 -12.550 1.00 0.00 H new ATOM 260 N ARG A 166 -2.701 2.996 -9.214 1.00 0.00 N ATOM 261 CA ARG A 166 -1.450 2.406 -8.771 1.00 0.00 C ATOM 262 C ARG A 166 -0.464 3.478 -8.342 1.00 0.00 C ATOM 263 O ARG A 166 -0.437 4.573 -8.904 1.00 0.00 O ATOM 264 CB ARG A 166 -0.841 1.556 -9.873 1.00 0.00 C ATOM 265 CG ARG A 166 0.413 0.854 -9.452 1.00 0.00 C ATOM 266 CD ARG A 166 0.809 -0.169 -10.476 1.00 0.00 C ATOM 267 NE ARG A 166 1.464 0.438 -11.632 1.00 0.00 N ATOM 268 CZ ARG A 166 2.135 -0.241 -12.558 1.00 0.00 C ATOM 269 NH1 ARG A 166 2.282 -1.556 -12.454 1.00 0.00 N ATOM 270 NH2 ARG A 166 2.678 0.406 -13.580 1.00 0.00 N ATOM 0 H ARG A 166 -2.603 3.895 -9.686 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.667 1.771 -7.912 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -1.572 0.816 -10.198 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -0.624 2.189 -10.733 1.00 0.00 H new ATOM 0 HG2 ARG A 166 1.217 1.579 -9.323 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.261 0.371 -8.487 1.00 0.00 H new ATOM 0 HD2 ARG A 166 1.480 -0.897 -10.020 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -0.076 -0.714 -10.805 1.00 0.00 H new ATOM 0 HE ARG A 166 1.403 1.451 -11.736 1.00 0.00 H new ATOM 0 HH11 ARG A 166 1.879 -2.053 -11.660 1.00 0.00 H new ATOM 0 HH12 ARG A 166 2.798 -2.070 -13.168 1.00 0.00 H new ATOM 0 HH21 ARG A 166 2.580 1.419 -13.653 1.00 0.00 H new ATOM 0 HH22 ARG A 166 3.194 -0.109 -14.294 1.00 0.00 H new ATOM 284 N THR A 167 0.332 3.160 -7.340 1.00 0.00 N ATOM 285 CA THR A 167 1.364 4.062 -6.867 1.00 0.00 C ATOM 286 C THR A 167 2.562 3.259 -6.395 1.00 0.00 C ATOM 287 O THR A 167 2.413 2.122 -5.961 1.00 0.00 O ATOM 288 CB THR A 167 0.858 4.948 -5.703 1.00 0.00 C ATOM 289 OG1 THR A 167 1.826 5.953 -5.373 1.00 0.00 O ATOM 290 CG2 THR A 167 0.558 4.114 -4.463 1.00 0.00 C ATOM 0 H THR A 167 0.283 2.276 -6.834 1.00 0.00 H new ATOM 0 HA THR A 167 1.644 4.713 -7.695 1.00 0.00 H new ATOM 0 HB THR A 167 -0.063 5.427 -6.037 1.00 0.00 H new ATOM 0 HG1 THR A 167 1.564 6.399 -4.541 1.00 0.00 H new ATOM 0 HG21 THR A 167 0.205 4.765 -3.663 1.00 0.00 H new ATOM 0 HG22 THR A 167 -0.210 3.377 -4.697 1.00 0.00 H new ATOM 0 HG23 THR A 167 1.465 3.602 -4.140 1.00 0.00 H new ATOM 298 N VAL A 168 3.749 3.822 -6.502 1.00 0.00 N ATOM 299 CA VAL A 168 4.897 3.205 -5.879 1.00 0.00 C ATOM 300 C VAL A 168 5.510 4.175 -4.892 1.00 0.00 C ATOM 301 O VAL A 168 5.809 5.321 -5.228 1.00 0.00 O ATOM 302 CB VAL A 168 5.965 2.732 -6.894 1.00 0.00 C ATOM 303 CG1 VAL A 168 6.396 1.339 -6.554 1.00 0.00 C ATOM 304 CG2 VAL A 168 5.445 2.765 -8.318 1.00 0.00 C ATOM 0 H VAL A 168 3.940 4.689 -7.005 1.00 0.00 H new ATOM 0 HA VAL A 168 4.544 2.309 -5.368 1.00 0.00 H new ATOM 0 HB VAL A 168 6.811 3.416 -6.830 1.00 0.00 H new ATOM 0 HG11 VAL A 168 7.148 1.006 -7.269 1.00 0.00 H new ATOM 0 HG12 VAL A 168 6.819 1.324 -5.549 1.00 0.00 H new ATOM 0 HG13 VAL A 168 5.535 0.671 -6.596 1.00 0.00 H new ATOM 0 HG21 VAL A 168 6.226 2.426 -8.998 1.00 0.00 H new ATOM 0 HG22 VAL A 168 4.578 2.109 -8.404 1.00 0.00 H new ATOM 0 HG23 VAL A 168 5.156 3.784 -8.576 1.00 0.00 H new ATOM 314 N VAL A 169 5.686 3.706 -3.677 1.00 0.00 N ATOM 315 CA VAL A 169 6.192 4.529 -2.597 1.00 0.00 C ATOM 316 C VAL A 169 7.434 3.879 -2.008 1.00 0.00 C ATOM 317 O VAL A 169 7.455 2.669 -1.797 1.00 0.00 O ATOM 318 CB VAL A 169 5.106 4.722 -1.508 1.00 0.00 C ATOM 319 CG1 VAL A 169 4.578 3.382 -1.023 1.00 0.00 C ATOM 320 CG2 VAL A 169 5.629 5.548 -0.341 1.00 0.00 C ATOM 0 H VAL A 169 5.483 2.743 -3.408 1.00 0.00 H new ATOM 0 HA VAL A 169 6.455 5.513 -2.986 1.00 0.00 H new ATOM 0 HB VAL A 169 4.281 5.271 -1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 169 3.817 3.545 -0.259 1.00 0.00 H new ATOM 0 HG12 VAL A 169 4.141 2.839 -1.861 1.00 0.00 H new ATOM 0 HG13 VAL A 169 5.397 2.800 -0.601 1.00 0.00 H new ATOM 0 HG21 VAL A 169 4.842 5.664 0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 169 6.483 5.042 0.109 1.00 0.00 H new ATOM 0 HG23 VAL A 169 5.937 6.530 -0.700 1.00 0.00 H new ATOM 330 N PRO A 170 8.502 4.662 -1.784 1.00 0.00 N ATOM 331 CA PRO A 170 9.743 4.147 -1.215 1.00 0.00 C ATOM 332 C PRO A 170 9.500 3.364 0.064 1.00 0.00 C ATOM 333 O PRO A 170 8.829 3.843 0.982 1.00 0.00 O ATOM 334 CB PRO A 170 10.557 5.406 -0.932 1.00 0.00 C ATOM 335 CG PRO A 170 10.048 6.405 -1.906 1.00 0.00 C ATOM 336 CD PRO A 170 8.589 6.103 -2.077 1.00 0.00 C ATOM 0 HA PRO A 170 10.245 3.450 -1.886 1.00 0.00 H new ATOM 0 HB2 PRO A 170 10.418 5.746 0.094 1.00 0.00 H new ATOM 0 HB3 PRO A 170 11.624 5.228 -1.067 1.00 0.00 H new ATOM 0 HG2 PRO A 170 10.197 7.420 -1.538 1.00 0.00 H new ATOM 0 HG3 PRO A 170 10.577 6.329 -2.856 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.975 6.690 -1.394 1.00 0.00 H new ATOM 0 HD3 PRO A 170 8.248 6.329 -3.087 1.00 0.00 H new ATOM 344 N ALA A 171 10.040 2.155 0.104 1.00 0.00 N ATOM 345 CA ALA A 171 9.853 1.259 1.231 1.00 0.00 C ATOM 346 C ALA A 171 10.630 1.755 2.442 1.00 0.00 C ATOM 347 O ALA A 171 11.722 1.269 2.746 1.00 0.00 O ATOM 348 CB ALA A 171 10.271 -0.152 0.850 1.00 0.00 C ATOM 0 H ALA A 171 10.618 1.770 -0.643 1.00 0.00 H new ATOM 0 HA ALA A 171 8.796 1.242 1.498 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.127 -0.817 1.702 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.664 -0.498 0.013 1.00 0.00 H new ATOM 0 HB3 ALA A 171 11.322 -0.155 0.561 1.00 0.00 H new ATOM 354 N ARG A 172 10.056 2.740 3.110 1.00 0.00 N ATOM 355 CA ARG A 172 10.669 3.373 4.263 1.00 0.00 C ATOM 356 C ARG A 172 10.733 2.429 5.457 1.00 0.00 C ATOM 357 O ARG A 172 9.702 2.019 5.985 1.00 0.00 O ATOM 358 CB ARG A 172 9.873 4.608 4.658 1.00 0.00 C ATOM 359 CG ARG A 172 9.946 5.751 3.664 1.00 0.00 C ATOM 360 CD ARG A 172 9.434 7.030 4.299 1.00 0.00 C ATOM 361 NE ARG A 172 9.314 8.130 3.343 1.00 0.00 N ATOM 362 CZ ARG A 172 8.931 9.365 3.677 1.00 0.00 C ATOM 363 NH1 ARG A 172 8.681 9.669 4.945 1.00 0.00 N ATOM 364 NH2 ARG A 172 8.808 10.301 2.745 1.00 0.00 N ATOM 0 H ARG A 172 9.144 3.126 2.865 1.00 0.00 H new ATOM 0 HA ARG A 172 11.686 3.648 3.983 1.00 0.00 H new ATOM 0 HB2 ARG A 172 8.829 4.324 4.789 1.00 0.00 H new ATOM 0 HB3 ARG A 172 10.231 4.961 5.625 1.00 0.00 H new ATOM 0 HG2 ARG A 172 10.975 5.888 3.331 1.00 0.00 H new ATOM 0 HG3 ARG A 172 9.354 5.513 2.780 1.00 0.00 H new ATOM 0 HD2 ARG A 172 8.461 6.841 4.752 1.00 0.00 H new ATOM 0 HD3 ARG A 172 10.108 7.326 5.103 1.00 0.00 H new ATOM 0 HE ARG A 172 9.536 7.943 2.365 1.00 0.00 H new ATOM 0 HH11 ARG A 172 8.781 8.958 5.669 1.00 0.00 H new ATOM 0 HH12 ARG A 172 8.389 10.614 5.195 1.00 0.00 H new ATOM 0 HH21 ARG A 172 9.006 10.079 1.769 1.00 0.00 H new ATOM 0 HH22 ARG A 172 8.515 11.243 3.004 1.00 0.00 H new ATOM 378 N CYS A 173 11.942 2.091 5.876 1.00 0.00 N ATOM 379 CA CYS A 173 12.130 1.323 7.094 1.00 0.00 C ATOM 380 C CYS A 173 12.035 2.261 8.290 1.00 0.00 C ATOM 381 O CYS A 173 12.920 3.094 8.510 1.00 0.00 O ATOM 382 CB CYS A 173 13.484 0.609 7.073 1.00 0.00 C ATOM 383 SG CYS A 173 13.796 -0.445 8.509 1.00 0.00 S ATOM 0 H CYS A 173 12.805 2.336 5.391 1.00 0.00 H new ATOM 0 HA CYS A 173 11.353 0.562 7.169 1.00 0.00 H new ATOM 0 HB2 CYS A 173 13.546 0.001 6.171 1.00 0.00 H new ATOM 0 HB3 CYS A 173 14.274 1.357 7.008 1.00 0.00 H new ATOM 0 HG CYS A 173 14.964 -1.003 8.392 1.00 0.00 H new ATOM 389 N GLY A 174 10.961 2.127 9.050 1.00 0.00 N ATOM 390 CA GLY A 174 10.691 3.057 10.127 1.00 0.00 C ATOM 391 C GLY A 174 9.474 3.904 9.822 1.00 0.00 C ATOM 392 O GLY A 174 9.279 4.973 10.398 1.00 0.00 O ATOM 0 H GLY A 174 10.267 1.387 8.940 1.00 0.00 H new ATOM 0 HA2 GLY A 174 10.533 2.508 11.055 1.00 0.00 H new ATOM 0 HA3 GLY A 174 11.557 3.701 10.282 1.00 0.00 H new ATOM 396 N VAL A 175 8.663 3.419 8.897 1.00 0.00 N ATOM 397 CA VAL A 175 7.448 4.099 8.487 1.00 0.00 C ATOM 398 C VAL A 175 6.343 3.075 8.269 1.00 0.00 C ATOM 399 O VAL A 175 6.554 2.039 7.639 1.00 0.00 O ATOM 400 CB VAL A 175 7.683 4.938 7.199 1.00 0.00 C ATOM 401 CG1 VAL A 175 6.560 4.776 6.193 1.00 0.00 C ATOM 402 CG2 VAL A 175 7.813 6.408 7.532 1.00 0.00 C ATOM 0 H VAL A 175 8.830 2.540 8.408 1.00 0.00 H new ATOM 0 HA VAL A 175 7.148 4.788 9.276 1.00 0.00 H new ATOM 0 HB VAL A 175 8.607 4.565 6.757 1.00 0.00 H new ATOM 0 HG11 VAL A 175 6.771 5.382 5.312 1.00 0.00 H new ATOM 0 HG12 VAL A 175 6.480 3.728 5.903 1.00 0.00 H new ATOM 0 HG13 VAL A 175 5.621 5.101 6.640 1.00 0.00 H new ATOM 0 HG21 VAL A 175 7.977 6.975 6.616 1.00 0.00 H new ATOM 0 HG22 VAL A 175 6.899 6.754 8.015 1.00 0.00 H new ATOM 0 HG23 VAL A 175 8.657 6.555 8.206 1.00 0.00 H new ATOM 412 N THR A 176 5.179 3.353 8.819 1.00 0.00 N ATOM 413 CA THR A 176 4.032 2.489 8.637 1.00 0.00 C ATOM 414 C THR A 176 3.469 2.651 7.235 1.00 0.00 C ATOM 415 O THR A 176 3.636 3.708 6.617 1.00 0.00 O ATOM 416 CB THR A 176 2.946 2.810 9.678 1.00 0.00 C ATOM 417 OG1 THR A 176 2.733 4.229 9.745 1.00 0.00 O ATOM 418 CG2 THR A 176 3.345 2.282 11.046 1.00 0.00 C ATOM 0 H THR A 176 5.002 4.174 9.398 1.00 0.00 H new ATOM 0 HA THR A 176 4.354 1.456 8.773 1.00 0.00 H new ATOM 0 HB THR A 176 2.020 2.323 9.373 1.00 0.00 H new ATOM 0 HG1 THR A 176 2.039 4.425 10.409 1.00 0.00 H new ATOM 0 HG21 THR A 176 2.564 2.519 11.769 1.00 0.00 H new ATOM 0 HG22 THR A 176 3.477 1.201 10.995 1.00 0.00 H new ATOM 0 HG23 THR A 176 4.281 2.747 11.357 1.00 0.00 H new ATOM 426 N VAL A 177 2.814 1.608 6.722 1.00 0.00 N ATOM 427 CA VAL A 177 2.147 1.694 5.440 1.00 0.00 C ATOM 428 C VAL A 177 1.111 2.811 5.496 1.00 0.00 C ATOM 429 O VAL A 177 0.705 3.353 4.479 1.00 0.00 O ATOM 430 CB VAL A 177 1.478 0.361 5.020 1.00 0.00 C ATOM 431 CG1 VAL A 177 2.431 -0.800 5.198 1.00 0.00 C ATOM 432 CG2 VAL A 177 0.187 0.107 5.772 1.00 0.00 C ATOM 0 H VAL A 177 2.736 0.700 7.180 1.00 0.00 H new ATOM 0 HA VAL A 177 2.902 1.911 4.684 1.00 0.00 H new ATOM 0 HB VAL A 177 1.227 0.450 3.963 1.00 0.00 H new ATOM 0 HG11 VAL A 177 1.938 -1.725 4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 177 3.316 -0.642 4.581 1.00 0.00 H new ATOM 0 HG13 VAL A 177 2.727 -0.871 6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 177 -0.245 -0.838 5.444 1.00 0.00 H new ATOM 0 HG22 VAL A 177 0.392 0.060 6.842 1.00 0.00 H new ATOM 0 HG23 VAL A 177 -0.516 0.916 5.572 1.00 0.00 H new ATOM 442 N ARG A 178 0.698 3.148 6.714 1.00 0.00 N ATOM 443 CA ARG A 178 -0.187 4.269 6.944 1.00 0.00 C ATOM 444 C ARG A 178 0.429 5.546 6.437 1.00 0.00 C ATOM 445 O ARG A 178 -0.135 6.196 5.594 1.00 0.00 O ATOM 446 CB ARG A 178 -0.490 4.426 8.425 1.00 0.00 C ATOM 447 CG ARG A 178 -1.855 4.997 8.688 1.00 0.00 C ATOM 448 CD ARG A 178 -2.251 4.847 10.142 1.00 0.00 C ATOM 449 NE ARG A 178 -3.633 5.252 10.366 1.00 0.00 N ATOM 450 CZ ARG A 178 -4.195 5.348 11.565 1.00 0.00 C ATOM 451 NH1 ARG A 178 -3.491 5.074 12.660 1.00 0.00 N ATOM 452 NH2 ARG A 178 -5.464 5.717 11.669 1.00 0.00 N ATOM 0 H ARG A 178 0.970 2.650 7.562 1.00 0.00 H new ATOM 0 HA ARG A 178 -1.113 4.070 6.404 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -0.409 3.454 8.912 1.00 0.00 H new ATOM 0 HB3 ARG A 178 0.262 5.073 8.877 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -1.868 6.052 8.414 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -2.588 4.495 8.057 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -2.121 3.810 10.450 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -1.589 5.450 10.764 1.00 0.00 H new ATOM 0 HE ARG A 178 -4.204 5.476 9.551 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -2.515 4.789 12.581 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -3.927 5.149 13.579 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -6.005 5.926 10.830 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -5.900 5.792 12.588 1.00 0.00 H new ATOM 466 N ASP A 179 1.588 5.887 6.964 1.00 0.00 N ATOM 467 CA ASP A 179 2.269 7.139 6.609 1.00 0.00 C ATOM 468 C ASP A 179 2.678 7.153 5.142 1.00 0.00 C ATOM 469 O ASP A 179 2.417 8.116 4.414 1.00 0.00 O ATOM 470 CB ASP A 179 3.500 7.346 7.492 1.00 0.00 C ATOM 471 CG ASP A 179 4.204 8.655 7.196 1.00 0.00 C ATOM 472 OD1 ASP A 179 3.766 9.701 7.721 1.00 0.00 O ATOM 473 OD2 ASP A 179 5.194 8.646 6.437 1.00 0.00 O ATOM 0 H ASP A 179 2.089 5.317 7.645 1.00 0.00 H new ATOM 0 HA ASP A 179 1.566 7.955 6.775 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.201 7.325 8.540 1.00 0.00 H new ATOM 0 HB3 ASP A 179 4.195 6.520 7.343 1.00 0.00 H new ATOM 478 N SER A 180 3.305 6.074 4.724 1.00 0.00 N ATOM 479 CA SER A 180 3.790 5.921 3.366 1.00 0.00 C ATOM 480 C SER A 180 2.640 6.004 2.343 1.00 0.00 C ATOM 481 O SER A 180 2.636 6.862 1.446 1.00 0.00 O ATOM 482 CB SER A 180 4.524 4.581 3.310 1.00 0.00 C ATOM 483 OG SER A 180 3.754 3.570 3.921 1.00 0.00 O ATOM 0 H SER A 180 3.495 5.270 5.322 1.00 0.00 H new ATOM 0 HA SER A 180 4.468 6.731 3.099 1.00 0.00 H new ATOM 0 HB2 SER A 180 4.728 4.314 2.273 1.00 0.00 H new ATOM 0 HB3 SER A 180 5.488 4.666 3.812 1.00 0.00 H new ATOM 0 HG SER A 180 3.880 3.604 4.892 1.00 0.00 H new ATOM 489 N LEU A 181 1.647 5.139 2.500 1.00 0.00 N ATOM 490 CA LEU A 181 0.499 5.119 1.607 1.00 0.00 C ATOM 491 C LEU A 181 -0.431 6.297 1.884 1.00 0.00 C ATOM 492 O LEU A 181 -1.296 6.611 1.068 1.00 0.00 O ATOM 493 CB LEU A 181 -0.263 3.795 1.733 1.00 0.00 C ATOM 494 CG LEU A 181 0.410 2.581 1.077 1.00 0.00 C ATOM 495 CD1 LEU A 181 1.768 2.293 1.696 1.00 0.00 C ATOM 496 CD2 LEU A 181 -0.482 1.355 1.188 1.00 0.00 C ATOM 0 H LEU A 181 1.615 4.439 3.241 1.00 0.00 H new ATOM 0 HA LEU A 181 0.868 5.210 0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 181 -0.410 3.579 2.791 1.00 0.00 H new ATOM 0 HB3 LEU A 181 -1.252 3.922 1.293 1.00 0.00 H new ATOM 0 HG LEU A 181 0.563 2.819 0.024 1.00 0.00 H new ATOM 0 HD11 LEU A 181 2.215 1.427 1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 181 2.418 3.158 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 181 1.647 2.086 2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 181 0.010 0.503 0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 181 -0.666 1.133 2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 181 -1.430 1.548 0.686 1.00 0.00 H new ATOM 508 N LYS A 182 -0.250 6.951 3.030 1.00 0.00 N ATOM 509 CA LYS A 182 -1.013 8.161 3.337 1.00 0.00 C ATOM 510 C LYS A 182 -0.723 9.184 2.282 1.00 0.00 C ATOM 511 O LYS A 182 -1.626 9.775 1.733 1.00 0.00 O ATOM 512 CB LYS A 182 -0.677 8.765 4.706 1.00 0.00 C ATOM 513 CG LYS A 182 -1.867 8.828 5.653 1.00 0.00 C ATOM 514 CD LYS A 182 -1.517 9.499 6.970 1.00 0.00 C ATOM 515 CE LYS A 182 -0.841 8.531 7.926 1.00 0.00 C ATOM 516 NZ LYS A 182 -0.414 9.195 9.187 1.00 0.00 N ATOM 0 H LYS A 182 0.410 6.668 3.754 1.00 0.00 H new ATOM 0 HA LYS A 182 -2.066 7.880 3.361 1.00 0.00 H new ATOM 0 HB2 LYS A 182 0.115 8.176 5.169 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -0.283 9.771 4.563 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -2.681 9.372 5.175 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -2.229 7.818 5.847 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -0.858 10.347 6.784 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -2.423 9.894 7.430 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -1.526 7.716 8.160 1.00 0.00 H new ATOM 0 HE3 LYS A 182 0.027 8.088 7.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 0.042 8.498 9.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 0.260 9.956 8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -1.245 9.596 9.667 1.00 0.00 H new ATOM 530 N LYS A 183 0.551 9.372 1.998 1.00 0.00 N ATOM 531 CA LYS A 183 0.963 10.260 0.933 1.00 0.00 C ATOM 532 C LYS A 183 0.393 9.788 -0.392 1.00 0.00 C ATOM 533 O LYS A 183 -0.200 10.564 -1.127 1.00 0.00 O ATOM 534 CB LYS A 183 2.467 10.323 0.862 1.00 0.00 C ATOM 535 CG LYS A 183 2.961 11.403 -0.049 1.00 0.00 C ATOM 536 CD LYS A 183 2.479 12.767 0.408 1.00 0.00 C ATOM 537 CE LYS A 183 2.720 13.003 1.891 1.00 0.00 C ATOM 538 NZ LYS A 183 2.553 14.432 2.262 1.00 0.00 N ATOM 0 H LYS A 183 1.320 8.919 2.493 1.00 0.00 H new ATOM 0 HA LYS A 183 0.581 11.259 1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 183 2.867 10.487 1.863 1.00 0.00 H new ATOM 0 HB3 LYS A 183 2.850 9.362 0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 183 4.051 11.389 -0.076 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.614 11.213 -1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 183 2.988 13.540 -0.167 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.414 12.862 0.197 1.00 0.00 H new ATOM 0 HE2 LYS A 183 2.027 12.394 2.472 1.00 0.00 H new ATOM 0 HE3 LYS A 183 3.727 12.676 2.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 2.726 14.549 3.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 3.231 15.011 1.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 1.585 14.738 2.038 1.00 0.00 H new ATOM 552 N ALA A 184 0.572 8.508 -0.675 1.00 0.00 N ATOM 553 CA ALA A 184 0.024 7.894 -1.888 1.00 0.00 C ATOM 554 C ALA A 184 -1.453 8.261 -2.121 1.00 0.00 C ATOM 555 O ALA A 184 -1.817 8.743 -3.196 1.00 0.00 O ATOM 556 CB ALA A 184 0.181 6.385 -1.815 1.00 0.00 C ATOM 0 H ALA A 184 1.095 7.865 -0.081 1.00 0.00 H new ATOM 0 HA ALA A 184 0.587 8.287 -2.734 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -0.228 5.933 -2.719 1.00 0.00 H new ATOM 0 HB2 ALA A 184 1.238 6.133 -1.729 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -0.355 6.005 -0.945 1.00 0.00 H new ATOM 562 N LEU A 185 -2.290 8.033 -1.116 1.00 0.00 N ATOM 563 CA LEU A 185 -3.721 8.321 -1.203 1.00 0.00 C ATOM 564 C LEU A 185 -3.995 9.816 -1.125 1.00 0.00 C ATOM 565 O LEU A 185 -4.798 10.346 -1.884 1.00 0.00 O ATOM 566 CB LEU A 185 -4.471 7.615 -0.072 1.00 0.00 C ATOM 567 CG LEU A 185 -4.585 6.098 -0.206 1.00 0.00 C ATOM 568 CD1 LEU A 185 -4.205 5.402 1.088 1.00 0.00 C ATOM 569 CD2 LEU A 185 -5.993 5.728 -0.590 1.00 0.00 C ATOM 0 H LEU A 185 -1.999 7.644 -0.219 1.00 0.00 H new ATOM 0 HA LEU A 185 -4.071 7.953 -2.168 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -3.971 7.843 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -5.476 8.033 -0.009 1.00 0.00 H new ATOM 0 HG LEU A 185 -3.894 5.771 -0.983 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -4.296 4.323 0.961 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -3.176 5.651 1.347 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -4.870 5.731 1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -6.072 4.645 -0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -6.683 6.076 0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -6.245 6.195 -1.542 1.00 0.00 H new ATOM 581 N MET A 186 -3.317 10.489 -0.210 1.00 0.00 N ATOM 582 CA MET A 186 -3.551 11.892 0.055 1.00 0.00 C ATOM 583 C MET A 186 -3.169 12.750 -1.152 1.00 0.00 C ATOM 584 O MET A 186 -3.830 13.742 -1.449 1.00 0.00 O ATOM 585 CB MET A 186 -2.790 12.309 1.328 1.00 0.00 C ATOM 586 CG MET A 186 -2.555 13.790 1.432 1.00 0.00 C ATOM 587 SD MET A 186 -4.084 14.741 1.575 1.00 0.00 S ATOM 588 CE MET A 186 -4.818 14.016 3.043 1.00 0.00 C ATOM 0 H MET A 186 -2.588 10.073 0.369 1.00 0.00 H new ATOM 0 HA MET A 186 -4.615 12.054 0.227 1.00 0.00 H new ATOM 0 HB2 MET A 186 -3.351 11.977 2.202 1.00 0.00 H new ATOM 0 HB3 MET A 186 -1.829 11.795 1.351 1.00 0.00 H new ATOM 0 HG2 MET A 186 -1.926 13.992 2.299 1.00 0.00 H new ATOM 0 HG3 MET A 186 -2.005 14.127 0.553 1.00 0.00 H new ATOM 0 HE1 MET A 186 -5.580 14.688 3.438 1.00 0.00 H new ATOM 0 HE2 MET A 186 -5.274 13.060 2.787 1.00 0.00 H new ATOM 0 HE3 MET A 186 -4.046 13.860 3.796 1.00 0.00 H new ATOM 598 N MET A 187 -2.139 12.336 -1.882 1.00 0.00 N ATOM 599 CA MET A 187 -1.747 13.035 -3.108 1.00 0.00 C ATOM 600 C MET A 187 -2.744 12.733 -4.221 1.00 0.00 C ATOM 601 O MET A 187 -2.714 13.344 -5.290 1.00 0.00 O ATOM 602 CB MET A 187 -0.343 12.623 -3.570 1.00 0.00 C ATOM 603 CG MET A 187 0.771 12.967 -2.594 1.00 0.00 C ATOM 604 SD MET A 187 2.414 12.772 -3.318 1.00 0.00 S ATOM 605 CE MET A 187 2.396 11.033 -3.754 1.00 0.00 C ATOM 0 H MET A 187 -1.562 11.527 -1.652 1.00 0.00 H new ATOM 0 HA MET A 187 -1.740 14.103 -2.888 1.00 0.00 H new ATOM 0 HB2 MET A 187 -0.334 11.547 -3.747 1.00 0.00 H new ATOM 0 HB3 MET A 187 -0.133 13.105 -4.525 1.00 0.00 H new ATOM 0 HG2 MET A 187 0.647 13.996 -2.255 1.00 0.00 H new ATOM 0 HG3 MET A 187 0.688 12.329 -1.714 1.00 0.00 H new ATOM 0 HE1 MET A 187 3.400 10.621 -3.649 1.00 0.00 H new ATOM 0 HE2 MET A 187 1.714 10.499 -3.092 1.00 0.00 H new ATOM 0 HE3 MET A 187 2.063 10.920 -4.786 1.00 0.00 H new ATOM 615 N ARG A 188 -3.621 11.778 -3.957 1.00 0.00 N ATOM 616 CA ARG A 188 -4.612 11.344 -4.922 1.00 0.00 C ATOM 617 C ARG A 188 -6.015 11.778 -4.505 1.00 0.00 C ATOM 618 O ARG A 188 -6.992 11.492 -5.193 1.00 0.00 O ATOM 619 CB ARG A 188 -4.526 9.823 -5.088 1.00 0.00 C ATOM 620 CG ARG A 188 -3.390 9.412 -6.005 1.00 0.00 C ATOM 621 CD ARG A 188 -3.214 7.906 -6.078 1.00 0.00 C ATOM 622 NE ARG A 188 -2.167 7.545 -7.034 1.00 0.00 N ATOM 623 CZ ARG A 188 -0.858 7.620 -6.778 1.00 0.00 C ATOM 624 NH1 ARG A 188 -0.425 8.014 -5.586 1.00 0.00 N ATOM 625 NH2 ARG A 188 0.022 7.300 -7.719 1.00 0.00 N ATOM 0 H ARG A 188 -3.664 11.283 -3.066 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.405 11.817 -5.882 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -4.388 9.359 -4.111 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -5.468 9.449 -5.489 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -3.577 9.801 -7.006 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -2.463 9.866 -5.655 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -2.960 7.518 -5.092 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -4.155 7.440 -6.371 1.00 0.00 H new ATOM 0 HE ARG A 188 -2.455 7.215 -7.955 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -1.094 8.262 -4.857 1.00 0.00 H new ATOM 0 HH12 ARG A 188 0.576 8.068 -5.399 1.00 0.00 H new ATOM 0 HH21 ARG A 188 -0.301 6.997 -8.638 1.00 0.00 H new ATOM 0 HH22 ARG A 188 1.021 7.357 -7.523 1.00 0.00 H new ATOM 639 N GLY A 189 -6.104 12.483 -3.383 1.00 0.00 N ATOM 640 CA GLY A 189 -7.390 12.956 -2.901 1.00 0.00 C ATOM 641 C GLY A 189 -8.186 11.867 -2.209 1.00 0.00 C ATOM 642 O GLY A 189 -9.410 11.948 -2.103 1.00 0.00 O ATOM 0 H GLY A 189 -5.308 12.736 -2.797 1.00 0.00 H new ATOM 0 HA2 GLY A 189 -7.233 13.783 -2.208 1.00 0.00 H new ATOM 0 HA3 GLY A 189 -7.967 13.347 -3.739 1.00 0.00 H new ATOM 646 N LEU A 190 -7.491 10.843 -1.745 1.00 0.00 N ATOM 647 CA LEU A 190 -8.121 9.732 -1.053 1.00 0.00 C ATOM 648 C LEU A 190 -7.672 9.705 0.396 1.00 0.00 C ATOM 649 O LEU A 190 -6.788 10.468 0.794 1.00 0.00 O ATOM 650 CB LEU A 190 -7.768 8.403 -1.729 1.00 0.00 C ATOM 651 CG LEU A 190 -8.615 8.022 -2.949 1.00 0.00 C ATOM 652 CD1 LEU A 190 -8.435 9.009 -4.084 1.00 0.00 C ATOM 653 CD2 LEU A 190 -8.264 6.628 -3.413 1.00 0.00 C ATOM 0 H LEU A 190 -6.479 10.758 -1.837 1.00 0.00 H new ATOM 0 HA LEU A 190 -9.202 9.867 -1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -6.723 8.441 -2.035 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -7.855 7.608 -0.989 1.00 0.00 H new ATOM 0 HG LEU A 190 -9.662 8.048 -2.647 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -9.051 8.706 -4.931 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -8.737 10.003 -3.753 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -7.388 9.029 -4.386 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -8.872 6.369 -4.280 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -7.209 6.590 -3.685 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -8.457 5.918 -2.609 1.00 0.00 H new ATOM 665 N ILE A 191 -8.285 8.837 1.183 1.00 0.00 N ATOM 666 CA ILE A 191 -7.918 8.686 2.581 1.00 0.00 C ATOM 667 C ILE A 191 -7.755 7.216 2.962 1.00 0.00 C ATOM 668 O ILE A 191 -8.603 6.377 2.649 1.00 0.00 O ATOM 669 CB ILE A 191 -8.943 9.345 3.531 1.00 0.00 C ATOM 670 CG1 ILE A 191 -10.352 8.798 3.275 1.00 0.00 C ATOM 671 CG2 ILE A 191 -8.914 10.857 3.368 1.00 0.00 C ATOM 672 CD1 ILE A 191 -11.359 9.184 4.336 1.00 0.00 C ATOM 0 H ILE A 191 -9.041 8.225 0.877 1.00 0.00 H new ATOM 0 HA ILE A 191 -6.962 9.197 2.696 1.00 0.00 H new ATOM 0 HB ILE A 191 -8.670 9.102 4.558 1.00 0.00 H new ATOM 0 HG12 ILE A 191 -10.701 9.159 2.307 1.00 0.00 H new ATOM 0 HG13 ILE A 191 -10.304 7.711 3.212 1.00 0.00 H new ATOM 0 HG21 ILE A 191 -9.641 11.310 4.043 1.00 0.00 H new ATOM 0 HG22 ILE A 191 -7.917 11.229 3.605 1.00 0.00 H new ATOM 0 HG23 ILE A 191 -9.163 11.117 2.339 1.00 0.00 H new ATOM 0 HD11 ILE A 191 -12.332 8.760 4.086 1.00 0.00 H new ATOM 0 HD12 ILE A 191 -11.034 8.800 5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 191 -11.438 10.270 4.385 1.00 0.00 H new ATOM 684 N PRO A 192 -6.646 6.895 3.651 1.00 0.00 N ATOM 685 CA PRO A 192 -6.328 5.525 4.078 1.00 0.00 C ATOM 686 C PRO A 192 -7.312 4.974 5.107 1.00 0.00 C ATOM 687 O PRO A 192 -7.423 3.762 5.286 1.00 0.00 O ATOM 688 CB PRO A 192 -4.939 5.651 4.717 1.00 0.00 C ATOM 689 CG PRO A 192 -4.404 6.954 4.240 1.00 0.00 C ATOM 690 CD PRO A 192 -5.593 7.842 4.052 1.00 0.00 C ATOM 0 HA PRO A 192 -6.375 4.836 3.235 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -5.003 5.627 5.805 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -4.292 4.827 4.417 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -3.709 7.380 4.964 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -3.856 6.833 3.306 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -5.852 8.371 4.969 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -5.416 8.598 3.287 1.00 0.00 H new ATOM 698 N GLU A 193 -8.017 5.869 5.793 1.00 0.00 N ATOM 699 CA GLU A 193 -8.950 5.471 6.843 1.00 0.00 C ATOM 700 C GLU A 193 -10.090 4.620 6.294 1.00 0.00 C ATOM 701 O GLU A 193 -10.581 3.719 6.970 1.00 0.00 O ATOM 702 CB GLU A 193 -9.513 6.698 7.553 1.00 0.00 C ATOM 703 CG GLU A 193 -8.493 7.410 8.418 1.00 0.00 C ATOM 704 CD GLU A 193 -7.882 6.498 9.462 1.00 0.00 C ATOM 705 OE1 GLU A 193 -6.735 6.049 9.269 1.00 0.00 O ATOM 706 OE2 GLU A 193 -8.546 6.223 10.483 1.00 0.00 O ATOM 0 H GLU A 193 -7.960 6.876 5.641 1.00 0.00 H new ATOM 0 HA GLU A 193 -8.393 4.866 7.559 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -9.898 7.395 6.809 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -10.357 6.395 8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -7.703 7.814 7.785 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -8.969 8.257 8.913 1.00 0.00 H new ATOM 713 N CYS A 194 -10.500 4.895 5.067 1.00 0.00 N ATOM 714 CA CYS A 194 -11.592 4.157 4.456 1.00 0.00 C ATOM 715 C CYS A 194 -11.039 3.139 3.463 1.00 0.00 C ATOM 716 O CYS A 194 -11.668 2.822 2.452 1.00 0.00 O ATOM 717 CB CYS A 194 -12.559 5.125 3.765 1.00 0.00 C ATOM 718 SG CYS A 194 -14.090 4.359 3.180 1.00 0.00 S ATOM 0 H CYS A 194 -10.095 5.621 4.476 1.00 0.00 H new ATOM 0 HA CYS A 194 -12.141 3.620 5.230 1.00 0.00 H new ATOM 0 HB2 CYS A 194 -12.810 5.927 4.460 1.00 0.00 H new ATOM 0 HB3 CYS A 194 -12.050 5.585 2.918 1.00 0.00 H new ATOM 0 HG CYS A 194 -13.810 3.262 2.541 1.00 0.00 H new ATOM 724 N CYS A 195 -9.855 2.626 3.757 1.00 0.00 N ATOM 725 CA CYS A 195 -9.192 1.683 2.874 1.00 0.00 C ATOM 726 C CYS A 195 -8.447 0.619 3.672 1.00 0.00 C ATOM 727 O CYS A 195 -8.301 0.739 4.888 1.00 0.00 O ATOM 728 CB CYS A 195 -8.230 2.425 1.945 1.00 0.00 C ATOM 729 SG CYS A 195 -9.044 3.609 0.846 1.00 0.00 S ATOM 0 H CYS A 195 -9.332 2.849 4.604 1.00 0.00 H new ATOM 0 HA CYS A 195 -9.951 1.182 2.273 1.00 0.00 H new ATOM 0 HB2 CYS A 195 -7.491 2.952 2.548 1.00 0.00 H new ATOM 0 HB3 CYS A 195 -7.688 1.697 1.342 1.00 0.00 H new ATOM 0 HG CYS A 195 -9.009 4.793 1.381 1.00 0.00 H new ATOM 735 N ALA A 196 -8.019 -0.435 2.987 1.00 0.00 N ATOM 736 CA ALA A 196 -7.212 -1.486 3.597 1.00 0.00 C ATOM 737 C ALA A 196 -6.093 -1.903 2.656 1.00 0.00 C ATOM 738 O ALA A 196 -6.207 -1.732 1.443 1.00 0.00 O ATOM 739 CB ALA A 196 -8.075 -2.687 3.944 1.00 0.00 C ATOM 0 H ALA A 196 -8.220 -0.585 1.998 1.00 0.00 H new ATOM 0 HA ALA A 196 -6.774 -1.095 4.515 1.00 0.00 H new ATOM 0 HB1 ALA A 196 -7.456 -3.461 4.398 1.00 0.00 H new ATOM 0 HB2 ALA A 196 -8.852 -2.386 4.646 1.00 0.00 H new ATOM 0 HB3 ALA A 196 -8.537 -3.077 3.037 1.00 0.00 H new ATOM 745 N VAL A 197 -5.021 -2.447 3.215 1.00 0.00 N ATOM 746 CA VAL A 197 -3.867 -2.858 2.424 1.00 0.00 C ATOM 747 C VAL A 197 -3.798 -4.380 2.341 1.00 0.00 C ATOM 748 O VAL A 197 -4.036 -5.068 3.325 1.00 0.00 O ATOM 749 CB VAL A 197 -2.549 -2.313 3.031 1.00 0.00 C ATOM 750 CG1 VAL A 197 -1.389 -2.466 2.061 1.00 0.00 C ATOM 751 CG2 VAL A 197 -2.713 -0.862 3.442 1.00 0.00 C ATOM 0 H VAL A 197 -4.925 -2.615 4.217 1.00 0.00 H new ATOM 0 HA VAL A 197 -3.986 -2.444 1.423 1.00 0.00 H new ATOM 0 HB VAL A 197 -2.321 -2.903 3.919 1.00 0.00 H new ATOM 0 HG11 VAL A 197 -0.480 -2.074 2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 197 -1.250 -3.521 1.823 1.00 0.00 H new ATOM 0 HG13 VAL A 197 -1.604 -1.913 1.147 1.00 0.00 H new ATOM 0 HG21 VAL A 197 -1.778 -0.496 3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 197 -2.974 -0.264 2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 197 -3.505 -0.782 4.187 1.00 0.00 H new ATOM 761 N TYR A 198 -3.516 -4.903 1.158 1.00 0.00 N ATOM 762 CA TYR A 198 -3.335 -6.341 0.975 1.00 0.00 C ATOM 763 C TYR A 198 -2.058 -6.617 0.205 1.00 0.00 C ATOM 764 O TYR A 198 -1.619 -5.792 -0.591 1.00 0.00 O ATOM 765 CB TYR A 198 -4.487 -6.970 0.182 1.00 0.00 C ATOM 766 CG TYR A 198 -5.855 -6.829 0.796 1.00 0.00 C ATOM 767 CD1 TYR A 198 -6.449 -7.909 1.421 1.00 0.00 C ATOM 768 CD2 TYR A 198 -6.560 -5.635 0.728 1.00 0.00 C ATOM 769 CE1 TYR A 198 -7.708 -7.813 1.969 1.00 0.00 C ATOM 770 CE2 TYR A 198 -7.820 -5.524 1.277 1.00 0.00 C ATOM 771 CZ TYR A 198 -8.393 -6.615 1.895 1.00 0.00 C ATOM 772 OH TYR A 198 -9.651 -6.508 2.435 1.00 0.00 O ATOM 0 H TYR A 198 -3.407 -4.354 0.305 1.00 0.00 H new ATOM 0 HA TYR A 198 -3.298 -6.776 1.974 1.00 0.00 H new ATOM 0 HB2 TYR A 198 -4.507 -6.522 -0.812 1.00 0.00 H new ATOM 0 HB3 TYR A 198 -4.276 -8.031 0.049 1.00 0.00 H new ATOM 0 HD1 TYR A 198 -5.915 -8.846 1.481 1.00 0.00 H new ATOM 0 HD2 TYR A 198 -6.115 -4.781 0.238 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -8.157 -8.668 2.453 1.00 0.00 H new ATOM 0 HE2 TYR A 198 -8.355 -4.587 1.223 1.00 0.00 H new ATOM 0 HH TYR A 198 -9.990 -5.599 2.297 1.00 0.00 H new ATOM 782 N ARG A 199 -1.471 -7.773 0.443 1.00 0.00 N ATOM 783 CA ARG A 199 -0.409 -8.276 -0.410 1.00 0.00 C ATOM 784 C ARG A 199 -0.839 -9.618 -0.985 1.00 0.00 C ATOM 785 O ARG A 199 -1.074 -10.576 -0.248 1.00 0.00 O ATOM 786 CB ARG A 199 0.920 -8.386 0.353 1.00 0.00 C ATOM 787 CG ARG A 199 0.834 -9.162 1.649 1.00 0.00 C ATOM 788 CD ARG A 199 2.083 -8.977 2.491 1.00 0.00 C ATOM 789 NE ARG A 199 3.270 -9.583 1.889 1.00 0.00 N ATOM 790 CZ ARG A 199 4.036 -10.484 2.502 1.00 0.00 C ATOM 791 NH1 ARG A 199 3.708 -10.936 3.707 1.00 0.00 N ATOM 792 NH2 ARG A 199 5.128 -10.935 1.903 1.00 0.00 N ATOM 0 H ARG A 199 -1.712 -8.385 1.223 1.00 0.00 H new ATOM 0 HA ARG A 199 -0.237 -7.575 -1.226 1.00 0.00 H new ATOM 0 HB2 ARG A 199 1.658 -8.862 -0.293 1.00 0.00 H new ATOM 0 HB3 ARG A 199 1.286 -7.382 0.568 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -0.039 -8.834 2.214 1.00 0.00 H new ATOM 0 HG3 ARG A 199 0.694 -10.221 1.432 1.00 0.00 H new ATOM 0 HD2 ARG A 199 2.261 -7.912 2.639 1.00 0.00 H new ATOM 0 HD3 ARG A 199 1.919 -9.413 3.476 1.00 0.00 H new ATOM 0 HE ARG A 199 3.527 -9.299 0.944 1.00 0.00 H new ATOM 0 HH11 ARG A 199 2.865 -10.593 4.168 1.00 0.00 H new ATOM 0 HH12 ARG A 199 4.299 -11.626 4.171 1.00 0.00 H new ATOM 0 HH21 ARG A 199 5.380 -10.592 0.976 1.00 0.00 H new ATOM 0 HH22 ARG A 199 5.717 -11.625 2.369 1.00 0.00 H new ATOM 876 N LYS A 205 -5.051 -13.250 -0.769 1.00 0.00 N ATOM 877 CA LYS A 205 -4.946 -11.897 -0.256 1.00 0.00 C ATOM 878 C LYS A 205 -4.482 -11.917 1.188 1.00 0.00 C ATOM 879 O LYS A 205 -5.059 -12.619 2.021 1.00 0.00 O ATOM 880 CB LYS A 205 -6.297 -11.179 -0.327 1.00 0.00 C ATOM 881 CG LYS A 205 -7.063 -11.412 -1.607 1.00 0.00 C ATOM 882 CD LYS A 205 -8.369 -10.645 -1.623 1.00 0.00 C ATOM 883 CE LYS A 205 -8.154 -9.143 -1.714 1.00 0.00 C ATOM 884 NZ LYS A 205 -9.445 -8.407 -1.748 1.00 0.00 N ATOM 0 HA LYS A 205 -4.222 -11.364 -0.872 1.00 0.00 H new ATOM 0 HB2 LYS A 205 -6.911 -11.503 0.513 1.00 0.00 H new ATOM 0 HB3 LYS A 205 -6.132 -10.108 -0.207 1.00 0.00 H new ATOM 0 HG2 LYS A 205 -6.452 -11.109 -2.457 1.00 0.00 H new ATOM 0 HG3 LYS A 205 -7.264 -12.477 -1.722 1.00 0.00 H new ATOM 0 HD2 LYS A 205 -8.972 -10.976 -2.469 1.00 0.00 H new ATOM 0 HD3 LYS A 205 -8.934 -10.875 -0.720 1.00 0.00 H new ATOM 0 HE2 LYS A 205 -7.565 -8.807 -0.861 1.00 0.00 H new ATOM 0 HE3 LYS A 205 -7.578 -8.911 -2.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 205 -9.335 -7.491 -1.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 205 -9.729 -8.249 -2.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 205 -10.176 -8.966 -1.263 1.00 0.00 H new ATOM 898 N LYS A 206 -3.443 -11.160 1.487 1.00 0.00 N ATOM 899 CA LYS A 206 -2.981 -11.018 2.848 1.00 0.00 C ATOM 900 C LYS A 206 -3.243 -9.597 3.324 1.00 0.00 C ATOM 901 O LYS A 206 -2.484 -8.685 2.993 1.00 0.00 O ATOM 902 CB LYS A 206 -1.490 -11.323 2.934 1.00 0.00 C ATOM 903 CG LYS A 206 -1.095 -12.679 2.373 1.00 0.00 C ATOM 904 CD LYS A 206 -1.766 -13.818 3.117 1.00 0.00 C ATOM 905 CE LYS A 206 -1.397 -15.155 2.505 1.00 0.00 C ATOM 906 NZ LYS A 206 -2.082 -16.288 3.174 1.00 0.00 N ATOM 0 H LYS A 206 -2.903 -10.633 0.800 1.00 0.00 H new ATOM 0 HA LYS A 206 -3.519 -11.722 3.483 1.00 0.00 H new ATOM 0 HB2 LYS A 206 -0.941 -10.548 2.399 1.00 0.00 H new ATOM 0 HB3 LYS A 206 -1.180 -11.270 3.978 1.00 0.00 H new ATOM 0 HG2 LYS A 206 -1.363 -12.727 1.318 1.00 0.00 H new ATOM 0 HG3 LYS A 206 -0.013 -12.795 2.432 1.00 0.00 H new ATOM 0 HD2 LYS A 206 -1.468 -13.799 4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 206 -2.848 -13.688 3.091 1.00 0.00 H new ATOM 0 HE2 LYS A 206 -1.655 -15.151 1.446 1.00 0.00 H new ATOM 0 HE3 LYS A 206 -0.318 -15.296 2.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 206 -1.799 -17.181 2.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 206 -1.816 -16.310 4.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 206 -3.112 -16.169 3.091 1.00 0.00 H new ATOM 920 N PRO A 207 -4.340 -9.378 4.061 1.00 0.00 N ATOM 921 CA PRO A 207 -4.670 -8.058 4.572 1.00 0.00 C ATOM 922 C PRO A 207 -3.658 -7.575 5.595 1.00 0.00 C ATOM 923 O PRO A 207 -3.442 -8.194 6.640 1.00 0.00 O ATOM 924 CB PRO A 207 -6.053 -8.205 5.196 1.00 0.00 C ATOM 925 CG PRO A 207 -6.310 -9.668 5.319 1.00 0.00 C ATOM 926 CD PRO A 207 -5.333 -10.393 4.432 1.00 0.00 C ATOM 0 HA PRO A 207 -4.655 -7.312 3.777 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -6.091 -7.721 6.172 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -6.811 -7.729 4.574 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -6.194 -9.989 6.354 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -7.334 -9.900 5.026 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -4.868 -11.229 4.955 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -5.827 -10.804 3.551 1.00 0.00 H new ATOM 934 N ILE A 208 -3.038 -6.473 5.254 1.00 0.00 N ATOM 935 CA ILE A 208 -1.995 -5.864 6.043 1.00 0.00 C ATOM 936 C ILE A 208 -2.564 -4.756 6.921 1.00 0.00 C ATOM 937 O ILE A 208 -3.589 -4.155 6.597 1.00 0.00 O ATOM 938 CB ILE A 208 -0.936 -5.276 5.095 1.00 0.00 C ATOM 939 CG1 ILE A 208 -0.362 -6.378 4.216 1.00 0.00 C ATOM 940 CG2 ILE A 208 0.176 -4.591 5.862 1.00 0.00 C ATOM 941 CD1 ILE A 208 0.241 -5.873 2.930 1.00 0.00 C ATOM 0 H ILE A 208 -3.250 -5.961 4.398 1.00 0.00 H new ATOM 0 HA ILE A 208 -1.547 -6.619 6.688 1.00 0.00 H new ATOM 0 HB ILE A 208 -1.421 -4.526 4.470 1.00 0.00 H new ATOM 0 HG12 ILE A 208 0.400 -6.919 4.777 1.00 0.00 H new ATOM 0 HG13 ILE A 208 -1.151 -7.092 3.981 1.00 0.00 H new ATOM 0 HG21 ILE A 208 0.906 -4.187 5.161 1.00 0.00 H new ATOM 0 HG22 ILE A 208 -0.240 -3.780 6.460 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.663 -5.312 6.518 1.00 0.00 H new ATOM 0 HD11 ILE A 208 0.630 -6.714 2.356 1.00 0.00 H new ATOM 0 HD12 ILE A 208 -0.523 -5.358 2.348 1.00 0.00 H new ATOM 0 HD13 ILE A 208 1.053 -5.182 3.156 1.00 0.00 H new ATOM 953 N GLY A 209 -1.886 -4.491 8.024 1.00 0.00 N ATOM 954 CA GLY A 209 -2.294 -3.435 8.915 1.00 0.00 C ATOM 955 C GLY A 209 -1.705 -2.111 8.498 1.00 0.00 C ATOM 956 O GLY A 209 -0.584 -2.064 7.999 1.00 0.00 O ATOM 0 H GLY A 209 -1.051 -4.997 8.319 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -3.382 -3.365 8.926 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -1.980 -3.672 9.932 1.00 0.00 H new ATOM 960 N TRP A 210 -2.441 -1.030 8.698 1.00 0.00 N ATOM 961 CA TRP A 210 -1.937 0.288 8.347 1.00 0.00 C ATOM 962 C TRP A 210 -0.795 0.688 9.276 1.00 0.00 C ATOM 963 O TRP A 210 0.075 1.475 8.907 1.00 0.00 O ATOM 964 CB TRP A 210 -3.052 1.332 8.375 1.00 0.00 C ATOM 965 CG TRP A 210 -4.026 1.196 7.245 1.00 0.00 C ATOM 966 CD1 TRP A 210 -5.238 0.577 7.279 1.00 0.00 C ATOM 967 CD2 TRP A 210 -3.868 1.696 5.913 1.00 0.00 C ATOM 968 NE1 TRP A 210 -5.844 0.667 6.053 1.00 0.00 N ATOM 969 CE2 TRP A 210 -5.024 1.350 5.195 1.00 0.00 C ATOM 970 CE3 TRP A 210 -2.861 2.405 5.263 1.00 0.00 C ATOM 971 CZ2 TRP A 210 -5.200 1.692 3.850 1.00 0.00 C ATOM 972 CZ3 TRP A 210 -3.032 2.745 3.933 1.00 0.00 C ATOM 973 CH2 TRP A 210 -4.196 2.390 3.239 1.00 0.00 C ATOM 0 H TRP A 210 -3.380 -1.037 9.097 1.00 0.00 H new ATOM 0 HA TRP A 210 -1.552 0.242 7.328 1.00 0.00 H new ATOM 0 HB2 TRP A 210 -3.590 1.252 9.320 1.00 0.00 H new ATOM 0 HB3 TRP A 210 -2.608 2.327 8.344 1.00 0.00 H new ATOM 0 HD1 TRP A 210 -5.660 0.087 8.144 1.00 0.00 H new ATOM 0 HE1 TRP A 210 -6.760 0.286 5.817 1.00 0.00 H new ATOM 0 HE3 TRP A 210 -1.960 2.685 5.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 210 -6.096 1.415 3.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 210 -2.255 3.293 3.421 1.00 0.00 H new ATOM 0 HH2 TRP A 210 -4.302 2.673 2.202 1.00 0.00 H new ATOM 984 N ASP A 211 -0.778 0.119 10.476 1.00 0.00 N ATOM 985 CA ASP A 211 0.306 0.377 11.416 1.00 0.00 C ATOM 986 C ASP A 211 1.454 -0.600 11.197 1.00 0.00 C ATOM 987 O ASP A 211 2.387 -0.669 11.998 1.00 0.00 O ATOM 988 CB ASP A 211 -0.168 0.297 12.867 1.00 0.00 C ATOM 989 CG ASP A 211 -0.583 -1.101 13.284 1.00 0.00 C ATOM 990 OD1 ASP A 211 0.229 -1.806 13.919 1.00 0.00 O ATOM 991 OD2 ASP A 211 -1.729 -1.498 12.989 1.00 0.00 O ATOM 0 H ASP A 211 -1.496 -0.519 10.819 1.00 0.00 H new ATOM 0 HA ASP A 211 0.656 1.392 11.229 1.00 0.00 H new ATOM 0 HB2 ASP A 211 0.631 0.643 13.523 1.00 0.00 H new ATOM 0 HB3 ASP A 211 -1.010 0.975 13.005 1.00 0.00 H new ATOM 996 N THR A 212 1.383 -1.349 10.110 1.00 0.00 N ATOM 997 CA THR A 212 2.458 -2.238 9.723 1.00 0.00 C ATOM 998 C THR A 212 3.509 -1.444 8.954 1.00 0.00 C ATOM 999 O THR A 212 3.167 -0.526 8.218 1.00 0.00 O ATOM 1000 CB THR A 212 1.919 -3.385 8.846 1.00 0.00 C ATOM 1001 OG1 THR A 212 0.970 -4.162 9.590 1.00 0.00 O ATOM 1002 CG2 THR A 212 3.042 -4.278 8.356 1.00 0.00 C ATOM 0 H THR A 212 0.583 -1.357 9.477 1.00 0.00 H new ATOM 0 HA THR A 212 2.906 -2.671 10.617 1.00 0.00 H new ATOM 0 HB THR A 212 1.431 -2.945 7.976 1.00 0.00 H new ATOM 0 HG1 THR A 212 0.870 -5.043 9.173 1.00 0.00 H new ATOM 0 HG21 THR A 212 2.629 -5.077 7.740 1.00 0.00 H new ATOM 0 HG22 THR A 212 3.743 -3.689 7.764 1.00 0.00 H new ATOM 0 HG23 THR A 212 3.562 -4.710 9.211 1.00 0.00 H new ATOM 1010 N ASP A 213 4.778 -1.769 9.150 1.00 0.00 N ATOM 1011 CA ASP A 213 5.853 -1.065 8.461 1.00 0.00 C ATOM 1012 C ASP A 213 5.922 -1.511 7.004 1.00 0.00 C ATOM 1013 O ASP A 213 5.823 -2.700 6.701 1.00 0.00 O ATOM 1014 CB ASP A 213 7.193 -1.325 9.156 1.00 0.00 C ATOM 1015 CG ASP A 213 8.281 -0.366 8.714 1.00 0.00 C ATOM 1016 OD1 ASP A 213 8.642 -0.378 7.526 1.00 0.00 O ATOM 1017 OD2 ASP A 213 8.794 0.394 9.564 1.00 0.00 O ATOM 0 H ASP A 213 5.089 -2.511 9.777 1.00 0.00 H new ATOM 0 HA ASP A 213 5.646 0.005 8.494 1.00 0.00 H new ATOM 0 HB2 ASP A 213 7.059 -1.243 10.235 1.00 0.00 H new ATOM 0 HB3 ASP A 213 7.511 -2.347 8.951 1.00 0.00 H new ATOM 1022 N ILE A 214 6.103 -0.551 6.110 1.00 0.00 N ATOM 1023 CA ILE A 214 6.069 -0.813 4.674 1.00 0.00 C ATOM 1024 C ILE A 214 7.377 -1.442 4.185 1.00 0.00 C ATOM 1025 O ILE A 214 7.413 -2.073 3.125 1.00 0.00 O ATOM 1026 CB ILE A 214 5.705 0.473 3.863 1.00 0.00 C ATOM 1027 CG1 ILE A 214 6.285 0.442 2.440 1.00 0.00 C ATOM 1028 CG2 ILE A 214 6.128 1.736 4.592 1.00 0.00 C ATOM 1029 CD1 ILE A 214 6.190 1.767 1.713 1.00 0.00 C ATOM 0 H ILE A 214 6.276 0.424 6.353 1.00 0.00 H new ATOM 0 HA ILE A 214 5.277 -1.540 4.495 1.00 0.00 H new ATOM 0 HB ILE A 214 4.619 0.486 3.774 1.00 0.00 H new ATOM 0 HG12 ILE A 214 7.331 0.140 2.490 1.00 0.00 H new ATOM 0 HG13 ILE A 214 5.761 -0.318 1.861 1.00 0.00 H new ATOM 0 HG21 ILE A 214 5.858 2.608 3.996 1.00 0.00 H new ATOM 0 HG22 ILE A 214 5.624 1.785 5.557 1.00 0.00 H new ATOM 0 HG23 ILE A 214 7.207 1.723 4.747 1.00 0.00 H new ATOM 0 HD11 ILE A 214 6.619 1.667 0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 214 5.144 2.062 1.630 1.00 0.00 H new ATOM 0 HD13 ILE A 214 6.738 2.527 2.269 1.00 0.00 H new ATOM 1041 N SER A 215 8.441 -1.334 4.977 1.00 0.00 N ATOM 1042 CA SER A 215 9.708 -1.952 4.605 1.00 0.00 C ATOM 1043 C SER A 215 9.605 -3.473 4.691 1.00 0.00 C ATOM 1044 O SER A 215 10.465 -4.192 4.181 1.00 0.00 O ATOM 1045 CB SER A 215 10.856 -1.449 5.482 1.00 0.00 C ATOM 1046 OG SER A 215 10.644 -1.763 6.845 1.00 0.00 O ATOM 0 H SER A 215 8.452 -0.833 5.865 1.00 0.00 H new ATOM 0 HA SER A 215 9.925 -1.669 3.575 1.00 0.00 H new ATOM 0 HB2 SER A 215 11.793 -1.894 5.147 1.00 0.00 H new ATOM 0 HB3 SER A 215 10.956 -0.370 5.368 1.00 0.00 H new ATOM 0 HG SER A 215 10.046 -1.098 7.245 1.00 0.00 H new ATOM 1052 N TRP A 216 8.552 -3.959 5.339 1.00 0.00 N ATOM 1053 CA TRP A 216 8.280 -5.388 5.378 1.00 0.00 C ATOM 1054 C TRP A 216 7.900 -5.860 3.982 1.00 0.00 C ATOM 1055 O TRP A 216 8.328 -6.916 3.524 1.00 0.00 O ATOM 1056 CB TRP A 216 7.134 -5.712 6.347 1.00 0.00 C ATOM 1057 CG TRP A 216 7.398 -5.338 7.778 1.00 0.00 C ATOM 1058 CD1 TRP A 216 8.400 -4.543 8.255 1.00 0.00 C ATOM 1059 CD2 TRP A 216 6.636 -5.746 8.922 1.00 0.00 C ATOM 1060 NE1 TRP A 216 8.308 -4.434 9.620 1.00 0.00 N ATOM 1061 CE2 TRP A 216 7.233 -5.160 10.053 1.00 0.00 C ATOM 1062 CE3 TRP A 216 5.506 -6.548 9.097 1.00 0.00 C ATOM 1063 CZ2 TRP A 216 6.739 -5.351 11.340 1.00 0.00 C ATOM 1064 CZ3 TRP A 216 5.016 -6.736 10.376 1.00 0.00 C ATOM 1065 CH2 TRP A 216 5.632 -6.139 11.482 1.00 0.00 C ATOM 0 H TRP A 216 7.876 -3.385 5.843 1.00 0.00 H new ATOM 0 HA TRP A 216 9.178 -5.899 5.725 1.00 0.00 H new ATOM 0 HB2 TRP A 216 6.235 -5.196 6.011 1.00 0.00 H new ATOM 0 HB3 TRP A 216 6.925 -6.781 6.297 1.00 0.00 H new ATOM 0 HD1 TRP A 216 9.156 -4.069 7.646 1.00 0.00 H new ATOM 0 HE1 TRP A 216 8.939 -3.898 10.215 1.00 0.00 H new ATOM 0 HE3 TRP A 216 5.024 -7.012 8.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 7.213 -4.893 12.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 4.143 -7.354 10.524 1.00 0.00 H new ATOM 0 HH2 TRP A 216 5.224 -6.305 12.468 1.00 0.00 H new ATOM 1076 N LEU A 217 7.107 -5.034 3.307 1.00 0.00 N ATOM 1077 CA LEU A 217 6.565 -5.362 1.998 1.00 0.00 C ATOM 1078 C LEU A 217 7.380 -4.683 0.898 1.00 0.00 C ATOM 1079 O LEU A 217 6.844 -4.316 -0.149 1.00 0.00 O ATOM 1080 CB LEU A 217 5.091 -4.918 1.901 1.00 0.00 C ATOM 1081 CG LEU A 217 4.178 -5.295 3.083 1.00 0.00 C ATOM 1082 CD1 LEU A 217 4.526 -6.664 3.641 1.00 0.00 C ATOM 1083 CD2 LEU A 217 4.231 -4.236 4.170 1.00 0.00 C ATOM 0 H LEU A 217 6.823 -4.118 3.655 1.00 0.00 H new ATOM 0 HA LEU A 217 6.621 -6.442 1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 217 5.069 -3.834 1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 217 4.666 -5.345 0.992 1.00 0.00 H new ATOM 0 HG LEU A 217 3.156 -5.344 2.706 1.00 0.00 H new ATOM 0 HD11 LEU A 217 3.862 -6.897 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 217 4.408 -7.416 2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 217 5.559 -6.663 3.990 1.00 0.00 H new ATOM 0 HD21 LEU A 217 3.578 -4.526 4.993 1.00 0.00 H new ATOM 0 HD22 LEU A 217 5.254 -4.140 4.535 1.00 0.00 H new ATOM 0 HD23 LEU A 217 3.900 -3.280 3.763 1.00 0.00 H new ATOM 1095 N THR A 218 8.674 -4.511 1.152 1.00 0.00 N ATOM 1096 CA THR A 218 9.577 -3.862 0.211 1.00 0.00 C ATOM 1097 C THR A 218 9.516 -4.489 -1.177 1.00 0.00 C ATOM 1098 O THR A 218 9.880 -5.652 -1.374 1.00 0.00 O ATOM 1099 CB THR A 218 11.036 -3.897 0.714 1.00 0.00 C ATOM 1100 OG1 THR A 218 11.170 -3.104 1.900 1.00 0.00 O ATOM 1101 CG2 THR A 218 11.995 -3.389 -0.352 1.00 0.00 C ATOM 0 H THR A 218 9.124 -4.817 2.015 1.00 0.00 H new ATOM 0 HA THR A 218 9.241 -2.827 0.139 1.00 0.00 H new ATOM 0 HB THR A 218 11.288 -4.933 0.941 1.00 0.00 H new ATOM 0 HG1 THR A 218 11.187 -3.690 2.685 1.00 0.00 H new ATOM 0 HG21 THR A 218 13.015 -3.425 0.030 1.00 0.00 H new ATOM 0 HG22 THR A 218 11.917 -4.016 -1.240 1.00 0.00 H new ATOM 0 HG23 THR A 218 11.740 -2.361 -0.611 1.00 0.00 H new ATOM 1109 N GLY A 219 9.031 -3.704 -2.123 1.00 0.00 N ATOM 1110 CA GLY A 219 9.086 -4.081 -3.512 1.00 0.00 C ATOM 1111 C GLY A 219 7.947 -4.978 -3.943 1.00 0.00 C ATOM 1112 O GLY A 219 7.900 -5.412 -5.094 1.00 0.00 O ATOM 0 H GLY A 219 8.594 -2.799 -1.947 1.00 0.00 H new ATOM 0 HA2 GLY A 219 9.079 -3.180 -4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 219 10.031 -4.590 -3.704 1.00 0.00 H new ATOM 1116 N GLU A 220 7.033 -5.255 -3.031 1.00 0.00 N ATOM 1117 CA GLU A 220 5.890 -6.103 -3.329 1.00 0.00 C ATOM 1118 C GLU A 220 4.738 -5.269 -3.872 1.00 0.00 C ATOM 1119 O GLU A 220 4.663 -4.063 -3.625 1.00 0.00 O ATOM 1120 CB GLU A 220 5.458 -6.859 -2.070 1.00 0.00 C ATOM 1121 CG GLU A 220 6.453 -7.926 -1.641 1.00 0.00 C ATOM 1122 CD GLU A 220 6.040 -8.640 -0.371 1.00 0.00 C ATOM 1123 OE1 GLU A 220 6.698 -8.436 0.668 1.00 0.00 O ATOM 1124 OE2 GLU A 220 5.057 -9.413 -0.410 1.00 0.00 O ATOM 0 H GLU A 220 7.059 -4.904 -2.074 1.00 0.00 H new ATOM 0 HA GLU A 220 6.177 -6.827 -4.091 1.00 0.00 H new ATOM 0 HB2 GLU A 220 5.324 -6.148 -1.255 1.00 0.00 H new ATOM 0 HB3 GLU A 220 4.489 -7.326 -2.249 1.00 0.00 H new ATOM 0 HG2 GLU A 220 6.563 -8.656 -2.443 1.00 0.00 H new ATOM 0 HG3 GLU A 220 7.430 -7.466 -1.492 1.00 0.00 H new ATOM 1131 N GLU A 221 3.864 -5.900 -4.643 1.00 0.00 N ATOM 1132 CA GLU A 221 2.678 -5.228 -5.140 1.00 0.00 C ATOM 1133 C GLU A 221 1.561 -5.323 -4.106 1.00 0.00 C ATOM 1134 O GLU A 221 1.021 -6.406 -3.860 1.00 0.00 O ATOM 1135 CB GLU A 221 2.195 -5.836 -6.462 1.00 0.00 C ATOM 1136 CG GLU A 221 3.194 -5.752 -7.603 1.00 0.00 C ATOM 1137 CD GLU A 221 4.125 -6.943 -7.659 1.00 0.00 C ATOM 1138 OE1 GLU A 221 5.238 -6.865 -7.100 1.00 0.00 O ATOM 1139 OE2 GLU A 221 3.751 -7.963 -8.280 1.00 0.00 O ATOM 0 H GLU A 221 3.955 -6.873 -4.936 1.00 0.00 H new ATOM 0 HA GLU A 221 2.938 -4.185 -5.319 1.00 0.00 H new ATOM 0 HB2 GLU A 221 1.944 -6.883 -6.294 1.00 0.00 H new ATOM 0 HB3 GLU A 221 1.277 -5.332 -6.764 1.00 0.00 H new ATOM 0 HG2 GLU A 221 2.654 -5.674 -8.547 1.00 0.00 H new ATOM 0 HG3 GLU A 221 3.783 -4.841 -7.497 1.00 0.00 H new ATOM 1146 N LEU A 222 1.211 -4.198 -3.510 1.00 0.00 N ATOM 1147 CA LEU A 222 0.170 -4.166 -2.500 1.00 0.00 C ATOM 1148 C LEU A 222 -1.108 -3.590 -3.092 1.00 0.00 C ATOM 1149 O LEU A 222 -1.092 -3.008 -4.170 1.00 0.00 O ATOM 1150 CB LEU A 222 0.619 -3.348 -1.283 1.00 0.00 C ATOM 1151 CG LEU A 222 1.995 -3.716 -0.720 1.00 0.00 C ATOM 1152 CD1 LEU A 222 2.308 -2.898 0.524 1.00 0.00 C ATOM 1153 CD2 LEU A 222 2.055 -5.195 -0.399 1.00 0.00 C ATOM 0 H LEU A 222 1.634 -3.292 -3.709 1.00 0.00 H new ATOM 0 HA LEU A 222 -0.025 -5.185 -2.166 1.00 0.00 H new ATOM 0 HB2 LEU A 222 0.627 -2.293 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU A 222 -0.122 -3.466 -0.493 1.00 0.00 H new ATOM 0 HG LEU A 222 2.744 -3.488 -1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 222 3.290 -3.177 0.905 1.00 0.00 H new ATOM 0 HD12 LEU A 222 2.304 -1.837 0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 222 1.554 -3.093 1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 222 3.039 -5.441 0.000 1.00 0.00 H new ATOM 0 HD22 LEU A 222 1.292 -5.438 0.341 1.00 0.00 H new ATOM 0 HD23 LEU A 222 1.877 -5.772 -1.307 1.00 0.00 H new ATOM 1165 N HIS A 223 -2.218 -3.776 -2.402 1.00 0.00 N ATOM 1166 CA HIS A 223 -3.503 -3.277 -2.873 1.00 0.00 C ATOM 1167 C HIS A 223 -4.196 -2.489 -1.778 1.00 0.00 C ATOM 1168 O HIS A 223 -4.214 -2.907 -0.626 1.00 0.00 O ATOM 1169 CB HIS A 223 -4.407 -4.429 -3.322 1.00 0.00 C ATOM 1170 CG HIS A 223 -3.891 -5.181 -4.509 1.00 0.00 C ATOM 1171 ND1 HIS A 223 -4.256 -4.892 -5.807 1.00 0.00 N ATOM 1172 CD2 HIS A 223 -3.029 -6.222 -4.587 1.00 0.00 C ATOM 1173 CE1 HIS A 223 -3.638 -5.720 -6.629 1.00 0.00 C ATOM 1174 NE2 HIS A 223 -2.889 -6.535 -5.914 1.00 0.00 N ATOM 0 H HIS A 223 -2.259 -4.270 -1.511 1.00 0.00 H new ATOM 0 HA HIS A 223 -3.316 -2.625 -3.726 1.00 0.00 H new ATOM 0 HB2 HIS A 223 -4.533 -5.124 -2.491 1.00 0.00 H new ATOM 0 HB3 HIS A 223 -5.394 -4.032 -3.558 1.00 0.00 H new ATOM 0 HD2 HIS A 223 -2.542 -6.714 -3.758 1.00 0.00 H new ATOM 0 HE1 HIS A 223 -3.731 -5.728 -7.705 1.00 0.00 H new ATOM 0 HE2 HIS A 223 -2.300 -7.279 -6.288 1.00 0.00 H new ATOM 1183 N VAL A 224 -4.746 -1.349 -2.145 1.00 0.00 N ATOM 1184 CA VAL A 224 -5.524 -0.534 -1.234 1.00 0.00 C ATOM 1185 C VAL A 224 -6.976 -0.513 -1.694 1.00 0.00 C ATOM 1186 O VAL A 224 -7.312 0.062 -2.732 1.00 0.00 O ATOM 1187 CB VAL A 224 -4.945 0.900 -1.126 1.00 0.00 C ATOM 1188 CG1 VAL A 224 -5.965 1.889 -0.593 1.00 0.00 C ATOM 1189 CG2 VAL A 224 -3.744 0.891 -0.211 1.00 0.00 C ATOM 0 H VAL A 224 -4.666 -0.961 -3.085 1.00 0.00 H new ATOM 0 HA VAL A 224 -5.474 -0.970 -0.236 1.00 0.00 H new ATOM 0 HB VAL A 224 -4.662 1.216 -2.130 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -5.515 2.880 -0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -6.825 1.920 -1.261 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -6.288 1.578 0.400 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -3.337 1.899 -0.135 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -4.043 0.545 0.778 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -2.984 0.222 -0.615 1.00 0.00 H new ATOM 1199 N GLU A 225 -7.823 -1.179 -0.931 1.00 0.00 N ATOM 1200 CA GLU A 225 -9.223 -1.336 -1.293 1.00 0.00 C ATOM 1201 C GLU A 225 -10.098 -0.522 -0.357 1.00 0.00 C ATOM 1202 O GLU A 225 -9.709 -0.240 0.772 1.00 0.00 O ATOM 1203 CB GLU A 225 -9.611 -2.812 -1.245 1.00 0.00 C ATOM 1204 CG GLU A 225 -8.666 -3.703 -2.039 1.00 0.00 C ATOM 1205 CD GLU A 225 -9.216 -5.094 -2.283 1.00 0.00 C ATOM 1206 OE1 GLU A 225 -9.399 -5.468 -3.460 1.00 0.00 O ATOM 1207 OE2 GLU A 225 -9.470 -5.823 -1.306 1.00 0.00 O ATOM 0 H GLU A 225 -7.565 -1.624 -0.050 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.373 -0.971 -2.309 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -9.628 -3.144 -0.207 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -10.623 -2.929 -1.633 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -8.453 -3.231 -2.998 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -7.719 -3.783 -1.505 1.00 0.00 H new ATOM 1214 N VAL A 226 -11.277 -0.152 -0.829 1.00 0.00 N ATOM 1215 CA VAL A 226 -12.145 0.748 -0.089 1.00 0.00 C ATOM 1216 C VAL A 226 -13.006 -0.019 0.900 1.00 0.00 C ATOM 1217 O VAL A 226 -13.627 -1.022 0.548 1.00 0.00 O ATOM 1218 CB VAL A 226 -13.075 1.544 -1.029 1.00 0.00 C ATOM 1219 CG1 VAL A 226 -13.643 2.764 -0.322 1.00 0.00 C ATOM 1220 CG2 VAL A 226 -12.349 1.939 -2.302 1.00 0.00 C ATOM 0 H VAL A 226 -11.656 -0.462 -1.724 1.00 0.00 H new ATOM 0 HA VAL A 226 -11.494 1.441 0.443 1.00 0.00 H new ATOM 0 HB VAL A 226 -13.909 0.899 -1.307 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -14.295 3.309 -1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -14.215 2.446 0.550 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -12.827 3.413 -0.004 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -13.025 2.499 -2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -11.489 2.560 -2.052 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -12.011 1.042 -2.821 1.00 0.00 H new ATOM 1230 N LEU A 227 -13.037 0.452 2.136 1.00 0.00 N ATOM 1231 CA LEU A 227 -13.935 -0.100 3.135 1.00 0.00 C ATOM 1232 C LEU A 227 -15.347 0.396 2.866 1.00 0.00 C ATOM 1233 O LEU A 227 -15.834 1.337 3.497 1.00 0.00 O ATOM 1234 CB LEU A 227 -13.476 0.283 4.544 1.00 0.00 C ATOM 1235 CG LEU A 227 -12.569 -0.737 5.235 1.00 0.00 C ATOM 1236 CD1 LEU A 227 -11.378 -1.089 4.365 1.00 0.00 C ATOM 1237 CD2 LEU A 227 -12.107 -0.195 6.573 1.00 0.00 C ATOM 0 H LEU A 227 -12.450 1.216 2.471 1.00 0.00 H new ATOM 0 HA LEU A 227 -13.923 -1.188 3.072 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -12.949 1.236 4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -14.358 0.441 5.165 1.00 0.00 H new ATOM 0 HG LEU A 227 -13.142 -1.650 5.399 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.752 -1.816 4.882 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -11.728 -1.515 3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -10.797 -0.189 4.162 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -11.462 -0.927 7.059 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -11.553 0.731 6.419 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -12.973 0.001 7.205 1.00 0.00 H new