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 Single : A 163 ASN : amide:sc= -0.303 X(o=-0.3,f=-0.034) USER MOD Single : A 164 LYS NZ :NH3+ 168:sc= 0.922 (180deg=0.759) USER MOD Single : A 165 GLN : amide:sc= -1.19 K(o=-1.2,f=-5.6!) USER MOD Single : A 167 THR OG1 : rot 180:sc=-0.00227 USER MOD Single : A 173 CYS SG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 33:sc= 0.138 USER MOD Single : A 180 SER OG : rot -116:sc= 1.04 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 -157:sc= -0.437 (180deg=-1.32) USER MOD Single : A 187 MET CE :methyl -148:sc= -0.376 (180deg=-1.22) USER MOD Single : A 194 CYS SG : rot 180:sc= 0 USER MOD Single : A 195 CYS SG : rot 100:sc= 0.0453 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ -160:sc= 1.26 (180deg=0.584) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot 180:sc= 0 USER MOD Single : A 215 SER OG : rot 90:sc= -2.41! USER MOD Single : A 218 THR OG1 : rot 103:sc= 0.704 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD ----------------------------------------------------------------- ATOM 65 N PRO A 155 14.501 1.253 -2.475 1.00 0.00 N ATOM 66 CA PRO A 155 13.475 0.444 -3.135 1.00 0.00 C ATOM 67 C PRO A 155 12.073 1.022 -2.979 1.00 0.00 C ATOM 68 O PRO A 155 11.825 1.862 -2.115 1.00 0.00 O ATOM 69 CB PRO A 155 13.588 -0.905 -2.432 1.00 0.00 C ATOM 70 CG PRO A 155 14.101 -0.574 -1.079 1.00 0.00 C ATOM 71 CD PRO A 155 15.022 0.598 -1.260 1.00 0.00 C ATOM 0 HA PRO A 155 13.629 0.394 -4.213 1.00 0.00 H new ATOM 0 HB2 PRO A 155 12.622 -1.408 -2.379 1.00 0.00 H new ATOM 0 HB3 PRO A 155 14.267 -1.574 -2.962 1.00 0.00 H new ATOM 0 HG2 PRO A 155 13.284 -0.327 -0.402 1.00 0.00 H new ATOM 0 HG3 PRO A 155 14.630 -1.422 -0.644 1.00 0.00 H new ATOM 0 HD2 PRO A 155 14.996 1.267 -0.400 1.00 0.00 H new ATOM 0 HD3 PRO A 155 16.057 0.281 -1.386 1.00 0.00 H new ATOM 79 N ILE A 156 11.163 0.567 -3.825 1.00 0.00 N ATOM 80 CA ILE A 156 9.788 1.038 -3.812 1.00 0.00 C ATOM 81 C ILE A 156 8.816 -0.140 -3.794 1.00 0.00 C ATOM 82 O ILE A 156 9.177 -1.249 -4.177 1.00 0.00 O ATOM 83 CB ILE A 156 9.500 1.944 -5.040 1.00 0.00 C ATOM 84 CG1 ILE A 156 10.220 1.446 -6.301 1.00 0.00 C ATOM 85 CG2 ILE A 156 9.866 3.387 -4.755 1.00 0.00 C ATOM 86 CD1 ILE A 156 9.620 0.191 -6.894 1.00 0.00 C ATOM 0 H ILE A 156 11.356 -0.137 -4.538 1.00 0.00 H new ATOM 0 HA ILE A 156 9.645 1.627 -2.906 1.00 0.00 H new ATOM 0 HB ILE A 156 8.428 1.891 -5.228 1.00 0.00 H new ATOM 0 HG12 ILE A 156 10.203 2.235 -7.053 1.00 0.00 H new ATOM 0 HG13 ILE A 156 11.266 1.258 -6.060 1.00 0.00 H new ATOM 0 HG21 ILE A 156 9.653 3.997 -5.633 1.00 0.00 H new ATOM 0 HG22 ILE A 156 9.281 3.751 -3.910 1.00 0.00 H new ATOM 0 HG23 ILE A 156 10.928 3.453 -4.516 1.00 0.00 H new ATOM 0 HD11 ILE A 156 10.183 -0.098 -7.781 1.00 0.00 H new ATOM 0 HD12 ILE A 156 9.661 -0.614 -6.160 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.582 0.379 -7.169 1.00 0.00 H new ATOM 98 N VAL A 157 7.594 0.098 -3.335 1.00 0.00 N ATOM 99 CA VAL A 157 6.561 -0.936 -3.325 1.00 0.00 C ATOM 100 C VAL A 157 5.318 -0.433 -4.072 1.00 0.00 C ATOM 101 O VAL A 157 4.878 0.704 -3.866 1.00 0.00 O ATOM 102 CB VAL A 157 6.199 -1.410 -1.880 1.00 0.00 C ATOM 103 CG1 VAL A 157 6.956 -0.629 -0.818 1.00 0.00 C ATOM 104 CG2 VAL A 157 4.703 -1.345 -1.614 1.00 0.00 C ATOM 0 H VAL A 157 7.291 0.999 -2.964 1.00 0.00 H new ATOM 0 HA VAL A 157 6.961 -1.810 -3.839 1.00 0.00 H new ATOM 0 HB VAL A 157 6.507 -2.454 -1.818 1.00 0.00 H new ATOM 0 HG11 VAL A 157 6.674 -0.991 0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 157 8.028 -0.764 -0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 157 6.710 0.430 -0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 157 4.499 -1.684 -0.598 1.00 0.00 H new ATOM 0 HG22 VAL A 157 4.357 -0.318 -1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 157 4.179 -1.987 -2.322 1.00 0.00 H new ATOM 114 N ARG A 158 4.764 -1.273 -4.947 1.00 0.00 N ATOM 115 CA ARG A 158 3.736 -0.835 -5.894 1.00 0.00 C ATOM 116 C ARG A 158 2.336 -1.034 -5.348 1.00 0.00 C ATOM 117 O ARG A 158 1.834 -2.148 -5.266 1.00 0.00 O ATOM 118 CB ARG A 158 3.901 -1.564 -7.232 1.00 0.00 C ATOM 119 CG ARG A 158 5.290 -1.384 -7.818 1.00 0.00 C ATOM 120 CD ARG A 158 5.433 -1.956 -9.214 1.00 0.00 C ATOM 121 NE ARG A 158 4.937 -3.327 -9.329 1.00 0.00 N ATOM 122 CZ ARG A 158 5.615 -4.318 -9.905 1.00 0.00 C ATOM 123 NH1 ARG A 158 6.866 -4.131 -10.311 1.00 0.00 N ATOM 124 NH2 ARG A 158 5.047 -5.504 -10.066 1.00 0.00 N ATOM 0 H ARG A 158 5.009 -2.260 -5.020 1.00 0.00 H new ATOM 0 HA ARG A 158 3.871 0.235 -6.052 1.00 0.00 H new ATOM 0 HB2 ARG A 158 3.703 -2.627 -7.091 1.00 0.00 H new ATOM 0 HB3 ARG A 158 3.160 -1.193 -7.939 1.00 0.00 H new ATOM 0 HG2 ARG A 158 5.531 -0.321 -7.842 1.00 0.00 H new ATOM 0 HG3 ARG A 158 6.018 -1.861 -7.162 1.00 0.00 H new ATOM 0 HD2 ARG A 158 4.893 -1.321 -9.917 1.00 0.00 H new ATOM 0 HD3 ARG A 158 6.483 -1.931 -9.504 1.00 0.00 H new ATOM 0 HE ARG A 158 4.016 -3.537 -8.945 1.00 0.00 H new ATOM 0 HH11 ARG A 158 7.314 -3.224 -10.182 1.00 0.00 H new ATOM 0 HH12 ARG A 158 7.379 -4.895 -10.751 1.00 0.00 H new ATOM 0 HH21 ARG A 158 4.090 -5.658 -9.749 1.00 0.00 H new ATOM 0 HH22 ARG A 158 5.567 -6.263 -10.507 1.00 0.00 H new ATOM 138 N VAL A 159 1.705 0.070 -5.007 1.00 0.00 N ATOM 139 CA VAL A 159 0.381 0.057 -4.425 1.00 0.00 C ATOM 140 C VAL A 159 -0.693 0.275 -5.474 1.00 0.00 C ATOM 141 O VAL A 159 -0.497 0.999 -6.441 1.00 0.00 O ATOM 142 CB VAL A 159 0.260 1.124 -3.316 1.00 0.00 C ATOM 143 CG1 VAL A 159 -1.189 1.464 -3.016 1.00 0.00 C ATOM 144 CG2 VAL A 159 0.921 0.606 -2.063 1.00 0.00 C ATOM 0 H VAL A 159 2.098 1.004 -5.126 1.00 0.00 H new ATOM 0 HA VAL A 159 0.230 -0.929 -3.986 1.00 0.00 H new ATOM 0 HB VAL A 159 0.751 2.033 -3.663 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -1.231 2.218 -2.230 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -1.666 1.851 -3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -1.712 0.567 -2.686 1.00 0.00 H new ATOM 0 HG21 VAL A 159 0.841 1.353 -1.274 1.00 0.00 H new ATOM 0 HG22 VAL A 159 0.428 -0.313 -1.745 1.00 0.00 H new ATOM 0 HG23 VAL A 159 1.973 0.402 -2.264 1.00 0.00 H new ATOM 154 N PHE A 160 -1.824 -0.369 -5.272 1.00 0.00 N ATOM 155 CA PHE A 160 -2.964 -0.207 -6.153 1.00 0.00 C ATOM 156 C PHE A 160 -4.098 0.498 -5.409 1.00 0.00 C ATOM 157 O PHE A 160 -4.808 -0.122 -4.631 1.00 0.00 O ATOM 158 CB PHE A 160 -3.427 -1.569 -6.682 1.00 0.00 C ATOM 159 CG PHE A 160 -2.488 -2.196 -7.682 1.00 0.00 C ATOM 160 CD1 PHE A 160 -1.231 -2.649 -7.300 1.00 0.00 C ATOM 161 CD2 PHE A 160 -2.871 -2.346 -9.005 1.00 0.00 C ATOM 162 CE1 PHE A 160 -0.378 -3.234 -8.218 1.00 0.00 C ATOM 163 CE2 PHE A 160 -2.023 -2.928 -9.927 1.00 0.00 C ATOM 164 CZ PHE A 160 -0.775 -3.372 -9.533 1.00 0.00 C ATOM 0 H PHE A 160 -1.979 -1.015 -4.498 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.671 0.406 -7.005 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -3.551 -2.250 -5.840 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -4.407 -1.452 -7.144 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -0.916 -2.543 -6.272 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.846 -2.003 -9.320 1.00 0.00 H new ATOM 0 HE1 PHE A 160 0.596 -3.582 -7.907 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -2.335 -3.036 -10.955 1.00 0.00 H new ATOM 0 HZ PHE A 160 -0.111 -3.827 -10.253 1.00 0.00 H new ATOM 174 N LEU A 161 -4.280 1.785 -5.683 1.00 0.00 N ATOM 175 CA LEU A 161 -5.215 2.627 -4.930 1.00 0.00 C ATOM 176 C LEU A 161 -6.654 2.324 -5.372 1.00 0.00 C ATOM 177 O LEU A 161 -6.857 1.553 -6.313 1.00 0.00 O ATOM 178 CB LEU A 161 -4.894 4.127 -5.146 1.00 0.00 C ATOM 179 CG LEU A 161 -3.465 4.595 -4.838 1.00 0.00 C ATOM 180 CD1 LEU A 161 -3.026 4.149 -3.458 1.00 0.00 C ATOM 181 CD2 LEU A 161 -2.497 4.135 -5.912 1.00 0.00 C ATOM 0 H LEU A 161 -3.788 2.277 -6.429 1.00 0.00 H new ATOM 0 HA LEU A 161 -5.111 2.405 -3.868 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.112 4.372 -6.186 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -5.579 4.710 -4.531 1.00 0.00 H new ATOM 0 HG LEU A 161 -3.461 5.685 -4.841 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -2.010 4.496 -3.270 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -3.697 4.569 -2.709 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.054 3.061 -3.401 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -1.492 4.480 -5.668 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.503 3.046 -5.965 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.799 4.547 -6.875 1.00 0.00 H new ATOM 193 N PRO A 162 -7.677 2.908 -4.710 1.00 0.00 N ATOM 194 CA PRO A 162 -9.084 2.687 -5.074 1.00 0.00 C ATOM 195 C PRO A 162 -9.370 2.983 -6.543 1.00 0.00 C ATOM 196 O PRO A 162 -8.660 3.768 -7.181 1.00 0.00 O ATOM 197 CB PRO A 162 -9.843 3.655 -4.173 1.00 0.00 C ATOM 198 CG PRO A 162 -8.955 3.809 -2.996 1.00 0.00 C ATOM 199 CD PRO A 162 -7.565 3.816 -3.558 1.00 0.00 C ATOM 0 HA PRO A 162 -9.373 1.645 -4.942 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -10.019 4.609 -4.669 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -10.818 3.258 -3.890 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -9.168 4.733 -2.459 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -9.091 2.991 -2.289 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -7.255 4.817 -3.860 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -6.833 3.461 -2.832 1.00 0.00 H new ATOM 207 N ASN A 163 -10.418 2.343 -7.060 1.00 0.00 N ATOM 208 CA ASN A 163 -10.785 2.424 -8.475 1.00 0.00 C ATOM 209 C ASN A 163 -9.710 1.754 -9.332 1.00 0.00 C ATOM 210 O ASN A 163 -9.588 2.022 -10.528 1.00 0.00 O ATOM 211 CB ASN A 163 -11.008 3.880 -8.911 1.00 0.00 C ATOM 212 CG ASN A 163 -11.902 4.003 -10.136 1.00 0.00 C ATOM 213 OD1 ASN A 163 -13.124 4.081 -10.016 1.00 0.00 O ATOM 214 ND2 ASN A 163 -11.306 4.025 -11.318 1.00 0.00 N ATOM 0 H ASN A 163 -11.039 1.751 -6.508 1.00 0.00 H new ATOM 0 HA ASN A 163 -11.727 1.894 -8.618 1.00 0.00 H new ATOM 0 HB2 ASN A 163 -11.453 4.437 -8.086 1.00 0.00 H new ATOM 0 HB3 ASN A 163 -10.044 4.342 -9.124 1.00 0.00 H new ATOM 0 HD21 ASN A 163 -11.863 4.109 -12.168 1.00 0.00 H new ATOM 0 HD22 ASN A 163 -10.290 3.958 -11.378 1.00 0.00 H new ATOM 221 N LYS A 164 -8.940 0.868 -8.698 1.00 0.00 N ATOM 222 CA LYS A 164 -7.875 0.118 -9.365 1.00 0.00 C ATOM 223 C LYS A 164 -6.806 1.052 -9.932 1.00 0.00 C ATOM 224 O LYS A 164 -6.358 0.894 -11.070 1.00 0.00 O ATOM 225 CB LYS A 164 -8.445 -0.782 -10.467 1.00 0.00 C ATOM 226 CG LYS A 164 -9.365 -1.895 -9.967 1.00 0.00 C ATOM 227 CD LYS A 164 -8.590 -3.103 -9.447 1.00 0.00 C ATOM 228 CE LYS A 164 -8.225 -2.984 -7.973 1.00 0.00 C ATOM 229 NZ LYS A 164 -9.424 -3.018 -7.092 1.00 0.00 N ATOM 0 H LYS A 164 -9.038 0.650 -7.706 1.00 0.00 H new ATOM 0 HA LYS A 164 -7.402 -0.516 -8.615 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -8.997 -0.163 -11.174 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -7.617 -1.232 -11.015 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -10.002 -1.506 -9.172 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -10.023 -2.210 -10.777 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -9.187 -4.003 -9.597 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -7.679 -3.223 -10.033 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -7.553 -3.797 -7.700 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -7.682 -2.053 -7.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -9.125 -3.139 -6.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -9.951 -2.126 -7.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -10.035 -3.813 -7.368 1.00 0.00 H new ATOM 243 N GLN A 165 -6.409 2.026 -9.129 1.00 0.00 N ATOM 244 CA GLN A 165 -5.313 2.916 -9.476 1.00 0.00 C ATOM 245 C GLN A 165 -3.995 2.287 -9.040 1.00 0.00 C ATOM 246 O GLN A 165 -4.003 1.253 -8.386 1.00 0.00 O ATOM 247 CB GLN A 165 -5.518 4.274 -8.804 1.00 0.00 C ATOM 248 CG GLN A 165 -6.606 5.128 -9.437 1.00 0.00 C ATOM 249 CD GLN A 165 -6.235 5.649 -10.815 1.00 0.00 C ATOM 250 OE1 GLN A 165 -5.499 5.009 -11.565 1.00 0.00 O ATOM 251 NE2 GLN A 165 -6.734 6.825 -11.151 1.00 0.00 N ATOM 0 H GLN A 165 -6.835 2.221 -8.223 1.00 0.00 H new ATOM 0 HA GLN A 165 -5.287 3.069 -10.555 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -5.763 4.113 -7.754 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -4.578 4.825 -8.831 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -7.521 4.541 -9.512 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -6.822 5.973 -8.783 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -7.341 7.326 -10.502 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -6.512 7.232 -12.060 1.00 0.00 H new ATOM 260 N ARG A 166 -2.866 2.874 -9.416 1.00 0.00 N ATOM 261 CA ARG A 166 -1.574 2.316 -9.030 1.00 0.00 C ATOM 262 C ARG A 166 -0.508 3.392 -8.844 1.00 0.00 C ATOM 263 O ARG A 166 -0.361 4.287 -9.674 1.00 0.00 O ATOM 264 CB ARG A 166 -1.136 1.278 -10.052 1.00 0.00 C ATOM 265 CG ARG A 166 0.275 0.756 -9.869 1.00 0.00 C ATOM 266 CD ARG A 166 0.495 -0.434 -10.774 1.00 0.00 C ATOM 267 NE ARG A 166 1.904 -0.667 -11.089 1.00 0.00 N ATOM 268 CZ ARG A 166 2.341 -1.720 -11.783 1.00 0.00 C ATOM 269 NH1 ARG A 166 1.482 -2.641 -12.203 1.00 0.00 N ATOM 270 NH2 ARG A 166 3.629 -1.843 -12.076 1.00 0.00 N ATOM 0 H ARG A 166 -2.816 3.723 -9.979 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.694 1.834 -8.060 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -1.827 0.436 -10.012 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -1.220 1.712 -11.048 1.00 0.00 H new ATOM 0 HG2 ARG A 166 0.997 1.540 -10.100 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.436 0.470 -8.830 1.00 0.00 H new ATOM 0 HD2 ARG A 166 0.084 -1.325 -10.299 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -0.058 -0.284 -11.701 1.00 0.00 H new ATOM 0 HE ARG A 166 2.590 0.012 -10.760 1.00 0.00 H new ATOM 0 HH11 ARG A 166 0.488 -2.544 -11.995 1.00 0.00 H new ATOM 0 HH12 ARG A 166 1.816 -3.446 -12.733 1.00 0.00 H new ATOM 0 HH21 ARG A 166 4.292 -1.130 -11.771 1.00 0.00 H new ATOM 0 HH22 ARG A 166 3.956 -2.650 -12.607 1.00 0.00 H new ATOM 284 N THR A 167 0.224 3.279 -7.746 1.00 0.00 N ATOM 285 CA THR A 167 1.342 4.161 -7.443 1.00 0.00 C ATOM 286 C THR A 167 2.489 3.318 -6.901 1.00 0.00 C ATOM 287 O THR A 167 2.330 2.114 -6.711 1.00 0.00 O ATOM 288 CB THR A 167 0.968 5.250 -6.399 1.00 0.00 C ATOM 289 OG1 THR A 167 1.936 6.305 -6.430 1.00 0.00 O ATOM 290 CG2 THR A 167 0.897 4.684 -4.977 1.00 0.00 C ATOM 0 H THR A 167 0.058 2.567 -7.034 1.00 0.00 H new ATOM 0 HA THR A 167 1.628 4.675 -8.361 1.00 0.00 H new ATOM 0 HB THR A 167 -0.019 5.628 -6.665 1.00 0.00 H new ATOM 0 HG1 THR A 167 1.695 6.990 -5.772 1.00 0.00 H new ATOM 0 HG21 THR A 167 0.633 5.480 -4.281 1.00 0.00 H new ATOM 0 HG22 THR A 167 0.141 3.900 -4.935 1.00 0.00 H new ATOM 0 HG23 THR A 167 1.867 4.269 -4.702 1.00 0.00 H new ATOM 298 N VAL A 168 3.641 3.923 -6.664 1.00 0.00 N ATOM 299 CA VAL A 168 4.704 3.220 -5.966 1.00 0.00 C ATOM 300 C VAL A 168 5.259 4.101 -4.863 1.00 0.00 C ATOM 301 O VAL A 168 5.608 5.257 -5.094 1.00 0.00 O ATOM 302 CB VAL A 168 5.858 2.754 -6.892 1.00 0.00 C ATOM 303 CG1 VAL A 168 6.369 1.435 -6.414 1.00 0.00 C ATOM 304 CG2 VAL A 168 5.419 2.636 -8.342 1.00 0.00 C ATOM 0 H VAL A 168 3.862 4.880 -6.938 1.00 0.00 H new ATOM 0 HA VAL A 168 4.257 2.316 -5.552 1.00 0.00 H new ATOM 0 HB VAL A 168 6.645 3.507 -6.850 1.00 0.00 H new ATOM 0 HG11 VAL A 168 7.180 1.103 -7.062 1.00 0.00 H new ATOM 0 HG12 VAL A 168 6.738 1.536 -5.393 1.00 0.00 H new ATOM 0 HG13 VAL A 168 5.563 0.702 -6.438 1.00 0.00 H new ATOM 0 HG21 VAL A 168 6.261 2.307 -8.951 1.00 0.00 H new ATOM 0 HG22 VAL A 168 4.609 1.910 -8.419 1.00 0.00 H new ATOM 0 HG23 VAL A 168 5.071 3.606 -8.697 1.00 0.00 H new ATOM 314 N VAL A 169 5.325 3.547 -3.668 1.00 0.00 N ATOM 315 CA VAL A 169 5.815 4.273 -2.513 1.00 0.00 C ATOM 316 C VAL A 169 7.170 3.721 -2.097 1.00 0.00 C ATOM 317 O VAL A 169 7.349 2.507 -1.997 1.00 0.00 O ATOM 318 CB VAL A 169 4.811 4.212 -1.336 1.00 0.00 C ATOM 319 CG1 VAL A 169 4.568 2.784 -0.877 1.00 0.00 C ATOM 320 CG2 VAL A 169 5.282 5.078 -0.177 1.00 0.00 C ATOM 0 H VAL A 169 5.042 2.587 -3.471 1.00 0.00 H new ATOM 0 HA VAL A 169 5.926 5.322 -2.788 1.00 0.00 H new ATOM 0 HB VAL A 169 3.861 4.606 -1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 169 3.858 2.783 -0.050 1.00 0.00 H new ATOM 0 HG12 VAL A 169 4.163 2.200 -1.703 1.00 0.00 H new ATOM 0 HG13 VAL A 169 5.509 2.343 -0.548 1.00 0.00 H new ATOM 0 HG21 VAL A 169 4.560 5.019 0.638 1.00 0.00 H new ATOM 0 HG22 VAL A 169 6.252 4.724 0.171 1.00 0.00 H new ATOM 0 HG23 VAL A 169 5.371 6.113 -0.509 1.00 0.00 H new ATOM 330 N PRO A 170 8.159 4.603 -1.911 1.00 0.00 N ATOM 331 CA PRO A 170 9.491 4.200 -1.481 1.00 0.00 C ATOM 332 C PRO A 170 9.445 3.442 -0.169 1.00 0.00 C ATOM 333 O PRO A 170 8.915 3.945 0.824 1.00 0.00 O ATOM 334 CB PRO A 170 10.242 5.522 -1.309 1.00 0.00 C ATOM 335 CG PRO A 170 9.486 6.512 -2.120 1.00 0.00 C ATOM 336 CD PRO A 170 8.057 6.058 -2.107 1.00 0.00 C ATOM 0 HA PRO A 170 9.967 3.529 -2.196 1.00 0.00 H new ATOM 0 HB2 PRO A 170 10.280 5.819 -0.261 1.00 0.00 H new ATOM 0 HB3 PRO A 170 11.273 5.436 -1.654 1.00 0.00 H new ATOM 0 HG2 PRO A 170 9.580 7.513 -1.700 1.00 0.00 H new ATOM 0 HG3 PRO A 170 9.871 6.556 -3.139 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.493 6.532 -1.304 1.00 0.00 H new ATOM 0 HD3 PRO A 170 7.550 6.302 -3.040 1.00 0.00 H new ATOM 344 N ALA A 171 9.984 2.230 -0.181 1.00 0.00 N ATOM 345 CA ALA A 171 10.032 1.398 1.006 1.00 0.00 C ATOM 346 C ALA A 171 10.858 2.093 2.072 1.00 0.00 C ATOM 347 O ALA A 171 12.090 2.084 2.043 1.00 0.00 O ATOM 348 CB ALA A 171 10.587 0.028 0.672 1.00 0.00 C ATOM 0 H ALA A 171 10.397 1.801 -1.010 1.00 0.00 H new ATOM 0 HA ALA A 171 9.023 1.251 1.392 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.616 -0.583 1.574 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.949 -0.452 -0.071 1.00 0.00 H new ATOM 0 HB3 ALA A 171 11.596 0.132 0.272 1.00 0.00 H new ATOM 354 N ARG A 172 10.153 2.710 2.991 1.00 0.00 N ATOM 355 CA ARG A 172 10.739 3.621 3.939 1.00 0.00 C ATOM 356 C ARG A 172 10.784 3.003 5.331 1.00 0.00 C ATOM 357 O ARG A 172 9.747 2.781 5.960 1.00 0.00 O ATOM 358 CB ARG A 172 9.923 4.902 3.902 1.00 0.00 C ATOM 359 CG ARG A 172 10.003 5.725 5.152 1.00 0.00 C ATOM 360 CD ARG A 172 9.439 7.105 4.912 1.00 0.00 C ATOM 361 NE ARG A 172 8.128 7.054 4.263 1.00 0.00 N ATOM 362 CZ ARG A 172 7.556 8.084 3.639 1.00 0.00 C ATOM 363 NH1 ARG A 172 8.141 9.276 3.621 1.00 0.00 N ATOM 364 NH2 ARG A 172 6.393 7.915 3.032 1.00 0.00 N ATOM 0 H ARG A 172 9.146 2.591 3.101 1.00 0.00 H new ATOM 0 HA ARG A 172 11.774 3.842 3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 172 10.259 5.508 3.061 1.00 0.00 H new ATOM 0 HB3 ARG A 172 8.880 4.648 3.715 1.00 0.00 H new ATOM 0 HG2 ARG A 172 9.451 5.234 5.954 1.00 0.00 H new ATOM 0 HG3 ARG A 172 11.040 5.801 5.479 1.00 0.00 H new ATOM 0 HD2 ARG A 172 9.353 7.632 5.862 1.00 0.00 H new ATOM 0 HD3 ARG A 172 10.129 7.676 4.291 1.00 0.00 H new ATOM 0 HE ARG A 172 7.618 6.171 4.290 1.00 0.00 H new ATOM 0 HH11 ARG A 172 9.038 9.411 4.088 1.00 0.00 H new ATOM 0 HH12 ARG A 172 7.694 10.056 3.140 1.00 0.00 H new ATOM 0 HH21 ARG A 172 5.940 7.001 3.043 1.00 0.00 H new ATOM 0 HH22 ARG A 172 5.949 8.698 2.553 1.00 0.00 H new ATOM 378 N CYS A 173 11.994 2.723 5.799 1.00 0.00 N ATOM 379 CA CYS A 173 12.187 2.063 7.082 1.00 0.00 C ATOM 380 C CYS A 173 11.837 3.000 8.233 1.00 0.00 C ATOM 381 O CYS A 173 12.312 4.138 8.287 1.00 0.00 O ATOM 382 CB CYS A 173 13.632 1.580 7.224 1.00 0.00 C ATOM 383 SG CYS A 173 13.945 0.642 8.739 1.00 0.00 S ATOM 0 H CYS A 173 12.859 2.944 5.306 1.00 0.00 H new ATOM 0 HA CYS A 173 11.520 1.202 7.121 1.00 0.00 H new ATOM 0 HB2 CYS A 173 13.883 0.958 6.365 1.00 0.00 H new ATOM 0 HB3 CYS A 173 14.298 2.443 7.198 1.00 0.00 H new ATOM 0 HG CYS A 173 15.191 0.273 8.771 1.00 0.00 H new ATOM 389 N GLY A 174 10.989 2.527 9.135 1.00 0.00 N ATOM 390 CA GLY A 174 10.632 3.310 10.300 1.00 0.00 C ATOM 391 C GLY A 174 9.210 3.810 10.224 1.00 0.00 C ATOM 392 O GLY A 174 8.595 4.132 11.242 1.00 0.00 O ATOM 0 H GLY A 174 10.541 1.612 9.080 1.00 0.00 H new ATOM 0 HA2 GLY A 174 10.757 2.704 11.198 1.00 0.00 H new ATOM 0 HA3 GLY A 174 11.311 4.158 10.390 1.00 0.00 H new ATOM 396 N VAL A 175 8.679 3.859 9.016 1.00 0.00 N ATOM 397 CA VAL A 175 7.328 4.337 8.798 1.00 0.00 C ATOM 398 C VAL A 175 6.364 3.176 8.656 1.00 0.00 C ATOM 399 O VAL A 175 6.691 2.138 8.079 1.00 0.00 O ATOM 400 CB VAL A 175 7.245 5.254 7.553 1.00 0.00 C ATOM 401 CG1 VAL A 175 6.007 4.991 6.714 1.00 0.00 C ATOM 402 CG2 VAL A 175 7.277 6.710 7.966 1.00 0.00 C ATOM 0 H VAL A 175 9.167 3.572 8.167 1.00 0.00 H new ATOM 0 HA VAL A 175 7.045 4.925 9.671 1.00 0.00 H new ATOM 0 HB VAL A 175 8.114 5.023 6.937 1.00 0.00 H new ATOM 0 HG11 VAL A 175 6.001 5.662 5.855 1.00 0.00 H new ATOM 0 HG12 VAL A 175 6.015 3.958 6.368 1.00 0.00 H new ATOM 0 HG13 VAL A 175 5.115 5.165 7.317 1.00 0.00 H new ATOM 0 HG21 VAL A 175 7.218 7.341 7.079 1.00 0.00 H new ATOM 0 HG22 VAL A 175 6.430 6.922 8.619 1.00 0.00 H new ATOM 0 HG23 VAL A 175 8.206 6.917 8.497 1.00 0.00 H new ATOM 412 N THR A 176 5.178 3.359 9.193 1.00 0.00 N ATOM 413 CA THR A 176 4.129 2.383 9.054 1.00 0.00 C ATOM 414 C THR A 176 3.448 2.554 7.708 1.00 0.00 C ATOM 415 O THR A 176 3.402 3.677 7.190 1.00 0.00 O ATOM 416 CB THR A 176 3.110 2.505 10.198 1.00 0.00 C ATOM 417 OG1 THR A 176 2.835 3.890 10.461 1.00 0.00 O ATOM 418 CG2 THR A 176 3.631 1.837 11.458 1.00 0.00 C ATOM 0 H THR A 176 4.918 4.184 9.734 1.00 0.00 H new ATOM 0 HA THR A 176 4.568 1.387 9.106 1.00 0.00 H new ATOM 0 HB THR A 176 2.191 2.003 9.895 1.00 0.00 H new ATOM 0 HG1 THR A 176 2.887 4.398 9.625 1.00 0.00 H new ATOM 0 HG21 THR A 176 2.893 1.936 12.254 1.00 0.00 H new ATOM 0 HG22 THR A 176 3.813 0.780 11.261 1.00 0.00 H new ATOM 0 HG23 THR A 176 4.562 2.314 11.765 1.00 0.00 H new ATOM 426 N VAL A 177 2.949 1.469 7.120 1.00 0.00 N ATOM 427 CA VAL A 177 2.353 1.541 5.801 1.00 0.00 C ATOM 428 C VAL A 177 1.342 2.682 5.738 1.00 0.00 C ATOM 429 O VAL A 177 1.210 3.330 4.716 1.00 0.00 O ATOM 430 CB VAL A 177 1.678 0.215 5.381 1.00 0.00 C ATOM 431 CG1 VAL A 177 2.666 -0.935 5.424 1.00 0.00 C ATOM 432 CG2 VAL A 177 0.466 -0.094 6.237 1.00 0.00 C ATOM 0 H VAL A 177 2.948 0.538 7.538 1.00 0.00 H new ATOM 0 HA VAL A 177 3.164 1.729 5.097 1.00 0.00 H new ATOM 0 HB VAL A 177 1.335 0.339 4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 177 2.166 -1.856 5.124 1.00 0.00 H new ATOM 0 HG12 VAL A 177 3.491 -0.732 4.741 1.00 0.00 H new ATOM 0 HG13 VAL A 177 3.052 -1.045 6.437 1.00 0.00 H new ATOM 0 HG21 VAL A 177 0.020 -1.033 5.910 1.00 0.00 H new ATOM 0 HG22 VAL A 177 0.770 -0.180 7.280 1.00 0.00 H new ATOM 0 HG23 VAL A 177 -0.264 0.709 6.137 1.00 0.00 H new ATOM 442 N ARG A 178 0.682 2.960 6.864 1.00 0.00 N ATOM 443 CA ARG A 178 -0.287 4.042 6.933 1.00 0.00 C ATOM 444 C ARG A 178 0.312 5.390 6.587 1.00 0.00 C ATOM 445 O ARG A 178 -0.309 6.143 5.875 1.00 0.00 O ATOM 446 CB ARG A 178 -0.954 4.122 8.302 1.00 0.00 C ATOM 447 CG ARG A 178 0.009 4.068 9.468 1.00 0.00 C ATOM 448 CD ARG A 178 -0.725 4.083 10.796 1.00 0.00 C ATOM 449 NE ARG A 178 0.187 3.910 11.922 1.00 0.00 N ATOM 450 CZ ARG A 178 -0.189 3.456 13.114 1.00 0.00 C ATOM 451 NH1 ARG A 178 -1.458 3.135 13.335 1.00 0.00 N ATOM 452 NH2 ARG A 178 0.705 3.319 14.083 1.00 0.00 N ATOM 0 H ARG A 178 0.805 2.448 7.737 1.00 0.00 H new ATOM 0 HA ARG A 178 -1.040 3.803 6.182 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -1.526 5.048 8.361 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -1.665 3.301 8.395 1.00 0.00 H new ATOM 0 HG2 ARG A 178 0.617 3.166 9.397 1.00 0.00 H new ATOM 0 HG3 ARG A 178 0.691 4.917 9.418 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -1.261 5.026 10.904 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -1.471 3.289 10.808 1.00 0.00 H new ATOM 0 HE ARG A 178 1.169 4.151 11.787 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -2.147 3.236 12.590 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -1.744 2.787 14.250 1.00 0.00 H new ATOM 0 HH21 ARG A 178 1.681 3.562 13.914 1.00 0.00 H new ATOM 0 HH22 ARG A 178 0.417 2.971 14.997 1.00 0.00 H new ATOM 466 N ASP A 179 1.497 5.711 7.082 1.00 0.00 N ATOM 467 CA ASP A 179 2.075 7.031 6.809 1.00 0.00 C ATOM 468 C ASP A 179 2.513 7.130 5.355 1.00 0.00 C ATOM 469 O ASP A 179 2.200 8.100 4.656 1.00 0.00 O ATOM 470 CB ASP A 179 3.257 7.323 7.735 1.00 0.00 C ATOM 471 CG ASP A 179 3.841 8.703 7.499 1.00 0.00 C ATOM 472 OD1 ASP A 179 4.802 8.822 6.710 1.00 0.00 O ATOM 473 OD2 ASP A 179 3.338 9.677 8.099 1.00 0.00 O ATOM 0 H ASP A 179 2.071 5.098 7.661 1.00 0.00 H new ATOM 0 HA ASP A 179 1.303 7.777 6.999 1.00 0.00 H new ATOM 0 HB2 ASP A 179 2.933 7.240 8.772 1.00 0.00 H new ATOM 0 HB3 ASP A 179 4.031 6.571 7.581 1.00 0.00 H new ATOM 478 N SER A 180 3.222 6.111 4.905 1.00 0.00 N ATOM 479 CA SER A 180 3.703 6.051 3.531 1.00 0.00 C ATOM 480 C SER A 180 2.539 6.030 2.530 1.00 0.00 C ATOM 481 O SER A 180 2.555 6.737 1.518 1.00 0.00 O ATOM 482 CB SER A 180 4.605 4.822 3.379 1.00 0.00 C ATOM 483 OG SER A 180 5.961 5.202 3.199 1.00 0.00 O ATOM 0 H SER A 180 3.481 5.305 5.475 1.00 0.00 H new ATOM 0 HA SER A 180 4.281 6.948 3.309 1.00 0.00 H new ATOM 0 HB2 SER A 180 4.516 4.190 4.263 1.00 0.00 H new ATOM 0 HB3 SER A 180 4.275 4.228 2.527 1.00 0.00 H new ATOM 0 HG SER A 180 6.266 4.916 2.313 1.00 0.00 H new ATOM 489 N LEU A 181 1.524 5.241 2.837 1.00 0.00 N ATOM 490 CA LEU A 181 0.327 5.138 2.006 1.00 0.00 C ATOM 491 C LEU A 181 -0.508 6.396 2.134 1.00 0.00 C ATOM 492 O LEU A 181 -1.110 6.844 1.168 1.00 0.00 O ATOM 493 CB LEU A 181 -0.513 3.935 2.434 1.00 0.00 C ATOM 494 CG LEU A 181 -0.082 2.568 1.891 1.00 0.00 C ATOM 495 CD1 LEU A 181 -0.863 2.256 0.637 1.00 0.00 C ATOM 496 CD2 LEU A 181 1.411 2.525 1.600 1.00 0.00 C ATOM 0 H LEU A 181 1.502 4.651 3.669 1.00 0.00 H new ATOM 0 HA LEU A 181 0.639 5.012 0.969 1.00 0.00 H new ATOM 0 HB2 LEU A 181 -0.508 3.886 3.523 1.00 0.00 H new ATOM 0 HB3 LEU A 181 -1.544 4.113 2.128 1.00 0.00 H new ATOM 0 HG LEU A 181 -0.291 1.818 2.653 1.00 0.00 H new ATOM 0 HD11 LEU A 181 -0.557 1.284 0.250 1.00 0.00 H new ATOM 0 HD12 LEU A 181 -1.928 2.236 0.867 1.00 0.00 H new ATOM 0 HD13 LEU A 181 -0.668 3.023 -0.113 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.679 1.540 1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 181 1.659 3.283 0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 181 1.966 2.721 2.517 1.00 0.00 H new ATOM 508 N LYS A 182 -0.537 6.959 3.337 1.00 0.00 N ATOM 509 CA LYS A 182 -1.314 8.167 3.605 1.00 0.00 C ATOM 510 C LYS A 182 -0.994 9.218 2.576 1.00 0.00 C ATOM 511 O LYS A 182 -1.885 9.844 2.028 1.00 0.00 O ATOM 512 CB LYS A 182 -1.033 8.729 5.003 1.00 0.00 C ATOM 513 CG LYS A 182 -2.223 8.644 5.948 1.00 0.00 C ATOM 514 CD LYS A 182 -1.893 9.207 7.320 1.00 0.00 C ATOM 515 CE LYS A 182 -1.155 8.188 8.168 1.00 0.00 C ATOM 516 NZ LYS A 182 -0.697 8.752 9.466 1.00 0.00 N ATOM 0 H LYS A 182 -0.030 6.598 4.145 1.00 0.00 H new ATOM 0 HA LYS A 182 -2.369 7.896 3.554 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -0.194 8.188 5.440 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -0.727 9.771 4.911 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -3.065 9.191 5.523 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -2.536 7.604 6.047 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -1.283 10.104 7.211 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -2.812 9.506 7.824 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -1.808 7.336 8.356 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -0.294 7.814 7.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -0.199 8.017 10.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -0.052 9.549 9.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -1.519 9.085 10.009 1.00 0.00 H new ATOM 530 N LYS A 183 0.286 9.381 2.304 1.00 0.00 N ATOM 531 CA LYS A 183 0.728 10.313 1.294 1.00 0.00 C ATOM 532 C LYS A 183 0.304 9.853 -0.092 1.00 0.00 C ATOM 533 O LYS A 183 -0.285 10.617 -0.843 1.00 0.00 O ATOM 534 CB LYS A 183 2.225 10.470 1.362 1.00 0.00 C ATOM 535 CG LYS A 183 2.718 11.630 0.560 1.00 0.00 C ATOM 536 CD LYS A 183 2.065 12.920 1.015 1.00 0.00 C ATOM 537 CE LYS A 183 2.057 13.063 2.528 1.00 0.00 C ATOM 538 NZ LYS A 183 1.657 14.427 2.952 1.00 0.00 N ATOM 0 H LYS A 183 1.038 8.876 2.772 1.00 0.00 H new ATOM 0 HA LYS A 183 0.260 11.279 1.485 1.00 0.00 H new ATOM 0 HB2 LYS A 183 2.526 10.598 2.402 1.00 0.00 H new ATOM 0 HB3 LYS A 183 2.699 9.557 1.002 1.00 0.00 H new ATOM 0 HG2 LYS A 183 3.800 11.711 0.659 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.506 11.463 -0.496 1.00 0.00 H new ATOM 0 HD2 LYS A 183 2.593 13.766 0.576 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.041 12.956 0.644 1.00 0.00 H new ATOM 0 HE2 LYS A 183 1.371 12.333 2.958 1.00 0.00 H new ATOM 0 HE3 LYS A 183 3.049 12.837 2.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 1.664 14.484 3.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 2.326 15.122 2.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 0.700 14.633 2.600 1.00 0.00 H new ATOM 552 N ALA A 184 0.616 8.606 -0.415 1.00 0.00 N ATOM 553 CA ALA A 184 0.202 7.990 -1.683 1.00 0.00 C ATOM 554 C ALA A 184 -1.263 8.305 -2.024 1.00 0.00 C ATOM 555 O ALA A 184 -1.564 8.810 -3.106 1.00 0.00 O ATOM 556 CB ALA A 184 0.422 6.480 -1.608 1.00 0.00 C ATOM 0 H ALA A 184 1.161 7.989 0.187 1.00 0.00 H new ATOM 0 HA ALA A 184 0.812 8.411 -2.482 1.00 0.00 H new ATOM 0 HB1 ALA A 184 0.116 6.021 -2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 184 1.478 6.274 -1.431 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -0.170 6.066 -0.792 1.00 0.00 H new ATOM 562 N LEU A 185 -2.164 8.010 -1.096 1.00 0.00 N ATOM 563 CA LEU A 185 -3.581 8.297 -1.259 1.00 0.00 C ATOM 564 C LEU A 185 -3.861 9.794 -1.224 1.00 0.00 C ATOM 565 O LEU A 185 -4.514 10.326 -2.116 1.00 0.00 O ATOM 566 CB LEU A 185 -4.396 7.598 -0.166 1.00 0.00 C ATOM 567 CG LEU A 185 -4.553 6.093 -0.345 1.00 0.00 C ATOM 568 CD1 LEU A 185 -3.447 5.321 0.341 1.00 0.00 C ATOM 569 CD2 LEU A 185 -5.912 5.635 0.150 1.00 0.00 C ATOM 0 H LEU A 185 -1.931 7.564 -0.208 1.00 0.00 H new ATOM 0 HA LEU A 185 -3.879 7.918 -2.237 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -3.922 7.787 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -5.387 8.050 -0.127 1.00 0.00 H new ATOM 0 HG LEU A 185 -4.479 5.884 -1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -3.599 4.253 0.187 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -2.484 5.614 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -3.459 5.539 1.409 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -6.005 4.558 0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -6.014 5.877 1.208 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -6.695 6.141 -0.415 1.00 0.00 H new ATOM 581 N MET A 186 -3.379 10.458 -0.185 1.00 0.00 N ATOM 582 CA MET A 186 -3.633 11.891 0.017 1.00 0.00 C ATOM 583 C MET A 186 -3.233 12.727 -1.198 1.00 0.00 C ATOM 584 O MET A 186 -3.929 13.681 -1.556 1.00 0.00 O ATOM 585 CB MET A 186 -2.906 12.417 1.261 1.00 0.00 C ATOM 586 CG MET A 186 -3.813 13.241 2.153 1.00 0.00 C ATOM 587 SD MET A 186 -3.401 13.110 3.903 1.00 0.00 S ATOM 588 CE MET A 186 -3.931 11.431 4.233 1.00 0.00 C ATOM 0 H MET A 186 -2.804 10.030 0.541 1.00 0.00 H new ATOM 0 HA MET A 186 -4.709 11.992 0.161 1.00 0.00 H new ATOM 0 HB2 MET A 186 -2.508 11.576 1.829 1.00 0.00 H new ATOM 0 HB3 MET A 186 -2.055 13.024 0.952 1.00 0.00 H new ATOM 0 HG2 MET A 186 -3.756 14.287 1.851 1.00 0.00 H new ATOM 0 HG3 MET A 186 -4.845 12.922 2.005 1.00 0.00 H new ATOM 0 HE1 MET A 186 -4.134 11.316 5.298 1.00 0.00 H new ATOM 0 HE2 MET A 186 -4.837 11.217 3.666 1.00 0.00 H new ATOM 0 HE3 MET A 186 -3.145 10.736 3.936 1.00 0.00 H new ATOM 598 N MET A 187 -2.127 12.364 -1.837 1.00 0.00 N ATOM 599 CA MET A 187 -1.648 13.091 -3.011 1.00 0.00 C ATOM 600 C MET A 187 -2.514 12.766 -4.219 1.00 0.00 C ATOM 601 O MET A 187 -2.499 13.473 -5.226 1.00 0.00 O ATOM 602 CB MET A 187 -0.189 12.738 -3.321 1.00 0.00 C ATOM 603 CG MET A 187 0.786 13.061 -2.200 1.00 0.00 C ATOM 604 SD MET A 187 2.508 12.896 -2.713 1.00 0.00 S ATOM 605 CE MET A 187 2.568 11.159 -3.153 1.00 0.00 C ATOM 0 H MET A 187 -1.545 11.572 -1.564 1.00 0.00 H new ATOM 0 HA MET A 187 -1.710 14.157 -2.792 1.00 0.00 H new ATOM 0 HB2 MET A 187 -0.125 11.673 -3.546 1.00 0.00 H new ATOM 0 HB3 MET A 187 0.119 13.273 -4.219 1.00 0.00 H new ATOM 0 HG2 MET A 187 0.610 14.079 -1.852 1.00 0.00 H new ATOM 0 HG3 MET A 187 0.597 12.398 -1.356 1.00 0.00 H new ATOM 0 HE1 MET A 187 3.562 10.764 -2.942 1.00 0.00 H new ATOM 0 HE2 MET A 187 1.828 10.610 -2.570 1.00 0.00 H new ATOM 0 HE3 MET A 187 2.350 11.045 -4.215 1.00 0.00 H new ATOM 615 N ARG A 188 -3.270 11.689 -4.099 1.00 0.00 N ATOM 616 CA ARG A 188 -4.117 11.204 -5.172 1.00 0.00 C ATOM 617 C ARG A 188 -5.587 11.498 -4.894 1.00 0.00 C ATOM 618 O ARG A 188 -6.477 10.981 -5.574 1.00 0.00 O ATOM 619 CB ARG A 188 -3.882 9.706 -5.358 1.00 0.00 C ATOM 620 CG ARG A 188 -2.605 9.420 -6.128 1.00 0.00 C ATOM 621 CD ARG A 188 -2.419 7.944 -6.424 1.00 0.00 C ATOM 622 NE ARG A 188 -1.179 7.714 -7.162 1.00 0.00 N ATOM 623 CZ ARG A 188 -1.108 7.140 -8.362 1.00 0.00 C ATOM 624 NH1 ARG A 188 -2.209 6.742 -8.987 1.00 0.00 N ATOM 625 NH2 ARG A 188 0.070 6.985 -8.950 1.00 0.00 N ATOM 0 H ARG A 188 -3.313 11.125 -3.251 1.00 0.00 H new ATOM 0 HA ARG A 188 -3.857 11.726 -6.093 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -3.832 9.223 -4.382 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -4.729 9.269 -5.887 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -2.619 9.976 -7.066 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -1.751 9.782 -5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -2.402 7.381 -5.491 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -3.266 7.575 -7.003 1.00 0.00 H new ATOM 0 HE ARG A 188 -0.306 8.014 -6.728 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -3.120 6.875 -8.549 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -2.144 6.304 -9.906 1.00 0.00 H new ATOM 0 HH21 ARG A 188 0.919 7.305 -8.484 1.00 0.00 H new ATOM 0 HH22 ARG A 188 0.128 6.546 -9.869 1.00 0.00 H new ATOM 639 N GLY A 189 -5.829 12.349 -3.901 1.00 0.00 N ATOM 640 CA GLY A 189 -7.186 12.713 -3.537 1.00 0.00 C ATOM 641 C GLY A 189 -7.938 11.554 -2.920 1.00 0.00 C ATOM 642 O GLY A 189 -9.125 11.362 -3.177 1.00 0.00 O ATOM 0 H GLY A 189 -5.104 12.795 -3.339 1.00 0.00 H new ATOM 0 HA2 GLY A 189 -7.162 13.545 -2.833 1.00 0.00 H new ATOM 0 HA3 GLY A 189 -7.718 13.060 -4.423 1.00 0.00 H new ATOM 646 N LEU A 190 -7.238 10.776 -2.111 1.00 0.00 N ATOM 647 CA LEU A 190 -7.799 9.582 -1.513 1.00 0.00 C ATOM 648 C LEU A 190 -7.506 9.540 -0.022 1.00 0.00 C ATOM 649 O LEU A 190 -6.571 10.184 0.454 1.00 0.00 O ATOM 650 CB LEU A 190 -7.207 8.355 -2.203 1.00 0.00 C ATOM 651 CG LEU A 190 -7.594 8.197 -3.671 1.00 0.00 C ATOM 652 CD1 LEU A 190 -6.581 7.342 -4.403 1.00 0.00 C ATOM 653 CD2 LEU A 190 -8.989 7.606 -3.796 1.00 0.00 C ATOM 0 H LEU A 190 -6.268 10.956 -1.853 1.00 0.00 H new ATOM 0 HA LEU A 190 -8.881 9.590 -1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -6.120 8.404 -2.132 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -7.522 7.463 -1.661 1.00 0.00 H new ATOM 0 HG LEU A 190 -7.600 9.185 -4.131 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -6.876 7.242 -5.448 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -5.599 7.812 -4.347 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -6.537 6.355 -3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -9.247 7.501 -4.850 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -9.014 6.627 -3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -9.708 8.265 -3.311 1.00 0.00 H new ATOM 665 N ILE A 191 -8.308 8.786 0.709 1.00 0.00 N ATOM 666 CA ILE A 191 -8.117 8.634 2.143 1.00 0.00 C ATOM 667 C ILE A 191 -7.933 7.171 2.526 1.00 0.00 C ATOM 668 O ILE A 191 -8.748 6.318 2.174 1.00 0.00 O ATOM 669 CB ILE A 191 -9.292 9.216 2.953 1.00 0.00 C ATOM 670 CG1 ILE A 191 -10.629 8.685 2.422 1.00 0.00 C ATOM 671 CG2 ILE A 191 -9.248 10.734 2.900 1.00 0.00 C ATOM 672 CD1 ILE A 191 -11.784 8.851 3.385 1.00 0.00 C ATOM 0 H ILE A 191 -9.101 8.267 0.332 1.00 0.00 H new ATOM 0 HA ILE A 191 -7.214 9.193 2.387 1.00 0.00 H new ATOM 0 HB ILE A 191 -9.200 8.901 3.992 1.00 0.00 H new ATOM 0 HG12 ILE A 191 -10.869 9.200 1.491 1.00 0.00 H new ATOM 0 HG13 ILE A 191 -10.519 7.627 2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 191 -10.080 11.142 3.474 1.00 0.00 H new ATOM 0 HG22 ILE A 191 -8.308 11.086 3.324 1.00 0.00 H new ATOM 0 HG23 ILE A 191 -9.325 11.064 1.864 1.00 0.00 H new ATOM 0 HD11 ILE A 191 -12.693 8.451 2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 191 -11.568 8.313 4.308 1.00 0.00 H new ATOM 0 HD13 ILE A 191 -11.924 9.909 3.606 1.00 0.00 H new ATOM 684 N PRO A 192 -6.850 6.862 3.261 1.00 0.00 N ATOM 685 CA PRO A 192 -6.566 5.501 3.726 1.00 0.00 C ATOM 686 C PRO A 192 -7.532 5.061 4.822 1.00 0.00 C ATOM 687 O PRO A 192 -7.600 3.882 5.169 1.00 0.00 O ATOM 688 CB PRO A 192 -5.140 5.589 4.288 1.00 0.00 C ATOM 689 CG PRO A 192 -4.615 6.918 3.864 1.00 0.00 C ATOM 690 CD PRO A 192 -5.809 7.806 3.685 1.00 0.00 C ATOM 0 HA PRO A 192 -6.673 4.771 2.923 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -5.142 5.498 5.374 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -4.517 4.782 3.902 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -3.937 7.325 4.614 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -4.050 6.834 2.935 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -6.077 8.316 4.610 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -5.632 8.577 2.936 1.00 0.00 H new ATOM 698 N GLU A 193 -8.272 6.024 5.358 1.00 0.00 N ATOM 699 CA GLU A 193 -9.228 5.777 6.431 1.00 0.00 C ATOM 700 C GLU A 193 -10.277 4.750 6.005 1.00 0.00 C ATOM 701 O GLU A 193 -10.642 3.858 6.774 1.00 0.00 O ATOM 702 CB GLU A 193 -9.904 7.096 6.817 1.00 0.00 C ATOM 703 CG GLU A 193 -10.919 6.973 7.940 1.00 0.00 C ATOM 704 CD GLU A 193 -11.526 8.307 8.314 1.00 0.00 C ATOM 705 OE1 GLU A 193 -10.922 9.031 9.131 1.00 0.00 O ATOM 706 OE2 GLU A 193 -12.607 8.645 7.789 1.00 0.00 O ATOM 0 H GLU A 193 -8.226 6.999 5.061 1.00 0.00 H new ATOM 0 HA GLU A 193 -8.695 5.372 7.292 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -9.136 7.811 7.113 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -10.400 7.507 5.938 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -11.711 6.288 7.637 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -10.438 6.537 8.816 1.00 0.00 H new ATOM 713 N CYS A 194 -10.737 4.870 4.772 1.00 0.00 N ATOM 714 CA CYS A 194 -11.766 3.993 4.249 1.00 0.00 C ATOM 715 C CYS A 194 -11.173 2.978 3.275 1.00 0.00 C ATOM 716 O CYS A 194 -11.807 2.600 2.290 1.00 0.00 O ATOM 717 CB CYS A 194 -12.836 4.837 3.559 1.00 0.00 C ATOM 718 SG CYS A 194 -13.708 5.965 4.670 1.00 0.00 S ATOM 0 H CYS A 194 -10.409 5.574 4.110 1.00 0.00 H new ATOM 0 HA CYS A 194 -12.215 3.437 5.072 1.00 0.00 H new ATOM 0 HB2 CYS A 194 -12.370 5.416 2.762 1.00 0.00 H new ATOM 0 HB3 CYS A 194 -13.561 4.173 3.089 1.00 0.00 H new ATOM 0 HG CYS A 194 -14.593 6.639 3.997 1.00 0.00 H new ATOM 724 N CYS A 195 -9.951 2.539 3.554 1.00 0.00 N ATOM 725 CA CYS A 195 -9.252 1.604 2.680 1.00 0.00 C ATOM 726 C CYS A 195 -8.394 0.639 3.492 1.00 0.00 C ATOM 727 O CYS A 195 -8.147 0.862 4.678 1.00 0.00 O ATOM 728 CB CYS A 195 -8.382 2.372 1.687 1.00 0.00 C ATOM 729 SG CYS A 195 -9.306 3.496 0.610 1.00 0.00 S ATOM 0 H CYS A 195 -9.422 2.817 4.381 1.00 0.00 H new ATOM 0 HA CYS A 195 -9.994 1.023 2.133 1.00 0.00 H new ATOM 0 HB2 CYS A 195 -7.638 2.945 2.240 1.00 0.00 H new ATOM 0 HB3 CYS A 195 -7.839 1.658 1.068 1.00 0.00 H new ATOM 0 HG CYS A 195 -9.214 4.709 1.068 1.00 0.00 H new ATOM 735 N ALA A 196 -7.962 -0.440 2.852 1.00 0.00 N ATOM 736 CA ALA A 196 -7.072 -1.404 3.482 1.00 0.00 C ATOM 737 C ALA A 196 -6.010 -1.865 2.501 1.00 0.00 C ATOM 738 O ALA A 196 -6.180 -1.736 1.290 1.00 0.00 O ATOM 739 CB ALA A 196 -7.853 -2.597 4.005 1.00 0.00 C ATOM 0 H ALA A 196 -8.216 -0.669 1.891 1.00 0.00 H new ATOM 0 HA ALA A 196 -6.584 -0.915 4.325 1.00 0.00 H new ATOM 0 HB1 ALA A 196 -7.167 -3.304 4.472 1.00 0.00 H new ATOM 0 HB2 ALA A 196 -8.583 -2.260 4.741 1.00 0.00 H new ATOM 0 HB3 ALA A 196 -8.370 -3.084 3.178 1.00 0.00 H new ATOM 745 N VAL A 197 -4.922 -2.405 3.031 1.00 0.00 N ATOM 746 CA VAL A 197 -3.801 -2.827 2.207 1.00 0.00 C ATOM 747 C VAL A 197 -3.711 -4.350 2.168 1.00 0.00 C ATOM 748 O VAL A 197 -3.956 -5.014 3.171 1.00 0.00 O ATOM 749 CB VAL A 197 -2.468 -2.252 2.736 1.00 0.00 C ATOM 750 CG1 VAL A 197 -1.341 -2.492 1.750 1.00 0.00 C ATOM 751 CG2 VAL A 197 -2.605 -0.773 3.045 1.00 0.00 C ATOM 0 H VAL A 197 -4.793 -2.561 4.031 1.00 0.00 H new ATOM 0 HA VAL A 197 -3.973 -2.445 1.201 1.00 0.00 H new ATOM 0 HB VAL A 197 -2.222 -2.773 3.661 1.00 0.00 H new ATOM 0 HG11 VAL A 197 -0.415 -2.077 2.148 1.00 0.00 H new ATOM 0 HG12 VAL A 197 -1.219 -3.563 1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 197 -1.578 -2.008 0.802 1.00 0.00 H new ATOM 0 HG21 VAL A 197 -1.655 -0.389 3.416 1.00 0.00 H new ATOM 0 HG22 VAL A 197 -2.884 -0.236 2.138 1.00 0.00 H new ATOM 0 HG23 VAL A 197 -3.375 -0.629 3.803 1.00 0.00 H new ATOM 761 N TYR A 198 -3.389 -4.892 1.004 1.00 0.00 N ATOM 762 CA TYR A 198 -3.211 -6.331 0.837 1.00 0.00 C ATOM 763 C TYR A 198 -1.946 -6.612 0.041 1.00 0.00 C ATOM 764 O TYR A 198 -1.630 -5.887 -0.893 1.00 0.00 O ATOM 765 CB TYR A 198 -4.378 -6.951 0.057 1.00 0.00 C ATOM 766 CG TYR A 198 -5.743 -6.801 0.683 1.00 0.00 C ATOM 767 CD1 TYR A 198 -6.378 -7.897 1.238 1.00 0.00 C ATOM 768 CD2 TYR A 198 -6.406 -5.580 0.696 1.00 0.00 C ATOM 769 CE1 TYR A 198 -7.635 -7.790 1.790 1.00 0.00 C ATOM 770 CE2 TYR A 198 -7.662 -5.460 1.253 1.00 0.00 C ATOM 771 CZ TYR A 198 -8.273 -6.569 1.798 1.00 0.00 C ATOM 772 OH TYR A 198 -9.533 -6.458 2.337 1.00 0.00 O ATOM 0 H TYR A 198 -3.244 -4.352 0.151 1.00 0.00 H new ATOM 0 HA TYR A 198 -3.156 -6.763 1.836 1.00 0.00 H new ATOM 0 HB2 TYR A 198 -4.404 -6.503 -0.937 1.00 0.00 H new ATOM 0 HB3 TYR A 198 -4.176 -8.014 -0.077 1.00 0.00 H new ATOM 0 HD1 TYR A 198 -5.879 -8.855 1.239 1.00 0.00 H new ATOM 0 HD2 TYR A 198 -5.931 -4.712 0.263 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -8.118 -8.658 2.214 1.00 0.00 H new ATOM 0 HE2 TYR A 198 -8.163 -4.504 1.262 1.00 0.00 H new ATOM 0 HH TYR A 198 -9.839 -5.530 2.264 1.00 0.00 H new ATOM 782 N ARG A 199 -1.232 -7.661 0.392 1.00 0.00 N ATOM 783 CA ARG A 199 -0.192 -8.170 -0.483 1.00 0.00 C ATOM 784 C ARG A 199 -0.681 -9.485 -1.069 1.00 0.00 C ATOM 785 O ARG A 199 -0.975 -10.428 -0.343 1.00 0.00 O ATOM 786 CB ARG A 199 1.164 -8.327 0.238 1.00 0.00 C ATOM 787 CG ARG A 199 1.205 -9.367 1.347 1.00 0.00 C ATOM 788 CD ARG A 199 2.515 -9.275 2.122 1.00 0.00 C ATOM 789 NE ARG A 199 3.665 -9.763 1.360 1.00 0.00 N ATOM 790 CZ ARG A 199 4.717 -10.371 1.910 1.00 0.00 C ATOM 791 NH1 ARG A 199 4.768 -10.579 3.221 1.00 0.00 N ATOM 792 NH2 ARG A 199 5.725 -10.761 1.142 1.00 0.00 N ATOM 0 H ARG A 199 -1.349 -8.174 1.266 1.00 0.00 H new ATOM 0 HA ARG A 199 -0.006 -7.452 -1.281 1.00 0.00 H new ATOM 0 HB2 ARG A 199 1.921 -8.583 -0.503 1.00 0.00 H new ATOM 0 HB3 ARG A 199 1.444 -7.362 0.660 1.00 0.00 H new ATOM 0 HG2 ARG A 199 0.364 -9.217 2.024 1.00 0.00 H new ATOM 0 HG3 ARG A 199 1.097 -10.365 0.921 1.00 0.00 H new ATOM 0 HD2 ARG A 199 2.689 -8.238 2.408 1.00 0.00 H new ATOM 0 HD3 ARG A 199 2.427 -9.850 3.044 1.00 0.00 H new ATOM 0 HE ARG A 199 3.662 -9.630 0.349 1.00 0.00 H new ATOM 0 HH11 ARG A 199 3.998 -10.273 3.816 1.00 0.00 H new ATOM 0 HH12 ARG A 199 5.577 -11.045 3.632 1.00 0.00 H new ATOM 0 HH21 ARG A 199 5.693 -10.596 0.136 1.00 0.00 H new ATOM 0 HH22 ARG A 199 6.532 -11.226 1.557 1.00 0.00 H new ATOM 876 N LYS A 205 -5.504 -12.622 -1.293 1.00 0.00 N ATOM 877 CA LYS A 205 -5.461 -11.267 -0.794 1.00 0.00 C ATOM 878 C LYS A 205 -5.045 -11.301 0.662 1.00 0.00 C ATOM 879 O LYS A 205 -5.858 -11.564 1.543 1.00 0.00 O ATOM 880 CB LYS A 205 -6.815 -10.577 -0.944 1.00 0.00 C ATOM 881 CG LYS A 205 -7.364 -10.590 -2.350 1.00 0.00 C ATOM 882 CD LYS A 205 -8.576 -9.695 -2.485 1.00 0.00 C ATOM 883 CE LYS A 205 -8.195 -8.232 -2.650 1.00 0.00 C ATOM 884 NZ LYS A 205 -9.394 -7.370 -2.835 1.00 0.00 N ATOM 0 HA LYS A 205 -4.739 -10.695 -1.376 1.00 0.00 H new ATOM 0 HB2 LYS A 205 -7.532 -11.061 -0.281 1.00 0.00 H new ATOM 0 HB3 LYS A 205 -6.722 -9.543 -0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 205 -6.591 -10.263 -3.046 1.00 0.00 H new ATOM 0 HG3 LYS A 205 -7.632 -11.610 -2.627 1.00 0.00 H new ATOM 0 HD2 LYS A 205 -9.167 -10.014 -3.344 1.00 0.00 H new ATOM 0 HD3 LYS A 205 -9.208 -9.807 -1.604 1.00 0.00 H new ATOM 0 HE2 LYS A 205 -7.639 -7.899 -1.773 1.00 0.00 H new ATOM 0 HE3 LYS A 205 -7.532 -8.123 -3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 205 -9.110 -6.470 -3.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 205 -10.078 -7.854 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 205 -9.833 -7.183 -1.911 1.00 0.00 H new ATOM 898 N LYS A 206 -3.766 -11.077 0.896 1.00 0.00 N ATOM 899 CA LYS A 206 -3.201 -11.161 2.230 1.00 0.00 C ATOM 900 C LYS A 206 -3.189 -9.779 2.870 1.00 0.00 C ATOM 901 O LYS A 206 -2.305 -8.971 2.586 1.00 0.00 O ATOM 902 CB LYS A 206 -1.790 -11.724 2.136 1.00 0.00 C ATOM 903 CG LYS A 206 -1.338 -12.464 3.375 1.00 0.00 C ATOM 904 CD LYS A 206 -2.253 -13.634 3.720 1.00 0.00 C ATOM 905 CE LYS A 206 -2.274 -14.684 2.619 1.00 0.00 C ATOM 906 NZ LYS A 206 -3.193 -15.806 2.944 1.00 0.00 N ATOM 0 H LYS A 206 -3.092 -10.833 0.171 1.00 0.00 H new ATOM 0 HA LYS A 206 -3.806 -11.821 2.852 1.00 0.00 H new ATOM 0 HB2 LYS A 206 -1.736 -12.399 1.282 1.00 0.00 H new ATOM 0 HB3 LYS A 206 -1.096 -10.906 1.940 1.00 0.00 H new ATOM 0 HG2 LYS A 206 -0.323 -12.832 3.225 1.00 0.00 H new ATOM 0 HG3 LYS A 206 -1.305 -11.772 4.216 1.00 0.00 H new ATOM 0 HD2 LYS A 206 -1.921 -14.092 4.652 1.00 0.00 H new ATOM 0 HD3 LYS A 206 -3.265 -13.266 3.889 1.00 0.00 H new ATOM 0 HE2 LYS A 206 -2.582 -14.221 1.681 1.00 0.00 H new ATOM 0 HE3 LYS A 206 -1.267 -15.072 2.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 206 -3.180 -16.501 2.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 206 -2.884 -16.264 3.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 206 -4.159 -15.440 3.064 1.00 0.00 H new ATOM 920 N PRO A 207 -4.179 -9.479 3.727 1.00 0.00 N ATOM 921 CA PRO A 207 -4.343 -8.145 4.305 1.00 0.00 C ATOM 922 C PRO A 207 -3.164 -7.727 5.169 1.00 0.00 C ATOM 923 O PRO A 207 -2.642 -8.510 5.970 1.00 0.00 O ATOM 924 CB PRO A 207 -5.611 -8.254 5.151 1.00 0.00 C ATOM 925 CG PRO A 207 -6.302 -9.475 4.655 1.00 0.00 C ATOM 926 CD PRO A 207 -5.212 -10.406 4.211 1.00 0.00 C ATOM 0 HA PRO A 207 -4.405 -7.386 3.526 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -5.372 -8.339 6.211 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -6.239 -7.371 5.036 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -6.908 -9.928 5.440 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -6.974 -9.237 3.830 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -4.849 -11.026 5.031 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -5.551 -11.082 3.426 1.00 0.00 H new ATOM 934 N ILE A 208 -2.751 -6.490 4.980 1.00 0.00 N ATOM 935 CA ILE A 208 -1.657 -5.909 5.724 1.00 0.00 C ATOM 936 C ILE A 208 -2.200 -5.078 6.871 1.00 0.00 C ATOM 937 O ILE A 208 -3.328 -4.583 6.815 1.00 0.00 O ATOM 938 CB ILE A 208 -0.805 -4.988 4.825 1.00 0.00 C ATOM 939 CG1 ILE A 208 -0.489 -5.672 3.498 1.00 0.00 C ATOM 940 CG2 ILE A 208 0.479 -4.570 5.523 1.00 0.00 C ATOM 941 CD1 ILE A 208 0.201 -7.008 3.643 1.00 0.00 C ATOM 0 H ILE A 208 -3.170 -5.856 4.300 1.00 0.00 H new ATOM 0 HA ILE A 208 -1.038 -6.725 6.099 1.00 0.00 H new ATOM 0 HB ILE A 208 -1.388 -4.089 4.624 1.00 0.00 H new ATOM 0 HG12 ILE A 208 -1.417 -5.812 2.944 1.00 0.00 H new ATOM 0 HG13 ILE A 208 0.141 -5.012 2.902 1.00 0.00 H new ATOM 0 HG21 ILE A 208 1.057 -3.922 4.864 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.236 -4.032 6.439 1.00 0.00 H new ATOM 0 HG23 ILE A 208 1.066 -5.456 5.767 1.00 0.00 H new ATOM 0 HD11 ILE A 208 0.391 -7.429 2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 208 1.147 -6.874 4.168 1.00 0.00 H new ATOM 0 HD13 ILE A 208 -0.436 -7.687 4.210 1.00 0.00 H new ATOM 953 N GLY A 209 -1.399 -4.928 7.901 1.00 0.00 N ATOM 954 CA GLY A 209 -1.760 -4.062 8.995 1.00 0.00 C ATOM 955 C GLY A 209 -1.284 -2.655 8.730 1.00 0.00 C ATOM 956 O GLY A 209 -0.146 -2.459 8.312 1.00 0.00 O ATOM 0 H GLY A 209 -0.497 -5.393 8.002 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -2.842 -4.068 9.130 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -1.321 -4.433 9.921 1.00 0.00 H new ATOM 960 N TRP A 210 -2.140 -1.671 8.957 1.00 0.00 N ATOM 961 CA TRP A 210 -1.777 -0.287 8.687 1.00 0.00 C ATOM 962 C TRP A 210 -0.639 0.169 9.602 1.00 0.00 C ATOM 963 O TRP A 210 0.120 1.072 9.258 1.00 0.00 O ATOM 964 CB TRP A 210 -2.988 0.643 8.827 1.00 0.00 C ATOM 965 CG TRP A 210 -3.943 0.587 7.669 1.00 0.00 C ATOM 966 CD1 TRP A 210 -5.130 -0.081 7.617 1.00 0.00 C ATOM 967 CD2 TRP A 210 -3.793 1.235 6.400 1.00 0.00 C ATOM 968 NE1 TRP A 210 -5.734 0.128 6.400 1.00 0.00 N ATOM 969 CE2 TRP A 210 -4.928 0.928 5.632 1.00 0.00 C ATOM 970 CE3 TRP A 210 -2.809 2.046 5.845 1.00 0.00 C ATOM 971 CZ2 TRP A 210 -5.105 1.411 4.333 1.00 0.00 C ATOM 972 CZ3 TRP A 210 -2.981 2.525 4.555 1.00 0.00 C ATOM 973 CH2 TRP A 210 -4.122 2.207 3.814 1.00 0.00 C ATOM 0 H TRP A 210 -3.083 -1.802 9.324 1.00 0.00 H new ATOM 0 HA TRP A 210 -1.429 -0.233 7.655 1.00 0.00 H new ATOM 0 HB2 TRP A 210 -3.526 0.386 9.740 1.00 0.00 H new ATOM 0 HB3 TRP A 210 -2.634 1.667 8.943 1.00 0.00 H new ATOM 0 HD1 TRP A 210 -5.536 -0.685 8.415 1.00 0.00 H new ATOM 0 HE1 TRP A 210 -6.637 -0.251 6.114 1.00 0.00 H new ATOM 0 HE3 TRP A 210 -1.924 2.299 6.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 210 -5.986 1.165 3.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 210 -2.221 3.154 4.116 1.00 0.00 H new ATOM 0 HH2 TRP A 210 -4.229 2.597 2.813 1.00 0.00 H new ATOM 984 N ASP A 211 -0.506 -0.478 10.755 1.00 0.00 N ATOM 985 CA ASP A 211 0.572 -0.157 11.688 1.00 0.00 C ATOM 986 C ASP A 211 1.783 -1.055 11.463 1.00 0.00 C ATOM 987 O ASP A 211 2.683 -1.127 12.301 1.00 0.00 O ATOM 988 CB ASP A 211 0.107 -0.276 13.138 1.00 0.00 C ATOM 989 CG ASP A 211 -0.275 -1.693 13.521 1.00 0.00 C ATOM 990 OD1 ASP A 211 -1.393 -2.128 13.172 1.00 0.00 O ATOM 991 OD2 ASP A 211 0.533 -2.377 14.183 1.00 0.00 O ATOM 0 H ASP A 211 -1.127 -1.225 11.066 1.00 0.00 H new ATOM 0 HA ASP A 211 0.861 0.877 11.498 1.00 0.00 H new ATOM 0 HB2 ASP A 211 0.901 0.072 13.799 1.00 0.00 H new ATOM 0 HB3 ASP A 211 -0.749 0.381 13.295 1.00 0.00 H new ATOM 996 N THR A 212 1.799 -1.741 10.337 1.00 0.00 N ATOM 997 CA THR A 212 2.951 -2.526 9.944 1.00 0.00 C ATOM 998 C THR A 212 3.918 -1.645 9.159 1.00 0.00 C ATOM 999 O THR A 212 3.491 -0.743 8.445 1.00 0.00 O ATOM 1000 CB THR A 212 2.522 -3.728 9.082 1.00 0.00 C ATOM 1001 OG1 THR A 212 1.599 -4.541 9.820 1.00 0.00 O ATOM 1002 CG2 THR A 212 3.723 -4.561 8.668 1.00 0.00 C ATOM 0 H THR A 212 1.023 -1.770 9.676 1.00 0.00 H new ATOM 0 HA THR A 212 3.442 -2.904 10.840 1.00 0.00 H new ATOM 0 HB THR A 212 2.042 -3.351 8.179 1.00 0.00 H new ATOM 0 HG1 THR A 212 1.325 -5.305 9.271 1.00 0.00 H new ATOM 0 HG21 THR A 212 3.390 -5.403 8.061 1.00 0.00 H new ATOM 0 HG22 THR A 212 4.411 -3.945 8.089 1.00 0.00 H new ATOM 0 HG23 THR A 212 4.231 -4.934 9.557 1.00 0.00 H new ATOM 1010 N ASP A 213 5.211 -1.882 9.316 1.00 0.00 N ATOM 1011 CA ASP A 213 6.217 -1.100 8.613 1.00 0.00 C ATOM 1012 C ASP A 213 6.234 -1.482 7.134 1.00 0.00 C ATOM 1013 O ASP A 213 6.237 -2.664 6.795 1.00 0.00 O ATOM 1014 CB ASP A 213 7.600 -1.338 9.230 1.00 0.00 C ATOM 1015 CG ASP A 213 8.631 -0.313 8.794 1.00 0.00 C ATOM 1016 OD1 ASP A 213 9.228 0.347 9.676 1.00 0.00 O ATOM 1017 OD2 ASP A 213 8.854 -0.163 7.581 1.00 0.00 O ATOM 0 H ASP A 213 5.589 -2.609 9.924 1.00 0.00 H new ATOM 0 HA ASP A 213 5.968 -0.043 8.706 1.00 0.00 H new ATOM 0 HB2 ASP A 213 7.515 -1.319 10.316 1.00 0.00 H new ATOM 0 HB3 ASP A 213 7.948 -2.334 8.955 1.00 0.00 H new ATOM 1022 N ILE A 214 6.264 -0.476 6.261 1.00 0.00 N ATOM 1023 CA ILE A 214 6.192 -0.703 4.815 1.00 0.00 C ATOM 1024 C ILE A 214 7.473 -1.355 4.300 1.00 0.00 C ATOM 1025 O ILE A 214 7.493 -1.947 3.220 1.00 0.00 O ATOM 1026 CB ILE A 214 5.846 0.604 4.020 1.00 0.00 C ATOM 1027 CG1 ILE A 214 6.729 0.781 2.769 1.00 0.00 C ATOM 1028 CG2 ILE A 214 5.915 1.844 4.899 1.00 0.00 C ATOM 1029 CD1 ILE A 214 6.611 2.151 2.120 1.00 0.00 C ATOM 0 H ILE A 214 6.338 0.506 6.528 1.00 0.00 H new ATOM 0 HA ILE A 214 5.369 -1.395 4.639 1.00 0.00 H new ATOM 0 HB ILE A 214 4.816 0.485 3.685 1.00 0.00 H new ATOM 0 HG12 ILE A 214 7.770 0.608 3.044 1.00 0.00 H new ATOM 0 HG13 ILE A 214 6.462 0.019 2.037 1.00 0.00 H new ATOM 0 HG21 ILE A 214 5.668 2.725 4.306 1.00 0.00 H new ATOM 0 HG22 ILE A 214 5.204 1.748 5.720 1.00 0.00 H new ATOM 0 HG23 ILE A 214 6.922 1.949 5.302 1.00 0.00 H new ATOM 0 HD11 ILE A 214 7.262 2.197 1.247 1.00 0.00 H new ATOM 0 HD12 ILE A 214 5.579 2.320 1.813 1.00 0.00 H new ATOM 0 HD13 ILE A 214 6.907 2.919 2.835 1.00 0.00 H new ATOM 1041 N SER A 215 8.525 -1.296 5.103 1.00 0.00 N ATOM 1042 CA SER A 215 9.784 -1.937 4.761 1.00 0.00 C ATOM 1043 C SER A 215 9.630 -3.460 4.744 1.00 0.00 C ATOM 1044 O SER A 215 10.431 -4.170 4.136 1.00 0.00 O ATOM 1045 CB SER A 215 10.861 -1.517 5.756 1.00 0.00 C ATOM 1046 OG SER A 215 10.840 -0.121 5.926 1.00 0.00 O ATOM 0 H SER A 215 8.530 -0.809 5.999 1.00 0.00 H new ATOM 0 HA SER A 215 10.081 -1.619 3.762 1.00 0.00 H new ATOM 0 HB2 SER A 215 10.696 -2.011 6.714 1.00 0.00 H new ATOM 0 HB3 SER A 215 11.841 -1.834 5.399 1.00 0.00 H new ATOM 0 HG SER A 215 10.224 0.111 6.652 1.00 0.00 H new ATOM 1052 N TRP A 216 8.586 -3.956 5.403 1.00 0.00 N ATOM 1053 CA TRP A 216 8.286 -5.386 5.394 1.00 0.00 C ATOM 1054 C TRP A 216 7.672 -5.775 4.060 1.00 0.00 C ATOM 1055 O TRP A 216 7.724 -6.930 3.640 1.00 0.00 O ATOM 1056 CB TRP A 216 7.310 -5.743 6.520 1.00 0.00 C ATOM 1057 CG TRP A 216 7.865 -5.512 7.897 1.00 0.00 C ATOM 1058 CD1 TRP A 216 8.956 -4.763 8.231 1.00 0.00 C ATOM 1059 CD2 TRP A 216 7.352 -6.041 9.124 1.00 0.00 C ATOM 1060 NE1 TRP A 216 9.153 -4.795 9.588 1.00 0.00 N ATOM 1061 CE2 TRP A 216 8.181 -5.570 10.159 1.00 0.00 C ATOM 1062 CE3 TRP A 216 6.271 -6.863 9.447 1.00 0.00 C ATOM 1063 CZ2 TRP A 216 7.961 -5.896 11.492 1.00 0.00 C ATOM 1064 CZ3 TRP A 216 6.055 -7.187 10.773 1.00 0.00 C ATOM 1065 CH2 TRP A 216 6.897 -6.702 11.781 1.00 0.00 C ATOM 0 H TRP A 216 7.935 -3.391 5.949 1.00 0.00 H new ATOM 0 HA TRP A 216 9.217 -5.932 5.547 1.00 0.00 H new ATOM 0 HB2 TRP A 216 6.401 -5.154 6.401 1.00 0.00 H new ATOM 0 HB3 TRP A 216 7.026 -6.791 6.424 1.00 0.00 H new ATOM 0 HD1 TRP A 216 9.574 -4.224 7.529 1.00 0.00 H new ATOM 0 HE1 TRP A 216 9.902 -4.318 10.090 1.00 0.00 H new ATOM 0 HE3 TRP A 216 5.616 -7.239 8.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 8.609 -5.525 12.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 5.224 -7.824 11.036 1.00 0.00 H new ATOM 0 HH2 TRP A 216 6.701 -6.971 12.808 1.00 0.00 H new ATOM 1076 N LEU A 217 7.089 -4.787 3.406 1.00 0.00 N ATOM 1077 CA LEU A 217 6.381 -4.990 2.160 1.00 0.00 C ATOM 1078 C LEU A 217 7.182 -4.374 1.017 1.00 0.00 C ATOM 1079 O LEU A 217 6.629 -4.012 -0.021 1.00 0.00 O ATOM 1080 CB LEU A 217 4.981 -4.348 2.225 1.00 0.00 C ATOM 1081 CG LEU A 217 4.038 -4.827 3.348 1.00 0.00 C ATOM 1082 CD1 LEU A 217 3.785 -6.317 3.244 1.00 0.00 C ATOM 1083 CD2 LEU A 217 4.546 -4.455 4.728 1.00 0.00 C ATOM 0 H LEU A 217 7.095 -3.819 3.727 1.00 0.00 H new ATOM 0 HA LEU A 217 6.263 -6.060 1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 217 5.108 -3.270 2.327 1.00 0.00 H new ATOM 0 HB3 LEU A 217 4.485 -4.522 1.270 1.00 0.00 H new ATOM 0 HG LEU A 217 3.090 -4.307 3.210 1.00 0.00 H new ATOM 0 HD11 LEU A 217 3.117 -6.630 4.047 1.00 0.00 H new ATOM 0 HD12 LEU A 217 3.325 -6.542 2.282 1.00 0.00 H new ATOM 0 HD13 LEU A 217 4.730 -6.853 3.329 1.00 0.00 H new ATOM 0 HD21 LEU A 217 3.846 -4.815 5.482 1.00 0.00 H new ATOM 0 HD22 LEU A 217 5.522 -4.911 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 217 4.635 -3.371 4.803 1.00 0.00 H new ATOM 1095 N THR A 218 8.488 -4.245 1.232 1.00 0.00 N ATOM 1096 CA THR A 218 9.389 -3.652 0.255 1.00 0.00 C ATOM 1097 C THR A 218 9.287 -4.333 -1.098 1.00 0.00 C ATOM 1098 O THR A 218 9.615 -5.508 -1.255 1.00 0.00 O ATOM 1099 CB THR A 218 10.855 -3.711 0.733 1.00 0.00 C ATOM 1100 OG1 THR A 218 11.036 -2.887 1.889 1.00 0.00 O ATOM 1101 CG2 THR A 218 11.812 -3.270 -0.368 1.00 0.00 C ATOM 0 H THR A 218 8.949 -4.549 2.089 1.00 0.00 H new ATOM 0 HA THR A 218 9.082 -2.611 0.150 1.00 0.00 H new ATOM 0 HB THR A 218 11.079 -4.746 0.990 1.00 0.00 H new ATOM 0 HG1 THR A 218 11.069 -3.450 2.690 1.00 0.00 H new ATOM 0 HG21 THR A 218 12.837 -3.322 -0.001 1.00 0.00 H new ATOM 0 HG22 THR A 218 11.701 -3.927 -1.231 1.00 0.00 H new ATOM 0 HG23 THR A 218 11.583 -2.245 -0.660 1.00 0.00 H new ATOM 1109 N GLY A 219 8.810 -3.575 -2.062 1.00 0.00 N ATOM 1110 CA GLY A 219 8.784 -4.032 -3.423 1.00 0.00 C ATOM 1111 C GLY A 219 7.570 -4.878 -3.738 1.00 0.00 C ATOM 1112 O GLY A 219 7.378 -5.306 -4.878 1.00 0.00 O ATOM 0 H GLY A 219 8.435 -2.637 -1.921 1.00 0.00 H new ATOM 0 HA2 GLY A 219 8.803 -3.170 -4.090 1.00 0.00 H new ATOM 0 HA3 GLY A 219 9.686 -4.611 -3.624 1.00 0.00 H new ATOM 1116 N GLU A 220 6.753 -5.123 -2.728 1.00 0.00 N ATOM 1117 CA GLU A 220 5.532 -5.890 -2.897 1.00 0.00 C ATOM 1118 C GLU A 220 4.487 -5.054 -3.605 1.00 0.00 C ATOM 1119 O GLU A 220 4.557 -3.825 -3.599 1.00 0.00 O ATOM 1120 CB GLU A 220 4.994 -6.329 -1.535 1.00 0.00 C ATOM 1121 CG GLU A 220 5.876 -7.345 -0.827 1.00 0.00 C ATOM 1122 CD GLU A 220 5.942 -8.666 -1.563 1.00 0.00 C ATOM 1123 OE1 GLU A 220 5.216 -9.603 -1.180 1.00 0.00 O ATOM 1124 OE2 GLU A 220 6.711 -8.775 -2.541 1.00 0.00 O ATOM 0 H GLU A 220 6.916 -4.798 -1.775 1.00 0.00 H new ATOM 0 HA GLU A 220 5.756 -6.772 -3.497 1.00 0.00 H new ATOM 0 HB2 GLU A 220 4.883 -5.451 -0.898 1.00 0.00 H new ATOM 0 HB3 GLU A 220 3.999 -6.755 -1.667 1.00 0.00 H new ATOM 0 HG2 GLU A 220 6.882 -6.939 -0.724 1.00 0.00 H new ATOM 0 HG3 GLU A 220 5.495 -7.512 0.181 1.00 0.00 H new ATOM 1131 N GLU A 221 3.536 -5.711 -4.237 1.00 0.00 N ATOM 1132 CA GLU A 221 2.398 -5.007 -4.776 1.00 0.00 C ATOM 1133 C GLU A 221 1.318 -4.947 -3.708 1.00 0.00 C ATOM 1134 O GLU A 221 0.683 -5.956 -3.389 1.00 0.00 O ATOM 1135 CB GLU A 221 1.884 -5.702 -6.035 1.00 0.00 C ATOM 1136 CG GLU A 221 2.940 -5.823 -7.117 1.00 0.00 C ATOM 1137 CD GLU A 221 2.421 -6.469 -8.378 1.00 0.00 C ATOM 1138 OE1 GLU A 221 2.007 -7.648 -8.327 1.00 0.00 O ATOM 1139 OE2 GLU A 221 2.443 -5.806 -9.433 1.00 0.00 O ATOM 0 H GLU A 221 3.530 -6.720 -4.387 1.00 0.00 H new ATOM 0 HA GLU A 221 2.687 -3.995 -5.058 1.00 0.00 H new ATOM 0 HB2 GLU A 221 1.524 -6.697 -5.773 1.00 0.00 H new ATOM 0 HB3 GLU A 221 1.031 -5.148 -6.427 1.00 0.00 H new ATOM 0 HG2 GLU A 221 3.324 -4.831 -7.355 1.00 0.00 H new ATOM 0 HG3 GLU A 221 3.778 -6.406 -6.735 1.00 0.00 H new ATOM 1146 N LEU A 222 1.111 -3.764 -3.164 1.00 0.00 N ATOM 1147 CA LEU A 222 0.189 -3.587 -2.065 1.00 0.00 C ATOM 1148 C LEU A 222 -1.114 -2.988 -2.557 1.00 0.00 C ATOM 1149 O LEU A 222 -1.183 -1.830 -2.950 1.00 0.00 O ATOM 1150 CB LEU A 222 0.818 -2.731 -0.966 1.00 0.00 C ATOM 1151 CG LEU A 222 2.033 -3.339 -0.270 1.00 0.00 C ATOM 1152 CD1 LEU A 222 2.550 -2.399 0.807 1.00 0.00 C ATOM 1153 CD2 LEU A 222 1.673 -4.685 0.330 1.00 0.00 C ATOM 0 H LEU A 222 1.573 -2.907 -3.469 1.00 0.00 H new ATOM 0 HA LEU A 222 -0.034 -4.564 -1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 222 1.111 -1.774 -1.398 1.00 0.00 H new ATOM 0 HB3 LEU A 222 0.058 -2.522 -0.214 1.00 0.00 H new ATOM 0 HG LEU A 222 2.822 -3.486 -1.008 1.00 0.00 H new ATOM 0 HD11 LEU A 222 3.416 -2.846 1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 222 2.838 -1.450 0.354 1.00 0.00 H new ATOM 0 HD13 LEU A 222 1.767 -2.226 1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 222 2.547 -5.109 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 222 0.872 -4.556 1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 222 1.340 -5.358 -0.460 1.00 0.00 H new ATOM 1165 N HIS A 223 -2.146 -3.801 -2.541 1.00 0.00 N ATOM 1166 CA HIS A 223 -3.442 -3.402 -3.043 1.00 0.00 C ATOM 1167 C HIS A 223 -4.224 -2.654 -1.983 1.00 0.00 C ATOM 1168 O HIS A 223 -4.462 -3.167 -0.893 1.00 0.00 O ATOM 1169 CB HIS A 223 -4.229 -4.623 -3.515 1.00 0.00 C ATOM 1170 CG HIS A 223 -3.663 -5.253 -4.748 1.00 0.00 C ATOM 1171 ND1 HIS A 223 -4.136 -4.982 -6.013 1.00 0.00 N ATOM 1172 CD2 HIS A 223 -2.650 -6.138 -4.906 1.00 0.00 C ATOM 1173 CE1 HIS A 223 -3.441 -5.672 -6.897 1.00 0.00 C ATOM 1174 NE2 HIS A 223 -2.533 -6.380 -6.252 1.00 0.00 N ATOM 0 H HIS A 223 -2.111 -4.755 -2.181 1.00 0.00 H new ATOM 0 HA HIS A 223 -3.287 -2.734 -3.890 1.00 0.00 H new ATOM 0 HB2 HIS A 223 -4.252 -5.363 -2.715 1.00 0.00 H new ATOM 0 HB3 HIS A 223 -5.261 -4.329 -3.707 1.00 0.00 H new ATOM 0 HD2 HIS A 223 -2.048 -6.571 -4.121 1.00 0.00 H new ATOM 0 HE1 HIS A 223 -3.590 -5.660 -7.967 1.00 0.00 H new ATOM 0 HE2 HIS A 223 -1.854 -7.006 -6.684 1.00 0.00 H new ATOM 1183 N VAL A 224 -4.601 -1.441 -2.316 1.00 0.00 N ATOM 1184 CA VAL A 224 -5.438 -0.623 -1.468 1.00 0.00 C ATOM 1185 C VAL A 224 -6.873 -0.683 -1.962 1.00 0.00 C ATOM 1186 O VAL A 224 -7.210 -0.182 -3.038 1.00 0.00 O ATOM 1187 CB VAL A 224 -4.933 0.835 -1.426 1.00 0.00 C ATOM 1188 CG1 VAL A 224 -6.039 1.803 -1.045 1.00 0.00 C ATOM 1189 CG2 VAL A 224 -3.793 0.951 -0.441 1.00 0.00 C ATOM 0 H VAL A 224 -4.333 -0.990 -3.191 1.00 0.00 H new ATOM 0 HA VAL A 224 -5.394 -1.013 -0.451 1.00 0.00 H new ATOM 0 HB VAL A 224 -4.589 1.098 -2.426 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -5.643 2.818 -1.026 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -6.845 1.741 -1.776 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -6.424 1.546 -0.058 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -3.439 1.982 -0.414 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -4.138 0.660 0.551 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -2.978 0.295 -0.749 1.00 0.00 H new ATOM 1199 N GLU A 225 -7.697 -1.338 -1.177 1.00 0.00 N ATOM 1200 CA GLU A 225 -9.088 -1.542 -1.516 1.00 0.00 C ATOM 1201 C GLU A 225 -9.963 -0.719 -0.594 1.00 0.00 C ATOM 1202 O GLU A 225 -9.636 -0.542 0.582 1.00 0.00 O ATOM 1203 CB GLU A 225 -9.428 -3.018 -1.368 1.00 0.00 C ATOM 1204 CG GLU A 225 -8.514 -3.936 -2.162 1.00 0.00 C ATOM 1205 CD GLU A 225 -8.844 -3.969 -3.639 1.00 0.00 C ATOM 1206 OE1 GLU A 225 -8.579 -2.981 -4.352 1.00 0.00 O ATOM 1207 OE2 GLU A 225 -9.362 -5.004 -4.100 1.00 0.00 O ATOM 0 H GLU A 225 -7.422 -1.746 -0.283 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.264 -1.230 -2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -9.376 -3.290 -0.314 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -10.457 -3.179 -1.688 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -7.482 -3.611 -2.034 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -8.583 -4.946 -1.758 1.00 0.00 H new ATOM 1214 N VAL A 226 -11.064 -0.218 -1.121 1.00 0.00 N ATOM 1215 CA VAL A 226 -11.994 0.558 -0.323 1.00 0.00 C ATOM 1216 C VAL A 226 -12.748 -0.360 0.628 1.00 0.00 C ATOM 1217 O VAL A 226 -13.218 -1.429 0.233 1.00 0.00 O ATOM 1218 CB VAL A 226 -12.996 1.338 -1.204 1.00 0.00 C ATOM 1219 CG1 VAL A 226 -14.023 2.057 -0.345 1.00 0.00 C ATOM 1220 CG2 VAL A 226 -12.265 2.333 -2.089 1.00 0.00 C ATOM 0 H VAL A 226 -11.336 -0.334 -2.097 1.00 0.00 H new ATOM 0 HA VAL A 226 -11.416 1.286 0.246 1.00 0.00 H new ATOM 0 HB VAL A 226 -13.517 0.622 -1.839 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -14.718 2.599 -0.986 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -14.572 1.329 0.251 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -13.516 2.759 0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -12.986 2.873 -2.702 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -11.717 3.040 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -11.566 1.801 -2.735 1.00 0.00 H new ATOM 1230 N LEU A 227 -12.840 0.046 1.884 1.00 0.00 N ATOM 1231 CA LEU A 227 -13.513 -0.750 2.896 1.00 0.00 C ATOM 1232 C LEU A 227 -15.022 -0.642 2.754 1.00 0.00 C ATOM 1233 O LEU A 227 -15.673 0.149 3.440 1.00 0.00 O ATOM 1234 CB LEU A 227 -13.083 -0.323 4.300 1.00 0.00 C ATOM 1235 CG LEU A 227 -11.635 -0.645 4.664 1.00 0.00 C ATOM 1236 CD1 LEU A 227 -11.345 -0.252 6.103 1.00 0.00 C ATOM 1237 CD2 LEU A 227 -11.353 -2.122 4.443 1.00 0.00 C ATOM 0 H LEU A 227 -12.455 0.926 2.227 1.00 0.00 H new ATOM 0 HA LEU A 227 -13.225 -1.791 2.748 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -13.235 0.752 4.398 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -13.739 -0.805 5.025 1.00 0.00 H new ATOM 0 HG LEU A 227 -10.977 -0.067 4.016 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.309 -0.489 6.343 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -11.511 0.818 6.228 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -12.007 -0.802 6.771 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -10.318 -2.338 4.706 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -12.018 -2.717 5.069 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -11.521 -2.372 3.395 1.00 0.00 H new