USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 598 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 160 GLN : amide:sc= 0.655 K(o=1.9,f=1.2) USER MOD Set 1.2: A 162 TYR OH : rot 101:sc= 1.27 USER MOD Single : A 134 MET CE :methyl 180:sc= -0.0662 (180deg=-0.0662) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 25:sc= -3.13! USER MOD Single : A 153 ASN : amide:sc= -0.0127 X(o=-0.013,f=0) USER MOD Single : A 154 MET CE :methyl 164:sc= -0.0484 (180deg=-0.547) USER MOD Single : A 155 HIS : no HD1:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.239 K(o=-0.24,f=-0.96) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.0464 X(o=-0.046,f=-0.2) USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 179 CYS SG : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc=-0.00408 X(o=-0.0041,f=0) USER MOD Single : A 183 THR OG1 : rot -160:sc= 0.0278 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.0113 X(o=-0.011,f=-0.01) USER MOD Single : A 187 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 66:sc= 1.08 USER MOD Single : A 192 THR OG1 : rot 84:sc= 0.75 USER MOD Single : A 193 THR OG1 : rot 83:sc= 0.103 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.056 X(o=-0.056,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= -0.189 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -110:sc= -0.319 (180deg=-0.474) USER MOD Single : A 206 MET CE :methyl -165:sc= -0.17 (180deg=-0.568) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 213 MET CE :methyl -134:sc= -2.91! (180deg=-7.55!) USER MOD Single : A 214 CYS SG : rot 147:sc= -3.52! USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.169 X(o=-0.17,f=0.066) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 15.250 -10.763 -13.295 1.00 0.00 N ATOM 109 CA ALA A 133 16.159 -10.245 -14.309 1.00 0.00 C ATOM 110 C ALA A 133 15.644 -10.544 -15.713 1.00 0.00 C ATOM 111 O ALA A 133 14.564 -11.110 -15.880 1.00 0.00 O ATOM 112 CB ALA A 133 17.550 -10.832 -14.120 1.00 0.00 C ATOM 0 HA ALA A 133 16.214 -9.163 -14.193 1.00 0.00 H new ATOM 0 HB1 ALA A 133 18.219 -10.436 -14.884 1.00 0.00 H new ATOM 0 HB2 ALA A 133 17.927 -10.563 -13.133 1.00 0.00 H new ATOM 0 HB3 ALA A 133 17.502 -11.917 -14.207 1.00 0.00 H new ATOM 118 N MET A 134 16.423 -10.160 -16.719 1.00 0.00 N ATOM 119 CA MET A 134 16.044 -10.388 -18.109 1.00 0.00 C ATOM 120 C MET A 134 17.068 -11.273 -18.813 1.00 0.00 C ATOM 121 O MET A 134 18.243 -11.288 -18.449 1.00 0.00 O ATOM 122 CB MET A 134 15.909 -9.056 -18.848 1.00 0.00 C ATOM 123 CG MET A 134 14.714 -8.230 -18.399 1.00 0.00 C ATOM 124 SD MET A 134 15.105 -7.136 -17.020 1.00 0.00 S ATOM 125 CE MET A 134 13.508 -6.380 -16.725 1.00 0.00 C ATOM 0 H MET A 134 17.320 -9.690 -16.598 1.00 0.00 H new ATOM 0 HA MET A 134 15.081 -10.899 -18.118 1.00 0.00 H new ATOM 0 HB2 MET A 134 16.819 -8.474 -18.700 1.00 0.00 H new ATOM 0 HB3 MET A 134 15.825 -9.250 -19.917 1.00 0.00 H new ATOM 0 HG2 MET A 134 14.352 -7.636 -19.238 1.00 0.00 H new ATOM 0 HG3 MET A 134 13.903 -8.899 -18.109 1.00 0.00 H new ATOM 0 HE1 MET A 134 13.586 -5.675 -15.897 1.00 0.00 H new ATOM 0 HE2 MET A 134 13.184 -5.852 -17.622 1.00 0.00 H new ATOM 0 HE3 MET A 134 12.780 -7.152 -16.476 1.00 0.00 H new ATOM 135 N SER A 135 16.613 -12.008 -19.823 1.00 0.00 N ATOM 136 CA SER A 135 17.489 -12.898 -20.575 1.00 0.00 C ATOM 137 C SER A 135 18.040 -12.198 -21.814 1.00 0.00 C ATOM 138 O SER A 135 17.408 -11.296 -22.363 1.00 0.00 O ATOM 139 CB SER A 135 16.735 -14.165 -20.985 1.00 0.00 C ATOM 140 OG SER A 135 17.524 -15.321 -20.765 1.00 0.00 O ATOM 0 H SER A 135 15.643 -12.004 -20.139 1.00 0.00 H new ATOM 0 HA SER A 135 18.325 -13.173 -19.932 1.00 0.00 H new ATOM 0 HB2 SER A 135 15.808 -14.240 -20.417 1.00 0.00 H new ATOM 0 HB3 SER A 135 16.460 -14.104 -22.038 1.00 0.00 H new ATOM 0 HG SER A 135 17.020 -16.117 -21.033 1.00 0.00 H new ATOM 146 N ARG A 136 19.223 -12.621 -22.248 1.00 0.00 N ATOM 147 CA ARG A 136 19.861 -12.035 -23.420 1.00 0.00 C ATOM 148 C ARG A 136 20.128 -10.548 -23.208 1.00 0.00 C ATOM 149 O ARG A 136 19.457 -9.685 -23.773 1.00 0.00 O ATOM 150 CB ARG A 136 18.984 -12.235 -24.658 1.00 0.00 C ATOM 151 CG ARG A 136 19.350 -13.466 -25.471 1.00 0.00 C ATOM 152 CD ARG A 136 18.706 -13.435 -26.848 1.00 0.00 C ATOM 153 NE ARG A 136 19.115 -12.263 -27.618 1.00 0.00 N ATOM 154 CZ ARG A 136 20.332 -12.106 -28.125 1.00 0.00 C ATOM 155 NH1 ARG A 136 21.255 -13.041 -27.946 1.00 0.00 N ATOM 156 NH2 ARG A 136 20.629 -11.011 -28.814 1.00 0.00 N ATOM 0 H ARG A 136 19.759 -13.368 -21.805 1.00 0.00 H new ATOM 0 HA ARG A 136 20.815 -12.539 -23.573 1.00 0.00 H new ATOM 0 HB2 ARG A 136 17.942 -12.312 -24.346 1.00 0.00 H new ATOM 0 HB3 ARG A 136 19.062 -11.353 -25.294 1.00 0.00 H new ATOM 0 HG2 ARG A 136 20.433 -13.525 -25.576 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.032 -14.363 -24.939 1.00 0.00 H new ATOM 0 HD2 ARG A 136 18.975 -14.339 -27.394 1.00 0.00 H new ATOM 0 HD3 ARG A 136 17.621 -13.438 -26.741 1.00 0.00 H new ATOM 0 HE ARG A 136 18.428 -11.525 -27.775 1.00 0.00 H new ATOM 0 HH11 ARG A 136 21.031 -13.884 -27.417 1.00 0.00 H new ATOM 0 HH12 ARG A 136 22.189 -12.917 -28.337 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.922 -10.289 -28.954 1.00 0.00 H new ATOM 0 HH22 ARG A 136 21.564 -10.891 -29.203 1.00 0.00 H new ATOM 170 N PRO A 137 21.131 -10.240 -22.372 1.00 0.00 N ATOM 171 CA PRO A 137 21.510 -8.858 -22.065 1.00 0.00 C ATOM 172 C PRO A 137 22.155 -8.156 -23.255 1.00 0.00 C ATOM 173 O PRO A 137 22.248 -6.928 -23.288 1.00 0.00 O ATOM 174 CB PRO A 137 22.518 -9.011 -20.924 1.00 0.00 C ATOM 175 CG PRO A 137 23.086 -10.377 -21.101 1.00 0.00 C ATOM 176 CD PRO A 137 21.973 -11.218 -21.663 1.00 0.00 C ATOM 0 HA PRO A 137 20.645 -8.246 -21.808 1.00 0.00 H new ATOM 0 HB2 PRO A 137 23.295 -8.249 -20.978 1.00 0.00 H new ATOM 0 HB3 PRO A 137 22.035 -8.906 -19.952 1.00 0.00 H new ATOM 0 HG2 PRO A 137 23.941 -10.360 -21.776 1.00 0.00 H new ATOM 0 HG3 PRO A 137 23.438 -10.779 -20.151 1.00 0.00 H new ATOM 0 HD2 PRO A 137 22.351 -11.986 -22.337 1.00 0.00 H new ATOM 0 HD3 PRO A 137 21.419 -11.729 -20.876 1.00 0.00 H new ATOM 184 N ILE A 138 22.599 -8.941 -24.230 1.00 0.00 N ATOM 185 CA ILE A 138 23.234 -8.394 -25.423 1.00 0.00 C ATOM 186 C ILE A 138 22.368 -7.313 -26.060 1.00 0.00 C ATOM 187 O ILE A 138 21.322 -7.604 -26.642 1.00 0.00 O ATOM 188 CB ILE A 138 23.515 -9.492 -26.465 1.00 0.00 C ATOM 189 CG1 ILE A 138 24.402 -10.583 -25.863 1.00 0.00 C ATOM 190 CG2 ILE A 138 24.168 -8.893 -27.702 1.00 0.00 C ATOM 191 CD1 ILE A 138 25.738 -10.073 -25.372 1.00 0.00 C ATOM 0 H ILE A 138 22.531 -9.959 -24.218 1.00 0.00 H new ATOM 0 HA ILE A 138 24.180 -7.957 -25.104 1.00 0.00 H new ATOM 0 HB ILE A 138 22.568 -9.943 -26.760 1.00 0.00 H new ATOM 0 HG12 ILE A 138 23.874 -11.052 -25.033 1.00 0.00 H new ATOM 0 HG13 ILE A 138 24.571 -11.357 -26.612 1.00 0.00 H new ATOM 0 HG21 ILE A 138 24.361 -9.681 -28.430 1.00 0.00 H new ATOM 0 HG22 ILE A 138 23.503 -8.149 -28.140 1.00 0.00 H new ATOM 0 HG23 ILE A 138 25.109 -8.419 -27.423 1.00 0.00 H new ATOM 0 HD11 ILE A 138 26.314 -10.901 -24.958 1.00 0.00 H new ATOM 0 HD12 ILE A 138 26.286 -9.630 -26.203 1.00 0.00 H new ATOM 0 HD13 ILE A 138 25.579 -9.320 -24.600 1.00 0.00 H new ATOM 203 N ILE A 139 22.810 -6.065 -25.947 1.00 0.00 N ATOM 204 CA ILE A 139 22.077 -4.941 -26.515 1.00 0.00 C ATOM 205 C ILE A 139 22.813 -4.353 -27.714 1.00 0.00 C ATOM 206 O ILE A 139 24.040 -4.418 -27.796 1.00 0.00 O ATOM 207 CB ILE A 139 21.851 -3.831 -25.471 1.00 0.00 C ATOM 208 CG1 ILE A 139 20.880 -2.780 -26.014 1.00 0.00 C ATOM 209 CG2 ILE A 139 23.175 -3.189 -25.087 1.00 0.00 C ATOM 210 CD1 ILE A 139 19.912 -2.258 -24.976 1.00 0.00 C ATOM 0 H ILE A 139 23.672 -5.807 -25.467 1.00 0.00 H new ATOM 0 HA ILE A 139 21.110 -5.327 -26.839 1.00 0.00 H new ATOM 0 HB ILE A 139 21.412 -4.276 -24.578 1.00 0.00 H new ATOM 0 HG12 ILE A 139 21.451 -1.945 -26.419 1.00 0.00 H new ATOM 0 HG13 ILE A 139 20.316 -3.211 -26.841 1.00 0.00 H new ATOM 0 HG21 ILE A 139 22.999 -2.407 -24.349 1.00 0.00 H new ATOM 0 HG22 ILE A 139 23.837 -3.945 -24.664 1.00 0.00 H new ATOM 0 HG23 ILE A 139 23.639 -2.755 -25.972 1.00 0.00 H new ATOM 0 HD11 ILE A 139 19.255 -1.517 -25.431 1.00 0.00 H new ATOM 0 HD12 ILE A 139 19.315 -3.083 -24.588 1.00 0.00 H new ATOM 0 HD13 ILE A 139 20.468 -1.797 -24.160 1.00 0.00 H new ATOM 222 N HIS A 140 22.056 -3.778 -28.643 1.00 0.00 N ATOM 223 CA HIS A 140 22.637 -3.176 -29.838 1.00 0.00 C ATOM 224 C HIS A 140 23.744 -2.194 -29.468 1.00 0.00 C ATOM 225 O HIS A 140 23.483 -1.134 -28.898 1.00 0.00 O ATOM 226 CB HIS A 140 21.557 -2.463 -30.652 1.00 0.00 C ATOM 227 CG HIS A 140 20.717 -3.390 -31.475 1.00 0.00 C ATOM 228 ND1 HIS A 140 20.646 -3.321 -32.850 1.00 0.00 N ATOM 229 CD2 HIS A 140 19.909 -4.413 -31.109 1.00 0.00 C ATOM 230 CE1 HIS A 140 19.831 -4.260 -33.295 1.00 0.00 C ATOM 231 NE2 HIS A 140 19.371 -4.937 -32.258 1.00 0.00 N ATOM 0 H HIS A 140 21.039 -3.716 -28.591 1.00 0.00 H new ATOM 0 HA HIS A 140 23.070 -3.973 -30.443 1.00 0.00 H new ATOM 0 HB2 HIS A 140 20.911 -1.906 -29.974 1.00 0.00 H new ATOM 0 HB3 HIS A 140 22.031 -1.735 -31.310 1.00 0.00 H new ATOM 0 HD2 HIS A 140 19.723 -4.753 -30.101 1.00 0.00 H new ATOM 0 HE1 HIS A 140 19.583 -4.443 -34.330 1.00 0.00 H new ATOM 0 HE2 HIS A 140 18.721 -5.722 -32.304 1.00 0.00 H new ATOM 239 N PHE A 141 24.981 -2.553 -29.795 1.00 0.00 N ATOM 240 CA PHE A 141 26.128 -1.704 -29.495 1.00 0.00 C ATOM 241 C PHE A 141 26.030 -0.375 -30.238 1.00 0.00 C ATOM 242 O PHE A 141 25.831 0.676 -29.629 1.00 0.00 O ATOM 243 CB PHE A 141 27.429 -2.416 -29.871 1.00 0.00 C ATOM 244 CG PHE A 141 27.491 -3.840 -29.398 1.00 0.00 C ATOM 245 CD1 PHE A 141 27.732 -4.131 -28.064 1.00 0.00 C ATOM 246 CD2 PHE A 141 27.307 -4.888 -30.285 1.00 0.00 C ATOM 247 CE1 PHE A 141 27.791 -5.440 -27.626 1.00 0.00 C ATOM 248 CE2 PHE A 141 27.364 -6.200 -29.853 1.00 0.00 C ATOM 249 CZ PHE A 141 27.605 -6.476 -28.521 1.00 0.00 C ATOM 0 H PHE A 141 25.215 -3.426 -30.268 1.00 0.00 H new ATOM 0 HA PHE A 141 26.129 -1.503 -28.424 1.00 0.00 H new ATOM 0 HB2 PHE A 141 27.545 -2.396 -30.955 1.00 0.00 H new ATOM 0 HB3 PHE A 141 28.270 -1.865 -29.450 1.00 0.00 H new ATOM 0 HD1 PHE A 141 27.875 -3.325 -27.359 1.00 0.00 H new ATOM 0 HD2 PHE A 141 27.117 -4.677 -31.327 1.00 0.00 H new ATOM 0 HE1 PHE A 141 27.982 -5.653 -26.585 1.00 0.00 H new ATOM 0 HE2 PHE A 141 27.220 -7.008 -30.555 1.00 0.00 H new ATOM 0 HZ PHE A 141 27.648 -7.500 -28.180 1.00 0.00 H new ATOM 259 N GLY A 142 26.171 -0.430 -31.559 1.00 0.00 N ATOM 260 CA GLY A 142 26.096 0.776 -32.364 1.00 0.00 C ATOM 261 C GLY A 142 27.464 1.297 -32.755 1.00 0.00 C ATOM 262 O GLY A 142 27.592 2.072 -33.703 1.00 0.00 O ATOM 0 H GLY A 142 26.336 -1.288 -32.086 1.00 0.00 H new ATOM 0 HA2 GLY A 142 25.517 0.573 -33.265 1.00 0.00 H new ATOM 0 HA3 GLY A 142 25.562 1.547 -31.809 1.00 0.00 H new ATOM 266 N SER A 143 28.489 0.873 -32.024 1.00 0.00 N ATOM 267 CA SER A 143 29.854 1.306 -32.297 1.00 0.00 C ATOM 268 C SER A 143 30.853 0.207 -31.949 1.00 0.00 C ATOM 269 O SER A 143 30.873 -0.297 -30.826 1.00 0.00 O ATOM 270 CB SER A 143 30.177 2.574 -31.504 1.00 0.00 C ATOM 271 OG SER A 143 30.497 3.650 -32.369 1.00 0.00 O ATOM 0 H SER A 143 28.400 0.230 -31.238 1.00 0.00 H new ATOM 0 HA SER A 143 29.934 1.521 -33.362 1.00 0.00 H new ATOM 0 HB2 SER A 143 29.324 2.845 -30.882 1.00 0.00 H new ATOM 0 HB3 SER A 143 31.013 2.383 -30.832 1.00 0.00 H new ATOM 0 HG SER A 143 30.698 4.449 -31.837 1.00 0.00 H new ATOM 277 N ASP A 144 31.682 -0.160 -32.920 1.00 0.00 N ATOM 278 CA ASP A 144 32.685 -1.199 -32.718 1.00 0.00 C ATOM 279 C ASP A 144 33.696 -0.779 -31.656 1.00 0.00 C ATOM 280 O ASP A 144 34.187 -1.608 -30.890 1.00 0.00 O ATOM 281 CB ASP A 144 33.405 -1.505 -34.032 1.00 0.00 C ATOM 282 CG ASP A 144 32.607 -2.434 -34.927 1.00 0.00 C ATOM 283 OD1 ASP A 144 31.426 -2.130 -35.193 1.00 0.00 O ATOM 284 OD2 ASP A 144 33.164 -3.465 -35.359 1.00 0.00 O ATOM 0 H ASP A 144 31.679 0.247 -33.855 1.00 0.00 H new ATOM 0 HA ASP A 144 32.176 -2.099 -32.374 1.00 0.00 H new ATOM 0 HB2 ASP A 144 33.599 -0.573 -34.562 1.00 0.00 H new ATOM 0 HB3 ASP A 144 34.373 -1.956 -33.816 1.00 0.00 H new ATOM 289 N TYR A 145 34.003 0.513 -31.617 1.00 0.00 N ATOM 290 CA TYR A 145 34.958 1.043 -30.652 1.00 0.00 C ATOM 291 C TYR A 145 34.382 1.007 -29.239 1.00 0.00 C ATOM 292 O TYR A 145 35.068 0.634 -28.288 1.00 0.00 O ATOM 293 CB TYR A 145 35.345 2.476 -31.019 1.00 0.00 C ATOM 294 CG TYR A 145 35.772 2.637 -32.461 1.00 0.00 C ATOM 295 CD1 TYR A 145 37.033 2.234 -32.882 1.00 0.00 C ATOM 296 CD2 TYR A 145 34.915 3.194 -33.402 1.00 0.00 C ATOM 297 CE1 TYR A 145 37.428 2.379 -34.198 1.00 0.00 C ATOM 298 CE2 TYR A 145 35.300 3.342 -34.720 1.00 0.00 C ATOM 299 CZ TYR A 145 36.558 2.933 -35.113 1.00 0.00 C ATOM 300 OH TYR A 145 36.946 3.081 -36.425 1.00 0.00 O ATOM 0 H TYR A 145 33.604 1.213 -32.243 1.00 0.00 H new ATOM 0 HA TYR A 145 35.848 0.415 -30.679 1.00 0.00 H new ATOM 0 HB2 TYR A 145 34.498 3.134 -30.824 1.00 0.00 H new ATOM 0 HB3 TYR A 145 36.158 2.802 -30.370 1.00 0.00 H new ATOM 0 HD1 TYR A 145 37.717 1.800 -32.168 1.00 0.00 H new ATOM 0 HD2 TYR A 145 33.930 3.517 -33.097 1.00 0.00 H new ATOM 0 HE1 TYR A 145 38.412 2.060 -34.508 1.00 0.00 H new ATOM 0 HE2 TYR A 145 34.620 3.775 -35.439 1.00 0.00 H new ATOM 0 HH TYR A 145 36.216 3.486 -36.938 1.00 0.00 H new ATOM 310 N GLU A 146 33.118 1.396 -29.112 1.00 0.00 N ATOM 311 CA GLU A 146 32.449 1.408 -27.817 1.00 0.00 C ATOM 312 C GLU A 146 32.155 -0.012 -27.343 1.00 0.00 C ATOM 313 O GLU A 146 32.120 -0.283 -26.143 1.00 0.00 O ATOM 314 CB GLU A 146 31.149 2.211 -27.896 1.00 0.00 C ATOM 315 CG GLU A 146 31.365 3.711 -27.999 1.00 0.00 C ATOM 316 CD GLU A 146 30.764 4.468 -26.830 1.00 0.00 C ATOM 317 OE1 GLU A 146 29.525 4.620 -26.795 1.00 0.00 O ATOM 318 OE2 GLU A 146 31.534 4.908 -25.950 1.00 0.00 O ATOM 0 H GLU A 146 32.536 1.707 -29.890 1.00 0.00 H new ATOM 0 HA GLU A 146 33.116 1.882 -27.097 1.00 0.00 H new ATOM 0 HB2 GLU A 146 30.576 1.875 -28.760 1.00 0.00 H new ATOM 0 HB3 GLU A 146 30.547 1.999 -27.013 1.00 0.00 H new ATOM 0 HG2 GLU A 146 32.434 3.918 -28.050 1.00 0.00 H new ATOM 0 HG3 GLU A 146 30.925 4.075 -28.928 1.00 0.00 H new ATOM 325 N ASP A 147 31.943 -0.915 -28.295 1.00 0.00 N ATOM 326 CA ASP A 147 31.652 -2.308 -27.976 1.00 0.00 C ATOM 327 C ASP A 147 32.787 -2.929 -27.168 1.00 0.00 C ATOM 328 O ASP A 147 32.560 -3.803 -26.331 1.00 0.00 O ATOM 329 CB ASP A 147 31.424 -3.109 -29.259 1.00 0.00 C ATOM 330 CG ASP A 147 30.953 -4.524 -28.981 1.00 0.00 C ATOM 331 OD1 ASP A 147 30.655 -4.830 -27.808 1.00 0.00 O ATOM 332 OD2 ASP A 147 30.884 -5.324 -29.937 1.00 0.00 O ATOM 0 H ASP A 147 31.967 -0.707 -29.293 1.00 0.00 H new ATOM 0 HA ASP A 147 30.744 -2.336 -27.373 1.00 0.00 H new ATOM 0 HB2 ASP A 147 30.686 -2.598 -29.877 1.00 0.00 H new ATOM 0 HB3 ASP A 147 32.350 -3.143 -29.832 1.00 0.00 H new ATOM 337 N ARG A 148 34.009 -2.473 -27.425 1.00 0.00 N ATOM 338 CA ARG A 148 35.179 -2.985 -26.724 1.00 0.00 C ATOM 339 C ARG A 148 35.089 -2.691 -25.229 1.00 0.00 C ATOM 340 O ARG A 148 35.255 -3.585 -24.399 1.00 0.00 O ATOM 341 CB ARG A 148 36.456 -2.370 -27.300 1.00 0.00 C ATOM 342 CG ARG A 148 36.567 -2.500 -28.810 1.00 0.00 C ATOM 343 CD ARG A 148 37.927 -2.040 -29.310 1.00 0.00 C ATOM 344 NE ARG A 148 38.979 -3.004 -29.000 1.00 0.00 N ATOM 345 CZ ARG A 148 40.161 -3.023 -29.607 1.00 0.00 C ATOM 346 NH1 ARG A 148 40.439 -2.135 -30.551 1.00 0.00 N ATOM 347 NH2 ARG A 148 41.067 -3.932 -29.270 1.00 0.00 N ATOM 0 H ARG A 148 34.214 -1.749 -28.114 1.00 0.00 H new ATOM 0 HA ARG A 148 35.210 -4.066 -26.863 1.00 0.00 H new ATOM 0 HB2 ARG A 148 36.494 -1.314 -27.031 1.00 0.00 H new ATOM 0 HB3 ARG A 148 37.320 -2.848 -26.838 1.00 0.00 H new ATOM 0 HG2 ARG A 148 36.404 -3.538 -29.100 1.00 0.00 H new ATOM 0 HG3 ARG A 148 35.784 -1.909 -29.286 1.00 0.00 H new ATOM 0 HD2 ARG A 148 37.883 -1.885 -30.388 1.00 0.00 H new ATOM 0 HD3 ARG A 148 38.172 -1.078 -28.860 1.00 0.00 H new ATOM 0 HE ARG A 148 38.797 -3.701 -28.278 1.00 0.00 H new ATOM 0 HH11 ARG A 148 39.745 -1.435 -30.813 1.00 0.00 H new ATOM 0 HH12 ARG A 148 41.347 -2.152 -31.015 1.00 0.00 H new ATOM 0 HH21 ARG A 148 40.857 -4.617 -28.544 1.00 0.00 H new ATOM 0 HH22 ARG A 148 41.974 -3.946 -29.737 1.00 0.00 H new ATOM 361 N TYR A 149 34.826 -1.433 -24.894 1.00 0.00 N ATOM 362 CA TYR A 149 34.717 -1.020 -23.500 1.00 0.00 C ATOM 363 C TYR A 149 33.397 -1.488 -22.895 1.00 0.00 C ATOM 364 O TYR A 149 33.309 -1.750 -21.695 1.00 0.00 O ATOM 365 CB TYR A 149 34.833 0.501 -23.386 1.00 0.00 C ATOM 366 CG TYR A 149 35.455 0.966 -22.089 1.00 0.00 C ATOM 367 CD1 TYR A 149 36.737 0.568 -21.729 1.00 0.00 C ATOM 368 CD2 TYR A 149 34.761 1.801 -21.223 1.00 0.00 C ATOM 369 CE1 TYR A 149 37.309 0.990 -20.544 1.00 0.00 C ATOM 370 CE2 TYR A 149 35.326 2.229 -20.037 1.00 0.00 C ATOM 371 CZ TYR A 149 36.600 1.820 -19.702 1.00 0.00 C ATOM 372 OH TYR A 149 37.166 2.243 -18.521 1.00 0.00 O ATOM 0 H TYR A 149 34.684 -0.681 -25.569 1.00 0.00 H new ATOM 0 HA TYR A 149 35.534 -1.482 -22.946 1.00 0.00 H new ATOM 0 HB2 TYR A 149 35.428 0.875 -24.219 1.00 0.00 H new ATOM 0 HB3 TYR A 149 33.840 0.941 -23.481 1.00 0.00 H new ATOM 0 HD1 TYR A 149 37.295 -0.082 -22.386 1.00 0.00 H new ATOM 0 HD2 TYR A 149 33.762 2.121 -21.481 1.00 0.00 H new ATOM 0 HE1 TYR A 149 38.306 0.671 -20.279 1.00 0.00 H new ATOM 0 HE2 TYR A 149 34.773 2.880 -19.376 1.00 0.00 H new ATOM 0 HH TYR A 149 36.535 2.823 -18.045 1.00 0.00 H new ATOM 382 N TYR A 150 32.373 -1.590 -23.734 1.00 0.00 N ATOM 383 CA TYR A 150 31.056 -2.024 -23.284 1.00 0.00 C ATOM 384 C TYR A 150 31.117 -3.431 -22.698 1.00 0.00 C ATOM 385 O TYR A 150 30.294 -3.804 -21.862 1.00 0.00 O ATOM 386 CB TYR A 150 30.058 -1.985 -24.443 1.00 0.00 C ATOM 387 CG TYR A 150 28.723 -2.614 -24.115 1.00 0.00 C ATOM 388 CD1 TYR A 150 27.919 -2.098 -23.106 1.00 0.00 C ATOM 389 CD2 TYR A 150 28.267 -3.726 -24.812 1.00 0.00 C ATOM 390 CE1 TYR A 150 26.699 -2.670 -22.802 1.00 0.00 C ATOM 391 CE2 TYR A 150 27.047 -4.304 -24.516 1.00 0.00 C ATOM 392 CZ TYR A 150 26.267 -3.772 -23.510 1.00 0.00 C ATOM 393 OH TYR A 150 25.053 -4.346 -23.211 1.00 0.00 O ATOM 0 H TYR A 150 32.429 -1.378 -24.730 1.00 0.00 H new ATOM 0 HA TYR A 150 30.723 -1.339 -22.504 1.00 0.00 H new ATOM 0 HB2 TYR A 150 29.898 -0.948 -24.739 1.00 0.00 H new ATOM 0 HB3 TYR A 150 30.491 -2.499 -25.301 1.00 0.00 H new ATOM 0 HD1 TYR A 150 28.254 -1.235 -22.550 1.00 0.00 H new ATOM 0 HD2 TYR A 150 28.876 -4.146 -25.599 1.00 0.00 H new ATOM 0 HE1 TYR A 150 26.087 -2.257 -22.014 1.00 0.00 H new ATOM 0 HE2 TYR A 150 26.706 -5.167 -25.069 1.00 0.00 H new ATOM 0 HH TYR A 150 24.468 -3.677 -22.797 1.00 0.00 H new ATOM 403 N ARG A 151 32.098 -4.208 -23.144 1.00 0.00 N ATOM 404 CA ARG A 151 32.268 -5.575 -22.665 1.00 0.00 C ATOM 405 C ARG A 151 32.327 -5.614 -21.141 1.00 0.00 C ATOM 406 O ARG A 151 31.946 -6.606 -20.521 1.00 0.00 O ATOM 407 CB ARG A 151 33.541 -6.188 -23.251 1.00 0.00 C ATOM 408 CG ARG A 151 33.477 -7.700 -23.399 1.00 0.00 C ATOM 409 CD ARG A 151 33.102 -8.105 -24.815 1.00 0.00 C ATOM 410 NE ARG A 151 34.273 -8.216 -25.681 1.00 0.00 N ATOM 411 CZ ARG A 151 34.212 -8.581 -26.957 1.00 0.00 C ATOM 412 NH1 ARG A 151 33.043 -8.869 -27.512 1.00 0.00 N ATOM 413 NH2 ARG A 151 35.322 -8.658 -27.680 1.00 0.00 N ATOM 0 H ARG A 151 32.787 -3.915 -23.836 1.00 0.00 H new ATOM 0 HA ARG A 151 31.407 -6.158 -22.993 1.00 0.00 H new ATOM 0 HB2 ARG A 151 33.732 -5.744 -24.228 1.00 0.00 H new ATOM 0 HB3 ARG A 151 34.386 -5.929 -22.613 1.00 0.00 H new ATOM 0 HG2 ARG A 151 34.443 -8.133 -23.139 1.00 0.00 H new ATOM 0 HG3 ARG A 151 32.747 -8.105 -22.698 1.00 0.00 H new ATOM 0 HD2 ARG A 151 32.577 -9.060 -24.792 1.00 0.00 H new ATOM 0 HD3 ARG A 151 32.412 -7.371 -25.231 1.00 0.00 H new ATOM 0 HE ARG A 151 35.188 -8.001 -25.284 1.00 0.00 H new ATOM 0 HH11 ARG A 151 32.188 -8.811 -26.959 1.00 0.00 H new ATOM 0 HH12 ARG A 151 32.999 -9.149 -28.492 1.00 0.00 H new ATOM 0 HH21 ARG A 151 36.223 -8.437 -27.256 1.00 0.00 H new ATOM 0 HH22 ARG A 151 35.274 -8.938 -28.660 1.00 0.00 H new ATOM 427 N GLU A 152 32.806 -4.527 -20.544 1.00 0.00 N ATOM 428 CA GLU A 152 32.916 -4.438 -19.093 1.00 0.00 C ATOM 429 C GLU A 152 31.641 -3.860 -18.485 1.00 0.00 C ATOM 430 O GLU A 152 31.321 -4.117 -17.326 1.00 0.00 O ATOM 431 CB GLU A 152 34.117 -3.575 -18.701 1.00 0.00 C ATOM 432 CG GLU A 152 35.440 -4.094 -19.239 1.00 0.00 C ATOM 433 CD GLU A 152 36.389 -4.524 -18.137 1.00 0.00 C ATOM 434 OE1 GLU A 152 36.184 -5.619 -17.572 1.00 0.00 O ATOM 435 OE2 GLU A 152 37.336 -3.767 -17.840 1.00 0.00 O ATOM 0 H GLU A 152 33.124 -3.696 -21.043 1.00 0.00 H new ATOM 0 HA GLU A 152 33.060 -5.446 -18.704 1.00 0.00 H new ATOM 0 HB2 GLU A 152 33.959 -2.560 -19.066 1.00 0.00 H new ATOM 0 HB3 GLU A 152 34.174 -3.518 -17.614 1.00 0.00 H new ATOM 0 HG2 GLU A 152 35.252 -4.939 -19.902 1.00 0.00 H new ATOM 0 HG3 GLU A 152 35.914 -3.317 -19.839 1.00 0.00 H new ATOM 442 N ASN A 153 30.917 -3.077 -19.278 1.00 0.00 N ATOM 443 CA ASN A 153 29.677 -2.461 -18.819 1.00 0.00 C ATOM 444 C ASN A 153 28.535 -3.472 -18.819 1.00 0.00 C ATOM 445 O ASN A 153 27.683 -3.461 -17.931 1.00 0.00 O ATOM 446 CB ASN A 153 29.317 -1.267 -19.707 1.00 0.00 C ATOM 447 CG ASN A 153 30.086 -0.015 -19.332 1.00 0.00 C ATOM 448 OD1 ASN A 153 29.681 0.732 -18.441 1.00 0.00 O ATOM 449 ND2 ASN A 153 31.202 0.220 -20.013 1.00 0.00 N ATOM 0 H ASN A 153 31.167 -2.854 -20.241 1.00 0.00 H new ATOM 0 HA ASN A 153 29.830 -2.113 -17.798 1.00 0.00 H new ATOM 0 HB2 ASN A 153 29.521 -1.517 -20.748 1.00 0.00 H new ATOM 0 HB3 ASN A 153 28.248 -1.070 -19.630 1.00 0.00 H new ATOM 0 HD21 ASN A 153 31.761 1.047 -19.805 1.00 0.00 H new ATOM 0 HD22 ASN A 153 31.500 -0.427 -20.743 1.00 0.00 H new ATOM 456 N MET A 154 28.524 -4.345 -19.821 1.00 0.00 N ATOM 457 CA MET A 154 27.487 -5.364 -19.936 1.00 0.00 C ATOM 458 C MET A 154 27.415 -6.210 -18.669 1.00 0.00 C ATOM 459 O MET A 154 26.352 -6.716 -18.308 1.00 0.00 O ATOM 460 CB MET A 154 27.754 -6.259 -21.147 1.00 0.00 C ATOM 461 CG MET A 154 29.129 -6.908 -21.133 1.00 0.00 C ATOM 462 SD MET A 154 29.259 -8.285 -22.289 1.00 0.00 S ATOM 463 CE MET A 154 28.475 -7.586 -23.739 1.00 0.00 C ATOM 0 H MET A 154 29.221 -4.367 -20.565 1.00 0.00 H new ATOM 0 HA MET A 154 26.530 -4.860 -20.070 1.00 0.00 H new ATOM 0 HB2 MET A 154 26.994 -7.039 -21.186 1.00 0.00 H new ATOM 0 HB3 MET A 154 27.650 -5.667 -22.056 1.00 0.00 H new ATOM 0 HG2 MET A 154 29.882 -6.160 -21.379 1.00 0.00 H new ATOM 0 HG3 MET A 154 29.349 -7.262 -20.126 1.00 0.00 H new ATOM 0 HE1 MET A 154 28.722 -8.189 -24.613 1.00 0.00 H new ATOM 0 HE2 MET A 154 27.394 -7.576 -23.599 1.00 0.00 H new ATOM 0 HE3 MET A 154 28.831 -6.567 -23.889 1.00 0.00 H new ATOM 473 N HIS A 155 28.552 -6.362 -17.998 1.00 0.00 N ATOM 474 CA HIS A 155 28.617 -7.148 -16.771 1.00 0.00 C ATOM 475 C HIS A 155 27.932 -6.416 -15.620 1.00 0.00 C ATOM 476 O HIS A 155 27.477 -7.038 -14.661 1.00 0.00 O ATOM 477 CB HIS A 155 30.072 -7.445 -16.407 1.00 0.00 C ATOM 478 CG HIS A 155 30.578 -8.738 -16.970 1.00 0.00 C ATOM 479 ND1 HIS A 155 31.389 -9.600 -16.263 1.00 0.00 N ATOM 480 CD2 HIS A 155 30.382 -9.313 -18.179 1.00 0.00 C ATOM 481 CE1 HIS A 155 31.671 -10.650 -17.014 1.00 0.00 C ATOM 482 NE2 HIS A 155 31.072 -10.501 -18.181 1.00 0.00 N ATOM 0 H HIS A 155 29.441 -5.951 -18.283 1.00 0.00 H new ATOM 0 HA HIS A 155 28.094 -8.089 -16.943 1.00 0.00 H new ATOM 0 HB2 HIS A 155 30.701 -6.631 -16.766 1.00 0.00 H new ATOM 0 HB3 HIS A 155 30.169 -7.468 -15.322 1.00 0.00 H new ATOM 0 HD2 HIS A 155 29.793 -8.913 -18.991 1.00 0.00 H new ATOM 0 HE1 HIS A 155 32.287 -11.488 -16.723 1.00 0.00 H new ATOM 0 HE2 HIS A 155 31.115 -11.161 -18.958 1.00 0.00 H new ATOM 490 N ARG A 156 27.864 -5.093 -15.724 1.00 0.00 N ATOM 491 CA ARG A 156 27.237 -4.277 -14.691 1.00 0.00 C ATOM 492 C ARG A 156 25.939 -3.658 -15.202 1.00 0.00 C ATOM 493 O ARG A 156 25.387 -2.749 -14.581 1.00 0.00 O ATOM 494 CB ARG A 156 28.194 -3.176 -14.231 1.00 0.00 C ATOM 495 CG ARG A 156 28.703 -3.366 -12.811 1.00 0.00 C ATOM 496 CD ARG A 156 27.666 -2.939 -11.785 1.00 0.00 C ATOM 497 NE ARG A 156 26.952 -4.081 -11.220 1.00 0.00 N ATOM 498 CZ ARG A 156 27.449 -4.859 -10.265 1.00 0.00 C ATOM 499 NH1 ARG A 156 28.655 -4.619 -9.770 1.00 0.00 N ATOM 500 NH2 ARG A 156 26.738 -5.879 -9.802 1.00 0.00 N ATOM 0 H ARG A 156 28.235 -4.563 -16.513 1.00 0.00 H new ATOM 0 HA ARG A 156 27.003 -4.922 -13.844 1.00 0.00 H new ATOM 0 HB2 ARG A 156 29.045 -3.138 -14.911 1.00 0.00 H new ATOM 0 HB3 ARG A 156 27.687 -2.213 -14.301 1.00 0.00 H new ATOM 0 HG2 ARG A 156 28.962 -4.413 -12.654 1.00 0.00 H new ATOM 0 HG3 ARG A 156 29.616 -2.787 -12.670 1.00 0.00 H new ATOM 0 HD2 ARG A 156 28.155 -2.385 -10.984 1.00 0.00 H new ATOM 0 HD3 ARG A 156 26.952 -2.260 -12.252 1.00 0.00 H new ATOM 0 HE ARG A 156 26.021 -4.293 -11.578 1.00 0.00 H new ATOM 0 HH11 ARG A 156 29.204 -3.835 -10.122 1.00 0.00 H new ATOM 0 HH12 ARG A 156 29.034 -5.218 -9.037 1.00 0.00 H new ATOM 0 HH21 ARG A 156 25.809 -6.066 -10.179 1.00 0.00 H new ATOM 0 HH22 ARG A 156 27.120 -6.476 -9.069 1.00 0.00 H new ATOM 514 N TYR A 157 25.458 -4.155 -16.336 1.00 0.00 N ATOM 515 CA TYR A 157 24.227 -3.648 -16.931 1.00 0.00 C ATOM 516 C TYR A 157 23.095 -3.631 -15.909 1.00 0.00 C ATOM 517 O TYR A 157 23.083 -4.395 -14.944 1.00 0.00 O ATOM 518 CB TYR A 157 23.829 -4.504 -18.135 1.00 0.00 C ATOM 519 CG TYR A 157 23.162 -5.807 -17.758 1.00 0.00 C ATOM 520 CD1 TYR A 157 23.801 -6.725 -16.934 1.00 0.00 C ATOM 521 CD2 TYR A 157 21.892 -6.121 -18.226 1.00 0.00 C ATOM 522 CE1 TYR A 157 23.196 -7.917 -16.587 1.00 0.00 C ATOM 523 CE2 TYR A 157 21.278 -7.310 -17.883 1.00 0.00 C ATOM 524 CZ TYR A 157 21.934 -8.205 -17.064 1.00 0.00 C ATOM 525 OH TYR A 157 21.326 -9.391 -16.721 1.00 0.00 O ATOM 0 H TYR A 157 25.902 -4.908 -16.862 1.00 0.00 H new ATOM 0 HA TYR A 157 24.407 -2.626 -17.263 1.00 0.00 H new ATOM 0 HB2 TYR A 157 23.154 -3.931 -18.770 1.00 0.00 H new ATOM 0 HB3 TYR A 157 24.719 -4.719 -18.727 1.00 0.00 H new ATOM 0 HD1 TYR A 157 24.789 -6.502 -16.558 1.00 0.00 H new ATOM 0 HD2 TYR A 157 21.376 -5.423 -18.869 1.00 0.00 H new ATOM 0 HE1 TYR A 157 23.708 -8.620 -15.946 1.00 0.00 H new ATOM 0 HE2 TYR A 157 20.290 -7.537 -18.254 1.00 0.00 H new ATOM 0 HH TYR A 157 20.441 -9.438 -17.139 1.00 0.00 H new ATOM 535 N PRO A 158 22.119 -2.736 -16.124 1.00 0.00 N ATOM 536 CA PRO A 158 20.963 -2.597 -15.234 1.00 0.00 C ATOM 537 C PRO A 158 20.020 -3.792 -15.317 1.00 0.00 C ATOM 538 O PRO A 158 19.528 -4.133 -16.392 1.00 0.00 O ATOM 539 CB PRO A 158 20.270 -1.332 -15.749 1.00 0.00 C ATOM 540 CG PRO A 158 20.675 -1.234 -17.179 1.00 0.00 C ATOM 541 CD PRO A 158 22.069 -1.793 -17.254 1.00 0.00 C ATOM 0 HA PRO A 158 21.259 -2.542 -14.186 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.187 -1.405 -15.648 1.00 0.00 H new ATOM 0 HB3 PRO A 158 20.584 -0.452 -15.187 1.00 0.00 H new ATOM 0 HG2 PRO A 158 19.994 -1.797 -17.817 1.00 0.00 H new ATOM 0 HG3 PRO A 158 20.650 -0.200 -17.522 1.00 0.00 H new ATOM 0 HD2 PRO A 158 22.250 -2.295 -18.205 1.00 0.00 H new ATOM 0 HD3 PRO A 158 22.822 -1.010 -17.158 1.00 0.00 H new ATOM 549 N ASN A 159 19.771 -4.424 -14.174 1.00 0.00 N ATOM 550 CA ASN A 159 18.887 -5.583 -14.118 1.00 0.00 C ATOM 551 C ASN A 159 17.691 -5.310 -13.212 1.00 0.00 C ATOM 552 O ASN A 159 17.104 -6.234 -12.649 1.00 0.00 O ATOM 553 CB ASN A 159 19.651 -6.810 -13.618 1.00 0.00 C ATOM 554 CG ASN A 159 19.809 -6.818 -12.110 1.00 0.00 C ATOM 555 OD1 ASN A 159 20.402 -5.907 -11.532 1.00 0.00 O ATOM 556 ND2 ASN A 159 19.278 -7.850 -11.465 1.00 0.00 N ATOM 0 H ASN A 159 20.169 -4.153 -13.275 1.00 0.00 H new ATOM 0 HA ASN A 159 18.520 -5.779 -15.126 1.00 0.00 H new ATOM 0 HB2 ASN A 159 19.127 -7.713 -13.930 1.00 0.00 H new ATOM 0 HB3 ASN A 159 20.636 -6.836 -14.084 1.00 0.00 H new ATOM 0 HD21 ASN A 159 19.353 -7.910 -10.450 1.00 0.00 H new ATOM 0 HD22 ASN A 159 18.795 -8.583 -11.985 1.00 0.00 H new ATOM 563 N GLN A 160 17.336 -4.036 -13.076 1.00 0.00 N ATOM 564 CA GLN A 160 16.210 -3.643 -12.238 1.00 0.00 C ATOM 565 C GLN A 160 15.565 -2.362 -12.757 1.00 0.00 C ATOM 566 O GLN A 160 16.250 -1.372 -13.017 1.00 0.00 O ATOM 567 CB GLN A 160 16.667 -3.447 -10.791 1.00 0.00 C ATOM 568 CG GLN A 160 16.840 -4.749 -10.026 1.00 0.00 C ATOM 569 CD GLN A 160 15.557 -5.553 -9.946 1.00 0.00 C ATOM 570 OE1 GLN A 160 14.526 -5.055 -9.492 1.00 0.00 O ATOM 571 NE2 GLN A 160 15.613 -6.804 -10.387 1.00 0.00 N ATOM 0 H GLN A 160 17.812 -3.259 -13.535 1.00 0.00 H new ATOM 0 HA GLN A 160 15.469 -4.441 -12.273 1.00 0.00 H new ATOM 0 HB2 GLN A 160 17.613 -2.905 -10.788 1.00 0.00 H new ATOM 0 HB3 GLN A 160 15.940 -2.823 -10.271 1.00 0.00 H new ATOM 0 HG2 GLN A 160 17.611 -5.350 -10.508 1.00 0.00 H new ATOM 0 HG3 GLN A 160 17.191 -4.530 -9.017 1.00 0.00 H new ATOM 0 HE21 GLN A 160 16.488 -7.176 -10.755 1.00 0.00 H new ATOM 0 HE22 GLN A 160 14.781 -7.393 -10.358 1.00 0.00 H new ATOM 580 N VAL A 161 14.245 -2.388 -12.907 1.00 0.00 N ATOM 581 CA VAL A 161 13.508 -1.229 -13.396 1.00 0.00 C ATOM 582 C VAL A 161 12.356 -0.877 -12.462 1.00 0.00 C ATOM 583 O VAL A 161 11.584 -1.746 -12.056 1.00 0.00 O ATOM 584 CB VAL A 161 12.951 -1.473 -14.811 1.00 0.00 C ATOM 585 CG1 VAL A 161 14.083 -1.550 -15.824 1.00 0.00 C ATOM 586 CG2 VAL A 161 12.111 -2.741 -14.841 1.00 0.00 C ATOM 0 H VAL A 161 13.664 -3.199 -12.697 1.00 0.00 H new ATOM 0 HA VAL A 161 14.212 -0.398 -13.430 1.00 0.00 H new ATOM 0 HB VAL A 161 12.310 -0.633 -15.081 1.00 0.00 H new ATOM 0 HG11 VAL A 161 13.671 -1.723 -16.818 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.639 -0.613 -15.820 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.751 -2.370 -15.561 1.00 0.00 H new ATOM 0 HG21 VAL A 161 11.725 -2.898 -15.848 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.727 -3.592 -14.551 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.278 -2.642 -14.145 1.00 0.00 H new ATOM 596 N TYR A 162 12.244 0.403 -12.125 1.00 0.00 N ATOM 597 CA TYR A 162 11.187 0.871 -11.237 1.00 0.00 C ATOM 598 C TYR A 162 10.523 2.127 -11.794 1.00 0.00 C ATOM 599 O TYR A 162 11.054 2.775 -12.696 1.00 0.00 O ATOM 600 CB TYR A 162 11.750 1.154 -9.843 1.00 0.00 C ATOM 601 CG TYR A 162 12.440 -0.036 -9.216 1.00 0.00 C ATOM 602 CD1 TYR A 162 11.721 -0.977 -8.489 1.00 0.00 C ATOM 603 CD2 TYR A 162 13.811 -0.220 -9.349 1.00 0.00 C ATOM 604 CE1 TYR A 162 12.346 -2.066 -7.913 1.00 0.00 C ATOM 605 CE2 TYR A 162 14.445 -1.307 -8.778 1.00 0.00 C ATOM 606 CZ TYR A 162 13.708 -2.226 -8.061 1.00 0.00 C ATOM 607 OH TYR A 162 14.336 -3.309 -7.490 1.00 0.00 O ATOM 0 H TYR A 162 12.873 1.136 -12.454 1.00 0.00 H new ATOM 0 HA TYR A 162 10.435 0.086 -11.165 1.00 0.00 H new ATOM 0 HB2 TYR A 162 12.457 1.981 -9.907 1.00 0.00 H new ATOM 0 HB3 TYR A 162 10.938 1.478 -9.191 1.00 0.00 H new ATOM 0 HD1 TYR A 162 10.654 -0.855 -8.372 1.00 0.00 H new ATOM 0 HD2 TYR A 162 14.391 0.499 -9.908 1.00 0.00 H new ATOM 0 HE1 TYR A 162 11.772 -2.787 -7.350 1.00 0.00 H new ATOM 0 HE2 TYR A 162 15.511 -1.436 -8.893 1.00 0.00 H new ATOM 0 HH TYR A 162 14.507 -3.987 -8.176 1.00 0.00 H new ATOM 797 N ASN A 174 7.016 9.556 -24.540 1.00 0.00 N ATOM 798 CA ASN A 174 7.496 10.181 -23.312 1.00 0.00 C ATOM 799 C ASN A 174 7.258 9.271 -22.111 1.00 0.00 C ATOM 800 O ASN A 174 7.980 9.339 -21.115 1.00 0.00 O ATOM 801 CB ASN A 174 6.799 11.526 -23.094 1.00 0.00 C ATOM 802 CG ASN A 174 7.636 12.482 -22.266 1.00 0.00 C ATOM 803 OD1 ASN A 174 7.349 12.720 -21.093 1.00 0.00 O ATOM 804 ND2 ASN A 174 8.677 13.037 -22.876 1.00 0.00 N ATOM 0 HA ASN A 174 8.568 10.348 -23.412 1.00 0.00 H new ATOM 0 HB2 ASN A 174 6.582 11.981 -24.061 1.00 0.00 H new ATOM 0 HB3 ASN A 174 5.843 11.361 -22.598 1.00 0.00 H new ATOM 0 HD21 ASN A 174 9.276 13.690 -22.370 1.00 0.00 H new ATOM 0 HD22 ASN A 174 8.878 12.811 -23.850 1.00 0.00 H new ATOM 811 N PHE A 175 6.242 8.421 -22.211 1.00 0.00 N ATOM 812 CA PHE A 175 5.909 7.498 -21.132 1.00 0.00 C ATOM 813 C PHE A 175 7.080 6.566 -20.833 1.00 0.00 C ATOM 814 O PHE A 175 7.472 6.395 -19.678 1.00 0.00 O ATOM 815 CB PHE A 175 4.671 6.677 -21.499 1.00 0.00 C ATOM 816 CG PHE A 175 3.854 6.260 -20.310 1.00 0.00 C ATOM 817 CD1 PHE A 175 2.850 7.079 -19.820 1.00 0.00 C ATOM 818 CD2 PHE A 175 4.090 5.047 -19.682 1.00 0.00 C ATOM 819 CE1 PHE A 175 2.098 6.697 -18.725 1.00 0.00 C ATOM 820 CE2 PHE A 175 3.341 4.660 -18.587 1.00 0.00 C ATOM 821 CZ PHE A 175 2.343 5.486 -18.108 1.00 0.00 C ATOM 0 H PHE A 175 5.635 8.352 -23.028 1.00 0.00 H new ATOM 0 HA PHE A 175 5.696 8.085 -20.238 1.00 0.00 H new ATOM 0 HB2 PHE A 175 4.045 7.261 -22.173 1.00 0.00 H new ATOM 0 HB3 PHE A 175 4.984 5.787 -22.045 1.00 0.00 H new ATOM 0 HD1 PHE A 175 2.653 8.027 -20.299 1.00 0.00 H new ATOM 0 HD2 PHE A 175 4.868 4.397 -20.053 1.00 0.00 H new ATOM 0 HE1 PHE A 175 1.319 7.345 -18.352 1.00 0.00 H new ATOM 0 HE2 PHE A 175 3.536 3.713 -18.106 1.00 0.00 H new ATOM 0 HZ PHE A 175 1.756 5.186 -17.253 1.00 0.00 H new ATOM 831 N VAL A 176 7.633 5.965 -21.881 1.00 0.00 N ATOM 832 CA VAL A 176 8.759 5.051 -21.732 1.00 0.00 C ATOM 833 C VAL A 176 10.020 5.796 -21.309 1.00 0.00 C ATOM 834 O VAL A 176 10.725 5.375 -20.391 1.00 0.00 O ATOM 835 CB VAL A 176 9.041 4.289 -23.041 1.00 0.00 C ATOM 836 CG1 VAL A 176 10.234 3.361 -22.872 1.00 0.00 C ATOM 837 CG2 VAL A 176 7.809 3.512 -23.480 1.00 0.00 C ATOM 0 H VAL A 176 7.320 6.095 -22.843 1.00 0.00 H new ATOM 0 HA VAL A 176 8.485 4.336 -20.956 1.00 0.00 H new ATOM 0 HB VAL A 176 9.282 5.014 -23.819 1.00 0.00 H new ATOM 0 HG11 VAL A 176 10.418 2.831 -23.807 1.00 0.00 H new ATOM 0 HG12 VAL A 176 11.115 3.946 -22.607 1.00 0.00 H new ATOM 0 HG13 VAL A 176 10.025 2.640 -22.081 1.00 0.00 H new ATOM 0 HG21 VAL A 176 8.026 2.980 -24.406 1.00 0.00 H new ATOM 0 HG22 VAL A 176 7.535 2.796 -22.705 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.982 4.203 -23.644 1.00 0.00 H new ATOM 847 N HIS A 177 10.299 6.906 -21.985 1.00 0.00 N ATOM 848 CA HIS A 177 11.476 7.712 -21.679 1.00 0.00 C ATOM 849 C HIS A 177 11.523 8.062 -20.194 1.00 0.00 C ATOM 850 O HIS A 177 12.555 7.904 -19.543 1.00 0.00 O ATOM 851 CB HIS A 177 11.476 8.991 -22.516 1.00 0.00 C ATOM 852 CG HIS A 177 11.836 8.767 -23.952 1.00 0.00 C ATOM 853 ND1 HIS A 177 12.830 7.898 -24.352 1.00 0.00 N ATOM 854 CD2 HIS A 177 11.329 9.303 -25.087 1.00 0.00 C ATOM 855 CE1 HIS A 177 12.919 7.911 -25.670 1.00 0.00 C ATOM 856 NE2 HIS A 177 12.018 8.755 -26.140 1.00 0.00 N ATOM 0 H HIS A 177 9.727 7.268 -22.748 1.00 0.00 H new ATOM 0 HA HIS A 177 12.361 7.126 -21.925 1.00 0.00 H new ATOM 0 HB2 HIS A 177 10.488 9.449 -22.465 1.00 0.00 H new ATOM 0 HB3 HIS A 177 12.179 9.701 -22.080 1.00 0.00 H new ATOM 0 HD2 HIS A 177 10.531 10.027 -25.152 1.00 0.00 H new ATOM 0 HE1 HIS A 177 13.611 7.330 -26.262 1.00 0.00 H new ATOM 0 HE2 HIS A 177 11.860 8.965 -27.125 1.00 0.00 H new ATOM 864 N ASN A 178 10.400 8.538 -19.667 1.00 0.00 N ATOM 865 CA ASN A 178 10.315 8.912 -18.260 1.00 0.00 C ATOM 866 C ASN A 178 10.654 7.726 -17.361 1.00 0.00 C ATOM 867 O ASN A 178 11.368 7.870 -16.368 1.00 0.00 O ATOM 868 CB ASN A 178 8.913 9.429 -17.932 1.00 0.00 C ATOM 869 CG ASN A 178 8.942 10.781 -17.245 1.00 0.00 C ATOM 870 OD1 ASN A 178 9.061 10.865 -16.022 1.00 0.00 O ATOM 871 ND2 ASN A 178 8.832 11.846 -18.030 1.00 0.00 N ATOM 0 H ASN A 178 9.536 8.674 -20.193 1.00 0.00 H new ATOM 0 HA ASN A 178 11.040 9.705 -18.076 1.00 0.00 H new ATOM 0 HB2 ASN A 178 8.332 9.504 -18.851 1.00 0.00 H new ATOM 0 HB3 ASN A 178 8.404 8.709 -17.291 1.00 0.00 H new ATOM 0 HD21 ASN A 178 8.844 12.782 -17.625 1.00 0.00 H new ATOM 0 HD22 ASN A 178 8.735 11.728 -19.039 1.00 0.00 H new ATOM 878 N CYS A 179 10.137 6.555 -17.717 1.00 0.00 N ATOM 879 CA CYS A 179 10.385 5.343 -16.944 1.00 0.00 C ATOM 880 C CYS A 179 11.879 5.048 -16.859 1.00 0.00 C ATOM 881 O CYS A 179 12.345 4.413 -15.912 1.00 0.00 O ATOM 882 CB CYS A 179 9.654 4.155 -17.571 1.00 0.00 C ATOM 883 SG CYS A 179 9.437 2.738 -16.447 1.00 0.00 S ATOM 0 H CYS A 179 9.544 6.419 -18.536 1.00 0.00 H new ATOM 0 HA CYS A 179 10.006 5.502 -15.934 1.00 0.00 H new ATOM 0 HB2 CYS A 179 8.674 4.486 -17.915 1.00 0.00 H new ATOM 0 HB3 CYS A 179 10.206 3.826 -18.451 1.00 0.00 H new ATOM 0 HG CYS A 179 8.807 1.785 -17.067 1.00 0.00 H new ATOM 888 N VAL A 180 12.627 5.514 -17.854 1.00 0.00 N ATOM 889 CA VAL A 180 14.069 5.301 -17.892 1.00 0.00 C ATOM 890 C VAL A 180 14.787 6.234 -16.924 1.00 0.00 C ATOM 891 O VAL A 180 15.767 5.850 -16.288 1.00 0.00 O ATOM 892 CB VAL A 180 14.631 5.518 -19.310 1.00 0.00 C ATOM 893 CG1 VAL A 180 16.130 5.264 -19.334 1.00 0.00 C ATOM 894 CG2 VAL A 180 13.914 4.623 -20.309 1.00 0.00 C ATOM 0 H VAL A 180 12.258 6.042 -18.645 1.00 0.00 H new ATOM 0 HA VAL A 180 14.245 4.267 -17.594 1.00 0.00 H new ATOM 0 HB VAL A 180 14.458 6.555 -19.597 1.00 0.00 H new ATOM 0 HG11 VAL A 180 16.510 5.422 -20.343 1.00 0.00 H new ATOM 0 HG12 VAL A 180 16.626 5.950 -18.648 1.00 0.00 H new ATOM 0 HG13 VAL A 180 16.330 4.237 -19.028 1.00 0.00 H new ATOM 0 HG21 VAL A 180 14.323 4.789 -21.305 1.00 0.00 H new ATOM 0 HG22 VAL A 180 14.054 3.579 -20.028 1.00 0.00 H new ATOM 0 HG23 VAL A 180 12.850 4.859 -20.310 1.00 0.00 H new ATOM 904 N ASN A 181 14.292 7.463 -16.818 1.00 0.00 N ATOM 905 CA ASN A 181 14.887 8.453 -15.927 1.00 0.00 C ATOM 906 C ASN A 181 14.806 7.994 -14.474 1.00 0.00 C ATOM 907 O ASN A 181 15.702 8.269 -13.675 1.00 0.00 O ATOM 908 CB ASN A 181 14.185 9.802 -16.087 1.00 0.00 C ATOM 909 CG ASN A 181 15.151 10.969 -16.018 1.00 0.00 C ATOM 910 OD1 ASN A 181 15.148 11.736 -15.055 1.00 0.00 O ATOM 911 ND2 ASN A 181 15.985 11.108 -17.043 1.00 0.00 N ATOM 0 H ASN A 181 13.481 7.797 -17.338 1.00 0.00 H new ATOM 0 HA ASN A 181 15.937 8.564 -16.197 1.00 0.00 H new ATOM 0 HB2 ASN A 181 13.660 9.824 -17.042 1.00 0.00 H new ATOM 0 HB3 ASN A 181 13.432 9.911 -15.307 1.00 0.00 H new ATOM 0 HD21 ASN A 181 16.658 11.874 -17.053 1.00 0.00 H new ATOM 0 HD22 ASN A 181 15.952 10.448 -17.820 1.00 0.00 H new ATOM 918 N ILE A 182 13.727 7.294 -14.139 1.00 0.00 N ATOM 919 CA ILE A 182 13.531 6.797 -12.783 1.00 0.00 C ATOM 920 C ILE A 182 14.616 5.795 -12.402 1.00 0.00 C ATOM 921 O ILE A 182 15.201 5.878 -11.322 1.00 0.00 O ATOM 922 CB ILE A 182 12.152 6.128 -12.623 1.00 0.00 C ATOM 923 CG1 ILE A 182 11.046 7.071 -13.101 1.00 0.00 C ATOM 924 CG2 ILE A 182 11.924 5.725 -11.174 1.00 0.00 C ATOM 925 CD1 ILE A 182 10.993 8.376 -12.338 1.00 0.00 C ATOM 0 H ILE A 182 12.976 7.059 -14.788 1.00 0.00 H new ATOM 0 HA ILE A 182 13.587 7.660 -12.119 1.00 0.00 H new ATOM 0 HB ILE A 182 12.127 5.228 -13.237 1.00 0.00 H new ATOM 0 HG12 ILE A 182 11.194 7.284 -14.160 1.00 0.00 H new ATOM 0 HG13 ILE A 182 10.084 6.566 -13.009 1.00 0.00 H new ATOM 0 HG21 ILE A 182 10.946 5.254 -11.077 1.00 0.00 H new ATOM 0 HG22 ILE A 182 12.698 5.022 -10.866 1.00 0.00 H new ATOM 0 HG23 ILE A 182 11.965 6.610 -10.539 1.00 0.00 H new ATOM 0 HD11 ILE A 182 10.186 8.994 -12.730 1.00 0.00 H new ATOM 0 HD12 ILE A 182 10.814 8.173 -11.282 1.00 0.00 H new ATOM 0 HD13 ILE A 182 11.941 8.902 -12.451 1.00 0.00 H new ATOM 937 N THR A 183 14.882 4.849 -13.298 1.00 0.00 N ATOM 938 CA THR A 183 15.897 3.832 -13.056 1.00 0.00 C ATOM 939 C THR A 183 17.257 4.466 -12.785 1.00 0.00 C ATOM 940 O THR A 183 17.951 4.087 -11.842 1.00 0.00 O ATOM 941 CB THR A 183 16.021 2.868 -14.251 1.00 0.00 C ATOM 942 OG1 THR A 183 14.727 2.600 -14.801 1.00 0.00 O ATOM 943 CG2 THR A 183 16.678 1.563 -13.827 1.00 0.00 C ATOM 0 H THR A 183 14.408 4.767 -14.198 1.00 0.00 H new ATOM 0 HA THR A 183 15.580 3.271 -12.177 1.00 0.00 H new ATOM 0 HB THR A 183 16.646 3.342 -15.008 1.00 0.00 H new ATOM 0 HG1 THR A 183 14.760 1.774 -15.328 1.00 0.00 H new ATOM 0 HG21 THR A 183 16.755 0.898 -14.687 1.00 0.00 H new ATOM 0 HG22 THR A 183 17.675 1.768 -13.436 1.00 0.00 H new ATOM 0 HG23 THR A 183 16.076 1.087 -13.053 1.00 0.00 H new ATOM 951 N ILE A 184 17.630 5.432 -13.617 1.00 0.00 N ATOM 952 CA ILE A 184 18.907 6.119 -13.465 1.00 0.00 C ATOM 953 C ILE A 184 18.966 6.884 -12.147 1.00 0.00 C ATOM 954 O ILE A 184 20.003 6.923 -11.485 1.00 0.00 O ATOM 955 CB ILE A 184 19.161 7.098 -14.626 1.00 0.00 C ATOM 956 CG1 ILE A 184 19.120 6.358 -15.965 1.00 0.00 C ATOM 957 CG2 ILE A 184 20.497 7.801 -14.444 1.00 0.00 C ATOM 958 CD1 ILE A 184 20.129 5.235 -16.065 1.00 0.00 C ATOM 0 H ILE A 184 17.067 5.757 -14.403 1.00 0.00 H new ATOM 0 HA ILE A 184 19.681 5.352 -13.472 1.00 0.00 H new ATOM 0 HB ILE A 184 18.373 7.851 -14.625 1.00 0.00 H new ATOM 0 HG12 ILE A 184 18.120 5.952 -16.116 1.00 0.00 H new ATOM 0 HG13 ILE A 184 19.300 7.070 -16.770 1.00 0.00 H new ATOM 0 HG21 ILE A 184 20.662 8.490 -15.273 1.00 0.00 H new ATOM 0 HG22 ILE A 184 20.491 8.357 -13.506 1.00 0.00 H new ATOM 0 HG23 ILE A 184 21.297 7.061 -14.422 1.00 0.00 H new ATOM 0 HD11 ILE A 184 20.044 4.755 -17.040 1.00 0.00 H new ATOM 0 HD12 ILE A 184 21.135 5.638 -15.946 1.00 0.00 H new ATOM 0 HD13 ILE A 184 19.937 4.502 -15.281 1.00 0.00 H new ATOM 970 N LYS A 185 17.845 7.491 -11.771 1.00 0.00 N ATOM 971 CA LYS A 185 17.767 8.253 -10.531 1.00 0.00 C ATOM 972 C LYS A 185 18.194 7.401 -9.340 1.00 0.00 C ATOM 973 O LYS A 185 19.198 7.688 -8.689 1.00 0.00 O ATOM 974 CB LYS A 185 16.343 8.771 -10.315 1.00 0.00 C ATOM 975 CG LYS A 185 16.273 10.019 -9.453 1.00 0.00 C ATOM 976 CD LYS A 185 15.480 9.775 -8.181 1.00 0.00 C ATOM 977 CE LYS A 185 14.690 11.008 -7.771 1.00 0.00 C ATOM 978 NZ LYS A 185 15.362 11.758 -6.674 1.00 0.00 N ATOM 0 H LYS A 185 16.978 7.470 -12.308 1.00 0.00 H new ATOM 0 HA LYS A 185 18.448 9.100 -10.612 1.00 0.00 H new ATOM 0 HB2 LYS A 185 15.892 8.984 -11.284 1.00 0.00 H new ATOM 0 HB3 LYS A 185 15.746 7.986 -9.851 1.00 0.00 H new ATOM 0 HG2 LYS A 185 17.282 10.342 -9.197 1.00 0.00 H new ATOM 0 HG3 LYS A 185 15.813 10.828 -10.020 1.00 0.00 H new ATOM 0 HD2 LYS A 185 14.798 8.938 -8.331 1.00 0.00 H new ATOM 0 HD3 LYS A 185 16.159 9.493 -7.376 1.00 0.00 H new ATOM 0 HE2 LYS A 185 14.564 11.662 -8.634 1.00 0.00 H new ATOM 0 HE3 LYS A 185 13.692 10.710 -7.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 14.792 12.591 -6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 15.460 11.142 -5.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 16.304 12.065 -6.990 1.00 0.00 H new ATOM 992 N GLN A 186 17.427 6.351 -9.064 1.00 0.00 N ATOM 993 CA GLN A 186 17.728 5.457 -7.952 1.00 0.00 C ATOM 994 C GLN A 186 19.122 4.855 -8.100 1.00 0.00 C ATOM 995 O GLN A 186 19.757 4.484 -7.112 1.00 0.00 O ATOM 996 CB GLN A 186 16.684 4.342 -7.869 1.00 0.00 C ATOM 997 CG GLN A 186 15.545 4.645 -6.909 1.00 0.00 C ATOM 998 CD GLN A 186 14.798 5.913 -7.273 1.00 0.00 C ATOM 999 OE1 GLN A 186 14.197 6.008 -8.344 1.00 0.00 O ATOM 1000 NE2 GLN A 186 14.829 6.896 -6.381 1.00 0.00 N ATOM 0 H GLN A 186 16.593 6.099 -9.595 1.00 0.00 H new ATOM 0 HA GLN A 186 17.700 6.040 -7.032 1.00 0.00 H new ATOM 0 HB2 GLN A 186 16.273 4.166 -8.863 1.00 0.00 H new ATOM 0 HB3 GLN A 186 17.174 3.419 -7.558 1.00 0.00 H new ATOM 0 HG2 GLN A 186 14.848 3.807 -6.901 1.00 0.00 H new ATOM 0 HG3 GLN A 186 15.942 4.739 -5.898 1.00 0.00 H new ATOM 0 HE21 GLN A 186 15.339 6.775 -5.506 1.00 0.00 H new ATOM 0 HE22 GLN A 186 14.343 7.772 -6.571 1.00 0.00 H new ATOM 1009 N HIS A 187 19.592 4.761 -9.340 1.00 0.00 N ATOM 1010 CA HIS A 187 20.911 4.203 -9.617 1.00 0.00 C ATOM 1011 C HIS A 187 21.983 4.910 -8.794 1.00 0.00 C ATOM 1012 O HIS A 187 23.014 4.324 -8.461 1.00 0.00 O ATOM 1013 CB HIS A 187 21.235 4.321 -11.107 1.00 0.00 C ATOM 1014 CG HIS A 187 22.035 3.172 -11.638 1.00 0.00 C ATOM 1015 ND1 HIS A 187 23.358 2.961 -11.313 1.00 0.00 N ATOM 1016 CD2 HIS A 187 21.690 2.167 -12.477 1.00 0.00 C ATOM 1017 CE1 HIS A 187 23.793 1.877 -11.929 1.00 0.00 C ATOM 1018 NE2 HIS A 187 22.801 1.376 -12.642 1.00 0.00 N ATOM 0 H HIS A 187 19.080 5.064 -10.168 1.00 0.00 H new ATOM 0 HA HIS A 187 20.899 3.149 -9.338 1.00 0.00 H new ATOM 0 HB2 HIS A 187 20.304 4.395 -11.668 1.00 0.00 H new ATOM 0 HB3 HIS A 187 21.785 5.246 -11.279 1.00 0.00 H new ATOM 0 HD2 HIS A 187 20.722 2.015 -12.932 1.00 0.00 H new ATOM 0 HE1 HIS A 187 24.791 1.469 -11.861 1.00 0.00 H new ATOM 0 HE2 HIS A 187 22.851 0.538 -13.221 1.00 0.00 H new ATOM 1026 N THR A 188 21.734 6.175 -8.467 1.00 0.00 N ATOM 1027 CA THR A 188 22.679 6.962 -7.685 1.00 0.00 C ATOM 1028 C THR A 188 23.019 6.267 -6.372 1.00 0.00 C ATOM 1029 O THR A 188 24.113 6.438 -5.832 1.00 0.00 O ATOM 1030 CB THR A 188 22.122 8.366 -7.380 1.00 0.00 C ATOM 1031 OG1 THR A 188 23.146 9.184 -6.802 1.00 0.00 O ATOM 1032 CG2 THR A 188 20.936 8.284 -6.431 1.00 0.00 C ATOM 0 H THR A 188 20.886 6.676 -8.732 1.00 0.00 H new ATOM 0 HA THR A 188 23.583 7.060 -8.286 1.00 0.00 H new ATOM 0 HB THR A 188 21.787 8.811 -8.317 1.00 0.00 H new ATOM 0 HG1 THR A 188 22.785 10.075 -6.612 1.00 0.00 H new ATOM 0 HG21 THR A 188 20.560 9.287 -6.231 1.00 0.00 H new ATOM 0 HG22 THR A 188 20.147 7.685 -6.886 1.00 0.00 H new ATOM 0 HG23 THR A 188 21.250 7.821 -5.496 1.00 0.00 H new ATOM 1040 N VAL A 189 22.076 5.481 -5.861 1.00 0.00 N ATOM 1041 CA VAL A 189 22.278 4.758 -4.612 1.00 0.00 C ATOM 1042 C VAL A 189 23.356 3.690 -4.762 1.00 0.00 C ATOM 1043 O VAL A 189 24.356 3.696 -4.043 1.00 0.00 O ATOM 1044 CB VAL A 189 20.974 4.091 -4.133 1.00 0.00 C ATOM 1045 CG1 VAL A 189 21.181 3.424 -2.782 1.00 0.00 C ATOM 1046 CG2 VAL A 189 19.848 5.112 -4.066 1.00 0.00 C ATOM 0 H VAL A 189 21.165 5.329 -6.293 1.00 0.00 H new ATOM 0 HA VAL A 189 22.597 5.491 -3.871 1.00 0.00 H new ATOM 0 HB VAL A 189 20.694 3.321 -4.852 1.00 0.00 H new ATOM 0 HG11 VAL A 189 20.250 2.958 -2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 189 21.957 2.663 -2.867 1.00 0.00 H new ATOM 0 HG13 VAL A 189 21.485 4.172 -2.050 1.00 0.00 H new ATOM 0 HG21 VAL A 189 18.934 4.624 -3.726 1.00 0.00 H new ATOM 0 HG22 VAL A 189 20.117 5.905 -3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 189 19.685 5.539 -5.055 1.00 0.00 H new ATOM 1056 N THR A 190 23.147 2.774 -5.701 1.00 0.00 N ATOM 1057 CA THR A 190 24.100 1.699 -5.946 1.00 0.00 C ATOM 1058 C THR A 190 25.464 2.253 -6.340 1.00 0.00 C ATOM 1059 O THR A 190 26.493 1.610 -6.126 1.00 0.00 O ATOM 1060 CB THR A 190 23.605 0.751 -7.055 1.00 0.00 C ATOM 1061 OG1 THR A 190 22.343 0.182 -6.686 1.00 0.00 O ATOM 1062 CG2 THR A 190 24.613 -0.360 -7.307 1.00 0.00 C ATOM 0 H THR A 190 22.325 2.755 -6.305 1.00 0.00 H new ATOM 0 HA THR A 190 24.192 1.140 -5.015 1.00 0.00 H new ATOM 0 HB THR A 190 23.489 1.329 -7.972 1.00 0.00 H new ATOM 0 HG1 THR A 190 22.034 -0.418 -7.397 1.00 0.00 H new ATOM 0 HG21 THR A 190 24.242 -1.017 -8.094 1.00 0.00 H new ATOM 0 HG22 THR A 190 25.564 0.075 -7.616 1.00 0.00 H new ATOM 0 HG23 THR A 190 24.757 -0.935 -6.392 1.00 0.00 H new ATOM 1070 N THR A 191 25.468 3.452 -6.915 1.00 0.00 N ATOM 1071 CA THR A 191 26.706 4.093 -7.339 1.00 0.00 C ATOM 1072 C THR A 191 27.686 4.216 -6.178 1.00 0.00 C ATOM 1073 O THR A 191 28.900 4.276 -6.379 1.00 0.00 O ATOM 1074 CB THR A 191 26.443 5.493 -7.924 1.00 0.00 C ATOM 1075 OG1 THR A 191 25.508 5.404 -9.005 1.00 0.00 O ATOM 1076 CG2 THR A 191 27.735 6.126 -8.415 1.00 0.00 C ATOM 0 H THR A 191 24.626 3.999 -7.098 1.00 0.00 H new ATOM 0 HA THR A 191 27.140 3.460 -8.113 1.00 0.00 H new ATOM 0 HB THR A 191 26.027 6.120 -7.135 1.00 0.00 H new ATOM 0 HG1 THR A 191 24.638 5.111 -8.662 1.00 0.00 H new ATOM 0 HG21 THR A 191 27.524 7.114 -8.824 1.00 0.00 H new ATOM 0 HG22 THR A 191 28.434 6.219 -7.583 1.00 0.00 H new ATOM 0 HG23 THR A 191 28.176 5.499 -9.190 1.00 0.00 H new ATOM 1084 N THR A 192 27.153 4.253 -4.960 1.00 0.00 N ATOM 1085 CA THR A 192 27.981 4.369 -3.767 1.00 0.00 C ATOM 1086 C THR A 192 28.774 3.091 -3.521 1.00 0.00 C ATOM 1087 O THR A 192 29.862 3.123 -2.944 1.00 0.00 O ATOM 1088 CB THR A 192 27.130 4.680 -2.521 1.00 0.00 C ATOM 1089 OG1 THR A 192 26.100 5.618 -2.852 1.00 0.00 O ATOM 1090 CG2 THR A 192 27.994 5.241 -1.402 1.00 0.00 C ATOM 0 H THR A 192 26.151 4.204 -4.775 1.00 0.00 H new ATOM 0 HA THR A 192 28.672 5.194 -3.941 1.00 0.00 H new ATOM 0 HB THR A 192 26.676 3.750 -2.177 1.00 0.00 H new ATOM 0 HG1 THR A 192 25.335 5.142 -3.238 1.00 0.00 H new ATOM 0 HG21 THR A 192 27.371 5.453 -0.533 1.00 0.00 H new ATOM 0 HG22 THR A 192 28.758 4.512 -1.132 1.00 0.00 H new ATOM 0 HG23 THR A 192 28.473 6.161 -1.738 1.00 0.00 H new ATOM 1098 N THR A 193 28.224 1.964 -3.962 1.00 0.00 N ATOM 1099 CA THR A 193 28.880 0.674 -3.789 1.00 0.00 C ATOM 1100 C THR A 193 30.233 0.648 -4.490 1.00 0.00 C ATOM 1101 O THR A 193 31.192 0.061 -3.989 1.00 0.00 O ATOM 1102 CB THR A 193 28.010 -0.475 -4.333 1.00 0.00 C ATOM 1103 OG1 THR A 193 26.675 -0.360 -3.829 1.00 0.00 O ATOM 1104 CG2 THR A 193 28.591 -1.825 -3.940 1.00 0.00 C ATOM 0 H THR A 193 27.325 1.919 -4.442 1.00 0.00 H new ATOM 0 HA THR A 193 29.026 0.534 -2.718 1.00 0.00 H new ATOM 0 HB THR A 193 27.994 -0.406 -5.421 1.00 0.00 H new ATOM 0 HG1 THR A 193 26.171 0.276 -4.379 1.00 0.00 H new ATOM 0 HG21 THR A 193 27.960 -2.621 -4.335 1.00 0.00 H new ATOM 0 HG22 THR A 193 29.596 -1.922 -4.350 1.00 0.00 H new ATOM 0 HG23 THR A 193 28.633 -1.901 -2.853 1.00 0.00 H new ATOM 1112 N LYS A 194 30.305 1.287 -5.653 1.00 0.00 N ATOM 1113 CA LYS A 194 31.542 1.339 -6.423 1.00 0.00 C ATOM 1114 C LYS A 194 32.391 2.537 -6.009 1.00 0.00 C ATOM 1115 O LYS A 194 33.567 2.628 -6.359 1.00 0.00 O ATOM 1116 CB LYS A 194 31.232 1.413 -7.920 1.00 0.00 C ATOM 1117 CG LYS A 194 31.589 0.146 -8.677 1.00 0.00 C ATOM 1118 CD LYS A 194 32.491 0.440 -9.864 1.00 0.00 C ATOM 1119 CE LYS A 194 32.711 -0.799 -10.718 1.00 0.00 C ATOM 1120 NZ LYS A 194 34.156 -1.037 -10.988 1.00 0.00 N ATOM 0 H LYS A 194 29.520 1.776 -6.083 1.00 0.00 H new ATOM 0 HA LYS A 194 32.106 0.429 -6.219 1.00 0.00 H new ATOM 0 HB2 LYS A 194 30.170 1.619 -8.053 1.00 0.00 H new ATOM 0 HB3 LYS A 194 31.776 2.252 -8.354 1.00 0.00 H new ATOM 0 HG2 LYS A 194 32.087 -0.552 -8.005 1.00 0.00 H new ATOM 0 HG3 LYS A 194 30.677 -0.341 -9.024 1.00 0.00 H new ATOM 0 HD2 LYS A 194 32.048 1.228 -10.472 1.00 0.00 H new ATOM 0 HD3 LYS A 194 33.451 0.813 -9.509 1.00 0.00 H new ATOM 0 HE2 LYS A 194 32.288 -1.668 -10.213 1.00 0.00 H new ATOM 0 HE3 LYS A 194 32.178 -0.688 -11.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 34.264 -1.890 -11.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 34.554 -0.219 -11.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 34.660 -1.168 -10.088 1.00 0.00 H new ATOM 1134 N GLY A 195 31.786 3.455 -5.260 1.00 0.00 N ATOM 1135 CA GLY A 195 32.502 4.634 -4.810 1.00 0.00 C ATOM 1136 C GLY A 195 33.070 5.441 -5.960 1.00 0.00 C ATOM 1137 O GLY A 195 34.126 6.059 -5.830 1.00 0.00 O ATOM 0 H GLY A 195 30.813 3.403 -4.957 1.00 0.00 H new ATOM 0 HA2 GLY A 195 31.830 5.263 -4.226 1.00 0.00 H new ATOM 0 HA3 GLY A 195 33.313 4.332 -4.147 1.00 0.00 H new ATOM 1141 N GLU A 196 32.369 5.435 -7.089 1.00 0.00 N ATOM 1142 CA GLU A 196 32.813 6.171 -8.267 1.00 0.00 C ATOM 1143 C GLU A 196 31.665 6.977 -8.869 1.00 0.00 C ATOM 1144 O GLU A 196 30.532 6.912 -8.395 1.00 0.00 O ATOM 1145 CB GLU A 196 33.378 5.208 -9.314 1.00 0.00 C ATOM 1146 CG GLU A 196 34.893 5.103 -9.289 1.00 0.00 C ATOM 1147 CD GLU A 196 35.545 5.782 -10.478 1.00 0.00 C ATOM 1148 OE1 GLU A 196 35.206 6.952 -10.753 1.00 0.00 O ATOM 1149 OE2 GLU A 196 36.396 5.143 -11.132 1.00 0.00 O ATOM 0 H GLU A 196 31.492 4.929 -7.213 1.00 0.00 H new ATOM 0 HA GLU A 196 33.597 6.862 -7.958 1.00 0.00 H new ATOM 0 HB2 GLU A 196 32.951 4.218 -9.153 1.00 0.00 H new ATOM 0 HB3 GLU A 196 33.061 5.535 -10.304 1.00 0.00 H new ATOM 0 HG2 GLU A 196 35.269 5.550 -8.369 1.00 0.00 H new ATOM 0 HG3 GLU A 196 35.180 4.052 -9.273 1.00 0.00 H new ATOM 1156 N ASN A 197 31.969 7.737 -9.916 1.00 0.00 N ATOM 1157 CA ASN A 197 30.964 8.558 -10.582 1.00 0.00 C ATOM 1158 C ASN A 197 30.617 7.985 -11.953 1.00 0.00 C ATOM 1159 O ASN A 197 31.202 6.994 -12.391 1.00 0.00 O ATOM 1160 CB ASN A 197 31.466 9.996 -10.730 1.00 0.00 C ATOM 1161 CG ASN A 197 31.973 10.568 -9.421 1.00 0.00 C ATOM 1162 OD1 ASN A 197 31.228 11.214 -8.683 1.00 0.00 O ATOM 1163 ND2 ASN A 197 33.247 10.334 -9.127 1.00 0.00 N ATOM 0 H ASN A 197 32.903 7.802 -10.322 1.00 0.00 H new ATOM 0 HA ASN A 197 30.064 8.556 -9.968 1.00 0.00 H new ATOM 0 HB2 ASN A 197 32.266 10.024 -11.470 1.00 0.00 H new ATOM 0 HB3 ASN A 197 30.659 10.623 -11.109 1.00 0.00 H new ATOM 0 HD21 ASN A 197 33.645 10.695 -8.260 1.00 0.00 H new ATOM 0 HD22 ASN A 197 33.827 9.794 -9.768 1.00 0.00 H new ATOM 1170 N PHE A 198 29.660 8.616 -12.626 1.00 0.00 N ATOM 1171 CA PHE A 198 29.234 8.170 -13.948 1.00 0.00 C ATOM 1172 C PHE A 198 29.522 9.235 -15.001 1.00 0.00 C ATOM 1173 O PHE A 198 29.238 10.417 -14.801 1.00 0.00 O ATOM 1174 CB PHE A 198 27.740 7.836 -13.939 1.00 0.00 C ATOM 1175 CG PHE A 198 26.886 8.926 -13.356 1.00 0.00 C ATOM 1176 CD1 PHE A 198 26.700 9.020 -11.987 1.00 0.00 C ATOM 1177 CD2 PHE A 198 26.270 9.855 -14.178 1.00 0.00 C ATOM 1178 CE1 PHE A 198 25.913 10.021 -11.448 1.00 0.00 C ATOM 1179 CE2 PHE A 198 25.483 10.859 -13.646 1.00 0.00 C ATOM 1180 CZ PHE A 198 25.305 10.942 -12.279 1.00 0.00 C ATOM 0 H PHE A 198 29.165 9.437 -12.278 1.00 0.00 H new ATOM 0 HA PHE A 198 29.799 7.273 -14.201 1.00 0.00 H new ATOM 0 HB2 PHE A 198 27.414 7.637 -14.960 1.00 0.00 H new ATOM 0 HB3 PHE A 198 27.584 6.919 -13.370 1.00 0.00 H new ATOM 0 HD1 PHE A 198 27.175 8.304 -11.333 1.00 0.00 H new ATOM 0 HD2 PHE A 198 26.406 9.794 -15.248 1.00 0.00 H new ATOM 0 HE1 PHE A 198 25.774 10.083 -10.379 1.00 0.00 H new ATOM 0 HE2 PHE A 198 25.008 11.577 -14.298 1.00 0.00 H new ATOM 0 HZ PHE A 198 24.691 11.726 -11.860 1.00 0.00 H new ATOM 1190 N THR A 199 30.090 8.809 -16.125 1.00 0.00 N ATOM 1191 CA THR A 199 30.419 9.725 -17.210 1.00 0.00 C ATOM 1192 C THR A 199 29.309 9.762 -18.255 1.00 0.00 C ATOM 1193 O THR A 199 28.492 8.846 -18.337 1.00 0.00 O ATOM 1194 CB THR A 199 31.741 9.332 -17.896 1.00 0.00 C ATOM 1195 OG1 THR A 199 31.716 7.944 -18.248 1.00 0.00 O ATOM 1196 CG2 THR A 199 32.926 9.608 -16.983 1.00 0.00 C ATOM 0 H THR A 199 30.332 7.835 -16.308 1.00 0.00 H new ATOM 0 HA THR A 199 30.529 10.714 -16.765 1.00 0.00 H new ATOM 0 HB THR A 199 31.850 9.933 -18.799 1.00 0.00 H new ATOM 0 HG1 THR A 199 32.559 7.702 -18.685 1.00 0.00 H new ATOM 0 HG21 THR A 199 33.849 9.323 -17.488 1.00 0.00 H new ATOM 0 HG22 THR A 199 32.959 10.670 -16.740 1.00 0.00 H new ATOM 0 HG23 THR A 199 32.821 9.029 -16.065 1.00 0.00 H new ATOM 1204 N GLU A 200 29.287 10.826 -19.051 1.00 0.00 N ATOM 1205 CA GLU A 200 28.276 10.981 -20.090 1.00 0.00 C ATOM 1206 C GLU A 200 28.344 9.830 -21.090 1.00 0.00 C ATOM 1207 O GLU A 200 27.337 9.455 -21.693 1.00 0.00 O ATOM 1208 CB GLU A 200 28.460 12.315 -20.817 1.00 0.00 C ATOM 1209 CG GLU A 200 28.298 13.527 -19.916 1.00 0.00 C ATOM 1210 CD GLU A 200 28.803 14.804 -20.559 1.00 0.00 C ATOM 1211 OE1 GLU A 200 29.412 14.721 -21.645 1.00 0.00 O ATOM 1212 OE2 GLU A 200 28.587 15.887 -19.975 1.00 0.00 O ATOM 0 H GLU A 200 29.957 11.593 -18.996 1.00 0.00 H new ATOM 0 HA GLU A 200 27.296 10.968 -19.613 1.00 0.00 H new ATOM 0 HB2 GLU A 200 29.452 12.339 -21.269 1.00 0.00 H new ATOM 0 HB3 GLU A 200 27.737 12.378 -21.630 1.00 0.00 H new ATOM 0 HG2 GLU A 200 27.245 13.646 -19.659 1.00 0.00 H new ATOM 0 HG3 GLU A 200 28.836 13.357 -18.984 1.00 0.00 H new ATOM 1219 N THR A 201 29.539 9.274 -21.263 1.00 0.00 N ATOM 1220 CA THR A 201 29.740 8.168 -22.191 1.00 0.00 C ATOM 1221 C THR A 201 29.285 6.847 -21.579 1.00 0.00 C ATOM 1222 O THR A 201 28.652 6.029 -22.246 1.00 0.00 O ATOM 1223 CB THR A 201 31.218 8.045 -22.607 1.00 0.00 C ATOM 1224 OG1 THR A 201 31.691 9.300 -23.107 1.00 0.00 O ATOM 1225 CG2 THR A 201 31.393 6.971 -23.669 1.00 0.00 C ATOM 0 H THR A 201 30.382 9.572 -20.773 1.00 0.00 H new ATOM 0 HA THR A 201 29.138 8.383 -23.074 1.00 0.00 H new ATOM 0 HB THR A 201 31.798 7.762 -21.729 1.00 0.00 H new ATOM 0 HG1 THR A 201 32.632 9.215 -23.368 1.00 0.00 H new ATOM 0 HG21 THR A 201 32.445 6.902 -23.947 1.00 0.00 H new ATOM 0 HG22 THR A 201 31.058 6.011 -23.275 1.00 0.00 H new ATOM 0 HG23 THR A 201 30.801 7.228 -24.548 1.00 0.00 H new ATOM 1233 N ASP A 202 29.610 6.647 -20.307 1.00 0.00 N ATOM 1234 CA ASP A 202 29.233 5.426 -19.604 1.00 0.00 C ATOM 1235 C ASP A 202 27.725 5.369 -19.385 1.00 0.00 C ATOM 1236 O ASP A 202 27.079 4.368 -19.697 1.00 0.00 O ATOM 1237 CB ASP A 202 29.960 5.340 -18.261 1.00 0.00 C ATOM 1238 CG ASP A 202 31.432 5.011 -18.419 1.00 0.00 C ATOM 1239 OD1 ASP A 202 31.850 4.688 -19.550 1.00 0.00 O ATOM 1240 OD2 ASP A 202 32.165 5.078 -17.411 1.00 0.00 O ATOM 0 H ASP A 202 30.134 7.315 -19.741 1.00 0.00 H new ATOM 0 HA ASP A 202 29.525 4.576 -20.221 1.00 0.00 H new ATOM 0 HB2 ASP A 202 29.857 6.289 -17.734 1.00 0.00 H new ATOM 0 HB3 ASP A 202 29.485 4.579 -17.642 1.00 0.00 H new ATOM 1245 N VAL A 203 27.169 6.449 -18.845 1.00 0.00 N ATOM 1246 CA VAL A 203 25.736 6.522 -18.584 1.00 0.00 C ATOM 1247 C VAL A 203 24.932 6.242 -19.849 1.00 0.00 C ATOM 1248 O VAL A 203 23.848 5.661 -19.793 1.00 0.00 O ATOM 1249 CB VAL A 203 25.337 7.902 -18.029 1.00 0.00 C ATOM 1250 CG1 VAL A 203 25.655 8.996 -19.037 1.00 0.00 C ATOM 1251 CG2 VAL A 203 23.861 7.920 -17.659 1.00 0.00 C ATOM 0 H VAL A 203 27.689 7.285 -18.580 1.00 0.00 H new ATOM 0 HA VAL A 203 25.510 5.760 -17.838 1.00 0.00 H new ATOM 0 HB VAL A 203 25.918 8.093 -17.127 1.00 0.00 H new ATOM 0 HG11 VAL A 203 25.366 9.964 -18.627 1.00 0.00 H new ATOM 0 HG12 VAL A 203 26.724 8.996 -19.249 1.00 0.00 H new ATOM 0 HG13 VAL A 203 25.103 8.813 -19.959 1.00 0.00 H new ATOM 0 HG21 VAL A 203 23.596 8.902 -17.268 1.00 0.00 H new ATOM 0 HG22 VAL A 203 23.261 7.707 -18.544 1.00 0.00 H new ATOM 0 HG23 VAL A 203 23.667 7.163 -16.899 1.00 0.00 H new ATOM 1261 N LYS A 204 25.470 6.660 -20.990 1.00 0.00 N ATOM 1262 CA LYS A 204 24.805 6.453 -22.270 1.00 0.00 C ATOM 1263 C LYS A 204 24.605 4.967 -22.546 1.00 0.00 C ATOM 1264 O LYS A 204 23.505 4.532 -22.888 1.00 0.00 O ATOM 1265 CB LYS A 204 25.620 7.087 -23.400 1.00 0.00 C ATOM 1266 CG LYS A 204 24.783 7.902 -24.371 1.00 0.00 C ATOM 1267 CD LYS A 204 24.815 9.382 -24.030 1.00 0.00 C ATOM 1268 CE LYS A 204 24.418 10.238 -25.222 1.00 0.00 C ATOM 1269 NZ LYS A 204 22.964 10.125 -25.527 1.00 0.00 N ATOM 0 H LYS A 204 26.365 7.144 -21.054 1.00 0.00 H new ATOM 0 HA LYS A 204 23.826 6.931 -22.223 1.00 0.00 H new ATOM 0 HB2 LYS A 204 26.387 7.729 -22.967 1.00 0.00 H new ATOM 0 HB3 LYS A 204 26.136 6.300 -23.950 1.00 0.00 H new ATOM 0 HG2 LYS A 204 25.153 7.754 -25.385 1.00 0.00 H new ATOM 0 HG3 LYS A 204 23.753 7.546 -24.352 1.00 0.00 H new ATOM 0 HD2 LYS A 204 24.139 9.579 -23.198 1.00 0.00 H new ATOM 0 HD3 LYS A 204 25.816 9.659 -23.700 1.00 0.00 H new ATOM 0 HE2 LYS A 204 24.667 11.280 -25.020 1.00 0.00 H new ATOM 0 HE3 LYS A 204 24.997 9.936 -26.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 22.734 10.723 -26.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 22.731 9.135 -25.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 22.411 10.437 -24.703 1.00 0.00 H new ATOM 1283 N MET A 205 25.674 4.192 -22.395 1.00 0.00 N ATOM 1284 CA MET A 205 25.614 2.753 -22.625 1.00 0.00 C ATOM 1285 C MET A 205 24.490 2.119 -21.813 1.00 0.00 C ATOM 1286 O MET A 205 23.747 1.277 -22.316 1.00 0.00 O ATOM 1287 CB MET A 205 26.950 2.101 -22.265 1.00 0.00 C ATOM 1288 CG MET A 205 28.146 2.753 -22.940 1.00 0.00 C ATOM 1289 SD MET A 205 29.656 1.784 -22.763 1.00 0.00 S ATOM 1290 CE MET A 205 30.709 2.572 -23.979 1.00 0.00 C ATOM 0 H MET A 205 26.592 4.536 -22.114 1.00 0.00 H new ATOM 0 HA MET A 205 25.411 2.588 -23.683 1.00 0.00 H new ATOM 0 HB2 MET A 205 27.086 2.143 -21.184 1.00 0.00 H new ATOM 0 HB3 MET A 205 26.917 1.047 -22.542 1.00 0.00 H new ATOM 0 HG2 MET A 205 27.930 2.891 -23.999 1.00 0.00 H new ATOM 0 HG3 MET A 205 28.303 3.744 -22.515 1.00 0.00 H new ATOM 0 HE1 MET A 205 30.866 1.894 -24.818 1.00 0.00 H new ATOM 0 HE2 MET A 205 30.233 3.486 -24.335 1.00 0.00 H new ATOM 0 HE3 MET A 205 31.669 2.816 -23.525 1.00 0.00 H new ATOM 1300 N MET A 206 24.371 2.529 -20.554 1.00 0.00 N ATOM 1301 CA MET A 206 23.336 2.001 -19.673 1.00 0.00 C ATOM 1302 C MET A 206 21.961 2.528 -20.073 1.00 0.00 C ATOM 1303 O MET A 206 20.972 1.797 -20.034 1.00 0.00 O ATOM 1304 CB MET A 206 23.634 2.374 -18.220 1.00 0.00 C ATOM 1305 CG MET A 206 24.906 1.739 -17.679 1.00 0.00 C ATOM 1306 SD MET A 206 25.025 1.846 -15.883 1.00 0.00 S ATOM 1307 CE MET A 206 24.543 3.550 -15.613 1.00 0.00 C ATOM 0 H MET A 206 24.978 3.225 -20.121 1.00 0.00 H new ATOM 0 HA MET A 206 23.332 0.915 -19.769 1.00 0.00 H new ATOM 0 HB2 MET A 206 23.717 3.458 -18.141 1.00 0.00 H new ATOM 0 HB3 MET A 206 22.793 2.072 -17.596 1.00 0.00 H new ATOM 0 HG2 MET A 206 24.941 0.692 -17.980 1.00 0.00 H new ATOM 0 HG3 MET A 206 25.771 2.229 -18.127 1.00 0.00 H new ATOM 0 HE1 MET A 206 24.817 3.850 -14.602 1.00 0.00 H new ATOM 0 HE2 MET A 206 25.053 4.191 -16.332 1.00 0.00 H new ATOM 0 HE3 MET A 206 23.465 3.648 -15.740 1.00 0.00 H new ATOM 1317 N GLU A 207 21.907 3.799 -20.457 1.00 0.00 N ATOM 1318 CA GLU A 207 20.653 4.422 -20.862 1.00 0.00 C ATOM 1319 C GLU A 207 19.951 3.587 -21.929 1.00 0.00 C ATOM 1320 O GLU A 207 18.723 3.505 -21.960 1.00 0.00 O ATOM 1321 CB GLU A 207 20.907 5.836 -21.390 1.00 0.00 C ATOM 1322 CG GLU A 207 21.190 6.852 -20.297 1.00 0.00 C ATOM 1323 CD GLU A 207 20.291 8.069 -20.385 1.00 0.00 C ATOM 1324 OE1 GLU A 207 19.138 7.990 -19.911 1.00 0.00 O ATOM 1325 OE2 GLU A 207 20.739 9.101 -20.927 1.00 0.00 O ATOM 0 H GLU A 207 22.717 4.417 -20.496 1.00 0.00 H new ATOM 0 HA GLU A 207 20.006 4.480 -19.987 1.00 0.00 H new ATOM 0 HB2 GLU A 207 21.751 5.811 -22.079 1.00 0.00 H new ATOM 0 HB3 GLU A 207 20.039 6.163 -21.962 1.00 0.00 H new ATOM 0 HG2 GLU A 207 21.060 6.379 -19.324 1.00 0.00 H new ATOM 0 HG3 GLU A 207 22.231 7.169 -20.361 1.00 0.00 H new ATOM 1332 N ARG A 208 20.740 2.969 -22.803 1.00 0.00 N ATOM 1333 CA ARG A 208 20.195 2.142 -23.872 1.00 0.00 C ATOM 1334 C ARG A 208 19.656 0.826 -23.321 1.00 0.00 C ATOM 1335 O ARG A 208 18.666 0.290 -23.819 1.00 0.00 O ATOM 1336 CB ARG A 208 21.267 1.864 -24.927 1.00 0.00 C ATOM 1337 CG ARG A 208 20.737 1.153 -26.162 1.00 0.00 C ATOM 1338 CD ARG A 208 20.942 1.988 -27.416 1.00 0.00 C ATOM 1339 NE ARG A 208 20.550 1.266 -28.624 1.00 0.00 N ATOM 1340 CZ ARG A 208 19.294 1.157 -29.040 1.00 0.00 C ATOM 1341 NH1 ARG A 208 18.312 1.721 -28.350 1.00 0.00 N ATOM 1342 NH2 ARG A 208 19.017 0.484 -30.150 1.00 0.00 N ATOM 0 H ARG A 208 21.758 3.026 -22.791 1.00 0.00 H new ATOM 0 HA ARG A 208 19.372 2.687 -24.334 1.00 0.00 H new ATOM 0 HB2 ARG A 208 21.721 2.808 -25.229 1.00 0.00 H new ATOM 0 HB3 ARG A 208 22.056 1.259 -24.480 1.00 0.00 H new ATOM 0 HG2 ARG A 208 21.242 0.194 -26.276 1.00 0.00 H new ATOM 0 HG3 ARG A 208 19.675 0.941 -26.034 1.00 0.00 H new ATOM 0 HD2 ARG A 208 20.361 2.907 -27.338 1.00 0.00 H new ATOM 0 HD3 ARG A 208 21.990 2.278 -27.491 1.00 0.00 H new ATOM 0 HE ARG A 208 21.282 0.821 -29.178 1.00 0.00 H new ATOM 0 HH11 ARG A 208 18.521 2.240 -27.497 1.00 0.00 H new ATOM 0 HH12 ARG A 208 17.348 1.636 -28.672 1.00 0.00 H new ATOM 0 HH21 ARG A 208 19.770 0.050 -30.684 1.00 0.00 H new ATOM 0 HH22 ARG A 208 18.052 0.401 -30.469 1.00 0.00 H new ATOM 1356 N VAL A 209 20.314 0.308 -22.288 1.00 0.00 N ATOM 1357 CA VAL A 209 19.902 -0.945 -21.668 1.00 0.00 C ATOM 1358 C VAL A 209 18.636 -0.757 -20.840 1.00 0.00 C ATOM 1359 O VAL A 209 17.797 -1.655 -20.756 1.00 0.00 O ATOM 1360 CB VAL A 209 21.012 -1.518 -20.767 1.00 0.00 C ATOM 1361 CG1 VAL A 209 20.641 -2.912 -20.284 1.00 0.00 C ATOM 1362 CG2 VAL A 209 22.341 -1.537 -21.507 1.00 0.00 C ATOM 0 H VAL A 209 21.136 0.738 -21.863 1.00 0.00 H new ATOM 0 HA VAL A 209 19.703 -1.648 -22.477 1.00 0.00 H new ATOM 0 HB VAL A 209 21.117 -0.873 -19.894 1.00 0.00 H new ATOM 0 HG11 VAL A 209 21.437 -3.301 -19.649 1.00 0.00 H new ATOM 0 HG12 VAL A 209 19.713 -2.865 -19.715 1.00 0.00 H new ATOM 0 HG13 VAL A 209 20.507 -3.571 -21.142 1.00 0.00 H new ATOM 0 HG21 VAL A 209 23.114 -1.945 -20.856 1.00 0.00 H new ATOM 0 HG22 VAL A 209 22.252 -2.158 -22.398 1.00 0.00 H new ATOM 0 HG23 VAL A 209 22.610 -0.522 -21.798 1.00 0.00 H new ATOM 1372 N VAL A 210 18.503 0.416 -20.229 1.00 0.00 N ATOM 1373 CA VAL A 210 17.338 0.723 -19.407 1.00 0.00 C ATOM 1374 C VAL A 210 16.089 0.889 -20.266 1.00 0.00 C ATOM 1375 O VAL A 210 14.990 0.515 -19.858 1.00 0.00 O ATOM 1376 CB VAL A 210 17.555 2.005 -18.583 1.00 0.00 C ATOM 1377 CG1 VAL A 210 16.322 2.320 -17.750 1.00 0.00 C ATOM 1378 CG2 VAL A 210 18.786 1.868 -17.698 1.00 0.00 C ATOM 0 H VAL A 210 19.188 1.170 -20.288 1.00 0.00 H new ATOM 0 HA VAL A 210 17.199 -0.117 -18.727 1.00 0.00 H new ATOM 0 HB VAL A 210 17.721 2.834 -19.271 1.00 0.00 H new ATOM 0 HG11 VAL A 210 16.494 3.229 -17.174 1.00 0.00 H new ATOM 0 HG12 VAL A 210 15.465 2.464 -18.408 1.00 0.00 H new ATOM 0 HG13 VAL A 210 16.122 1.492 -17.069 1.00 0.00 H new ATOM 0 HG21 VAL A 210 18.924 2.783 -17.123 1.00 0.00 H new ATOM 0 HG22 VAL A 210 18.653 1.028 -17.017 1.00 0.00 H new ATOM 0 HG23 VAL A 210 19.664 1.695 -18.320 1.00 0.00 H new ATOM 1388 N GLU A 211 16.267 1.452 -21.457 1.00 0.00 N ATOM 1389 CA GLU A 211 15.153 1.668 -22.373 1.00 0.00 C ATOM 1390 C GLU A 211 14.598 0.339 -22.877 1.00 0.00 C ATOM 1391 O GLU A 211 13.401 0.074 -22.769 1.00 0.00 O ATOM 1392 CB GLU A 211 15.596 2.530 -23.556 1.00 0.00 C ATOM 1393 CG GLU A 211 14.560 2.624 -24.663 1.00 0.00 C ATOM 1394 CD GLU A 211 14.878 3.712 -25.670 1.00 0.00 C ATOM 1395 OE1 GLU A 211 14.735 4.903 -25.321 1.00 0.00 O ATOM 1396 OE2 GLU A 211 15.270 3.373 -26.806 1.00 0.00 O ATOM 0 H GLU A 211 17.171 1.766 -21.810 1.00 0.00 H new ATOM 0 HA GLU A 211 14.365 2.189 -21.829 1.00 0.00 H new ATOM 0 HB2 GLU A 211 15.824 3.534 -23.198 1.00 0.00 H new ATOM 0 HB3 GLU A 211 16.519 2.121 -23.967 1.00 0.00 H new ATOM 0 HG2 GLU A 211 14.496 1.665 -25.178 1.00 0.00 H new ATOM 0 HG3 GLU A 211 13.581 2.816 -24.224 1.00 0.00 H new ATOM 1403 N GLN A 212 15.477 -0.492 -23.428 1.00 0.00 N ATOM 1404 CA GLN A 212 15.075 -1.793 -23.950 1.00 0.00 C ATOM 1405 C GLN A 212 14.311 -2.589 -22.898 1.00 0.00 C ATOM 1406 O GLN A 212 13.361 -3.304 -23.216 1.00 0.00 O ATOM 1407 CB GLN A 212 16.301 -2.581 -24.413 1.00 0.00 C ATOM 1408 CG GLN A 212 16.004 -3.567 -25.531 1.00 0.00 C ATOM 1409 CD GLN A 212 16.280 -5.003 -25.132 1.00 0.00 C ATOM 1410 OE1 GLN A 212 15.485 -5.627 -24.429 1.00 0.00 O ATOM 1411 NE2 GLN A 212 17.411 -5.536 -25.580 1.00 0.00 N ATOM 0 H GLN A 212 16.472 -0.288 -23.524 1.00 0.00 H new ATOM 0 HA GLN A 212 14.416 -1.627 -24.802 1.00 0.00 H new ATOM 0 HB2 GLN A 212 17.066 -1.882 -24.750 1.00 0.00 H new ATOM 0 HB3 GLN A 212 16.717 -3.122 -23.563 1.00 0.00 H new ATOM 0 HG2 GLN A 212 14.959 -3.471 -25.827 1.00 0.00 H new ATOM 0 HG3 GLN A 212 16.607 -3.314 -26.403 1.00 0.00 H new ATOM 0 HE21 GLN A 212 18.041 -4.982 -26.160 1.00 0.00 H new ATOM 0 HE22 GLN A 212 17.649 -6.499 -25.344 1.00 0.00 H new ATOM 1420 N MET A 213 14.732 -2.460 -21.644 1.00 0.00 N ATOM 1421 CA MET A 213 14.086 -3.168 -20.545 1.00 0.00 C ATOM 1422 C MET A 213 12.596 -2.846 -20.492 1.00 0.00 C ATOM 1423 O MET A 213 11.775 -3.708 -20.176 1.00 0.00 O ATOM 1424 CB MET A 213 14.746 -2.800 -19.215 1.00 0.00 C ATOM 1425 CG MET A 213 15.259 -4.001 -18.438 1.00 0.00 C ATOM 1426 SD MET A 213 17.053 -3.997 -18.256 1.00 0.00 S ATOM 1427 CE MET A 213 17.290 -2.518 -17.274 1.00 0.00 C ATOM 0 H MET A 213 15.517 -1.872 -21.364 1.00 0.00 H new ATOM 0 HA MET A 213 14.203 -4.238 -20.717 1.00 0.00 H new ATOM 0 HB2 MET A 213 15.576 -2.120 -19.407 1.00 0.00 H new ATOM 0 HB3 MET A 213 14.027 -2.260 -18.599 1.00 0.00 H new ATOM 0 HG2 MET A 213 14.798 -4.014 -17.451 1.00 0.00 H new ATOM 0 HG3 MET A 213 14.951 -4.915 -18.945 1.00 0.00 H new ATOM 0 HE1 MET A 213 18.105 -1.929 -17.695 1.00 0.00 H new ATOM 0 HE2 MET A 213 16.374 -1.927 -17.280 1.00 0.00 H new ATOM 0 HE3 MET A 213 17.535 -2.797 -16.249 1.00 0.00 H new ATOM 1437 N CYS A 214 12.253 -1.601 -20.803 1.00 0.00 N ATOM 1438 CA CYS A 214 10.862 -1.164 -20.791 1.00 0.00 C ATOM 1439 C CYS A 214 10.016 -2.015 -21.734 1.00 0.00 C ATOM 1440 O CYS A 214 8.847 -2.288 -21.460 1.00 0.00 O ATOM 1441 CB CYS A 214 10.764 0.309 -21.190 1.00 0.00 C ATOM 1442 SG CYS A 214 9.417 1.216 -20.364 1.00 0.00 S ATOM 0 H CYS A 214 12.920 -0.876 -21.067 1.00 0.00 H new ATOM 0 HA CYS A 214 10.479 -1.285 -19.778 1.00 0.00 H new ATOM 0 HB2 CYS A 214 11.710 0.800 -20.963 1.00 0.00 H new ATOM 0 HB3 CYS A 214 10.623 0.373 -22.269 1.00 0.00 H new ATOM 0 HG CYS A 214 9.779 2.449 -20.170 1.00 0.00 H new ATOM 1447 N ILE A 215 10.616 -2.431 -22.844 1.00 0.00 N ATOM 1448 CA ILE A 215 9.919 -3.252 -23.827 1.00 0.00 C ATOM 1449 C ILE A 215 9.705 -4.670 -23.306 1.00 0.00 C ATOM 1450 O ILE A 215 8.713 -5.321 -23.634 1.00 0.00 O ATOM 1451 CB ILE A 215 10.692 -3.317 -25.157 1.00 0.00 C ATOM 1452 CG1 ILE A 215 10.992 -1.906 -25.666 1.00 0.00 C ATOM 1453 CG2 ILE A 215 9.901 -4.103 -26.192 1.00 0.00 C ATOM 1454 CD1 ILE A 215 9.752 -1.081 -25.927 1.00 0.00 C ATOM 0 H ILE A 215 11.583 -2.213 -23.085 1.00 0.00 H new ATOM 0 HA ILE A 215 8.952 -2.781 -24.002 1.00 0.00 H new ATOM 0 HB ILE A 215 11.638 -3.830 -24.986 1.00 0.00 H new ATOM 0 HG12 ILE A 215 11.615 -1.390 -24.935 1.00 0.00 H new ATOM 0 HG13 ILE A 215 11.572 -1.976 -26.586 1.00 0.00 H new ATOM 0 HG21 ILE A 215 10.461 -4.140 -27.127 1.00 0.00 H new ATOM 0 HG22 ILE A 215 9.734 -5.117 -25.829 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.941 -3.616 -26.363 1.00 0.00 H new ATOM 0 HD11 ILE A 215 10.041 -0.093 -26.285 1.00 0.00 H new ATOM 0 HD12 ILE A 215 9.138 -1.575 -26.680 1.00 0.00 H new ATOM 0 HD13 ILE A 215 9.182 -0.979 -25.004 1.00 0.00 H new ATOM 1466 N THR A 216 10.642 -5.142 -22.490 1.00 0.00 N ATOM 1467 CA THR A 216 10.557 -6.482 -21.923 1.00 0.00 C ATOM 1468 C THR A 216 9.467 -6.561 -20.861 1.00 0.00 C ATOM 1469 O THR A 216 8.679 -7.506 -20.837 1.00 0.00 O ATOM 1470 CB THR A 216 11.898 -6.915 -21.300 1.00 0.00 C ATOM 1471 OG1 THR A 216 12.979 -6.562 -22.171 1.00 0.00 O ATOM 1472 CG2 THR A 216 11.916 -8.414 -21.043 1.00 0.00 C ATOM 0 H THR A 216 11.469 -4.616 -22.207 1.00 0.00 H new ATOM 0 HA THR A 216 10.311 -7.157 -22.743 1.00 0.00 H new ATOM 0 HB THR A 216 12.015 -6.398 -20.348 1.00 0.00 H new ATOM 0 HG1 THR A 216 13.828 -6.839 -21.767 1.00 0.00 H new ATOM 0 HG21 THR A 216 12.873 -8.696 -20.603 1.00 0.00 H new ATOM 0 HG22 THR A 216 11.110 -8.675 -20.357 1.00 0.00 H new ATOM 0 HG23 THR A 216 11.778 -8.946 -21.984 1.00 0.00 H new ATOM 1480 N GLN A 217 9.428 -5.563 -19.985 1.00 0.00 N ATOM 1481 CA GLN A 217 8.433 -5.521 -18.919 1.00 0.00 C ATOM 1482 C GLN A 217 7.022 -5.629 -19.488 1.00 0.00 C ATOM 1483 O GLN A 217 6.137 -6.223 -18.872 1.00 0.00 O ATOM 1484 CB GLN A 217 8.573 -4.229 -18.113 1.00 0.00 C ATOM 1485 CG GLN A 217 8.723 -4.458 -16.617 1.00 0.00 C ATOM 1486 CD GLN A 217 7.660 -5.384 -16.060 1.00 0.00 C ATOM 1487 OE1 GLN A 217 6.471 -5.065 -16.077 1.00 0.00 O ATOM 1488 NE2 GLN A 217 8.084 -6.539 -15.560 1.00 0.00 N ATOM 0 H GLN A 217 10.073 -4.773 -19.992 1.00 0.00 H new ATOM 0 HA GLN A 217 8.606 -6.372 -18.260 1.00 0.00 H new ATOM 0 HB2 GLN A 217 9.439 -3.676 -18.476 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.698 -3.603 -18.290 1.00 0.00 H new ATOM 0 HG2 GLN A 217 9.708 -4.878 -16.414 1.00 0.00 H new ATOM 0 HG3 GLN A 217 8.673 -3.500 -16.100 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.079 -6.763 -15.566 1.00 0.00 H new ATOM 0 HE22 GLN A 217 7.415 -7.202 -15.170 1.00 0.00 H new ATOM 1497 N TYR A 218 6.818 -5.050 -20.666 1.00 0.00 N ATOM 1498 CA TYR A 218 5.514 -5.078 -21.317 1.00 0.00 C ATOM 1499 C TYR A 218 5.652 -5.406 -22.800 1.00 0.00 C ATOM 1500 O TYR A 218 6.190 -4.615 -23.574 1.00 0.00 O ATOM 1501 CB TYR A 218 4.805 -3.734 -21.144 1.00 0.00 C ATOM 1502 CG TYR A 218 4.642 -3.316 -19.700 1.00 0.00 C ATOM 1503 CD1 TYR A 218 4.046 -4.164 -18.774 1.00 0.00 C ATOM 1504 CD2 TYR A 218 5.085 -2.075 -19.261 1.00 0.00 C ATOM 1505 CE1 TYR A 218 3.895 -3.786 -17.454 1.00 0.00 C ATOM 1506 CE2 TYR A 218 4.939 -1.689 -17.943 1.00 0.00 C ATOM 1507 CZ TYR A 218 4.343 -2.548 -17.043 1.00 0.00 C ATOM 1508 OH TYR A 218 4.196 -2.168 -15.728 1.00 0.00 O ATOM 0 H TYR A 218 7.540 -4.555 -21.190 1.00 0.00 H new ATOM 0 HA TYR A 218 4.918 -5.859 -20.845 1.00 0.00 H new ATOM 0 HB2 TYR A 218 5.367 -2.965 -21.675 1.00 0.00 H new ATOM 0 HB3 TYR A 218 3.821 -3.789 -21.611 1.00 0.00 H new ATOM 0 HD1 TYR A 218 3.695 -5.135 -19.092 1.00 0.00 H new ATOM 0 HD2 TYR A 218 5.552 -1.400 -19.963 1.00 0.00 H new ATOM 0 HE1 TYR A 218 3.429 -4.456 -16.747 1.00 0.00 H new ATOM 0 HE2 TYR A 218 5.289 -0.720 -17.619 1.00 0.00 H new ATOM 0 HH TYR A 218 4.565 -1.268 -15.604 1.00 0.00 H new