USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 867 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 108 CYS SG : rot 77:sc= -0.812 USER MOD Set 1.2: A 121 MET CE :methyl -120:sc= -3.45! (180deg=-1.63!) USER MOD Set 2.1: A 49 LYS NZ :NH3+ -179:sc= 1.54 (180deg=1.21) USER MOD Set 2.2: A 90 TYR OH : rot 30:sc= 0.0063 USER MOD Set 3.1: A 44 MET CE :methyl -139:sc= -0.114 (180deg=-0.428) USER MOD Set 3.2: A 46 SER OG : rot -20:sc= 0.733 USER MOD Set 4.1: A 23 ASN : amide:sc= -1.52! X(o=-0.65!,f=-1.1) USER MOD Set 4.2: A 24 SER OG : rot 180:sc= 0 USER MOD Set 4.3: A 26 THR OG1 : rot 50:sc= 0.875 USER MOD Single : A 13 LYS NZ :NH3+ -141:sc= -2.75! (180deg=-5.59!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -120:sc= -2.84! (180deg=-5.63!) USER MOD Single : A 21 THR OG1 : rot -31:sc= 0.326 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0102) USER MOD Single : A 37 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0141) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -159:sc= -2.07 (180deg=-3.23) USER MOD Single : A 59 LYS NZ :NH3+ -125:sc= -2.62 (180deg=-6.73!) USER MOD Single : A 60 SER OG : rot -78:sc= 0.00364 USER MOD Single : A 62 THR OG1 : rot -148:sc= -3.21! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 120:sc= -0.735 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -167:sc= -0.0187 (180deg=-0.225) USER MOD Single : A 96 SER OG : rot 138:sc= 0.833 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 119:sc= 0.0164 USER MOD Single : A 105 GLN :FLIP amide:sc= -3.03 F(o=-5.4!,f=-3) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 123 LYS NZ :NH3+ 164:sc= -0.0704 (180deg=-0.378) USER MOD Single : A 127 GLN :FLIP amide:sc= -5.32! C(o=-13!,f=-5.3!) USER MOD Single : A 129 ASN :FLIP amide:sc= -1.25 F(o=-8.7!,f=-1.2) USER MOD Single : A 132 GLN :FLIP amide:sc= -1.47 F(o=-3.5!,f=-1.5) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl 169:sc= -1.16 (180deg=-1.74) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 2.773 -12.709 4.914 1.00 0.00 N ATOM 161 CA LEU A 12 2.224 -11.465 5.433 1.00 0.00 C ATOM 162 C LEU A 12 3.057 -10.278 4.971 1.00 0.00 C ATOM 163 O LEU A 12 2.515 -9.282 4.493 1.00 0.00 O ATOM 164 CB LEU A 12 2.164 -11.522 6.964 1.00 0.00 C ATOM 165 CG LEU A 12 1.406 -10.370 7.631 1.00 0.00 C ATOM 166 CD1 LEU A 12 -0.063 -10.394 7.237 1.00 0.00 C ATOM 167 CD2 LEU A 12 1.557 -10.442 9.143 1.00 0.00 C ATOM 0 HA LEU A 12 1.213 -11.337 5.047 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.697 -12.462 7.258 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.183 -11.538 7.351 1.00 0.00 H new ATOM 0 HG LEU A 12 1.835 -9.429 7.285 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.583 -9.568 7.721 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.151 -10.294 6.155 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.509 -11.338 7.552 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.013 -9.617 9.603 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.154 -11.388 9.504 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.612 -10.373 9.407 1.00 0.00 H new ATOM 179 N LYS A 13 4.378 -10.394 5.093 1.00 0.00 N ATOM 180 CA LYS A 13 5.265 -9.328 4.651 1.00 0.00 C ATOM 181 C LYS A 13 4.977 -9.030 3.191 1.00 0.00 C ATOM 182 O LYS A 13 5.083 -7.891 2.737 1.00 0.00 O ATOM 183 CB LYS A 13 6.731 -9.720 4.848 1.00 0.00 C ATOM 184 CG LYS A 13 7.714 -8.723 4.255 1.00 0.00 C ATOM 185 CD LYS A 13 9.163 -9.153 4.457 1.00 0.00 C ATOM 186 CE LYS A 13 9.507 -10.412 3.669 1.00 0.00 C ATOM 187 NZ LYS A 13 8.867 -11.630 4.240 1.00 0.00 N ATOM 0 H LYS A 13 4.850 -11.206 5.490 1.00 0.00 H new ATOM 0 HA LYS A 13 5.086 -8.434 5.249 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.930 -9.823 5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.901 -10.697 4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.516 -8.610 3.189 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.559 -7.746 4.713 1.00 0.00 H new ATOM 0 HD2 LYS A 13 9.826 -8.343 4.152 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.343 -9.330 5.517 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.188 -10.288 2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.589 -10.545 3.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.531 -12.428 4.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.614 -11.456 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.009 -11.857 3.699 1.00 0.00 H new ATOM 201 N GLU A 14 4.560 -10.069 2.472 1.00 0.00 N ATOM 202 CA GLU A 14 4.194 -9.931 1.075 1.00 0.00 C ATOM 203 C GLU A 14 2.820 -9.298 0.986 1.00 0.00 C ATOM 204 O GLU A 14 2.571 -8.458 0.127 1.00 0.00 O ATOM 205 CB GLU A 14 4.199 -11.286 0.369 1.00 0.00 C ATOM 206 CG GLU A 14 5.593 -11.800 0.060 1.00 0.00 C ATOM 207 CD GLU A 14 6.428 -12.021 1.304 1.00 0.00 C ATOM 208 OE1 GLU A 14 6.011 -12.825 2.165 1.00 0.00 O ATOM 209 OE2 GLU A 14 7.502 -11.391 1.418 1.00 0.00 O ATOM 0 H GLU A 14 4.469 -11.016 2.840 1.00 0.00 H new ATOM 0 HA GLU A 14 4.927 -9.296 0.577 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.681 -12.014 0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.635 -11.205 -0.560 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.515 -12.737 -0.491 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.101 -11.089 -0.591 1.00 0.00 H new ATOM 216 N LEU A 15 1.940 -9.690 1.908 1.00 0.00 N ATOM 217 CA LEU A 15 0.592 -9.142 1.958 1.00 0.00 C ATOM 218 C LEU A 15 0.659 -7.627 2.044 1.00 0.00 C ATOM 219 O LEU A 15 -0.242 -6.921 1.593 1.00 0.00 O ATOM 220 CB LEU A 15 -0.176 -9.690 3.162 1.00 0.00 C ATOM 221 CG LEU A 15 -1.625 -9.215 3.269 1.00 0.00 C ATOM 222 CD1 LEU A 15 -2.416 -9.632 2.041 1.00 0.00 C ATOM 223 CD2 LEU A 15 -2.273 -9.751 4.535 1.00 0.00 C ATOM 0 H LEU A 15 2.140 -10.384 2.628 1.00 0.00 H new ATOM 0 HA LEU A 15 0.067 -9.437 1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.168 -10.779 3.115 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.353 -9.406 4.072 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.626 -8.126 3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.445 -9.285 2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.965 -9.192 1.151 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.406 -10.718 1.954 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.304 -9.401 4.592 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.260 -10.841 4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.721 -9.396 5.405 1.00 0.00 H new ATOM 235 N PHE A 16 1.748 -7.138 2.623 1.00 0.00 N ATOM 236 CA PHE A 16 1.957 -5.710 2.765 1.00 0.00 C ATOM 237 C PHE A 16 2.240 -5.069 1.415 1.00 0.00 C ATOM 238 O PHE A 16 1.676 -4.029 1.086 1.00 0.00 O ATOM 239 CB PHE A 16 3.123 -5.423 3.709 1.00 0.00 C ATOM 240 CG PHE A 16 3.644 -4.019 3.555 1.00 0.00 C ATOM 241 CD1 PHE A 16 2.817 -2.929 3.779 1.00 0.00 C ATOM 242 CD2 PHE A 16 4.948 -3.791 3.144 1.00 0.00 C ATOM 243 CE1 PHE A 16 3.280 -1.641 3.597 1.00 0.00 C ATOM 244 CE2 PHE A 16 5.418 -2.504 2.967 1.00 0.00 C ATOM 245 CZ PHE A 16 4.582 -1.428 3.191 1.00 0.00 C ATOM 0 H PHE A 16 2.500 -7.714 3.002 1.00 0.00 H new ATOM 0 HA PHE A 16 1.044 -5.284 3.182 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.802 -5.579 4.739 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.928 -6.131 3.515 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.798 -3.089 4.100 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.604 -4.629 2.960 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.624 -0.801 3.772 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.438 -2.340 2.654 1.00 0.00 H new ATOM 0 HZ PHE A 16 4.946 -0.421 3.049 1.00 0.00 H new ATOM 255 N LYS A 17 3.106 -5.703 0.630 1.00 0.00 N ATOM 256 CA LYS A 17 3.443 -5.183 -0.687 1.00 0.00 C ATOM 257 C LYS A 17 2.372 -5.619 -1.655 1.00 0.00 C ATOM 258 O LYS A 17 2.266 -5.123 -2.776 1.00 0.00 O ATOM 259 CB LYS A 17 4.824 -5.662 -1.139 1.00 0.00 C ATOM 260 CG LYS A 17 4.944 -7.170 -1.267 1.00 0.00 C ATOM 261 CD LYS A 17 6.333 -7.575 -1.731 1.00 0.00 C ATOM 262 CE LYS A 17 6.433 -9.076 -1.949 1.00 0.00 C ATOM 263 NZ LYS A 17 7.801 -9.489 -2.368 1.00 0.00 N ATOM 0 H LYS A 17 3.582 -6.569 0.881 1.00 0.00 H new ATOM 0 HA LYS A 17 3.487 -4.095 -0.650 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.058 -5.206 -2.101 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.571 -5.308 -0.428 1.00 0.00 H new ATOM 0 HG2 LYS A 17 4.729 -7.637 -0.306 1.00 0.00 H new ATOM 0 HG3 LYS A 17 4.200 -7.538 -1.974 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.574 -7.055 -2.658 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.070 -7.264 -0.991 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.164 -9.595 -1.029 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.714 -9.381 -2.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 7.826 -10.520 -2.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.049 -9.014 -3.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.485 -9.222 -1.632 1.00 0.00 H new ATOM 277 N MET A 18 1.564 -6.547 -1.174 1.00 0.00 N ATOM 278 CA MET A 18 0.459 -7.079 -1.929 1.00 0.00 C ATOM 279 C MET A 18 -0.514 -5.949 -2.217 1.00 0.00 C ATOM 280 O MET A 18 -1.260 -5.974 -3.196 1.00 0.00 O ATOM 281 CB MET A 18 -0.220 -8.178 -1.115 1.00 0.00 C ATOM 282 CG MET A 18 -0.800 -9.314 -1.934 1.00 0.00 C ATOM 283 SD MET A 18 0.356 -10.004 -3.141 1.00 0.00 S ATOM 284 CE MET A 18 0.100 -8.922 -4.547 1.00 0.00 C ATOM 0 H MET A 18 1.662 -6.951 -0.242 1.00 0.00 H new ATOM 0 HA MET A 18 0.804 -7.506 -2.871 1.00 0.00 H new ATOM 0 HB2 MET A 18 0.504 -8.589 -0.412 1.00 0.00 H new ATOM 0 HB3 MET A 18 -1.019 -7.731 -0.524 1.00 0.00 H new ATOM 0 HG2 MET A 18 -1.124 -10.107 -1.260 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.687 -8.957 -2.457 1.00 0.00 H new ATOM 0 HE1 MET A 18 -0.240 -9.509 -5.401 1.00 0.00 H new ATOM 0 HE2 MET A 18 -0.653 -8.174 -4.298 1.00 0.00 H new ATOM 0 HE3 MET A 18 1.037 -8.424 -4.798 1.00 0.00 H new ATOM 294 N ILE A 19 -0.478 -4.947 -1.340 1.00 0.00 N ATOM 295 CA ILE A 19 -1.328 -3.773 -1.462 1.00 0.00 C ATOM 296 C ILE A 19 -0.672 -2.728 -2.362 1.00 0.00 C ATOM 297 O ILE A 19 -1.225 -2.346 -3.394 1.00 0.00 O ATOM 298 CB ILE A 19 -1.614 -3.141 -0.083 1.00 0.00 C ATOM 299 CG1 ILE A 19 -2.264 -4.169 0.856 1.00 0.00 C ATOM 300 CG2 ILE A 19 -2.489 -1.909 -0.241 1.00 0.00 C ATOM 301 CD1 ILE A 19 -3.086 -3.561 1.976 1.00 0.00 C ATOM 0 H ILE A 19 0.140 -4.930 -0.529 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.270 -4.099 -1.903 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.670 -2.831 0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.904 -4.827 0.268 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.482 -4.791 1.292 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.683 -1.473 0.739 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -1.979 -1.178 -0.869 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.433 -2.191 -0.707 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.508 -4.356 2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -2.449 -2.926 2.592 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -3.893 -2.963 1.552 1.00 0.00 H new ATOM 313 N ASP A 20 0.517 -2.282 -1.963 1.00 0.00 N ATOM 314 CA ASP A 20 1.270 -1.293 -2.728 1.00 0.00 C ATOM 315 C ASP A 20 2.043 -1.964 -3.851 1.00 0.00 C ATOM 316 O ASP A 20 3.270 -1.877 -3.927 1.00 0.00 O ATOM 317 CB ASP A 20 2.230 -0.540 -1.812 1.00 0.00 C ATOM 318 CG ASP A 20 2.882 -1.447 -0.790 1.00 0.00 C ATOM 319 OD1 ASP A 20 2.200 -1.826 0.180 1.00 0.00 O ATOM 320 OD2 ASP A 20 4.066 -1.791 -0.967 1.00 0.00 O ATOM 0 H ASP A 20 0.981 -2.592 -1.109 1.00 0.00 H new ATOM 0 HA ASP A 20 0.566 -0.585 -3.164 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.002 -0.061 -2.414 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.689 0.254 -1.297 1.00 0.00 H new ATOM 325 N THR A 21 1.309 -2.661 -4.698 1.00 0.00 N ATOM 326 CA THR A 21 1.892 -3.397 -5.811 1.00 0.00 C ATOM 327 C THR A 21 2.187 -2.496 -7.005 1.00 0.00 C ATOM 328 O THR A 21 2.776 -2.941 -7.991 1.00 0.00 O ATOM 329 CB THR A 21 0.937 -4.509 -6.231 1.00 0.00 C ATOM 330 OG1 THR A 21 1.562 -5.392 -7.147 1.00 0.00 O ATOM 331 CG2 THR A 21 -0.328 -3.993 -6.884 1.00 0.00 C ATOM 0 H THR A 21 0.294 -2.735 -4.637 1.00 0.00 H new ATOM 0 HA THR A 21 2.841 -3.815 -5.476 1.00 0.00 H new ATOM 0 HB THR A 21 0.670 -5.024 -5.308 1.00 0.00 H new ATOM 0 HG1 THR A 21 2.213 -4.897 -7.687 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.965 -4.834 -7.159 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.861 -3.348 -6.186 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.070 -3.425 -7.778 1.00 0.00 H new ATOM 339 N ASP A 22 1.763 -1.242 -6.931 1.00 0.00 N ATOM 340 CA ASP A 22 1.977 -0.312 -8.033 1.00 0.00 C ATOM 341 C ASP A 22 2.608 0.996 -7.566 1.00 0.00 C ATOM 342 O ASP A 22 3.087 1.781 -8.384 1.00 0.00 O ATOM 343 CB ASP A 22 0.650 -0.021 -8.735 1.00 0.00 C ATOM 344 CG ASP A 22 -0.378 0.581 -7.796 1.00 0.00 C ATOM 345 OD1 ASP A 22 -0.059 0.764 -6.605 1.00 0.00 O ATOM 346 OD2 ASP A 22 -1.504 0.867 -8.255 1.00 0.00 O ATOM 0 H ASP A 22 1.273 -0.847 -6.128 1.00 0.00 H new ATOM 0 HA ASP A 22 2.670 -0.785 -8.729 1.00 0.00 H new ATOM 0 HB2 ASP A 22 0.824 0.662 -9.566 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.255 -0.945 -9.158 1.00 0.00 H new ATOM 351 N ASN A 23 2.597 1.241 -6.261 1.00 0.00 N ATOM 352 CA ASN A 23 3.158 2.469 -5.726 1.00 0.00 C ATOM 353 C ASN A 23 4.682 2.436 -5.752 1.00 0.00 C ATOM 354 O ASN A 23 5.307 2.905 -6.703 1.00 0.00 O ATOM 355 CB ASN A 23 2.664 2.707 -4.294 1.00 0.00 C ATOM 356 CG ASN A 23 3.059 4.067 -3.741 1.00 0.00 C ATOM 357 OD1 ASN A 23 2.771 4.381 -2.587 1.00 0.00 O ATOM 358 ND2 ASN A 23 3.710 4.888 -4.560 1.00 0.00 N ATOM 0 H ASN A 23 2.208 0.609 -5.561 1.00 0.00 H new ATOM 0 HA ASN A 23 2.822 3.291 -6.359 1.00 0.00 H new ATOM 0 HB2 ASN A 23 1.578 2.614 -4.271 1.00 0.00 H new ATOM 0 HB3 ASN A 23 3.064 1.928 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN A 23 3.989 5.815 -4.238 1.00 0.00 H new ATOM 0 HD22 ASN A 23 3.931 4.591 -5.510 1.00 0.00 H new ATOM 365 N SER A 24 5.270 1.888 -4.694 1.00 0.00 N ATOM 366 CA SER A 24 6.724 1.805 -4.579 1.00 0.00 C ATOM 367 C SER A 24 7.125 1.061 -3.312 1.00 0.00 C ATOM 368 O SER A 24 8.299 1.023 -2.945 1.00 0.00 O ATOM 369 CB SER A 24 7.325 3.209 -4.565 1.00 0.00 C ATOM 370 OG SER A 24 6.734 4.001 -3.549 1.00 0.00 O ATOM 0 H SER A 24 4.762 1.494 -3.902 1.00 0.00 H new ATOM 0 HA SER A 24 7.106 1.255 -5.439 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.401 3.147 -4.404 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.175 3.683 -5.535 1.00 0.00 H new ATOM 0 HG SER A 24 7.135 4.895 -3.557 1.00 0.00 H new ATOM 376 N GLY A 25 6.132 0.513 -2.624 1.00 0.00 N ATOM 377 CA GLY A 25 6.376 -0.176 -1.377 1.00 0.00 C ATOM 378 C GLY A 25 5.796 0.590 -0.206 1.00 0.00 C ATOM 379 O GLY A 25 6.311 0.532 0.911 1.00 0.00 O ATOM 0 H GLY A 25 5.154 0.535 -2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.936 -1.173 -1.417 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.449 -0.306 -1.234 1.00 0.00 H new ATOM 383 N THR A 26 4.695 1.294 -0.477 1.00 0.00 N ATOM 384 CA THR A 26 3.988 2.071 0.536 1.00 0.00 C ATOM 385 C THR A 26 2.507 2.132 0.202 1.00 0.00 C ATOM 386 O THR A 26 2.122 2.130 -0.966 1.00 0.00 O ATOM 387 CB THR A 26 4.541 3.484 0.654 1.00 0.00 C ATOM 388 OG1 THR A 26 4.524 4.142 -0.600 1.00 0.00 O ATOM 389 CG2 THR A 26 5.954 3.542 1.190 1.00 0.00 C ATOM 0 H THR A 26 4.271 1.340 -1.404 1.00 0.00 H new ATOM 0 HA THR A 26 4.133 1.572 1.494 1.00 0.00 H new ATOM 0 HB THR A 26 3.885 3.983 1.368 1.00 0.00 H new ATOM 0 HG1 THR A 26 3.634 4.057 -1.002 1.00 0.00 H new ATOM 0 HG21 THR A 26 6.280 4.581 1.246 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.984 3.098 2.185 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.618 2.989 0.526 1.00 0.00 H new ATOM 397 N ILE A 27 1.683 2.141 1.233 1.00 0.00 N ATOM 398 CA ILE A 27 0.243 2.133 1.046 1.00 0.00 C ATOM 399 C ILE A 27 -0.398 3.488 1.259 1.00 0.00 C ATOM 400 O ILE A 27 -0.604 3.923 2.381 1.00 0.00 O ATOM 401 CB ILE A 27 -0.384 1.152 2.030 1.00 0.00 C ATOM 402 CG1 ILE A 27 0.338 -0.188 1.924 1.00 0.00 C ATOM 403 CG2 ILE A 27 -1.872 1.007 1.768 1.00 0.00 C ATOM 404 CD1 ILE A 27 -0.413 -1.338 2.541 1.00 0.00 C ATOM 0 H ILE A 27 1.985 2.154 2.207 1.00 0.00 H new ATOM 0 HA ILE A 27 0.065 1.842 0.011 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.274 1.530 3.046 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.520 -0.409 0.872 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.312 -0.103 2.405 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.300 0.302 2.481 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.357 1.977 1.880 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.029 0.638 0.755 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.165 -2.255 2.425 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.572 -1.141 3.601 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.377 -1.452 2.044 1.00 0.00 H new ATOM 416 N THR A 28 -0.754 4.137 0.173 1.00 0.00 N ATOM 417 CA THR A 28 -1.394 5.429 0.267 1.00 0.00 C ATOM 418 C THR A 28 -2.886 5.302 0.011 1.00 0.00 C ATOM 419 O THR A 28 -3.349 4.275 -0.461 1.00 0.00 O ATOM 420 CB THR A 28 -0.748 6.407 -0.709 1.00 0.00 C ATOM 421 OG1 THR A 28 -0.856 5.939 -2.042 1.00 0.00 O ATOM 422 CG2 THR A 28 0.719 6.630 -0.412 1.00 0.00 C ATOM 0 H THR A 28 -0.613 3.795 -0.777 1.00 0.00 H new ATOM 0 HA THR A 28 -1.260 5.818 1.276 1.00 0.00 H new ATOM 0 HB THR A 28 -1.284 7.348 -0.589 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.436 6.583 -2.650 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.134 7.334 -1.134 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.829 7.035 0.594 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.253 5.682 -0.482 1.00 0.00 H new ATOM 430 N PHE A 29 -3.619 6.343 0.372 1.00 0.00 N ATOM 431 CA PHE A 29 -5.079 6.379 0.242 1.00 0.00 C ATOM 432 C PHE A 29 -5.583 5.615 -0.988 1.00 0.00 C ATOM 433 O PHE A 29 -6.639 4.985 -0.939 1.00 0.00 O ATOM 434 CB PHE A 29 -5.538 7.834 0.147 1.00 0.00 C ATOM 435 CG PHE A 29 -6.988 8.041 0.480 1.00 0.00 C ATOM 436 CD1 PHE A 29 -7.380 8.289 1.784 1.00 0.00 C ATOM 437 CD2 PHE A 29 -7.955 8.001 -0.512 1.00 0.00 C ATOM 438 CE1 PHE A 29 -8.711 8.488 2.095 1.00 0.00 C ATOM 439 CE2 PHE A 29 -9.287 8.200 -0.207 1.00 0.00 C ATOM 440 CZ PHE A 29 -9.667 8.444 1.099 1.00 0.00 C ATOM 0 H PHE A 29 -3.222 7.195 0.767 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.496 5.892 1.123 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -4.931 8.440 0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -5.353 8.197 -0.864 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -6.637 8.327 2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.664 7.812 -1.535 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -9.004 8.678 3.117 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.031 8.165 -0.989 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.708 8.600 1.340 1.00 0.00 H new ATOM 450 N ASP A 30 -4.836 5.677 -2.084 1.00 0.00 N ATOM 451 CA ASP A 30 -5.229 4.991 -3.313 1.00 0.00 C ATOM 452 C ASP A 30 -4.971 3.485 -3.227 1.00 0.00 C ATOM 453 O ASP A 30 -5.857 2.676 -3.517 1.00 0.00 O ATOM 454 CB ASP A 30 -4.475 5.579 -4.507 1.00 0.00 C ATOM 455 CG ASP A 30 -4.729 7.064 -4.683 1.00 0.00 C ATOM 456 OD1 ASP A 30 -5.497 7.637 -3.881 1.00 0.00 O ATOM 457 OD2 ASP A 30 -4.159 7.655 -5.624 1.00 0.00 O ATOM 0 H ASP A 30 -3.958 6.192 -2.149 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.300 5.141 -3.447 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -3.406 5.410 -4.376 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -4.772 5.053 -5.414 1.00 0.00 H new ATOM 462 N GLU A 31 -3.761 3.110 -2.819 1.00 0.00 N ATOM 463 CA GLU A 31 -3.412 1.699 -2.694 1.00 0.00 C ATOM 464 C GLU A 31 -4.039 1.094 -1.455 1.00 0.00 C ATOM 465 O GLU A 31 -4.202 -0.120 -1.369 1.00 0.00 O ATOM 466 CB GLU A 31 -1.895 1.501 -2.682 1.00 0.00 C ATOM 467 CG GLU A 31 -1.302 1.386 -4.076 1.00 0.00 C ATOM 468 CD GLU A 31 -1.252 2.717 -4.802 1.00 0.00 C ATOM 469 OE1 GLU A 31 -2.328 3.290 -5.071 1.00 0.00 O ATOM 470 OE2 GLU A 31 -0.134 3.186 -5.098 1.00 0.00 O ATOM 0 H GLU A 31 -3.013 3.757 -2.572 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.811 1.182 -3.567 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.429 2.338 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.656 0.601 -2.116 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.294 0.977 -4.005 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.892 0.680 -4.660 1.00 0.00 H new ATOM 477 N LEU A 32 -4.417 1.949 -0.513 1.00 0.00 N ATOM 478 CA LEU A 32 -5.051 1.501 0.711 1.00 0.00 C ATOM 479 C LEU A 32 -6.127 0.490 0.360 1.00 0.00 C ATOM 480 O LEU A 32 -6.221 -0.590 0.945 1.00 0.00 O ATOM 481 CB LEU A 32 -5.675 2.686 1.442 1.00 0.00 C ATOM 482 CG LEU A 32 -5.945 2.468 2.936 1.00 0.00 C ATOM 483 CD1 LEU A 32 -7.119 1.524 3.149 1.00 0.00 C ATOM 484 CD2 LEU A 32 -4.703 1.924 3.627 1.00 0.00 C ATOM 0 H LEU A 32 -4.293 2.959 -0.578 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.307 1.043 1.363 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.017 3.548 1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.616 2.939 0.953 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.200 3.433 3.375 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.287 1.388 4.217 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.014 1.947 2.692 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.898 0.560 2.691 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -4.912 1.775 4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.423 0.973 3.175 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.884 2.634 3.515 1.00 0.00 H new ATOM 496 N LYS A 33 -6.922 0.871 -0.625 1.00 0.00 N ATOM 497 CA LYS A 33 -8.007 0.044 -1.128 1.00 0.00 C ATOM 498 C LYS A 33 -7.514 -0.944 -2.187 1.00 0.00 C ATOM 499 O LYS A 33 -7.770 -2.148 -2.093 1.00 0.00 O ATOM 500 CB LYS A 33 -9.114 0.926 -1.714 1.00 0.00 C ATOM 501 CG LYS A 33 -8.687 2.366 -1.961 1.00 0.00 C ATOM 502 CD LYS A 33 -9.620 3.079 -2.920 1.00 0.00 C ATOM 503 CE LYS A 33 -11.042 3.072 -2.406 1.00 0.00 C ATOM 504 NZ LYS A 33 -11.941 3.912 -3.243 1.00 0.00 N ATOM 0 H LYS A 33 -6.833 1.768 -1.102 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.404 -0.529 -0.290 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -9.453 0.491 -2.654 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.967 0.921 -1.035 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.661 2.904 -1.013 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.674 2.380 -2.363 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.286 4.107 -3.060 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.581 2.596 -3.896 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.416 2.048 -2.387 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.058 3.436 -1.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.898 3.907 -2.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.581 4.887 -3.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.973 3.530 -4.210 1.00 0.00 H new ATOM 518 N ASP A 34 -6.811 -0.425 -3.194 1.00 0.00 N ATOM 519 CA ASP A 34 -6.294 -1.246 -4.290 1.00 0.00 C ATOM 520 C ASP A 34 -5.836 -2.626 -3.820 1.00 0.00 C ATOM 521 O ASP A 34 -5.987 -3.616 -4.534 1.00 0.00 O ATOM 522 CB ASP A 34 -5.131 -0.529 -4.969 1.00 0.00 C ATOM 523 CG ASP A 34 -5.569 0.723 -5.707 1.00 0.00 C ATOM 524 OD1 ASP A 34 -6.777 1.040 -5.678 1.00 0.00 O ATOM 525 OD2 ASP A 34 -4.701 1.386 -6.314 1.00 0.00 O ATOM 0 H ASP A 34 -6.585 0.567 -3.274 1.00 0.00 H new ATOM 0 HA ASP A 34 -7.112 -1.393 -4.995 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -4.386 -0.263 -4.220 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.649 -1.210 -5.670 1.00 0.00 H new ATOM 530 N GLY A 35 -5.264 -2.681 -2.627 1.00 0.00 N ATOM 531 CA GLY A 35 -4.777 -3.937 -2.092 1.00 0.00 C ATOM 532 C GLY A 35 -5.860 -4.957 -1.743 1.00 0.00 C ATOM 533 O GLY A 35 -5.824 -6.084 -2.240 1.00 0.00 O ATOM 0 H GLY A 35 -5.128 -1.875 -2.017 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.099 -4.385 -2.818 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.193 -3.730 -1.196 1.00 0.00 H new ATOM 537 N LEU A 36 -6.809 -4.598 -0.871 1.00 0.00 N ATOM 538 CA LEU A 36 -7.838 -5.563 -0.467 1.00 0.00 C ATOM 539 C LEU A 36 -8.860 -5.798 -1.566 1.00 0.00 C ATOM 540 O LEU A 36 -9.436 -6.882 -1.659 1.00 0.00 O ATOM 541 CB LEU A 36 -8.512 -5.178 0.873 1.00 0.00 C ATOM 542 CG LEU A 36 -9.599 -4.086 0.861 1.00 0.00 C ATOM 543 CD1 LEU A 36 -9.093 -2.809 0.233 1.00 0.00 C ATOM 544 CD2 LEU A 36 -10.864 -4.561 0.162 1.00 0.00 C ATOM 0 H LEU A 36 -6.887 -3.676 -0.443 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.325 -6.510 -0.299 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.954 -6.081 1.294 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.728 -4.858 1.559 1.00 0.00 H new ATOM 0 HG LEU A 36 -9.849 -3.876 1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.885 -2.061 0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -8.238 -2.439 0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -8.789 -3.005 -0.795 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -11.607 -3.764 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.632 -4.826 -0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.260 -5.434 0.680 1.00 0.00 H new ATOM 556 N LYS A 37 -9.079 -4.801 -2.410 1.00 0.00 N ATOM 557 CA LYS A 37 -10.022 -4.946 -3.500 1.00 0.00 C ATOM 558 C LYS A 37 -9.512 -5.984 -4.496 1.00 0.00 C ATOM 559 O LYS A 37 -10.203 -6.335 -5.453 1.00 0.00 O ATOM 560 CB LYS A 37 -10.253 -3.601 -4.187 1.00 0.00 C ATOM 561 CG LYS A 37 -9.008 -3.007 -4.817 1.00 0.00 C ATOM 562 CD LYS A 37 -9.337 -1.794 -5.677 1.00 0.00 C ATOM 563 CE LYS A 37 -9.950 -0.669 -4.857 1.00 0.00 C ATOM 564 NZ LYS A 37 -10.286 0.512 -5.699 1.00 0.00 N ATOM 0 H LYS A 37 -8.619 -3.892 -2.359 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.976 -5.290 -3.100 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.014 -3.724 -4.958 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.650 -2.896 -3.457 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.306 -2.719 -4.034 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -8.513 -3.762 -5.427 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.429 -1.436 -6.163 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.028 -2.086 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.851 -1.030 -4.362 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -9.254 -0.370 -4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.763 1.229 -5.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.413 0.914 -6.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.917 0.219 -6.472 1.00 0.00 H new ATOM 578 N ARG A 38 -8.295 -6.481 -4.254 1.00 0.00 N ATOM 579 CA ARG A 38 -7.691 -7.487 -5.117 1.00 0.00 C ATOM 580 C ARG A 38 -8.097 -8.897 -4.693 1.00 0.00 C ATOM 581 O ARG A 38 -8.396 -9.744 -5.536 1.00 0.00 O ATOM 582 CB ARG A 38 -6.166 -7.345 -5.097 1.00 0.00 C ATOM 583 CG ARG A 38 -5.429 -8.494 -5.769 1.00 0.00 C ATOM 584 CD ARG A 38 -3.959 -8.166 -5.979 1.00 0.00 C ATOM 585 NE ARG A 38 -3.787 -7.065 -6.924 1.00 0.00 N ATOM 586 CZ ARG A 38 -2.607 -6.590 -7.307 1.00 0.00 C ATOM 587 NH1 ARG A 38 -1.487 -7.089 -6.799 1.00 0.00 N ATOM 588 NH2 ARG A 38 -2.546 -5.609 -8.197 1.00 0.00 N ATOM 0 H ARG A 38 -7.713 -6.199 -3.465 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.053 -7.326 -6.132 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -5.892 -6.413 -5.591 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.832 -7.268 -4.062 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.519 -9.392 -5.158 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -5.895 -8.714 -6.730 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.504 -7.902 -5.024 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.437 -9.049 -6.348 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.625 -6.634 -7.314 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -1.530 -7.841 -6.111 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.584 -6.721 -7.097 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -3.405 -5.220 -8.587 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.641 -5.243 -8.492 1.00 0.00 H new ATOM 602 N VAL A 39 -8.095 -9.150 -3.387 1.00 0.00 N ATOM 603 CA VAL A 39 -8.453 -10.464 -2.857 1.00 0.00 C ATOM 604 C VAL A 39 -9.952 -10.732 -2.946 1.00 0.00 C ATOM 605 O VAL A 39 -10.422 -11.796 -2.544 1.00 0.00 O ATOM 606 CB VAL A 39 -8.010 -10.610 -1.388 1.00 0.00 C ATOM 607 CG1 VAL A 39 -6.494 -10.577 -1.281 1.00 0.00 C ATOM 608 CG2 VAL A 39 -8.634 -9.520 -0.531 1.00 0.00 C ATOM 0 H VAL A 39 -7.849 -8.462 -2.675 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.930 -11.194 -3.475 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.357 -11.575 -1.018 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.201 -10.681 -0.236 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.070 -11.397 -1.861 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.122 -9.629 -1.669 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.310 -9.640 0.503 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.320 -8.543 -0.899 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -9.720 -9.595 -0.581 1.00 0.00 H new ATOM 618 N GLY A 40 -10.700 -9.768 -3.470 1.00 0.00 N ATOM 619 CA GLY A 40 -12.137 -9.935 -3.591 1.00 0.00 C ATOM 620 C GLY A 40 -12.906 -8.960 -2.722 1.00 0.00 C ATOM 621 O GLY A 40 -13.959 -8.461 -3.120 1.00 0.00 O ATOM 0 H GLY A 40 -10.340 -8.877 -3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -12.430 -9.799 -4.632 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -12.406 -10.954 -3.315 1.00 0.00 H new ATOM 625 N SER A 41 -12.370 -8.684 -1.536 1.00 0.00 N ATOM 626 CA SER A 41 -12.998 -7.753 -0.602 1.00 0.00 C ATOM 627 C SER A 41 -13.294 -6.422 -1.289 1.00 0.00 C ATOM 628 O SER A 41 -12.618 -6.052 -2.248 1.00 0.00 O ATOM 629 CB SER A 41 -12.085 -7.541 0.608 1.00 0.00 C ATOM 630 OG SER A 41 -12.130 -8.652 1.484 1.00 0.00 O ATOM 0 H SER A 41 -11.499 -9.093 -1.198 1.00 0.00 H new ATOM 0 HA SER A 41 -13.943 -8.176 -0.263 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.061 -7.382 0.271 1.00 0.00 H new ATOM 0 HB3 SER A 41 -12.388 -6.641 1.142 1.00 0.00 H new ATOM 0 HG SER A 41 -11.537 -8.491 2.247 1.00 0.00 H new ATOM 636 N GLU A 42 -14.307 -5.704 -0.803 1.00 0.00 N ATOM 637 CA GLU A 42 -14.668 -4.420 -1.400 1.00 0.00 C ATOM 638 C GLU A 42 -15.115 -3.403 -0.352 1.00 0.00 C ATOM 639 O GLU A 42 -16.234 -3.459 0.156 1.00 0.00 O ATOM 640 CB GLU A 42 -15.778 -4.611 -2.436 1.00 0.00 C ATOM 641 CG GLU A 42 -15.374 -5.484 -3.612 1.00 0.00 C ATOM 642 CD GLU A 42 -16.489 -5.648 -4.626 1.00 0.00 C ATOM 643 OE1 GLU A 42 -16.943 -4.625 -5.180 1.00 0.00 O ATOM 644 OE2 GLU A 42 -16.909 -6.799 -4.866 1.00 0.00 O ATOM 0 H GLU A 42 -14.884 -5.985 -0.010 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.774 -4.028 -1.885 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.646 -5.054 -1.948 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -16.086 -3.634 -2.809 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.504 -5.047 -4.102 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.074 -6.466 -3.245 1.00 0.00 H new ATOM 651 N LEU A 43 -14.222 -2.467 -0.051 1.00 0.00 N ATOM 652 CA LEU A 43 -14.475 -1.413 0.910 1.00 0.00 C ATOM 653 C LEU A 43 -14.722 -0.075 0.209 1.00 0.00 C ATOM 654 O LEU A 43 -14.471 0.061 -0.989 1.00 0.00 O ATOM 655 CB LEU A 43 -13.301 -1.326 1.880 1.00 0.00 C ATOM 656 CG LEU A 43 -11.896 -1.287 1.264 1.00 0.00 C ATOM 657 CD1 LEU A 43 -11.781 -0.240 0.169 1.00 0.00 C ATOM 658 CD2 LEU A 43 -10.864 -1.028 2.351 1.00 0.00 C ATOM 0 H LEU A 43 -13.295 -2.423 -0.474 1.00 0.00 H new ATOM 0 HA LEU A 43 -15.380 -1.648 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -13.430 -0.432 2.490 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -13.353 -2.181 2.554 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.708 -2.257 0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.770 -0.248 -0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -12.493 -0.464 -0.625 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.997 0.745 0.583 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.868 -1.001 1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.073 -0.072 2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.910 -1.825 3.093 1.00 0.00 H new ATOM 670 N MET A 44 -15.206 0.912 0.958 1.00 0.00 N ATOM 671 CA MET A 44 -15.472 2.236 0.412 1.00 0.00 C ATOM 672 C MET A 44 -14.390 3.199 0.864 1.00 0.00 C ATOM 673 O MET A 44 -13.643 2.896 1.792 1.00 0.00 O ATOM 674 CB MET A 44 -16.818 2.748 0.911 1.00 0.00 C ATOM 675 CG MET A 44 -17.804 1.640 1.209 1.00 0.00 C ATOM 676 SD MET A 44 -19.477 2.250 1.489 1.00 0.00 S ATOM 677 CE MET A 44 -19.215 3.326 2.896 1.00 0.00 C ATOM 0 H MET A 44 -15.422 0.817 1.950 1.00 0.00 H new ATOM 0 HA MET A 44 -15.486 2.169 -0.676 1.00 0.00 H new ATOM 0 HB2 MET A 44 -16.663 3.340 1.813 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.246 3.415 0.162 1.00 0.00 H new ATOM 0 HG2 MET A 44 -17.814 0.935 0.378 1.00 0.00 H new ATOM 0 HG3 MET A 44 -17.471 1.090 2.089 1.00 0.00 H new ATOM 0 HE1 MET A 44 -20.035 3.206 3.604 1.00 0.00 H new ATOM 0 HE2 MET A 44 -18.275 3.066 3.382 1.00 0.00 H new ATOM 0 HE3 MET A 44 -19.175 4.362 2.559 1.00 0.00 H new ATOM 687 N GLU A 45 -14.313 4.363 0.226 1.00 0.00 N ATOM 688 CA GLU A 45 -13.317 5.355 0.601 1.00 0.00 C ATOM 689 C GLU A 45 -13.303 5.552 2.106 1.00 0.00 C ATOM 690 O GLU A 45 -12.274 5.347 2.739 1.00 0.00 O ATOM 691 CB GLU A 45 -13.555 6.668 -0.119 1.00 0.00 C ATOM 692 CG GLU A 45 -13.207 6.613 -1.596 1.00 0.00 C ATOM 693 CD GLU A 45 -13.356 7.956 -2.286 1.00 0.00 C ATOM 694 OE1 GLU A 45 -13.735 8.934 -1.609 1.00 0.00 O ATOM 695 OE2 GLU A 45 -13.093 8.028 -3.505 1.00 0.00 O ATOM 0 H GLU A 45 -14.922 4.639 -0.544 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.338 4.986 0.296 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.602 6.950 -0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.963 7.449 0.358 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -12.181 6.263 -1.710 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.849 5.883 -2.089 1.00 0.00 H new ATOM 702 N SER A 46 -14.431 5.971 2.684 1.00 0.00 N ATOM 703 CA SER A 46 -14.523 6.198 4.123 1.00 0.00 C ATOM 704 C SER A 46 -13.772 5.139 4.925 1.00 0.00 C ATOM 705 O SER A 46 -13.184 5.450 5.958 1.00 0.00 O ATOM 706 CB SER A 46 -15.992 6.213 4.545 1.00 0.00 C ATOM 707 OG SER A 46 -16.585 4.937 4.371 1.00 0.00 O ATOM 0 H SER A 46 -15.294 6.160 2.174 1.00 0.00 H new ATOM 0 HA SER A 46 -14.058 7.161 4.334 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.071 6.515 5.589 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.535 6.953 3.957 1.00 0.00 H new ATOM 0 HG SER A 46 -16.049 4.410 3.742 1.00 0.00 H new ATOM 713 N GLU A 47 -13.772 3.895 4.445 1.00 0.00 N ATOM 714 CA GLU A 47 -13.069 2.818 5.130 1.00 0.00 C ATOM 715 C GLU A 47 -11.567 3.064 5.091 1.00 0.00 C ATOM 716 O GLU A 47 -10.865 2.859 6.079 1.00 0.00 O ATOM 717 CB GLU A 47 -13.400 1.465 4.491 1.00 0.00 C ATOM 718 CG GLU A 47 -14.744 0.895 4.923 1.00 0.00 C ATOM 719 CD GLU A 47 -15.933 1.621 4.321 1.00 0.00 C ATOM 720 OE1 GLU A 47 -15.722 2.561 3.534 1.00 0.00 O ATOM 721 OE2 GLU A 47 -17.080 1.240 4.639 1.00 0.00 O ATOM 0 H GLU A 47 -14.249 3.612 3.589 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.397 2.798 6.169 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.394 1.574 3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -12.615 0.752 4.744 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.791 -0.157 4.641 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.815 0.938 6.010 1.00 0.00 H new ATOM 728 N ILE A 48 -11.090 3.523 3.940 1.00 0.00 N ATOM 729 CA ILE A 48 -9.681 3.827 3.745 1.00 0.00 C ATOM 730 C ILE A 48 -9.197 4.845 4.768 1.00 0.00 C ATOM 731 O ILE A 48 -8.291 4.571 5.556 1.00 0.00 O ATOM 732 CB ILE A 48 -9.422 4.379 2.325 1.00 0.00 C ATOM 733 CG1 ILE A 48 -9.485 3.259 1.302 1.00 0.00 C ATOM 734 CG2 ILE A 48 -8.073 5.078 2.251 1.00 0.00 C ATOM 735 CD1 ILE A 48 -10.860 2.672 1.118 1.00 0.00 C ATOM 0 H ILE A 48 -11.669 3.694 3.118 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.130 2.895 3.874 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.200 5.108 2.100 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -9.132 3.637 0.343 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.800 2.466 1.604 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -7.915 5.457 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.054 5.908 2.958 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.282 4.370 2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -10.820 1.879 0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.210 2.261 2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.546 3.450 0.784 1.00 0.00 H new ATOM 747 N LYS A 49 -9.806 6.022 4.744 1.00 0.00 N ATOM 748 CA LYS A 49 -9.439 7.087 5.660 1.00 0.00 C ATOM 749 C LYS A 49 -9.742 6.679 7.095 1.00 0.00 C ATOM 750 O LYS A 49 -9.112 7.161 8.040 1.00 0.00 O ATOM 751 CB LYS A 49 -10.199 8.364 5.308 1.00 0.00 C ATOM 752 CG LYS A 49 -9.667 9.593 6.020 1.00 0.00 C ATOM 753 CD LYS A 49 -10.563 10.799 5.799 1.00 0.00 C ATOM 754 CE LYS A 49 -9.878 12.076 6.248 1.00 0.00 C ATOM 755 NZ LYS A 49 -9.262 11.927 7.595 1.00 0.00 N ATOM 0 H LYS A 49 -10.558 6.262 4.098 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.369 7.273 5.568 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.146 8.525 4.231 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.251 8.234 5.560 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -9.587 9.389 7.088 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.662 9.815 5.662 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -10.824 10.874 4.743 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.495 10.670 6.349 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.110 12.350 5.525 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.603 12.890 6.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.818 12.825 7.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.996 11.673 8.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.540 11.179 7.566 1.00 0.00 H new ATOM 769 N ASP A 50 -10.704 5.773 7.251 1.00 0.00 N ATOM 770 CA ASP A 50 -11.082 5.288 8.573 1.00 0.00 C ATOM 771 C ASP A 50 -9.981 4.404 9.126 1.00 0.00 C ATOM 772 O ASP A 50 -9.682 4.429 10.317 1.00 0.00 O ATOM 773 CB ASP A 50 -12.395 4.503 8.515 1.00 0.00 C ATOM 774 CG ASP A 50 -12.871 4.049 9.882 1.00 0.00 C ATOM 775 OD1 ASP A 50 -12.232 4.420 10.891 1.00 0.00 O ATOM 776 OD2 ASP A 50 -13.888 3.328 9.946 1.00 0.00 O ATOM 0 H ASP A 50 -11.233 5.362 6.482 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.226 6.148 9.227 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.164 5.124 8.056 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.264 3.632 7.873 1.00 0.00 H new ATOM 781 N LEU A 51 -9.373 3.627 8.241 1.00 0.00 N ATOM 782 CA LEU A 51 -8.296 2.735 8.620 1.00 0.00 C ATOM 783 C LEU A 51 -7.011 3.526 8.826 1.00 0.00 C ATOM 784 O LEU A 51 -6.112 3.091 9.539 1.00 0.00 O ATOM 785 CB LEU A 51 -8.109 1.655 7.550 1.00 0.00 C ATOM 786 CG LEU A 51 -7.023 0.621 7.845 1.00 0.00 C ATOM 787 CD1 LEU A 51 -7.349 -0.698 7.161 1.00 0.00 C ATOM 788 CD2 LEU A 51 -5.666 1.124 7.381 1.00 0.00 C ATOM 0 H LEU A 51 -9.612 3.599 7.250 1.00 0.00 H new ATOM 0 HA LEU A 51 -8.550 2.245 9.560 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -9.057 1.133 7.415 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.876 2.142 6.603 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.987 0.461 8.923 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.567 -1.425 7.380 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.305 -1.072 7.528 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.410 -0.544 6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.906 0.374 7.600 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -5.694 1.310 6.307 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.423 2.050 7.903 1.00 0.00 H new ATOM 800 N MET A 52 -6.937 4.697 8.205 1.00 0.00 N ATOM 801 CA MET A 52 -5.768 5.554 8.327 1.00 0.00 C ATOM 802 C MET A 52 -5.684 6.190 9.711 1.00 0.00 C ATOM 803 O MET A 52 -4.621 6.240 10.321 1.00 0.00 O ATOM 804 CB MET A 52 -5.803 6.652 7.268 1.00 0.00 C ATOM 805 CG MET A 52 -5.477 6.168 5.867 1.00 0.00 C ATOM 806 SD MET A 52 -3.856 5.383 5.764 1.00 0.00 S ATOM 807 CE MET A 52 -3.704 5.132 3.998 1.00 0.00 C ATOM 0 H MET A 52 -7.675 5.074 7.611 1.00 0.00 H new ATOM 0 HA MET A 52 -4.887 4.929 8.179 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.794 7.107 7.263 1.00 0.00 H new ATOM 0 HB3 MET A 52 -5.095 7.433 7.546 1.00 0.00 H new ATOM 0 HG2 MET A 52 -6.241 5.460 5.544 1.00 0.00 H new ATOM 0 HG3 MET A 52 -5.513 7.012 5.178 1.00 0.00 H new ATOM 0 HE1 MET A 52 -2.969 4.351 3.803 1.00 0.00 H new ATOM 0 HE2 MET A 52 -4.669 4.832 3.589 1.00 0.00 H new ATOM 0 HE3 MET A 52 -3.382 6.060 3.525 1.00 0.00 H new ATOM 817 N ASP A 53 -6.803 6.695 10.198 1.00 0.00 N ATOM 818 CA ASP A 53 -6.821 7.344 11.504 1.00 0.00 C ATOM 819 C ASP A 53 -7.061 6.348 12.634 1.00 0.00 C ATOM 820 O ASP A 53 -6.603 6.554 13.757 1.00 0.00 O ATOM 821 CB ASP A 53 -7.889 8.439 11.537 1.00 0.00 C ATOM 822 CG ASP A 53 -7.927 9.171 12.864 1.00 0.00 C ATOM 823 OD1 ASP A 53 -6.893 9.758 13.247 1.00 0.00 O ATOM 824 OD2 ASP A 53 -8.989 9.158 13.520 1.00 0.00 O ATOM 0 H ASP A 53 -7.703 6.671 9.719 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.838 7.790 11.659 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -7.697 9.154 10.737 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -8.866 7.996 11.342 1.00 0.00 H new ATOM 829 N ALA A 54 -7.796 5.282 12.342 1.00 0.00 N ATOM 830 CA ALA A 54 -8.106 4.279 13.353 1.00 0.00 C ATOM 831 C ALA A 54 -7.085 3.140 13.394 1.00 0.00 C ATOM 832 O ALA A 54 -7.013 2.413 14.386 1.00 0.00 O ATOM 833 CB ALA A 54 -9.504 3.723 13.132 1.00 0.00 C ATOM 0 H ALA A 54 -8.186 5.090 11.419 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.059 4.781 14.319 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.723 2.975 13.894 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.232 4.532 13.198 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.561 3.263 12.145 1.00 0.00 H new ATOM 839 N ALA A 55 -6.311 2.960 12.323 1.00 0.00 N ATOM 840 CA ALA A 55 -5.330 1.873 12.288 1.00 0.00 C ATOM 841 C ALA A 55 -3.920 2.345 11.940 1.00 0.00 C ATOM 842 O ALA A 55 -2.954 1.914 12.568 1.00 0.00 O ATOM 843 CB ALA A 55 -5.777 0.794 11.314 1.00 0.00 C ATOM 0 H ALA A 55 -6.341 3.539 11.484 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.282 1.465 13.297 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -5.040 -0.009 11.297 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.741 0.395 11.630 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.871 1.221 10.316 1.00 0.00 H new ATOM 849 N ASP A 56 -3.792 3.221 10.946 1.00 0.00 N ATOM 850 CA ASP A 56 -2.477 3.717 10.556 1.00 0.00 C ATOM 851 C ASP A 56 -1.835 4.451 11.731 1.00 0.00 C ATOM 852 O ASP A 56 -2.110 5.628 11.970 1.00 0.00 O ATOM 853 CB ASP A 56 -2.577 4.633 9.330 1.00 0.00 C ATOM 854 CG ASP A 56 -1.220 5.000 8.761 1.00 0.00 C ATOM 855 OD1 ASP A 56 -0.338 5.402 9.543 1.00 0.00 O ATOM 856 OD2 ASP A 56 -1.046 4.901 7.531 1.00 0.00 O ATOM 0 H ASP A 56 -4.570 3.597 10.404 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.849 2.869 10.283 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.168 4.138 8.559 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -3.110 5.544 9.604 1.00 0.00 H new ATOM 861 N ILE A 57 -0.999 3.728 12.470 1.00 0.00 N ATOM 862 CA ILE A 57 -0.318 4.265 13.647 1.00 0.00 C ATOM 863 C ILE A 57 0.340 5.613 13.363 1.00 0.00 C ATOM 864 O ILE A 57 0.594 6.396 14.279 1.00 0.00 O ATOM 865 CB ILE A 57 0.758 3.282 14.151 1.00 0.00 C ATOM 866 CG1 ILE A 57 0.182 1.865 14.247 1.00 0.00 C ATOM 867 CG2 ILE A 57 1.304 3.733 15.499 1.00 0.00 C ATOM 868 CD1 ILE A 57 -0.991 1.742 15.197 1.00 0.00 C ATOM 0 H ILE A 57 -0.774 2.753 12.271 1.00 0.00 H new ATOM 0 HA ILE A 57 -1.082 4.405 14.412 1.00 0.00 H new ATOM 0 HB ILE A 57 1.581 3.272 13.436 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.132 1.543 13.254 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.970 1.184 14.568 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.062 3.027 15.839 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.749 4.723 15.399 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.493 3.772 16.226 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -1.342 0.710 15.210 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.678 2.031 16.200 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.798 2.396 14.866 1.00 0.00 H new ATOM 880 N ASP A 58 0.619 5.875 12.093 1.00 0.00 N ATOM 881 CA ASP A 58 1.258 7.128 11.693 1.00 0.00 C ATOM 882 C ASP A 58 0.482 7.797 10.563 1.00 0.00 C ATOM 883 O ASP A 58 1.070 8.225 9.571 1.00 0.00 O ATOM 884 CB ASP A 58 2.704 6.871 11.261 1.00 0.00 C ATOM 885 CG ASP A 58 3.487 8.152 11.034 1.00 0.00 C ATOM 886 OD1 ASP A 58 2.920 9.244 11.250 1.00 0.00 O ATOM 887 OD2 ASP A 58 4.670 8.061 10.643 1.00 0.00 O ATOM 0 H ASP A 58 0.415 5.240 11.321 1.00 0.00 H new ATOM 0 HA ASP A 58 1.259 7.799 12.552 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.205 6.274 12.023 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.705 6.282 10.344 1.00 0.00 H new ATOM 892 N LYS A 59 -0.846 7.828 10.704 1.00 0.00 N ATOM 893 CA LYS A 59 -1.738 8.379 9.691 1.00 0.00 C ATOM 894 C LYS A 59 -1.112 9.541 8.926 1.00 0.00 C ATOM 895 O LYS A 59 -1.247 10.708 9.296 1.00 0.00 O ATOM 896 CB LYS A 59 -3.060 8.813 10.330 1.00 0.00 C ATOM 897 CG LYS A 59 -4.190 9.078 9.333 1.00 0.00 C ATOM 898 CD LYS A 59 -3.980 10.359 8.540 1.00 0.00 C ATOM 899 CE LYS A 59 -5.098 10.589 7.535 1.00 0.00 C ATOM 900 NZ LYS A 59 -5.171 9.500 6.524 1.00 0.00 N ATOM 0 H LYS A 59 -1.330 7.470 11.527 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.926 7.587 8.966 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.382 8.040 11.028 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.887 9.718 10.913 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.267 8.237 8.644 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.137 9.138 9.870 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.926 11.206 9.224 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.025 10.311 8.017 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -6.050 10.659 8.061 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.941 11.542 7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.115 9.908 5.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.379 8.841 6.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.070 8.988 6.629 1.00 0.00 H new ATOM 914 N SER A 60 -0.452 9.183 7.836 1.00 0.00 N ATOM 915 CA SER A 60 0.185 10.139 6.944 1.00 0.00 C ATOM 916 C SER A 60 -0.298 9.862 5.528 1.00 0.00 C ATOM 917 O SER A 60 0.318 10.271 4.543 1.00 0.00 O ATOM 918 CB SER A 60 1.708 10.023 7.022 1.00 0.00 C ATOM 919 OG SER A 60 2.141 8.725 6.650 1.00 0.00 O ATOM 0 H SER A 60 -0.342 8.212 7.543 1.00 0.00 H new ATOM 0 HA SER A 60 -0.082 11.154 7.239 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.166 10.764 6.367 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.041 10.244 8.036 1.00 0.00 H new ATOM 0 HG SER A 60 1.994 8.105 7.395 1.00 0.00 H new ATOM 925 N GLY A 61 -1.410 9.132 5.455 1.00 0.00 N ATOM 926 CA GLY A 61 -1.986 8.757 4.178 1.00 0.00 C ATOM 927 C GLY A 61 -1.136 7.724 3.470 1.00 0.00 C ATOM 928 O GLY A 61 -1.270 7.522 2.260 1.00 0.00 O ATOM 0 H GLY A 61 -1.925 8.792 6.267 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.990 8.361 4.332 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.086 9.641 3.549 1.00 0.00 H new ATOM 932 N THR A 62 -0.259 7.073 4.239 1.00 0.00 N ATOM 933 CA THR A 62 0.638 6.055 3.714 1.00 0.00 C ATOM 934 C THR A 62 0.963 5.017 4.791 1.00 0.00 C ATOM 935 O THR A 62 1.386 5.368 5.892 1.00 0.00 O ATOM 936 CB THR A 62 1.930 6.711 3.223 1.00 0.00 C ATOM 937 OG1 THR A 62 1.658 7.672 2.220 1.00 0.00 O ATOM 938 CG2 THR A 62 2.927 5.725 2.655 1.00 0.00 C ATOM 0 H THR A 62 -0.155 7.240 5.240 1.00 0.00 H new ATOM 0 HA THR A 62 0.146 5.551 2.882 1.00 0.00 H new ATOM 0 HB THR A 62 2.367 7.176 4.107 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.406 7.706 1.588 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.819 6.258 2.326 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.200 5.000 3.422 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.482 5.205 1.807 1.00 0.00 H new ATOM 946 N ILE A 63 0.757 3.740 4.469 1.00 0.00 N ATOM 947 CA ILE A 63 1.021 2.665 5.409 1.00 0.00 C ATOM 948 C ILE A 63 2.256 1.873 5.013 1.00 0.00 C ATOM 949 O ILE A 63 2.384 1.424 3.875 1.00 0.00 O ATOM 950 CB ILE A 63 -0.172 1.693 5.521 1.00 0.00 C ATOM 951 CG1 ILE A 63 -1.376 2.391 6.152 1.00 0.00 C ATOM 952 CG2 ILE A 63 0.214 0.462 6.331 1.00 0.00 C ATOM 953 CD1 ILE A 63 -2.602 1.510 6.251 1.00 0.00 C ATOM 0 H ILE A 63 0.408 3.431 3.562 1.00 0.00 H new ATOM 0 HA ILE A 63 1.186 3.141 6.376 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.447 1.372 4.516 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.104 2.735 7.150 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.621 3.276 5.565 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.640 -0.211 6.399 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.042 -0.051 5.842 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.517 0.766 7.333 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.417 2.071 6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.899 1.186 5.253 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.374 0.637 6.863 1.00 0.00 H new ATOM 965 N ASP A 64 3.154 1.693 5.967 1.00 0.00 N ATOM 966 CA ASP A 64 4.374 0.942 5.730 1.00 0.00 C ATOM 967 C ASP A 64 4.277 -0.428 6.378 1.00 0.00 C ATOM 968 O ASP A 64 3.369 -0.679 7.166 1.00 0.00 O ATOM 969 CB ASP A 64 5.594 1.702 6.253 1.00 0.00 C ATOM 970 CG ASP A 64 5.760 3.056 5.591 1.00 0.00 C ATOM 971 OD1 ASP A 64 5.908 3.097 4.352 1.00 0.00 O ATOM 972 OD2 ASP A 64 5.740 4.076 6.312 1.00 0.00 O ATOM 0 H ASP A 64 3.060 2.058 6.915 1.00 0.00 H new ATOM 0 HA ASP A 64 4.497 0.813 4.655 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.500 1.837 7.331 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.490 1.105 6.083 1.00 0.00 H new ATOM 977 N TYR A 65 5.206 -1.314 6.024 1.00 0.00 N ATOM 978 CA TYR A 65 5.223 -2.674 6.554 1.00 0.00 C ATOM 979 C TYR A 65 4.762 -2.713 8.006 1.00 0.00 C ATOM 980 O TYR A 65 3.950 -3.557 8.385 1.00 0.00 O ATOM 981 CB TYR A 65 6.627 -3.268 6.446 1.00 0.00 C ATOM 982 CG TYR A 65 6.728 -4.666 7.006 1.00 0.00 C ATOM 983 CD1 TYR A 65 5.959 -5.699 6.486 1.00 0.00 C ATOM 984 CD2 TYR A 65 7.587 -4.953 8.058 1.00 0.00 C ATOM 985 CE1 TYR A 65 6.044 -6.977 6.997 1.00 0.00 C ATOM 986 CE2 TYR A 65 7.679 -6.228 8.577 1.00 0.00 C ATOM 987 CZ TYR A 65 6.906 -7.238 8.044 1.00 0.00 C ATOM 988 OH TYR A 65 6.993 -8.512 8.557 1.00 0.00 O ATOM 0 H TYR A 65 5.961 -1.112 5.368 1.00 0.00 H new ATOM 0 HA TYR A 65 4.529 -3.268 5.958 1.00 0.00 H new ATOM 0 HB2 TYR A 65 6.929 -3.281 5.399 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.329 -2.621 6.972 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.283 -5.498 5.668 1.00 0.00 H new ATOM 0 HD2 TYR A 65 8.194 -4.164 8.478 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.440 -7.769 6.581 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.352 -6.434 9.396 1.00 0.00 H new ATOM 0 HH TYR A 65 7.645 -8.526 9.288 1.00 0.00 H new ATOM 998 N GLY A 66 5.280 -1.795 8.814 1.00 0.00 N ATOM 999 CA GLY A 66 4.901 -1.751 10.210 1.00 0.00 C ATOM 1000 C GLY A 66 3.433 -1.423 10.398 1.00 0.00 C ATOM 1001 O GLY A 66 2.670 -2.242 10.912 1.00 0.00 O ATOM 0 H GLY A 66 5.953 -1.084 8.527 1.00 0.00 H new ATOM 0 HA2 GLY A 66 5.118 -2.713 10.674 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.506 -1.005 10.725 1.00 0.00 H new ATOM 1005 N GLU A 67 3.036 -0.223 9.979 1.00 0.00 N ATOM 1006 CA GLU A 67 1.651 0.213 10.097 1.00 0.00 C ATOM 1007 C GLU A 67 0.701 -0.822 9.497 1.00 0.00 C ATOM 1008 O GLU A 67 -0.461 -0.913 9.894 1.00 0.00 O ATOM 1009 CB GLU A 67 1.476 1.556 9.390 1.00 0.00 C ATOM 1010 CG GLU A 67 2.518 2.588 9.792 1.00 0.00 C ATOM 1011 CD GLU A 67 2.412 3.871 8.992 1.00 0.00 C ATOM 1012 OE1 GLU A 67 1.482 3.981 8.166 1.00 0.00 O ATOM 1013 OE2 GLU A 67 3.259 4.765 9.191 1.00 0.00 O ATOM 0 H GLU A 67 3.658 0.465 9.554 1.00 0.00 H new ATOM 0 HA GLU A 67 1.409 0.323 11.154 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.526 1.401 8.312 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.483 1.948 9.610 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.407 2.816 10.852 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.513 2.164 9.660 1.00 0.00 H new ATOM 1020 N PHE A 68 1.205 -1.605 8.543 1.00 0.00 N ATOM 1021 CA PHE A 68 0.410 -2.633 7.893 1.00 0.00 C ATOM 1022 C PHE A 68 -0.011 -3.698 8.884 1.00 0.00 C ATOM 1023 O PHE A 68 -1.194 -3.891 9.153 1.00 0.00 O ATOM 1024 CB PHE A 68 1.224 -3.312 6.798 1.00 0.00 C ATOM 1025 CG PHE A 68 0.442 -4.328 6.025 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -0.576 -3.922 5.185 1.00 0.00 C ATOM 1027 CD2 PHE A 68 0.714 -5.680 6.143 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -1.311 -4.846 4.472 1.00 0.00 C ATOM 1029 CE2 PHE A 68 -0.021 -6.610 5.436 1.00 0.00 C ATOM 1030 CZ PHE A 68 -1.036 -6.192 4.600 1.00 0.00 C ATOM 0 H PHE A 68 2.166 -1.542 8.206 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.471 -2.149 7.473 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.601 -2.554 6.111 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.092 -3.795 7.246 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.799 -2.870 5.085 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.509 -6.010 6.795 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.101 -4.516 3.814 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.198 -7.663 5.537 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.614 -6.917 4.047 1.00 0.00 H new ATOM 1040 N ILE A 69 0.988 -4.401 9.393 1.00 0.00 N ATOM 1041 CA ILE A 69 0.774 -5.483 10.333 1.00 0.00 C ATOM 1042 C ILE A 69 -0.091 -5.043 11.511 1.00 0.00 C ATOM 1043 O ILE A 69 -0.971 -5.784 11.952 1.00 0.00 O ATOM 1044 CB ILE A 69 2.111 -6.032 10.858 1.00 0.00 C ATOM 1045 CG1 ILE A 69 3.131 -6.184 9.721 1.00 0.00 C ATOM 1046 CG2 ILE A 69 1.878 -7.369 11.519 1.00 0.00 C ATOM 1047 CD1 ILE A 69 2.674 -7.099 8.604 1.00 0.00 C ATOM 0 H ILE A 69 1.968 -4.236 9.165 1.00 0.00 H new ATOM 0 HA ILE A 69 0.250 -6.271 9.793 1.00 0.00 H new ATOM 0 HB ILE A 69 2.515 -5.326 11.583 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.347 -5.200 9.306 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.065 -6.568 10.133 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.824 -7.760 11.892 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.183 -7.248 12.350 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.458 -8.066 10.793 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.449 -7.155 7.839 1.00 0.00 H new ATOM 0 HD12 ILE A 69 2.486 -8.096 9.004 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.757 -6.706 8.164 1.00 0.00 H new ATOM 1059 N ALA A 70 0.153 -3.837 12.013 1.00 0.00 N ATOM 1060 CA ALA A 70 -0.619 -3.311 13.134 1.00 0.00 C ATOM 1061 C ALA A 70 -2.064 -3.059 12.718 1.00 0.00 C ATOM 1062 O ALA A 70 -2.976 -3.077 13.545 1.00 0.00 O ATOM 1063 CB ALA A 70 0.015 -2.033 13.663 1.00 0.00 C ATOM 0 H ALA A 70 0.876 -3.208 11.664 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.617 -4.053 13.932 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.573 -1.654 14.499 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.030 -2.243 14.000 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.043 -1.285 12.870 1.00 0.00 H new ATOM 1069 N ALA A 71 -2.258 -2.827 11.424 1.00 0.00 N ATOM 1070 CA ALA A 71 -3.586 -2.574 10.876 1.00 0.00 C ATOM 1071 C ALA A 71 -4.207 -3.857 10.331 1.00 0.00 C ATOM 1072 O ALA A 71 -5.400 -3.902 10.033 1.00 0.00 O ATOM 1073 CB ALA A 71 -3.516 -1.513 9.787 1.00 0.00 C ATOM 0 H ALA A 71 -1.509 -2.809 10.732 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.221 -2.207 11.682 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.514 -1.335 9.388 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.122 -0.587 10.206 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -2.861 -1.856 8.986 1.00 0.00 H new ATOM 1303 N VAL A 85 -20.907 1.906 9.370 1.00 0.00 N ATOM 1304 CA VAL A 85 -20.270 2.262 10.631 1.00 0.00 C ATOM 1305 C VAL A 85 -18.857 2.804 10.418 1.00 0.00 C ATOM 1306 O VAL A 85 -18.368 3.610 11.212 1.00 0.00 O ATOM 1307 CB VAL A 85 -20.226 1.064 11.597 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -19.352 -0.047 11.040 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -19.748 1.505 12.971 1.00 0.00 C ATOM 0 HA VAL A 85 -20.878 3.049 11.076 1.00 0.00 H new ATOM 0 HB VAL A 85 -21.236 0.669 11.703 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -19.336 -0.883 11.740 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -19.754 -0.382 10.084 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -18.338 0.325 10.896 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -19.723 0.645 13.641 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -18.748 1.930 12.889 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -20.430 2.256 13.370 1.00 0.00 H new ATOM 1319 N SER A 86 -18.213 2.373 9.334 1.00 0.00 N ATOM 1320 CA SER A 86 -16.867 2.833 9.014 1.00 0.00 C ATOM 1321 C SER A 86 -16.812 4.355 9.046 1.00 0.00 C ATOM 1322 O SER A 86 -16.008 4.944 9.769 1.00 0.00 O ATOM 1323 CB SER A 86 -16.441 2.320 7.637 1.00 0.00 C ATOM 1324 OG SER A 86 -16.446 0.904 7.596 1.00 0.00 O ATOM 0 H SER A 86 -18.602 1.708 8.666 1.00 0.00 H new ATOM 0 HA SER A 86 -16.178 2.439 9.761 1.00 0.00 H new ATOM 0 HB2 SER A 86 -17.115 2.711 6.875 1.00 0.00 H new ATOM 0 HB3 SER A 86 -15.443 2.690 7.400 1.00 0.00 H new ATOM 0 HG SER A 86 -17.073 0.599 6.908 1.00 0.00 H new ATOM 1330 N ALA A 87 -17.691 4.987 8.274 1.00 0.00 N ATOM 1331 CA ALA A 87 -17.762 6.440 8.233 1.00 0.00 C ATOM 1332 C ALA A 87 -18.561 6.953 9.420 1.00 0.00 C ATOM 1333 O ALA A 87 -18.202 7.954 10.034 1.00 0.00 O ATOM 1334 CB ALA A 87 -18.378 6.912 6.929 1.00 0.00 C ATOM 0 H ALA A 87 -18.363 4.514 7.669 1.00 0.00 H new ATOM 0 HA ALA A 87 -16.750 6.841 8.291 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -18.421 8.001 6.920 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -17.770 6.566 6.093 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -19.386 6.508 6.836 1.00 0.00 H new ATOM 1340 N PHE A 88 -19.638 6.242 9.748 1.00 0.00 N ATOM 1341 CA PHE A 88 -20.486 6.598 10.882 1.00 0.00 C ATOM 1342 C PHE A 88 -19.627 6.914 12.096 1.00 0.00 C ATOM 1343 O PHE A 88 -20.046 7.621 13.009 1.00 0.00 O ATOM 1344 CB PHE A 88 -21.436 5.448 11.207 1.00 0.00 C ATOM 1345 CG PHE A 88 -22.680 5.896 11.900 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -23.581 6.702 11.237 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -22.948 5.522 13.207 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -24.728 7.135 11.858 1.00 0.00 C ATOM 1349 CE2 PHE A 88 -24.100 5.951 13.837 1.00 0.00 C ATOM 1350 CZ PHE A 88 -24.993 6.760 13.161 1.00 0.00 C ATOM 0 H PHE A 88 -19.945 5.412 9.241 1.00 0.00 H new ATOM 0 HA PHE A 88 -21.071 7.480 10.620 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -21.706 4.935 10.284 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -20.918 4.723 11.835 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -23.383 6.997 10.217 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -22.251 4.890 13.737 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -25.423 7.769 11.327 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -24.302 5.655 14.856 1.00 0.00 H new ATOM 0 HZ PHE A 88 -25.895 7.098 13.649 1.00 0.00 H new ATOM 1360 N SER A 89 -18.417 6.385 12.095 1.00 0.00 N ATOM 1361 CA SER A 89 -17.493 6.619 13.183 1.00 0.00 C ATOM 1362 C SER A 89 -16.659 7.871 12.924 1.00 0.00 C ATOM 1363 O SER A 89 -16.477 8.698 13.818 1.00 0.00 O ATOM 1364 CB SER A 89 -16.598 5.404 13.372 1.00 0.00 C ATOM 1365 OG SER A 89 -15.761 5.551 14.506 1.00 0.00 O ATOM 0 H SER A 89 -18.053 5.790 11.351 1.00 0.00 H new ATOM 0 HA SER A 89 -18.062 6.780 14.098 1.00 0.00 H new ATOM 0 HB2 SER A 89 -17.213 4.511 13.485 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.986 5.259 12.482 1.00 0.00 H new ATOM 0 HG SER A 89 -15.199 4.754 14.603 1.00 0.00 H new ATOM 1371 N TYR A 90 -16.156 8.011 11.696 1.00 0.00 N ATOM 1372 CA TYR A 90 -15.349 9.164 11.337 1.00 0.00 C ATOM 1373 C TYR A 90 -16.242 10.292 10.818 1.00 0.00 C ATOM 1374 O TYR A 90 -16.343 11.346 11.446 1.00 0.00 O ATOM 1375 CB TYR A 90 -14.328 8.763 10.282 1.00 0.00 C ATOM 1376 CG TYR A 90 -13.091 9.628 10.295 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -12.102 9.426 11.249 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -12.916 10.649 9.373 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -10.971 10.214 11.284 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -11.786 11.444 9.399 1.00 0.00 C ATOM 1381 CZ TYR A 90 -10.817 11.223 10.357 1.00 0.00 C ATOM 1382 OH TYR A 90 -9.690 12.014 10.385 1.00 0.00 O ATOM 0 H TYR A 90 -16.296 7.340 10.941 1.00 0.00 H new ATOM 0 HA TYR A 90 -14.822 9.524 12.221 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -14.039 7.724 10.441 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -14.792 8.818 9.297 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -12.221 8.637 11.977 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -13.674 10.825 8.624 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -10.211 10.042 12.032 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -11.662 12.234 8.673 1.00 0.00 H new ATOM 0 HH TYR A 90 -8.936 11.497 10.737 1.00 0.00 H new ATOM 1392 N PHE A 91 -16.919 10.048 9.691 1.00 0.00 N ATOM 1393 CA PHE A 91 -17.841 11.033 9.125 1.00 0.00 C ATOM 1394 C PHE A 91 -18.808 11.464 10.218 1.00 0.00 C ATOM 1395 O PHE A 91 -18.804 12.621 10.637 1.00 0.00 O ATOM 1396 CB PHE A 91 -18.598 10.453 7.926 1.00 0.00 C ATOM 1397 CG PHE A 91 -17.759 10.311 6.685 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -16.485 9.762 6.741 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -18.248 10.728 5.457 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -15.719 9.633 5.598 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -17.486 10.600 4.311 1.00 0.00 C ATOM 1402 CZ PHE A 91 -16.220 10.053 4.382 1.00 0.00 C ATOM 0 H PHE A 91 -16.845 9.182 9.157 1.00 0.00 H new ATOM 0 HA PHE A 91 -17.281 11.895 8.763 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -18.995 9.475 8.198 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -19.452 11.093 7.704 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -16.088 9.432 7.689 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -19.237 11.158 5.395 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -14.730 9.204 5.656 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -17.880 10.928 3.360 1.00 0.00 H new ATOM 0 HZ PHE A 91 -15.623 9.954 3.488 1.00 0.00 H new ATOM 1412 N ASP A 92 -19.590 10.503 10.717 1.00 0.00 N ATOM 1413 CA ASP A 92 -20.505 10.756 11.828 1.00 0.00 C ATOM 1414 C ASP A 92 -19.676 10.818 13.106 1.00 0.00 C ATOM 1415 O ASP A 92 -19.897 10.058 14.048 1.00 0.00 O ATOM 1416 CB ASP A 92 -21.547 9.636 11.934 1.00 0.00 C ATOM 1417 CG ASP A 92 -22.900 10.011 11.366 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -23.575 10.874 11.966 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -23.281 9.450 10.318 1.00 0.00 O ATOM 0 H ASP A 92 -19.606 9.545 10.368 1.00 0.00 H new ATOM 0 HA ASP A 92 -21.038 11.693 11.668 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -21.175 8.754 11.412 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -21.666 9.360 12.982 1.00 0.00 H new ATOM 1424 N LYS A 93 -18.680 11.700 13.094 1.00 0.00 N ATOM 1425 CA LYS A 93 -17.755 11.863 14.199 1.00 0.00 C ATOM 1426 C LYS A 93 -18.461 11.888 15.549 1.00 0.00 C ATOM 1427 O LYS A 93 -18.105 11.130 16.451 1.00 0.00 O ATOM 1428 CB LYS A 93 -16.939 13.136 13.989 1.00 0.00 C ATOM 1429 CG LYS A 93 -15.761 13.277 14.940 1.00 0.00 C ATOM 1430 CD LYS A 93 -14.842 14.416 14.525 1.00 0.00 C ATOM 1431 CE LYS A 93 -14.175 14.137 13.184 1.00 0.00 C ATOM 1432 NZ LYS A 93 -13.270 12.956 13.248 1.00 0.00 N ATOM 0 H LYS A 93 -18.495 12.324 12.308 1.00 0.00 H new ATOM 0 HA LYS A 93 -17.091 10.999 14.215 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -16.570 13.154 12.964 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.594 13.999 14.107 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.128 13.454 15.951 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -15.198 12.344 14.964 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -15.414 15.342 14.462 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -14.078 14.565 15.288 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -14.940 13.967 12.427 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -13.607 15.013 12.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -12.674 12.929 12.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -12.666 13.027 14.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -13.838 12.086 13.301 1.00 0.00 H new ATOM 1446 N ASP A 94 -19.458 12.752 15.693 1.00 0.00 N ATOM 1447 CA ASP A 94 -20.188 12.841 16.950 1.00 0.00 C ATOM 1448 C ASP A 94 -21.008 11.577 17.177 1.00 0.00 C ATOM 1449 O ASP A 94 -21.376 11.261 18.310 1.00 0.00 O ATOM 1450 CB ASP A 94 -21.105 14.066 16.949 1.00 0.00 C ATOM 1451 CG ASP A 94 -21.872 14.211 18.249 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -21.222 14.347 19.308 1.00 0.00 O ATOM 1453 OD2 ASP A 94 -23.120 14.187 18.209 1.00 0.00 O ATOM 0 H ASP A 94 -19.776 13.393 14.966 1.00 0.00 H new ATOM 0 HA ASP A 94 -19.467 12.943 17.761 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -20.509 14.963 16.779 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -21.809 13.989 16.121 1.00 0.00 H new ATOM 1458 N GLY A 95 -21.287 10.859 16.088 1.00 0.00 N ATOM 1459 CA GLY A 95 -22.061 9.645 16.183 1.00 0.00 C ATOM 1460 C GLY A 95 -23.287 9.863 17.033 1.00 0.00 C ATOM 1461 O GLY A 95 -23.429 9.304 18.121 1.00 0.00 O ATOM 0 H GLY A 95 -20.987 11.103 15.144 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -22.356 9.317 15.186 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -21.451 8.851 16.612 1.00 0.00 H new ATOM 1465 N SER A 96 -24.186 10.655 16.486 1.00 0.00 N ATOM 1466 CA SER A 96 -25.457 10.959 17.111 1.00 0.00 C ATOM 1467 C SER A 96 -26.521 10.385 16.210 1.00 0.00 C ATOM 1468 O SER A 96 -27.637 10.071 16.625 1.00 0.00 O ATOM 1469 CB SER A 96 -25.636 12.470 17.274 1.00 0.00 C ATOM 1470 OG SER A 96 -25.474 13.139 16.035 1.00 0.00 O ATOM 0 H SER A 96 -24.053 11.111 15.584 1.00 0.00 H new ATOM 0 HA SER A 96 -25.516 10.529 18.111 1.00 0.00 H new ATOM 0 HB2 SER A 96 -26.626 12.681 17.678 1.00 0.00 H new ATOM 0 HB3 SER A 96 -24.911 12.850 17.994 1.00 0.00 H new ATOM 0 HG SER A 96 -26.164 13.829 15.943 1.00 0.00 H new ATOM 1476 N GLY A 97 -26.114 10.228 14.957 1.00 0.00 N ATOM 1477 CA GLY A 97 -26.957 9.665 13.947 1.00 0.00 C ATOM 1478 C GLY A 97 -26.996 10.503 12.689 1.00 0.00 C ATOM 1479 O GLY A 97 -27.601 10.107 11.702 1.00 0.00 O ATOM 0 H GLY A 97 -25.186 10.492 14.626 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -26.604 8.663 13.701 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -27.968 9.559 14.340 1.00 0.00 H new ATOM 1483 N TYR A 98 -26.339 11.660 12.726 1.00 0.00 N ATOM 1484 CA TYR A 98 -26.294 12.549 11.570 1.00 0.00 C ATOM 1485 C TYR A 98 -24.994 13.349 11.493 1.00 0.00 C ATOM 1486 O TYR A 98 -24.254 13.465 12.469 1.00 0.00 O ATOM 1487 CB TYR A 98 -27.485 13.493 11.548 1.00 0.00 C ATOM 1488 CG TYR A 98 -27.796 14.160 12.866 1.00 0.00 C ATOM 1489 CD1 TYR A 98 -26.833 14.886 13.554 1.00 0.00 C ATOM 1490 CD2 TYR A 98 -29.067 14.074 13.410 1.00 0.00 C ATOM 1491 CE1 TYR A 98 -27.130 15.504 14.750 1.00 0.00 C ATOM 1492 CE2 TYR A 98 -29.373 14.690 14.603 1.00 0.00 C ATOM 1493 CZ TYR A 98 -28.401 15.404 15.272 1.00 0.00 C ATOM 1494 OH TYR A 98 -28.704 16.022 16.464 1.00 0.00 O ATOM 0 H TYR A 98 -25.832 12.002 13.542 1.00 0.00 H new ATOM 0 HA TYR A 98 -26.338 11.904 10.693 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -27.303 14.266 10.801 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -28.364 12.937 11.223 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -25.836 14.968 13.146 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -29.831 13.515 12.890 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -26.370 16.064 15.275 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -30.369 14.614 15.013 1.00 0.00 H new ATOM 0 HH TYR A 98 -29.643 15.854 16.690 1.00 0.00 H new ATOM 1504 N ILE A 99 -24.730 13.875 10.298 1.00 0.00 N ATOM 1505 CA ILE A 99 -23.528 14.651 10.019 1.00 0.00 C ATOM 1506 C ILE A 99 -23.847 15.936 9.268 1.00 0.00 C ATOM 1507 O ILE A 99 -24.074 15.907 8.064 1.00 0.00 O ATOM 1508 CB ILE A 99 -22.556 13.826 9.160 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -22.415 12.438 9.735 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -21.201 14.505 9.075 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -21.699 11.488 8.804 1.00 0.00 C ATOM 0 H ILE A 99 -25.349 13.773 9.494 1.00 0.00 H new ATOM 0 HA ILE A 99 -23.079 14.902 10.980 1.00 0.00 H new ATOM 0 HB ILE A 99 -22.960 13.753 8.150 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -21.871 12.494 10.678 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -23.405 12.041 9.961 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.530 13.903 8.462 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -21.316 15.491 8.626 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -20.783 14.609 10.076 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -21.627 10.506 9.271 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -22.255 11.406 7.870 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -20.697 11.866 8.598 1.00 0.00 H new ATOM 1523 N THR A 100 -23.819 17.063 9.948 1.00 0.00 N ATOM 1524 CA THR A 100 -24.070 18.327 9.278 1.00 0.00 C ATOM 1525 C THR A 100 -22.868 18.667 8.408 1.00 0.00 C ATOM 1526 O THR A 100 -21.751 18.281 8.746 1.00 0.00 O ATOM 1527 CB THR A 100 -24.319 19.431 10.304 1.00 0.00 C ATOM 1528 OG1 THR A 100 -23.160 19.655 11.088 1.00 0.00 O ATOM 1529 CG2 THR A 100 -25.457 19.112 11.249 1.00 0.00 C ATOM 0 H THR A 100 -23.629 17.133 10.948 1.00 0.00 H new ATOM 0 HA THR A 100 -24.959 18.243 8.653 1.00 0.00 H new ATOM 0 HB THR A 100 -24.581 20.317 9.726 1.00 0.00 H new ATOM 0 HG1 THR A 100 -22.856 20.578 10.966 1.00 0.00 H new ATOM 0 HG21 THR A 100 -25.586 19.933 11.954 1.00 0.00 H new ATOM 0 HG22 THR A 100 -26.376 18.976 10.679 1.00 0.00 H new ATOM 0 HG23 THR A 100 -25.230 18.197 11.796 1.00 0.00 H new ATOM 1537 N LEU A 101 -23.093 19.330 7.268 1.00 0.00 N ATOM 1538 CA LEU A 101 -22.005 19.656 6.340 1.00 0.00 C ATOM 1539 C LEU A 101 -20.701 19.957 7.069 1.00 0.00 C ATOM 1540 O LEU A 101 -19.622 19.635 6.578 1.00 0.00 O ATOM 1541 CB LEU A 101 -22.396 20.865 5.497 1.00 0.00 C ATOM 1542 CG LEU A 101 -22.741 22.125 6.291 1.00 0.00 C ATOM 1543 CD1 LEU A 101 -21.498 22.975 6.519 1.00 0.00 C ATOM 1544 CD2 LEU A 101 -23.823 22.927 5.582 1.00 0.00 C ATOM 0 H LEU A 101 -24.014 19.650 6.967 1.00 0.00 H new ATOM 0 HA LEU A 101 -21.843 18.784 5.706 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -21.575 21.096 4.818 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -23.254 20.596 4.881 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.126 21.821 7.264 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -21.766 23.867 7.086 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -20.760 22.398 7.077 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -21.077 23.269 5.558 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -24.054 23.820 6.163 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -23.470 23.219 4.593 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -24.721 22.317 5.481 1.00 0.00 H new ATOM 1556 N ASP A 102 -20.801 20.555 8.241 1.00 0.00 N ATOM 1557 CA ASP A 102 -19.618 20.863 9.033 1.00 0.00 C ATOM 1558 C ASP A 102 -18.786 19.599 9.248 1.00 0.00 C ATOM 1559 O ASP A 102 -17.609 19.560 8.902 1.00 0.00 O ATOM 1560 CB ASP A 102 -20.015 21.466 10.381 1.00 0.00 C ATOM 1561 CG ASP A 102 -20.850 22.721 10.228 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -20.360 23.688 9.608 1.00 0.00 O ATOM 1563 OD2 ASP A 102 -21.993 22.738 10.730 1.00 0.00 O ATOM 0 H ASP A 102 -21.684 20.837 8.667 1.00 0.00 H new ATOM 0 HA ASP A 102 -19.019 21.594 8.490 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -20.575 20.728 10.955 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -19.116 21.698 10.951 1.00 0.00 H new ATOM 1568 N GLU A 103 -19.412 18.563 9.807 1.00 0.00 N ATOM 1569 CA GLU A 103 -18.734 17.292 10.054 1.00 0.00 C ATOM 1570 C GLU A 103 -18.461 16.547 8.746 1.00 0.00 C ATOM 1571 O GLU A 103 -17.464 15.834 8.630 1.00 0.00 O ATOM 1572 CB GLU A 103 -19.561 16.422 11.003 1.00 0.00 C ATOM 1573 CG GLU A 103 -19.677 16.987 12.410 1.00 0.00 C ATOM 1574 CD GLU A 103 -20.563 16.145 13.311 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -21.091 15.117 12.835 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -20.728 16.513 14.492 1.00 0.00 O ATOM 0 H GLU A 103 -20.390 18.580 10.098 1.00 0.00 H new ATOM 0 HA GLU A 103 -17.774 17.508 10.523 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -20.561 16.298 10.588 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -19.112 15.430 11.056 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -18.683 17.059 12.851 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.077 18.000 12.358 1.00 0.00 H new ATOM 1583 N ILE A 104 -19.338 16.726 7.757 1.00 0.00 N ATOM 1584 CA ILE A 104 -19.163 16.075 6.457 1.00 0.00 C ATOM 1585 C ILE A 104 -17.920 16.613 5.756 1.00 0.00 C ATOM 1586 O ILE A 104 -16.953 15.887 5.527 1.00 0.00 O ATOM 1587 CB ILE A 104 -20.391 16.287 5.535 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -21.566 15.413 5.977 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -20.033 15.986 4.087 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -22.849 15.700 5.228 1.00 0.00 C ATOM 0 H ILE A 104 -20.170 17.311 7.829 1.00 0.00 H new ATOM 0 HA ILE A 104 -19.053 15.007 6.647 1.00 0.00 H new ATOM 0 HB ILE A 104 -20.690 17.332 5.613 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -21.301 14.365 5.838 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -21.737 15.560 7.043 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -20.908 16.141 3.456 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -19.231 16.650 3.765 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -19.703 14.951 4.002 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -23.638 15.043 5.594 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -23.138 16.739 5.387 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -22.696 15.525 4.163 1.00 0.00 H new ATOM 1602 N GLN A 105 -17.969 17.894 5.413 1.00 0.00 N ATOM 1603 CA GLN A 105 -16.871 18.563 4.729 1.00 0.00 C ATOM 1604 C GLN A 105 -15.573 18.486 5.537 1.00 0.00 C ATOM 1605 O GLN A 105 -14.497 18.298 4.968 1.00 0.00 O ATOM 1606 CB GLN A 105 -17.250 20.021 4.452 1.00 0.00 C ATOM 1607 CG GLN A 105 -18.441 20.167 3.516 1.00 0.00 C ATOM 1608 CD GLN A 105 -18.750 21.615 3.184 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -18.877 21.917 1.895 1.00 0.00 O flip ATOM 1610 NE2 GLN A 105 -18.894 22.450 4.077 1.00 0.00 N flip ATOM 0 H GLN A 105 -18.770 18.497 5.601 1.00 0.00 H new ATOM 0 HA GLN A 105 -16.693 18.051 3.783 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -17.476 20.516 5.396 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -16.392 20.536 4.020 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -18.242 19.621 2.594 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -19.317 19.709 3.975 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -18.788 22.176 5.054 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -19.120 23.416 3.840 1.00 0.00 H new ATOM 1619 N GLN A 106 -15.676 18.622 6.859 1.00 0.00 N ATOM 1620 CA GLN A 106 -14.497 18.554 7.724 1.00 0.00 C ATOM 1621 C GLN A 106 -13.802 17.203 7.581 1.00 0.00 C ATOM 1622 O GLN A 106 -12.579 17.126 7.472 1.00 0.00 O ATOM 1623 CB GLN A 106 -14.889 18.784 9.184 1.00 0.00 C ATOM 1624 CG GLN A 106 -13.720 18.709 10.152 1.00 0.00 C ATOM 1625 CD GLN A 106 -14.139 18.942 11.591 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -14.952 18.199 12.141 1.00 0.00 O ATOM 1627 NE2 GLN A 106 -13.587 19.981 12.207 1.00 0.00 N ATOM 0 H GLN A 106 -16.555 18.779 7.352 1.00 0.00 H new ATOM 0 HA GLN A 106 -13.806 19.339 7.416 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -15.361 19.762 9.274 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -15.635 18.043 9.471 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -13.247 17.731 10.069 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -12.972 19.450 9.871 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -12.917 20.570 11.712 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -13.833 20.190 13.175 1.00 0.00 H new ATOM 1636 N ALA A 107 -14.602 16.140 7.569 1.00 0.00 N ATOM 1637 CA ALA A 107 -14.091 14.778 7.426 1.00 0.00 C ATOM 1638 C ALA A 107 -13.393 14.589 6.080 1.00 0.00 C ATOM 1639 O ALA A 107 -12.840 13.525 5.799 1.00 0.00 O ATOM 1640 CB ALA A 107 -15.222 13.772 7.580 1.00 0.00 C ATOM 0 H ALA A 107 -15.617 16.196 7.657 1.00 0.00 H new ATOM 0 HA ALA A 107 -13.357 14.608 8.213 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -14.828 12.762 7.471 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -15.674 13.881 8.566 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -15.976 13.952 6.813 1.00 0.00 H new ATOM 1646 N CYS A 108 -13.418 15.633 5.259 1.00 0.00 N ATOM 1647 CA CYS A 108 -12.787 15.596 3.947 1.00 0.00 C ATOM 1648 C CYS A 108 -11.626 16.585 3.872 1.00 0.00 C ATOM 1649 O CYS A 108 -11.472 17.306 2.886 1.00 0.00 O ATOM 1650 CB CYS A 108 -13.816 15.900 2.858 1.00 0.00 C ATOM 1651 SG CYS A 108 -15.149 14.682 2.753 1.00 0.00 S ATOM 0 H CYS A 108 -13.871 16.519 5.482 1.00 0.00 H new ATOM 0 HA CYS A 108 -12.389 14.594 3.787 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -14.249 16.883 3.044 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -13.308 15.952 1.895 1.00 0.00 H new ATOM 0 HG CYS A 108 -15.995 14.881 3.719 1.00 0.00 H new ATOM 1657 N LYS A 109 -10.810 16.607 4.923 1.00 0.00 N ATOM 1658 CA LYS A 109 -9.657 17.500 4.983 1.00 0.00 C ATOM 1659 C LYS A 109 -8.699 17.226 3.829 1.00 0.00 C ATOM 1660 O LYS A 109 -8.098 18.147 3.275 1.00 0.00 O ATOM 1661 CB LYS A 109 -8.929 17.339 6.318 1.00 0.00 C ATOM 1662 CG LYS A 109 -8.513 15.906 6.615 1.00 0.00 C ATOM 1663 CD LYS A 109 -7.764 15.797 7.935 1.00 0.00 C ATOM 1664 CE LYS A 109 -6.455 16.570 7.903 1.00 0.00 C ATOM 1665 NZ LYS A 109 -5.705 16.447 9.183 1.00 0.00 N ATOM 0 H LYS A 109 -10.927 16.015 5.746 1.00 0.00 H new ATOM 0 HA LYS A 109 -10.017 18.525 4.897 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -8.043 17.973 6.318 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -9.575 17.695 7.120 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -9.397 15.270 6.645 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -7.882 15.536 5.807 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -8.391 16.176 8.742 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -7.562 14.748 8.154 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -5.837 16.203 7.084 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -6.659 17.622 7.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.819 16.988 9.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -6.284 16.821 9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -5.487 15.446 9.363 1.00 0.00 H new ATOM 1679 N ASP A 110 -8.564 15.954 3.471 1.00 0.00 N ATOM 1680 CA ASP A 110 -7.685 15.556 2.380 1.00 0.00 C ATOM 1681 C ASP A 110 -8.320 15.907 1.039 1.00 0.00 C ATOM 1682 O ASP A 110 -7.632 16.051 0.027 1.00 0.00 O ATOM 1683 CB ASP A 110 -7.398 14.054 2.451 1.00 0.00 C ATOM 1684 CG ASP A 110 -6.344 13.610 1.453 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -5.770 14.480 0.763 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -6.086 12.392 1.366 1.00 0.00 O ATOM 0 H ASP A 110 -9.053 15.181 3.922 1.00 0.00 H new ATOM 0 HA ASP A 110 -6.743 16.096 2.475 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -7.069 13.799 3.458 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -8.321 13.503 2.268 1.00 0.00 H new ATOM 1691 N PHE A 111 -9.642 16.053 1.042 1.00 0.00 N ATOM 1692 CA PHE A 111 -10.381 16.394 -0.169 1.00 0.00 C ATOM 1693 C PHE A 111 -10.229 17.870 -0.501 1.00 0.00 C ATOM 1694 O PHE A 111 -10.706 18.328 -1.541 1.00 0.00 O ATOM 1695 CB PHE A 111 -11.870 16.064 -0.011 1.00 0.00 C ATOM 1696 CG PHE A 111 -12.181 14.591 -0.018 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -11.484 13.709 0.795 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -13.180 14.090 -0.837 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -11.777 12.358 0.788 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -13.478 12.741 -0.848 1.00 0.00 C ATOM 1701 CZ PHE A 111 -12.775 11.873 -0.034 1.00 0.00 C ATOM 0 H PHE A 111 -10.224 15.940 1.872 1.00 0.00 H new ATOM 0 HA PHE A 111 -9.966 15.800 -0.983 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -12.229 16.495 0.924 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -12.424 16.545 -0.817 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -10.703 14.082 1.441 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -13.733 14.763 -1.475 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -11.226 11.682 1.425 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -14.259 12.365 -1.492 1.00 0.00 H new ATOM 0 HZ PHE A 111 -13.006 10.818 -0.041 1.00 0.00 H new ATOM 1711 N GLY A 112 -9.570 18.619 0.380 1.00 0.00 N ATOM 1712 CA GLY A 112 -9.395 20.033 0.126 1.00 0.00 C ATOM 1713 C GLY A 112 -10.730 20.743 0.065 1.00 0.00 C ATOM 1714 O GLY A 112 -10.938 21.599 -0.793 1.00 0.00 O ATOM 0 H GLY A 112 -9.162 18.277 1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -8.780 20.474 0.911 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -8.861 20.174 -0.814 1.00 0.00 H new ATOM 1718 N LEU A 113 -11.652 20.336 0.944 1.00 0.00 N ATOM 1719 CA LEU A 113 -13.007 20.886 0.964 1.00 0.00 C ATOM 1720 C LEU A 113 -13.020 22.354 0.552 1.00 0.00 C ATOM 1721 O LEU A 113 -12.208 23.157 1.008 1.00 0.00 O ATOM 1722 CB LEU A 113 -13.658 20.703 2.347 1.00 0.00 C ATOM 1723 CG LEU A 113 -13.526 21.876 3.329 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -14.245 21.565 4.630 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -12.070 22.203 3.598 1.00 0.00 C ATOM 0 H LEU A 113 -11.481 19.624 1.654 1.00 0.00 H new ATOM 0 HA LEU A 113 -13.595 20.330 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -14.719 20.499 2.200 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -13.225 19.818 2.813 1.00 0.00 H new ATOM 0 HG LEU A 113 -13.991 22.749 2.871 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -14.141 22.407 5.314 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -15.302 21.390 4.429 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -13.809 20.674 5.083 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -12.008 23.037 4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -11.575 21.332 4.028 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -11.579 22.475 2.663 1.00 0.00 H new ATOM 1737 N ASP A 114 -13.939 22.685 -0.343 1.00 0.00 N ATOM 1738 CA ASP A 114 -14.055 24.046 -0.847 1.00 0.00 C ATOM 1739 C ASP A 114 -15.504 24.490 -0.903 1.00 0.00 C ATOM 1740 O ASP A 114 -16.424 23.681 -0.779 1.00 0.00 O ATOM 1741 CB ASP A 114 -13.434 24.159 -2.245 1.00 0.00 C ATOM 1742 CG ASP A 114 -11.917 24.109 -2.230 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -11.329 24.142 -1.130 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -11.317 24.056 -3.324 1.00 0.00 O ATOM 0 H ASP A 114 -14.615 22.030 -0.735 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.516 24.696 -0.158 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.812 23.350 -2.870 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -13.756 25.094 -2.704 1.00 0.00 H new ATOM 1749 N ASP A 115 -15.698 25.785 -1.103 1.00 0.00 N ATOM 1750 CA ASP A 115 -17.030 26.349 -1.190 1.00 0.00 C ATOM 1751 C ASP A 115 -17.583 26.177 -2.602 1.00 0.00 C ATOM 1752 O ASP A 115 -18.750 26.470 -2.866 1.00 0.00 O ATOM 1753 CB ASP A 115 -17.015 27.830 -0.803 1.00 0.00 C ATOM 1754 CG ASP A 115 -16.537 28.055 0.620 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -16.219 27.061 1.306 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -16.483 29.227 1.048 1.00 0.00 O ATOM 0 H ASP A 115 -14.945 26.465 -1.208 1.00 0.00 H new ATOM 0 HA ASP A 115 -17.676 25.818 -0.491 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -16.368 28.375 -1.490 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -18.018 28.242 -0.915 1.00 0.00 H new ATOM 1761 N ILE A 116 -16.727 25.717 -3.510 1.00 0.00 N ATOM 1762 CA ILE A 116 -17.116 25.514 -4.900 1.00 0.00 C ATOM 1763 C ILE A 116 -17.601 24.085 -5.158 1.00 0.00 C ATOM 1764 O ILE A 116 -18.760 23.872 -5.515 1.00 0.00 O ATOM 1765 CB ILE A 116 -15.952 25.833 -5.856 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -15.436 27.252 -5.601 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -16.396 25.675 -7.305 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -14.248 27.635 -6.462 1.00 0.00 C ATOM 0 H ILE A 116 -15.757 25.477 -3.306 1.00 0.00 H new ATOM 0 HA ILE A 116 -17.941 26.200 -5.092 1.00 0.00 H new ATOM 0 HB ILE A 116 -15.141 25.130 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -16.245 27.960 -5.779 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -15.157 27.344 -4.551 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -15.562 25.904 -7.968 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -16.724 24.650 -7.475 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -17.220 26.358 -7.510 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -13.940 28.653 -6.224 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -13.422 26.951 -6.267 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -14.527 27.577 -7.514 1.00 0.00 H new ATOM 1780 N HIS A 117 -16.704 23.110 -4.996 1.00 0.00 N ATOM 1781 CA HIS A 117 -17.047 21.707 -5.237 1.00 0.00 C ATOM 1782 C HIS A 117 -17.587 21.008 -3.997 1.00 0.00 C ATOM 1783 O HIS A 117 -18.767 20.659 -3.944 1.00 0.00 O ATOM 1784 CB HIS A 117 -15.826 20.946 -5.752 1.00 0.00 C ATOM 1785 CG HIS A 117 -15.695 20.963 -7.240 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -15.534 22.118 -7.975 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -15.712 19.948 -8.131 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -15.458 21.811 -9.258 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -15.563 20.501 -9.380 1.00 0.00 N ATOM 0 H HIS A 117 -15.740 23.265 -4.701 1.00 0.00 H new ATOM 0 HA HIS A 117 -17.839 21.706 -5.986 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -14.927 21.377 -5.311 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -15.883 19.912 -5.412 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -15.822 18.898 -7.904 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -15.331 22.513 -10.069 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -15.538 19.983 -10.259 1.00 0.00 H new ATOM 1798 N ILE A 118 -16.725 20.786 -3.006 1.00 0.00 N ATOM 1799 CA ILE A 118 -17.134 20.108 -1.783 1.00 0.00 C ATOM 1800 C ILE A 118 -18.365 20.772 -1.166 1.00 0.00 C ATOM 1801 O ILE A 118 -19.087 20.160 -0.379 1.00 0.00 O ATOM 1802 CB ILE A 118 -15.984 20.060 -0.759 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -14.792 19.303 -1.354 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -16.441 19.406 0.540 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -15.102 17.870 -1.736 1.00 0.00 C ATOM 0 H ILE A 118 -15.744 21.065 -3.028 1.00 0.00 H new ATOM 0 HA ILE A 118 -17.395 19.085 -2.053 1.00 0.00 H new ATOM 0 HB ILE A 118 -15.677 21.080 -0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -14.440 19.836 -2.237 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -13.975 19.308 -0.633 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -15.612 19.384 1.247 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -17.265 19.978 0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -16.773 18.388 0.338 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -14.208 17.402 -2.149 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -15.424 17.319 -0.852 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -15.897 17.856 -2.482 1.00 0.00 H new ATOM 1817 N ASP A 119 -18.620 22.017 -1.549 1.00 0.00 N ATOM 1818 CA ASP A 119 -19.786 22.732 -1.053 1.00 0.00 C ATOM 1819 C ASP A 119 -21.037 22.133 -1.675 1.00 0.00 C ATOM 1820 O ASP A 119 -22.002 21.830 -0.982 1.00 0.00 O ATOM 1821 CB ASP A 119 -19.700 24.219 -1.381 1.00 0.00 C ATOM 1822 CG ASP A 119 -20.905 24.994 -0.887 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -21.153 24.992 0.338 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -21.602 25.604 -1.724 1.00 0.00 O ATOM 0 H ASP A 119 -18.039 22.548 -2.197 1.00 0.00 H new ATOM 0 HA ASP A 119 -19.825 22.631 0.032 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -18.797 24.635 -0.934 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -19.609 24.345 -2.460 1.00 0.00 H new ATOM 1829 N ASP A 120 -20.995 21.930 -2.992 1.00 0.00 N ATOM 1830 CA ASP A 120 -22.113 21.322 -3.699 1.00 0.00 C ATOM 1831 C ASP A 120 -22.311 19.912 -3.160 1.00 0.00 C ATOM 1832 O ASP A 120 -23.410 19.366 -3.181 1.00 0.00 O ATOM 1833 CB ASP A 120 -21.838 21.285 -5.207 1.00 0.00 C ATOM 1834 CG ASP A 120 -23.014 20.754 -6.008 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -24.067 20.465 -5.403 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -22.881 20.634 -7.245 1.00 0.00 O ATOM 0 H ASP A 120 -20.202 22.177 -3.584 1.00 0.00 H new ATOM 0 HA ASP A 120 -23.016 21.911 -3.540 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -21.594 22.290 -5.552 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -20.964 20.662 -5.397 1.00 0.00 H new ATOM 1841 N MET A 121 -21.215 19.357 -2.653 1.00 0.00 N ATOM 1842 CA MET A 121 -21.184 18.039 -2.067 1.00 0.00 C ATOM 1843 C MET A 121 -22.121 17.966 -0.868 1.00 0.00 C ATOM 1844 O MET A 121 -22.711 16.932 -0.595 1.00 0.00 O ATOM 1845 CB MET A 121 -19.746 17.697 -1.689 1.00 0.00 C ATOM 1846 CG MET A 121 -19.610 16.791 -0.485 1.00 0.00 C ATOM 1847 SD MET A 121 -17.903 16.295 -0.199 1.00 0.00 S ATOM 1848 CE MET A 121 -17.971 15.883 1.538 1.00 0.00 C ATOM 0 H MET A 121 -20.310 19.827 -2.642 1.00 0.00 H new ATOM 0 HA MET A 121 -21.536 17.302 -2.789 1.00 0.00 H new ATOM 0 HB2 MET A 121 -19.263 17.220 -2.542 1.00 0.00 H new ATOM 0 HB3 MET A 121 -19.206 18.623 -1.493 1.00 0.00 H new ATOM 0 HG2 MET A 121 -19.991 17.303 0.398 1.00 0.00 H new ATOM 0 HG3 MET A 121 -20.226 15.903 -0.629 1.00 0.00 H new ATOM 0 HE1 MET A 121 -17.277 16.517 2.090 1.00 0.00 H new ATOM 0 HE2 MET A 121 -18.983 16.043 1.911 1.00 0.00 H new ATOM 0 HE3 MET A 121 -17.695 14.837 1.675 1.00 0.00 H new ATOM 1858 N ILE A 122 -22.302 19.090 -0.195 1.00 0.00 N ATOM 1859 CA ILE A 122 -23.229 19.160 0.928 1.00 0.00 C ATOM 1860 C ILE A 122 -24.580 18.767 0.410 1.00 0.00 C ATOM 1861 O ILE A 122 -25.303 17.985 1.017 1.00 0.00 O ATOM 1862 CB ILE A 122 -23.296 20.597 1.463 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -21.897 21.093 1.794 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -24.206 20.695 2.669 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -21.853 22.532 2.263 1.00 0.00 C ATOM 0 H ILE A 122 -21.822 19.965 -0.404 1.00 0.00 H new ATOM 0 HA ILE A 122 -22.904 18.502 1.734 1.00 0.00 H new ATOM 0 HB ILE A 122 -23.719 21.234 0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -21.469 20.455 2.568 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -21.267 20.989 0.911 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -24.231 21.726 3.023 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -25.213 20.382 2.392 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -23.830 20.048 3.462 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -20.822 22.813 2.480 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -22.250 23.181 1.483 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -22.455 22.639 3.165 1.00 0.00 H new ATOM 1877 N LYS A 123 -24.877 19.310 -0.752 1.00 0.00 N ATOM 1878 CA LYS A 123 -26.117 19.036 -1.439 1.00 0.00 C ATOM 1879 C LYS A 123 -25.981 17.782 -2.303 1.00 0.00 C ATOM 1880 O LYS A 123 -26.972 17.228 -2.781 1.00 0.00 O ATOM 1881 CB LYS A 123 -26.517 20.230 -2.305 1.00 0.00 C ATOM 1882 CG LYS A 123 -27.064 21.419 -1.523 1.00 0.00 C ATOM 1883 CD LYS A 123 -26.102 21.909 -0.451 1.00 0.00 C ATOM 1884 CE LYS A 123 -24.817 22.438 -1.060 1.00 0.00 C ATOM 1885 NZ LYS A 123 -25.072 23.554 -2.013 1.00 0.00 N ATOM 0 H LYS A 123 -24.262 19.956 -1.247 1.00 0.00 H new ATOM 0 HA LYS A 123 -26.895 18.865 -0.695 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -25.648 20.556 -2.877 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -27.269 19.906 -3.024 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -27.279 22.235 -2.213 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -28.009 21.139 -1.057 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -26.578 22.694 0.136 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -25.873 21.093 0.235 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -24.154 22.783 -0.266 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -24.301 21.629 -1.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -24.184 24.062 -2.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -25.444 23.170 -2.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -25.767 24.210 -1.602 1.00 0.00 H new ATOM 1899 N GLU A 124 -24.735 17.348 -2.504 1.00 0.00 N ATOM 1900 CA GLU A 124 -24.442 16.169 -3.313 1.00 0.00 C ATOM 1901 C GLU A 124 -24.562 14.902 -2.483 1.00 0.00 C ATOM 1902 O GLU A 124 -24.787 13.811 -3.008 1.00 0.00 O ATOM 1903 CB GLU A 124 -23.036 16.259 -3.898 1.00 0.00 C ATOM 1904 CG GLU A 124 -22.617 15.036 -4.693 1.00 0.00 C ATOM 1905 CD GLU A 124 -21.396 15.286 -5.557 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -20.881 16.424 -5.547 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -20.956 14.342 -6.247 1.00 0.00 O ATOM 0 H GLU A 124 -23.909 17.801 -2.113 1.00 0.00 H new ATOM 0 HA GLU A 124 -25.169 16.132 -4.125 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -22.978 17.136 -4.543 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -22.325 16.413 -3.086 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -22.408 14.216 -4.006 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -23.446 14.719 -5.326 1.00 0.00 H new ATOM 1914 N ILE A 125 -24.410 15.065 -1.181 1.00 0.00 N ATOM 1915 CA ILE A 125 -24.492 13.965 -0.247 1.00 0.00 C ATOM 1916 C ILE A 125 -25.793 14.083 0.525 1.00 0.00 C ATOM 1917 O ILE A 125 -26.323 13.101 1.038 1.00 0.00 O ATOM 1918 CB ILE A 125 -23.278 13.979 0.695 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -22.003 14.276 -0.105 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -23.152 12.648 1.404 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -21.715 13.275 -1.203 1.00 0.00 C ATOM 0 H ILE A 125 -24.226 15.968 -0.744 1.00 0.00 H new ATOM 0 HA ILE A 125 -24.480 13.014 -0.780 1.00 0.00 H new ATOM 0 HB ILE A 125 -23.418 14.760 1.443 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -22.087 15.269 -0.546 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -21.155 14.302 0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -22.288 12.670 2.069 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -24.054 12.459 1.987 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -23.023 11.854 0.668 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -20.798 13.556 -1.720 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -21.597 12.282 -0.769 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -22.543 13.264 -1.912 1.00 0.00 H new ATOM 1933 N ASP A 126 -26.327 15.306 0.550 1.00 0.00 N ATOM 1934 CA ASP A 126 -27.597 15.575 1.205 1.00 0.00 C ATOM 1935 C ASP A 126 -28.698 14.798 0.516 1.00 0.00 C ATOM 1936 O ASP A 126 -29.202 15.207 -0.530 1.00 0.00 O ATOM 1937 CB ASP A 126 -27.923 17.061 1.152 1.00 0.00 C ATOM 1938 CG ASP A 126 -29.304 17.362 1.687 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -29.573 17.007 2.850 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -30.115 17.952 0.942 1.00 0.00 O ATOM 0 H ASP A 126 -25.894 16.124 0.121 1.00 0.00 H new ATOM 0 HA ASP A 126 -27.521 15.267 2.248 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -27.183 17.614 1.730 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -27.850 17.411 0.122 1.00 0.00 H new ATOM 1945 N GLN A 127 -29.051 13.666 1.089 1.00 0.00 N ATOM 1946 CA GLN A 127 -30.071 12.820 0.510 1.00 0.00 C ATOM 1947 C GLN A 127 -31.481 13.205 0.966 1.00 0.00 C ATOM 1948 O GLN A 127 -32.458 12.757 0.365 1.00 0.00 O ATOM 1949 CB GLN A 127 -29.751 11.350 0.820 1.00 0.00 C ATOM 1950 CG GLN A 127 -30.908 10.391 0.596 1.00 0.00 C ATOM 1951 CD GLN A 127 -31.854 10.346 1.779 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -31.476 11.019 2.861 1.00 0.00 O flip ATOM 1953 NE2 GLN A 127 -32.903 9.704 1.727 1.00 0.00 N flip ATOM 0 H GLN A 127 -28.646 13.311 1.955 1.00 0.00 H new ATOM 0 HA GLN A 127 -30.062 12.965 -0.570 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -28.911 11.036 0.201 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -29.428 11.273 1.858 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -31.459 10.691 -0.296 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -30.517 9.391 0.408 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -33.152 9.202 0.875 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -33.523 9.674 2.536 1.00 0.00 H new ATOM 1962 N ASP A 128 -31.619 14.031 2.013 1.00 0.00 N ATOM 1963 CA ASP A 128 -32.968 14.389 2.445 1.00 0.00 C ATOM 1964 C ASP A 128 -33.231 15.901 2.573 1.00 0.00 C ATOM 1965 O ASP A 128 -34.350 16.328 2.286 1.00 0.00 O ATOM 1966 CB ASP A 128 -33.284 13.692 3.770 1.00 0.00 C ATOM 1967 CG ASP A 128 -32.308 14.053 4.871 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -31.493 14.971 4.668 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -32.365 13.418 5.943 1.00 0.00 O ATOM 0 H ASP A 128 -30.855 14.443 2.549 1.00 0.00 H new ATOM 0 HA ASP A 128 -33.632 14.047 1.651 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -34.293 13.959 4.084 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -33.272 12.613 3.619 1.00 0.00 H new ATOM 1974 N ASN A 129 -32.239 16.730 2.958 1.00 0.00 N ATOM 1975 CA ASN A 129 -32.505 18.181 3.042 1.00 0.00 C ATOM 1976 C ASN A 129 -31.334 19.084 3.490 1.00 0.00 C ATOM 1977 O ASN A 129 -30.844 19.915 2.725 1.00 0.00 O ATOM 1978 CB ASN A 129 -33.731 18.465 3.929 1.00 0.00 C ATOM 1979 CG ASN A 129 -33.702 17.772 5.285 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -32.655 17.006 5.560 1.00 0.00 O flip ATOM 1981 ND2 ASN A 129 -34.626 17.929 6.084 1.00 0.00 N flip ATOM 0 H ASN A 129 -31.293 16.440 3.204 1.00 0.00 H new ATOM 0 HA ASN A 129 -32.687 18.455 2.003 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -33.809 19.541 4.086 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -34.630 18.155 3.396 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -35.416 18.526 5.839 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -34.601 17.462 6.991 1.00 0.00 H new ATOM 1988 N ASP A 130 -31.001 18.992 4.778 1.00 0.00 N ATOM 1989 CA ASP A 130 -30.012 19.864 5.435 1.00 0.00 C ATOM 1990 C ASP A 130 -28.552 19.772 4.973 1.00 0.00 C ATOM 1991 O ASP A 130 -27.674 20.225 5.709 1.00 0.00 O ATOM 1992 CB ASP A 130 -30.063 19.596 6.942 1.00 0.00 C ATOM 1993 CG ASP A 130 -31.376 20.032 7.566 1.00 0.00 C ATOM 1994 OD1 ASP A 130 -32.249 20.534 6.826 1.00 0.00 O ATOM 1995 OD2 ASP A 130 -31.531 19.872 8.795 1.00 0.00 O ATOM 0 H ASP A 130 -31.413 18.303 5.407 1.00 0.00 H new ATOM 0 HA ASP A 130 -30.313 20.871 5.146 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -29.914 18.532 7.124 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -29.241 20.121 7.429 1.00 0.00 H new ATOM 2000 N GLY A 131 -28.250 19.232 3.795 1.00 0.00 N ATOM 2001 CA GLY A 131 -26.856 19.186 3.395 1.00 0.00 C ATOM 2002 C GLY A 131 -26.045 18.460 4.434 1.00 0.00 C ATOM 2003 O GLY A 131 -24.928 18.852 4.791 1.00 0.00 O ATOM 0 H GLY A 131 -28.918 18.839 3.132 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -26.762 18.684 2.432 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -26.473 20.198 3.265 1.00 0.00 H new ATOM 2007 N GLN A 132 -26.661 17.432 4.967 1.00 0.00 N ATOM 2008 CA GLN A 132 -26.092 16.650 6.007 1.00 0.00 C ATOM 2009 C GLN A 132 -26.248 15.187 5.697 1.00 0.00 C ATOM 2010 O GLN A 132 -26.941 14.811 4.757 1.00 0.00 O ATOM 2011 CB GLN A 132 -26.764 16.946 7.313 1.00 0.00 C ATOM 2012 CG GLN A 132 -28.145 16.343 7.420 1.00 0.00 C ATOM 2013 CD GLN A 132 -28.604 16.215 8.855 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -28.708 14.979 9.322 1.00 0.00 O flip ATOM 2015 NE2 GLN A 132 -28.841 17.210 9.539 1.00 0.00 N flip ATOM 0 H GLN A 132 -27.588 17.121 4.676 1.00 0.00 H new ATOM 0 HA GLN A 132 -25.034 16.900 6.081 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -26.145 16.568 8.127 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -26.835 18.026 7.442 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -28.853 16.961 6.868 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -28.147 15.359 6.951 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -28.747 18.141 9.134 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -29.132 17.103 10.511 1.00 0.00 H new ATOM 2024 N ILE A 133 -25.595 14.371 6.484 1.00 0.00 N ATOM 2025 CA ILE A 133 -25.653 12.959 6.303 1.00 0.00 C ATOM 2026 C ILE A 133 -25.903 12.260 7.614 1.00 0.00 C ATOM 2027 O ILE A 133 -25.116 12.340 8.539 1.00 0.00 O ATOM 2028 CB ILE A 133 -24.377 12.491 5.638 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -24.504 12.802 4.156 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -24.123 11.015 5.886 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -25.386 11.819 3.420 1.00 0.00 C ATOM 0 H ILE A 133 -25.012 14.674 7.264 1.00 0.00 H new ATOM 0 HA ILE A 133 -26.490 12.705 5.653 1.00 0.00 H new ATOM 0 HB ILE A 133 -23.516 13.010 6.060 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -24.909 13.807 4.035 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -23.512 12.801 3.704 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -23.198 10.717 5.392 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -24.037 10.836 6.958 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -24.952 10.431 5.486 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -25.437 12.094 2.367 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -24.970 10.816 3.513 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -26.388 11.837 3.849 1.00 0.00 H new ATOM 2043 N ASP A 134 -26.974 11.512 7.644 1.00 0.00 N ATOM 2044 CA ASP A 134 -27.323 10.737 8.816 1.00 0.00 C ATOM 2045 C ASP A 134 -27.203 9.266 8.492 1.00 0.00 C ATOM 2046 O ASP A 134 -27.180 8.896 7.327 1.00 0.00 O ATOM 2047 CB ASP A 134 -28.748 11.052 9.292 1.00 0.00 C ATOM 2048 CG ASP A 134 -29.815 10.415 8.431 1.00 0.00 C ATOM 2049 OD1 ASP A 134 -29.966 10.828 7.270 1.00 0.00 O ATOM 2050 OD2 ASP A 134 -30.502 9.500 8.924 1.00 0.00 O ATOM 0 H ASP A 134 -27.627 11.420 6.866 1.00 0.00 H new ATOM 0 HA ASP A 134 -26.637 11.000 9.621 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -28.866 10.708 10.320 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -28.892 12.132 9.299 1.00 0.00 H new ATOM 2055 N TYR A 135 -27.134 8.430 9.518 1.00 0.00 N ATOM 2056 CA TYR A 135 -27.036 6.992 9.318 1.00 0.00 C ATOM 2057 C TYR A 135 -27.911 6.549 8.155 1.00 0.00 C ATOM 2058 O TYR A 135 -27.589 5.596 7.447 1.00 0.00 O ATOM 2059 CB TYR A 135 -27.439 6.280 10.597 1.00 0.00 C ATOM 2060 CG TYR A 135 -27.805 4.823 10.420 1.00 0.00 C ATOM 2061 CD1 TYR A 135 -26.844 3.881 10.069 1.00 0.00 C ATOM 2062 CD2 TYR A 135 -29.111 4.388 10.609 1.00 0.00 C ATOM 2063 CE1 TYR A 135 -27.175 2.549 9.909 1.00 0.00 C ATOM 2064 CE2 TYR A 135 -29.450 3.058 10.451 1.00 0.00 C ATOM 2065 CZ TYR A 135 -28.479 2.143 10.101 1.00 0.00 C ATOM 2066 OH TYR A 135 -28.814 0.818 9.942 1.00 0.00 O ATOM 0 H TYR A 135 -27.144 8.722 10.495 1.00 0.00 H new ATOM 0 HA TYR A 135 -26.006 6.733 9.074 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -26.618 6.350 11.310 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -28.288 6.803 11.036 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -25.822 4.196 9.919 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -29.874 5.101 10.884 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -26.417 1.830 9.635 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -30.470 2.736 10.601 1.00 0.00 H new ATOM 0 HH TYR A 135 -29.771 0.700 10.115 1.00 0.00 H new ATOM 2076 N GLY A 136 -29.004 7.272 7.949 1.00 0.00 N ATOM 2077 CA GLY A 136 -29.892 6.965 6.856 1.00 0.00 C ATOM 2078 C GLY A 136 -29.428 7.599 5.562 1.00 0.00 C ATOM 2079 O GLY A 136 -29.406 6.946 4.523 1.00 0.00 O ATOM 0 H GLY A 136 -29.288 8.066 8.523 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -29.954 5.884 6.730 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -30.896 7.316 7.094 1.00 0.00 H new ATOM 2083 N GLU A 137 -29.039 8.873 5.626 1.00 0.00 N ATOM 2084 CA GLU A 137 -28.551 9.568 4.442 1.00 0.00 C ATOM 2085 C GLU A 137 -27.286 8.899 3.948 1.00 0.00 C ATOM 2086 O GLU A 137 -27.188 8.548 2.776 1.00 0.00 O ATOM 2087 CB GLU A 137 -28.269 11.039 4.724 1.00 0.00 C ATOM 2088 CG GLU A 137 -29.505 11.912 4.770 1.00 0.00 C ATOM 2089 CD GLU A 137 -29.184 13.341 5.134 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -28.814 13.587 6.300 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -29.278 14.211 4.245 1.00 0.00 O ATOM 0 H GLU A 137 -29.053 9.436 6.476 1.00 0.00 H new ATOM 0 HA GLU A 137 -29.329 9.516 3.680 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -27.745 11.120 5.676 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -27.596 11.422 3.956 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -30.000 11.889 3.799 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -30.209 11.504 5.496 1.00 0.00 H new ATOM 2098 N PHE A 138 -26.318 8.701 4.848 1.00 0.00 N ATOM 2099 CA PHE A 138 -25.084 8.042 4.462 1.00 0.00 C ATOM 2100 C PHE A 138 -25.408 6.679 3.872 1.00 0.00 C ATOM 2101 O PHE A 138 -24.595 6.075 3.172 1.00 0.00 O ATOM 2102 CB PHE A 138 -24.108 7.845 5.629 1.00 0.00 C ATOM 2103 CG PHE A 138 -22.750 7.473 5.121 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -22.128 8.244 4.141 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -22.107 6.346 5.594 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -20.886 7.888 3.653 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -20.865 5.987 5.109 1.00 0.00 C ATOM 2108 CZ PHE A 138 -20.254 6.760 4.138 1.00 0.00 C ATOM 0 H PHE A 138 -26.369 8.984 5.827 1.00 0.00 H new ATOM 0 HA PHE A 138 -24.598 8.692 3.735 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -24.045 8.761 6.216 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -24.480 7.065 6.294 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -22.621 9.126 3.760 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -22.581 5.739 6.351 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -20.410 8.491 2.894 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -20.371 5.104 5.487 1.00 0.00 H new ATOM 0 HZ PHE A 138 -19.282 6.481 3.759 1.00 0.00 H new ATOM 2118 N ALA A 139 -26.612 6.205 4.168 1.00 0.00 N ATOM 2119 CA ALA A 139 -27.076 4.920 3.684 1.00 0.00 C ATOM 2120 C ALA A 139 -27.700 5.048 2.296 1.00 0.00 C ATOM 2121 O ALA A 139 -27.490 4.198 1.433 1.00 0.00 O ATOM 2122 CB ALA A 139 -28.066 4.332 4.681 1.00 0.00 C ATOM 0 H ALA A 139 -27.288 6.701 4.748 1.00 0.00 H new ATOM 0 HA ALA A 139 -26.224 4.246 3.592 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -28.416 3.365 4.319 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -27.577 4.202 5.646 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -28.915 5.007 4.792 1.00 0.00 H new ATOM 2128 N ALA A 140 -28.473 6.115 2.087 1.00 0.00 N ATOM 2129 CA ALA A 140 -29.129 6.345 0.803 1.00 0.00 C ATOM 2130 C ALA A 140 -28.234 7.109 -0.174 1.00 0.00 C ATOM 2131 O ALA A 140 -28.552 7.218 -1.359 1.00 0.00 O ATOM 2132 CB ALA A 140 -30.420 7.112 1.018 1.00 0.00 C ATOM 0 H ALA A 140 -28.659 6.831 2.790 1.00 0.00 H new ATOM 0 HA ALA A 140 -29.340 5.370 0.363 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -30.907 7.282 0.058 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -31.083 6.536 1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -30.200 8.071 1.488 1.00 0.00 H new ATOM 2138 N MET A 141 -27.130 7.653 0.327 1.00 0.00 N ATOM 2139 CA MET A 141 -26.212 8.424 -0.498 1.00 0.00 C ATOM 2140 C MET A 141 -25.422 7.527 -1.445 1.00 0.00 C ATOM 2141 O MET A 141 -24.688 8.015 -2.306 1.00 0.00 O ATOM 2142 CB MET A 141 -25.263 9.223 0.397 1.00 0.00 C ATOM 2143 CG MET A 141 -24.298 8.365 1.200 1.00 0.00 C ATOM 2144 SD MET A 141 -22.832 7.888 0.266 1.00 0.00 S ATOM 2145 CE MET A 141 -22.051 9.485 0.043 1.00 0.00 C ATOM 0 H MET A 141 -26.850 7.573 1.305 1.00 0.00 H new ATOM 0 HA MET A 141 -26.797 9.111 -1.110 1.00 0.00 H new ATOM 0 HB2 MET A 141 -24.690 9.912 -0.223 1.00 0.00 H new ATOM 0 HB3 MET A 141 -25.853 9.828 1.085 1.00 0.00 H new ATOM 0 HG2 MET A 141 -23.991 8.911 2.092 1.00 0.00 H new ATOM 0 HG3 MET A 141 -24.815 7.467 1.538 1.00 0.00 H new ATOM 0 HE1 MET A 141 -21.041 9.345 -0.343 1.00 0.00 H new ATOM 0 HE2 MET A 141 -22.631 10.078 -0.664 1.00 0.00 H new ATOM 0 HE3 MET A 141 -22.005 10.004 1.000 1.00 0.00 H new ATOM 2155 N MET A 142 -25.576 6.218 -1.287 1.00 0.00 N ATOM 2156 CA MET A 142 -24.875 5.262 -2.134 1.00 0.00 C ATOM 2157 C MET A 142 -25.814 4.157 -2.604 1.00 0.00 C ATOM 2158 O MET A 142 -25.648 3.613 -3.696 1.00 0.00 O ATOM 2159 CB MET A 142 -23.686 4.656 -1.386 1.00 0.00 C ATOM 2160 CG MET A 142 -24.080 3.883 -0.138 1.00 0.00 C ATOM 2161 SD MET A 142 -22.662 3.142 0.693 1.00 0.00 S ATOM 2162 CE MET A 142 -23.472 2.271 2.031 1.00 0.00 C ATOM 0 H MET A 142 -26.179 5.795 -0.581 1.00 0.00 H new ATOM 0 HA MET A 142 -24.507 5.796 -3.010 1.00 0.00 H new ATOM 0 HB2 MET A 142 -23.145 3.991 -2.059 1.00 0.00 H new ATOM 0 HB3 MET A 142 -22.999 5.454 -1.106 1.00 0.00 H new ATOM 0 HG2 MET A 142 -24.593 4.552 0.553 1.00 0.00 H new ATOM 0 HG3 MET A 142 -24.788 3.100 -0.408 1.00 0.00 H new ATOM 0 HE1 MET A 142 -22.724 1.760 2.638 1.00 0.00 H new ATOM 0 HE2 MET A 142 -24.018 2.983 2.651 1.00 0.00 H new ATOM 0 HE3 MET A 142 -24.168 1.539 1.620 1.00 0.00 H new