USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=37 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 105 GLN : amide:sc= -22.3! C(o=-27!,f=-34!) USER MOD Set 1.2: A 121 MET CE :methyl -150:sc= -4.42! (180deg=-2.73!) USER MOD Set 2.1: A 49 LYS NZ :NH3+ -166:sc= -4.92! (180deg=-5.73!) USER MOD Set 2.2: A 59 LYS NZ :NH3+ 137:sc= -3.95! (180deg=-5.27!) USER MOD Set 3.1: A 23 ASN :FLIP amide:sc= -0.636 F(o=-2.8!,f=-0.29) USER MOD Set 3.2: A 24 SER OG : rot 180:sc= 0.171 USER MOD Set 3.3: A 26 THR OG1 : rot -84:sc= 0.176 USER MOD Single : A 13 LYS NZ :NH3+ 165:sc= -0.0364 (180deg=-0.283) USER MOD Single : A 17 LYS NZ :NH3+ 163:sc= -1.23 (180deg=-1.61) USER MOD Single : A 18 MET CE :methyl 147:sc= -2.24! (180deg=-4.37!) USER MOD Single : A 21 THR OG1 : rot -26:sc= 0.356 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -177:sc= -0.0152 (180deg=-0.0591) USER MOD Single : A 37 LYS NZ :NH3+ 175:sc= -2.27! (180deg=-2.42!) USER MOD Single : A 41 SER OG : rot -120:sc=-0.00213 USER MOD Single : A 44 MET CE :methyl -135:sc= -0.239 (180deg=-0.817) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -159:sc= -3.21 (180deg=-5.12!) USER MOD Single : A 60 SER OG : rot 86:sc= 1.45 USER MOD Single : A 62 THR OG1 : rot 180:sc= -2.4! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot -96:sc= 0.596 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 65:sc= 0.716 USER MOD Single : A 93 LYS NZ :NH3+ -164:sc= -0.0226 (180deg=-0.275) USER MOD Single : A 96 SER OG : rot 108:sc= 2.05 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 GLN :FLIP amide:sc= -0.752 F(o=-2.4!,f=-0.75) USER MOD Single : A 108 CYS SG : rot -56:sc= -8.59! USER MOD Single : A 109 LYS NZ :NH3+ -166:sc= -0.047 (180deg=-0.263) USER MOD Single : A 117 HIS : no HD1:sc= -3.14! C(o=-3.1!,f=-2.9!) USER MOD Single : A 123 LYS NZ :NH3+ 160:sc= -1.42 (180deg=-2.76!) USER MOD Single : A 127 GLN :FLIP amide:sc= -11.7! C(o=-14!,f=-12!) USER MOD Single : A 129 ASN :FLIP amide:sc= -0.651 F(o=-1.4,f=-0.65) USER MOD Single : A 132 GLN :FLIP amide:sc= -1.51 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 157:sc= -0.227 (180deg=-0.892) USER MOD Single : A 142 MET CE :methyl -161:sc= -0.243 (180deg=-0.91) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 2.580 -12.529 5.182 1.00 0.00 N ATOM 161 CA LEU A 12 1.957 -11.219 5.333 1.00 0.00 C ATOM 162 C LEU A 12 2.872 -10.123 4.805 1.00 0.00 C ATOM 163 O LEU A 12 2.401 -9.121 4.267 1.00 0.00 O ATOM 164 CB LEU A 12 1.612 -10.961 6.801 1.00 0.00 C ATOM 165 CG LEU A 12 0.830 -9.674 7.073 1.00 0.00 C ATOM 166 CD1 LEU A 12 -0.532 -9.725 6.400 1.00 0.00 C ATOM 167 CD2 LEU A 12 0.678 -9.450 8.569 1.00 0.00 C ATOM 0 HA LEU A 12 1.037 -11.208 4.749 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.032 -11.805 7.174 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.538 -10.932 7.375 1.00 0.00 H new ATOM 0 HG LEU A 12 1.388 -8.837 6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.074 -8.801 6.604 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.402 -9.839 5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.098 -10.571 6.789 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.120 -8.531 8.744 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.142 -10.290 9.010 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.664 -9.369 9.027 1.00 0.00 H new ATOM 179 N LYS A 13 4.181 -10.320 4.937 1.00 0.00 N ATOM 180 CA LYS A 13 5.138 -9.344 4.438 1.00 0.00 C ATOM 181 C LYS A 13 4.948 -9.195 2.937 1.00 0.00 C ATOM 182 O LYS A 13 4.944 -8.085 2.396 1.00 0.00 O ATOM 183 CB LYS A 13 6.572 -9.771 4.764 1.00 0.00 C ATOM 184 CG LYS A 13 6.955 -11.122 4.181 1.00 0.00 C ATOM 185 CD LYS A 13 8.379 -11.505 4.549 1.00 0.00 C ATOM 186 CE LYS A 13 8.778 -12.829 3.921 1.00 0.00 C ATOM 187 NZ LYS A 13 8.733 -12.774 2.433 1.00 0.00 N ATOM 0 H LYS A 13 4.598 -11.138 5.381 1.00 0.00 H new ATOM 0 HA LYS A 13 4.965 -8.384 4.924 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.261 -9.015 4.388 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.695 -9.804 5.847 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.267 -11.885 4.545 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.854 -11.093 3.096 1.00 0.00 H new ATOM 0 HD2 LYS A 13 9.064 -10.724 4.220 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.470 -11.573 5.633 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.784 -13.095 4.244 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.111 -13.615 4.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.244 -13.590 2.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 7.743 -12.800 2.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.180 -11.894 2.104 1.00 0.00 H new ATOM 201 N GLU A 14 4.741 -10.331 2.280 1.00 0.00 N ATOM 202 CA GLU A 14 4.497 -10.351 0.850 1.00 0.00 C ATOM 203 C GLU A 14 3.148 -9.711 0.577 1.00 0.00 C ATOM 204 O GLU A 14 2.924 -9.139 -0.488 1.00 0.00 O ATOM 205 CB GLU A 14 4.522 -11.788 0.323 1.00 0.00 C ATOM 206 CG GLU A 14 4.282 -11.893 -1.173 1.00 0.00 C ATOM 207 CD GLU A 14 4.261 -13.330 -1.662 1.00 0.00 C ATOM 208 OE1 GLU A 14 4.422 -14.245 -0.827 1.00 0.00 O ATOM 209 OE2 GLU A 14 4.082 -13.539 -2.881 1.00 0.00 O ATOM 0 H GLU A 14 4.738 -11.251 2.721 1.00 0.00 H new ATOM 0 HA GLU A 14 5.280 -9.792 0.337 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.487 -12.236 0.560 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.763 -12.371 0.846 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.334 -11.415 -1.419 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.062 -11.345 -1.702 1.00 0.00 H new ATOM 216 N LEU A 15 2.257 -9.799 1.566 1.00 0.00 N ATOM 217 CA LEU A 15 0.931 -9.217 1.456 1.00 0.00 C ATOM 218 C LEU A 15 1.018 -7.698 1.537 1.00 0.00 C ATOM 219 O LEU A 15 0.250 -6.988 0.890 1.00 0.00 O ATOM 220 CB LEU A 15 0.008 -9.761 2.545 1.00 0.00 C ATOM 221 CG LEU A 15 -1.453 -9.313 2.441 1.00 0.00 C ATOM 222 CD1 LEU A 15 -2.023 -9.655 1.074 1.00 0.00 C ATOM 223 CD2 LEU A 15 -2.287 -9.954 3.538 1.00 0.00 C ATOM 0 H LEU A 15 2.437 -10.271 2.452 1.00 0.00 H new ATOM 0 HA LEU A 15 0.511 -9.493 0.489 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.041 -10.850 2.517 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.397 -9.455 3.516 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.488 -8.231 2.567 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.062 -9.328 1.021 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.444 -9.150 0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.973 -10.733 0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.322 -9.624 3.448 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.242 -11.039 3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.896 -9.659 4.512 1.00 0.00 H new ATOM 235 N PHE A 16 1.981 -7.201 2.313 1.00 0.00 N ATOM 236 CA PHE A 16 2.178 -5.762 2.435 1.00 0.00 C ATOM 237 C PHE A 16 2.597 -5.193 1.096 1.00 0.00 C ATOM 238 O PHE A 16 2.022 -4.222 0.605 1.00 0.00 O ATOM 239 CB PHE A 16 3.254 -5.426 3.470 1.00 0.00 C ATOM 240 CG PHE A 16 3.826 -4.045 3.272 1.00 0.00 C ATOM 241 CD1 PHE A 16 2.998 -2.931 3.252 1.00 0.00 C ATOM 242 CD2 PHE A 16 5.186 -3.867 3.076 1.00 0.00 C ATOM 243 CE1 PHE A 16 3.518 -1.670 3.045 1.00 0.00 C ATOM 244 CE2 PHE A 16 5.709 -2.605 2.865 1.00 0.00 C ATOM 245 CZ PHE A 16 4.874 -1.506 2.850 1.00 0.00 C ATOM 0 H PHE A 16 2.629 -7.768 2.860 1.00 0.00 H new ATOM 0 HA PHE A 16 1.234 -5.324 2.761 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.829 -5.501 4.471 1.00 0.00 H new ATOM 0 HB3 PHE A 16 4.056 -6.161 3.409 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.935 -3.053 3.400 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.844 -4.723 3.088 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.863 -0.811 3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.771 -2.479 2.712 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.281 -0.519 2.686 1.00 0.00 H new ATOM 255 N LYS A 17 3.603 -5.822 0.507 1.00 0.00 N ATOM 256 CA LYS A 17 4.103 -5.395 -0.784 1.00 0.00 C ATOM 257 C LYS A 17 3.099 -5.802 -1.837 1.00 0.00 C ATOM 258 O LYS A 17 3.116 -5.313 -2.967 1.00 0.00 O ATOM 259 CB LYS A 17 5.478 -5.998 -1.073 1.00 0.00 C ATOM 260 CG LYS A 17 5.462 -7.503 -1.289 1.00 0.00 C ATOM 261 CD LYS A 17 6.843 -8.024 -1.653 1.00 0.00 C ATOM 262 CE LYS A 17 6.808 -9.496 -2.035 1.00 0.00 C ATOM 263 NZ LYS A 17 5.916 -9.748 -3.200 1.00 0.00 N ATOM 0 H LYS A 17 4.086 -6.628 0.904 1.00 0.00 H new ATOM 0 HA LYS A 17 4.228 -4.312 -0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.894 -5.519 -1.959 1.00 0.00 H new ATOM 0 HB3 LYS A 17 6.146 -5.768 -0.243 1.00 0.00 H new ATOM 0 HG2 LYS A 17 5.111 -7.999 -0.384 1.00 0.00 H new ATOM 0 HG3 LYS A 17 4.757 -7.751 -2.082 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.244 -7.442 -2.483 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.519 -7.883 -0.809 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.817 -9.833 -2.271 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.467 -10.084 -1.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 6.132 -10.680 -3.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.924 -9.728 -2.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.068 -9.012 -3.919 1.00 0.00 H new ATOM 277 N MET A 18 2.200 -6.690 -1.431 1.00 0.00 N ATOM 278 CA MET A 18 1.148 -7.159 -2.310 1.00 0.00 C ATOM 279 C MET A 18 0.162 -6.025 -2.543 1.00 0.00 C ATOM 280 O MET A 18 -0.597 -6.029 -3.511 1.00 0.00 O ATOM 281 CB MET A 18 0.418 -8.366 -1.707 1.00 0.00 C ATOM 282 CG MET A 18 0.189 -9.514 -2.684 1.00 0.00 C ATOM 283 SD MET A 18 -0.772 -9.040 -4.139 1.00 0.00 S ATOM 284 CE MET A 18 0.507 -8.398 -5.218 1.00 0.00 C ATOM 0 H MET A 18 2.182 -7.098 -0.496 1.00 0.00 H new ATOM 0 HA MET A 18 1.592 -7.474 -3.254 1.00 0.00 H new ATOM 0 HB2 MET A 18 0.993 -8.736 -0.858 1.00 0.00 H new ATOM 0 HB3 MET A 18 -0.546 -8.036 -1.320 1.00 0.00 H new ATOM 0 HG2 MET A 18 1.154 -9.904 -3.007 1.00 0.00 H new ATOM 0 HG3 MET A 18 -0.325 -10.324 -2.167 1.00 0.00 H new ATOM 0 HE1 MET A 18 0.249 -8.611 -6.255 1.00 0.00 H new ATOM 0 HE2 MET A 18 0.593 -7.320 -5.079 1.00 0.00 H new ATOM 0 HE3 MET A 18 1.458 -8.872 -4.977 1.00 0.00 H new ATOM 294 N ILE A 19 0.184 -5.051 -1.632 1.00 0.00 N ATOM 295 CA ILE A 19 -0.697 -3.900 -1.713 1.00 0.00 C ATOM 296 C ILE A 19 -0.145 -2.862 -2.684 1.00 0.00 C ATOM 297 O ILE A 19 -0.773 -2.539 -3.693 1.00 0.00 O ATOM 298 CB ILE A 19 -0.864 -3.229 -0.332 1.00 0.00 C ATOM 299 CG1 ILE A 19 -1.180 -4.253 0.770 1.00 0.00 C ATOM 300 CG2 ILE A 19 -1.951 -2.168 -0.391 1.00 0.00 C ATOM 301 CD1 ILE A 19 -2.213 -5.290 0.379 1.00 0.00 C ATOM 0 H ILE A 19 0.810 -5.043 -0.826 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.663 -4.262 -2.065 1.00 0.00 H new ATOM 0 HB ILE A 19 0.086 -2.758 -0.079 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -0.259 -4.763 1.051 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.532 -3.721 1.654 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.059 -1.703 0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -1.680 -1.409 -1.125 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -2.895 -2.630 -0.679 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.377 -5.973 1.213 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.150 -4.793 0.127 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.856 -5.851 -0.485 1.00 0.00 H new ATOM 313 N ASP A 20 1.034 -2.339 -2.358 1.00 0.00 N ATOM 314 CA ASP A 20 1.689 -1.327 -3.177 1.00 0.00 C ATOM 315 C ASP A 20 2.515 -1.948 -4.293 1.00 0.00 C ATOM 316 O ASP A 20 3.746 -1.924 -4.259 1.00 0.00 O ATOM 317 CB ASP A 20 2.575 -0.450 -2.300 1.00 0.00 C ATOM 318 CG ASP A 20 3.280 -1.245 -1.220 1.00 0.00 C ATOM 319 OD1 ASP A 20 4.029 -2.183 -1.567 1.00 0.00 O ATOM 320 OD2 ASP A 20 3.083 -0.932 -0.027 1.00 0.00 O ATOM 0 H ASP A 20 1.558 -2.604 -1.524 1.00 0.00 H new ATOM 0 HA ASP A 20 0.912 -0.720 -3.642 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.317 0.051 -2.922 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.968 0.329 -1.838 1.00 0.00 H new ATOM 325 N THR A 21 1.832 -2.519 -5.272 1.00 0.00 N ATOM 326 CA THR A 21 2.501 -3.168 -6.393 1.00 0.00 C ATOM 327 C THR A 21 2.823 -2.187 -7.522 1.00 0.00 C ATOM 328 O THR A 21 3.468 -2.559 -8.502 1.00 0.00 O ATOM 329 CB THR A 21 1.628 -4.302 -6.931 1.00 0.00 C ATOM 330 OG1 THR A 21 2.332 -5.065 -7.893 1.00 0.00 O ATOM 331 CG2 THR A 21 0.351 -3.816 -7.582 1.00 0.00 C ATOM 0 H THR A 21 0.813 -2.547 -5.315 1.00 0.00 H new ATOM 0 HA THR A 21 3.446 -3.566 -6.023 1.00 0.00 H new ATOM 0 HB THR A 21 1.370 -4.904 -6.060 1.00 0.00 H new ATOM 0 HG1 THR A 21 3.020 -4.508 -8.313 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.222 -4.671 -7.942 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.241 -3.263 -6.853 1.00 0.00 H new ATOM 0 HG23 THR A 21 0.595 -3.164 -8.420 1.00 0.00 H new ATOM 339 N ASP A 22 2.351 -0.946 -7.406 1.00 0.00 N ATOM 340 CA ASP A 22 2.583 0.044 -8.457 1.00 0.00 C ATOM 341 C ASP A 22 3.087 1.382 -7.919 1.00 0.00 C ATOM 342 O ASP A 22 3.707 2.153 -8.651 1.00 0.00 O ATOM 343 CB ASP A 22 1.288 0.280 -9.231 1.00 0.00 C ATOM 344 CG ASP A 22 0.186 0.824 -8.342 1.00 0.00 C ATOM 345 OD1 ASP A 22 -0.226 0.110 -7.403 1.00 0.00 O ATOM 346 OD2 ASP A 22 -0.265 1.962 -8.584 1.00 0.00 O ATOM 0 H ASP A 22 1.814 -0.606 -6.608 1.00 0.00 H new ATOM 0 HA ASP A 22 3.360 -0.362 -9.105 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.475 0.979 -10.046 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.960 -0.656 -9.683 1.00 0.00 H new ATOM 351 N ASN A 23 2.797 1.676 -6.657 1.00 0.00 N ATOM 352 CA ASN A 23 3.204 2.945 -6.068 1.00 0.00 C ATOM 353 C ASN A 23 4.710 3.010 -5.828 1.00 0.00 C ATOM 354 O ASN A 23 5.423 3.689 -6.567 1.00 0.00 O ATOM 355 CB ASN A 23 2.431 3.218 -4.773 1.00 0.00 C ATOM 356 CG ASN A 23 2.817 4.523 -4.090 1.00 0.00 C ATOM 357 OD1 ASN A 23 3.639 5.336 -4.747 1.00 0.00 O flip ATOM 358 ND2 ASN A 23 2.363 4.807 -2.982 1.00 0.00 N flip ATOM 0 H ASN A 23 2.286 1.058 -6.027 1.00 0.00 H new ATOM 0 HA ASN A 23 2.960 3.727 -6.787 1.00 0.00 H new ATOM 0 HB2 ASN A 23 1.364 3.237 -4.995 1.00 0.00 H new ATOM 0 HB3 ASN A 23 2.598 2.393 -4.080 1.00 0.00 H new ATOM 0 HD21 ASN A 23 1.735 4.159 -2.507 1.00 0.00 H new ATOM 0 HD22 ASN A 23 2.615 5.690 -2.539 1.00 0.00 H new ATOM 365 N SER A 24 5.196 2.339 -4.785 1.00 0.00 N ATOM 366 CA SER A 24 6.622 2.382 -4.470 1.00 0.00 C ATOM 367 C SER A 24 6.989 1.454 -3.318 1.00 0.00 C ATOM 368 O SER A 24 8.157 1.351 -2.943 1.00 0.00 O ATOM 369 CB SER A 24 6.987 3.810 -4.082 1.00 0.00 C ATOM 370 OG SER A 24 6.112 4.277 -3.066 1.00 0.00 O ATOM 0 H SER A 24 4.634 1.768 -4.153 1.00 0.00 H new ATOM 0 HA SER A 24 7.172 2.051 -5.351 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.018 3.848 -3.731 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.924 4.460 -4.955 1.00 0.00 H new ATOM 0 HG SER A 24 6.355 5.195 -2.822 1.00 0.00 H new ATOM 376 N GLY A 25 5.987 0.830 -2.724 1.00 0.00 N ATOM 377 CA GLY A 25 6.220 -0.023 -1.581 1.00 0.00 C ATOM 378 C GLY A 25 5.648 0.624 -0.342 1.00 0.00 C ATOM 379 O GLY A 25 6.130 0.428 0.774 1.00 0.00 O ATOM 0 H GLY A 25 5.012 0.899 -3.015 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.758 -0.997 -1.741 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.289 -0.194 -1.454 1.00 0.00 H new ATOM 383 N THR A 26 4.592 1.392 -0.577 1.00 0.00 N ATOM 384 CA THR A 26 3.875 2.101 0.469 1.00 0.00 C ATOM 385 C THR A 26 2.391 2.108 0.148 1.00 0.00 C ATOM 386 O THR A 26 2.005 2.118 -1.015 1.00 0.00 O ATOM 387 CB THR A 26 4.377 3.533 0.605 1.00 0.00 C ATOM 388 OG1 THR A 26 4.291 4.216 -0.633 1.00 0.00 O ATOM 389 CG2 THR A 26 5.807 3.628 1.088 1.00 0.00 C ATOM 0 H THR A 26 4.207 1.540 -1.510 1.00 0.00 H new ATOM 0 HA THR A 26 4.048 1.588 1.415 1.00 0.00 H new ATOM 0 HB THR A 26 3.731 3.992 1.354 1.00 0.00 H new ATOM 0 HG1 THR A 26 5.087 4.020 -1.171 1.00 0.00 H new ATOM 0 HG21 THR A 26 6.097 4.676 1.161 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.892 3.158 2.068 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.464 3.118 0.383 1.00 0.00 H new ATOM 397 N ILE A 27 1.567 2.057 1.176 1.00 0.00 N ATOM 398 CA ILE A 27 0.131 2.000 0.981 1.00 0.00 C ATOM 399 C ILE A 27 -0.553 3.323 1.239 1.00 0.00 C ATOM 400 O ILE A 27 -0.769 3.714 2.377 1.00 0.00 O ATOM 401 CB ILE A 27 -0.469 0.967 1.922 1.00 0.00 C ATOM 402 CG1 ILE A 27 0.296 -0.343 1.780 1.00 0.00 C ATOM 403 CG2 ILE A 27 -1.949 0.776 1.635 1.00 0.00 C ATOM 404 CD1 ILE A 27 -0.350 -1.493 2.503 1.00 0.00 C ATOM 0 H ILE A 27 1.865 2.054 2.151 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.031 1.734 -0.064 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.381 1.317 2.951 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.383 -0.591 0.722 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.308 -0.207 2.160 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.359 0.033 2.319 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.471 1.723 1.772 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.079 0.435 0.608 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.247 -2.394 2.360 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.413 -1.265 3.567 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.352 -1.655 2.107 1.00 0.00 H new ATOM 416 N THR A 28 -0.931 3.991 0.171 1.00 0.00 N ATOM 417 CA THR A 28 -1.611 5.260 0.293 1.00 0.00 C ATOM 418 C THR A 28 -3.097 5.097 0.032 1.00 0.00 C ATOM 419 O THR A 28 -3.539 4.068 -0.458 1.00 0.00 O ATOM 420 CB THR A 28 -1.000 6.283 -0.661 1.00 0.00 C ATOM 421 OG1 THR A 28 -1.100 5.844 -2.005 1.00 0.00 O ATOM 422 CG2 THR A 28 0.460 6.554 -0.370 1.00 0.00 C ATOM 0 H THR A 28 -0.779 3.677 -0.788 1.00 0.00 H new ATOM 0 HA THR A 28 -1.486 5.625 1.312 1.00 0.00 H new ATOM 0 HB THR A 28 -1.567 7.202 -0.511 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.704 6.515 -2.599 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.842 7.289 -1.079 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.563 6.940 0.644 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.028 5.628 -0.465 1.00 0.00 H new ATOM 430 N PHE A 29 -3.847 6.122 0.397 1.00 0.00 N ATOM 431 CA PHE A 29 -5.305 6.151 0.255 1.00 0.00 C ATOM 432 C PHE A 29 -5.783 5.403 -0.993 1.00 0.00 C ATOM 433 O PHE A 29 -6.855 4.796 -0.983 1.00 0.00 O ATOM 434 CB PHE A 29 -5.758 7.609 0.172 1.00 0.00 C ATOM 435 CG PHE A 29 -7.198 7.839 0.519 1.00 0.00 C ATOM 436 CD1 PHE A 29 -8.208 7.547 -0.383 1.00 0.00 C ATOM 437 CD2 PHE A 29 -7.539 8.362 1.754 1.00 0.00 C ATOM 438 CE1 PHE A 29 -9.533 7.771 -0.057 1.00 0.00 C ATOM 439 CE2 PHE A 29 -8.857 8.592 2.083 1.00 0.00 C ATOM 440 CZ PHE A 29 -9.857 8.297 1.180 1.00 0.00 C ATOM 0 H PHE A 29 -3.462 6.973 0.807 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.739 5.651 1.121 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.138 8.206 0.840 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -5.580 7.974 -0.840 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -7.958 7.140 -1.352 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.763 8.593 2.469 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -10.313 7.536 -0.767 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -9.108 9.004 3.049 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.890 8.476 1.438 1.00 0.00 H new ATOM 450 N ASP A 30 -4.988 5.439 -2.057 1.00 0.00 N ATOM 451 CA ASP A 30 -5.344 4.752 -3.297 1.00 0.00 C ATOM 452 C ASP A 30 -5.041 3.256 -3.198 1.00 0.00 C ATOM 453 O ASP A 30 -5.908 2.420 -3.453 1.00 0.00 O ATOM 454 CB ASP A 30 -4.590 5.362 -4.480 1.00 0.00 C ATOM 455 CG ASP A 30 -4.927 4.683 -5.793 1.00 0.00 C ATOM 456 OD1 ASP A 30 -6.113 4.701 -6.184 1.00 0.00 O ATOM 457 OD2 ASP A 30 -4.004 4.133 -6.431 1.00 0.00 O ATOM 0 H ASP A 30 -4.097 5.934 -2.088 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.415 4.877 -3.457 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.829 6.423 -4.551 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.517 5.288 -4.301 1.00 0.00 H new ATOM 462 N GLU A 31 -3.807 2.924 -2.821 1.00 0.00 N ATOM 463 CA GLU A 31 -3.404 1.526 -2.685 1.00 0.00 C ATOM 464 C GLU A 31 -4.007 0.892 -1.447 1.00 0.00 C ATOM 465 O GLU A 31 -4.011 -0.330 -1.310 1.00 0.00 O ATOM 466 CB GLU A 31 -1.886 1.386 -2.676 1.00 0.00 C ATOM 467 CG GLU A 31 -1.311 1.167 -4.060 1.00 0.00 C ATOM 468 CD GLU A 31 0.197 1.240 -4.084 1.00 0.00 C ATOM 469 OE1 GLU A 31 0.791 1.678 -3.075 1.00 0.00 O ATOM 470 OE2 GLU A 31 0.784 0.867 -5.115 1.00 0.00 O ATOM 0 H GLU A 31 -3.074 3.599 -2.606 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.788 0.993 -3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.445 2.283 -2.242 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.606 0.551 -2.034 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.629 0.193 -4.431 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.718 1.915 -4.740 1.00 0.00 H new ATOM 477 N LEU A 32 -4.532 1.718 -0.554 1.00 0.00 N ATOM 478 CA LEU A 32 -5.148 1.218 0.653 1.00 0.00 C ATOM 479 C LEU A 32 -6.229 0.208 0.269 1.00 0.00 C ATOM 480 O LEU A 32 -6.195 -0.959 0.670 1.00 0.00 O ATOM 481 CB LEU A 32 -5.733 2.373 1.463 1.00 0.00 C ATOM 482 CG LEU A 32 -6.024 2.064 2.938 1.00 0.00 C ATOM 483 CD1 LEU A 32 -7.275 1.209 3.076 1.00 0.00 C ATOM 484 CD2 LEU A 32 -4.835 1.368 3.585 1.00 0.00 C ATOM 0 H LEU A 32 -4.541 2.734 -0.647 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.404 0.723 1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.041 3.214 1.416 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.660 2.695 0.987 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.196 3.009 3.453 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.461 1.003 4.130 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.128 1.741 2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.134 0.269 2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.061 1.158 4.630 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.632 0.433 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.959 2.014 3.526 1.00 0.00 H new ATOM 496 N LYS A 33 -7.160 0.673 -0.560 1.00 0.00 N ATOM 497 CA LYS A 33 -8.243 -0.160 -1.068 1.00 0.00 C ATOM 498 C LYS A 33 -7.726 -1.095 -2.148 1.00 0.00 C ATOM 499 O LYS A 33 -8.053 -2.273 -2.161 1.00 0.00 O ATOM 500 CB LYS A 33 -9.366 0.717 -1.624 1.00 0.00 C ATOM 501 CG LYS A 33 -8.864 1.886 -2.462 1.00 0.00 C ATOM 502 CD LYS A 33 -10.003 2.686 -3.075 1.00 0.00 C ATOM 503 CE LYS A 33 -11.067 3.045 -2.048 1.00 0.00 C ATOM 504 NZ LYS A 33 -12.163 3.854 -2.646 1.00 0.00 N ATOM 0 H LYS A 33 -7.184 1.635 -0.897 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.638 -0.759 -0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -10.029 0.102 -2.232 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.960 1.103 -0.795 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.256 2.542 -1.839 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.218 1.511 -3.256 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.606 3.599 -3.520 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -10.457 2.110 -3.881 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.481 2.132 -1.620 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.609 3.602 -1.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.842 4.121 -1.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.765 4.713 -3.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.650 3.294 -3.375 1.00 0.00 H new ATOM 518 N ASP A 34 -6.908 -0.567 -3.052 1.00 0.00 N ATOM 519 CA ASP A 34 -6.349 -1.376 -4.127 1.00 0.00 C ATOM 520 C ASP A 34 -5.886 -2.727 -3.593 1.00 0.00 C ATOM 521 O ASP A 34 -6.435 -3.766 -3.950 1.00 0.00 O ATOM 522 CB ASP A 34 -5.176 -0.649 -4.775 1.00 0.00 C ATOM 523 CG ASP A 34 -4.665 -1.353 -6.018 1.00 0.00 C ATOM 524 OD1 ASP A 34 -5.243 -2.395 -6.392 1.00 0.00 O ATOM 525 OD2 ASP A 34 -3.686 -0.861 -6.618 1.00 0.00 O ATOM 0 H ASP A 34 -6.619 0.411 -3.062 1.00 0.00 H new ATOM 0 HA ASP A 34 -7.126 -1.541 -4.874 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -5.481 0.364 -5.036 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.364 -0.561 -4.053 1.00 0.00 H new ATOM 530 N GLY A 35 -4.872 -2.697 -2.731 1.00 0.00 N ATOM 531 CA GLY A 35 -4.340 -3.920 -2.155 1.00 0.00 C ATOM 532 C GLY A 35 -5.350 -4.685 -1.315 1.00 0.00 C ATOM 533 O GLY A 35 -5.526 -5.887 -1.503 1.00 0.00 O ATOM 0 H GLY A 35 -4.408 -1.843 -2.421 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.984 -4.565 -2.958 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.476 -3.675 -1.537 1.00 0.00 H new ATOM 537 N LEU A 36 -6.008 -4.001 -0.377 1.00 0.00 N ATOM 538 CA LEU A 36 -6.991 -4.657 0.485 1.00 0.00 C ATOM 539 C LEU A 36 -8.131 -5.241 -0.343 1.00 0.00 C ATOM 540 O LEU A 36 -8.317 -6.455 -0.402 1.00 0.00 O ATOM 541 CB LEU A 36 -7.554 -3.670 1.501 1.00 0.00 C ATOM 542 CG LEU A 36 -7.860 -4.251 2.882 1.00 0.00 C ATOM 543 CD1 LEU A 36 -8.877 -5.374 2.775 1.00 0.00 C ATOM 544 CD2 LEU A 36 -6.584 -4.744 3.551 1.00 0.00 C ATOM 0 H LEU A 36 -5.880 -3.005 -0.197 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.486 -5.466 1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -6.843 -2.852 1.619 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -8.470 -3.240 1.095 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.286 -3.461 3.500 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.082 -5.775 3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.800 -4.989 2.341 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -8.480 -6.165 2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.823 -5.154 4.532 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.127 -5.519 2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.888 -3.913 3.664 1.00 0.00 H new ATOM 556 N LYS A 37 -8.881 -4.355 -0.982 1.00 0.00 N ATOM 557 CA LYS A 37 -10.007 -4.737 -1.825 1.00 0.00 C ATOM 558 C LYS A 37 -9.594 -5.790 -2.857 1.00 0.00 C ATOM 559 O LYS A 37 -10.428 -6.547 -3.354 1.00 0.00 O ATOM 560 CB LYS A 37 -10.560 -3.487 -2.520 1.00 0.00 C ATOM 561 CG LYS A 37 -11.503 -3.775 -3.669 1.00 0.00 C ATOM 562 CD LYS A 37 -11.017 -3.124 -4.954 1.00 0.00 C ATOM 563 CE LYS A 37 -9.681 -3.696 -5.400 1.00 0.00 C ATOM 564 NZ LYS A 37 -9.816 -5.084 -5.925 1.00 0.00 N ATOM 0 H LYS A 37 -8.726 -3.348 -0.931 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.783 -5.180 -1.200 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.081 -2.877 -1.782 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.725 -2.893 -2.892 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.587 -4.852 -3.813 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.500 -3.407 -3.426 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.757 -3.272 -5.740 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.921 -2.049 -4.804 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.252 -3.057 -6.172 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.986 -3.692 -4.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.899 -5.406 -6.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.120 -5.717 -5.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.523 -5.099 -6.688 1.00 0.00 H new ATOM 578 N ARG A 38 -8.301 -5.826 -3.174 1.00 0.00 N ATOM 579 CA ARG A 38 -7.769 -6.778 -4.154 1.00 0.00 C ATOM 580 C ARG A 38 -8.061 -8.226 -3.767 1.00 0.00 C ATOM 581 O ARG A 38 -8.435 -9.035 -4.616 1.00 0.00 O ATOM 582 CB ARG A 38 -6.260 -6.588 -4.317 1.00 0.00 C ATOM 583 CG ARG A 38 -5.633 -7.503 -5.356 1.00 0.00 C ATOM 584 CD ARG A 38 -4.158 -7.194 -5.542 1.00 0.00 C ATOM 585 NE ARG A 38 -3.945 -5.801 -5.926 1.00 0.00 N ATOM 586 CZ ARG A 38 -2.748 -5.267 -6.140 1.00 0.00 C ATOM 587 NH1 ARG A 38 -1.654 -6.007 -6.020 1.00 0.00 N ATOM 588 NH2 ARG A 38 -2.645 -3.988 -6.474 1.00 0.00 N ATOM 0 H ARG A 38 -7.600 -5.207 -2.767 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.271 -6.575 -5.100 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -6.062 -5.552 -4.592 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.776 -6.761 -3.356 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.754 -8.542 -5.049 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -6.154 -7.389 -6.307 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.622 -7.403 -4.616 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.742 -7.850 -6.306 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.764 -5.203 -6.036 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -1.730 -6.991 -5.762 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.737 -5.592 -6.185 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -3.484 -3.416 -6.566 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.726 -3.576 -6.639 1.00 0.00 H new ATOM 602 N VAL A 39 -7.873 -8.560 -2.491 1.00 0.00 N ATOM 603 CA VAL A 39 -8.104 -9.924 -2.018 1.00 0.00 C ATOM 604 C VAL A 39 -9.593 -10.259 -1.931 1.00 0.00 C ATOM 605 O VAL A 39 -9.986 -11.185 -1.221 1.00 0.00 O ATOM 606 CB VAL A 39 -7.453 -10.159 -0.640 1.00 0.00 C ATOM 607 CG1 VAL A 39 -5.962 -9.870 -0.696 1.00 0.00 C ATOM 608 CG2 VAL A 39 -8.127 -9.312 0.430 1.00 0.00 C ATOM 0 H VAL A 39 -7.563 -7.909 -1.770 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.642 -10.583 -2.754 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.588 -11.208 -0.375 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.521 -10.042 0.286 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.491 -10.529 -1.426 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.803 -8.832 -0.989 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.650 -9.495 1.393 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.031 -8.257 0.173 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -9.183 -9.576 0.492 1.00 0.00 H new ATOM 618 N GLY A 40 -10.416 -9.508 -2.656 1.00 0.00 N ATOM 619 CA GLY A 40 -11.846 -9.751 -2.641 1.00 0.00 C ATOM 620 C GLY A 40 -12.585 -8.792 -1.732 1.00 0.00 C ATOM 621 O GLY A 40 -13.808 -8.664 -1.813 1.00 0.00 O ATOM 0 H GLY A 40 -10.118 -8.736 -3.253 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -12.238 -9.662 -3.654 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -12.035 -10.774 -2.316 1.00 0.00 H new ATOM 625 N SER A 41 -11.841 -8.113 -0.865 1.00 0.00 N ATOM 626 CA SER A 41 -12.419 -7.159 0.063 1.00 0.00 C ATOM 627 C SER A 41 -13.125 -6.033 -0.683 1.00 0.00 C ATOM 628 O SER A 41 -12.806 -5.744 -1.835 1.00 0.00 O ATOM 629 CB SER A 41 -11.321 -6.593 0.958 1.00 0.00 C ATOM 630 OG SER A 41 -10.779 -7.598 1.797 1.00 0.00 O ATOM 0 H SER A 41 -10.828 -8.210 -0.789 1.00 0.00 H new ATOM 0 HA SER A 41 -13.160 -7.671 0.677 1.00 0.00 H new ATOM 0 HB2 SER A 41 -10.531 -6.164 0.342 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.725 -5.785 1.568 1.00 0.00 H new ATOM 0 HG SER A 41 -10.909 -7.346 2.735 1.00 0.00 H new ATOM 636 N GLU A 42 -14.089 -5.403 -0.021 1.00 0.00 N ATOM 637 CA GLU A 42 -14.839 -4.311 -0.627 1.00 0.00 C ATOM 638 C GLU A 42 -15.060 -3.181 0.376 1.00 0.00 C ATOM 639 O GLU A 42 -15.846 -3.307 1.314 1.00 0.00 O ATOM 640 CB GLU A 42 -16.175 -4.816 -1.172 1.00 0.00 C ATOM 641 CG GLU A 42 -17.052 -5.485 -0.126 1.00 0.00 C ATOM 642 CD GLU A 42 -18.363 -5.988 -0.700 1.00 0.00 C ATOM 643 OE1 GLU A 42 -19.135 -5.160 -1.228 1.00 0.00 O ATOM 644 OE2 GLU A 42 -18.615 -7.208 -0.620 1.00 0.00 O ATOM 0 H GLU A 42 -14.369 -5.630 0.933 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.254 -3.917 -1.458 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.719 -3.978 -1.607 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -15.983 -5.524 -1.978 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.510 -6.320 0.318 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.259 -4.777 0.676 1.00 0.00 H new ATOM 651 N LEU A 43 -14.342 -2.083 0.176 1.00 0.00 N ATOM 652 CA LEU A 43 -14.433 -0.930 1.062 1.00 0.00 C ATOM 653 C LEU A 43 -14.762 0.339 0.282 1.00 0.00 C ATOM 654 O LEU A 43 -14.637 0.377 -0.943 1.00 0.00 O ATOM 655 CB LEU A 43 -13.113 -0.746 1.807 1.00 0.00 C ATOM 656 CG LEU A 43 -12.573 -2.004 2.489 1.00 0.00 C ATOM 657 CD1 LEU A 43 -11.213 -1.728 3.113 1.00 0.00 C ATOM 658 CD2 LEU A 43 -13.552 -2.506 3.542 1.00 0.00 C ATOM 0 H LEU A 43 -13.687 -1.967 -0.597 1.00 0.00 H new ATOM 0 HA LEU A 43 -15.237 -1.112 1.776 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.364 -0.383 1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -13.244 0.030 2.561 1.00 0.00 H new ATOM 0 HG LEU A 43 -12.455 -2.781 1.734 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.843 -2.633 3.594 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.513 -1.417 2.337 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.307 -0.935 3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -13.149 -3.401 4.016 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.703 -1.733 4.296 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -14.505 -2.743 3.069 1.00 0.00 H new ATOM 670 N MET A 44 -15.149 1.386 1.004 1.00 0.00 N ATOM 671 CA MET A 44 -15.457 2.673 0.400 1.00 0.00 C ATOM 672 C MET A 44 -14.389 3.667 0.829 1.00 0.00 C ATOM 673 O MET A 44 -13.644 3.394 1.766 1.00 0.00 O ATOM 674 CB MET A 44 -16.839 3.153 0.841 1.00 0.00 C ATOM 675 CG MET A 44 -17.890 2.058 0.806 1.00 0.00 C ATOM 676 SD MET A 44 -19.566 2.693 1.012 1.00 0.00 S ATOM 677 CE MET A 44 -19.450 3.445 2.633 1.00 0.00 C ATOM 0 H MET A 44 -15.257 1.365 2.018 1.00 0.00 H new ATOM 0 HA MET A 44 -15.468 2.582 -0.686 1.00 0.00 H new ATOM 0 HB2 MET A 44 -16.772 3.552 1.853 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.155 3.972 0.196 1.00 0.00 H new ATOM 0 HG2 MET A 44 -17.822 1.525 -0.143 1.00 0.00 H new ATOM 0 HG3 MET A 44 -17.681 1.334 1.594 1.00 0.00 H new ATOM 0 HE1 MET A 44 -20.324 3.171 3.225 1.00 0.00 H new ATOM 0 HE2 MET A 44 -18.548 3.093 3.134 1.00 0.00 H new ATOM 0 HE3 MET A 44 -19.408 4.529 2.529 1.00 0.00 H new ATOM 687 N GLU A 45 -14.287 4.802 0.148 1.00 0.00 N ATOM 688 CA GLU A 45 -13.263 5.779 0.499 1.00 0.00 C ATOM 689 C GLU A 45 -13.245 6.077 1.994 1.00 0.00 C ATOM 690 O GLU A 45 -12.257 5.769 2.660 1.00 0.00 O ATOM 691 CB GLU A 45 -13.415 7.054 -0.318 1.00 0.00 C ATOM 692 CG GLU A 45 -12.919 6.885 -1.731 1.00 0.00 C ATOM 693 CD GLU A 45 -12.755 8.203 -2.461 1.00 0.00 C ATOM 694 OE1 GLU A 45 -13.761 8.930 -2.607 1.00 0.00 O ATOM 695 OE2 GLU A 45 -11.621 8.509 -2.885 1.00 0.00 O ATOM 0 H GLU A 45 -14.886 5.066 -0.634 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.299 5.336 0.251 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.464 7.350 -0.336 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.864 7.861 0.165 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -11.962 6.363 -1.715 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.617 6.255 -2.282 1.00 0.00 H new ATOM 702 N SER A 46 -14.305 6.680 2.535 1.00 0.00 N ATOM 703 CA SER A 46 -14.347 7.002 3.960 1.00 0.00 C ATOM 704 C SER A 46 -13.953 5.807 4.827 1.00 0.00 C ATOM 705 O SER A 46 -13.545 5.977 5.975 1.00 0.00 O ATOM 706 CB SER A 46 -15.746 7.483 4.349 1.00 0.00 C ATOM 707 OG SER A 46 -16.106 8.641 3.617 1.00 0.00 O ATOM 0 H SER A 46 -15.138 6.953 2.013 1.00 0.00 H new ATOM 0 HA SER A 46 -13.622 7.796 4.137 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.471 6.691 4.163 1.00 0.00 H new ATOM 0 HB3 SER A 46 -15.776 7.699 5.417 1.00 0.00 H new ATOM 0 HG SER A 46 -17.005 8.929 3.881 1.00 0.00 H new ATOM 713 N GLU A 47 -14.050 4.605 4.268 1.00 0.00 N ATOM 714 CA GLU A 47 -13.676 3.396 4.996 1.00 0.00 C ATOM 715 C GLU A 47 -12.164 3.236 4.953 1.00 0.00 C ATOM 716 O GLU A 47 -11.529 2.966 5.969 1.00 0.00 O ATOM 717 CB GLU A 47 -14.370 2.168 4.408 1.00 0.00 C ATOM 718 CG GLU A 47 -15.881 2.205 4.561 1.00 0.00 C ATOM 719 CD GLU A 47 -16.563 0.975 3.991 1.00 0.00 C ATOM 720 OE1 GLU A 47 -15.850 0.064 3.523 1.00 0.00 O ATOM 721 OE2 GLU A 47 -17.810 0.922 4.021 1.00 0.00 O ATOM 0 H GLU A 47 -14.383 4.442 3.318 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.999 3.488 6.033 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -14.120 2.089 3.350 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.984 1.272 4.894 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.132 2.296 5.618 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.270 3.093 4.063 1.00 0.00 H new ATOM 728 N ILE A 48 -11.592 3.459 3.774 1.00 0.00 N ATOM 729 CA ILE A 48 -10.149 3.405 3.597 1.00 0.00 C ATOM 730 C ILE A 48 -9.508 4.360 4.582 1.00 0.00 C ATOM 731 O ILE A 48 -8.658 3.993 5.397 1.00 0.00 O ATOM 732 CB ILE A 48 -9.766 3.827 2.161 1.00 0.00 C ATOM 733 CG1 ILE A 48 -9.881 2.645 1.212 1.00 0.00 C ATOM 734 CG2 ILE A 48 -8.359 4.411 2.114 1.00 0.00 C ATOM 735 CD1 ILE A 48 -11.251 2.007 1.171 1.00 0.00 C ATOM 0 H ILE A 48 -12.111 3.680 2.924 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.802 2.386 3.767 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.463 4.602 1.842 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -9.617 2.975 0.207 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -9.151 1.890 1.502 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -8.118 4.699 1.091 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.307 5.288 2.759 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.644 3.665 2.459 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.243 1.173 0.469 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.513 1.643 2.164 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.986 2.745 0.850 1.00 0.00 H new ATOM 747 N LYS A 49 -9.971 5.590 4.494 1.00 0.00 N ATOM 748 CA LYS A 49 -9.525 6.659 5.350 1.00 0.00 C ATOM 749 C LYS A 49 -9.782 6.312 6.803 1.00 0.00 C ATOM 750 O LYS A 49 -9.067 6.758 7.702 1.00 0.00 O ATOM 751 CB LYS A 49 -10.296 7.915 4.991 1.00 0.00 C ATOM 752 CG LYS A 49 -10.059 9.062 5.934 1.00 0.00 C ATOM 753 CD LYS A 49 -10.968 10.220 5.604 1.00 0.00 C ATOM 754 CE LYS A 49 -10.758 11.357 6.578 1.00 0.00 C ATOM 755 NZ LYS A 49 -9.310 11.672 6.738 1.00 0.00 N ATOM 0 H LYS A 49 -10.677 5.874 3.815 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.455 6.814 5.212 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.021 8.223 3.982 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.361 7.684 4.975 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -10.233 8.738 6.960 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.019 9.381 5.872 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -10.773 10.564 4.588 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -12.008 9.894 5.636 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -11.288 12.242 6.227 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -11.184 11.093 7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.177 12.279 7.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.775 10.789 6.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.967 12.168 5.891 1.00 0.00 H new ATOM 769 N ASP A 50 -10.814 5.511 7.021 1.00 0.00 N ATOM 770 CA ASP A 50 -11.176 5.099 8.366 1.00 0.00 C ATOM 771 C ASP A 50 -10.103 4.188 8.927 1.00 0.00 C ATOM 772 O ASP A 50 -9.560 4.436 9.997 1.00 0.00 O ATOM 773 CB ASP A 50 -12.530 4.389 8.366 1.00 0.00 C ATOM 774 CG ASP A 50 -12.971 3.989 9.761 1.00 0.00 C ATOM 775 OD1 ASP A 50 -13.121 4.886 10.616 1.00 0.00 O ATOM 776 OD2 ASP A 50 -13.165 2.779 9.997 1.00 0.00 O ATOM 0 H ASP A 50 -11.413 5.135 6.286 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.257 5.985 8.996 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.281 5.044 7.924 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.472 3.501 7.737 1.00 0.00 H new ATOM 781 N LEU A 51 -9.795 3.140 8.179 1.00 0.00 N ATOM 782 CA LEU A 51 -8.777 2.184 8.578 1.00 0.00 C ATOM 783 C LEU A 51 -7.449 2.871 8.864 1.00 0.00 C ATOM 784 O LEU A 51 -6.677 2.414 9.703 1.00 0.00 O ATOM 785 CB LEU A 51 -8.595 1.129 7.485 1.00 0.00 C ATOM 786 CG LEU A 51 -7.330 0.283 7.616 1.00 0.00 C ATOM 787 CD1 LEU A 51 -7.587 -1.140 7.139 1.00 0.00 C ATOM 788 CD2 LEU A 51 -6.187 0.901 6.823 1.00 0.00 C ATOM 0 H LEU A 51 -10.240 2.930 7.286 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.110 1.702 9.497 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -9.461 0.467 7.491 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -8.583 1.628 6.516 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.048 0.254 8.669 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.675 -1.728 7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.376 -1.589 7.742 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.894 -1.123 6.093 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.295 0.284 6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -6.464 0.960 5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.982 1.903 7.201 1.00 0.00 H new ATOM 800 N MET A 52 -7.172 3.954 8.152 1.00 0.00 N ATOM 801 CA MET A 52 -5.918 4.665 8.332 1.00 0.00 C ATOM 802 C MET A 52 -5.861 5.431 9.648 1.00 0.00 C ATOM 803 O MET A 52 -5.051 5.135 10.519 1.00 0.00 O ATOM 804 CB MET A 52 -5.689 5.637 7.180 1.00 0.00 C ATOM 805 CG MET A 52 -5.474 4.965 5.843 1.00 0.00 C ATOM 806 SD MET A 52 -4.637 6.033 4.659 1.00 0.00 S ATOM 807 CE MET A 52 -4.087 4.820 3.465 1.00 0.00 C ATOM 0 H MET A 52 -7.794 4.356 7.450 1.00 0.00 H new ATOM 0 HA MET A 52 -5.133 3.909 8.350 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.547 6.305 7.106 1.00 0.00 H new ATOM 0 HB3 MET A 52 -4.821 6.256 7.408 1.00 0.00 H new ATOM 0 HG2 MET A 52 -4.887 4.058 5.987 1.00 0.00 H new ATOM 0 HG3 MET A 52 -6.437 4.660 5.434 1.00 0.00 H new ATOM 0 HE1 MET A 52 -3.261 5.230 2.884 1.00 0.00 H new ATOM 0 HE2 MET A 52 -3.754 3.922 3.986 1.00 0.00 H new ATOM 0 HE3 MET A 52 -4.910 4.568 2.797 1.00 0.00 H new ATOM 817 N ASP A 53 -6.702 6.434 9.786 1.00 0.00 N ATOM 818 CA ASP A 53 -6.691 7.247 10.995 1.00 0.00 C ATOM 819 C ASP A 53 -7.105 6.428 12.211 1.00 0.00 C ATOM 820 O ASP A 53 -6.832 6.811 13.349 1.00 0.00 O ATOM 821 CB ASP A 53 -7.599 8.467 10.837 1.00 0.00 C ATOM 822 CG ASP A 53 -7.342 9.519 11.900 1.00 0.00 C ATOM 823 OD1 ASP A 53 -6.488 9.284 12.779 1.00 0.00 O ATOM 824 OD2 ASP A 53 -7.992 10.583 11.850 1.00 0.00 O ATOM 0 H ASP A 53 -7.395 6.708 9.089 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.670 7.595 11.153 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -7.446 8.905 9.851 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -8.641 8.150 10.887 1.00 0.00 H new ATOM 829 N ALA A 54 -7.758 5.301 11.970 1.00 0.00 N ATOM 830 CA ALA A 54 -8.198 4.441 13.057 1.00 0.00 C ATOM 831 C ALA A 54 -7.156 3.375 13.397 1.00 0.00 C ATOM 832 O ALA A 54 -7.022 2.980 14.555 1.00 0.00 O ATOM 833 CB ALA A 54 -9.523 3.782 12.715 1.00 0.00 C ATOM 0 H ALA A 54 -7.994 4.962 11.037 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.329 5.073 13.935 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.835 3.143 13.541 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.278 4.550 12.545 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.408 3.180 11.814 1.00 0.00 H new ATOM 839 N ALA A 55 -6.433 2.891 12.383 1.00 0.00 N ATOM 840 CA ALA A 55 -5.429 1.848 12.600 1.00 0.00 C ATOM 841 C ALA A 55 -4.016 2.295 12.227 1.00 0.00 C ATOM 842 O ALA A 55 -3.075 2.023 12.971 1.00 0.00 O ATOM 843 CB ALA A 55 -5.802 0.590 11.832 1.00 0.00 C ATOM 0 H ALA A 55 -6.523 3.201 11.415 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.421 1.636 13.669 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -5.047 -0.178 12.002 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.771 0.228 12.175 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.856 0.816 10.767 1.00 0.00 H new ATOM 849 N ASP A 56 -3.861 2.975 11.086 1.00 0.00 N ATOM 850 CA ASP A 56 -2.540 3.440 10.659 1.00 0.00 C ATOM 851 C ASP A 56 -1.823 4.110 11.829 1.00 0.00 C ATOM 852 O ASP A 56 -2.093 5.266 12.158 1.00 0.00 O ATOM 853 CB ASP A 56 -2.655 4.418 9.483 1.00 0.00 C ATOM 854 CG ASP A 56 -1.305 4.795 8.907 1.00 0.00 C ATOM 855 OD1 ASP A 56 -0.283 4.292 9.415 1.00 0.00 O ATOM 856 OD2 ASP A 56 -1.270 5.592 7.946 1.00 0.00 O ATOM 0 H ASP A 56 -4.623 3.212 10.451 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.962 2.577 10.328 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.268 3.970 8.701 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -3.170 5.320 9.814 1.00 0.00 H new ATOM 861 N ILE A 57 -0.929 3.360 12.469 1.00 0.00 N ATOM 862 CA ILE A 57 -0.181 3.846 13.626 1.00 0.00 C ATOM 863 C ILE A 57 0.471 5.199 13.359 1.00 0.00 C ATOM 864 O ILE A 57 0.761 5.953 14.288 1.00 0.00 O ATOM 865 CB ILE A 57 0.912 2.839 14.031 1.00 0.00 C ATOM 866 CG1 ILE A 57 0.342 1.416 14.060 1.00 0.00 C ATOM 867 CG2 ILE A 57 1.504 3.207 15.385 1.00 0.00 C ATOM 868 CD1 ILE A 57 -0.798 1.231 15.042 1.00 0.00 C ATOM 0 H ILE A 57 -0.703 2.402 12.202 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.901 3.961 14.437 1.00 0.00 H new ATOM 0 HB ILE A 57 1.709 2.877 13.289 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.006 1.154 13.061 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.142 0.720 14.312 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.274 2.484 15.654 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.944 4.203 15.331 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.718 3.198 16.140 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -1.147 0.199 15.004 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.451 1.460 16.050 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.617 1.901 14.779 1.00 0.00 H new ATOM 880 N ASP A 58 0.705 5.497 12.089 1.00 0.00 N ATOM 881 CA ASP A 58 1.332 6.758 11.704 1.00 0.00 C ATOM 882 C ASP A 58 0.531 7.434 10.599 1.00 0.00 C ATOM 883 O ASP A 58 1.091 7.863 9.594 1.00 0.00 O ATOM 884 CB ASP A 58 2.778 6.532 11.254 1.00 0.00 C ATOM 885 CG ASP A 58 3.600 7.808 11.269 1.00 0.00 C ATOM 886 OD1 ASP A 58 3.238 8.761 10.550 1.00 0.00 O ATOM 887 OD2 ASP A 58 4.610 7.852 12.003 1.00 0.00 O ATOM 0 H ASP A 58 0.471 4.885 11.307 1.00 0.00 H new ATOM 0 HA ASP A 58 1.345 7.412 12.576 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.246 5.795 11.906 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.780 6.114 10.247 1.00 0.00 H new ATOM 892 N LYS A 59 -0.789 7.469 10.779 1.00 0.00 N ATOM 893 CA LYS A 59 -1.707 8.030 9.798 1.00 0.00 C ATOM 894 C LYS A 59 -1.102 9.186 9.009 1.00 0.00 C ATOM 895 O LYS A 59 -1.192 10.353 9.394 1.00 0.00 O ATOM 896 CB LYS A 59 -2.984 8.503 10.489 1.00 0.00 C ATOM 897 CG LYS A 59 -3.933 9.227 9.564 1.00 0.00 C ATOM 898 CD LYS A 59 -4.481 8.312 8.486 1.00 0.00 C ATOM 899 CE LYS A 59 -5.340 9.075 7.490 1.00 0.00 C ATOM 900 NZ LYS A 59 -6.490 9.754 8.150 1.00 0.00 N ATOM 0 H LYS A 59 -1.250 7.107 11.614 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.930 7.234 9.088 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.495 7.642 10.921 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.718 9.163 11.315 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.759 9.641 10.143 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.417 10.067 9.099 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.655 7.831 7.962 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.072 7.520 8.946 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.728 9.816 6.976 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -5.712 8.387 6.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -6.596 10.713 7.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -7.360 9.212 7.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.318 9.811 9.174 1.00 0.00 H new ATOM 914 N SER A 60 -0.513 8.826 7.878 1.00 0.00 N ATOM 915 CA SER A 60 0.096 9.778 6.959 1.00 0.00 C ATOM 916 C SER A 60 -0.474 9.540 5.567 1.00 0.00 C ATOM 917 O SER A 60 0.114 9.928 4.557 1.00 0.00 O ATOM 918 CB SER A 60 1.617 9.614 6.937 1.00 0.00 C ATOM 919 OG SER A 60 2.167 9.760 8.232 1.00 0.00 O ATOM 0 H SER A 60 -0.443 7.856 7.569 1.00 0.00 H new ATOM 0 HA SER A 60 -0.127 10.793 7.288 1.00 0.00 H new ATOM 0 HB2 SER A 60 1.874 8.632 6.539 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.055 10.354 6.268 1.00 0.00 H new ATOM 0 HG SER A 60 2.143 8.898 8.697 1.00 0.00 H new ATOM 925 N GLY A 61 -1.615 8.855 5.539 1.00 0.00 N ATOM 926 CA GLY A 61 -2.251 8.517 4.282 1.00 0.00 C ATOM 927 C GLY A 61 -1.416 7.507 3.529 1.00 0.00 C ATOM 928 O GLY A 61 -1.557 7.338 2.315 1.00 0.00 O ATOM 0 H GLY A 61 -2.110 8.528 6.369 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.246 8.112 4.467 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.380 9.415 3.678 1.00 0.00 H new ATOM 932 N THR A 62 -0.536 6.844 4.280 1.00 0.00 N ATOM 933 CA THR A 62 0.370 5.840 3.749 1.00 0.00 C ATOM 934 C THR A 62 0.606 4.754 4.794 1.00 0.00 C ATOM 935 O THR A 62 0.674 5.042 5.991 1.00 0.00 O ATOM 936 CB THR A 62 1.699 6.488 3.358 1.00 0.00 C ATOM 937 OG1 THR A 62 1.502 7.474 2.359 1.00 0.00 O ATOM 938 CG2 THR A 62 2.717 5.501 2.835 1.00 0.00 C ATOM 0 H THR A 62 -0.436 6.995 5.284 1.00 0.00 H new ATOM 0 HA THR A 62 -0.076 5.390 2.862 1.00 0.00 H new ATOM 0 HB THR A 62 2.085 6.929 4.277 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.363 7.878 2.124 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.635 6.028 2.577 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.929 4.756 3.602 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.321 5.006 1.948 1.00 0.00 H new ATOM 946 N ILE A 63 0.724 3.510 4.344 1.00 0.00 N ATOM 947 CA ILE A 63 0.943 2.402 5.250 1.00 0.00 C ATOM 948 C ILE A 63 2.138 1.557 4.824 1.00 0.00 C ATOM 949 O ILE A 63 2.217 1.093 3.689 1.00 0.00 O ATOM 950 CB ILE A 63 -0.313 1.516 5.354 1.00 0.00 C ATOM 951 CG1 ILE A 63 -1.426 2.265 6.096 1.00 0.00 C ATOM 952 CG2 ILE A 63 0.004 0.198 6.047 1.00 0.00 C ATOM 953 CD1 ILE A 63 -2.714 1.481 6.216 1.00 0.00 C ATOM 0 H ILE A 63 0.671 3.250 3.359 1.00 0.00 H new ATOM 0 HA ILE A 63 1.157 2.828 6.230 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.657 1.287 4.345 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.074 2.523 7.095 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.629 3.202 5.577 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.900 -0.408 6.107 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.763 -0.339 5.478 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.376 0.396 7.052 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.453 2.076 6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.091 1.245 5.221 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.527 0.556 6.762 1.00 0.00 H new ATOM 965 N ASP A 64 3.059 1.360 5.755 1.00 0.00 N ATOM 966 CA ASP A 64 4.256 0.573 5.508 1.00 0.00 C ATOM 967 C ASP A 64 4.117 -0.786 6.169 1.00 0.00 C ATOM 968 O ASP A 64 3.200 -0.993 6.956 1.00 0.00 O ATOM 969 CB ASP A 64 5.501 1.295 6.031 1.00 0.00 C ATOM 970 CG ASP A 64 5.716 2.641 5.365 1.00 0.00 C ATOM 971 OD1 ASP A 64 4.907 3.008 4.487 1.00 0.00 O ATOM 972 OD2 ASP A 64 6.696 3.328 5.721 1.00 0.00 O ATOM 0 H ASP A 64 2.998 1.740 6.700 1.00 0.00 H new ATOM 0 HA ASP A 64 4.372 0.440 4.432 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.409 1.437 7.108 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.377 0.668 5.866 1.00 0.00 H new ATOM 977 N TYR A 65 5.011 -1.713 5.830 1.00 0.00 N ATOM 978 CA TYR A 65 4.967 -3.064 6.383 1.00 0.00 C ATOM 979 C TYR A 65 4.485 -3.058 7.828 1.00 0.00 C ATOM 980 O TYR A 65 3.598 -3.826 8.196 1.00 0.00 O ATOM 981 CB TYR A 65 6.349 -3.713 6.306 1.00 0.00 C ATOM 982 CG TYR A 65 6.400 -5.085 6.936 1.00 0.00 C ATOM 983 CD1 TYR A 65 5.522 -6.083 6.534 1.00 0.00 C ATOM 984 CD2 TYR A 65 7.313 -5.377 7.938 1.00 0.00 C ATOM 985 CE1 TYR A 65 5.554 -7.335 7.114 1.00 0.00 C ATOM 986 CE2 TYR A 65 7.353 -6.628 8.522 1.00 0.00 C ATOM 987 CZ TYR A 65 6.472 -7.604 8.107 1.00 0.00 C ATOM 988 OH TYR A 65 6.507 -8.851 8.686 1.00 0.00 O ATOM 0 H TYR A 65 5.775 -1.552 5.174 1.00 0.00 H new ATOM 0 HA TYR A 65 4.260 -3.642 5.788 1.00 0.00 H new ATOM 0 HB2 TYR A 65 6.649 -3.789 5.261 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.074 -3.067 6.800 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.803 -5.876 5.755 1.00 0.00 H new ATOM 0 HD2 TYR A 65 8.003 -4.614 8.267 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.863 -8.100 6.792 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.071 -6.841 9.300 1.00 0.00 H new ATOM 0 HH TYR A 65 7.211 -8.876 9.367 1.00 0.00 H new ATOM 998 N GLY A 66 5.058 -2.177 8.637 1.00 0.00 N ATOM 999 CA GLY A 66 4.656 -2.080 10.025 1.00 0.00 C ATOM 1000 C GLY A 66 3.189 -1.724 10.171 1.00 0.00 C ATOM 1001 O GLY A 66 2.405 -2.494 10.729 1.00 0.00 O ATOM 0 H GLY A 66 5.794 -1.528 8.356 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.850 -3.029 10.525 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.263 -1.326 10.526 1.00 0.00 H new ATOM 1005 N GLU A 67 2.821 -0.552 9.664 1.00 0.00 N ATOM 1006 CA GLU A 67 1.447 -0.076 9.724 1.00 0.00 C ATOM 1007 C GLU A 67 0.486 -1.080 9.083 1.00 0.00 C ATOM 1008 O GLU A 67 -0.698 -1.114 9.413 1.00 0.00 O ATOM 1009 CB GLU A 67 1.357 1.274 9.013 1.00 0.00 C ATOM 1010 CG GLU A 67 2.453 2.239 9.434 1.00 0.00 C ATOM 1011 CD GLU A 67 2.443 3.529 8.637 1.00 0.00 C ATOM 1012 OE1 GLU A 67 2.665 3.474 7.412 1.00 0.00 O ATOM 1013 OE2 GLU A 67 2.214 4.596 9.237 1.00 0.00 O ATOM 0 H GLU A 67 3.465 0.091 9.202 1.00 0.00 H new ATOM 0 HA GLU A 67 1.157 0.037 10.769 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.413 1.116 7.936 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.386 1.723 9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.338 2.471 10.493 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.422 1.753 9.317 1.00 0.00 H new ATOM 1020 N PHE A 68 1.008 -1.896 8.169 1.00 0.00 N ATOM 1021 CA PHE A 68 0.206 -2.904 7.481 1.00 0.00 C ATOM 1022 C PHE A 68 -0.287 -3.953 8.452 1.00 0.00 C ATOM 1023 O PHE A 68 -1.479 -4.246 8.525 1.00 0.00 O ATOM 1024 CB PHE A 68 1.034 -3.591 6.405 1.00 0.00 C ATOM 1025 CG PHE A 68 0.251 -4.507 5.515 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -0.794 -4.030 4.746 1.00 0.00 C ATOM 1027 CD2 PHE A 68 0.577 -5.849 5.443 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -1.498 -4.878 3.915 1.00 0.00 C ATOM 1029 CE2 PHE A 68 -0.124 -6.702 4.619 1.00 0.00 C ATOM 1030 CZ PHE A 68 -1.160 -6.216 3.852 1.00 0.00 C ATOM 0 H PHE A 68 1.988 -1.878 7.887 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.647 -2.398 7.029 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.514 -2.829 5.791 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.830 -4.162 6.884 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.062 -2.985 4.796 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.391 -6.233 6.040 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.311 -4.496 3.315 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.138 -7.749 4.574 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.708 -6.881 3.201 1.00 0.00 H new ATOM 1040 N ILE A 69 0.653 -4.530 9.180 1.00 0.00 N ATOM 1041 CA ILE A 69 0.341 -5.568 10.140 1.00 0.00 C ATOM 1042 C ILE A 69 -0.595 -5.047 11.226 1.00 0.00 C ATOM 1043 O ILE A 69 -1.581 -5.696 11.570 1.00 0.00 O ATOM 1044 CB ILE A 69 1.613 -6.130 10.800 1.00 0.00 C ATOM 1045 CG1 ILE A 69 2.772 -6.207 9.798 1.00 0.00 C ATOM 1046 CG2 ILE A 69 1.314 -7.506 11.349 1.00 0.00 C ATOM 1047 CD1 ILE A 69 4.045 -6.779 10.388 1.00 0.00 C ATOM 0 H ILE A 69 1.644 -4.294 9.122 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.153 -6.368 9.589 1.00 0.00 H new ATOM 0 HB ILE A 69 1.914 -5.462 11.607 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.468 -6.819 8.949 1.00 0.00 H new ATOM 0 HG13 ILE A 69 2.976 -5.208 9.414 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.209 -7.913 11.819 1.00 0.00 H new ATOM 0 HG22 ILE A 69 0.516 -7.437 12.088 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.001 -8.162 10.537 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.821 -6.804 9.623 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.374 -6.155 11.219 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.857 -7.791 10.747 1.00 0.00 H new ATOM 1059 N ALA A 70 -0.280 -3.872 11.759 1.00 0.00 N ATOM 1060 CA ALA A 70 -1.094 -3.265 12.806 1.00 0.00 C ATOM 1061 C ALA A 70 -2.467 -2.859 12.276 1.00 0.00 C ATOM 1062 O ALA A 70 -3.361 -2.511 13.049 1.00 0.00 O ATOM 1063 CB ALA A 70 -0.375 -2.059 13.394 1.00 0.00 C ATOM 0 H ALA A 70 0.533 -3.321 11.484 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.245 -4.007 13.590 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.991 -1.613 14.175 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.577 -2.375 13.820 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.196 -1.324 12.609 1.00 0.00 H new ATOM 1069 N ALA A 71 -2.626 -2.903 10.957 1.00 0.00 N ATOM 1070 CA ALA A 71 -3.890 -2.536 10.324 1.00 0.00 C ATOM 1071 C ALA A 71 -4.761 -3.759 10.062 1.00 0.00 C ATOM 1072 O ALA A 71 -5.914 -3.816 10.490 1.00 0.00 O ATOM 1073 CB ALA A 71 -3.630 -1.786 9.027 1.00 0.00 C ATOM 0 H ALA A 71 -1.896 -3.189 10.305 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.430 -1.885 11.011 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.580 -1.518 8.565 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.061 -0.881 9.238 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -3.062 -2.421 8.347 1.00 0.00 H new ATOM 1303 N VAL A 85 -17.103 -1.277 15.055 1.00 0.00 N ATOM 1304 CA VAL A 85 -16.543 -0.457 16.116 1.00 0.00 C ATOM 1305 C VAL A 85 -15.375 0.388 15.611 1.00 0.00 C ATOM 1306 O VAL A 85 -15.006 1.385 16.234 1.00 0.00 O ATOM 1307 CB VAL A 85 -16.080 -1.314 17.310 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -17.247 -2.101 17.882 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -14.951 -2.245 16.897 1.00 0.00 C ATOM 0 HA VAL A 85 -17.339 0.208 16.451 1.00 0.00 H new ATOM 0 HB VAL A 85 -15.702 -0.649 18.086 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.903 -2.701 18.724 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -18.020 -1.411 18.220 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -17.656 -2.756 17.113 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -14.639 -2.841 17.755 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.297 -2.906 16.102 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.107 -1.656 16.538 1.00 0.00 H new ATOM 1319 N SER A 86 -14.796 -0.014 14.479 1.00 0.00 N ATOM 1320 CA SER A 86 -13.671 0.711 13.895 1.00 0.00 C ATOM 1321 C SER A 86 -14.011 2.189 13.716 1.00 0.00 C ATOM 1322 O SER A 86 -13.435 3.049 14.383 1.00 0.00 O ATOM 1323 CB SER A 86 -13.290 0.099 12.546 1.00 0.00 C ATOM 1324 OG SER A 86 -12.203 0.793 11.959 1.00 0.00 O ATOM 0 H SER A 86 -15.088 -0.836 13.950 1.00 0.00 H new ATOM 0 HA SER A 86 -12.824 0.630 14.577 1.00 0.00 H new ATOM 0 HB2 SER A 86 -13.025 -0.950 12.681 1.00 0.00 H new ATOM 0 HB3 SER A 86 -14.148 0.127 11.875 1.00 0.00 H new ATOM 0 HG SER A 86 -12.543 1.456 11.323 1.00 0.00 H new ATOM 1330 N ALA A 87 -14.966 2.481 12.835 1.00 0.00 N ATOM 1331 CA ALA A 87 -15.381 3.860 12.607 1.00 0.00 C ATOM 1332 C ALA A 87 -16.123 4.379 13.825 1.00 0.00 C ATOM 1333 O ALA A 87 -16.022 5.552 14.173 1.00 0.00 O ATOM 1334 CB ALA A 87 -16.233 3.972 11.361 1.00 0.00 C ATOM 0 H ALA A 87 -15.461 1.788 12.274 1.00 0.00 H new ATOM 0 HA ALA A 87 -14.493 4.473 12.450 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -16.529 5.011 11.215 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -15.661 3.632 10.497 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -17.124 3.354 11.472 1.00 0.00 H new ATOM 1340 N PHE A 88 -16.846 3.477 14.488 1.00 0.00 N ATOM 1341 CA PHE A 88 -17.580 3.809 15.702 1.00 0.00 C ATOM 1342 C PHE A 88 -16.683 4.612 16.636 1.00 0.00 C ATOM 1343 O PHE A 88 -17.153 5.346 17.499 1.00 0.00 O ATOM 1344 CB PHE A 88 -18.031 2.525 16.389 1.00 0.00 C ATOM 1345 CG PHE A 88 -19.186 2.711 17.313 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -20.410 3.121 16.822 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -19.052 2.470 18.670 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -21.482 3.290 17.665 1.00 0.00 C ATOM 1349 CE2 PHE A 88 -20.124 2.638 19.521 1.00 0.00 C ATOM 1350 CZ PHE A 88 -21.341 3.048 19.018 1.00 0.00 C ATOM 0 H PHE A 88 -16.937 2.503 14.199 1.00 0.00 H new ATOM 0 HA PHE A 88 -18.456 4.406 15.449 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -18.301 1.792 15.628 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -17.193 2.110 16.949 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -20.526 3.311 15.765 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -18.100 2.148 19.065 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -22.434 3.612 17.270 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -20.011 2.449 20.578 1.00 0.00 H new ATOM 0 HZ PHE A 88 -22.183 3.180 19.681 1.00 0.00 H new ATOM 1360 N SER A 89 -15.378 4.470 16.438 1.00 0.00 N ATOM 1361 CA SER A 89 -14.400 5.189 17.234 1.00 0.00 C ATOM 1362 C SER A 89 -14.079 6.540 16.599 1.00 0.00 C ATOM 1363 O SER A 89 -13.986 7.553 17.292 1.00 0.00 O ATOM 1364 CB SER A 89 -13.135 4.356 17.372 1.00 0.00 C ATOM 1365 OG SER A 89 -12.161 5.026 18.155 1.00 0.00 O ATOM 0 H SER A 89 -14.974 3.859 15.728 1.00 0.00 H new ATOM 0 HA SER A 89 -14.818 5.368 18.225 1.00 0.00 H new ATOM 0 HB2 SER A 89 -13.377 3.397 17.830 1.00 0.00 H new ATOM 0 HB3 SER A 89 -12.727 4.143 16.384 1.00 0.00 H new ATOM 0 HG SER A 89 -11.359 4.467 18.228 1.00 0.00 H new ATOM 1371 N TYR A 90 -13.906 6.548 15.274 1.00 0.00 N ATOM 1372 CA TYR A 90 -13.592 7.777 14.556 1.00 0.00 C ATOM 1373 C TYR A 90 -14.860 8.588 14.305 1.00 0.00 C ATOM 1374 O TYR A 90 -15.016 9.685 14.844 1.00 0.00 O ATOM 1375 CB TYR A 90 -12.896 7.450 13.232 1.00 0.00 C ATOM 1376 CG TYR A 90 -12.192 8.637 12.611 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -11.497 9.535 13.408 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -12.215 8.861 11.236 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -10.846 10.619 12.862 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -11.565 9.946 10.683 1.00 0.00 C ATOM 1381 CZ TYR A 90 -10.882 10.822 11.499 1.00 0.00 C ATOM 1382 OH TYR A 90 -10.233 11.905 10.952 1.00 0.00 O ATOM 0 H TYR A 90 -13.979 5.720 14.683 1.00 0.00 H new ATOM 0 HA TYR A 90 -12.917 8.376 15.168 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -12.170 6.654 13.399 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -13.634 7.066 12.528 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -11.466 9.381 14.477 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -12.749 8.176 10.594 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -10.310 11.307 13.499 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -11.592 10.108 9.616 1.00 0.00 H new ATOM 0 HH TYR A 90 -9.268 11.814 11.095 1.00 0.00 H new ATOM 1392 N PHE A 91 -15.778 8.037 13.509 1.00 0.00 N ATOM 1393 CA PHE A 91 -17.043 8.705 13.223 1.00 0.00 C ATOM 1394 C PHE A 91 -17.752 9.012 14.532 1.00 0.00 C ATOM 1395 O PHE A 91 -17.954 10.176 14.876 1.00 0.00 O ATOM 1396 CB PHE A 91 -17.926 7.837 12.323 1.00 0.00 C ATOM 1397 CG PHE A 91 -17.438 7.739 10.900 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -16.116 7.427 10.620 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -18.305 7.964 9.843 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -15.670 7.342 9.315 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -17.864 7.880 8.536 1.00 0.00 C ATOM 1402 CZ PHE A 91 -16.545 7.568 8.271 1.00 0.00 C ATOM 0 H PHE A 91 -15.667 7.131 13.053 1.00 0.00 H new ATOM 0 HA PHE A 91 -16.844 9.636 12.692 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -17.985 6.834 12.746 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -18.938 8.243 12.323 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -15.427 7.248 11.432 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -19.338 8.208 10.043 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -14.638 7.099 9.112 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -18.551 8.058 7.722 1.00 0.00 H new ATOM 0 HZ PHE A 91 -16.199 7.501 7.250 1.00 0.00 H new ATOM 1412 N ASP A 92 -18.086 7.961 15.283 1.00 0.00 N ATOM 1413 CA ASP A 92 -18.713 8.138 16.585 1.00 0.00 C ATOM 1414 C ASP A 92 -17.614 8.459 17.581 1.00 0.00 C ATOM 1415 O ASP A 92 -17.338 7.702 18.511 1.00 0.00 O ATOM 1416 CB ASP A 92 -19.492 6.885 17.002 1.00 0.00 C ATOM 1417 CG ASP A 92 -20.211 7.058 18.325 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -20.183 8.179 18.877 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -20.812 6.076 18.806 1.00 0.00 O ATOM 0 H ASP A 92 -17.933 6.990 15.012 1.00 0.00 H new ATOM 0 HA ASP A 92 -19.437 8.952 16.547 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -20.219 6.639 16.228 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.805 6.042 17.074 1.00 0.00 H new ATOM 1424 N LYS A 93 -16.957 9.577 17.314 1.00 0.00 N ATOM 1425 CA LYS A 93 -15.831 10.050 18.093 1.00 0.00 C ATOM 1426 C LYS A 93 -16.036 9.899 19.593 1.00 0.00 C ATOM 1427 O LYS A 93 -15.087 9.620 20.326 1.00 0.00 O ATOM 1428 CB LYS A 93 -15.561 11.508 17.742 1.00 0.00 C ATOM 1429 CG LYS A 93 -14.195 12.007 18.177 1.00 0.00 C ATOM 1430 CD LYS A 93 -13.825 13.293 17.454 1.00 0.00 C ATOM 1431 CE LYS A 93 -13.636 13.058 15.960 1.00 0.00 C ATOM 1432 NZ LYS A 93 -12.514 12.120 15.686 1.00 0.00 N ATOM 0 H LYS A 93 -17.198 10.190 16.535 1.00 0.00 H new ATOM 0 HA LYS A 93 -14.972 9.429 17.838 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -15.656 11.635 16.664 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.327 12.130 18.204 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -14.193 12.178 19.253 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -13.444 11.243 17.974 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -14.606 14.037 17.611 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -12.907 13.699 17.879 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -14.557 12.657 15.536 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -13.444 14.009 15.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -12.239 12.191 14.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -11.701 12.366 16.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -12.816 11.147 15.894 1.00 0.00 H new ATOM 1446 N ASP A 94 -17.261 10.094 20.055 1.00 0.00 N ATOM 1447 CA ASP A 94 -17.540 9.985 21.478 1.00 0.00 C ATOM 1448 C ASP A 94 -17.925 8.559 21.868 1.00 0.00 C ATOM 1449 O ASP A 94 -17.789 8.177 23.032 1.00 0.00 O ATOM 1450 CB ASP A 94 -18.653 10.966 21.858 1.00 0.00 C ATOM 1451 CG ASP A 94 -19.061 10.868 23.317 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -19.609 9.819 23.716 1.00 0.00 O ATOM 1453 OD2 ASP A 94 -18.831 11.844 24.062 1.00 0.00 O ATOM 0 H ASP A 94 -18.068 10.325 19.475 1.00 0.00 H new ATOM 0 HA ASP A 94 -16.632 10.236 22.026 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -18.321 11.983 21.647 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -19.524 10.779 21.230 1.00 0.00 H new ATOM 1458 N GLY A 95 -18.405 7.773 20.903 1.00 0.00 N ATOM 1459 CA GLY A 95 -18.800 6.419 21.202 1.00 0.00 C ATOM 1460 C GLY A 95 -19.771 6.398 22.356 1.00 0.00 C ATOM 1461 O GLY A 95 -19.446 5.990 23.470 1.00 0.00 O ATOM 0 H GLY A 95 -18.524 8.054 19.930 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -19.259 5.965 20.324 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -17.921 5.823 21.447 1.00 0.00 H new ATOM 1465 N SER A 96 -20.982 6.818 22.045 1.00 0.00 N ATOM 1466 CA SER A 96 -22.081 6.848 22.990 1.00 0.00 C ATOM 1467 C SER A 96 -23.188 6.006 22.401 1.00 0.00 C ATOM 1468 O SER A 96 -24.215 5.742 23.024 1.00 0.00 O ATOM 1469 CB SER A 96 -22.553 8.284 23.229 1.00 0.00 C ATOM 1470 OG SER A 96 -22.912 8.911 22.012 1.00 0.00 O ATOM 0 H SER A 96 -21.234 7.153 21.115 1.00 0.00 H new ATOM 0 HA SER A 96 -21.771 6.454 23.958 1.00 0.00 H new ATOM 0 HB2 SER A 96 -23.407 8.282 23.906 1.00 0.00 H new ATOM 0 HB3 SER A 96 -21.762 8.854 23.716 1.00 0.00 H new ATOM 0 HG SER A 96 -23.886 9.012 21.971 1.00 0.00 H new ATOM 1476 N GLY A 97 -22.919 5.575 21.175 1.00 0.00 N ATOM 1477 CA GLY A 97 -23.822 4.739 20.439 1.00 0.00 C ATOM 1478 C GLY A 97 -24.469 5.452 19.274 1.00 0.00 C ATOM 1479 O GLY A 97 -25.110 4.826 18.440 1.00 0.00 O ATOM 0 H GLY A 97 -22.061 5.804 20.673 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -23.282 3.867 20.070 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -24.599 4.373 21.110 1.00 0.00 H new ATOM 1483 N TYR A 98 -24.287 6.759 19.208 1.00 0.00 N ATOM 1484 CA TYR A 98 -24.853 7.550 18.120 1.00 0.00 C ATOM 1485 C TYR A 98 -23.916 8.666 17.664 1.00 0.00 C ATOM 1486 O TYR A 98 -23.015 9.087 18.389 1.00 0.00 O ATOM 1487 CB TYR A 98 -26.223 8.121 18.493 1.00 0.00 C ATOM 1488 CG TYR A 98 -26.492 8.202 19.975 1.00 0.00 C ATOM 1489 CD1 TYR A 98 -25.691 8.962 20.817 1.00 0.00 C ATOM 1490 CD2 TYR A 98 -27.564 7.517 20.530 1.00 0.00 C ATOM 1491 CE1 TYR A 98 -25.951 9.034 22.173 1.00 0.00 C ATOM 1492 CE2 TYR A 98 -27.832 7.583 21.880 1.00 0.00 C ATOM 1493 CZ TYR A 98 -27.023 8.342 22.699 1.00 0.00 C ATOM 1494 OH TYR A 98 -27.286 8.410 24.047 1.00 0.00 O ATOM 0 H TYR A 98 -23.754 7.297 19.891 1.00 0.00 H new ATOM 0 HA TYR A 98 -24.982 6.867 17.281 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -26.313 9.120 18.066 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -26.995 7.506 18.031 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -24.852 9.505 20.407 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -28.200 6.921 19.892 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -25.319 9.628 22.817 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -28.671 7.043 22.294 1.00 0.00 H new ATOM 0 HH TYR A 98 -28.075 7.867 24.254 1.00 0.00 H new ATOM 1504 N ILE A 99 -24.147 9.119 16.436 1.00 0.00 N ATOM 1505 CA ILE A 99 -23.357 10.167 15.811 1.00 0.00 C ATOM 1506 C ILE A 99 -24.258 11.226 15.198 1.00 0.00 C ATOM 1507 O ILE A 99 -24.822 11.012 14.128 1.00 0.00 O ATOM 1508 CB ILE A 99 -22.488 9.585 14.683 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -21.553 8.520 15.214 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -21.703 10.676 13.979 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -20.855 7.762 14.107 1.00 0.00 C ATOM 0 H ILE A 99 -24.897 8.763 15.843 1.00 0.00 H new ATOM 0 HA ILE A 99 -22.730 10.608 16.586 1.00 0.00 H new ATOM 0 HB ILE A 99 -23.156 9.124 13.956 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -20.807 8.984 15.859 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -22.117 7.820 15.831 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -21.098 10.235 13.187 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -22.394 11.401 13.548 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -21.053 11.177 14.696 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -20.196 7.010 14.541 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -21.598 7.274 13.476 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -20.268 8.456 13.505 1.00 0.00 H new ATOM 1523 N THR A 100 -24.377 12.373 15.839 1.00 0.00 N ATOM 1524 CA THR A 100 -25.195 13.430 15.295 1.00 0.00 C ATOM 1525 C THR A 100 -24.523 13.972 14.046 1.00 0.00 C ATOM 1526 O THR A 100 -23.296 13.970 13.958 1.00 0.00 O ATOM 1527 CB THR A 100 -25.381 14.536 16.331 1.00 0.00 C ATOM 1528 OG1 THR A 100 -24.153 15.195 16.590 1.00 0.00 O ATOM 1529 CG2 THR A 100 -25.904 14.016 17.653 1.00 0.00 C ATOM 0 H THR A 100 -23.922 12.592 16.726 1.00 0.00 H new ATOM 0 HA THR A 100 -26.180 13.043 15.036 1.00 0.00 H new ATOM 0 HB THR A 100 -26.112 15.222 15.902 1.00 0.00 H new ATOM 0 HG1 THR A 100 -24.294 15.901 17.255 1.00 0.00 H new ATOM 0 HG21 THR A 100 -26.017 14.845 18.351 1.00 0.00 H new ATOM 0 HG22 THR A 100 -26.871 13.537 17.499 1.00 0.00 H new ATOM 0 HG23 THR A 100 -25.201 13.290 18.062 1.00 0.00 H new ATOM 1537 N LEU A 101 -25.321 14.409 13.079 1.00 0.00 N ATOM 1538 CA LEU A 101 -24.796 14.937 11.827 1.00 0.00 C ATOM 1539 C LEU A 101 -23.491 15.709 12.033 1.00 0.00 C ATOM 1540 O LEU A 101 -22.601 15.655 11.193 1.00 0.00 O ATOM 1541 CB LEU A 101 -25.832 15.861 11.200 1.00 0.00 C ATOM 1542 CG LEU A 101 -26.460 16.855 12.177 1.00 0.00 C ATOM 1543 CD1 LEU A 101 -26.795 18.159 11.471 1.00 0.00 C ATOM 1544 CD2 LEU A 101 -27.711 16.259 12.807 1.00 0.00 C ATOM 0 H LEU A 101 -26.339 14.408 13.139 1.00 0.00 H new ATOM 0 HA LEU A 101 -24.584 14.093 11.170 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -25.363 16.415 10.387 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -26.623 15.255 10.758 1.00 0.00 H new ATOM 0 HG LEU A 101 -25.738 17.065 12.966 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -27.241 18.854 12.183 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -25.884 18.595 11.060 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -27.500 17.965 10.663 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -28.147 16.978 13.500 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -28.434 16.023 12.026 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -27.449 15.349 13.346 1.00 0.00 H new ATOM 1556 N ASP A 102 -23.375 16.416 13.153 1.00 0.00 N ATOM 1557 CA ASP A 102 -22.167 17.184 13.448 1.00 0.00 C ATOM 1558 C ASP A 102 -20.931 16.286 13.440 1.00 0.00 C ATOM 1559 O ASP A 102 -19.950 16.575 12.757 1.00 0.00 O ATOM 1560 CB ASP A 102 -22.295 17.885 14.802 1.00 0.00 C ATOM 1561 CG ASP A 102 -23.464 18.853 14.850 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -24.170 18.985 13.828 1.00 0.00 O ATOM 1563 OD2 ASP A 102 -23.672 19.479 15.910 1.00 0.00 O ATOM 0 H ASP A 102 -24.099 16.474 13.869 1.00 0.00 H new ATOM 0 HA ASP A 102 -22.051 17.937 12.669 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -22.416 17.136 15.585 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -21.372 18.424 15.016 1.00 0.00 H new ATOM 1568 N GLU A 103 -20.987 15.201 14.207 1.00 0.00 N ATOM 1569 CA GLU A 103 -19.874 14.260 14.292 1.00 0.00 C ATOM 1570 C GLU A 103 -19.540 13.655 12.930 1.00 0.00 C ATOM 1571 O GLU A 103 -18.383 13.333 12.658 1.00 0.00 O ATOM 1572 CB GLU A 103 -20.189 13.161 15.303 1.00 0.00 C ATOM 1573 CG GLU A 103 -20.196 13.642 16.744 1.00 0.00 C ATOM 1574 CD GLU A 103 -20.518 12.536 17.731 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -20.759 11.394 17.287 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -20.532 12.813 18.949 1.00 0.00 O ATOM 0 H GLU A 103 -21.793 14.951 14.780 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.996 14.812 14.628 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -21.163 12.731 15.068 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -19.454 12.362 15.199 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -19.221 14.066 16.986 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.927 14.443 16.851 1.00 0.00 H new ATOM 1583 N ILE A 104 -20.545 13.516 12.066 1.00 0.00 N ATOM 1584 CA ILE A 104 -20.318 12.964 10.731 1.00 0.00 C ATOM 1585 C ILE A 104 -19.653 13.998 9.840 1.00 0.00 C ATOM 1586 O ILE A 104 -18.545 13.793 9.346 1.00 0.00 O ATOM 1587 CB ILE A 104 -21.622 12.526 10.042 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -22.327 11.428 10.836 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -21.315 12.047 8.628 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -23.741 11.166 10.368 1.00 0.00 C ATOM 0 H ILE A 104 -21.512 13.774 12.263 1.00 0.00 H new ATOM 0 HA ILE A 104 -19.680 12.091 10.868 1.00 0.00 H new ATOM 0 HB ILE A 104 -22.294 13.383 9.996 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -21.750 10.506 10.760 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -22.346 11.706 11.890 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -22.239 11.737 8.140 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -20.859 12.858 8.060 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -20.627 11.203 8.671 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -24.184 10.375 10.974 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -24.332 12.076 10.470 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -23.727 10.858 9.323 1.00 0.00 H new ATOM 1602 N GLN A 105 -20.354 15.108 9.632 1.00 0.00 N ATOM 1603 CA GLN A 105 -19.855 16.185 8.797 1.00 0.00 C ATOM 1604 C GLN A 105 -18.459 16.579 9.248 1.00 0.00 C ATOM 1605 O GLN A 105 -17.639 17.018 8.451 1.00 0.00 O ATOM 1606 CB GLN A 105 -20.795 17.389 8.862 1.00 0.00 C ATOM 1607 CG GLN A 105 -22.279 17.051 8.686 1.00 0.00 C ATOM 1608 CD GLN A 105 -22.532 15.911 7.711 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -22.140 14.775 7.957 1.00 0.00 O ATOM 1610 NE2 GLN A 105 -23.217 16.194 6.613 1.00 0.00 N ATOM 0 H GLN A 105 -21.275 15.282 10.035 1.00 0.00 H new ATOM 0 HA GLN A 105 -19.810 15.841 7.764 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -20.661 17.886 9.823 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -20.504 18.102 8.090 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -22.701 16.789 9.656 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -22.807 17.939 8.339 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -23.528 17.149 6.438 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -23.433 15.456 5.942 1.00 0.00 H new ATOM 1619 N GLN A 106 -18.189 16.398 10.532 1.00 0.00 N ATOM 1620 CA GLN A 106 -16.881 16.712 11.076 1.00 0.00 C ATOM 1621 C GLN A 106 -15.825 15.808 10.445 1.00 0.00 C ATOM 1622 O GLN A 106 -14.740 16.261 10.080 1.00 0.00 O ATOM 1623 CB GLN A 106 -16.881 16.533 12.594 1.00 0.00 C ATOM 1624 CG GLN A 106 -15.556 16.891 13.245 1.00 0.00 C ATOM 1625 CD GLN A 106 -15.586 16.742 14.754 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -14.711 15.894 15.282 1.00 0.00 O flip ATOM 1627 NE2 GLN A 106 -16.385 17.383 15.437 1.00 0.00 N flip ATOM 0 H GLN A 106 -18.857 16.037 11.213 1.00 0.00 H new ATOM 0 HA GLN A 106 -16.646 17.751 10.846 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -17.668 17.152 13.025 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -17.125 15.497 12.830 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -14.771 16.254 12.837 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -15.297 17.919 12.991 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -17.040 18.024 14.989 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -16.392 17.273 16.451 1.00 0.00 H new ATOM 1636 N ALA A 107 -16.163 14.522 10.316 1.00 0.00 N ATOM 1637 CA ALA A 107 -15.259 13.538 9.724 1.00 0.00 C ATOM 1638 C ALA A 107 -14.714 14.031 8.394 1.00 0.00 C ATOM 1639 O ALA A 107 -13.513 14.264 8.262 1.00 0.00 O ATOM 1640 CB ALA A 107 -15.976 12.212 9.524 1.00 0.00 C ATOM 0 H ALA A 107 -17.060 14.139 10.615 1.00 0.00 H new ATOM 0 HA ALA A 107 -14.425 13.395 10.410 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -15.289 11.490 9.082 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -16.326 11.839 10.487 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -16.828 12.356 8.860 1.00 0.00 H new ATOM 1646 N CYS A 108 -15.610 14.170 7.411 1.00 0.00 N ATOM 1647 CA CYS A 108 -15.229 14.626 6.075 1.00 0.00 C ATOM 1648 C CYS A 108 -14.092 15.640 6.184 1.00 0.00 C ATOM 1649 O CYS A 108 -14.240 16.676 6.811 1.00 0.00 O ATOM 1650 CB CYS A 108 -16.459 15.200 5.367 1.00 0.00 C ATOM 1651 SG CYS A 108 -16.916 16.870 5.856 1.00 0.00 S ATOM 0 H CYS A 108 -16.605 13.972 7.518 1.00 0.00 H new ATOM 0 HA CYS A 108 -14.863 13.792 5.476 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -16.277 15.190 4.292 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -17.306 14.540 5.553 1.00 0.00 H new ATOM 0 HG CYS A 108 -17.090 16.913 7.144 1.00 0.00 H new ATOM 1657 N LYS A 109 -12.924 15.289 5.640 1.00 0.00 N ATOM 1658 CA LYS A 109 -11.736 16.143 5.743 1.00 0.00 C ATOM 1659 C LYS A 109 -11.628 17.165 4.614 1.00 0.00 C ATOM 1660 O LYS A 109 -11.566 18.369 4.866 1.00 0.00 O ATOM 1661 CB LYS A 109 -10.469 15.286 5.781 1.00 0.00 C ATOM 1662 CG LYS A 109 -9.190 16.101 5.904 1.00 0.00 C ATOM 1663 CD LYS A 109 -7.955 15.214 5.966 1.00 0.00 C ATOM 1664 CE LYS A 109 -7.943 14.351 7.219 1.00 0.00 C ATOM 1665 NZ LYS A 109 -7.923 15.173 8.462 1.00 0.00 N ATOM 0 H LYS A 109 -12.775 14.422 5.125 1.00 0.00 H new ATOM 0 HA LYS A 109 -11.841 16.703 6.672 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -10.532 14.595 6.621 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -10.420 14.683 4.875 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -9.108 16.778 5.054 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -9.238 16.719 6.801 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.922 14.575 5.084 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -7.060 15.835 5.944 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -8.822 13.707 7.224 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -7.070 13.698 7.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -7.678 14.570 9.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -7.215 15.929 8.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -8.861 15.594 8.615 1.00 0.00 H new ATOM 1679 N ASP A 110 -11.584 16.686 3.374 1.00 0.00 N ATOM 1680 CA ASP A 110 -11.462 17.569 2.217 1.00 0.00 C ATOM 1681 C ASP A 110 -12.591 18.586 2.216 1.00 0.00 C ATOM 1682 O ASP A 110 -12.544 19.596 1.516 1.00 0.00 O ATOM 1683 CB ASP A 110 -11.475 16.747 0.923 1.00 0.00 C ATOM 1684 CG ASP A 110 -11.238 17.588 -0.318 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -12.096 18.436 -0.639 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -10.190 17.397 -0.971 1.00 0.00 O ATOM 0 H ASP A 110 -11.631 15.693 3.144 1.00 0.00 H new ATOM 0 HA ASP A 110 -10.514 18.104 2.277 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -10.709 15.974 0.983 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -12.435 16.238 0.832 1.00 0.00 H new ATOM 1691 N PHE A 111 -13.604 18.299 3.016 1.00 0.00 N ATOM 1692 CA PHE A 111 -14.762 19.160 3.136 1.00 0.00 C ATOM 1693 C PHE A 111 -14.809 19.790 4.528 1.00 0.00 C ATOM 1694 O PHE A 111 -15.005 20.995 4.690 1.00 0.00 O ATOM 1695 CB PHE A 111 -16.034 18.327 2.898 1.00 0.00 C ATOM 1696 CG PHE A 111 -15.836 17.126 2.010 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -15.389 15.930 2.541 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -16.122 17.185 0.656 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -15.224 14.816 1.749 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -15.959 16.072 -0.148 1.00 0.00 C ATOM 1701 CZ PHE A 111 -15.510 14.884 0.399 1.00 0.00 C ATOM 0 H PHE A 111 -13.644 17.463 3.599 1.00 0.00 H new ATOM 0 HA PHE A 111 -14.699 19.957 2.395 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -16.419 17.992 3.861 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -16.796 18.969 2.456 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -15.165 15.869 3.596 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -16.476 18.109 0.224 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -14.872 13.891 2.182 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -16.182 16.130 -1.203 1.00 0.00 H new ATOM 0 HZ PHE A 111 -15.383 14.013 -0.227 1.00 0.00 H new ATOM 1711 N GLY A 112 -14.668 18.923 5.516 1.00 0.00 N ATOM 1712 CA GLY A 112 -14.727 19.292 6.924 1.00 0.00 C ATOM 1713 C GLY A 112 -16.162 19.445 7.364 1.00 0.00 C ATOM 1714 O GLY A 112 -16.491 19.268 8.537 1.00 0.00 O ATOM 0 H GLY A 112 -14.507 17.928 5.362 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -14.233 18.531 7.528 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -14.188 20.226 7.085 1.00 0.00 H new ATOM 1718 N LEU A 113 -17.020 19.677 6.376 1.00 0.00 N ATOM 1719 CA LEU A 113 -18.457 19.752 6.559 1.00 0.00 C ATOM 1720 C LEU A 113 -19.097 20.122 5.209 1.00 0.00 C ATOM 1721 O LEU A 113 -19.806 21.114 5.089 1.00 0.00 O ATOM 1722 CB LEU A 113 -18.840 20.667 7.748 1.00 0.00 C ATOM 1723 CG LEU A 113 -18.866 22.184 7.538 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -17.852 22.634 6.496 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -20.279 22.619 7.189 1.00 0.00 C ATOM 0 H LEU A 113 -16.726 19.820 5.410 1.00 0.00 H new ATOM 0 HA LEU A 113 -18.864 18.784 6.851 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -19.830 20.365 8.090 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -18.144 20.459 8.561 1.00 0.00 H new ATOM 0 HG LEU A 113 -18.571 22.672 8.467 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -17.906 23.716 6.380 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -16.850 22.353 6.819 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -18.074 22.155 5.542 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -20.301 23.698 7.039 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -20.598 22.119 6.275 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -20.953 22.352 8.003 1.00 0.00 H new ATOM 1737 N ASP A 114 -18.782 19.346 4.170 1.00 0.00 N ATOM 1738 CA ASP A 114 -19.268 19.628 2.812 1.00 0.00 C ATOM 1739 C ASP A 114 -20.666 20.238 2.814 1.00 0.00 C ATOM 1740 O ASP A 114 -21.657 19.540 2.946 1.00 0.00 O ATOM 1741 CB ASP A 114 -19.261 18.353 1.966 1.00 0.00 C ATOM 1742 CG ASP A 114 -19.467 18.637 0.489 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -19.662 19.818 0.131 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -19.430 17.678 -0.310 1.00 0.00 O ATOM 0 H ASP A 114 -18.193 18.517 4.240 1.00 0.00 H new ATOM 0 HA ASP A 114 -18.588 20.360 2.376 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -18.313 17.834 2.104 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -20.046 17.683 2.317 1.00 0.00 H new ATOM 1749 N ASP A 115 -20.731 21.557 2.659 1.00 0.00 N ATOM 1750 CA ASP A 115 -22.007 22.264 2.645 1.00 0.00 C ATOM 1751 C ASP A 115 -22.929 21.733 1.550 1.00 0.00 C ATOM 1752 O ASP A 115 -24.138 21.966 1.578 1.00 0.00 O ATOM 1753 CB ASP A 115 -21.777 23.763 2.447 1.00 0.00 C ATOM 1754 CG ASP A 115 -20.926 24.369 3.546 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -19.767 23.934 3.708 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -21.419 25.279 4.245 1.00 0.00 O ATOM 0 H ASP A 115 -19.915 22.158 2.541 1.00 0.00 H new ATOM 0 HA ASP A 115 -22.491 22.094 3.607 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -21.294 23.929 1.484 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -22.739 24.274 2.413 1.00 0.00 H new ATOM 1761 N ILE A 116 -22.353 21.028 0.581 1.00 0.00 N ATOM 1762 CA ILE A 116 -23.125 20.477 -0.525 1.00 0.00 C ATOM 1763 C ILE A 116 -23.588 19.050 -0.238 1.00 0.00 C ATOM 1764 O ILE A 116 -24.760 18.720 -0.421 1.00 0.00 O ATOM 1765 CB ILE A 116 -22.307 20.482 -1.833 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -21.756 21.883 -2.113 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -23.159 19.997 -2.998 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -22.829 22.946 -2.264 1.00 0.00 C ATOM 0 H ILE A 116 -21.354 20.825 0.540 1.00 0.00 H new ATOM 0 HA ILE A 116 -24.000 21.116 -0.640 1.00 0.00 H new ATOM 0 HB ILE A 116 -21.466 19.798 -1.718 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -21.087 22.169 -1.301 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -21.158 21.852 -3.024 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -22.565 20.007 -3.912 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -23.502 18.982 -2.800 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -24.020 20.654 -3.117 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -22.361 23.910 -2.460 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -23.485 22.685 -3.095 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -23.413 23.007 -1.346 1.00 0.00 H new ATOM 1780 N HIS A 117 -22.659 18.202 0.195 1.00 0.00 N ATOM 1781 CA HIS A 117 -22.974 16.807 0.484 1.00 0.00 C ATOM 1782 C HIS A 117 -23.660 16.660 1.832 1.00 0.00 C ATOM 1783 O HIS A 117 -24.564 15.843 1.981 1.00 0.00 O ATOM 1784 CB HIS A 117 -21.704 15.956 0.459 1.00 0.00 C ATOM 1785 CG HIS A 117 -21.968 14.486 0.340 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -20.973 13.535 0.420 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -23.120 13.804 0.128 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -21.500 12.333 0.263 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -22.801 12.469 0.084 1.00 0.00 N ATOM 0 H HIS A 117 -21.684 18.456 0.353 1.00 0.00 H new ATOM 0 HA HIS A 117 -23.658 16.459 -0.290 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -21.081 16.273 -0.377 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -21.135 16.142 1.370 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -24.105 14.231 0.015 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -20.959 11.399 0.279 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -23.462 11.706 -0.063 1.00 0.00 H new ATOM 1798 N ILE A 118 -23.208 17.439 2.806 1.00 0.00 N ATOM 1799 CA ILE A 118 -23.754 17.391 4.160 1.00 0.00 C ATOM 1800 C ILE A 118 -25.254 17.139 4.207 1.00 0.00 C ATOM 1801 O ILE A 118 -25.704 16.172 4.802 1.00 0.00 O ATOM 1802 CB ILE A 118 -23.485 18.702 4.936 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -22.101 18.670 5.582 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -24.565 18.941 5.990 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -21.877 19.796 6.560 1.00 0.00 C ATOM 0 H ILE A 118 -22.457 18.119 2.683 1.00 0.00 H new ATOM 0 HA ILE A 118 -23.239 16.550 4.624 1.00 0.00 H new ATOM 0 HB ILE A 118 -23.514 19.529 4.226 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -21.969 17.718 6.097 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -21.341 18.718 4.802 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -24.355 19.868 6.523 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -25.538 19.014 5.504 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -24.574 18.111 6.696 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -20.876 19.716 6.984 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -21.978 20.751 6.045 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -22.615 19.736 7.360 1.00 0.00 H new ATOM 1817 N ASP A 119 -26.019 18.039 3.627 1.00 0.00 N ATOM 1818 CA ASP A 119 -27.474 17.936 3.655 1.00 0.00 C ATOM 1819 C ASP A 119 -27.938 16.545 3.269 1.00 0.00 C ATOM 1820 O ASP A 119 -28.587 15.854 4.055 1.00 0.00 O ATOM 1821 CB ASP A 119 -28.090 18.985 2.741 1.00 0.00 C ATOM 1822 CG ASP A 119 -29.609 18.980 2.770 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -30.190 18.184 3.539 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -30.217 19.779 2.027 1.00 0.00 O ATOM 0 H ASP A 119 -25.663 18.854 3.128 1.00 0.00 H new ATOM 0 HA ASP A 119 -27.808 18.120 4.676 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -27.730 19.971 3.034 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -27.751 18.813 1.719 1.00 0.00 H new ATOM 1829 N ASP A 120 -27.599 16.135 2.063 1.00 0.00 N ATOM 1830 CA ASP A 120 -27.976 14.822 1.584 1.00 0.00 C ATOM 1831 C ASP A 120 -27.244 13.737 2.362 1.00 0.00 C ATOM 1832 O ASP A 120 -27.641 12.585 2.315 1.00 0.00 O ATOM 1833 CB ASP A 120 -27.671 14.691 0.092 1.00 0.00 C ATOM 1834 CG ASP A 120 -28.442 15.691 -0.746 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -29.690 15.656 -0.712 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -27.798 16.511 -1.434 1.00 0.00 O ATOM 0 H ASP A 120 -27.063 16.693 1.398 1.00 0.00 H new ATOM 0 HA ASP A 120 -29.048 14.698 1.737 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -26.603 14.832 -0.071 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -27.914 13.681 -0.238 1.00 0.00 H new ATOM 1841 N MET A 121 -26.168 14.122 3.059 1.00 0.00 N ATOM 1842 CA MET A 121 -25.342 13.211 3.832 1.00 0.00 C ATOM 1843 C MET A 121 -25.984 12.830 5.152 1.00 0.00 C ATOM 1844 O MET A 121 -26.145 11.652 5.463 1.00 0.00 O ATOM 1845 CB MET A 121 -24.018 13.889 4.090 1.00 0.00 C ATOM 1846 CG MET A 121 -22.865 13.155 3.473 1.00 0.00 C ATOM 1847 SD MET A 121 -21.261 13.798 3.977 1.00 0.00 S ATOM 1848 CE MET A 121 -21.256 13.338 5.707 1.00 0.00 C ATOM 0 H MET A 121 -25.849 15.090 3.097 1.00 0.00 H new ATOM 0 HA MET A 121 -25.214 12.290 3.264 1.00 0.00 H new ATOM 0 HB2 MET A 121 -24.051 14.904 3.695 1.00 0.00 H new ATOM 0 HB3 MET A 121 -23.859 13.970 5.165 1.00 0.00 H new ATOM 0 HG2 MET A 121 -22.928 12.101 3.743 1.00 0.00 H new ATOM 0 HG3 MET A 121 -22.947 13.211 2.387 1.00 0.00 H new ATOM 0 HE1 MET A 121 -20.667 14.059 6.274 1.00 0.00 H new ATOM 0 HE2 MET A 121 -22.279 13.328 6.084 1.00 0.00 H new ATOM 0 HE3 MET A 121 -20.819 12.346 5.818 1.00 0.00 H new ATOM 1858 N ILE A 122 -26.370 13.844 5.904 1.00 0.00 N ATOM 1859 CA ILE A 122 -27.041 13.655 7.173 1.00 0.00 C ATOM 1860 C ILE A 122 -28.169 12.693 6.931 1.00 0.00 C ATOM 1861 O ILE A 122 -28.443 11.796 7.723 1.00 0.00 O ATOM 1862 CB ILE A 122 -27.607 15.005 7.628 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -26.506 16.054 7.628 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -28.253 14.909 8.992 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -26.988 17.450 7.961 1.00 0.00 C ATOM 0 H ILE A 122 -26.226 14.822 5.651 1.00 0.00 H new ATOM 0 HA ILE A 122 -26.364 13.273 7.937 1.00 0.00 H new ATOM 0 HB ILE A 122 -28.383 15.301 6.923 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -25.741 15.763 8.348 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -26.032 16.069 6.647 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -28.642 15.886 9.280 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -29.070 14.189 8.958 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -27.513 14.584 9.723 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -26.145 18.141 7.941 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -27.731 17.763 7.228 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -27.436 17.453 8.955 1.00 0.00 H new ATOM 1877 N LYS A 123 -28.788 12.895 5.786 1.00 0.00 N ATOM 1878 CA LYS A 123 -29.883 12.062 5.336 1.00 0.00 C ATOM 1879 C LYS A 123 -29.362 10.830 4.582 1.00 0.00 C ATOM 1880 O LYS A 123 -30.081 9.845 4.410 1.00 0.00 O ATOM 1881 CB LYS A 123 -30.806 12.875 4.431 1.00 0.00 C ATOM 1882 CG LYS A 123 -31.519 14.035 5.122 1.00 0.00 C ATOM 1883 CD LYS A 123 -32.481 13.562 6.204 1.00 0.00 C ATOM 1884 CE LYS A 123 -31.787 13.401 7.548 1.00 0.00 C ATOM 1885 NZ LYS A 123 -31.236 14.692 8.044 1.00 0.00 N ATOM 0 H LYS A 123 -28.544 13.645 5.139 1.00 0.00 H new ATOM 0 HA LYS A 123 -30.438 11.717 6.209 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -30.222 13.269 3.600 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -31.555 12.207 4.006 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -30.779 14.702 5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -32.068 14.615 4.380 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -33.299 14.276 6.301 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -32.922 12.611 5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -32.494 13.004 8.277 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -30.981 12.673 7.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -31.081 14.632 9.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -30.333 14.890 7.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -31.909 15.458 7.840 1.00 0.00 H new ATOM 1899 N GLU A 124 -28.110 10.906 4.118 1.00 0.00 N ATOM 1900 CA GLU A 124 -27.481 9.816 3.359 1.00 0.00 C ATOM 1901 C GLU A 124 -26.982 8.697 4.262 1.00 0.00 C ATOM 1902 O GLU A 124 -26.716 7.589 3.796 1.00 0.00 O ATOM 1903 CB GLU A 124 -26.294 10.328 2.535 1.00 0.00 C ATOM 1904 CG GLU A 124 -25.602 9.252 1.712 1.00 0.00 C ATOM 1905 CD GLU A 124 -26.512 8.643 0.664 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -26.982 9.388 -0.221 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -26.753 7.419 0.727 1.00 0.00 O ATOM 0 H GLU A 124 -27.507 11.717 4.256 1.00 0.00 H new ATOM 0 HA GLU A 124 -28.257 9.424 2.701 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -26.642 11.115 1.866 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -25.566 10.781 3.208 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -24.727 9.680 1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -25.243 8.466 2.377 1.00 0.00 H new ATOM 1914 N ILE A 125 -26.826 8.987 5.544 1.00 0.00 N ATOM 1915 CA ILE A 125 -26.322 7.997 6.469 1.00 0.00 C ATOM 1916 C ILE A 125 -27.385 7.650 7.497 1.00 0.00 C ATOM 1917 O ILE A 125 -27.466 6.517 7.958 1.00 0.00 O ATOM 1918 CB ILE A 125 -25.046 8.523 7.154 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -24.127 9.166 6.114 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -24.318 7.394 7.860 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -22.871 9.775 6.701 1.00 0.00 C ATOM 0 H ILE A 125 -27.040 9.893 5.961 1.00 0.00 H new ATOM 0 HA ILE A 125 -26.071 7.089 5.921 1.00 0.00 H new ATOM 0 HB ILE A 125 -25.330 9.270 7.895 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -23.845 8.414 5.378 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -24.681 9.940 5.583 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -23.419 7.783 8.338 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -24.971 6.957 8.616 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -24.040 6.630 7.134 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -22.271 10.211 5.903 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -23.143 10.552 7.416 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -22.294 9.001 7.208 1.00 0.00 H new ATOM 1933 N ASP A 126 -28.203 8.638 7.842 1.00 0.00 N ATOM 1934 CA ASP A 126 -29.280 8.466 8.815 1.00 0.00 C ATOM 1935 C ASP A 126 -30.324 7.457 8.348 1.00 0.00 C ATOM 1936 O ASP A 126 -31.053 7.705 7.386 1.00 0.00 O ATOM 1937 CB ASP A 126 -29.960 9.805 9.051 1.00 0.00 C ATOM 1938 CG ASP A 126 -31.239 9.671 9.845 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -31.361 8.692 10.607 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -32.107 10.557 9.720 1.00 0.00 O ATOM 0 H ASP A 126 -28.140 9.580 7.457 1.00 0.00 H new ATOM 0 HA ASP A 126 -28.835 8.087 9.735 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -29.276 10.469 9.580 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -30.179 10.272 8.091 1.00 0.00 H new ATOM 1945 N GLN A 127 -30.400 6.324 9.038 1.00 0.00 N ATOM 1946 CA GLN A 127 -31.367 5.288 8.695 1.00 0.00 C ATOM 1947 C GLN A 127 -32.718 5.449 9.398 1.00 0.00 C ATOM 1948 O GLN A 127 -33.647 4.704 9.085 1.00 0.00 O ATOM 1949 CB GLN A 127 -30.820 3.890 9.009 1.00 0.00 C ATOM 1950 CG GLN A 127 -29.816 3.374 7.993 1.00 0.00 C ATOM 1951 CD GLN A 127 -28.437 3.971 8.166 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -28.199 4.608 9.308 1.00 0.00 O flip ATOM 1953 NE2 GLN A 127 -27.586 3.843 7.291 1.00 0.00 N flip ATOM 0 H GLN A 127 -29.805 6.100 9.836 1.00 0.00 H new ATOM 0 HA GLN A 127 -31.531 5.402 7.623 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -30.349 3.908 9.992 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -31.654 3.190 9.068 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -29.749 2.289 8.076 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -30.178 3.595 6.989 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -27.811 3.346 6.429 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -26.653 4.233 7.426 1.00 0.00 H new ATOM 1962 N ASP A 128 -32.850 6.355 10.380 1.00 0.00 N ATOM 1963 CA ASP A 128 -34.136 6.437 11.078 1.00 0.00 C ATOM 1964 C ASP A 128 -34.729 7.844 11.293 1.00 0.00 C ATOM 1965 O ASP A 128 -35.954 7.967 11.306 1.00 0.00 O ATOM 1966 CB ASP A 128 -33.987 5.762 12.442 1.00 0.00 C ATOM 1967 CG ASP A 128 -32.901 6.400 13.290 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -32.322 7.416 12.855 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -32.628 5.885 14.392 1.00 0.00 O ATOM 0 H ASP A 128 -32.128 7.004 10.693 1.00 0.00 H new ATOM 0 HA ASP A 128 -34.843 5.940 10.413 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -34.937 5.813 12.975 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -33.758 4.706 12.298 1.00 0.00 H new ATOM 1974 N ASN A 129 -33.920 8.898 11.476 1.00 0.00 N ATOM 1975 CA ASN A 129 -34.531 10.223 11.703 1.00 0.00 C ATOM 1976 C ASN A 129 -33.582 11.416 11.872 1.00 0.00 C ATOM 1977 O ASN A 129 -33.555 12.333 11.052 1.00 0.00 O ATOM 1978 CB ASN A 129 -35.415 10.159 12.951 1.00 0.00 C ATOM 1979 CG ASN A 129 -35.743 11.534 13.501 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -35.076 11.902 14.593 1.00 0.00 O flip ATOM 1981 ND2 ASN A 129 -36.555 12.267 12.938 1.00 0.00 N flip ATOM 0 H ASN A 129 -32.900 8.871 11.473 1.00 0.00 H new ATOM 0 HA ASN A 129 -35.076 10.416 10.779 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -36.341 9.637 12.710 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -34.910 9.574 13.720 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -37.043 11.942 12.103 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -36.741 13.200 13.306 1.00 0.00 H new ATOM 1988 N ASP A 130 -32.925 11.447 13.027 1.00 0.00 N ATOM 1989 CA ASP A 130 -32.096 12.578 13.450 1.00 0.00 C ATOM 1990 C ASP A 130 -30.872 12.873 12.587 1.00 0.00 C ATOM 1991 O ASP A 130 -30.008 13.638 13.018 1.00 0.00 O ATOM 1992 CB ASP A 130 -31.635 12.329 14.889 1.00 0.00 C ATOM 1993 CG ASP A 130 -31.108 13.579 15.567 1.00 0.00 C ATOM 1994 OD1 ASP A 130 -31.215 14.672 14.972 1.00 0.00 O ATOM 1995 OD2 ASP A 130 -30.600 13.465 16.702 1.00 0.00 O ATOM 0 H ASP A 130 -32.951 10.684 13.703 1.00 0.00 H new ATOM 0 HA ASP A 130 -32.732 13.457 13.349 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -32.469 11.932 15.468 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -30.856 11.567 14.888 1.00 0.00 H new ATOM 2000 N GLY A 131 -30.761 12.311 11.389 1.00 0.00 N ATOM 2001 CA GLY A 131 -29.589 12.621 10.606 1.00 0.00 C ATOM 2002 C GLY A 131 -28.365 12.282 11.405 1.00 0.00 C ATOM 2003 O GLY A 131 -27.366 13.010 11.423 1.00 0.00 O ATOM 0 H GLY A 131 -31.433 11.673 10.962 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -29.599 12.056 9.674 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -29.583 13.678 10.338 1.00 0.00 H new ATOM 2007 N GLN A 132 -28.497 11.191 12.126 1.00 0.00 N ATOM 2008 CA GLN A 132 -27.486 10.711 13.006 1.00 0.00 C ATOM 2009 C GLN A 132 -27.217 9.266 12.724 1.00 0.00 C ATOM 2010 O GLN A 132 -27.993 8.610 12.029 1.00 0.00 O ATOM 2011 CB GLN A 132 -27.938 10.832 14.432 1.00 0.00 C ATOM 2012 CG GLN A 132 -28.923 9.751 14.827 1.00 0.00 C ATOM 2013 CD GLN A 132 -29.006 9.545 16.324 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -28.545 8.385 16.778 1.00 0.00 O flip ATOM 2015 NE2 GLN A 132 -29.460 10.417 17.064 1.00 0.00 N flip ATOM 0 H GLN A 132 -29.334 10.608 12.108 1.00 0.00 H new ATOM 0 HA GLN A 132 -26.585 11.304 12.850 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -27.070 10.784 15.089 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -28.398 11.809 14.581 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -29.911 10.010 14.446 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -28.635 8.813 14.352 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -29.803 11.293 16.670 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -29.493 10.264 18.072 1.00 0.00 H new ATOM 2024 N ILE A 133 -26.135 8.769 13.277 1.00 0.00 N ATOM 2025 CA ILE A 133 -25.772 7.405 13.084 1.00 0.00 C ATOM 2026 C ILE A 133 -25.572 6.698 14.399 1.00 0.00 C ATOM 2027 O ILE A 133 -24.778 7.097 15.236 1.00 0.00 O ATOM 2028 CB ILE A 133 -24.539 7.348 12.197 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -24.889 8.065 10.899 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -24.115 5.913 11.942 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -26.145 7.526 10.262 1.00 0.00 C ATOM 0 H ILE A 133 -25.494 9.301 13.866 1.00 0.00 H new ATOM 0 HA ILE A 133 -26.583 6.875 12.584 1.00 0.00 H new ATOM 0 HB ILE A 133 -23.692 7.834 12.682 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -25.014 9.129 11.098 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -24.060 7.967 10.199 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -23.231 5.903 11.305 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -23.885 5.428 12.890 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -24.925 5.377 11.447 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -26.349 8.072 9.341 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -26.013 6.468 10.035 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -26.983 7.648 10.949 1.00 0.00 H new ATOM 2043 N ASP A 134 -26.299 5.621 14.547 1.00 0.00 N ATOM 2044 CA ASP A 134 -26.240 4.804 15.744 1.00 0.00 C ATOM 2045 C ASP A 134 -25.425 3.561 15.458 1.00 0.00 C ATOM 2046 O ASP A 134 -25.270 3.172 14.309 1.00 0.00 O ATOM 2047 CB ASP A 134 -27.656 4.405 16.175 1.00 0.00 C ATOM 2048 CG ASP A 134 -27.688 3.593 17.456 1.00 0.00 C ATOM 2049 OD1 ASP A 134 -27.431 4.168 18.532 1.00 0.00 O ATOM 2050 OD2 ASP A 134 -27.973 2.379 17.382 1.00 0.00 O ATOM 0 H ASP A 134 -26.952 5.280 13.842 1.00 0.00 H new ATOM 0 HA ASP A 134 -25.773 5.372 16.548 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -28.255 5.306 16.309 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -28.122 3.829 15.376 1.00 0.00 H new ATOM 2055 N TYR A 135 -24.913 2.941 16.502 1.00 0.00 N ATOM 2056 CA TYR A 135 -24.122 1.734 16.343 1.00 0.00 C ATOM 2057 C TYR A 135 -24.847 0.757 15.428 1.00 0.00 C ATOM 2058 O TYR A 135 -24.224 -0.028 14.714 1.00 0.00 O ATOM 2059 CB TYR A 135 -23.834 1.131 17.710 1.00 0.00 C ATOM 2060 CG TYR A 135 -23.442 -0.332 17.691 1.00 0.00 C ATOM 2061 CD1 TYR A 135 -22.255 -0.749 17.092 1.00 0.00 C ATOM 2062 CD2 TYR A 135 -24.254 -1.294 18.278 1.00 0.00 C ATOM 2063 CE1 TYR A 135 -21.895 -2.083 17.080 1.00 0.00 C ATOM 2064 CE2 TYR A 135 -23.898 -2.630 18.268 1.00 0.00 C ATOM 2065 CZ TYR A 135 -22.719 -3.018 17.668 1.00 0.00 C ATOM 2066 OH TYR A 135 -22.362 -4.348 17.656 1.00 0.00 O ATOM 0 H TYR A 135 -25.029 3.250 17.467 1.00 0.00 H new ATOM 0 HA TYR A 135 -23.166 1.971 15.876 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -23.033 1.701 18.181 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -24.719 1.247 18.336 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -21.607 -0.019 16.630 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -25.178 -0.994 18.750 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -20.972 -2.392 16.612 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -24.541 -3.366 18.728 1.00 0.00 H new ATOM 0 HH TYR A 135 -23.050 -4.876 18.113 1.00 0.00 H new ATOM 2076 N GLY A 136 -26.173 0.854 15.420 1.00 0.00 N ATOM 2077 CA GLY A 136 -26.969 0.019 14.551 1.00 0.00 C ATOM 2078 C GLY A 136 -27.095 0.641 13.176 1.00 0.00 C ATOM 2079 O GLY A 136 -27.049 -0.056 12.162 1.00 0.00 O ATOM 0 H GLY A 136 -26.707 1.499 16.003 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -26.512 -0.967 14.469 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -27.960 -0.123 14.983 1.00 0.00 H new ATOM 2083 N GLU A 137 -27.227 1.968 13.143 1.00 0.00 N ATOM 2084 CA GLU A 137 -27.322 2.690 11.882 1.00 0.00 C ATOM 2085 C GLU A 137 -26.032 2.514 11.102 1.00 0.00 C ATOM 2086 O GLU A 137 -26.047 2.007 9.982 1.00 0.00 O ATOM 2087 CB GLU A 137 -27.598 4.171 12.118 1.00 0.00 C ATOM 2088 CG GLU A 137 -29.003 4.455 12.619 1.00 0.00 C ATOM 2089 CD GLU A 137 -29.266 5.935 12.816 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -28.645 6.536 13.717 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -30.087 6.496 12.061 1.00 0.00 O ATOM 0 H GLU A 137 -27.270 2.559 13.973 1.00 0.00 H new ATOM 0 HA GLU A 137 -28.154 2.283 11.308 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -26.879 4.555 12.841 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -27.436 4.715 11.187 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -29.726 4.053 11.909 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -29.160 3.933 13.563 1.00 0.00 H new ATOM 2098 N PHE A 138 -24.905 2.912 11.704 1.00 0.00 N ATOM 2099 CA PHE A 138 -23.614 2.752 11.047 1.00 0.00 C ATOM 2100 C PHE A 138 -23.437 1.308 10.591 1.00 0.00 C ATOM 2101 O PHE A 138 -22.600 1.007 9.740 1.00 0.00 O ATOM 2102 CB PHE A 138 -22.425 3.095 11.952 1.00 0.00 C ATOM 2103 CG PHE A 138 -21.166 3.176 11.150 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -21.068 4.060 10.081 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -20.101 2.345 11.431 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -19.922 4.112 9.315 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -18.951 2.394 10.670 1.00 0.00 C ATOM 2108 CZ PHE A 138 -18.862 3.278 9.609 1.00 0.00 C ATOM 0 H PHE A 138 -24.865 3.340 12.629 1.00 0.00 H new ATOM 0 HA PHE A 138 -23.621 3.447 10.207 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -22.605 4.045 12.455 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -22.321 2.338 12.729 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -21.897 4.712 9.848 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -20.168 1.649 12.255 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -19.854 4.803 8.488 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -18.121 1.743 10.902 1.00 0.00 H new ATOM 0 HZ PHE A 138 -17.963 3.315 9.011 1.00 0.00 H new ATOM 2118 N ALA A 139 -24.231 0.420 11.173 1.00 0.00 N ATOM 2119 CA ALA A 139 -24.171 -0.993 10.848 1.00 0.00 C ATOM 2120 C ALA A 139 -24.956 -1.302 9.575 1.00 0.00 C ATOM 2121 O ALA A 139 -24.553 -2.153 8.781 1.00 0.00 O ATOM 2122 CB ALA A 139 -24.686 -1.806 12.025 1.00 0.00 C ATOM 0 H ALA A 139 -24.929 0.659 11.878 1.00 0.00 H new ATOM 0 HA ALA A 139 -23.134 -1.268 10.657 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -24.641 -2.867 11.781 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -24.069 -1.608 12.901 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -25.718 -1.526 12.237 1.00 0.00 H new ATOM 2128 N ALA A 140 -26.075 -0.606 9.381 1.00 0.00 N ATOM 2129 CA ALA A 140 -26.906 -0.812 8.198 1.00 0.00 C ATOM 2130 C ALA A 140 -26.364 -0.051 6.989 1.00 0.00 C ATOM 2131 O ALA A 140 -26.408 -0.550 5.864 1.00 0.00 O ATOM 2132 CB ALA A 140 -28.337 -0.392 8.483 1.00 0.00 C ATOM 0 H ALA A 140 -26.425 0.103 10.026 1.00 0.00 H new ATOM 0 HA ALA A 140 -26.884 -1.875 7.958 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -28.947 -0.550 7.593 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -28.734 -0.987 9.306 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -28.359 0.663 8.755 1.00 0.00 H new ATOM 2138 N MET A 141 -25.860 1.161 7.223 1.00 0.00 N ATOM 2139 CA MET A 141 -25.319 1.991 6.153 1.00 0.00 C ATOM 2140 C MET A 141 -24.212 1.260 5.401 1.00 0.00 C ATOM 2141 O MET A 141 -23.883 1.608 4.267 1.00 0.00 O ATOM 2142 CB MET A 141 -24.791 3.307 6.734 1.00 0.00 C ATOM 2143 CG MET A 141 -23.633 3.137 7.706 1.00 0.00 C ATOM 2144 SD MET A 141 -22.047 2.898 6.881 1.00 0.00 S ATOM 2145 CE MET A 141 -21.840 4.492 6.088 1.00 0.00 C ATOM 0 H MET A 141 -25.816 1.588 8.148 1.00 0.00 H new ATOM 0 HA MET A 141 -26.119 2.208 5.445 1.00 0.00 H new ATOM 0 HB2 MET A 141 -24.472 3.951 5.915 1.00 0.00 H new ATOM 0 HB3 MET A 141 -25.607 3.820 7.244 1.00 0.00 H new ATOM 0 HG2 MET A 141 -23.573 4.016 8.348 1.00 0.00 H new ATOM 0 HG3 MET A 141 -23.832 2.283 8.353 1.00 0.00 H new ATOM 0 HE1 MET A 141 -20.782 4.666 5.892 1.00 0.00 H new ATOM 0 HE2 MET A 141 -22.390 4.505 5.147 1.00 0.00 H new ATOM 0 HE3 MET A 141 -22.221 5.276 6.742 1.00 0.00 H new ATOM 2155 N MET A 142 -23.644 0.247 6.043 1.00 0.00 N ATOM 2156 CA MET A 142 -22.574 -0.536 5.443 1.00 0.00 C ATOM 2157 C MET A 142 -23.137 -1.758 4.729 1.00 0.00 C ATOM 2158 O MET A 142 -23.029 -1.883 3.509 1.00 0.00 O ATOM 2159 CB MET A 142 -21.584 -0.977 6.519 1.00 0.00 C ATOM 2160 CG MET A 142 -20.335 -1.644 5.966 1.00 0.00 C ATOM 2161 SD MET A 142 -19.239 -2.239 7.267 1.00 0.00 S ATOM 2162 CE MET A 142 -19.084 -0.764 8.269 1.00 0.00 C ATOM 0 H MET A 142 -23.908 -0.051 6.982 1.00 0.00 H new ATOM 0 HA MET A 142 -22.059 0.088 4.712 1.00 0.00 H new ATOM 0 HB2 MET A 142 -21.290 -0.108 7.108 1.00 0.00 H new ATOM 0 HB3 MET A 142 -22.083 -1.668 7.198 1.00 0.00 H new ATOM 0 HG2 MET A 142 -20.625 -2.479 5.329 1.00 0.00 H new ATOM 0 HG3 MET A 142 -19.796 -0.935 5.337 1.00 0.00 H new ATOM 0 HE1 MET A 142 -18.202 -0.846 8.904 1.00 0.00 H new ATOM 0 HE2 MET A 142 -18.985 0.107 7.621 1.00 0.00 H new ATOM 0 HE3 MET A 142 -19.971 -0.653 8.893 1.00 0.00 H new