USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 867 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 108 CYS SG : rot 77:sc= -0.847 USER MOD Set 1.2: A 121 MET CE :methyl -119:sc= -3.44! (180deg=-1.62!) USER MOD Set 2.1: A 49 LYS NZ :NH3+ -179:sc= 1.55 (180deg=1.25) USER MOD Set 2.2: A 90 TYR OH : rot 30:sc= 0.00711 USER MOD Set 3.1: A 44 MET CE :methyl -140:sc= -0.0833 (180deg=-0.402) USER MOD Set 3.2: A 46 SER OG : rot -22:sc= 0.726 USER MOD Set 4.1: A 23 ASN : amide:sc= -1.57! X(o=-0.67!,f=-1.1) USER MOD Set 4.2: A 24 SER OG : rot 180:sc= 0 USER MOD Set 4.3: A 26 THR OG1 : rot 47:sc= 0.902 USER MOD Single : A 13 LYS NZ :NH3+ -138:sc= -2.78! (180deg=-5.81!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -115:sc= -2.77! (180deg=-5.43!) USER MOD Single : A 21 THR OG1 : rot -40:sc= 0.226 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00848) USER MOD Single : A 37 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0189) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -165:sc= -1.99 (180deg=-3.19) USER MOD Single : A 59 LYS NZ :NH3+ -130:sc= -2.52 (180deg=-6.7!) USER MOD Single : A 60 SER OG : rot -76:sc= 0.00393 USER MOD Single : A 62 THR OG1 : rot -142:sc= -3.21! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 141:sc= -0.587 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -166:sc= -0.0156 (180deg=-0.198) USER MOD Single : A 96 SER OG : rot 140:sc= 0.835 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 116:sc= 0.0151 USER MOD Single : A 105 GLN : amide:sc= -5.48! K(o=-5.5!,f=-3.2) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 123 LYS NZ :NH3+ 165:sc= -0.0402 (180deg=-0.324) USER MOD Single : A 127 GLN : amide:sc= -12.2! C(o=-12!,f=-5.1!) USER MOD Single : A 129 ASN : amide:sc= -8.64! K(o=-8.6!,f=-1.1) USER MOD Single : A 132 GLN : amide:sc= -3.5! K(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 168:sc= -1.17 (180deg=-1.72) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 -10.269 8.988 13.612 1.00 0.00 N ATOM 161 CA LEU A 12 -10.705 9.157 12.233 1.00 0.00 C ATOM 162 C LEU A 12 -10.264 7.974 11.383 1.00 0.00 C ATOM 163 O LEU A 12 -11.061 7.413 10.631 1.00 0.00 O ATOM 164 CB LEU A 12 -10.146 10.468 11.669 1.00 0.00 C ATOM 165 CG LEU A 12 -10.703 10.881 10.303 1.00 0.00 C ATOM 166 CD1 LEU A 12 -12.194 11.164 10.394 1.00 0.00 C ATOM 167 CD2 LEU A 12 -9.957 12.096 9.772 1.00 0.00 C ATOM 0 HA LEU A 12 -11.794 9.200 12.209 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.348 11.267 12.382 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.063 10.378 11.590 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.557 10.055 9.607 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -12.570 11.456 9.413 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -12.715 10.267 10.730 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.368 11.972 11.104 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.364 12.377 8.801 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.072 12.927 10.468 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.899 11.856 9.666 1.00 0.00 H new ATOM 179 N LYS A 13 -9.000 7.580 11.520 1.00 0.00 N ATOM 180 CA LYS A 13 -8.488 6.439 10.775 1.00 0.00 C ATOM 181 C LYS A 13 -9.364 5.235 11.071 1.00 0.00 C ATOM 182 O LYS A 13 -9.577 4.374 10.217 1.00 0.00 O ATOM 183 CB LYS A 13 -7.030 6.155 11.143 1.00 0.00 C ATOM 184 CG LYS A 13 -6.483 4.877 10.528 1.00 0.00 C ATOM 185 CD LYS A 13 -5.035 4.619 10.927 1.00 0.00 C ATOM 186 CE LYS A 13 -4.890 4.317 12.415 1.00 0.00 C ATOM 187 NZ LYS A 13 -5.108 5.524 13.261 1.00 0.00 N ATOM 0 H LYS A 13 -8.320 8.030 12.133 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.515 6.659 9.708 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.413 6.995 10.823 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.944 6.092 12.228 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -7.099 4.034 10.839 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -6.553 4.940 9.442 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -4.645 3.781 10.349 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -4.430 5.490 10.675 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -5.605 3.544 12.698 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -3.895 3.917 12.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -4.400 5.547 14.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.015 6.379 12.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.061 5.490 13.675 1.00 0.00 H new ATOM 201 N GLU A 14 -9.910 5.215 12.283 1.00 0.00 N ATOM 202 CA GLU A 14 -10.813 4.157 12.695 1.00 0.00 C ATOM 203 C GLU A 14 -12.172 4.398 12.069 1.00 0.00 C ATOM 204 O GLU A 14 -12.836 3.464 11.630 1.00 0.00 O ATOM 205 CB GLU A 14 -10.935 4.098 14.217 1.00 0.00 C ATOM 206 CG GLU A 14 -9.729 3.474 14.894 1.00 0.00 C ATOM 207 CD GLU A 14 -8.450 4.246 14.648 1.00 0.00 C ATOM 208 OE1 GLU A 14 -8.396 5.440 15.013 1.00 0.00 O ATOM 209 OE2 GLU A 14 -7.498 3.657 14.091 1.00 0.00 O ATOM 0 H GLU A 14 -9.739 5.924 12.996 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.414 3.200 12.358 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.077 5.108 14.602 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -11.826 3.528 14.481 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.911 3.415 15.967 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -9.605 2.452 14.535 1.00 0.00 H new ATOM 216 N LEU A 15 -12.564 5.671 12.005 1.00 0.00 N ATOM 217 CA LEU A 15 -13.834 6.050 11.403 1.00 0.00 C ATOM 218 C LEU A 15 -13.912 5.505 9.988 1.00 0.00 C ATOM 219 O LEU A 15 -14.992 5.226 9.469 1.00 0.00 O ATOM 220 CB LEU A 15 -13.994 7.571 11.376 1.00 0.00 C ATOM 221 CG LEU A 15 -15.325 8.066 10.812 1.00 0.00 C ATOM 222 CD1 LEU A 15 -16.485 7.537 11.637 1.00 0.00 C ATOM 223 CD2 LEU A 15 -15.352 9.585 10.756 1.00 0.00 C ATOM 0 H LEU A 15 -12.017 6.454 12.364 1.00 0.00 H new ATOM 0 HA LEU A 15 -14.639 5.629 12.005 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.882 7.952 12.391 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.184 7.997 10.784 1.00 0.00 H new ATOM 0 HG LEU A 15 -15.429 7.687 9.795 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -17.424 7.901 11.220 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -16.477 6.447 11.619 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -16.387 7.883 12.666 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -16.308 9.917 10.352 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -15.223 9.988 11.760 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -14.544 9.940 10.116 1.00 0.00 H new ATOM 235 N PHE A 16 -12.746 5.348 9.374 1.00 0.00 N ATOM 236 CA PHE A 16 -12.662 4.825 8.024 1.00 0.00 C ATOM 237 C PHE A 16 -13.012 3.345 7.996 1.00 0.00 C ATOM 238 O PHE A 16 -13.775 2.900 7.143 1.00 0.00 O ATOM 239 CB PHE A 16 -11.258 5.017 7.454 1.00 0.00 C ATOM 240 CG PHE A 16 -11.004 4.132 6.263 1.00 0.00 C ATOM 241 CD1 PHE A 16 -11.793 4.231 5.127 1.00 0.00 C ATOM 242 CD2 PHE A 16 -10.005 3.171 6.298 1.00 0.00 C ATOM 243 CE1 PHE A 16 -11.590 3.391 4.050 1.00 0.00 C ATOM 244 CE2 PHE A 16 -9.794 2.333 5.220 1.00 0.00 C ATOM 245 CZ PHE A 16 -10.589 2.441 4.096 1.00 0.00 C ATOM 0 H PHE A 16 -11.845 5.577 9.794 1.00 0.00 H new ATOM 0 HA PHE A 16 -13.377 5.376 7.413 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.124 6.060 7.165 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.521 4.803 8.228 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -12.576 4.974 5.084 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -9.385 3.077 7.177 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -12.214 3.477 3.172 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -9.008 1.594 5.256 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.428 1.784 3.254 1.00 0.00 H new ATOM 255 N LYS A 17 -12.463 2.590 8.942 1.00 0.00 N ATOM 256 CA LYS A 17 -12.737 1.162 9.015 1.00 0.00 C ATOM 257 C LYS A 17 -14.047 0.970 9.737 1.00 0.00 C ATOM 258 O LYS A 17 -14.645 -0.106 9.726 1.00 0.00 O ATOM 259 CB LYS A 17 -11.604 0.411 9.717 1.00 0.00 C ATOM 260 CG LYS A 17 -11.374 0.843 11.154 1.00 0.00 C ATOM 261 CD LYS A 17 -10.246 0.050 11.793 1.00 0.00 C ATOM 262 CE LYS A 17 -10.071 0.413 13.259 1.00 0.00 C ATOM 263 NZ LYS A 17 -8.944 -0.331 13.887 1.00 0.00 N ATOM 0 H LYS A 17 -11.831 2.940 9.662 1.00 0.00 H new ATOM 0 HA LYS A 17 -12.805 0.751 8.008 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.824 -0.656 9.700 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -10.682 0.555 9.153 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.136 1.906 11.183 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.290 0.705 11.729 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.453 -1.016 11.703 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.317 0.240 11.256 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.893 1.485 13.348 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.993 0.197 13.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.859 -0.054 14.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.126 -1.353 13.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.059 -0.106 13.389 1.00 0.00 H new ATOM 277 N MET A 18 -14.487 2.057 10.344 1.00 0.00 N ATOM 278 CA MET A 18 -15.732 2.092 11.066 1.00 0.00 C ATOM 279 C MET A 18 -16.861 1.812 10.090 1.00 0.00 C ATOM 280 O MET A 18 -17.926 1.318 10.460 1.00 0.00 O ATOM 281 CB MET A 18 -15.902 3.468 11.704 1.00 0.00 C ATOM 282 CG MET A 18 -16.626 3.470 13.036 1.00 0.00 C ATOM 283 SD MET A 18 -15.973 2.270 14.220 1.00 0.00 S ATOM 284 CE MET A 18 -16.887 0.792 13.778 1.00 0.00 C ATOM 0 H MET A 18 -13.982 2.943 10.346 1.00 0.00 H new ATOM 0 HA MET A 18 -15.743 1.340 11.855 1.00 0.00 H new ATOM 0 HB2 MET A 18 -14.916 3.912 11.842 1.00 0.00 H new ATOM 0 HB3 MET A 18 -16.446 4.109 11.010 1.00 0.00 H new ATOM 0 HG2 MET A 18 -16.564 4.467 13.472 1.00 0.00 H new ATOM 0 HG3 MET A 18 -17.682 3.261 12.866 1.00 0.00 H new ATOM 0 HE1 MET A 18 -17.536 0.504 14.605 1.00 0.00 H new ATOM 0 HE2 MET A 18 -17.493 0.990 12.894 1.00 0.00 H new ATOM 0 HE3 MET A 18 -16.189 -0.018 13.566 1.00 0.00 H new ATOM 294 N ILE A 19 -16.595 2.132 8.825 1.00 0.00 N ATOM 295 CA ILE A 19 -17.551 1.922 7.749 1.00 0.00 C ATOM 296 C ILE A 19 -17.429 0.505 7.194 1.00 0.00 C ATOM 297 O ILE A 19 -18.386 -0.271 7.224 1.00 0.00 O ATOM 298 CB ILE A 19 -17.337 2.932 6.602 1.00 0.00 C ATOM 299 CG1 ILE A 19 -17.439 4.373 7.126 1.00 0.00 C ATOM 300 CG2 ILE A 19 -18.337 2.680 5.486 1.00 0.00 C ATOM 301 CD1 ILE A 19 -17.813 5.397 6.072 1.00 0.00 C ATOM 0 H ILE A 19 -15.712 2.543 8.522 1.00 0.00 H new ATOM 0 HA ILE A 19 -18.547 2.069 8.166 1.00 0.00 H new ATOM 0 HB ILE A 19 -16.335 2.796 6.196 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -18.180 4.405 7.925 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -16.483 4.655 7.566 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -18.175 3.399 4.683 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -18.204 1.669 5.100 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -19.350 2.790 5.873 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -17.863 6.386 6.527 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -17.061 5.398 5.283 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -18.784 5.144 5.647 1.00 0.00 H new ATOM 313 N ASP A 20 -16.239 0.175 6.697 1.00 0.00 N ATOM 314 CA ASP A 20 -15.969 -1.148 6.145 1.00 0.00 C ATOM 315 C ASP A 20 -15.634 -2.131 7.255 1.00 0.00 C ATOM 316 O ASP A 20 -14.556 -2.728 7.279 1.00 0.00 O ATOM 317 CB ASP A 20 -14.817 -1.076 5.147 1.00 0.00 C ATOM 318 CG ASP A 20 -13.715 -0.146 5.606 1.00 0.00 C ATOM 319 OD1 ASP A 20 -13.908 1.081 5.523 1.00 0.00 O ATOM 320 OD2 ASP A 20 -12.667 -0.642 6.063 1.00 0.00 O ATOM 0 H ASP A 20 -15.442 0.811 6.666 1.00 0.00 H new ATOM 0 HA ASP A 20 -16.864 -1.496 5.630 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.407 -2.075 4.996 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -15.196 -0.738 4.182 1.00 0.00 H new ATOM 325 N THR A 21 -16.559 -2.260 8.187 1.00 0.00 N ATOM 326 CA THR A 21 -16.386 -3.131 9.341 1.00 0.00 C ATOM 327 C THR A 21 -16.693 -4.588 9.013 1.00 0.00 C ATOM 328 O THR A 21 -16.497 -5.470 9.850 1.00 0.00 O ATOM 329 CB THR A 21 -17.296 -2.656 10.468 1.00 0.00 C ATOM 330 OG1 THR A 21 -16.989 -3.324 11.680 1.00 0.00 O ATOM 331 CG2 THR A 21 -18.766 -2.879 10.182 1.00 0.00 C ATOM 0 H THR A 21 -17.451 -1.766 8.169 1.00 0.00 H new ATOM 0 HA THR A 21 -15.341 -3.079 9.647 1.00 0.00 H new ATOM 0 HB THR A 21 -17.115 -1.584 10.552 1.00 0.00 H new ATOM 0 HG1 THR A 21 -16.805 -4.269 11.495 1.00 0.00 H new ATOM 0 HG21 THR A 21 -19.359 -2.519 11.023 1.00 0.00 H new ATOM 0 HG22 THR A 21 -19.048 -2.335 9.280 1.00 0.00 H new ATOM 0 HG23 THR A 21 -18.951 -3.943 10.036 1.00 0.00 H new ATOM 339 N ASP A 22 -17.193 -4.841 7.812 1.00 0.00 N ATOM 340 CA ASP A 22 -17.541 -6.200 7.416 1.00 0.00 C ATOM 341 C ASP A 22 -16.930 -6.580 6.070 1.00 0.00 C ATOM 342 O ASP A 22 -16.908 -7.757 5.709 1.00 0.00 O ATOM 343 CB ASP A 22 -19.061 -6.351 7.351 1.00 0.00 C ATOM 344 CG ASP A 22 -19.694 -5.390 6.363 1.00 0.00 C ATOM 345 OD1 ASP A 22 -18.952 -4.608 5.737 1.00 0.00 O ATOM 346 OD2 ASP A 22 -20.934 -5.421 6.217 1.00 0.00 O ATOM 0 H ASP A 22 -17.366 -4.131 7.100 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.132 -6.874 8.169 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -19.310 -7.374 7.070 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -19.483 -6.181 8.341 1.00 0.00 H new ATOM 351 N ASN A 23 -16.450 -5.593 5.323 1.00 0.00 N ATOM 352 CA ASN A 23 -15.867 -5.858 4.020 1.00 0.00 C ATOM 353 C ASN A 23 -14.485 -6.489 4.152 1.00 0.00 C ATOM 354 O ASN A 23 -14.347 -7.712 4.142 1.00 0.00 O ATOM 355 CB ASN A 23 -15.776 -4.566 3.199 1.00 0.00 C ATOM 356 CG ASN A 23 -15.352 -4.799 1.758 1.00 0.00 C ATOM 357 OD1 ASN A 23 -15.192 -3.850 0.991 1.00 0.00 O ATOM 358 ND2 ASN A 23 -15.177 -6.060 1.374 1.00 0.00 N ATOM 0 H ASN A 23 -16.454 -4.610 5.597 1.00 0.00 H new ATOM 0 HA ASN A 23 -16.518 -6.563 3.503 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -16.745 -4.068 3.209 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -15.065 -3.890 3.675 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -14.901 -6.267 0.414 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -15.319 -6.820 2.039 1.00 0.00 H new ATOM 365 N SER A 24 -13.468 -5.642 4.264 1.00 0.00 N ATOM 366 CA SER A 24 -12.088 -6.108 4.382 1.00 0.00 C ATOM 367 C SER A 24 -11.136 -4.936 4.578 1.00 0.00 C ATOM 368 O SER A 24 -9.916 -5.098 4.537 1.00 0.00 O ATOM 369 CB SER A 24 -11.695 -6.888 3.128 1.00 0.00 C ATOM 370 OG SER A 24 -11.921 -6.115 1.962 1.00 0.00 O ATOM 0 H SER A 24 -13.572 -4.627 4.276 1.00 0.00 H new ATOM 0 HA SER A 24 -12.018 -6.760 5.253 1.00 0.00 H new ATOM 0 HB2 SER A 24 -10.644 -7.170 3.184 1.00 0.00 H new ATOM 0 HB3 SER A 24 -12.270 -7.812 3.074 1.00 0.00 H new ATOM 0 HG SER A 24 -11.661 -6.632 1.171 1.00 0.00 H new ATOM 376 N GLY A 25 -11.705 -3.749 4.744 1.00 0.00 N ATOM 377 CA GLY A 25 -10.910 -2.551 4.889 1.00 0.00 C ATOM 378 C GLY A 25 -11.061 -1.645 3.685 1.00 0.00 C ATOM 379 O GLY A 25 -10.142 -0.910 3.322 1.00 0.00 O ATOM 0 H GLY A 25 -12.713 -3.597 4.781 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -11.213 -2.017 5.790 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.861 -2.820 5.016 1.00 0.00 H new ATOM 383 N THR A 26 -12.251 -1.693 3.084 1.00 0.00 N ATOM 384 CA THR A 26 -12.582 -0.870 1.925 1.00 0.00 C ATOM 385 C THR A 26 -14.070 -0.565 1.914 1.00 0.00 C ATOM 386 O THR A 26 -14.884 -1.371 2.361 1.00 0.00 O ATOM 387 CB THR A 26 -12.192 -1.547 0.619 1.00 0.00 C ATOM 388 OG1 THR A 26 -12.780 -2.832 0.519 1.00 0.00 O ATOM 389 CG2 THR A 26 -10.699 -1.704 0.436 1.00 0.00 C ATOM 0 H THR A 26 -13.010 -2.303 3.388 1.00 0.00 H new ATOM 0 HA THR A 26 -12.013 0.056 2.007 1.00 0.00 H new ATOM 0 HB THR A 26 -12.562 -0.883 -0.162 1.00 0.00 H new ATOM 0 HG1 THR A 26 -13.731 -2.776 0.750 1.00 0.00 H new ATOM 0 HG21 THR A 26 -10.499 -2.194 -0.517 1.00 0.00 H new ATOM 0 HG22 THR A 26 -10.226 -0.722 0.445 1.00 0.00 H new ATOM 0 HG23 THR A 26 -10.295 -2.309 1.247 1.00 0.00 H new ATOM 397 N ILE A 27 -14.413 0.620 1.443 1.00 0.00 N ATOM 398 CA ILE A 27 -15.798 1.056 1.439 1.00 0.00 C ATOM 399 C ILE A 27 -16.452 0.967 0.076 1.00 0.00 C ATOM 400 O ILE A 27 -16.244 1.809 -0.783 1.00 0.00 O ATOM 401 CB ILE A 27 -15.867 2.506 1.904 1.00 0.00 C ATOM 402 CG1 ILE A 27 -15.099 2.645 3.215 1.00 0.00 C ATOM 403 CG2 ILE A 27 -17.310 2.954 2.052 1.00 0.00 C ATOM 404 CD1 ILE A 27 -15.407 3.908 3.974 1.00 0.00 C ATOM 0 H ILE A 27 -13.753 1.297 1.059 1.00 0.00 H new ATOM 0 HA ILE A 27 -16.337 0.386 2.109 1.00 0.00 H new ATOM 0 HB ILE A 27 -15.407 3.153 1.158 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -15.325 1.788 3.849 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.030 2.612 3.003 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -17.337 3.992 2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -17.818 2.868 1.092 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -17.813 2.325 2.786 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -14.822 3.932 4.893 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -15.154 4.772 3.360 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -16.469 3.935 4.219 1.00 0.00 H new ATOM 416 N THR A 28 -17.281 -0.037 -0.103 1.00 0.00 N ATOM 417 CA THR A 28 -17.973 -0.200 -1.361 1.00 0.00 C ATOM 418 C THR A 28 -19.420 0.247 -1.232 1.00 0.00 C ATOM 419 O THR A 28 -19.912 0.445 -0.132 1.00 0.00 O ATOM 420 CB THR A 28 -17.884 -1.650 -1.825 1.00 0.00 C ATOM 421 OG1 THR A 28 -18.457 -2.525 -0.870 1.00 0.00 O ATOM 422 CG2 THR A 28 -16.455 -2.090 -2.060 1.00 0.00 C ATOM 0 H THR A 28 -17.491 -0.746 0.599 1.00 0.00 H new ATOM 0 HA THR A 28 -17.494 0.428 -2.113 1.00 0.00 H new ATOM 0 HB THR A 28 -18.433 -1.698 -2.765 1.00 0.00 H new ATOM 0 HG1 THR A 28 -18.390 -3.449 -1.191 1.00 0.00 H new ATOM 0 HG21 THR A 28 -16.444 -3.129 -2.389 1.00 0.00 H new ATOM 0 HG22 THR A 28 -16.002 -1.462 -2.827 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.888 -1.997 -1.133 1.00 0.00 H new ATOM 430 N PHE A 29 -20.063 0.440 -2.372 1.00 0.00 N ATOM 431 CA PHE A 29 -21.448 0.915 -2.441 1.00 0.00 C ATOM 432 C PHE A 29 -22.308 0.401 -1.280 1.00 0.00 C ATOM 433 O PHE A 29 -23.179 1.118 -0.787 1.00 0.00 O ATOM 434 CB PHE A 29 -22.070 0.458 -3.761 1.00 0.00 C ATOM 435 CG PHE A 29 -23.282 1.244 -4.170 1.00 0.00 C ATOM 436 CD1 PHE A 29 -23.150 2.385 -4.943 1.00 0.00 C ATOM 437 CD2 PHE A 29 -24.552 0.835 -3.795 1.00 0.00 C ATOM 438 CE1 PHE A 29 -24.262 3.108 -5.330 1.00 0.00 C ATOM 439 CE2 PHE A 29 -25.667 1.554 -4.179 1.00 0.00 C ATOM 440 CZ PHE A 29 -25.523 2.693 -4.948 1.00 0.00 C ATOM 0 H PHE A 29 -19.641 0.272 -3.286 1.00 0.00 H new ATOM 0 HA PHE A 29 -21.422 2.003 -2.374 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -21.320 0.531 -4.549 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -22.343 -0.594 -3.677 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -22.167 2.714 -5.247 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -24.671 -0.056 -3.196 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -24.145 3.998 -5.931 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -26.651 1.226 -3.878 1.00 0.00 H new ATOM 0 HZ PHE A 29 -26.393 3.257 -5.249 1.00 0.00 H new ATOM 450 N ASP A 30 -22.069 -0.833 -0.853 1.00 0.00 N ATOM 451 CA ASP A 30 -22.837 -1.421 0.243 1.00 0.00 C ATOM 452 C ASP A 30 -22.396 -0.870 1.601 1.00 0.00 C ATOM 453 O ASP A 30 -23.226 -0.433 2.404 1.00 0.00 O ATOM 454 CB ASP A 30 -22.690 -2.944 0.229 1.00 0.00 C ATOM 455 CG ASP A 30 -23.161 -3.563 -1.073 1.00 0.00 C ATOM 456 OD1 ASP A 30 -23.608 -2.809 -1.965 1.00 0.00 O ATOM 457 OD2 ASP A 30 -23.082 -4.802 -1.202 1.00 0.00 O ATOM 0 H ASP A 30 -21.354 -1.445 -1.245 1.00 0.00 H new ATOM 0 HA ASP A 30 -23.883 -1.153 0.095 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -21.645 -3.206 0.395 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -23.260 -3.368 1.056 1.00 0.00 H new ATOM 462 N GLU A 31 -21.089 -0.881 1.853 1.00 0.00 N ATOM 463 CA GLU A 31 -20.561 -0.372 3.114 1.00 0.00 C ATOM 464 C GLU A 31 -20.572 1.143 3.133 1.00 0.00 C ATOM 465 O GLU A 31 -20.548 1.752 4.199 1.00 0.00 O ATOM 466 CB GLU A 31 -19.152 -0.904 3.382 1.00 0.00 C ATOM 467 CG GLU A 31 -19.152 -2.253 4.081 1.00 0.00 C ATOM 468 CD GLU A 31 -19.546 -3.391 3.158 1.00 0.00 C ATOM 469 OE1 GLU A 31 -20.698 -3.396 2.677 1.00 0.00 O ATOM 470 OE2 GLU A 31 -18.698 -4.274 2.915 1.00 0.00 O ATOM 0 H GLU A 31 -20.383 -1.233 1.207 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.212 -0.730 3.912 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -18.616 -0.990 2.437 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -18.607 -0.184 3.993 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.159 -2.447 4.487 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -19.841 -2.220 4.925 1.00 0.00 H new ATOM 477 N LEU A 32 -20.640 1.743 1.952 1.00 0.00 N ATOM 478 CA LEU A 32 -20.681 3.187 1.833 1.00 0.00 C ATOM 479 C LEU A 32 -21.685 3.729 2.833 1.00 0.00 C ATOM 480 O LEU A 32 -21.416 4.670 3.581 1.00 0.00 O ATOM 481 CB LEU A 32 -21.095 3.585 0.419 1.00 0.00 C ATOM 482 CG LEU A 32 -20.723 5.014 0.004 1.00 0.00 C ATOM 483 CD1 LEU A 32 -21.600 6.036 0.711 1.00 0.00 C ATOM 484 CD2 LEU A 32 -19.256 5.289 0.299 1.00 0.00 C ATOM 0 H LEU A 32 -20.668 1.246 1.062 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.693 3.600 2.035 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -20.638 2.889 -0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -22.175 3.467 0.328 1.00 0.00 H new ATOM 0 HG LEU A 32 -20.891 5.105 -1.069 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -21.314 7.040 0.398 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -22.644 5.859 0.454 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -21.471 5.942 1.789 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -19.009 6.307 -0.002 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -19.071 5.171 1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -18.635 4.586 -0.257 1.00 0.00 H new ATOM 496 N LYS A 33 -22.843 3.092 2.832 1.00 0.00 N ATOM 497 CA LYS A 33 -23.937 3.441 3.724 1.00 0.00 C ATOM 498 C LYS A 33 -23.796 2.749 5.081 1.00 0.00 C ATOM 499 O LYS A 33 -23.854 3.399 6.129 1.00 0.00 O ATOM 500 CB LYS A 33 -25.278 3.066 3.086 1.00 0.00 C ATOM 501 CG LYS A 33 -25.151 2.128 1.894 1.00 0.00 C ATOM 502 CD LYS A 33 -26.463 1.439 1.570 1.00 0.00 C ATOM 503 CE LYS A 33 -27.553 2.447 1.285 1.00 0.00 C ATOM 504 NZ LYS A 33 -28.800 1.796 0.798 1.00 0.00 N ATOM 0 H LYS A 33 -23.053 2.313 2.208 1.00 0.00 H new ATOM 0 HA LYS A 33 -23.901 4.518 3.888 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -25.910 2.596 3.840 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -25.785 3.977 2.767 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -24.813 2.691 1.024 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -24.389 1.377 2.103 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -26.331 0.788 0.706 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -26.760 0.805 2.405 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -27.769 3.013 2.191 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -27.201 3.160 0.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -29.510 2.524 0.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -28.593 1.249 -0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -29.169 1.159 1.533 1.00 0.00 H new ATOM 518 N ASP A 34 -23.614 1.428 5.052 1.00 0.00 N ATOM 519 CA ASP A 34 -23.484 0.631 6.273 1.00 0.00 C ATOM 520 C ASP A 34 -22.723 1.369 7.374 1.00 0.00 C ATOM 521 O ASP A 34 -23.031 1.226 8.556 1.00 0.00 O ATOM 522 CB ASP A 34 -22.776 -0.683 5.959 1.00 0.00 C ATOM 523 CG ASP A 34 -23.610 -1.601 5.084 1.00 0.00 C ATOM 524 OD1 ASP A 34 -24.735 -1.207 4.710 1.00 0.00 O ATOM 525 OD2 ASP A 34 -23.135 -2.714 4.773 1.00 0.00 O ATOM 0 H ASP A 34 -23.553 0.885 4.191 1.00 0.00 H new ATOM 0 HA ASP A 34 -24.492 0.440 6.642 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -21.830 -0.472 5.460 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -22.537 -1.194 6.891 1.00 0.00 H new ATOM 530 N GLY A 35 -21.723 2.142 6.981 1.00 0.00 N ATOM 531 CA GLY A 35 -20.924 2.873 7.944 1.00 0.00 C ATOM 532 C GLY A 35 -21.656 4.000 8.672 1.00 0.00 C ATOM 533 O GLY A 35 -21.692 4.013 9.903 1.00 0.00 O ATOM 0 H GLY A 35 -21.449 2.277 6.008 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -20.543 2.170 8.685 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -20.060 3.294 7.431 1.00 0.00 H new ATOM 537 N LEU A 36 -22.215 4.968 7.937 1.00 0.00 N ATOM 538 CA LEU A 36 -22.882 6.097 8.596 1.00 0.00 C ATOM 539 C LEU A 36 -24.222 5.698 9.190 1.00 0.00 C ATOM 540 O LEU A 36 -24.661 6.278 10.183 1.00 0.00 O ATOM 541 CB LEU A 36 -23.009 7.330 7.667 1.00 0.00 C ATOM 542 CG LEU A 36 -24.128 7.339 6.608 1.00 0.00 C ATOM 543 CD1 LEU A 36 -24.062 6.117 5.722 1.00 0.00 C ATOM 544 CD2 LEU A 36 -25.503 7.463 7.246 1.00 0.00 C ATOM 0 H LEU A 36 -22.221 4.995 6.917 1.00 0.00 H new ATOM 0 HA LEU A 36 -22.240 6.394 9.425 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -23.143 8.209 8.298 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -22.059 7.453 7.147 1.00 0.00 H new ATOM 0 HG LEU A 36 -23.967 8.218 5.984 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -24.866 6.157 4.987 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -23.101 6.092 5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -24.171 5.220 6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -26.266 7.466 6.468 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -25.671 6.620 7.916 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -25.559 8.393 7.812 1.00 0.00 H new ATOM 556 N LYS A 37 -24.870 4.703 8.603 1.00 0.00 N ATOM 557 CA LYS A 37 -26.145 4.244 9.115 1.00 0.00 C ATOM 558 C LYS A 37 -25.957 3.617 10.494 1.00 0.00 C ATOM 559 O LYS A 37 -26.926 3.245 11.157 1.00 0.00 O ATOM 560 CB LYS A 37 -26.781 3.248 8.147 1.00 0.00 C ATOM 561 CG LYS A 37 -25.965 1.988 7.931 1.00 0.00 C ATOM 562 CD LYS A 37 -26.744 0.941 7.147 1.00 0.00 C ATOM 563 CE LYS A 37 -27.105 1.431 5.753 1.00 0.00 C ATOM 564 NZ LYS A 37 -27.879 0.414 4.990 1.00 0.00 N ATOM 0 H LYS A 37 -24.535 4.204 7.779 1.00 0.00 H new ATOM 0 HA LYS A 37 -26.816 5.097 9.211 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -27.766 2.970 8.523 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -26.934 3.739 7.186 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -25.048 2.235 7.396 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -25.670 1.575 8.896 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -26.151 0.030 7.070 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -27.654 0.684 7.689 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -27.689 2.348 5.831 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -26.194 1.678 5.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -28.149 0.805 4.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -27.294 -0.434 4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -28.736 0.159 5.522 1.00 0.00 H new ATOM 578 N ARG A 38 -24.696 3.513 10.925 1.00 0.00 N ATOM 579 CA ARG A 38 -24.374 2.944 12.226 1.00 0.00 C ATOM 580 C ARG A 38 -24.415 4.008 13.321 1.00 0.00 C ATOM 581 O ARG A 38 -24.925 3.764 14.415 1.00 0.00 O ATOM 582 CB ARG A 38 -22.993 2.283 12.180 1.00 0.00 C ATOM 583 CG ARG A 38 -22.457 1.874 13.544 1.00 0.00 C ATOM 584 CD ARG A 38 -21.239 0.973 13.417 1.00 0.00 C ATOM 585 NE ARG A 38 -21.582 -0.306 12.799 1.00 0.00 N ATOM 586 CZ ARG A 38 -20.713 -1.289 12.589 1.00 0.00 C ATOM 587 NH1 ARG A 38 -19.435 -1.132 12.909 1.00 0.00 N ATOM 588 NH2 ARG A 38 -21.123 -2.430 12.052 1.00 0.00 N ATOM 0 H ARG A 38 -23.885 3.817 10.387 1.00 0.00 H new ATOM 0 HA ARG A 38 -25.125 2.190 12.463 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -23.045 1.401 11.542 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -22.287 2.971 11.715 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -22.194 2.765 14.115 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -23.237 1.356 14.102 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -20.475 1.473 12.821 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -20.810 0.798 14.404 1.00 0.00 H new ATOM 0 HE ARG A 38 -22.549 -0.453 12.511 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -19.116 -0.254 13.318 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -18.772 -1.889 12.746 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -22.104 -2.552 11.801 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -20.457 -3.186 11.890 1.00 0.00 H new ATOM 602 N VAL A 39 -23.866 5.185 13.030 1.00 0.00 N ATOM 603 CA VAL A 39 -23.832 6.279 13.997 1.00 0.00 C ATOM 604 C VAL A 39 -25.202 6.922 14.188 1.00 0.00 C ATOM 605 O VAL A 39 -25.350 7.860 14.971 1.00 0.00 O ATOM 606 CB VAL A 39 -22.830 7.369 13.569 1.00 0.00 C ATOM 607 CG1 VAL A 39 -21.410 6.825 13.587 1.00 0.00 C ATOM 608 CG2 VAL A 39 -23.182 7.908 12.192 1.00 0.00 C ATOM 0 H VAL A 39 -23.438 5.406 12.131 1.00 0.00 H new ATOM 0 HA VAL A 39 -23.517 5.838 14.943 1.00 0.00 H new ATOM 0 HB VAL A 39 -22.890 8.191 14.282 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -20.716 7.609 13.282 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -21.161 6.492 14.594 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -21.334 5.984 12.897 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -22.463 8.676 11.907 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -23.152 7.096 11.465 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -24.183 8.338 12.215 1.00 0.00 H new ATOM 618 N GLY A 40 -26.201 6.420 13.471 1.00 0.00 N ATOM 619 CA GLY A 40 -27.539 6.972 13.586 1.00 0.00 C ATOM 620 C GLY A 40 -28.006 7.624 12.300 1.00 0.00 C ATOM 621 O GLY A 40 -29.180 7.531 11.940 1.00 0.00 O ATOM 0 H GLY A 40 -26.110 5.644 12.815 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -28.234 6.179 13.862 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -27.558 7.707 14.391 1.00 0.00 H new ATOM 625 N SER A 41 -27.079 8.278 11.605 1.00 0.00 N ATOM 626 CA SER A 41 -27.387 8.944 10.342 1.00 0.00 C ATOM 627 C SER A 41 -28.080 7.980 9.383 1.00 0.00 C ATOM 628 O SER A 41 -27.887 6.768 9.469 1.00 0.00 O ATOM 629 CB SER A 41 -26.099 9.488 9.718 1.00 0.00 C ATOM 630 OG SER A 41 -25.666 10.662 10.381 1.00 0.00 O ATOM 0 H SER A 41 -26.105 8.361 11.896 1.00 0.00 H new ATOM 0 HA SER A 41 -28.065 9.775 10.536 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.318 8.729 9.769 1.00 0.00 H new ATOM 0 HB3 SER A 41 -26.266 9.703 8.663 1.00 0.00 H new ATOM 0 HG SER A 41 -24.841 10.988 9.964 1.00 0.00 H new ATOM 636 N GLU A 42 -28.892 8.516 8.471 1.00 0.00 N ATOM 637 CA GLU A 42 -29.604 7.671 7.514 1.00 0.00 C ATOM 638 C GLU A 42 -29.711 8.324 6.138 1.00 0.00 C ATOM 639 O GLU A 42 -30.523 9.222 5.918 1.00 0.00 O ATOM 640 CB GLU A 42 -31.004 7.343 8.037 1.00 0.00 C ATOM 641 CG GLU A 42 -31.003 6.546 9.331 1.00 0.00 C ATOM 642 CD GLU A 42 -32.402 6.227 9.820 1.00 0.00 C ATOM 643 OE1 GLU A 42 -33.152 5.557 9.079 1.00 0.00 O ATOM 644 OE2 GLU A 42 -32.749 6.648 10.943 1.00 0.00 O ATOM 0 H GLU A 42 -29.071 9.516 8.375 1.00 0.00 H new ATOM 0 HA GLU A 42 -29.026 6.753 7.403 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -31.550 8.273 8.194 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -31.544 6.781 7.275 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -30.454 5.617 9.181 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -30.473 7.109 10.100 1.00 0.00 H new ATOM 651 N LEU A 43 -28.885 7.844 5.215 1.00 0.00 N ATOM 652 CA LEU A 43 -28.854 8.331 3.851 1.00 0.00 C ATOM 653 C LEU A 43 -29.510 7.333 2.894 1.00 0.00 C ATOM 654 O LEU A 43 -29.772 6.188 3.264 1.00 0.00 O ATOM 655 CB LEU A 43 -27.410 8.619 3.454 1.00 0.00 C ATOM 656 CG LEU A 43 -26.379 7.522 3.749 1.00 0.00 C ATOM 657 CD1 LEU A 43 -26.828 6.163 3.237 1.00 0.00 C ATOM 658 CD2 LEU A 43 -25.038 7.897 3.139 1.00 0.00 C ATOM 0 H LEU A 43 -28.214 7.099 5.400 1.00 0.00 H new ATOM 0 HA LEU A 43 -29.428 9.255 3.786 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -27.387 8.828 2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -27.093 9.529 3.963 1.00 0.00 H new ATOM 0 HG LEU A 43 -26.280 7.443 4.832 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -26.067 5.418 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -27.766 5.885 3.717 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -26.973 6.211 2.158 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -24.310 7.114 3.352 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -25.147 8.007 2.060 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -24.694 8.839 3.567 1.00 0.00 H new ATOM 670 N MET A 44 -29.766 7.765 1.662 1.00 0.00 N ATOM 671 CA MET A 44 -30.376 6.908 0.654 1.00 0.00 C ATOM 672 C MET A 44 -29.321 6.466 -0.342 1.00 0.00 C ATOM 673 O MET A 44 -28.238 7.045 -0.392 1.00 0.00 O ATOM 674 CB MET A 44 -31.462 7.671 -0.094 1.00 0.00 C ATOM 675 CG MET A 44 -32.116 8.750 0.740 1.00 0.00 C ATOM 676 SD MET A 44 -33.598 9.428 -0.031 1.00 0.00 S ATOM 677 CE MET A 44 -32.924 10.065 -1.562 1.00 0.00 C ATOM 0 H MET A 44 -29.558 8.710 1.338 1.00 0.00 H new ATOM 0 HA MET A 44 -30.812 6.041 1.150 1.00 0.00 H new ATOM 0 HB2 MET A 44 -31.030 8.123 -0.987 1.00 0.00 H new ATOM 0 HB3 MET A 44 -32.225 6.968 -0.430 1.00 0.00 H new ATOM 0 HG2 MET A 44 -32.375 8.341 1.717 1.00 0.00 H new ATOM 0 HG3 MET A 44 -31.401 9.554 0.911 1.00 0.00 H new ATOM 0 HE1 MET A 44 -33.389 11.023 -1.794 1.00 0.00 H new ATOM 0 HE2 MET A 44 -31.848 10.200 -1.457 1.00 0.00 H new ATOM 0 HE3 MET A 44 -33.124 9.360 -2.369 1.00 0.00 H new ATOM 687 N GLU A 45 -29.636 5.455 -1.146 1.00 0.00 N ATOM 688 CA GLU A 45 -28.693 4.972 -2.143 1.00 0.00 C ATOM 689 C GLU A 45 -28.106 6.133 -2.926 1.00 0.00 C ATOM 690 O GLU A 45 -26.894 6.316 -2.930 1.00 0.00 O ATOM 691 CB GLU A 45 -29.345 3.964 -3.070 1.00 0.00 C ATOM 692 CG GLU A 45 -29.608 2.624 -2.407 1.00 0.00 C ATOM 693 CD GLU A 45 -30.170 1.593 -3.367 1.00 0.00 C ATOM 694 OE1 GLU A 45 -30.358 1.926 -4.556 1.00 0.00 O ATOM 695 OE2 GLU A 45 -30.422 0.450 -2.929 1.00 0.00 O ATOM 0 H GLU A 45 -30.528 4.960 -1.126 1.00 0.00 H new ATOM 0 HA GLU A 45 -27.880 4.464 -1.624 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.287 4.372 -3.435 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -28.705 3.813 -3.939 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -28.679 2.247 -1.979 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -30.306 2.763 -1.581 1.00 0.00 H new ATOM 702 N SER A 46 -28.952 6.908 -3.608 1.00 0.00 N ATOM 703 CA SER A 46 -28.491 8.046 -4.398 1.00 0.00 C ATOM 704 C SER A 46 -27.368 8.814 -3.705 1.00 0.00 C ATOM 705 O SER A 46 -26.458 9.306 -4.368 1.00 0.00 O ATOM 706 CB SER A 46 -29.663 8.989 -4.669 1.00 0.00 C ATOM 707 OG SER A 46 -30.127 9.583 -3.468 1.00 0.00 O ATOM 0 H SER A 46 -29.962 6.766 -3.627 1.00 0.00 H new ATOM 0 HA SER A 46 -28.093 7.656 -5.335 1.00 0.00 H new ATOM 0 HB2 SER A 46 -29.354 9.767 -5.368 1.00 0.00 H new ATOM 0 HB3 SER A 46 -30.475 8.438 -5.144 1.00 0.00 H new ATOM 0 HG SER A 46 -29.856 9.032 -2.704 1.00 0.00 H new ATOM 713 N GLU A 47 -27.417 8.901 -2.376 1.00 0.00 N ATOM 714 CA GLU A 47 -26.382 9.598 -1.623 1.00 0.00 C ATOM 715 C GLU A 47 -25.057 8.857 -1.742 1.00 0.00 C ATOM 716 O GLU A 47 -24.003 9.466 -1.908 1.00 0.00 O ATOM 717 CB GLU A 47 -26.783 9.731 -0.150 1.00 0.00 C ATOM 718 CG GLU A 47 -27.771 10.858 0.117 1.00 0.00 C ATOM 719 CD GLU A 47 -29.175 10.564 -0.377 1.00 0.00 C ATOM 720 OE1 GLU A 47 -29.402 9.463 -0.908 1.00 0.00 O ATOM 721 OE2 GLU A 47 -30.050 11.443 -0.225 1.00 0.00 O ATOM 0 H GLU A 47 -28.159 8.499 -1.804 1.00 0.00 H new ATOM 0 HA GLU A 47 -26.266 10.598 -2.040 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -27.220 8.790 0.185 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -25.887 9.897 0.448 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -27.805 11.054 1.189 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -27.409 11.768 -0.362 1.00 0.00 H new ATOM 728 N ILE A 48 -25.132 7.533 -1.672 1.00 0.00 N ATOM 729 CA ILE A 48 -23.960 6.679 -1.787 1.00 0.00 C ATOM 730 C ILE A 48 -23.229 6.930 -3.099 1.00 0.00 C ATOM 731 O ILE A 48 -22.060 7.318 -3.109 1.00 0.00 O ATOM 732 CB ILE A 48 -24.350 5.186 -1.708 1.00 0.00 C ATOM 733 CG1 ILE A 48 -24.686 4.802 -0.278 1.00 0.00 C ATOM 734 CG2 ILE A 48 -23.230 4.302 -2.236 1.00 0.00 C ATOM 735 CD1 ILE A 48 -25.944 5.439 0.250 1.00 0.00 C ATOM 0 H ILE A 48 -26.005 7.024 -1.534 1.00 0.00 H new ATOM 0 HA ILE A 48 -23.301 6.923 -0.954 1.00 0.00 H new ATOM 0 HB ILE A 48 -25.231 5.034 -2.332 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -24.788 3.718 -0.218 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -23.852 5.080 0.367 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -23.530 3.256 -2.169 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -23.026 4.555 -3.276 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -22.330 4.460 -1.641 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -26.113 5.114 1.277 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -25.841 6.524 0.225 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -26.790 5.141 -0.369 1.00 0.00 H new ATOM 747 N LYS A 49 -23.928 6.702 -4.202 1.00 0.00 N ATOM 748 CA LYS A 49 -23.351 6.894 -5.520 1.00 0.00 C ATOM 749 C LYS A 49 -23.012 8.362 -5.740 1.00 0.00 C ATOM 750 O LYS A 49 -22.118 8.698 -6.522 1.00 0.00 O ATOM 751 CB LYS A 49 -24.329 6.418 -6.593 1.00 0.00 C ATOM 752 CG LYS A 49 -23.702 6.311 -7.970 1.00 0.00 C ATOM 753 CD LYS A 49 -24.743 6.025 -9.038 1.00 0.00 C ATOM 754 CE LYS A 49 -24.086 5.620 -10.344 1.00 0.00 C ATOM 755 NZ LYS A 49 -22.974 6.539 -10.710 1.00 0.00 N ATOM 0 H LYS A 49 -24.897 6.383 -4.208 1.00 0.00 H new ATOM 0 HA LYS A 49 -22.434 6.309 -5.589 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -24.727 5.445 -6.306 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -25.172 7.107 -6.638 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -23.183 7.240 -8.207 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -22.954 5.518 -7.969 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -25.407 5.230 -8.699 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -25.359 6.910 -9.196 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -23.704 4.603 -10.259 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -24.831 5.615 -11.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -22.561 6.240 -11.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.340 7.508 -10.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -22.243 6.511 -9.971 1.00 0.00 H new ATOM 769 N ASP A 50 -23.723 9.236 -5.032 1.00 0.00 N ATOM 770 CA ASP A 50 -23.488 10.671 -5.141 1.00 0.00 C ATOM 771 C ASP A 50 -22.165 11.021 -4.488 1.00 0.00 C ATOM 772 O ASP A 50 -21.423 11.873 -4.970 1.00 0.00 O ATOM 773 CB ASP A 50 -24.617 11.464 -4.479 1.00 0.00 C ATOM 774 CG ASP A 50 -24.457 12.964 -4.640 1.00 0.00 C ATOM 775 OD1 ASP A 50 -23.517 13.392 -5.345 1.00 0.00 O ATOM 776 OD2 ASP A 50 -25.276 13.712 -4.068 1.00 0.00 O ATOM 0 H ASP A 50 -24.463 8.976 -4.380 1.00 0.00 H new ATOM 0 HA ASP A 50 -23.458 10.936 -6.198 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -25.570 11.157 -4.909 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -24.652 11.219 -3.417 1.00 0.00 H new ATOM 781 N LEU A 51 -21.873 10.344 -3.387 1.00 0.00 N ATOM 782 CA LEU A 51 -20.641 10.564 -2.658 1.00 0.00 C ATOM 783 C LEU A 51 -19.478 9.902 -3.387 1.00 0.00 C ATOM 784 O LEU A 51 -18.327 10.293 -3.221 1.00 0.00 O ATOM 785 CB LEU A 51 -20.772 10.024 -1.231 1.00 0.00 C ATOM 786 CG LEU A 51 -19.548 10.226 -0.339 1.00 0.00 C ATOM 787 CD1 LEU A 51 -19.966 10.307 1.122 1.00 0.00 C ATOM 788 CD2 LEU A 51 -18.553 9.094 -0.531 1.00 0.00 C ATOM 0 H LEU A 51 -22.481 9.633 -2.980 1.00 0.00 H new ATOM 0 HA LEU A 51 -20.444 11.634 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -21.629 10.502 -0.757 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -20.991 8.957 -1.283 1.00 0.00 H new ATOM 0 HG LEU A 51 -19.069 11.163 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -19.084 10.451 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -20.648 11.146 1.259 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -20.466 9.382 1.409 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -17.689 9.256 0.113 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -19.025 8.146 -0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -18.230 9.066 -1.572 1.00 0.00 H new ATOM 800 N MET A 52 -19.791 8.904 -4.204 1.00 0.00 N ATOM 801 CA MET A 52 -18.775 8.195 -4.967 1.00 0.00 C ATOM 802 C MET A 52 -18.222 9.056 -6.097 1.00 0.00 C ATOM 803 O MET A 52 -17.018 9.107 -6.324 1.00 0.00 O ATOM 804 CB MET A 52 -19.352 6.907 -5.548 1.00 0.00 C ATOM 805 CG MET A 52 -19.556 5.805 -4.525 1.00 0.00 C ATOM 806 SD MET A 52 -18.031 5.363 -3.669 1.00 0.00 S ATOM 807 CE MET A 52 -18.564 3.940 -2.723 1.00 0.00 C ATOM 0 H MET A 52 -20.742 8.568 -4.354 1.00 0.00 H new ATOM 0 HA MET A 52 -17.959 7.957 -4.284 1.00 0.00 H new ATOM 0 HB2 MET A 52 -20.308 7.131 -6.021 1.00 0.00 H new ATOM 0 HB3 MET A 52 -18.686 6.543 -6.331 1.00 0.00 H new ATOM 0 HG2 MET A 52 -20.299 6.125 -3.794 1.00 0.00 H new ATOM 0 HG3 MET A 52 -19.958 4.922 -5.022 1.00 0.00 H new ATOM 0 HE1 MET A 52 -17.826 3.718 -1.952 1.00 0.00 H new ATOM 0 HE2 MET A 52 -19.525 4.154 -2.255 1.00 0.00 H new ATOM 0 HE3 MET A 52 -18.666 3.080 -3.385 1.00 0.00 H new ATOM 817 N ASP A 53 -19.106 9.719 -6.821 1.00 0.00 N ATOM 818 CA ASP A 53 -18.678 10.553 -7.939 1.00 0.00 C ATOM 819 C ASP A 53 -18.335 11.971 -7.495 1.00 0.00 C ATOM 820 O ASP A 53 -17.496 12.632 -8.106 1.00 0.00 O ATOM 821 CB ASP A 53 -19.763 10.590 -9.018 1.00 0.00 C ATOM 822 CG ASP A 53 -19.354 11.417 -10.221 1.00 0.00 C ATOM 823 OD1 ASP A 53 -18.327 11.083 -10.849 1.00 0.00 O ATOM 824 OD2 ASP A 53 -20.060 12.398 -10.535 1.00 0.00 O ATOM 0 H ASP A 53 -20.113 9.700 -6.661 1.00 0.00 H new ATOM 0 HA ASP A 53 -17.772 10.107 -8.350 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -19.987 9.573 -9.339 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -20.680 11.000 -8.594 1.00 0.00 H new ATOM 829 N ALA A 54 -18.999 12.444 -6.448 1.00 0.00 N ATOM 830 CA ALA A 54 -18.766 13.796 -5.955 1.00 0.00 C ATOM 831 C ALA A 54 -17.690 13.856 -4.868 1.00 0.00 C ATOM 832 O ALA A 54 -17.148 14.928 -4.597 1.00 0.00 O ATOM 833 CB ALA A 54 -20.064 14.400 -5.442 1.00 0.00 C ATOM 0 H ALA A 54 -19.699 11.916 -5.927 1.00 0.00 H new ATOM 0 HA ALA A 54 -18.397 14.380 -6.798 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -19.876 15.410 -5.077 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -20.793 14.437 -6.251 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -20.454 13.787 -4.630 1.00 0.00 H new ATOM 839 N ALA A 55 -17.389 12.725 -4.228 1.00 0.00 N ATOM 840 CA ALA A 55 -16.386 12.718 -3.161 1.00 0.00 C ATOM 841 C ALA A 55 -15.293 11.672 -3.369 1.00 0.00 C ATOM 842 O ALA A 55 -14.115 11.964 -3.168 1.00 0.00 O ATOM 843 CB ALA A 55 -17.056 12.516 -1.812 1.00 0.00 C ATOM 0 H ALA A 55 -17.815 11.819 -4.424 1.00 0.00 H new ATOM 0 HA ALA A 55 -15.895 13.691 -3.188 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -16.300 12.513 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -17.763 13.326 -1.632 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -17.587 11.564 -1.808 1.00 0.00 H new ATOM 849 N ASP A 56 -15.671 10.458 -3.764 1.00 0.00 N ATOM 850 CA ASP A 56 -14.684 9.406 -3.982 1.00 0.00 C ATOM 851 C ASP A 56 -13.717 9.829 -5.085 1.00 0.00 C ATOM 852 O ASP A 56 -14.007 9.681 -6.274 1.00 0.00 O ATOM 853 CB ASP A 56 -15.366 8.078 -4.335 1.00 0.00 C ATOM 854 CG ASP A 56 -14.397 6.912 -4.361 1.00 0.00 C ATOM 855 OD1 ASP A 56 -13.329 7.041 -4.988 1.00 0.00 O ATOM 856 OD2 ASP A 56 -14.715 5.863 -3.767 1.00 0.00 O ATOM 0 H ASP A 56 -16.638 10.182 -3.937 1.00 0.00 H new ATOM 0 HA ASP A 56 -14.124 9.254 -3.059 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -16.154 7.875 -3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -15.846 8.168 -5.310 1.00 0.00 H new ATOM 861 N ILE A 57 -12.580 10.379 -4.670 1.00 0.00 N ATOM 862 CA ILE A 57 -11.554 10.865 -5.592 1.00 0.00 C ATOM 863 C ILE A 57 -11.221 9.838 -6.671 1.00 0.00 C ATOM 864 O ILE A 57 -10.715 10.186 -7.738 1.00 0.00 O ATOM 865 CB ILE A 57 -10.262 11.224 -4.830 1.00 0.00 C ATOM 866 CG1 ILE A 57 -10.587 12.089 -3.608 1.00 0.00 C ATOM 867 CG2 ILE A 57 -9.281 11.939 -5.750 1.00 0.00 C ATOM 868 CD1 ILE A 57 -11.265 13.400 -3.946 1.00 0.00 C ATOM 0 H ILE A 57 -12.342 10.501 -3.686 1.00 0.00 H new ATOM 0 HA ILE A 57 -11.962 11.754 -6.073 1.00 0.00 H new ATOM 0 HB ILE A 57 -9.795 10.302 -4.484 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -11.230 11.522 -2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -9.664 12.298 -3.067 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.375 12.185 -5.196 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -9.028 11.289 -6.588 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -9.736 12.855 -6.126 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -11.462 13.955 -3.029 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -10.616 13.989 -4.594 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -12.206 13.201 -4.459 1.00 0.00 H new ATOM 880 N ASP A 58 -11.500 8.573 -6.385 1.00 0.00 N ATOM 881 CA ASP A 58 -11.219 7.494 -7.332 1.00 0.00 C ATOM 882 C ASP A 58 -12.451 6.618 -7.537 1.00 0.00 C ATOM 883 O ASP A 58 -12.357 5.392 -7.496 1.00 0.00 O ATOM 884 CB ASP A 58 -10.044 6.647 -6.837 1.00 0.00 C ATOM 885 CG ASP A 58 -9.567 5.642 -7.870 1.00 0.00 C ATOM 886 OD1 ASP A 58 -10.122 5.628 -8.989 1.00 0.00 O ATOM 887 OD2 ASP A 58 -8.634 4.872 -7.559 1.00 0.00 O ATOM 0 H ASP A 58 -11.920 8.266 -5.508 1.00 0.00 H new ATOM 0 HA ASP A 58 -10.953 7.941 -8.290 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.217 7.304 -6.567 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.340 6.118 -5.931 1.00 0.00 H new ATOM 892 N LYS A 59 -13.608 7.264 -7.702 1.00 0.00 N ATOM 893 CA LYS A 59 -14.885 6.578 -7.854 1.00 0.00 C ATOM 894 C LYS A 59 -14.751 5.239 -8.572 1.00 0.00 C ATOM 895 O LYS A 59 -14.860 5.146 -9.795 1.00 0.00 O ATOM 896 CB LYS A 59 -15.885 7.477 -8.586 1.00 0.00 C ATOM 897 CG LYS A 59 -17.340 7.011 -8.497 1.00 0.00 C ATOM 898 CD LYS A 59 -17.609 5.773 -9.338 1.00 0.00 C ATOM 899 CE LYS A 59 -19.052 5.310 -9.213 1.00 0.00 C ATOM 900 NZ LYS A 59 -19.396 4.928 -7.816 1.00 0.00 N ATOM 0 H LYS A 59 -13.681 8.281 -7.733 1.00 0.00 H new ATOM 0 HA LYS A 59 -15.254 6.364 -6.851 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -15.814 8.485 -8.178 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.599 7.537 -9.636 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -17.587 6.800 -7.457 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -17.997 7.817 -8.823 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -17.385 5.987 -10.383 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -16.941 4.970 -9.027 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -19.718 6.106 -9.546 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -19.218 4.459 -9.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -19.848 3.991 -7.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -18.530 4.896 -7.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -20.051 5.629 -7.416 1.00 0.00 H new ATOM 914 N SER A 60 -14.541 4.208 -7.768 1.00 0.00 N ATOM 915 CA SER A 60 -14.423 2.840 -8.247 1.00 0.00 C ATOM 916 C SER A 60 -15.393 1.975 -7.455 1.00 0.00 C ATOM 917 O SER A 60 -15.270 0.751 -7.398 1.00 0.00 O ATOM 918 CB SER A 60 -12.992 2.327 -8.080 1.00 0.00 C ATOM 919 OG SER A 60 -12.597 2.348 -6.719 1.00 0.00 O ATOM 0 H SER A 60 -14.447 4.298 -6.756 1.00 0.00 H new ATOM 0 HA SER A 60 -14.664 2.799 -9.309 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.919 1.311 -8.467 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.311 2.942 -8.669 1.00 0.00 H new ATOM 0 HG SER A 60 -12.395 3.269 -6.451 1.00 0.00 H new ATOM 925 N GLY A 61 -16.352 2.652 -6.826 1.00 0.00 N ATOM 926 CA GLY A 61 -17.341 1.978 -6.006 1.00 0.00 C ATOM 927 C GLY A 61 -16.729 1.448 -4.727 1.00 0.00 C ATOM 928 O GLY A 61 -17.308 0.582 -4.065 1.00 0.00 O ATOM 0 H GLY A 61 -16.460 3.665 -6.872 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -18.149 2.669 -5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -17.782 1.155 -6.568 1.00 0.00 H new ATOM 932 N THR A 62 -15.551 1.978 -4.387 1.00 0.00 N ATOM 933 CA THR A 62 -14.827 1.574 -3.192 1.00 0.00 C ATOM 934 C THR A 62 -13.985 2.735 -2.655 1.00 0.00 C ATOM 935 O THR A 62 -13.203 3.335 -3.391 1.00 0.00 O ATOM 936 CB THR A 62 -13.919 0.386 -3.517 1.00 0.00 C ATOM 937 OG1 THR A 62 -14.674 -0.705 -4.010 1.00 0.00 O ATOM 938 CG2 THR A 62 -13.124 -0.107 -2.328 1.00 0.00 C ATOM 0 H THR A 62 -15.078 2.697 -4.935 1.00 0.00 H new ATOM 0 HA THR A 62 -15.548 1.284 -2.428 1.00 0.00 H new ATOM 0 HB THR A 62 -13.223 0.757 -4.269 1.00 0.00 H new ATOM 0 HG1 THR A 62 -14.302 -1.543 -3.664 1.00 0.00 H new ATOM 0 HG21 THR A 62 -12.502 -0.950 -2.630 1.00 0.00 H new ATOM 0 HG22 THR A 62 -12.489 0.697 -1.956 1.00 0.00 H new ATOM 0 HG23 THR A 62 -13.807 -0.424 -1.540 1.00 0.00 H new ATOM 946 N ILE A 63 -14.155 3.049 -1.370 1.00 0.00 N ATOM 947 CA ILE A 63 -13.419 4.136 -0.748 1.00 0.00 C ATOM 948 C ILE A 63 -12.361 3.612 0.209 1.00 0.00 C ATOM 949 O ILE A 63 -12.645 2.795 1.083 1.00 0.00 O ATOM 950 CB ILE A 63 -14.351 5.093 0.024 1.00 0.00 C ATOM 951 CG1 ILE A 63 -15.277 5.834 -0.939 1.00 0.00 C ATOM 952 CG2 ILE A 63 -13.538 6.083 0.848 1.00 0.00 C ATOM 953 CD1 ILE A 63 -16.254 6.759 -0.247 1.00 0.00 C ATOM 0 H ILE A 63 -14.797 2.562 -0.745 1.00 0.00 H new ATOM 0 HA ILE A 63 -12.939 4.683 -1.560 1.00 0.00 H new ATOM 0 HB ILE A 63 -14.963 4.500 0.703 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.673 6.413 -1.637 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -15.834 5.105 -1.528 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -14.213 6.750 1.385 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -12.919 5.540 1.562 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -12.900 6.669 0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.879 7.251 -0.992 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -16.883 6.182 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -15.704 7.511 0.319 1.00 0.00 H new ATOM 965 N ASP A 64 -11.144 4.104 0.045 1.00 0.00 N ATOM 966 CA ASP A 64 -10.042 3.702 0.900 1.00 0.00 C ATOM 967 C ASP A 64 -9.717 4.809 1.887 1.00 0.00 C ATOM 968 O ASP A 64 -10.203 5.928 1.746 1.00 0.00 O ATOM 969 CB ASP A 64 -8.809 3.340 0.069 1.00 0.00 C ATOM 970 CG ASP A 64 -9.075 2.199 -0.894 1.00 0.00 C ATOM 971 OD1 ASP A 64 -9.436 1.100 -0.426 1.00 0.00 O ATOM 972 OD2 ASP A 64 -8.923 2.406 -2.116 1.00 0.00 O ATOM 0 H ASP A 64 -10.895 4.783 -0.674 1.00 0.00 H new ATOM 0 HA ASP A 64 -10.343 2.814 1.456 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.482 4.216 -0.491 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.992 3.065 0.737 1.00 0.00 H new ATOM 977 N TYR A 65 -8.910 4.482 2.895 1.00 0.00 N ATOM 978 CA TYR A 65 -8.530 5.441 3.927 1.00 0.00 C ATOM 979 C TYR A 65 -8.369 6.844 3.353 1.00 0.00 C ATOM 980 O TYR A 65 -8.862 7.817 3.924 1.00 0.00 O ATOM 981 CB TYR A 65 -7.226 5.010 4.598 1.00 0.00 C ATOM 982 CG TYR A 65 -6.753 5.974 5.658 1.00 0.00 C ATOM 983 CD1 TYR A 65 -7.542 6.260 6.764 1.00 0.00 C ATOM 984 CD2 TYR A 65 -5.520 6.604 5.550 1.00 0.00 C ATOM 985 CE1 TYR A 65 -7.116 7.145 7.733 1.00 0.00 C ATOM 986 CE2 TYR A 65 -5.085 7.491 6.514 1.00 0.00 C ATOM 987 CZ TYR A 65 -5.886 7.759 7.604 1.00 0.00 C ATOM 988 OH TYR A 65 -5.458 8.642 8.569 1.00 0.00 O ATOM 0 H TYR A 65 -8.505 3.554 3.018 1.00 0.00 H new ATOM 0 HA TYR A 65 -9.331 5.463 4.666 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -7.364 4.026 5.047 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -6.451 4.907 3.838 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -8.505 5.782 6.868 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -4.891 6.396 4.697 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -7.741 7.356 8.588 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -4.123 7.972 6.415 1.00 0.00 H new ATOM 0 HH TYR A 65 -4.572 8.985 8.329 1.00 0.00 H new ATOM 998 N GLY A 66 -7.681 6.943 2.221 1.00 0.00 N ATOM 999 CA GLY A 66 -7.478 8.234 1.599 1.00 0.00 C ATOM 1000 C GLY A 66 -8.778 8.861 1.136 1.00 0.00 C ATOM 1001 O GLY A 66 -9.176 9.915 1.633 1.00 0.00 O ATOM 0 H GLY A 66 -7.263 6.155 1.726 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.987 8.902 2.306 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.807 8.123 0.747 1.00 0.00 H new ATOM 1005 N GLU A 67 -9.442 8.210 0.183 1.00 0.00 N ATOM 1006 CA GLU A 67 -10.707 8.704 -0.346 1.00 0.00 C ATOM 1007 C GLU A 67 -11.692 8.998 0.783 1.00 0.00 C ATOM 1008 O GLU A 67 -12.583 9.836 0.637 1.00 0.00 O ATOM 1009 CB GLU A 67 -11.300 7.669 -1.302 1.00 0.00 C ATOM 1010 CG GLU A 67 -10.309 7.175 -2.344 1.00 0.00 C ATOM 1011 CD GLU A 67 -10.869 6.058 -3.203 1.00 0.00 C ATOM 1012 OE1 GLU A 67 -12.056 5.713 -3.028 1.00 0.00 O ATOM 1013 OE2 GLU A 67 -10.120 5.530 -4.049 1.00 0.00 O ATOM 0 H GLU A 67 -9.122 7.338 -0.238 1.00 0.00 H new ATOM 0 HA GLU A 67 -10.521 9.633 -0.884 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -11.664 6.819 -0.725 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.162 8.104 -1.808 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.016 8.007 -2.984 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.406 6.825 -1.843 1.00 0.00 H new ATOM 1020 N PHE A 68 -11.522 8.309 1.911 1.00 0.00 N ATOM 1021 CA PHE A 68 -12.387 8.496 3.064 1.00 0.00 C ATOM 1022 C PHE A 68 -12.256 9.901 3.615 1.00 0.00 C ATOM 1023 O PHE A 68 -13.205 10.681 3.613 1.00 0.00 O ATOM 1024 CB PHE A 68 -12.003 7.523 4.172 1.00 0.00 C ATOM 1025 CG PHE A 68 -12.906 7.599 5.364 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -14.213 7.163 5.268 1.00 0.00 C ATOM 1027 CD2 PHE A 68 -12.457 8.111 6.569 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -15.060 7.233 6.354 1.00 0.00 C ATOM 1029 CE2 PHE A 68 -13.301 8.189 7.658 1.00 0.00 C ATOM 1030 CZ PHE A 68 -14.605 7.750 7.550 1.00 0.00 C ATOM 0 H PHE A 68 -10.788 7.614 2.046 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.412 8.320 2.737 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.019 6.507 3.776 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.979 7.726 4.486 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.575 6.763 4.333 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.436 8.453 6.658 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.078 6.884 6.269 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -12.942 8.593 8.593 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.268 7.811 8.400 1.00 0.00 H new ATOM 1040 N ILE A 69 -11.065 10.186 4.114 1.00 0.00 N ATOM 1041 CA ILE A 69 -10.763 11.471 4.714 1.00 0.00 C ATOM 1042 C ILE A 69 -11.134 12.626 3.788 1.00 0.00 C ATOM 1043 O ILE A 69 -11.676 13.637 4.236 1.00 0.00 O ATOM 1044 CB ILE A 69 -9.275 11.572 5.086 1.00 0.00 C ATOM 1045 CG1 ILE A 69 -8.779 10.276 5.742 1.00 0.00 C ATOM 1046 CG2 ILE A 69 -9.073 12.733 6.030 1.00 0.00 C ATOM 1047 CD1 ILE A 69 -9.534 9.895 6.998 1.00 0.00 C ATOM 0 H ILE A 69 -10.282 9.532 4.114 1.00 0.00 H new ATOM 0 HA ILE A 69 -11.364 11.545 5.620 1.00 0.00 H new ATOM 0 HB ILE A 69 -8.700 11.731 4.174 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.859 9.462 5.021 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -7.722 10.385 5.984 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -8.018 12.807 6.295 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.391 13.656 5.545 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.664 12.575 6.932 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.125 8.969 7.402 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -9.434 10.689 7.738 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -10.588 9.752 6.760 1.00 0.00 H new ATOM 1059 N ALA A 70 -10.850 12.472 2.499 1.00 0.00 N ATOM 1060 CA ALA A 70 -11.169 13.509 1.523 1.00 0.00 C ATOM 1061 C ALA A 70 -12.679 13.657 1.372 1.00 0.00 C ATOM 1062 O ALA A 70 -13.179 14.720 1.002 1.00 0.00 O ATOM 1063 CB ALA A 70 -10.527 13.190 0.180 1.00 0.00 C ATOM 0 H ALA A 70 -10.402 11.644 2.107 1.00 0.00 H new ATOM 0 HA ALA A 70 -10.766 14.456 1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -10.775 13.973 -0.537 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.445 13.135 0.298 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -10.901 12.233 -0.184 1.00 0.00 H new ATOM 1069 N ALA A 71 -13.395 12.577 1.666 1.00 0.00 N ATOM 1070 CA ALA A 71 -14.851 12.569 1.575 1.00 0.00 C ATOM 1071 C ALA A 71 -15.486 12.871 2.929 1.00 0.00 C ATOM 1072 O ALA A 71 -16.686 13.129 3.018 1.00 0.00 O ATOM 1073 CB ALA A 71 -15.340 11.228 1.045 1.00 0.00 C ATOM 0 H ALA A 71 -12.989 11.692 1.971 1.00 0.00 H new ATOM 0 HA ALA A 71 -15.152 13.352 0.879 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -16.428 11.236 0.982 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -14.921 11.054 0.054 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -15.022 10.432 1.719 1.00 0.00 H new ATOM 1303 N VAL A 85 -31.736 16.655 -2.959 1.00 0.00 N ATOM 1304 CA VAL A 85 -30.696 17.298 -3.751 1.00 0.00 C ATOM 1305 C VAL A 85 -29.555 16.334 -4.076 1.00 0.00 C ATOM 1306 O VAL A 85 -28.887 16.477 -5.102 1.00 0.00 O ATOM 1307 CB VAL A 85 -30.136 18.543 -3.040 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -29.435 18.158 -1.749 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -29.206 19.312 -3.965 1.00 0.00 C ATOM 0 HA VAL A 85 -31.163 17.608 -4.686 1.00 0.00 H new ATOM 0 HB VAL A 85 -30.969 19.197 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -29.047 19.054 -1.264 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -30.143 17.663 -1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -28.611 17.480 -1.971 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -28.820 20.189 -3.446 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -28.376 18.671 -4.262 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -29.755 19.628 -4.852 1.00 0.00 H new ATOM 1319 N SER A 86 -29.349 15.344 -3.209 1.00 0.00 N ATOM 1320 CA SER A 86 -28.303 14.351 -3.421 1.00 0.00 C ATOM 1321 C SER A 86 -28.413 13.763 -4.822 1.00 0.00 C ATOM 1322 O SER A 86 -27.461 13.803 -5.602 1.00 0.00 O ATOM 1323 CB SER A 86 -28.402 13.239 -2.375 1.00 0.00 C ATOM 1324 OG SER A 86 -28.262 13.758 -1.064 1.00 0.00 O ATOM 0 H SER A 86 -29.892 15.210 -2.356 1.00 0.00 H new ATOM 0 HA SER A 86 -27.334 14.840 -3.318 1.00 0.00 H new ATOM 0 HB2 SER A 86 -29.363 12.732 -2.468 1.00 0.00 H new ATOM 0 HB3 SER A 86 -27.629 12.493 -2.559 1.00 0.00 H new ATOM 0 HG SER A 86 -28.878 13.293 -0.460 1.00 0.00 H new ATOM 1330 N ALA A 87 -29.592 13.239 -5.143 1.00 0.00 N ATOM 1331 CA ALA A 87 -29.838 12.669 -6.460 1.00 0.00 C ATOM 1332 C ALA A 87 -30.154 13.776 -7.452 1.00 0.00 C ATOM 1333 O ALA A 87 -29.697 13.748 -8.592 1.00 0.00 O ATOM 1334 CB ALA A 87 -30.971 11.660 -6.406 1.00 0.00 C ATOM 0 H ALA A 87 -30.390 13.198 -4.509 1.00 0.00 H new ATOM 0 HA ALA A 87 -28.939 12.148 -6.789 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -31.138 11.247 -7.401 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -30.710 10.856 -5.718 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -31.880 12.152 -6.060 1.00 0.00 H new ATOM 1340 N PHE A 88 -30.924 14.763 -6.998 1.00 0.00 N ATOM 1341 CA PHE A 88 -31.287 15.908 -7.829 1.00 0.00 C ATOM 1342 C PHE A 88 -30.059 16.437 -8.553 1.00 0.00 C ATOM 1343 O PHE A 88 -30.159 17.087 -9.590 1.00 0.00 O ATOM 1344 CB PHE A 88 -31.893 17.011 -6.965 1.00 0.00 C ATOM 1345 CG PHE A 88 -32.802 17.917 -7.727 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -33.977 17.424 -8.252 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -32.485 19.252 -7.925 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -34.825 18.237 -8.966 1.00 0.00 C ATOM 1349 CE2 PHE A 88 -33.333 20.075 -8.638 1.00 0.00 C ATOM 1350 CZ PHE A 88 -34.507 19.567 -9.161 1.00 0.00 C ATOM 0 H PHE A 88 -31.310 14.792 -6.054 1.00 0.00 H new ATOM 0 HA PHE A 88 -32.024 15.588 -8.565 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -32.447 16.558 -6.143 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -31.090 17.600 -6.522 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -34.235 16.386 -8.101 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -31.568 19.651 -7.518 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -35.740 17.836 -9.375 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -33.080 21.114 -8.787 1.00 0.00 H new ATOM 0 HZ PHE A 88 -35.173 20.207 -9.720 1.00 0.00 H new ATOM 1360 N SER A 89 -28.897 16.148 -7.996 1.00 0.00 N ATOM 1361 CA SER A 89 -27.651 16.578 -8.590 1.00 0.00 C ATOM 1362 C SER A 89 -27.136 15.537 -9.581 1.00 0.00 C ATOM 1363 O SER A 89 -26.710 15.880 -10.684 1.00 0.00 O ATOM 1364 CB SER A 89 -26.622 16.841 -7.501 1.00 0.00 C ATOM 1365 OG SER A 89 -25.427 17.379 -8.040 1.00 0.00 O ATOM 0 H SER A 89 -28.793 15.616 -7.132 1.00 0.00 H new ATOM 0 HA SER A 89 -27.825 17.504 -9.138 1.00 0.00 H new ATOM 0 HB2 SER A 89 -27.035 17.532 -6.766 1.00 0.00 H new ATOM 0 HB3 SER A 89 -26.400 15.912 -6.975 1.00 0.00 H new ATOM 0 HG SER A 89 -24.785 17.539 -7.317 1.00 0.00 H new ATOM 1371 N TYR A 90 -27.181 14.263 -9.187 1.00 0.00 N ATOM 1372 CA TYR A 90 -26.720 13.189 -10.049 1.00 0.00 C ATOM 1373 C TYR A 90 -27.867 12.686 -10.926 1.00 0.00 C ATOM 1374 O TYR A 90 -27.830 12.837 -12.147 1.00 0.00 O ATOM 1375 CB TYR A 90 -26.162 12.057 -9.198 1.00 0.00 C ATOM 1376 CG TYR A 90 -25.129 11.226 -9.920 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -23.827 11.689 -10.058 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -25.452 9.996 -10.473 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -22.872 10.950 -10.724 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -24.503 9.247 -11.143 1.00 0.00 C ATOM 1381 CZ TYR A 90 -23.215 9.729 -11.266 1.00 0.00 C ATOM 1382 OH TYR A 90 -22.267 8.984 -11.933 1.00 0.00 O ATOM 0 H TYR A 90 -27.532 13.957 -8.279 1.00 0.00 H new ATOM 0 HA TYR A 90 -25.931 13.564 -10.701 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -25.717 12.475 -8.295 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -26.981 11.412 -8.880 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -23.557 12.646 -9.636 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -26.459 9.618 -10.379 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -21.864 11.324 -10.820 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -24.768 8.290 -11.568 1.00 0.00 H new ATOM 0 HH TYR A 90 -21.381 9.168 -11.556 1.00 0.00 H new ATOM 1392 N PHE A 91 -28.903 12.127 -10.292 1.00 0.00 N ATOM 1393 CA PHE A 91 -30.080 11.653 -11.021 1.00 0.00 C ATOM 1394 C PHE A 91 -30.576 12.783 -11.911 1.00 0.00 C ATOM 1395 O PHE A 91 -30.538 12.677 -13.137 1.00 0.00 O ATOM 1396 CB PHE A 91 -31.179 11.197 -10.056 1.00 0.00 C ATOM 1397 CG PHE A 91 -30.891 9.885 -9.379 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -29.645 9.624 -8.823 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -31.871 8.908 -9.297 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -29.386 8.417 -8.201 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -31.616 7.700 -8.676 1.00 0.00 C ATOM 1402 CZ PHE A 91 -30.373 7.454 -8.128 1.00 0.00 C ATOM 0 H PHE A 91 -28.949 11.993 -9.282 1.00 0.00 H new ATOM 0 HA PHE A 91 -29.812 10.790 -11.631 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -31.321 11.964 -9.295 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -32.118 11.114 -10.604 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -28.869 10.373 -8.877 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -32.846 9.093 -9.724 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -28.413 8.227 -7.773 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -32.389 6.948 -8.619 1.00 0.00 H new ATOM 0 HZ PHE A 91 -30.173 6.510 -7.643 1.00 0.00 H new ATOM 1412 N ASP A 92 -30.981 13.888 -11.279 1.00 0.00 N ATOM 1413 CA ASP A 92 -31.403 15.081 -12.011 1.00 0.00 C ATOM 1414 C ASP A 92 -30.148 15.774 -12.530 1.00 0.00 C ATOM 1415 O ASP A 92 -29.889 16.937 -12.225 1.00 0.00 O ATOM 1416 CB ASP A 92 -32.182 16.029 -11.092 1.00 0.00 C ATOM 1417 CG ASP A 92 -33.683 15.966 -11.288 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -34.158 16.402 -12.358 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -34.382 15.474 -10.379 1.00 0.00 O ATOM 0 H ASP A 92 -31.025 13.979 -10.264 1.00 0.00 H new ATOM 0 HA ASP A 92 -32.058 14.802 -12.836 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -31.949 15.789 -10.055 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -31.844 17.050 -11.267 1.00 0.00 H new ATOM 1424 N LYS A 93 -29.346 15.014 -13.271 1.00 0.00 N ATOM 1425 CA LYS A 93 -28.084 15.486 -13.807 1.00 0.00 C ATOM 1426 C LYS A 93 -28.194 16.880 -14.413 1.00 0.00 C ATOM 1427 O LYS A 93 -27.426 17.774 -14.060 1.00 0.00 O ATOM 1428 CB LYS A 93 -27.569 14.485 -14.838 1.00 0.00 C ATOM 1429 CG LYS A 93 -26.134 14.734 -15.277 1.00 0.00 C ATOM 1430 CD LYS A 93 -25.592 13.574 -16.097 1.00 0.00 C ATOM 1431 CE LYS A 93 -25.484 12.302 -15.265 1.00 0.00 C ATOM 1432 NZ LYS A 93 -24.500 12.445 -14.156 1.00 0.00 N ATOM 0 H LYS A 93 -29.560 14.047 -13.515 1.00 0.00 H new ATOM 0 HA LYS A 93 -27.375 15.564 -12.983 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -27.642 13.480 -14.422 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -28.217 14.515 -15.714 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -26.086 15.650 -15.865 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -25.505 14.886 -14.400 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -26.244 13.396 -16.952 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -24.611 13.835 -16.493 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -26.462 12.054 -14.853 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -25.189 11.472 -15.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -24.278 11.507 -13.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -23.629 12.883 -14.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -24.904 13.045 -13.408 1.00 0.00 H new ATOM 1446 N ASP A 94 -29.143 17.070 -15.321 1.00 0.00 N ATOM 1447 CA ASP A 94 -29.320 18.371 -15.950 1.00 0.00 C ATOM 1448 C ASP A 94 -29.833 19.385 -14.934 1.00 0.00 C ATOM 1449 O ASP A 94 -29.683 20.594 -15.121 1.00 0.00 O ATOM 1450 CB ASP A 94 -30.295 18.269 -17.124 1.00 0.00 C ATOM 1451 CG ASP A 94 -30.495 19.599 -17.824 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -29.498 20.156 -18.333 1.00 0.00 O ATOM 1453 OD2 ASP A 94 -31.645 20.085 -17.861 1.00 0.00 O ATOM 0 H ASP A 94 -29.794 16.350 -15.635 1.00 0.00 H new ATOM 0 HA ASP A 94 -28.353 18.706 -16.325 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -29.922 17.537 -17.840 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -31.256 17.902 -16.764 1.00 0.00 H new ATOM 1458 N GLY A 95 -30.437 18.878 -13.858 1.00 0.00 N ATOM 1459 CA GLY A 95 -30.966 19.745 -12.833 1.00 0.00 C ATOM 1460 C GLY A 95 -31.771 20.863 -13.446 1.00 0.00 C ATOM 1461 O GLY A 95 -31.405 22.037 -13.380 1.00 0.00 O ATOM 0 H GLY A 95 -30.566 17.881 -13.685 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -31.593 19.170 -12.151 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -30.149 20.160 -12.243 1.00 0.00 H new ATOM 1465 N SER A 96 -32.897 20.470 -14.006 1.00 0.00 N ATOM 1466 CA SER A 96 -33.841 21.387 -14.610 1.00 0.00 C ATOM 1467 C SER A 96 -35.102 21.300 -13.788 1.00 0.00 C ATOM 1468 O SER A 96 -35.919 22.221 -13.735 1.00 0.00 O ATOM 1469 CB SER A 96 -34.112 21.007 -16.068 1.00 0.00 C ATOM 1470 OG SER A 96 -34.532 19.658 -16.173 1.00 0.00 O ATOM 0 H SER A 96 -33.185 19.493 -14.055 1.00 0.00 H new ATOM 0 HA SER A 96 -33.450 22.404 -14.621 1.00 0.00 H new ATOM 0 HB2 SER A 96 -34.878 21.663 -16.482 1.00 0.00 H new ATOM 0 HB3 SER A 96 -33.209 21.157 -16.660 1.00 0.00 H new ATOM 0 HG SER A 96 -35.254 19.590 -16.832 1.00 0.00 H new ATOM 1476 N GLY A 97 -35.211 20.160 -13.119 1.00 0.00 N ATOM 1477 CA GLY A 97 -36.315 19.889 -12.250 1.00 0.00 C ATOM 1478 C GLY A 97 -36.945 18.540 -12.514 1.00 0.00 C ATOM 1479 O GLY A 97 -37.842 18.126 -11.793 1.00 0.00 O ATOM 0 H GLY A 97 -34.528 19.405 -13.173 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -35.977 19.932 -11.215 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -37.068 20.668 -12.372 1.00 0.00 H new ATOM 1483 N TYR A 98 -36.464 17.853 -13.548 1.00 0.00 N ATOM 1484 CA TYR A 98 -36.982 16.534 -13.895 1.00 0.00 C ATOM 1485 C TYR A 98 -35.920 15.629 -14.517 1.00 0.00 C ATOM 1486 O TYR A 98 -34.872 16.088 -14.970 1.00 0.00 O ATOM 1487 CB TYR A 98 -38.184 16.635 -14.821 1.00 0.00 C ATOM 1488 CG TYR A 98 -38.020 17.591 -15.977 1.00 0.00 C ATOM 1489 CD1 TYR A 98 -36.953 17.484 -16.858 1.00 0.00 C ATOM 1490 CD2 TYR A 98 -38.952 18.593 -16.193 1.00 0.00 C ATOM 1491 CE1 TYR A 98 -36.819 18.353 -17.920 1.00 0.00 C ATOM 1492 CE2 TYR A 98 -38.828 19.464 -17.252 1.00 0.00 C ATOM 1493 CZ TYR A 98 -37.759 19.342 -18.115 1.00 0.00 C ATOM 1494 OH TYR A 98 -37.632 20.210 -19.175 1.00 0.00 O ATOM 0 H TYR A 98 -35.718 18.188 -14.158 1.00 0.00 H new ATOM 0 HA TYR A 98 -37.295 16.078 -12.956 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -38.403 15.643 -15.217 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -39.050 16.942 -14.235 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -36.216 16.708 -16.709 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -39.790 18.693 -15.519 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -35.982 18.259 -18.596 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -39.564 20.239 -17.406 1.00 0.00 H new ATOM 0 HH TYR A 98 -38.378 20.845 -19.169 1.00 0.00 H new ATOM 1504 N ILE A 99 -36.213 14.329 -14.503 1.00 0.00 N ATOM 1505 CA ILE A 99 -35.318 13.307 -15.029 1.00 0.00 C ATOM 1506 C ILE A 99 -36.052 12.317 -15.922 1.00 0.00 C ATOM 1507 O ILE A 99 -36.733 11.426 -15.427 1.00 0.00 O ATOM 1508 CB ILE A 99 -34.679 12.521 -13.872 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -34.164 13.478 -12.825 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -33.556 11.634 -14.378 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -33.773 12.786 -11.540 1.00 0.00 C ATOM 0 H ILE A 99 -37.083 13.957 -14.124 1.00 0.00 H new ATOM 0 HA ILE A 99 -34.557 13.821 -15.617 1.00 0.00 H new ATOM 0 HB ILE A 99 -35.439 11.881 -13.424 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -33.301 14.013 -13.221 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -34.930 14.223 -12.612 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -33.119 11.088 -13.542 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -33.951 10.926 -15.107 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -32.790 12.250 -14.849 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -33.410 13.524 -10.825 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -34.641 12.274 -11.124 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.986 12.060 -11.743 1.00 0.00 H new ATOM 1523 N THR A 100 -35.885 12.429 -17.223 1.00 0.00 N ATOM 1524 CA THR A 100 -36.524 11.487 -18.126 1.00 0.00 C ATOM 1525 C THR A 100 -35.813 10.145 -18.016 1.00 0.00 C ATOM 1526 O THR A 100 -34.617 10.119 -17.731 1.00 0.00 O ATOM 1527 CB THR A 100 -36.469 12.007 -19.561 1.00 0.00 C ATOM 1528 OG1 THR A 100 -35.128 12.094 -20.010 1.00 0.00 O ATOM 1529 CG2 THR A 100 -37.095 13.376 -19.716 1.00 0.00 C ATOM 0 H THR A 100 -35.323 13.149 -17.676 1.00 0.00 H new ATOM 0 HA THR A 100 -37.572 11.367 -17.853 1.00 0.00 H new ATOM 0 HB THR A 100 -37.037 11.292 -20.156 1.00 0.00 H new ATOM 0 HG1 THR A 100 -34.992 11.474 -20.757 1.00 0.00 H new ATOM 0 HG21 THR A 100 -37.026 13.692 -20.757 1.00 0.00 H new ATOM 0 HG22 THR A 100 -38.143 13.333 -19.419 1.00 0.00 H new ATOM 0 HG23 THR A 100 -36.568 14.091 -19.084 1.00 0.00 H new ATOM 1537 N LEU A 101 -36.545 9.038 -18.179 1.00 0.00 N ATOM 1538 CA LEU A 101 -35.959 7.701 -18.040 1.00 0.00 C ATOM 1539 C LEU A 101 -34.517 7.653 -18.529 1.00 0.00 C ATOM 1540 O LEU A 101 -33.692 6.932 -17.973 1.00 0.00 O ATOM 1541 CB LEU A 101 -36.788 6.694 -18.831 1.00 0.00 C ATOM 1542 CG LEU A 101 -36.931 7.001 -20.322 1.00 0.00 C ATOM 1543 CD1 LEU A 101 -35.805 6.351 -21.116 1.00 0.00 C ATOM 1544 CD2 LEU A 101 -38.289 6.545 -20.836 1.00 0.00 C ATOM 0 H LEU A 101 -37.539 9.041 -18.406 1.00 0.00 H new ATOM 0 HA LEU A 101 -35.963 7.451 -16.979 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -36.336 5.708 -18.721 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -37.783 6.640 -18.390 1.00 0.00 H new ATOM 0 HG LEU A 101 -36.862 8.080 -20.457 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -35.926 6.582 -22.174 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -34.846 6.735 -20.768 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -35.837 5.271 -20.974 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -38.371 6.772 -21.899 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -38.393 5.470 -20.686 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -39.077 7.065 -20.292 1.00 0.00 H new ATOM 1556 N ASP A 102 -34.211 8.430 -19.551 1.00 0.00 N ATOM 1557 CA ASP A 102 -32.855 8.481 -20.079 1.00 0.00 C ATOM 1558 C ASP A 102 -31.867 8.810 -18.959 1.00 0.00 C ATOM 1559 O ASP A 102 -30.928 8.059 -18.714 1.00 0.00 O ATOM 1560 CB ASP A 102 -32.750 9.522 -21.194 1.00 0.00 C ATOM 1561 CG ASP A 102 -33.714 9.249 -22.330 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -33.624 8.161 -22.936 1.00 0.00 O ATOM 1563 OD2 ASP A 102 -34.558 10.124 -22.615 1.00 0.00 O ATOM 0 H ASP A 102 -34.878 9.033 -20.032 1.00 0.00 H new ATOM 0 HA ASP A 102 -32.609 7.504 -20.494 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -32.948 10.512 -20.783 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -31.731 9.535 -21.581 1.00 0.00 H new ATOM 1568 N GLU A 103 -32.098 9.930 -18.273 1.00 0.00 N ATOM 1569 CA GLU A 103 -31.238 10.352 -17.170 1.00 0.00 C ATOM 1570 C GLU A 103 -31.423 9.449 -15.948 1.00 0.00 C ATOM 1571 O GLU A 103 -30.480 9.224 -15.190 1.00 0.00 O ATOM 1572 CB GLU A 103 -31.515 11.811 -16.804 1.00 0.00 C ATOM 1573 CG GLU A 103 -31.127 12.801 -17.891 1.00 0.00 C ATOM 1574 CD GLU A 103 -31.481 14.234 -17.535 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -32.034 14.456 -16.437 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -31.205 15.134 -18.355 1.00 0.00 O ATOM 0 H GLU A 103 -32.876 10.562 -18.463 1.00 0.00 H new ATOM 0 HA GLU A 103 -30.202 10.265 -17.499 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -32.576 11.925 -16.584 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -30.972 12.056 -15.891 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -30.055 12.731 -18.074 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -31.627 12.528 -18.820 1.00 0.00 H new ATOM 1583 N ILE A 104 -32.634 8.921 -15.768 1.00 0.00 N ATOM 1584 CA ILE A 104 -32.916 8.029 -14.642 1.00 0.00 C ATOM 1585 C ILE A 104 -32.124 6.733 -14.778 1.00 0.00 C ATOM 1586 O ILE A 104 -31.251 6.432 -13.965 1.00 0.00 O ATOM 1587 CB ILE A 104 -34.425 7.686 -14.540 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -35.220 8.871 -13.989 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -34.639 6.461 -13.663 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -36.719 8.664 -14.028 1.00 0.00 C ATOM 0 H ILE A 104 -33.430 9.093 -16.382 1.00 0.00 H new ATOM 0 HA ILE A 104 -32.618 8.557 -13.736 1.00 0.00 H new ATOM 0 HB ILE A 104 -34.786 7.466 -15.545 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -34.914 9.056 -12.959 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -34.970 9.764 -14.562 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -35.704 6.237 -13.604 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -34.112 5.609 -14.093 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -34.254 6.658 -12.662 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -37.218 9.544 -13.622 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -37.038 8.509 -15.059 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -36.981 7.790 -13.431 1.00 0.00 H new ATOM 1602 N GLN A 105 -32.450 5.972 -15.815 1.00 0.00 N ATOM 1603 CA GLN A 105 -31.797 4.699 -16.087 1.00 0.00 C ATOM 1604 C GLN A 105 -30.286 4.866 -16.262 1.00 0.00 C ATOM 1605 O GLN A 105 -29.510 4.030 -15.797 1.00 0.00 O ATOM 1606 CB GLN A 105 -32.419 4.058 -17.331 1.00 0.00 C ATOM 1607 CG GLN A 105 -33.891 3.714 -17.162 1.00 0.00 C ATOM 1608 CD GLN A 105 -34.469 3.003 -18.371 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -34.342 3.475 -19.501 1.00 0.00 O ATOM 1610 NE2 GLN A 105 -35.131 1.873 -18.138 1.00 0.00 N ATOM 0 H GLN A 105 -33.173 6.220 -16.490 1.00 0.00 H new ATOM 0 HA GLN A 105 -31.951 4.044 -15.229 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -32.307 4.738 -18.175 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -31.868 3.151 -17.577 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -34.014 3.083 -16.282 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -34.455 4.629 -16.980 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -35.212 1.517 -17.186 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -35.557 1.363 -18.912 1.00 0.00 H new ATOM 1619 N GLN A 106 -29.871 5.947 -16.922 1.00 0.00 N ATOM 1620 CA GLN A 106 -28.446 6.207 -17.135 1.00 0.00 C ATOM 1621 C GLN A 106 -27.716 6.330 -15.801 1.00 0.00 C ATOM 1622 O GLN A 106 -26.636 5.771 -15.614 1.00 0.00 O ATOM 1623 CB GLN A 106 -28.250 7.483 -17.954 1.00 0.00 C ATOM 1624 CG GLN A 106 -26.793 7.835 -18.203 1.00 0.00 C ATOM 1625 CD GLN A 106 -26.630 9.104 -19.018 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -27.068 10.179 -18.608 1.00 0.00 O ATOM 1627 NE2 GLN A 106 -26.002 8.983 -20.181 1.00 0.00 N ATOM 0 H GLN A 106 -30.494 6.652 -17.316 1.00 0.00 H new ATOM 0 HA GLN A 106 -28.028 5.365 -17.687 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.755 7.369 -18.913 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -28.731 8.313 -17.437 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.283 7.954 -17.247 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -26.307 7.009 -18.723 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -25.655 8.072 -20.481 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -25.866 9.801 -20.775 1.00 0.00 H new ATOM 1636 N ALA A 107 -28.328 7.060 -14.873 1.00 0.00 N ATOM 1637 CA ALA A 107 -27.764 7.263 -13.539 1.00 0.00 C ATOM 1638 C ALA A 107 -27.641 5.939 -12.785 1.00 0.00 C ATOM 1639 O ALA A 107 -27.127 5.895 -11.667 1.00 0.00 O ATOM 1640 CB ALA A 107 -28.619 8.243 -12.749 1.00 0.00 C ATOM 0 H ALA A 107 -29.223 7.526 -15.021 1.00 0.00 H new ATOM 0 HA ALA A 107 -26.763 7.680 -13.655 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -28.188 8.385 -11.758 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -28.652 9.199 -13.271 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -29.630 7.847 -12.652 1.00 0.00 H new ATOM 1646 N CYS A 108 -28.108 4.866 -13.412 1.00 0.00 N ATOM 1647 CA CYS A 108 -28.050 3.539 -12.815 1.00 0.00 C ATOM 1648 C CYS A 108 -27.134 2.618 -13.620 1.00 0.00 C ATOM 1649 O CYS A 108 -27.467 1.461 -13.875 1.00 0.00 O ATOM 1650 CB CYS A 108 -29.453 2.941 -12.719 1.00 0.00 C ATOM 1651 SG CYS A 108 -30.571 3.872 -11.643 1.00 0.00 S ATOM 0 H CYS A 108 -28.533 4.891 -14.339 1.00 0.00 H new ATOM 0 HA CYS A 108 -27.638 3.634 -11.810 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -29.885 2.889 -13.718 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -29.377 1.918 -12.351 1.00 0.00 H new ATOM 0 HG CYS A 108 -30.981 4.939 -12.263 1.00 0.00 H new ATOM 1657 N LYS A 109 -25.977 3.145 -14.012 1.00 0.00 N ATOM 1658 CA LYS A 109 -25.005 2.377 -14.783 1.00 0.00 C ATOM 1659 C LYS A 109 -24.558 1.139 -14.013 1.00 0.00 C ATOM 1660 O LYS A 109 -24.336 0.078 -14.597 1.00 0.00 O ATOM 1661 CB LYS A 109 -23.794 3.245 -15.127 1.00 0.00 C ATOM 1662 CG LYS A 109 -23.134 3.877 -13.910 1.00 0.00 C ATOM 1663 CD LYS A 109 -21.915 4.704 -14.295 1.00 0.00 C ATOM 1664 CE LYS A 109 -20.824 3.843 -14.910 1.00 0.00 C ATOM 1665 NZ LYS A 109 -19.619 4.642 -15.265 1.00 0.00 N ATOM 0 H LYS A 109 -25.690 4.102 -13.808 1.00 0.00 H new ATOM 0 HA LYS A 109 -25.484 2.054 -15.707 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -23.059 2.637 -15.654 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -24.105 4.034 -15.812 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -23.855 4.511 -13.393 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -22.837 3.096 -13.210 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -22.210 5.479 -15.003 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -21.525 5.210 -13.412 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -20.544 3.056 -14.209 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -21.210 3.352 -15.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.899 4.018 -15.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -19.880 5.377 -15.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -19.235 5.090 -14.409 1.00 0.00 H new ATOM 1679 N ASP A 110 -24.433 1.282 -12.698 1.00 0.00 N ATOM 1680 CA ASP A 110 -24.019 0.177 -11.844 1.00 0.00 C ATOM 1681 C ASP A 110 -25.170 -0.808 -11.666 1.00 0.00 C ATOM 1682 O ASP A 110 -24.961 -1.980 -11.351 1.00 0.00 O ATOM 1683 CB ASP A 110 -23.559 0.702 -10.482 1.00 0.00 C ATOM 1684 CG ASP A 110 -22.944 -0.380 -9.613 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -22.794 -1.522 -10.098 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -22.605 -0.083 -8.449 1.00 0.00 O ATOM 0 H ASP A 110 -24.613 2.154 -12.201 1.00 0.00 H new ATOM 0 HA ASP A 110 -23.184 -0.338 -12.319 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -22.831 1.499 -10.632 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -24.410 1.141 -9.961 1.00 0.00 H new ATOM 1691 N PHE A 111 -26.389 -0.322 -11.880 1.00 0.00 N ATOM 1692 CA PHE A 111 -27.581 -1.153 -11.751 1.00 0.00 C ATOM 1693 C PHE A 111 -27.743 -2.063 -12.959 1.00 0.00 C ATOM 1694 O PHE A 111 -28.642 -2.906 -12.990 1.00 0.00 O ATOM 1695 CB PHE A 111 -28.837 -0.287 -11.603 1.00 0.00 C ATOM 1696 CG PHE A 111 -28.956 0.407 -10.272 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -27.898 1.137 -9.749 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -30.134 0.333 -9.546 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -28.014 1.776 -8.529 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -30.256 0.970 -8.326 1.00 0.00 C ATOM 1701 CZ PHE A 111 -29.194 1.693 -7.816 1.00 0.00 C ATOM 0 H PHE A 111 -26.577 0.645 -12.144 1.00 0.00 H new ATOM 0 HA PHE A 111 -27.457 -1.763 -10.856 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -28.842 0.464 -12.393 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -29.716 -0.914 -11.753 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -26.973 1.207 -10.302 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -30.968 -0.230 -9.939 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -27.182 2.340 -8.133 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -31.180 0.903 -7.771 1.00 0.00 H new ATOM 0 HZ PHE A 111 -29.287 2.192 -6.863 1.00 0.00 H new ATOM 1711 N GLY A 112 -26.878 -1.896 -13.957 1.00 0.00 N ATOM 1712 CA GLY A 112 -26.981 -2.727 -15.137 1.00 0.00 C ATOM 1713 C GLY A 112 -28.302 -2.508 -15.842 1.00 0.00 C ATOM 1714 O GLY A 112 -28.929 -3.465 -16.294 1.00 0.00 O ATOM 0 H GLY A 112 -26.122 -1.212 -13.968 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -26.160 -2.501 -15.818 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -26.884 -3.776 -14.857 1.00 0.00 H new ATOM 1718 N LEU A 113 -28.747 -1.247 -15.878 1.00 0.00 N ATOM 1719 CA LEU A 113 -30.036 -0.892 -16.470 1.00 0.00 C ATOM 1720 C LEU A 113 -30.378 -1.797 -17.648 1.00 0.00 C ATOM 1721 O LEU A 113 -29.549 -2.064 -18.516 1.00 0.00 O ATOM 1722 CB LEU A 113 -30.059 0.588 -16.896 1.00 0.00 C ATOM 1723 CG LEU A 113 -29.683 0.889 -18.354 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -29.787 2.378 -18.634 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -28.287 0.390 -18.673 1.00 0.00 C ATOM 0 H LEU A 113 -28.228 -0.454 -15.501 1.00 0.00 H new ATOM 0 HA LEU A 113 -30.798 -1.040 -15.705 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -31.060 0.979 -16.714 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -29.378 1.140 -16.248 1.00 0.00 H new ATOM 0 HG LEU A 113 -30.387 0.361 -18.997 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -29.517 2.573 -19.672 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -30.810 2.711 -18.456 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -29.109 2.920 -17.975 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -28.048 0.617 -19.712 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -27.567 0.882 -18.019 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -28.241 -0.688 -18.517 1.00 0.00 H new ATOM 1737 N ASP A 114 -31.608 -2.290 -17.647 1.00 0.00 N ATOM 1738 CA ASP A 114 -32.068 -3.188 -18.697 1.00 0.00 C ATOM 1739 C ASP A 114 -33.461 -2.815 -19.167 1.00 0.00 C ATOM 1740 O ASP A 114 -34.158 -2.023 -18.533 1.00 0.00 O ATOM 1741 CB ASP A 114 -32.070 -4.640 -18.203 1.00 0.00 C ATOM 1742 CG ASP A 114 -30.677 -5.227 -18.072 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -29.709 -4.572 -18.507 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -30.558 -6.355 -17.549 1.00 0.00 O ATOM 0 H ASP A 114 -32.305 -2.084 -16.932 1.00 0.00 H new ATOM 0 HA ASP A 114 -31.378 -3.092 -19.535 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -32.570 -4.687 -17.236 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -32.652 -5.251 -18.893 1.00 0.00 H new ATOM 1749 N ASP A 115 -33.865 -3.404 -20.283 1.00 0.00 N ATOM 1750 CA ASP A 115 -35.177 -3.152 -20.844 1.00 0.00 C ATOM 1751 C ASP A 115 -36.221 -4.025 -20.154 1.00 0.00 C ATOM 1752 O ASP A 115 -37.422 -3.881 -20.386 1.00 0.00 O ATOM 1753 CB ASP A 115 -35.178 -3.414 -22.352 1.00 0.00 C ATOM 1754 CG ASP A 115 -34.204 -2.521 -23.099 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -33.529 -1.698 -22.446 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -34.119 -2.645 -24.339 1.00 0.00 O ATOM 0 H ASP A 115 -33.298 -4.062 -20.817 1.00 0.00 H new ATOM 0 HA ASP A 115 -35.429 -2.105 -20.677 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -34.923 -4.458 -22.536 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -36.183 -3.257 -22.744 1.00 0.00 H new ATOM 1761 N ILE A 116 -35.749 -4.946 -19.318 1.00 0.00 N ATOM 1762 CA ILE A 116 -36.631 -5.856 -18.599 1.00 0.00 C ATOM 1763 C ILE A 116 -37.013 -5.316 -17.219 1.00 0.00 C ATOM 1764 O ILE A 116 -38.186 -5.055 -16.951 1.00 0.00 O ATOM 1765 CB ILE A 116 -35.987 -7.245 -18.438 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -35.577 -7.797 -19.807 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -36.948 -8.199 -17.740 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -34.880 -9.142 -19.741 1.00 0.00 C ATOM 0 H ILE A 116 -34.757 -5.081 -19.123 1.00 0.00 H new ATOM 0 HA ILE A 116 -37.537 -5.944 -19.199 1.00 0.00 H new ATOM 0 HB ILE A 116 -35.094 -7.149 -17.821 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -36.465 -7.889 -20.432 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -34.917 -7.080 -20.295 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -36.477 -9.176 -17.634 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -37.197 -7.807 -16.754 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -37.858 -8.297 -18.332 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -34.621 -9.467 -20.749 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -33.973 -9.053 -19.144 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -35.545 -9.874 -19.283 1.00 0.00 H new ATOM 1780 N HIS A 117 -36.020 -5.169 -16.338 1.00 0.00 N ATOM 1781 CA HIS A 117 -36.269 -4.683 -14.980 1.00 0.00 C ATOM 1782 C HIS A 117 -36.189 -3.167 -14.870 1.00 0.00 C ATOM 1783 O HIS A 117 -37.203 -2.506 -14.643 1.00 0.00 O ATOM 1784 CB HIS A 117 -35.274 -5.311 -14.004 1.00 0.00 C ATOM 1785 CG HIS A 117 -35.747 -6.600 -13.416 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -36.023 -7.722 -14.168 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -36.000 -6.935 -12.132 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -36.428 -8.694 -13.368 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -36.423 -8.242 -12.128 1.00 0.00 N ATOM 0 H HIS A 117 -35.042 -5.378 -16.540 1.00 0.00 H new ATOM 0 HA HIS A 117 -37.287 -4.978 -14.727 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -34.329 -5.482 -14.520 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -35.074 -4.605 -13.198 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -35.890 -6.295 -11.269 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -36.714 -9.689 -13.677 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -36.690 -8.776 -11.301 1.00 0.00 H new ATOM 1798 N ILE A 118 -34.986 -2.614 -15.012 1.00 0.00 N ATOM 1799 CA ILE A 118 -34.796 -1.173 -14.906 1.00 0.00 C ATOM 1800 C ILE A 118 -35.748 -0.419 -15.835 1.00 0.00 C ATOM 1801 O ILE A 118 -36.024 0.764 -15.634 1.00 0.00 O ATOM 1802 CB ILE A 118 -33.337 -0.778 -15.204 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -32.401 -1.462 -14.202 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -33.163 0.736 -15.153 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -32.671 -1.094 -12.757 1.00 0.00 C ATOM 0 H ILE A 118 -34.133 -3.141 -15.200 1.00 0.00 H new ATOM 0 HA ILE A 118 -35.024 -0.891 -13.878 1.00 0.00 H new ATOM 0 HB ILE A 118 -33.083 -1.110 -16.211 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -32.492 -2.542 -14.314 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -31.371 -1.202 -14.446 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -32.125 0.990 -15.367 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -33.811 1.202 -15.895 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -33.429 1.100 -14.160 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -31.968 -1.619 -12.110 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -32.551 -0.018 -12.627 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -33.689 -1.380 -12.493 1.00 0.00 H new ATOM 1817 N ASP A 119 -36.274 -1.115 -16.835 1.00 0.00 N ATOM 1818 CA ASP A 119 -37.221 -0.507 -17.757 1.00 0.00 C ATOM 1819 C ASP A 119 -38.539 -0.278 -17.036 1.00 0.00 C ATOM 1820 O ASP A 119 -39.108 0.806 -17.094 1.00 0.00 O ATOM 1821 CB ASP A 119 -37.442 -1.392 -18.980 1.00 0.00 C ATOM 1822 CG ASP A 119 -38.432 -0.793 -19.959 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -38.172 0.321 -20.463 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -39.468 -1.437 -20.224 1.00 0.00 O ATOM 0 H ASP A 119 -36.062 -2.094 -17.027 1.00 0.00 H new ATOM 0 HA ASP A 119 -36.815 0.444 -18.101 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -36.489 -1.553 -19.485 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -37.801 -2.369 -18.657 1.00 0.00 H new ATOM 1829 N ASP A 120 -39.000 -1.304 -16.320 1.00 0.00 N ATOM 1830 CA ASP A 120 -40.229 -1.195 -15.548 1.00 0.00 C ATOM 1831 C ASP A 120 -40.035 -0.121 -14.487 1.00 0.00 C ATOM 1832 O ASP A 120 -40.983 0.523 -14.045 1.00 0.00 O ATOM 1833 CB ASP A 120 -40.573 -2.538 -14.894 1.00 0.00 C ATOM 1834 CG ASP A 120 -41.901 -2.513 -14.158 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -42.587 -1.471 -14.199 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -42.257 -3.543 -13.545 1.00 0.00 O ATOM 0 H ASP A 120 -38.541 -2.213 -16.261 1.00 0.00 H new ATOM 0 HA ASP A 120 -41.056 -0.924 -16.204 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -40.602 -3.313 -15.660 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -39.781 -2.810 -14.196 1.00 0.00 H new ATOM 1841 N MET A 121 -38.773 0.066 -14.117 1.00 0.00 N ATOM 1842 CA MET A 121 -38.362 1.050 -13.144 1.00 0.00 C ATOM 1843 C MET A 121 -38.732 2.451 -13.614 1.00 0.00 C ATOM 1844 O MET A 121 -39.043 3.320 -12.814 1.00 0.00 O ATOM 1845 CB MET A 121 -36.863 0.908 -12.897 1.00 0.00 C ATOM 1846 CG MET A 121 -36.159 2.199 -12.542 1.00 0.00 C ATOM 1847 SD MET A 121 -34.434 1.931 -12.101 1.00 0.00 S ATOM 1848 CE MET A 121 -33.760 3.554 -12.424 1.00 0.00 C ATOM 0 H MET A 121 -37.998 -0.477 -14.497 1.00 0.00 H new ATOM 0 HA MET A 121 -38.884 0.884 -12.202 1.00 0.00 H new ATOM 0 HB2 MET A 121 -36.707 0.191 -12.091 1.00 0.00 H new ATOM 0 HB3 MET A 121 -36.399 0.490 -13.790 1.00 0.00 H new ATOM 0 HG2 MET A 121 -36.214 2.886 -13.387 1.00 0.00 H new ATOM 0 HG3 MET A 121 -36.676 2.676 -11.709 1.00 0.00 H new ATOM 0 HE1 MET A 121 -32.994 3.483 -13.196 1.00 0.00 H new ATOM 0 HE2 MET A 121 -34.556 4.218 -12.763 1.00 0.00 H new ATOM 0 HE3 MET A 121 -33.319 3.953 -11.511 1.00 0.00 H new ATOM 1858 N ILE A 122 -38.757 2.644 -14.922 1.00 0.00 N ATOM 1859 CA ILE A 122 -39.164 3.923 -15.492 1.00 0.00 C ATOM 1860 C ILE A 122 -40.556 4.199 -15.006 1.00 0.00 C ATOM 1861 O ILE A 122 -40.884 5.300 -14.578 1.00 0.00 O ATOM 1862 CB ILE A 122 -39.177 3.834 -17.024 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -37.828 3.343 -17.526 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -39.539 5.163 -17.651 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -37.766 3.153 -19.027 1.00 0.00 C ATOM 0 H ILE A 122 -38.502 1.935 -15.610 1.00 0.00 H new ATOM 0 HA ILE A 122 -38.473 4.712 -15.194 1.00 0.00 H new ATOM 0 HB ILE A 122 -39.943 3.118 -17.320 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -37.059 4.055 -17.227 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -37.592 2.397 -17.039 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -39.539 5.065 -18.737 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -40.530 5.466 -17.314 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -38.809 5.916 -17.355 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -36.773 2.802 -19.309 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -38.511 2.418 -19.332 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -37.969 4.102 -19.523 1.00 0.00 H new ATOM 1877 N LYS A 123 -41.349 3.150 -15.055 1.00 0.00 N ATOM 1878 CA LYS A 123 -42.720 3.195 -14.604 1.00 0.00 C ATOM 1879 C LYS A 123 -42.796 2.913 -13.103 1.00 0.00 C ATOM 1880 O LYS A 123 -43.825 3.138 -12.465 1.00 0.00 O ATOM 1881 CB LYS A 123 -43.564 2.179 -15.373 1.00 0.00 C ATOM 1882 CG LYS A 123 -43.887 2.586 -16.806 1.00 0.00 C ATOM 1883 CD LYS A 123 -42.641 2.888 -17.626 1.00 0.00 C ATOM 1884 CE LYS A 123 -41.773 1.655 -17.788 1.00 0.00 C ATOM 1885 NZ LYS A 123 -42.510 0.538 -18.442 1.00 0.00 N ATOM 0 H LYS A 123 -41.058 2.239 -15.410 1.00 0.00 H new ATOM 0 HA LYS A 123 -43.114 4.194 -14.792 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -43.037 1.225 -15.389 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -44.498 2.018 -14.834 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -44.449 1.787 -17.288 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -44.531 3.466 -16.793 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -42.931 3.262 -18.608 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -42.067 3.678 -17.141 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -40.893 1.906 -18.381 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -41.416 1.331 -16.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -41.833 -0.183 -18.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -43.172 0.113 -17.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -43.041 0.903 -19.258 1.00 0.00 H new ATOM 1899 N GLU A 124 -41.691 2.407 -12.551 1.00 0.00 N ATOM 1900 CA GLU A 124 -41.611 2.078 -11.131 1.00 0.00 C ATOM 1901 C GLU A 124 -41.247 3.305 -10.313 1.00 0.00 C ATOM 1902 O GLU A 124 -41.535 3.387 -9.118 1.00 0.00 O ATOM 1903 CB GLU A 124 -40.572 0.986 -10.895 1.00 0.00 C ATOM 1904 CG GLU A 124 -40.367 0.633 -9.433 1.00 0.00 C ATOM 1905 CD GLU A 124 -39.626 -0.676 -9.242 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -39.282 -1.320 -10.256 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -39.391 -1.059 -8.076 1.00 0.00 O ATOM 0 H GLU A 124 -40.835 2.216 -13.072 1.00 0.00 H new ATOM 0 HA GLU A 124 -42.590 1.719 -10.815 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -40.874 0.089 -11.436 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -39.620 1.308 -11.317 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -39.812 1.434 -8.945 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -41.337 0.571 -8.940 1.00 0.00 H new ATOM 1914 N ILE A 125 -40.610 4.255 -10.974 1.00 0.00 N ATOM 1915 CA ILE A 125 -40.189 5.487 -10.347 1.00 0.00 C ATOM 1916 C ILE A 125 -41.082 6.610 -10.843 1.00 0.00 C ATOM 1917 O ILE A 125 -41.249 7.632 -10.182 1.00 0.00 O ATOM 1918 CB ILE A 125 -38.711 5.764 -10.665 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -37.901 4.468 -10.539 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -38.164 6.816 -9.724 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -37.960 3.832 -9.167 1.00 0.00 C ATOM 0 H ILE A 125 -40.371 4.190 -11.964 1.00 0.00 H new ATOM 0 HA ILE A 125 -40.281 5.412 -9.264 1.00 0.00 H new ATOM 0 HB ILE A 125 -38.630 6.135 -11.687 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -38.265 3.752 -11.275 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -36.860 4.677 -10.786 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -37.116 7.004 -9.958 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -38.733 7.738 -9.839 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -38.248 6.464 -8.696 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -37.361 2.921 -9.162 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -37.567 4.528 -8.426 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -38.994 3.588 -8.923 1.00 0.00 H new ATOM 1933 N ASP A 126 -41.697 6.374 -12.003 1.00 0.00 N ATOM 1934 CA ASP A 126 -42.625 7.328 -12.588 1.00 0.00 C ATOM 1935 C ASP A 126 -43.813 7.511 -11.667 1.00 0.00 C ATOM 1936 O ASP A 126 -44.733 6.694 -11.653 1.00 0.00 O ATOM 1937 CB ASP A 126 -43.112 6.840 -13.945 1.00 0.00 C ATOM 1938 CG ASP A 126 -44.192 7.729 -14.517 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -43.936 8.937 -14.675 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -45.294 7.215 -14.807 1.00 0.00 O ATOM 0 H ASP A 126 -41.565 5.526 -12.553 1.00 0.00 H new ATOM 0 HA ASP A 126 -42.108 8.278 -12.720 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -42.272 6.800 -14.638 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -43.494 5.824 -13.848 1.00 0.00 H new ATOM 1945 N GLN A 127 -43.778 8.568 -10.883 1.00 0.00 N ATOM 1946 CA GLN A 127 -44.840 8.835 -9.939 1.00 0.00 C ATOM 1947 C GLN A 127 -45.988 9.638 -10.558 1.00 0.00 C ATOM 1948 O GLN A 127 -47.065 9.715 -9.967 1.00 0.00 O ATOM 1949 CB GLN A 127 -44.259 9.532 -8.700 1.00 0.00 C ATOM 1950 CG GLN A 127 -45.292 10.192 -7.803 1.00 0.00 C ATOM 1951 CD GLN A 127 -45.679 11.573 -8.293 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -46.582 12.208 -7.748 1.00 0.00 O ATOM 1953 NE2 GLN A 127 -44.983 12.051 -9.319 1.00 0.00 N ATOM 0 H GLN A 127 -43.025 9.256 -10.882 1.00 0.00 H new ATOM 0 HA GLN A 127 -45.276 7.882 -9.638 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -43.703 8.800 -8.114 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -43.544 10.288 -9.026 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -46.181 9.564 -7.753 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -44.897 10.266 -6.790 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -44.243 11.489 -9.739 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -45.189 12.980 -9.686 1.00 0.00 H new ATOM 1962 N ASP A 128 -45.792 10.238 -11.741 1.00 0.00 N ATOM 1963 CA ASP A 128 -46.890 11.006 -12.323 1.00 0.00 C ATOM 1964 C ASP A 128 -47.251 10.632 -13.772 1.00 0.00 C ATOM 1965 O ASP A 128 -48.433 10.686 -14.115 1.00 0.00 O ATOM 1966 CB ASP A 128 -46.573 12.501 -12.235 1.00 0.00 C ATOM 1967 CG ASP A 128 -45.289 12.871 -12.948 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -44.732 12.014 -13.657 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -44.843 14.027 -12.800 1.00 0.00 O ATOM 0 H ASP A 128 -44.930 10.209 -12.286 1.00 0.00 H new ATOM 0 HA ASP A 128 -47.771 10.753 -11.733 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -47.398 13.069 -12.664 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -46.498 12.791 -11.187 1.00 0.00 H new ATOM 1974 N ASN A 129 -46.290 10.223 -14.625 1.00 0.00 N ATOM 1975 CA ASN A 129 -46.664 9.837 -16.001 1.00 0.00 C ATOM 1976 C ASN A 129 -45.522 9.377 -16.936 1.00 0.00 C ATOM 1977 O ASN A 129 -45.474 8.223 -17.360 1.00 0.00 O ATOM 1978 CB ASN A 129 -47.461 10.959 -16.690 1.00 0.00 C ATOM 1979 CG ASN A 129 -46.818 12.337 -16.598 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -47.361 13.313 -17.117 1.00 0.00 O ATOM 1981 ND2 ASN A 129 -45.668 12.434 -15.944 1.00 0.00 N ATOM 0 H ASN A 129 -45.297 10.153 -14.402 1.00 0.00 H new ATOM 0 HA ASN A 129 -47.273 8.947 -15.845 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -47.592 10.702 -17.741 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -48.456 11.006 -16.247 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -45.205 13.339 -15.859 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -45.247 11.604 -15.527 1.00 0.00 H new ATOM 1988 N ASP A 130 -44.698 10.341 -17.348 1.00 0.00 N ATOM 1989 CA ASP A 130 -43.636 10.141 -18.349 1.00 0.00 C ATOM 1990 C ASP A 130 -42.478 9.199 -17.992 1.00 0.00 C ATOM 1991 O ASP A 130 -41.438 9.273 -18.648 1.00 0.00 O ATOM 1992 CB ASP A 130 -43.054 11.511 -18.710 1.00 0.00 C ATOM 1993 CG ASP A 130 -44.052 12.393 -19.438 1.00 0.00 C ATOM 1994 OD1 ASP A 130 -45.198 11.943 -19.653 1.00 0.00 O ATOM 1995 OD2 ASP A 130 -43.687 13.533 -19.793 1.00 0.00 O ATOM 0 H ASP A 130 -44.746 11.297 -16.995 1.00 0.00 H new ATOM 0 HA ASP A 130 -44.139 9.634 -19.172 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -42.726 12.014 -17.800 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -42.171 11.374 -19.335 1.00 0.00 H new ATOM 2000 N GLY A 131 -42.609 8.313 -17.008 1.00 0.00 N ATOM 2001 CA GLY A 131 -41.493 7.431 -16.722 1.00 0.00 C ATOM 2002 C GLY A 131 -40.259 8.240 -16.426 1.00 0.00 C ATOM 2003 O GLY A 131 -39.145 7.927 -16.860 1.00 0.00 O ATOM 0 H GLY A 131 -43.436 8.192 -16.423 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -41.732 6.793 -15.871 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -41.311 6.774 -17.572 1.00 0.00 H new ATOM 2007 N GLN A 132 -40.492 9.332 -15.736 1.00 0.00 N ATOM 2008 CA GLN A 132 -39.472 10.262 -15.404 1.00 0.00 C ATOM 2009 C GLN A 132 -39.570 10.639 -13.951 1.00 0.00 C ATOM 2010 O GLN A 132 -40.532 10.291 -13.273 1.00 0.00 O ATOM 2011 CB GLN A 132 -39.600 11.501 -16.238 1.00 0.00 C ATOM 2012 CG GLN A 132 -40.747 12.387 -15.812 1.00 0.00 C ATOM 2013 CD GLN A 132 -40.581 13.809 -16.298 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -40.639 14.084 -17.496 1.00 0.00 O ATOM 2015 NE2 GLN A 132 -40.350 14.718 -15.361 1.00 0.00 N ATOM 0 H GLN A 132 -41.416 9.591 -15.390 1.00 0.00 H new ATOM 0 HA GLN A 132 -38.507 9.793 -15.599 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -38.671 12.068 -16.181 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -39.737 11.217 -17.281 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -41.681 11.980 -16.198 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -40.823 12.383 -14.725 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -40.311 14.441 -14.380 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -40.211 15.695 -15.621 1.00 0.00 H new ATOM 2024 N ILE A 133 -38.570 11.339 -13.481 1.00 0.00 N ATOM 2025 CA ILE A 133 -38.534 11.763 -12.121 1.00 0.00 C ATOM 2026 C ILE A 133 -38.162 13.219 -12.022 1.00 0.00 C ATOM 2027 O ILE A 133 -37.088 13.631 -12.419 1.00 0.00 O ATOM 2028 CB ILE A 133 -37.582 10.874 -11.350 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -38.321 9.581 -11.049 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -37.085 11.549 -10.085 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -39.305 9.715 -9.908 1.00 0.00 C ATOM 0 H ILE A 133 -37.763 11.626 -14.035 1.00 0.00 H new ATOM 0 HA ILE A 133 -39.526 11.668 -11.679 1.00 0.00 H new ATOM 0 HB ILE A 133 -36.690 10.669 -11.942 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -38.852 9.256 -11.943 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -37.597 8.803 -10.808 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -36.404 10.880 -9.559 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -36.561 12.469 -10.345 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -37.932 11.784 -9.441 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -39.801 8.759 -9.741 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -38.775 10.011 -9.003 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -40.049 10.471 -10.156 1.00 0.00 H new ATOM 2043 N ASP A 134 -39.041 13.972 -11.415 1.00 0.00 N ATOM 2044 CA ASP A 134 -38.806 15.384 -11.197 1.00 0.00 C ATOM 2045 C ASP A 134 -38.657 15.639 -9.715 1.00 0.00 C ATOM 2046 O ASP A 134 -39.056 14.811 -8.908 1.00 0.00 O ATOM 2047 CB ASP A 134 -39.951 16.236 -11.761 1.00 0.00 C ATOM 2048 CG ASP A 134 -41.192 16.208 -10.898 1.00 0.00 C ATOM 2049 OD1 ASP A 134 -41.837 15.150 -10.819 1.00 0.00 O ATOM 2050 OD2 ASP A 134 -41.518 17.252 -10.300 1.00 0.00 O ATOM 0 H ASP A 134 -39.934 13.632 -11.059 1.00 0.00 H new ATOM 0 HA ASP A 134 -37.892 15.668 -11.719 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -39.612 17.267 -11.866 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -40.202 15.880 -12.760 1.00 0.00 H new ATOM 2055 N TYR A 135 -38.092 16.783 -9.357 1.00 0.00 N ATOM 2056 CA TYR A 135 -37.919 17.137 -7.956 1.00 0.00 C ATOM 2057 C TYR A 135 -39.126 16.706 -7.138 1.00 0.00 C ATOM 2058 O TYR A 135 -39.005 16.360 -5.964 1.00 0.00 O ATOM 2059 CB TYR A 135 -37.697 18.635 -7.842 1.00 0.00 C ATOM 2060 CG TYR A 135 -37.935 19.204 -6.461 1.00 0.00 C ATOM 2061 CD1 TYR A 135 -37.091 18.888 -5.401 1.00 0.00 C ATOM 2062 CD2 TYR A 135 -39.000 20.063 -6.217 1.00 0.00 C ATOM 2063 CE1 TYR A 135 -37.305 19.409 -4.139 1.00 0.00 C ATOM 2064 CE2 TYR A 135 -39.220 20.587 -4.959 1.00 0.00 C ATOM 2065 CZ TYR A 135 -38.370 20.258 -3.923 1.00 0.00 C ATOM 2066 OH TYR A 135 -38.587 20.778 -2.668 1.00 0.00 O ATOM 0 H TYR A 135 -37.746 17.481 -10.016 1.00 0.00 H new ATOM 0 HA TYR A 135 -37.048 16.615 -7.559 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -36.674 18.861 -8.142 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -38.356 19.141 -8.548 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -36.255 18.225 -5.567 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -39.667 20.325 -7.025 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -36.642 19.153 -3.326 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -40.054 21.252 -4.786 1.00 0.00 H new ATOM 0 HH TYR A 135 -39.377 21.358 -2.686 1.00 0.00 H new ATOM 2076 N GLY A 136 -40.286 16.701 -7.782 1.00 0.00 N ATOM 2077 CA GLY A 136 -41.493 16.280 -7.117 1.00 0.00 C ATOM 2078 C GLY A 136 -41.656 14.775 -7.151 1.00 0.00 C ATOM 2079 O GLY A 136 -41.974 14.162 -6.136 1.00 0.00 O ATOM 0 H GLY A 136 -40.408 16.982 -8.755 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -41.476 16.621 -6.082 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -42.354 16.750 -7.593 1.00 0.00 H new ATOM 2083 N GLU A 137 -41.422 14.174 -8.318 1.00 0.00 N ATOM 2084 CA GLU A 137 -41.526 12.727 -8.450 1.00 0.00 C ATOM 2085 C GLU A 137 -40.493 12.062 -7.564 1.00 0.00 C ATOM 2086 O GLU A 137 -40.829 11.191 -6.768 1.00 0.00 O ATOM 2087 CB GLU A 137 -41.325 12.273 -9.890 1.00 0.00 C ATOM 2088 CG GLU A 137 -42.532 12.476 -10.781 1.00 0.00 C ATOM 2089 CD GLU A 137 -42.258 12.090 -12.214 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -41.486 12.806 -12.884 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -42.795 11.056 -12.659 1.00 0.00 O ATOM 0 H GLU A 137 -41.162 14.663 -9.175 1.00 0.00 H new ATOM 0 HA GLU A 137 -42.531 12.436 -8.144 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -40.479 12.814 -10.315 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -41.060 11.216 -9.892 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -43.365 11.885 -10.401 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -42.839 13.521 -10.741 1.00 0.00 H new ATOM 2098 N PHE A 138 -39.232 12.487 -7.685 1.00 0.00 N ATOM 2099 CA PHE A 138 -38.186 11.921 -6.854 1.00 0.00 C ATOM 2100 C PHE A 138 -38.560 12.096 -5.391 1.00 0.00 C ATOM 2101 O PHE A 138 -38.028 11.420 -4.509 1.00 0.00 O ATOM 2102 CB PHE A 138 -36.812 12.563 -7.083 1.00 0.00 C ATOM 2103 CG PHE A 138 -35.734 11.734 -6.457 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -35.644 10.370 -6.732 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -34.832 12.300 -5.578 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -34.666 9.599 -6.137 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -33.852 11.532 -4.981 1.00 0.00 C ATOM 2108 CZ PHE A 138 -33.769 10.180 -5.262 1.00 0.00 C ATOM 0 H PHE A 138 -38.923 13.206 -8.339 1.00 0.00 H new ATOM 0 HA PHE A 138 -38.105 10.869 -7.128 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -36.626 12.665 -8.152 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -36.798 13.567 -6.660 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -36.345 9.914 -7.416 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -34.894 13.355 -5.355 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -34.602 8.543 -6.355 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -33.151 11.986 -4.296 1.00 0.00 H new ATOM 0 HZ PHE A 138 -33.002 9.578 -4.797 1.00 0.00 H new ATOM 2118 N ALA A 139 -39.485 13.016 -5.148 1.00 0.00 N ATOM 2119 CA ALA A 139 -39.954 13.305 -3.808 1.00 0.00 C ATOM 2120 C ALA A 139 -41.087 12.364 -3.406 1.00 0.00 C ATOM 2121 O ALA A 139 -41.141 11.896 -2.271 1.00 0.00 O ATOM 2122 CB ALA A 139 -40.393 14.761 -3.729 1.00 0.00 C ATOM 0 H ALA A 139 -39.927 13.579 -5.875 1.00 0.00 H new ATOM 0 HA ALA A 139 -39.138 13.143 -3.104 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -40.746 14.980 -2.721 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -39.549 15.409 -3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -41.198 14.937 -4.442 1.00 0.00 H new ATOM 2128 N ALA A 140 -41.996 12.092 -4.344 1.00 0.00 N ATOM 2129 CA ALA A 140 -43.129 11.210 -4.080 1.00 0.00 C ATOM 2130 C ALA A 140 -42.788 9.740 -4.333 1.00 0.00 C ATOM 2131 O ALA A 140 -43.560 8.849 -3.977 1.00 0.00 O ATOM 2132 CB ALA A 140 -44.307 11.616 -4.945 1.00 0.00 C ATOM 0 H ALA A 140 -41.968 12.470 -5.291 1.00 0.00 H new ATOM 0 HA ALA A 140 -43.385 11.312 -3.025 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -45.150 10.955 -4.745 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -44.589 12.644 -4.716 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -44.029 11.541 -5.996 1.00 0.00 H new ATOM 2138 N MET A 141 -41.646 9.492 -4.965 1.00 0.00 N ATOM 2139 CA MET A 141 -41.224 8.136 -5.284 1.00 0.00 C ATOM 2140 C MET A 141 -40.778 7.380 -4.037 1.00 0.00 C ATOM 2141 O MET A 141 -40.507 6.180 -4.094 1.00 0.00 O ATOM 2142 CB MET A 141 -40.096 8.177 -6.316 1.00 0.00 C ATOM 2143 CG MET A 141 -38.801 8.780 -5.795 1.00 0.00 C ATOM 2144 SD MET A 141 -37.782 7.596 -4.897 1.00 0.00 S ATOM 2145 CE MET A 141 -37.340 6.472 -6.221 1.00 0.00 C ATOM 0 H MET A 141 -40.995 10.217 -5.267 1.00 0.00 H new ATOM 0 HA MET A 141 -42.078 7.602 -5.702 1.00 0.00 H new ATOM 0 HB2 MET A 141 -39.898 7.163 -6.663 1.00 0.00 H new ATOM 0 HB3 MET A 141 -40.430 8.751 -7.181 1.00 0.00 H new ATOM 0 HG2 MET A 141 -38.230 9.180 -6.633 1.00 0.00 H new ATOM 0 HG3 MET A 141 -39.035 9.619 -5.140 1.00 0.00 H new ATOM 0 HE1 MET A 141 -36.545 5.807 -5.884 1.00 0.00 H new ATOM 0 HE2 MET A 141 -38.212 5.881 -6.503 1.00 0.00 H new ATOM 0 HE3 MET A 141 -36.994 7.043 -7.083 1.00 0.00 H new ATOM 2155 N MET A 142 -40.707 8.082 -2.913 1.00 0.00 N ATOM 2156 CA MET A 142 -40.295 7.468 -1.657 1.00 0.00 C ATOM 2157 C MET A 142 -41.211 7.893 -0.515 1.00 0.00 C ATOM 2158 O MET A 142 -41.431 7.134 0.429 1.00 0.00 O ATOM 2159 CB MET A 142 -38.847 7.836 -1.332 1.00 0.00 C ATOM 2160 CG MET A 142 -38.622 9.328 -1.148 1.00 0.00 C ATOM 2161 SD MET A 142 -36.917 9.724 -0.719 1.00 0.00 S ATOM 2162 CE MET A 142 -37.025 11.498 -0.507 1.00 0.00 C ATOM 0 H MET A 142 -40.929 9.075 -2.845 1.00 0.00 H new ATOM 0 HA MET A 142 -40.368 6.387 -1.772 1.00 0.00 H new ATOM 0 HB2 MET A 142 -38.545 7.317 -0.422 1.00 0.00 H new ATOM 0 HB3 MET A 142 -38.201 7.476 -2.133 1.00 0.00 H new ATOM 0 HG2 MET A 142 -38.892 9.848 -2.067 1.00 0.00 H new ATOM 0 HG3 MET A 142 -39.285 9.698 -0.366 1.00 0.00 H new ATOM 0 HE1 MET A 142 -36.045 11.893 -0.238 1.00 0.00 H new ATOM 0 HE2 MET A 142 -37.358 11.956 -1.438 1.00 0.00 H new ATOM 0 HE3 MET A 142 -37.738 11.727 0.285 1.00 0.00 H new