USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 949 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 26 TYR OH : rot -37:sc= -2.35 USER MOD Set 1.2: A 28 ASN : amide:sc= 0.388! K(o=-1.5!,f=-5.4) USER MOD Set 1.3: A 185 CYS SG : rot -111:sc= 0.45 USER MOD Set 2.1: A 77 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 166 HIS :FLIP no HD1:sc= -1.23 F(o=-2.4!,f=-1.2) USER MOD Set 3.1: A 17 HIS : no HD1:sc= 0.0933 K(o=-0.04,f=-1.8) USER MOD Set 3.2: A 21 MET CE :methyl -140:sc= -0.251 (180deg=-0.36) USER MOD Set 3.3: A 178 SER OG : rot -111:sc= 1.28 USER MOD Set 3.4: A 182 GLN :FLIP amide:sc= -1.16 F(o=-0.86,f=-0.04) USER MOD Single : A 19 SER OG : rot 180:sc= -0.174 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 1.17 K(o=1.2,f=-0.97) USER MOD Single : A 23 GLN : amide:sc= -0.124 K(o=-0.12,f=-2.3) USER MOD Single : A 24 ASN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 71 GLN :FLIP amide:sc= -1.04 F(o=-2.2!,f=-1) USER MOD Single : A 72 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.501) USER MOD Single : A 76 GLN : amide:sc= -0.283 X(o=-0.28,f=0) USER MOD Single : A 80 MET CE :methyl -141:sc= 0 (180deg=-0.0572) USER MOD Single : A 89 MET CE :methyl 152:sc= -1.95 (180deg=-3.25!) USER MOD Single : A 91 THR OG1 : rot -170:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -5.61! C(o=-5.6!,f=-8.7!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.612 X(o=-0.61,f=-0.95) USER MOD Single : A 100 MET CE :methyl 166:sc= -0.679 (180deg=-0.973) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 111:sc= 0.458 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0686 K(o=-0.069,f=-0.81) USER MOD Single : A 113 MET CE :methyl -125:sc= -0.244 (180deg=-1.05) USER MOD Single : A 114 ASN : amide:sc= -2.98! C(o=-3!,f=-9.3!) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= -0.0316 USER MOD Single : A 126 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.139) USER MOD Single : A 127 ASN : amide:sc= -0.363 K(o=-0.36,f=-0.93) USER MOD Single : A 135 CYS SG : rot 168:sc= 0.226 USER MOD Single : A 141 SER OG : rot 127:sc= -0.203 USER MOD Single : A 143 MET CE :methyl -124:sc= -1.83 (180deg=-6.41!) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 HIS : no HD1:sc= -0.839 K(o=-0.84,f=-1.6) USER MOD Single : A 151 THR OG1 : rot -33:sc= 0.831 USER MOD Single : A 156 MET CE :methyl -145:sc= -0.0509 (180deg=-1.08) USER MOD Single : A 158 THR OG1 : rot -108:sc= 1.22 USER MOD Single : A 165 CYS SG : rot 180:sc= -0.343 USER MOD Single : A 170 CYS SG : rot -178:sc= -3.26! USER MOD Single : A 173 ASN : amide:sc= 0.14 K(o=0.14,f=-5.1!) USER MOD Single : A 176 ASN : amide:sc=-0.00592 X(o=-0.0059,f=-0.0059) USER MOD ----------------------------------------------------------------- ATOM 196 N HIS A 17 15.295 6.103 -7.301 1.00 0.00 N ATOM 197 CA HIS A 17 13.857 6.137 -7.061 1.00 0.00 C ATOM 198 C HIS A 17 13.525 5.611 -5.668 1.00 0.00 C ATOM 199 O HIS A 17 12.687 6.175 -4.963 1.00 0.00 O ATOM 200 CB HIS A 17 13.123 5.313 -8.119 1.00 0.00 C ATOM 201 CG HIS A 17 11.804 4.778 -7.653 1.00 0.00 C ATOM 202 ND1 HIS A 17 10.790 5.584 -7.177 1.00 0.00 N ATOM 203 CD2 HIS A 17 11.334 3.510 -7.593 1.00 0.00 C ATOM 204 CE1 HIS A 17 9.755 4.834 -6.843 1.00 0.00 C ATOM 205 NE2 HIS A 17 10.059 3.572 -7.086 1.00 0.00 N ATOM 0 HA HIS A 17 13.527 7.174 -7.126 1.00 0.00 H new ATOM 0 HB2 HIS A 17 12.963 5.931 -9.003 1.00 0.00 H new ATOM 0 HB3 HIS A 17 13.757 4.480 -8.423 1.00 0.00 H new ATOM 0 HD2 HIS A 17 11.863 2.616 -7.889 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.819 5.192 -6.440 1.00 0.00 H new ATOM 0 HE2 HIS A 17 9.446 2.773 -6.924 1.00 0.00 H new ATOM 213 N LEU A 18 14.186 4.527 -5.278 1.00 0.00 N ATOM 214 CA LEU A 18 13.961 3.923 -3.969 1.00 0.00 C ATOM 215 C LEU A 18 14.474 4.830 -2.856 1.00 0.00 C ATOM 216 O LEU A 18 13.722 5.221 -1.963 1.00 0.00 O ATOM 217 CB LEU A 18 14.649 2.559 -3.890 1.00 0.00 C ATOM 218 CG LEU A 18 13.983 1.425 -4.669 1.00 0.00 C ATOM 219 CD1 LEU A 18 15.001 0.351 -5.023 1.00 0.00 C ATOM 220 CD2 LEU A 18 12.834 0.830 -3.868 1.00 0.00 C ATOM 0 H LEU A 18 14.882 4.048 -5.849 1.00 0.00 H new ATOM 0 HA LEU A 18 12.887 3.789 -3.837 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.672 2.669 -4.251 1.00 0.00 H new ATOM 0 HB3 LEU A 18 14.711 2.266 -2.842 1.00 0.00 H new ATOM 0 HG LEU A 18 13.580 1.834 -5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 18 14.509 -0.448 -5.577 1.00 0.00 H new ATOM 0 HD12 LEU A 18 15.790 0.786 -5.637 1.00 0.00 H new ATOM 0 HD13 LEU A 18 15.434 -0.055 -4.109 1.00 0.00 H new ATOM 0 HD21 LEU A 18 12.372 0.024 -4.438 1.00 0.00 H new ATOM 0 HD22 LEU A 18 13.213 0.436 -2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 18 12.093 1.603 -3.666 1.00 0.00 H new ATOM 232 N SER A 19 15.759 5.163 -2.916 1.00 0.00 N ATOM 233 CA SER A 19 16.374 6.024 -1.912 1.00 0.00 C ATOM 234 C SER A 19 15.404 7.112 -1.462 1.00 0.00 C ATOM 235 O SER A 19 15.185 7.310 -0.267 1.00 0.00 O ATOM 236 CB SER A 19 17.650 6.659 -2.466 1.00 0.00 C ATOM 237 OG SER A 19 17.365 7.491 -3.577 1.00 0.00 O ATOM 0 H SER A 19 16.395 4.850 -3.649 1.00 0.00 H new ATOM 0 HA SER A 19 16.629 5.409 -1.049 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.137 7.243 -1.686 1.00 0.00 H new ATOM 0 HB3 SER A 19 18.349 5.878 -2.763 1.00 0.00 H new ATOM 0 HG SER A 19 18.197 7.886 -3.912 1.00 0.00 H new ATOM 243 N LYS A 20 14.826 7.816 -2.429 1.00 0.00 N ATOM 244 CA LYS A 20 13.878 8.885 -2.135 1.00 0.00 C ATOM 245 C LYS A 20 12.798 8.405 -1.170 1.00 0.00 C ATOM 246 O LYS A 20 12.479 9.083 -0.194 1.00 0.00 O ATOM 247 CB LYS A 20 13.233 9.391 -3.427 1.00 0.00 C ATOM 248 CG LYS A 20 14.177 10.197 -4.303 1.00 0.00 C ATOM 249 CD LYS A 20 13.420 11.166 -5.195 1.00 0.00 C ATOM 250 CE LYS A 20 13.033 12.430 -4.442 1.00 0.00 C ATOM 251 NZ LYS A 20 12.405 13.439 -5.339 1.00 0.00 N ATOM 0 H LYS A 20 14.997 7.666 -3.423 1.00 0.00 H new ATOM 0 HA LYS A 20 14.425 9.702 -1.664 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.862 8.539 -3.996 1.00 0.00 H new ATOM 0 HB3 LYS A 20 12.370 10.007 -3.175 1.00 0.00 H new ATOM 0 HG2 LYS A 20 14.875 10.750 -3.674 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.769 9.521 -4.919 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.036 11.428 -6.055 1.00 0.00 H new ATOM 0 HD3 LYS A 20 12.523 10.682 -5.581 1.00 0.00 H new ATOM 0 HE2 LYS A 20 12.341 12.177 -3.639 1.00 0.00 H new ATOM 0 HE3 LYS A 20 13.919 12.860 -3.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 12.156 14.285 -4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 13.075 13.700 -6.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.545 13.038 -5.765 1.00 0.00 H new ATOM 265 N MET A 21 12.241 7.231 -1.449 1.00 0.00 N ATOM 266 CA MET A 21 11.200 6.660 -0.603 1.00 0.00 C ATOM 267 C MET A 21 11.663 6.576 0.848 1.00 0.00 C ATOM 268 O MET A 21 10.860 6.703 1.772 1.00 0.00 O ATOM 269 CB MET A 21 10.809 5.269 -1.107 1.00 0.00 C ATOM 270 CG MET A 21 10.081 5.288 -2.441 1.00 0.00 C ATOM 271 SD MET A 21 9.236 3.735 -2.793 1.00 0.00 S ATOM 272 CE MET A 21 7.730 4.335 -3.555 1.00 0.00 C ATOM 0 H MET A 21 12.493 6.657 -2.254 1.00 0.00 H new ATOM 0 HA MET A 21 10.329 7.314 -0.651 1.00 0.00 H new ATOM 0 HB2 MET A 21 11.708 4.660 -1.202 1.00 0.00 H new ATOM 0 HB3 MET A 21 10.175 4.787 -0.363 1.00 0.00 H new ATOM 0 HG2 MET A 21 9.355 6.101 -2.443 1.00 0.00 H new ATOM 0 HG3 MET A 21 10.795 5.497 -3.237 1.00 0.00 H new ATOM 0 HE1 MET A 21 6.885 3.740 -3.209 1.00 0.00 H new ATOM 0 HE2 MET A 21 7.575 5.379 -3.281 1.00 0.00 H new ATOM 0 HE3 MET A 21 7.813 4.252 -4.639 1.00 0.00 H new ATOM 282 N GLN A 22 12.960 6.362 1.039 1.00 0.00 N ATOM 283 CA GLN A 22 13.528 6.261 2.378 1.00 0.00 C ATOM 284 C GLN A 22 13.694 7.641 3.005 1.00 0.00 C ATOM 285 O GLN A 22 13.679 7.783 4.227 1.00 0.00 O ATOM 286 CB GLN A 22 14.879 5.545 2.329 1.00 0.00 C ATOM 287 CG GLN A 22 14.767 4.051 2.068 1.00 0.00 C ATOM 288 CD GLN A 22 15.986 3.283 2.540 1.00 0.00 C ATOM 289 OE1 GLN A 22 17.100 3.807 2.545 1.00 0.00 O ATOM 290 NE2 GLN A 22 15.780 2.034 2.940 1.00 0.00 N ATOM 0 H GLN A 22 13.637 6.255 0.284 1.00 0.00 H new ATOM 0 HA GLN A 22 12.840 5.683 2.994 1.00 0.00 H new ATOM 0 HB2 GLN A 22 15.492 5.997 1.549 1.00 0.00 H new ATOM 0 HB3 GLN A 22 15.399 5.702 3.274 1.00 0.00 H new ATOM 0 HG2 GLN A 22 13.881 3.664 2.571 1.00 0.00 H new ATOM 0 HG3 GLN A 22 14.627 3.882 1.000 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.839 1.640 2.919 1.00 0.00 H new ATOM 0 HE22 GLN A 22 16.562 1.468 3.269 1.00 0.00 H new ATOM 299 N GLN A 23 13.851 8.655 2.160 1.00 0.00 N ATOM 300 CA GLN A 23 14.020 10.024 2.632 1.00 0.00 C ATOM 301 C GLN A 23 12.806 10.476 3.436 1.00 0.00 C ATOM 302 O GLN A 23 12.892 10.684 4.645 1.00 0.00 O ATOM 303 CB GLN A 23 14.246 10.969 1.451 1.00 0.00 C ATOM 304 CG GLN A 23 15.498 10.652 0.649 1.00 0.00 C ATOM 305 CD GLN A 23 16.768 11.087 1.354 1.00 0.00 C ATOM 306 OE1 GLN A 23 16.742 11.476 2.522 1.00 0.00 O ATOM 307 NE2 GLN A 23 17.890 11.022 0.646 1.00 0.00 N ATOM 0 H GLN A 23 13.865 8.554 1.145 1.00 0.00 H new ATOM 0 HA GLN A 23 14.894 10.052 3.282 1.00 0.00 H new ATOM 0 HB2 GLN A 23 13.380 10.925 0.790 1.00 0.00 H new ATOM 0 HB3 GLN A 23 14.312 11.992 1.822 1.00 0.00 H new ATOM 0 HG2 GLN A 23 15.541 9.580 0.459 1.00 0.00 H new ATOM 0 HG3 GLN A 23 15.438 11.145 -0.321 1.00 0.00 H new ATOM 0 HE21 GLN A 23 17.866 10.693 -0.319 1.00 0.00 H new ATOM 0 HE22 GLN A 23 18.776 11.301 1.068 1.00 0.00 H new ATOM 316 N ASN A 24 11.675 10.627 2.755 1.00 0.00 N ATOM 317 CA ASN A 24 10.442 11.057 3.406 1.00 0.00 C ATOM 318 C ASN A 24 9.310 10.071 3.131 1.00 0.00 C ATOM 319 O ASN A 24 8.484 9.800 4.001 1.00 0.00 O ATOM 320 CB ASN A 24 10.046 12.454 2.923 1.00 0.00 C ATOM 321 CG ASN A 24 10.755 13.553 3.690 1.00 0.00 C ATOM 322 OD1 ASN A 24 12.083 13.532 3.661 1.00 0.00 O flip ATOM 323 ND2 ASN A 24 10.117 14.410 4.301 1.00 0.00 N flip ATOM 0 H ASN A 24 11.586 10.458 1.753 1.00 0.00 H new ATOM 0 HA ASN A 24 10.619 11.089 4.481 1.00 0.00 H new ATOM 0 HB2 ASN A 24 10.277 12.548 1.862 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.968 12.579 3.027 1.00 0.00 H new ATOM 0 HD21 ASN A 24 9.097 14.387 4.296 1.00 0.00 H new ATOM 0 HD22 ASN A 24 10.608 15.143 4.813 1.00 0.00 H new ATOM 330 N GLY A 25 9.279 9.538 1.913 1.00 0.00 N ATOM 331 CA GLY A 25 8.245 8.589 1.545 1.00 0.00 C ATOM 332 C GLY A 25 7.329 9.121 0.460 1.00 0.00 C ATOM 333 O GLY A 25 7.614 10.149 -0.153 1.00 0.00 O ATOM 0 H GLY A 25 9.952 9.747 1.175 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.710 7.664 1.203 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.653 8.341 2.426 1.00 0.00 H new ATOM 337 N TYR A 26 6.227 8.419 0.223 1.00 0.00 N ATOM 338 CA TYR A 26 5.268 8.824 -0.798 1.00 0.00 C ATOM 339 C TYR A 26 3.836 8.659 -0.297 1.00 0.00 C ATOM 340 O TYR A 26 3.324 7.544 -0.206 1.00 0.00 O ATOM 341 CB TYR A 26 5.471 8.004 -2.073 1.00 0.00 C ATOM 342 CG TYR A 26 4.266 7.996 -2.987 1.00 0.00 C ATOM 343 CD1 TYR A 26 3.458 9.119 -3.114 1.00 0.00 C ATOM 344 CD2 TYR A 26 3.936 6.865 -3.723 1.00 0.00 C ATOM 345 CE1 TYR A 26 2.356 9.116 -3.946 1.00 0.00 C ATOM 346 CE2 TYR A 26 2.837 6.853 -4.560 1.00 0.00 C ATOM 347 CZ TYR A 26 2.050 7.980 -4.667 1.00 0.00 C ATOM 348 OH TYR A 26 0.953 7.973 -5.499 1.00 0.00 O ATOM 0 H TYR A 26 5.975 7.567 0.724 1.00 0.00 H new ATOM 0 HA TYR A 26 5.437 9.878 -1.021 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.327 8.402 -2.618 1.00 0.00 H new ATOM 0 HB3 TYR A 26 5.716 6.978 -1.800 1.00 0.00 H new ATOM 0 HD1 TYR A 26 3.696 10.010 -2.552 1.00 0.00 H new ATOM 0 HD2 TYR A 26 4.549 5.980 -3.639 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.738 9.997 -4.032 1.00 0.00 H new ATOM 0 HE2 TYR A 26 2.596 5.966 -5.127 1.00 0.00 H new ATOM 0 HH TYR A 26 0.227 8.487 -5.088 1.00 0.00 H new ATOM 358 N GLU A 27 3.197 9.779 0.026 1.00 0.00 N ATOM 359 CA GLU A 27 1.824 9.758 0.519 1.00 0.00 C ATOM 360 C GLU A 27 0.834 9.640 -0.636 1.00 0.00 C ATOM 361 O GLU A 27 1.141 10.002 -1.771 1.00 0.00 O ATOM 362 CB GLU A 27 1.531 11.023 1.329 1.00 0.00 C ATOM 363 CG GLU A 27 1.876 10.894 2.803 1.00 0.00 C ATOM 364 CD GLU A 27 3.313 11.273 3.101 1.00 0.00 C ATOM 365 OE1 GLU A 27 4.204 10.886 2.317 1.00 0.00 O ATOM 366 OE2 GLU A 27 3.547 11.957 4.120 1.00 0.00 O ATOM 0 H GLU A 27 3.607 10.710 -0.044 1.00 0.00 H new ATOM 0 HA GLU A 27 1.709 8.887 1.164 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.093 11.855 0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.474 11.270 1.232 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.208 11.529 3.385 1.00 0.00 H new ATOM 0 HG3 GLU A 27 1.701 9.867 3.125 1.00 0.00 H new ATOM 373 N ASN A 28 -0.357 9.130 -0.337 1.00 0.00 N ATOM 374 CA ASN A 28 -1.393 8.962 -1.350 1.00 0.00 C ATOM 375 C ASN A 28 -2.314 10.178 -1.392 1.00 0.00 C ATOM 376 O ASN A 28 -3.123 10.406 -0.494 1.00 0.00 O ATOM 377 CB ASN A 28 -2.210 7.699 -1.069 1.00 0.00 C ATOM 378 CG ASN A 28 -2.718 7.046 -2.340 1.00 0.00 C ATOM 379 OD1 ASN A 28 -1.999 6.955 -3.335 1.00 0.00 O ATOM 380 ND2 ASN A 28 -3.963 6.586 -2.311 1.00 0.00 N ATOM 0 H ASN A 28 -0.628 8.826 0.598 1.00 0.00 H new ATOM 0 HA ASN A 28 -0.906 8.863 -2.320 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.596 6.987 -0.518 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.056 7.951 -0.430 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.360 6.135 -3.136 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -4.523 6.683 -1.464 1.00 0.00 H new ATOM 939 N VAL A 70 -3.255 -6.229 -15.878 1.00 0.00 N ATOM 940 CA VAL A 70 -2.921 -6.608 -14.510 1.00 0.00 C ATOM 941 C VAL A 70 -1.439 -6.942 -14.378 1.00 0.00 C ATOM 942 O VAL A 70 -0.869 -7.622 -15.231 1.00 0.00 O ATOM 943 CB VAL A 70 -3.752 -7.818 -14.044 1.00 0.00 C ATOM 944 CG1 VAL A 70 -3.510 -9.014 -14.952 1.00 0.00 C ATOM 945 CG2 VAL A 70 -3.428 -8.162 -12.598 1.00 0.00 C ATOM 0 HA VAL A 70 -3.155 -5.751 -13.878 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.808 -7.555 -14.103 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.106 -9.859 -14.607 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -3.797 -8.760 -15.972 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.453 -9.281 -14.928 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.024 -9.019 -12.286 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.369 -8.405 -12.510 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.658 -7.308 -11.961 1.00 0.00 H new ATOM 955 N GLN A 71 -0.823 -6.460 -13.304 1.00 0.00 N ATOM 956 CA GLN A 71 0.593 -6.708 -13.061 1.00 0.00 C ATOM 957 C GLN A 71 0.783 -7.728 -11.943 1.00 0.00 C ATOM 958 O GLN A 71 0.340 -7.518 -10.814 1.00 0.00 O ATOM 959 CB GLN A 71 1.307 -5.403 -12.704 1.00 0.00 C ATOM 960 CG GLN A 71 1.539 -4.490 -13.897 1.00 0.00 C ATOM 961 CD GLN A 71 1.589 -3.025 -13.510 1.00 0.00 C ATOM 962 OE1 GLN A 71 2.638 -2.637 -12.795 1.00 0.00 O flip ATOM 963 NE2 GLN A 71 0.693 -2.251 -13.848 1.00 0.00 N flip ATOM 0 H GLN A 71 -1.282 -5.896 -12.589 1.00 0.00 H new ATOM 0 HA GLN A 71 1.027 -7.113 -13.975 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.719 -4.869 -11.958 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.267 -5.638 -12.245 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.475 -4.765 -14.384 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.743 -4.642 -14.626 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.095 -2.592 -14.398 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.739 -1.268 -13.578 1.00 0.00 H new ATOM 972 N LYS A 72 1.445 -8.835 -12.265 1.00 0.00 N ATOM 973 CA LYS A 72 1.695 -9.888 -11.289 1.00 0.00 C ATOM 974 C LYS A 72 3.177 -9.959 -10.932 1.00 0.00 C ATOM 975 O LYS A 72 4.012 -10.299 -11.770 1.00 0.00 O ATOM 976 CB LYS A 72 1.227 -11.239 -11.834 1.00 0.00 C ATOM 977 CG LYS A 72 -0.284 -11.393 -11.861 1.00 0.00 C ATOM 978 CD LYS A 72 -0.693 -12.845 -12.042 1.00 0.00 C ATOM 979 CE LYS A 72 -0.752 -13.229 -13.513 1.00 0.00 C ATOM 980 NZ LYS A 72 0.573 -13.681 -14.021 1.00 0.00 N ATOM 0 H LYS A 72 1.818 -9.025 -13.195 1.00 0.00 H new ATOM 0 HA LYS A 72 1.132 -9.652 -10.386 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.615 -11.368 -12.844 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.654 -12.035 -11.224 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.707 -11.008 -10.933 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.697 -10.794 -12.672 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.016 -13.491 -11.525 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.668 -13.009 -11.583 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.485 -14.024 -13.652 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.093 -12.375 -14.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.814 -13.150 -14.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.299 -13.512 -13.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.533 -14.697 -14.240 1.00 0.00 H new ATOM 994 N PHE A 73 3.496 -9.636 -9.683 1.00 0.00 N ATOM 995 CA PHE A 73 4.877 -9.663 -9.215 1.00 0.00 C ATOM 996 C PHE A 73 5.090 -10.796 -8.216 1.00 0.00 C ATOM 997 O PHE A 73 4.133 -11.343 -7.668 1.00 0.00 O ATOM 998 CB PHE A 73 5.246 -8.324 -8.572 1.00 0.00 C ATOM 999 CG PHE A 73 5.177 -7.163 -9.522 1.00 0.00 C ATOM 1000 CD1 PHE A 73 6.258 -6.845 -10.328 1.00 0.00 C ATOM 1001 CD2 PHE A 73 4.030 -6.390 -9.609 1.00 0.00 C ATOM 1002 CE1 PHE A 73 6.197 -5.778 -11.204 1.00 0.00 C ATOM 1003 CE2 PHE A 73 3.964 -5.321 -10.483 1.00 0.00 C ATOM 1004 CZ PHE A 73 5.049 -5.014 -11.281 1.00 0.00 C ATOM 0 H PHE A 73 2.817 -9.352 -8.977 1.00 0.00 H new ATOM 0 HA PHE A 73 5.523 -9.835 -10.076 1.00 0.00 H new ATOM 0 HB2 PHE A 73 4.576 -8.136 -7.733 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.255 -8.391 -8.166 1.00 0.00 H new ATOM 0 HD1 PHE A 73 7.159 -7.438 -10.271 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.179 -6.625 -8.987 1.00 0.00 H new ATOM 0 HE1 PHE A 73 7.046 -5.542 -11.828 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.065 -4.726 -10.542 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.000 -4.178 -11.964 1.00 0.00 H new ATOM 1014 N ARG A 74 6.352 -11.144 -7.986 1.00 0.00 N ATOM 1015 CA ARG A 74 6.692 -12.213 -7.054 1.00 0.00 C ATOM 1016 C ARG A 74 7.300 -11.646 -5.774 1.00 0.00 C ATOM 1017 O ARG A 74 8.271 -10.891 -5.817 1.00 0.00 O ATOM 1018 CB ARG A 74 7.670 -13.193 -7.705 1.00 0.00 C ATOM 1019 CG ARG A 74 8.177 -14.267 -6.757 1.00 0.00 C ATOM 1020 CD ARG A 74 9.448 -13.829 -6.046 1.00 0.00 C ATOM 1021 NE ARG A 74 10.648 -14.206 -6.788 1.00 0.00 N ATOM 1022 CZ ARG A 74 11.864 -14.229 -6.255 1.00 0.00 C ATOM 1023 NH1 ARG A 74 12.041 -13.899 -4.983 1.00 0.00 N ATOM 1024 NH2 ARG A 74 12.908 -14.584 -6.995 1.00 0.00 N ATOM 0 H ARG A 74 7.156 -10.702 -8.432 1.00 0.00 H new ATOM 0 HA ARG A 74 5.775 -12.742 -6.796 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.181 -13.671 -8.554 1.00 0.00 H new ATOM 0 HB3 ARG A 74 8.521 -12.637 -8.099 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.407 -14.496 -6.020 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.368 -15.184 -7.314 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.432 -12.748 -5.908 1.00 0.00 H new ATOM 0 HD3 ARG A 74 9.480 -14.277 -5.053 1.00 0.00 H new ATOM 0 HE ARG A 74 10.547 -14.466 -7.769 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.242 -13.626 -4.411 1.00 0.00 H new ATOM 0 HH12 ARG A 74 12.976 -13.918 -4.577 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.776 -14.839 -7.974 1.00 0.00 H new ATOM 0 HH22 ARG A 74 13.842 -14.601 -6.585 1.00 0.00 H new ATOM 1038 N VAL A 75 6.720 -12.015 -4.637 1.00 0.00 N ATOM 1039 CA VAL A 75 7.204 -11.545 -3.344 1.00 0.00 C ATOM 1040 C VAL A 75 6.725 -12.450 -2.215 1.00 0.00 C ATOM 1041 O VAL A 75 5.996 -13.415 -2.447 1.00 0.00 O ATOM 1042 CB VAL A 75 6.741 -10.103 -3.063 1.00 0.00 C ATOM 1043 CG1 VAL A 75 7.201 -9.168 -4.171 1.00 0.00 C ATOM 1044 CG2 VAL A 75 5.228 -10.051 -2.904 1.00 0.00 C ATOM 0 H VAL A 75 5.914 -12.638 -4.584 1.00 0.00 H new ATOM 0 HA VAL A 75 8.293 -11.568 -3.386 1.00 0.00 H new ATOM 0 HB VAL A 75 7.194 -9.770 -2.129 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.864 -8.154 -3.955 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.289 -9.184 -4.232 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.780 -9.495 -5.122 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.918 -9.025 -2.706 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.754 -10.403 -3.820 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.927 -10.688 -2.072 1.00 0.00 H new ATOM 1054 N GLN A 76 7.139 -12.133 -0.993 1.00 0.00 N ATOM 1055 CA GLN A 76 6.752 -12.918 0.173 1.00 0.00 C ATOM 1056 C GLN A 76 5.850 -12.110 1.099 1.00 0.00 C ATOM 1057 O GLN A 76 5.860 -10.879 1.073 1.00 0.00 O ATOM 1058 CB GLN A 76 7.993 -13.388 0.933 1.00 0.00 C ATOM 1059 CG GLN A 76 8.648 -14.620 0.327 1.00 0.00 C ATOM 1060 CD GLN A 76 10.081 -14.803 0.784 1.00 0.00 C ATOM 1061 OE1 GLN A 76 10.972 -14.050 0.390 1.00 0.00 O ATOM 1062 NE2 GLN A 76 10.312 -15.808 1.621 1.00 0.00 N ATOM 0 H GLN A 76 7.743 -11.338 -0.784 1.00 0.00 H new ATOM 0 HA GLN A 76 6.197 -13.789 -0.176 1.00 0.00 H new ATOM 0 HB2 GLN A 76 8.720 -12.577 0.961 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.717 -13.604 1.965 1.00 0.00 H new ATOM 0 HG2 GLN A 76 8.069 -15.504 0.596 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.624 -14.542 -0.760 1.00 0.00 H new ATOM 0 HE21 GLN A 76 9.544 -16.408 1.922 1.00 0.00 H new ATOM 0 HE22 GLN A 76 11.258 -15.980 1.963 1.00 0.00 H new ATOM 1071 N TYR A 77 5.071 -12.809 1.917 1.00 0.00 N ATOM 1072 CA TYR A 77 4.161 -12.156 2.850 1.00 0.00 C ATOM 1073 C TYR A 77 4.581 -12.416 4.293 1.00 0.00 C ATOM 1074 O TYR A 77 4.448 -13.531 4.801 1.00 0.00 O ATOM 1075 CB TYR A 77 2.730 -12.648 2.628 1.00 0.00 C ATOM 1076 CG TYR A 77 1.721 -12.021 3.563 1.00 0.00 C ATOM 1077 CD1 TYR A 77 1.832 -10.689 3.944 1.00 0.00 C ATOM 1078 CD2 TYR A 77 0.658 -12.759 4.068 1.00 0.00 C ATOM 1079 CE1 TYR A 77 0.914 -10.111 4.799 1.00 0.00 C ATOM 1080 CE2 TYR A 77 -0.265 -12.190 4.923 1.00 0.00 C ATOM 1081 CZ TYR A 77 -0.133 -10.865 5.285 1.00 0.00 C ATOM 1082 OH TYR A 77 -1.051 -10.294 6.137 1.00 0.00 O ATOM 0 H TYR A 77 5.052 -13.828 1.953 1.00 0.00 H new ATOM 0 HA TYR A 77 4.202 -11.082 2.666 1.00 0.00 H new ATOM 0 HB2 TYR A 77 2.438 -12.438 1.599 1.00 0.00 H new ATOM 0 HB3 TYR A 77 2.704 -13.731 2.752 1.00 0.00 H new ATOM 0 HD1 TYR A 77 2.651 -10.095 3.565 1.00 0.00 H new ATOM 0 HD2 TYR A 77 0.552 -13.796 3.787 1.00 0.00 H new ATOM 0 HE1 TYR A 77 1.016 -9.075 5.085 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.085 -12.779 5.306 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.725 -10.960 6.386 1.00 0.00 H new ATOM 1092 N LEU A 78 5.089 -11.379 4.950 1.00 0.00 N ATOM 1093 CA LEU A 78 5.529 -11.492 6.336 1.00 0.00 C ATOM 1094 C LEU A 78 4.336 -11.557 7.284 1.00 0.00 C ATOM 1095 O LEU A 78 4.389 -12.212 8.323 1.00 0.00 O ATOM 1096 CB LEU A 78 6.425 -10.309 6.706 1.00 0.00 C ATOM 1097 CG LEU A 78 7.830 -10.316 6.103 1.00 0.00 C ATOM 1098 CD1 LEU A 78 7.775 -9.990 4.619 1.00 0.00 C ATOM 1099 CD2 LEU A 78 8.730 -9.331 6.835 1.00 0.00 C ATOM 0 H LEU A 78 5.206 -10.450 4.545 1.00 0.00 H new ATOM 0 HA LEU A 78 6.098 -12.416 6.435 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.925 -9.390 6.400 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.518 -10.275 7.792 1.00 0.00 H new ATOM 0 HG LEU A 78 8.250 -11.315 6.219 1.00 0.00 H new ATOM 0 HD11 LEU A 78 8.784 -9.999 4.207 1.00 0.00 H new ATOM 0 HD12 LEU A 78 7.166 -10.734 4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.335 -9.002 4.479 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.726 -9.350 6.392 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.314 -8.327 6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 78 8.795 -9.610 7.887 1.00 0.00 H new ATOM 1111 N GLY A 79 3.256 -10.873 6.915 1.00 0.00 N ATOM 1112 CA GLY A 79 2.064 -10.867 7.741 1.00 0.00 C ATOM 1113 C GLY A 79 1.462 -9.483 7.881 1.00 0.00 C ATOM 1114 O GLY A 79 1.823 -8.565 7.146 1.00 0.00 O ATOM 0 H GLY A 79 3.187 -10.323 6.059 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.323 -11.540 7.309 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.309 -11.255 8.730 1.00 0.00 H new ATOM 1118 N MET A 80 0.541 -9.333 8.827 1.00 0.00 N ATOM 1119 CA MET A 80 -0.113 -8.050 9.061 1.00 0.00 C ATOM 1120 C MET A 80 0.299 -7.467 10.409 1.00 0.00 C ATOM 1121 O MET A 80 0.211 -8.138 11.439 1.00 0.00 O ATOM 1122 CB MET A 80 -1.633 -8.210 9.003 1.00 0.00 C ATOM 1123 CG MET A 80 -2.383 -6.888 8.994 1.00 0.00 C ATOM 1124 SD MET A 80 -4.039 -7.024 9.695 1.00 0.00 S ATOM 1125 CE MET A 80 -3.662 -7.081 11.445 1.00 0.00 C ATOM 0 H MET A 80 0.230 -10.083 9.444 1.00 0.00 H new ATOM 0 HA MET A 80 0.202 -7.362 8.277 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.897 -8.774 8.108 1.00 0.00 H new ATOM 0 HB3 MET A 80 -1.961 -8.799 9.860 1.00 0.00 H new ATOM 0 HG2 MET A 80 -1.814 -6.148 9.557 1.00 0.00 H new ATOM 0 HG3 MET A 80 -2.455 -6.523 7.970 1.00 0.00 H new ATOM 0 HE1 MET A 80 -4.324 -7.794 11.937 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.627 -7.392 11.584 1.00 0.00 H new ATOM 0 HE3 MET A 80 -3.806 -6.092 11.881 1.00 0.00 H new ATOM 1135 N LEU A 81 0.747 -6.217 10.397 1.00 0.00 N ATOM 1136 CA LEU A 81 1.172 -5.544 11.619 1.00 0.00 C ATOM 1137 C LEU A 81 0.400 -4.245 11.822 1.00 0.00 C ATOM 1138 O LEU A 81 0.414 -3.348 10.979 1.00 0.00 O ATOM 1139 CB LEU A 81 2.674 -5.257 11.570 1.00 0.00 C ATOM 1140 CG LEU A 81 3.402 -5.258 12.915 1.00 0.00 C ATOM 1141 CD1 LEU A 81 2.912 -4.114 13.789 1.00 0.00 C ATOM 1142 CD2 LEU A 81 3.211 -6.592 13.624 1.00 0.00 C ATOM 0 H LEU A 81 0.825 -5.648 9.554 1.00 0.00 H new ATOM 0 HA LEU A 81 0.962 -6.204 12.460 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.144 -5.999 10.924 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.823 -4.285 11.100 1.00 0.00 H new ATOM 0 HG LEU A 81 4.467 -5.116 12.730 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.442 -4.131 14.742 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.101 -3.165 13.286 1.00 0.00 H new ATOM 0 HD13 LEU A 81 1.842 -4.224 13.967 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.736 -6.575 14.579 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.149 -6.763 13.797 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.612 -7.394 13.004 1.00 0.00 H new ATOM 1154 N PRO A 82 -0.288 -4.138 12.969 1.00 0.00 N ATOM 1155 CA PRO A 82 -1.077 -2.951 13.311 1.00 0.00 C ATOM 1156 C PRO A 82 -0.201 -1.740 13.611 1.00 0.00 C ATOM 1157 O PRO A 82 0.763 -1.831 14.371 1.00 0.00 O ATOM 1158 CB PRO A 82 -1.841 -3.382 14.565 1.00 0.00 C ATOM 1159 CG PRO A 82 -1.002 -4.454 15.170 1.00 0.00 C ATOM 1160 CD PRO A 82 -0.350 -5.169 14.019 1.00 0.00 C ATOM 0 HA PRO A 82 -1.721 -2.639 12.489 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.974 -2.548 15.254 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.836 -3.751 14.315 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.254 -4.032 15.841 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.610 -5.139 15.761 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.643 -5.534 14.283 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.933 -6.033 13.700 1.00 0.00 H new ATOM 1168 N VAL A 83 -0.542 -0.605 13.009 1.00 0.00 N ATOM 1169 CA VAL A 83 0.213 0.626 13.213 1.00 0.00 C ATOM 1170 C VAL A 83 -0.586 1.631 14.034 1.00 0.00 C ATOM 1171 O VAL A 83 -1.817 1.596 14.051 1.00 0.00 O ATOM 1172 CB VAL A 83 0.606 1.272 11.871 1.00 0.00 C ATOM 1173 CG1 VAL A 83 1.725 0.485 11.207 1.00 0.00 C ATOM 1174 CG2 VAL A 83 -0.603 1.373 10.954 1.00 0.00 C ATOM 0 H VAL A 83 -1.336 -0.512 12.376 1.00 0.00 H new ATOM 0 HA VAL A 83 1.118 0.356 13.757 1.00 0.00 H new ATOM 0 HB VAL A 83 0.970 2.281 12.066 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.989 0.956 10.260 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.597 0.470 11.861 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.392 -0.536 11.023 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.307 1.832 10.011 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.000 0.376 10.764 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.370 1.984 11.429 1.00 0.00 H new ATOM 1184 N ASP A 84 0.121 2.527 14.714 1.00 0.00 N ATOM 1185 CA ASP A 84 -0.523 3.544 15.537 1.00 0.00 C ATOM 1186 C ASP A 84 -0.927 4.749 14.693 1.00 0.00 C ATOM 1187 O ASP A 84 -1.915 5.423 14.989 1.00 0.00 O ATOM 1188 CB ASP A 84 0.412 3.986 16.664 1.00 0.00 C ATOM 1189 CG ASP A 84 1.339 2.875 17.116 1.00 0.00 C ATOM 1190 OD1 ASP A 84 0.834 1.847 17.614 1.00 0.00 O ATOM 1191 OD2 ASP A 84 2.570 3.033 16.972 1.00 0.00 O ATOM 0 H ASP A 84 1.140 2.570 14.712 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.423 3.109 15.972 1.00 0.00 H new ATOM 0 HB2 ASP A 84 1.005 4.836 16.327 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.182 4.327 17.512 1.00 0.00 H new ATOM 1196 N ARG A 85 -0.157 5.016 13.643 1.00 0.00 N ATOM 1197 CA ARG A 85 -0.434 6.141 12.759 1.00 0.00 C ATOM 1198 C ARG A 85 -0.612 5.669 11.318 1.00 0.00 C ATOM 1199 O ARG A 85 0.041 4.731 10.861 1.00 0.00 O ATOM 1200 CB ARG A 85 0.698 7.167 12.834 1.00 0.00 C ATOM 1201 CG ARG A 85 1.005 7.632 14.248 1.00 0.00 C ATOM 1202 CD ARG A 85 2.119 8.667 14.264 1.00 0.00 C ATOM 1203 NE ARG A 85 1.607 10.026 14.111 1.00 0.00 N ATOM 1204 CZ ARG A 85 0.834 10.625 15.010 1.00 0.00 C ATOM 1205 NH1 ARG A 85 0.486 9.989 16.120 1.00 0.00 N ATOM 1206 NH2 ARG A 85 0.407 11.864 14.800 1.00 0.00 N ATOM 0 H ARG A 85 0.664 4.468 13.384 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.362 6.609 13.088 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.599 6.734 12.399 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.434 8.032 12.225 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.106 8.056 14.696 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.293 6.777 14.859 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.671 8.591 15.201 1.00 0.00 H new ATOM 0 HD3 ARG A 85 2.824 8.453 13.461 1.00 0.00 H new ATOM 0 HE ARG A 85 1.856 10.543 13.268 1.00 0.00 H new ATOM 0 HH11 ARG A 85 0.812 9.037 16.286 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -0.108 10.452 16.808 1.00 0.00 H new ATOM 0 HH21 ARG A 85 0.672 12.357 13.948 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -0.187 12.323 15.491 1.00 0.00 H new ATOM 1220 N PRO A 86 -1.518 6.333 10.585 1.00 0.00 N ATOM 1221 CA PRO A 86 -1.804 5.999 9.187 1.00 0.00 C ATOM 1222 C PRO A 86 -0.647 6.355 8.259 1.00 0.00 C ATOM 1223 O PRO A 86 -0.576 5.876 7.127 1.00 0.00 O ATOM 1224 CB PRO A 86 -3.032 6.853 8.862 1.00 0.00 C ATOM 1225 CG PRO A 86 -2.957 8.001 9.808 1.00 0.00 C ATOM 1226 CD PRO A 86 -2.334 7.462 11.066 1.00 0.00 C ATOM 0 HA PRO A 86 -1.963 4.930 9.047 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -3.015 7.192 7.826 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.954 6.288 8.998 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -2.358 8.811 9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -3.948 8.408 10.007 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.724 8.214 11.567 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -3.089 7.136 11.781 1.00 0.00 H new ATOM 1234 N VAL A 87 0.258 7.199 8.745 1.00 0.00 N ATOM 1235 CA VAL A 87 1.412 7.617 7.959 1.00 0.00 C ATOM 1236 C VAL A 87 2.658 7.730 8.830 1.00 0.00 C ATOM 1237 O VAL A 87 2.596 7.556 10.046 1.00 0.00 O ATOM 1238 CB VAL A 87 1.159 8.970 7.267 1.00 0.00 C ATOM 1239 CG1 VAL A 87 -0.100 8.908 6.417 1.00 0.00 C ATOM 1240 CG2 VAL A 87 1.063 10.085 8.297 1.00 0.00 C ATOM 0 H VAL A 87 0.214 7.606 9.679 1.00 0.00 H new ATOM 0 HA VAL A 87 1.571 6.852 7.199 1.00 0.00 H new ATOM 0 HB VAL A 87 2.001 9.185 6.610 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -0.262 9.873 5.936 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.013 8.137 5.655 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.955 8.670 7.050 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.884 11.034 7.791 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.240 9.878 8.981 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.996 10.143 8.858 1.00 0.00 H new ATOM 1250 N GLY A 88 3.791 8.022 8.198 1.00 0.00 N ATOM 1251 CA GLY A 88 5.037 8.153 8.930 1.00 0.00 C ATOM 1252 C GLY A 88 6.027 7.056 8.592 1.00 0.00 C ATOM 1253 O GLY A 88 5.665 5.881 8.530 1.00 0.00 O ATOM 0 H GLY A 88 3.868 8.170 7.192 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.484 9.122 8.709 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.830 8.134 10.000 1.00 0.00 H new ATOM 1257 N MET A 89 7.280 7.440 8.370 1.00 0.00 N ATOM 1258 CA MET A 89 8.325 6.479 8.034 1.00 0.00 C ATOM 1259 C MET A 89 8.650 5.590 9.231 1.00 0.00 C ATOM 1260 O MET A 89 8.549 4.366 9.151 1.00 0.00 O ATOM 1261 CB MET A 89 9.586 7.208 7.568 1.00 0.00 C ATOM 1262 CG MET A 89 9.628 7.451 6.068 1.00 0.00 C ATOM 1263 SD MET A 89 10.420 6.104 5.168 1.00 0.00 S ATOM 1264 CE MET A 89 9.087 4.911 5.102 1.00 0.00 C ATOM 0 H MET A 89 7.596 8.409 8.417 1.00 0.00 H new ATOM 0 HA MET A 89 7.959 5.848 7.224 1.00 0.00 H new ATOM 0 HB2 MET A 89 9.654 8.165 8.085 1.00 0.00 H new ATOM 0 HB3 MET A 89 10.461 6.626 7.858 1.00 0.00 H new ATOM 0 HG2 MET A 89 8.612 7.583 5.697 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.163 8.380 5.869 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.202 4.285 4.217 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.114 4.286 5.994 1.00 0.00 H new ATOM 0 HE3 MET A 89 8.132 5.435 5.055 1.00 0.00 H new ATOM 1274 N ASP A 90 9.041 6.214 10.336 1.00 0.00 N ATOM 1275 CA ASP A 90 9.380 5.479 11.549 1.00 0.00 C ATOM 1276 C ASP A 90 8.349 4.390 11.832 1.00 0.00 C ATOM 1277 O ASP A 90 8.694 3.288 12.258 1.00 0.00 O ATOM 1278 CB ASP A 90 9.472 6.433 12.741 1.00 0.00 C ATOM 1279 CG ASP A 90 8.108 6.848 13.256 1.00 0.00 C ATOM 1280 OD1 ASP A 90 7.378 7.537 12.514 1.00 0.00 O ATOM 1281 OD2 ASP A 90 7.771 6.485 14.403 1.00 0.00 O ATOM 0 H ASP A 90 9.131 7.227 10.417 1.00 0.00 H new ATOM 0 HA ASP A 90 10.350 5.005 11.397 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.030 5.953 13.545 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.033 7.321 12.450 1.00 0.00 H new ATOM 1286 N THR A 91 7.080 4.708 11.592 1.00 0.00 N ATOM 1287 CA THR A 91 5.999 3.759 11.823 1.00 0.00 C ATOM 1288 C THR A 91 6.099 2.569 10.875 1.00 0.00 C ATOM 1289 O THR A 91 5.978 1.417 11.292 1.00 0.00 O ATOM 1290 CB THR A 91 4.621 4.425 11.649 1.00 0.00 C ATOM 1291 OG1 THR A 91 4.436 5.437 12.644 1.00 0.00 O ATOM 1292 CG2 THR A 91 3.505 3.395 11.752 1.00 0.00 C ATOM 0 H THR A 91 6.777 5.615 11.238 1.00 0.00 H new ATOM 0 HA THR A 91 6.099 3.410 12.851 1.00 0.00 H new ATOM 0 HB THR A 91 4.585 4.879 10.659 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.506 5.745 12.629 1.00 0.00 H new ATOM 0 HG21 THR A 91 2.541 3.889 11.626 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.632 2.642 10.974 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.542 2.915 12.730 1.00 0.00 H new ATOM 1300 N LEU A 92 6.322 2.855 9.597 1.00 0.00 N ATOM 1301 CA LEU A 92 6.441 1.808 8.588 1.00 0.00 C ATOM 1302 C LEU A 92 7.445 0.745 9.021 1.00 0.00 C ATOM 1303 O LEU A 92 7.083 -0.408 9.250 1.00 0.00 O ATOM 1304 CB LEU A 92 6.864 2.410 7.247 1.00 0.00 C ATOM 1305 CG LEU A 92 6.562 1.567 6.007 1.00 0.00 C ATOM 1306 CD1 LEU A 92 5.173 1.881 5.474 1.00 0.00 C ATOM 1307 CD2 LEU A 92 7.614 1.802 4.933 1.00 0.00 C ATOM 0 H LEU A 92 6.424 3.803 9.235 1.00 0.00 H new ATOM 0 HA LEU A 92 5.466 1.335 8.475 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.372 3.376 7.134 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.937 2.601 7.279 1.00 0.00 H new ATOM 0 HG LEU A 92 6.590 0.515 6.290 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.976 1.272 4.592 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.431 1.660 6.241 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.116 2.936 5.207 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.383 1.194 4.058 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.618 2.855 4.652 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.595 1.525 5.318 1.00 0.00 H new ATOM 1319 N ASN A 93 8.708 1.143 9.134 1.00 0.00 N ATOM 1320 CA ASN A 93 9.765 0.224 9.542 1.00 0.00 C ATOM 1321 C ASN A 93 9.407 -0.470 10.852 1.00 0.00 C ATOM 1322 O ASN A 93 9.395 -1.699 10.932 1.00 0.00 O ATOM 1323 CB ASN A 93 11.090 0.974 9.695 1.00 0.00 C ATOM 1324 CG ASN A 93 10.897 2.391 10.201 1.00 0.00 C ATOM 1325 OD1 ASN A 93 10.851 2.630 11.407 1.00 0.00 O ATOM 1326 ND2 ASN A 93 10.783 3.338 9.277 1.00 0.00 N ATOM 0 H ASN A 93 9.025 2.095 8.949 1.00 0.00 H new ATOM 0 HA ASN A 93 9.872 -0.535 8.767 1.00 0.00 H new ATOM 0 HB2 ASN A 93 11.735 0.430 10.385 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.602 1.001 8.733 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.651 4.310 9.557 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.827 3.093 8.288 1.00 0.00 H new ATOM 1333 N SER A 94 9.114 0.325 11.876 1.00 0.00 N ATOM 1334 CA SER A 94 8.758 -0.213 13.184 1.00 0.00 C ATOM 1335 C SER A 94 7.955 -1.503 13.041 1.00 0.00 C ATOM 1336 O SER A 94 8.189 -2.475 13.758 1.00 0.00 O ATOM 1337 CB SER A 94 7.953 0.816 13.980 1.00 0.00 C ATOM 1338 OG SER A 94 7.834 0.430 15.338 1.00 0.00 O ATOM 0 H SER A 94 9.116 1.344 11.825 1.00 0.00 H new ATOM 0 HA SER A 94 9.680 -0.437 13.720 1.00 0.00 H new ATOM 0 HB2 SER A 94 8.438 1.790 13.917 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.961 0.925 13.541 1.00 0.00 H new ATOM 0 HG SER A 94 7.317 1.105 15.826 1.00 0.00 H new ATOM 1344 N ALA A 95 7.009 -1.503 12.108 1.00 0.00 N ATOM 1345 CA ALA A 95 6.172 -2.672 11.868 1.00 0.00 C ATOM 1346 C ALA A 95 6.958 -3.774 11.166 1.00 0.00 C ATOM 1347 O ALA A 95 6.958 -4.925 11.604 1.00 0.00 O ATOM 1348 CB ALA A 95 4.950 -2.288 11.047 1.00 0.00 C ATOM 0 H ALA A 95 6.803 -0.706 11.506 1.00 0.00 H new ATOM 0 HA ALA A 95 5.841 -3.055 12.833 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.335 -3.171 10.876 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.369 -1.540 11.587 1.00 0.00 H new ATOM 0 HB3 ALA A 95 5.270 -1.877 10.089 1.00 0.00 H new ATOM 1354 N ILE A 96 7.626 -3.415 10.075 1.00 0.00 N ATOM 1355 CA ILE A 96 8.416 -4.374 9.313 1.00 0.00 C ATOM 1356 C ILE A 96 9.184 -5.312 10.238 1.00 0.00 C ATOM 1357 O ILE A 96 9.057 -6.532 10.146 1.00 0.00 O ATOM 1358 CB ILE A 96 9.412 -3.666 8.376 1.00 0.00 C ATOM 1359 CG1 ILE A 96 8.684 -2.645 7.499 1.00 0.00 C ATOM 1360 CG2 ILE A 96 10.146 -4.684 7.516 1.00 0.00 C ATOM 1361 CD1 ILE A 96 9.565 -2.021 6.440 1.00 0.00 C ATOM 0 H ILE A 96 7.636 -2.467 9.699 1.00 0.00 H new ATOM 0 HA ILE A 96 7.715 -4.953 8.713 1.00 0.00 H new ATOM 0 HB ILE A 96 10.146 -3.137 8.984 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.837 -3.132 7.015 1.00 0.00 H new ATOM 0 HG13 ILE A 96 8.278 -1.857 8.133 1.00 0.00 H new ATOM 0 HG21 ILE A 96 10.846 -4.168 6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 96 10.692 -5.376 8.157 1.00 0.00 H new ATOM 0 HG23 ILE A 96 9.426 -5.239 6.914 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.983 -1.308 5.856 1.00 0.00 H new ATOM 0 HD12 ILE A 96 10.398 -1.505 6.917 1.00 0.00 H new ATOM 0 HD13 ILE A 96 9.950 -2.800 5.782 1.00 0.00 H new ATOM 1373 N GLU A 97 9.981 -4.732 11.131 1.00 0.00 N ATOM 1374 CA GLU A 97 10.769 -5.517 12.074 1.00 0.00 C ATOM 1375 C GLU A 97 9.871 -6.418 12.916 1.00 0.00 C ATOM 1376 O GLU A 97 10.078 -7.629 12.984 1.00 0.00 O ATOM 1377 CB GLU A 97 11.581 -4.594 12.986 1.00 0.00 C ATOM 1378 CG GLU A 97 12.758 -3.932 12.288 1.00 0.00 C ATOM 1379 CD GLU A 97 13.427 -2.877 13.148 1.00 0.00 C ATOM 1380 OE1 GLU A 97 13.482 -3.064 14.382 1.00 0.00 O ATOM 1381 OE2 GLU A 97 13.897 -1.866 12.586 1.00 0.00 O ATOM 0 H GLU A 97 10.098 -3.723 11.221 1.00 0.00 H new ATOM 0 HA GLU A 97 11.452 -6.145 11.502 1.00 0.00 H new ATOM 0 HB2 GLU A 97 10.924 -3.821 13.385 1.00 0.00 H new ATOM 0 HB3 GLU A 97 11.949 -5.169 13.836 1.00 0.00 H new ATOM 0 HG2 GLU A 97 13.490 -4.693 12.017 1.00 0.00 H new ATOM 0 HG3 GLU A 97 12.415 -3.475 11.360 1.00 0.00 H new ATOM 1388 N ASN A 98 8.873 -5.818 13.556 1.00 0.00 N ATOM 1389 CA ASN A 98 7.943 -6.566 14.395 1.00 0.00 C ATOM 1390 C ASN A 98 7.660 -7.942 13.800 1.00 0.00 C ATOM 1391 O ASN A 98 7.612 -8.943 14.516 1.00 0.00 O ATOM 1392 CB ASN A 98 6.634 -5.790 14.559 1.00 0.00 C ATOM 1393 CG ASN A 98 5.956 -6.075 15.885 1.00 0.00 C ATOM 1394 OD1 ASN A 98 6.035 -7.186 16.410 1.00 0.00 O ATOM 1395 ND2 ASN A 98 5.283 -5.070 16.433 1.00 0.00 N ATOM 0 H ASN A 98 8.687 -4.816 13.510 1.00 0.00 H new ATOM 0 HA ASN A 98 8.403 -6.700 15.374 1.00 0.00 H new ATOM 0 HB2 ASN A 98 6.835 -4.722 14.479 1.00 0.00 H new ATOM 0 HB3 ASN A 98 5.957 -6.048 13.745 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.805 -5.202 17.324 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.244 -4.166 15.963 1.00 0.00 H new ATOM 1402 N LEU A 99 7.474 -7.985 12.485 1.00 0.00 N ATOM 1403 CA LEU A 99 7.196 -9.239 11.792 1.00 0.00 C ATOM 1404 C LEU A 99 8.484 -10.014 11.532 1.00 0.00 C ATOM 1405 O LEU A 99 8.553 -11.220 11.768 1.00 0.00 O ATOM 1406 CB LEU A 99 6.476 -8.965 10.471 1.00 0.00 C ATOM 1407 CG LEU A 99 5.129 -8.251 10.576 1.00 0.00 C ATOM 1408 CD1 LEU A 99 4.675 -7.763 9.209 1.00 0.00 C ATOM 1409 CD2 LEU A 99 4.083 -9.171 11.189 1.00 0.00 C ATOM 0 H LEU A 99 7.511 -7.167 11.877 1.00 0.00 H new ATOM 0 HA LEU A 99 6.552 -9.844 12.430 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.133 -8.367 9.840 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.322 -9.916 9.961 1.00 0.00 H new ATOM 0 HG LEU A 99 5.249 -7.385 11.227 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.714 -7.257 9.304 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.413 -7.068 8.807 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.572 -8.613 8.535 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.130 -8.645 11.256 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.966 -10.056 10.564 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.402 -9.471 12.187 1.00 0.00 H new ATOM 1421 N MET A 100 9.503 -9.312 11.047 1.00 0.00 N ATOM 1422 CA MET A 100 10.790 -9.934 10.758 1.00 0.00 C ATOM 1423 C MET A 100 11.180 -10.914 11.860 1.00 0.00 C ATOM 1424 O MET A 100 11.672 -12.009 11.586 1.00 0.00 O ATOM 1425 CB MET A 100 11.874 -8.865 10.603 1.00 0.00 C ATOM 1426 CG MET A 100 11.855 -8.173 9.250 1.00 0.00 C ATOM 1427 SD MET A 100 13.436 -7.407 8.840 1.00 0.00 S ATOM 1428 CE MET A 100 13.575 -7.826 7.104 1.00 0.00 C ATOM 0 H MET A 100 9.463 -8.313 10.846 1.00 0.00 H new ATOM 0 HA MET A 100 10.697 -10.485 9.822 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.750 -8.117 11.386 1.00 0.00 H new ATOM 0 HB3 MET A 100 12.851 -9.325 10.753 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.596 -8.898 8.479 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.075 -7.412 9.246 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.360 -7.225 6.646 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.822 -8.883 7.003 1.00 0.00 H new ATOM 0 HE3 MET A 100 12.627 -7.626 6.604 1.00 0.00 H new ATOM 1438 N THR A 101 10.957 -10.514 13.108 1.00 0.00 N ATOM 1439 CA THR A 101 11.285 -11.356 14.251 1.00 0.00 C ATOM 1440 C THR A 101 10.199 -12.396 14.498 1.00 0.00 C ATOM 1441 O THR A 101 10.480 -13.502 14.960 1.00 0.00 O ATOM 1442 CB THR A 101 11.478 -10.518 15.529 1.00 0.00 C ATOM 1443 OG1 THR A 101 12.154 -11.292 16.526 1.00 0.00 O ATOM 1444 CG2 THR A 101 10.138 -10.043 16.072 1.00 0.00 C ATOM 0 H THR A 101 10.550 -9.611 13.353 1.00 0.00 H new ATOM 0 HA THR A 101 12.221 -11.862 14.012 1.00 0.00 H new ATOM 0 HB THR A 101 12.081 -9.646 15.277 1.00 0.00 H new ATOM 0 HG1 THR A 101 12.274 -10.751 17.334 1.00 0.00 H new ATOM 0 HG21 THR A 101 10.299 -9.453 16.974 1.00 0.00 H new ATOM 0 HG22 THR A 101 9.638 -9.429 15.322 1.00 0.00 H new ATOM 0 HG23 THR A 101 9.515 -10.905 16.309 1.00 0.00 H new ATOM 1452 N SER A 102 8.959 -12.036 14.187 1.00 0.00 N ATOM 1453 CA SER A 102 7.829 -12.938 14.378 1.00 0.00 C ATOM 1454 C SER A 102 8.036 -14.238 13.606 1.00 0.00 C ATOM 1455 O SER A 102 7.933 -15.329 14.166 1.00 0.00 O ATOM 1456 CB SER A 102 6.530 -12.266 13.929 1.00 0.00 C ATOM 1457 OG SER A 102 5.428 -13.147 14.062 1.00 0.00 O ATOM 0 H SER A 102 8.710 -11.125 13.801 1.00 0.00 H new ATOM 0 HA SER A 102 7.759 -13.173 15.440 1.00 0.00 H new ATOM 0 HB2 SER A 102 6.356 -11.369 14.524 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.622 -11.947 12.891 1.00 0.00 H new ATOM 0 HG SER A 102 4.610 -12.694 13.770 1.00 0.00 H new ATOM 1463 N SER A 103 8.328 -14.112 12.315 1.00 0.00 N ATOM 1464 CA SER A 103 8.545 -15.276 11.464 1.00 0.00 C ATOM 1465 C SER A 103 9.858 -15.150 10.696 1.00 0.00 C ATOM 1466 O SER A 103 10.368 -14.048 10.495 1.00 0.00 O ATOM 1467 CB SER A 103 7.382 -15.441 10.483 1.00 0.00 C ATOM 1468 OG SER A 103 6.913 -14.183 10.032 1.00 0.00 O ATOM 0 H SER A 103 8.420 -13.216 11.836 1.00 0.00 H new ATOM 0 HA SER A 103 8.600 -16.157 12.103 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.703 -16.040 9.631 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.569 -15.984 10.966 1.00 0.00 H new ATOM 0 HG SER A 103 7.132 -14.073 9.083 1.00 0.00 H new ATOM 1474 N SER A 104 10.398 -16.287 10.271 1.00 0.00 N ATOM 1475 CA SER A 104 11.654 -16.306 9.529 1.00 0.00 C ATOM 1476 C SER A 104 11.415 -16.014 8.051 1.00 0.00 C ATOM 1477 O SER A 104 10.288 -16.096 7.563 1.00 0.00 O ATOM 1478 CB SER A 104 12.344 -17.662 9.688 1.00 0.00 C ATOM 1479 OG SER A 104 12.705 -17.895 11.038 1.00 0.00 O ATOM 0 H SER A 104 9.986 -17.207 10.427 1.00 0.00 H new ATOM 0 HA SER A 104 12.300 -15.528 9.936 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.679 -18.454 9.344 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.234 -17.697 9.059 1.00 0.00 H new ATOM 0 HG SER A 104 13.143 -18.769 11.113 1.00 0.00 H new ATOM 1485 N LYS A 105 12.486 -15.673 7.341 1.00 0.00 N ATOM 1486 CA LYS A 105 12.396 -15.370 5.918 1.00 0.00 C ATOM 1487 C LYS A 105 11.734 -16.514 5.158 1.00 0.00 C ATOM 1488 O LYS A 105 10.872 -16.290 4.309 1.00 0.00 O ATOM 1489 CB LYS A 105 13.790 -15.101 5.344 1.00 0.00 C ATOM 1490 CG LYS A 105 13.777 -14.702 3.879 1.00 0.00 C ATOM 1491 CD LYS A 105 15.046 -13.961 3.492 1.00 0.00 C ATOM 1492 CE LYS A 105 14.912 -13.301 2.128 1.00 0.00 C ATOM 1493 NZ LYS A 105 15.219 -14.248 1.021 1.00 0.00 N ATOM 0 H LYS A 105 13.427 -15.600 7.729 1.00 0.00 H new ATOM 0 HA LYS A 105 11.782 -14.477 5.801 1.00 0.00 H new ATOM 0 HB2 LYS A 105 14.266 -14.310 5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 105 14.402 -15.995 5.463 1.00 0.00 H new ATOM 0 HG2 LYS A 105 13.671 -15.592 3.259 1.00 0.00 H new ATOM 0 HG3 LYS A 105 12.911 -14.071 3.680 1.00 0.00 H new ATOM 0 HD2 LYS A 105 15.270 -13.204 4.243 1.00 0.00 H new ATOM 0 HD3 LYS A 105 15.885 -14.656 3.480 1.00 0.00 H new ATOM 0 HE2 LYS A 105 13.899 -12.918 2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 105 15.585 -12.445 2.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 15.116 -13.760 0.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 16.195 -14.594 1.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 14.561 -15.052 1.060 1.00 0.00 H new ATOM 1507 N GLU A 106 12.142 -17.740 5.470 1.00 0.00 N ATOM 1508 CA GLU A 106 11.587 -18.919 4.816 1.00 0.00 C ATOM 1509 C GLU A 106 10.157 -19.177 5.283 1.00 0.00 C ATOM 1510 O GLU A 106 9.329 -19.687 4.528 1.00 0.00 O ATOM 1511 CB GLU A 106 12.457 -20.145 5.101 1.00 0.00 C ATOM 1512 CG GLU A 106 12.484 -20.545 6.567 1.00 0.00 C ATOM 1513 CD GLU A 106 13.278 -21.814 6.811 1.00 0.00 C ATOM 1514 OE1 GLU A 106 12.962 -22.843 6.177 1.00 0.00 O ATOM 1515 OE2 GLU A 106 14.215 -21.777 7.635 1.00 0.00 O ATOM 0 H GLU A 106 12.855 -17.943 6.171 1.00 0.00 H new ATOM 0 HA GLU A 106 11.573 -18.734 3.742 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.091 -20.985 4.511 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.475 -19.942 4.770 1.00 0.00 H new ATOM 0 HG2 GLU A 106 12.914 -19.733 7.153 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.463 -20.686 6.920 1.00 0.00 H new ATOM 1522 N ASP A 107 9.875 -18.822 6.532 1.00 0.00 N ATOM 1523 CA ASP A 107 8.546 -19.014 7.100 1.00 0.00 C ATOM 1524 C ASP A 107 7.504 -18.210 6.329 1.00 0.00 C ATOM 1525 O ASP A 107 6.311 -18.508 6.383 1.00 0.00 O ATOM 1526 CB ASP A 107 8.535 -18.608 8.574 1.00 0.00 C ATOM 1527 CG ASP A 107 8.886 -19.759 9.496 1.00 0.00 C ATOM 1528 OD1 ASP A 107 8.701 -20.924 9.085 1.00 0.00 O ATOM 1529 OD2 ASP A 107 9.344 -19.496 10.627 1.00 0.00 O ATOM 0 H ASP A 107 10.549 -18.400 7.170 1.00 0.00 H new ATOM 0 HA ASP A 107 8.293 -20.071 7.021 1.00 0.00 H new ATOM 0 HB2 ASP A 107 9.243 -17.794 8.729 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.548 -18.226 8.835 1.00 0.00 H new ATOM 1534 N TRP A 108 7.963 -17.189 5.615 1.00 0.00 N ATOM 1535 CA TRP A 108 7.070 -16.340 4.834 1.00 0.00 C ATOM 1536 C TRP A 108 6.587 -17.064 3.583 1.00 0.00 C ATOM 1537 O TRP A 108 7.374 -17.465 2.725 1.00 0.00 O ATOM 1538 CB TRP A 108 7.778 -15.041 4.445 1.00 0.00 C ATOM 1539 CG TRP A 108 8.441 -14.356 5.602 1.00 0.00 C ATOM 1540 CD1 TRP A 108 8.160 -14.529 6.927 1.00 0.00 C ATOM 1541 CD2 TRP A 108 9.494 -13.389 5.536 1.00 0.00 C ATOM 1542 NE1 TRP A 108 8.975 -13.727 7.689 1.00 0.00 N ATOM 1543 CE2 TRP A 108 9.803 -13.018 6.860 1.00 0.00 C ATOM 1544 CE3 TRP A 108 10.207 -12.800 4.488 1.00 0.00 C ATOM 1545 CZ2 TRP A 108 10.792 -12.086 7.160 1.00 0.00 C ATOM 1546 CZ3 TRP A 108 11.189 -11.875 4.788 1.00 0.00 C ATOM 1547 CH2 TRP A 108 11.475 -11.526 6.115 1.00 0.00 C ATOM 0 H TRP A 108 8.948 -16.929 5.560 1.00 0.00 H new ATOM 0 HA TRP A 108 6.203 -16.102 5.451 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.527 -15.258 3.683 1.00 0.00 H new ATOM 0 HB3 TRP A 108 7.054 -14.361 3.996 1.00 0.00 H new ATOM 0 HD1 TRP A 108 7.408 -15.198 7.318 1.00 0.00 H new ATOM 0 HE1 TRP A 108 8.965 -13.669 8.707 1.00 0.00 H new ATOM 0 HE3 TRP A 108 9.994 -13.063 3.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 11.013 -11.814 8.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.746 -11.413 3.986 1.00 0.00 H new ATOM 0 HH2 TRP A 108 12.250 -10.801 6.317 1.00 0.00 H new ATOM 1558 N PRO A 109 5.261 -17.237 3.472 1.00 0.00 N ATOM 1559 CA PRO A 109 4.643 -17.914 2.328 1.00 0.00 C ATOM 1560 C PRO A 109 4.741 -17.093 1.047 1.00 0.00 C ATOM 1561 O PRO A 109 4.259 -15.962 0.985 1.00 0.00 O ATOM 1562 CB PRO A 109 3.181 -18.068 2.754 1.00 0.00 C ATOM 1563 CG PRO A 109 2.956 -16.972 3.738 1.00 0.00 C ATOM 1564 CD PRO A 109 4.263 -16.785 4.457 1.00 0.00 C ATOM 0 HA PRO A 109 5.136 -18.859 2.099 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.508 -17.978 1.901 1.00 0.00 H new ATOM 0 HB3 PRO A 109 3.000 -19.045 3.201 1.00 0.00 H new ATOM 0 HG2 PRO A 109 2.652 -16.053 3.236 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.160 -17.232 4.436 1.00 0.00 H new ATOM 0 HD2 PRO A 109 4.421 -15.744 4.740 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.306 -17.375 5.373 1.00 0.00 H new ATOM 1572 N SER A 110 5.368 -17.669 0.026 1.00 0.00 N ATOM 1573 CA SER A 110 5.532 -16.988 -1.253 1.00 0.00 C ATOM 1574 C SER A 110 4.179 -16.583 -1.830 1.00 0.00 C ATOM 1575 O SER A 110 3.331 -17.431 -2.109 1.00 0.00 O ATOM 1576 CB SER A 110 6.272 -17.890 -2.243 1.00 0.00 C ATOM 1577 OG SER A 110 7.662 -17.917 -1.968 1.00 0.00 O ATOM 0 H SER A 110 5.771 -18.606 0.060 1.00 0.00 H new ATOM 0 HA SER A 110 6.120 -16.086 -1.084 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.868 -18.901 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.106 -17.533 -3.259 1.00 0.00 H new ATOM 0 HG SER A 110 8.112 -18.502 -2.613 1.00 0.00 H new ATOM 1583 N VAL A 111 3.984 -15.280 -2.005 1.00 0.00 N ATOM 1584 CA VAL A 111 2.735 -14.760 -2.550 1.00 0.00 C ATOM 1585 C VAL A 111 2.982 -13.960 -3.824 1.00 0.00 C ATOM 1586 O VAL A 111 4.123 -13.788 -4.249 1.00 0.00 O ATOM 1587 CB VAL A 111 2.007 -13.866 -1.529 1.00 0.00 C ATOM 1588 CG1 VAL A 111 1.542 -14.687 -0.336 1.00 0.00 C ATOM 1589 CG2 VAL A 111 2.908 -12.724 -1.082 1.00 0.00 C ATOM 0 H VAL A 111 4.675 -14.565 -1.777 1.00 0.00 H new ATOM 0 HA VAL A 111 2.108 -15.621 -2.781 1.00 0.00 H new ATOM 0 HB VAL A 111 1.128 -13.438 -2.010 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.030 -14.038 0.375 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.858 -15.466 -0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.404 -15.146 0.148 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.377 -12.103 -0.361 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.807 -13.130 -0.619 1.00 0.00 H new ATOM 0 HG23 VAL A 111 3.186 -12.120 -1.946 1.00 0.00 H new ATOM 1599 N ASN A 112 1.903 -13.474 -4.429 1.00 0.00 N ATOM 1600 CA ASN A 112 2.002 -12.692 -5.656 1.00 0.00 C ATOM 1601 C ASN A 112 1.223 -11.386 -5.534 1.00 0.00 C ATOM 1602 O ASN A 112 0.141 -11.351 -4.948 1.00 0.00 O ATOM 1603 CB ASN A 112 1.480 -13.501 -6.845 1.00 0.00 C ATOM 1604 CG ASN A 112 2.521 -14.456 -7.397 1.00 0.00 C ATOM 1605 OD1 ASN A 112 3.703 -14.122 -7.481 1.00 0.00 O ATOM 1606 ND2 ASN A 112 2.086 -15.652 -7.776 1.00 0.00 N ATOM 0 H ASN A 112 0.950 -13.608 -4.090 1.00 0.00 H new ATOM 0 HA ASN A 112 3.053 -12.453 -5.821 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.600 -14.066 -6.538 1.00 0.00 H new ATOM 0 HB3 ASN A 112 1.162 -12.819 -7.634 1.00 0.00 H new ATOM 0 HD21 ASN A 112 2.741 -16.336 -8.155 1.00 0.00 H new ATOM 0 HD22 ASN A 112 1.097 -15.886 -7.688 1.00 0.00 H new ATOM 1613 N MET A 113 1.780 -10.316 -6.090 1.00 0.00 N ATOM 1614 CA MET A 113 1.136 -9.009 -6.045 1.00 0.00 C ATOM 1615 C MET A 113 0.327 -8.757 -7.313 1.00 0.00 C ATOM 1616 O MET A 113 0.886 -8.462 -8.369 1.00 0.00 O ATOM 1617 CB MET A 113 2.182 -7.907 -5.866 1.00 0.00 C ATOM 1618 CG MET A 113 1.586 -6.555 -5.509 1.00 0.00 C ATOM 1619 SD MET A 113 2.810 -5.411 -4.841 1.00 0.00 S ATOM 1620 CE MET A 113 3.212 -6.214 -3.291 1.00 0.00 C ATOM 0 H MET A 113 2.676 -10.328 -6.577 1.00 0.00 H new ATOM 0 HA MET A 113 0.456 -8.996 -5.193 1.00 0.00 H new ATOM 0 HB2 MET A 113 2.881 -8.204 -5.084 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.757 -7.810 -6.787 1.00 0.00 H new ATOM 0 HG2 MET A 113 1.131 -6.117 -6.397 1.00 0.00 H new ATOM 0 HG3 MET A 113 0.789 -6.695 -4.779 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.063 -5.514 -2.469 1.00 0.00 H new ATOM 0 HE2 MET A 113 2.565 -7.080 -3.152 1.00 0.00 H new ATOM 0 HE3 MET A 113 4.253 -6.537 -3.308 1.00 0.00 H new ATOM 1630 N ASN A 114 -0.992 -8.875 -7.202 1.00 0.00 N ATOM 1631 CA ASN A 114 -1.878 -8.661 -8.341 1.00 0.00 C ATOM 1632 C ASN A 114 -2.379 -7.221 -8.377 1.00 0.00 C ATOM 1633 O ASN A 114 -3.351 -6.873 -7.706 1.00 0.00 O ATOM 1634 CB ASN A 114 -3.064 -9.625 -8.279 1.00 0.00 C ATOM 1635 CG ASN A 114 -3.612 -9.957 -9.653 1.00 0.00 C ATOM 1636 OD1 ASN A 114 -2.893 -9.901 -10.651 1.00 0.00 O ATOM 1637 ND2 ASN A 114 -4.893 -10.303 -9.712 1.00 0.00 N ATOM 0 H ASN A 114 -1.471 -9.118 -6.335 1.00 0.00 H new ATOM 0 HA ASN A 114 -1.311 -8.852 -9.252 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -2.755 -10.545 -7.782 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.855 -9.185 -7.672 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -5.318 -10.535 -10.610 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -5.452 -10.336 -8.860 1.00 0.00 H new ATOM 1644 N VAL A 115 -1.709 -6.386 -9.165 1.00 0.00 N ATOM 1645 CA VAL A 115 -2.087 -4.984 -9.290 1.00 0.00 C ATOM 1646 C VAL A 115 -2.927 -4.751 -10.541 1.00 0.00 C ATOM 1647 O VAL A 115 -2.399 -4.672 -11.650 1.00 0.00 O ATOM 1648 CB VAL A 115 -0.847 -4.071 -9.341 1.00 0.00 C ATOM 1649 CG1 VAL A 115 -1.262 -2.608 -9.374 1.00 0.00 C ATOM 1650 CG2 VAL A 115 0.066 -4.348 -8.156 1.00 0.00 C ATOM 0 H VAL A 115 -0.902 -6.657 -9.726 1.00 0.00 H new ATOM 0 HA VAL A 115 -2.677 -4.735 -8.408 1.00 0.00 H new ATOM 0 HB VAL A 115 -0.295 -4.288 -10.255 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.373 -1.978 -9.410 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.873 -2.423 -10.257 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.837 -2.373 -8.479 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.937 -3.695 -8.207 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.475 -4.160 -7.228 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.391 -5.388 -8.182 1.00 0.00 H new ATOM 1660 N ALA A 116 -4.238 -4.641 -10.354 1.00 0.00 N ATOM 1661 CA ALA A 116 -5.152 -4.414 -11.467 1.00 0.00 C ATOM 1662 C ALA A 116 -6.212 -3.379 -11.105 1.00 0.00 C ATOM 1663 O ALA A 116 -6.716 -3.360 -9.981 1.00 0.00 O ATOM 1664 CB ALA A 116 -5.809 -5.721 -11.885 1.00 0.00 C ATOM 0 H ALA A 116 -4.691 -4.705 -9.442 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.574 -4.026 -12.306 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -6.489 -5.537 -12.717 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -5.042 -6.431 -12.194 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.368 -6.133 -11.044 1.00 0.00 H new ATOM 1670 N ASP A 117 -6.545 -2.521 -12.062 1.00 0.00 N ATOM 1671 CA ASP A 117 -7.546 -1.483 -11.843 1.00 0.00 C ATOM 1672 C ASP A 117 -7.238 -0.689 -10.577 1.00 0.00 C ATOM 1673 O ASP A 117 -8.139 -0.357 -9.807 1.00 0.00 O ATOM 1674 CB ASP A 117 -8.941 -2.102 -11.746 1.00 0.00 C ATOM 1675 CG ASP A 117 -10.037 -1.123 -12.120 1.00 0.00 C ATOM 1676 OD1 ASP A 117 -10.316 -0.210 -11.315 1.00 0.00 O ATOM 1677 OD2 ASP A 117 -10.615 -1.271 -13.217 1.00 0.00 O ATOM 0 H ASP A 117 -6.137 -2.523 -12.997 1.00 0.00 H new ATOM 0 HA ASP A 117 -7.518 -0.801 -12.693 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.996 -2.972 -12.401 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -9.107 -2.458 -10.729 1.00 0.00 H new ATOM 1682 N ALA A 118 -5.960 -0.389 -10.369 1.00 0.00 N ATOM 1683 CA ALA A 118 -5.534 0.366 -9.197 1.00 0.00 C ATOM 1684 C ALA A 118 -5.947 -0.339 -7.910 1.00 0.00 C ATOM 1685 O ALA A 118 -6.450 0.290 -6.978 1.00 0.00 O ATOM 1686 CB ALA A 118 -6.111 1.774 -9.238 1.00 0.00 C ATOM 0 H ALA A 118 -5.202 -0.657 -10.997 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.446 0.430 -9.212 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.785 2.327 -8.357 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.762 2.284 -10.136 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.200 1.721 -9.251 1.00 0.00 H new ATOM 1692 N THR A 119 -5.731 -1.650 -7.863 1.00 0.00 N ATOM 1693 CA THR A 119 -6.082 -2.441 -6.691 1.00 0.00 C ATOM 1694 C THR A 119 -5.015 -3.489 -6.395 1.00 0.00 C ATOM 1695 O THR A 119 -4.744 -4.363 -7.218 1.00 0.00 O ATOM 1696 CB THR A 119 -7.440 -3.146 -6.874 1.00 0.00 C ATOM 1697 OG1 THR A 119 -8.435 -2.196 -7.271 1.00 0.00 O ATOM 1698 CG2 THR A 119 -7.872 -3.832 -5.587 1.00 0.00 C ATOM 0 H THR A 119 -5.314 -2.186 -8.624 1.00 0.00 H new ATOM 0 HA THR A 119 -6.151 -1.748 -5.852 1.00 0.00 H new ATOM 0 HB THR A 119 -7.330 -3.903 -7.651 1.00 0.00 H new ATOM 0 HG1 THR A 119 -9.295 -2.652 -7.387 1.00 0.00 H new ATOM 0 HG21 THR A 119 -8.833 -4.323 -5.741 1.00 0.00 H new ATOM 0 HG22 THR A 119 -7.127 -4.575 -5.303 1.00 0.00 H new ATOM 0 HG23 THR A 119 -7.966 -3.091 -4.793 1.00 0.00 H new ATOM 1706 N VAL A 120 -4.412 -3.395 -5.214 1.00 0.00 N ATOM 1707 CA VAL A 120 -3.376 -4.337 -4.808 1.00 0.00 C ATOM 1708 C VAL A 120 -3.979 -5.559 -4.126 1.00 0.00 C ATOM 1709 O VAL A 120 -4.508 -5.469 -3.018 1.00 0.00 O ATOM 1710 CB VAL A 120 -2.363 -3.678 -3.852 1.00 0.00 C ATOM 1711 CG1 VAL A 120 -1.333 -4.695 -3.382 1.00 0.00 C ATOM 1712 CG2 VAL A 120 -1.686 -2.495 -4.527 1.00 0.00 C ATOM 0 H VAL A 120 -4.623 -2.676 -4.522 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.860 -4.650 -5.716 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.900 -3.310 -2.978 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -0.626 -4.212 -2.708 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.837 -5.507 -2.858 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -0.798 -5.095 -4.243 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -0.974 -2.041 -3.838 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -1.161 -2.837 -5.419 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -2.438 -1.758 -4.809 1.00 0.00 H new ATOM 1722 N THR A 121 -3.897 -6.705 -4.797 1.00 0.00 N ATOM 1723 CA THR A 121 -4.436 -7.947 -4.257 1.00 0.00 C ATOM 1724 C THR A 121 -3.352 -9.012 -4.143 1.00 0.00 C ATOM 1725 O THR A 121 -2.819 -9.480 -5.149 1.00 0.00 O ATOM 1726 CB THR A 121 -5.583 -8.488 -5.131 1.00 0.00 C ATOM 1727 OG1 THR A 121 -6.390 -7.405 -5.606 1.00 0.00 O ATOM 1728 CG2 THR A 121 -6.446 -9.465 -4.346 1.00 0.00 C ATOM 0 H THR A 121 -3.462 -6.798 -5.715 1.00 0.00 H new ATOM 0 HA THR A 121 -4.823 -7.719 -3.264 1.00 0.00 H new ATOM 0 HB THR A 121 -5.147 -9.014 -5.980 1.00 0.00 H new ATOM 0 HG1 THR A 121 -7.116 -7.757 -6.162 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.250 -9.834 -4.983 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.834 -10.303 -4.011 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.873 -8.959 -3.480 1.00 0.00 H new ATOM 1736 N VAL A 122 -3.030 -9.393 -2.911 1.00 0.00 N ATOM 1737 CA VAL A 122 -2.011 -10.406 -2.665 1.00 0.00 C ATOM 1738 C VAL A 122 -2.580 -11.811 -2.833 1.00 0.00 C ATOM 1739 O VAL A 122 -3.152 -12.375 -1.900 1.00 0.00 O ATOM 1740 CB VAL A 122 -1.414 -10.271 -1.252 1.00 0.00 C ATOM 1741 CG1 VAL A 122 -0.506 -11.451 -0.940 1.00 0.00 C ATOM 1742 CG2 VAL A 122 -0.660 -8.957 -1.116 1.00 0.00 C ATOM 0 H VAL A 122 -3.461 -9.015 -2.067 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.223 -10.246 -3.401 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.231 -10.272 -0.530 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.094 -11.338 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.080 -12.376 -0.994 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.307 -11.486 -1.665 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.245 -8.878 -0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.148 -8.924 -1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.343 -8.126 -1.293 1.00 0.00 H new ATOM 1752 N ILE A 123 -2.419 -12.370 -4.027 1.00 0.00 N ATOM 1753 CA ILE A 123 -2.915 -13.709 -4.316 1.00 0.00 C ATOM 1754 C ILE A 123 -1.844 -14.762 -4.050 1.00 0.00 C ATOM 1755 O ILE A 123 -0.672 -14.563 -4.368 1.00 0.00 O ATOM 1756 CB ILE A 123 -3.387 -13.832 -5.777 1.00 0.00 C ATOM 1757 CG1 ILE A 123 -4.192 -12.595 -6.182 1.00 0.00 C ATOM 1758 CG2 ILE A 123 -4.216 -15.094 -5.962 1.00 0.00 C ATOM 1759 CD1 ILE A 123 -5.620 -12.614 -5.683 1.00 0.00 C ATOM 0 H ILE A 123 -1.949 -11.916 -4.810 1.00 0.00 H new ATOM 0 HA ILE A 123 -3.763 -13.880 -3.653 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.511 -13.899 -6.422 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.693 -11.705 -5.798 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.196 -12.514 -7.269 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.542 -15.166 -7.000 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.613 -15.966 -5.710 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -5.088 -15.055 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.131 -11.707 -6.007 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.135 -13.485 -6.088 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.624 -12.663 -4.594 1.00 0.00 H new ATOM 1771 N SER A 124 -2.256 -15.882 -3.466 1.00 0.00 N ATOM 1772 CA SER A 124 -1.332 -16.966 -3.154 1.00 0.00 C ATOM 1773 C SER A 124 -0.660 -17.488 -4.421 1.00 0.00 C ATOM 1774 O SER A 124 -1.208 -17.379 -5.517 1.00 0.00 O ATOM 1775 CB SER A 124 -2.068 -18.106 -2.448 1.00 0.00 C ATOM 1776 OG SER A 124 -1.463 -19.356 -2.729 1.00 0.00 O ATOM 0 H SER A 124 -3.224 -16.063 -3.199 1.00 0.00 H new ATOM 0 HA SER A 124 -0.562 -16.574 -2.489 1.00 0.00 H new ATOM 0 HB2 SER A 124 -2.067 -17.932 -1.372 1.00 0.00 H new ATOM 0 HB3 SER A 124 -3.110 -18.123 -2.767 1.00 0.00 H new ATOM 0 HG SER A 124 -1.951 -20.068 -2.265 1.00 0.00 H new ATOM 1782 N GLU A 125 0.532 -18.055 -4.260 1.00 0.00 N ATOM 1783 CA GLU A 125 1.280 -18.593 -5.391 1.00 0.00 C ATOM 1784 C GLU A 125 0.414 -19.543 -6.214 1.00 0.00 C ATOM 1785 O GLU A 125 0.219 -19.343 -7.413 1.00 0.00 O ATOM 1786 CB GLU A 125 2.532 -19.322 -4.902 1.00 0.00 C ATOM 1787 CG GLU A 125 3.457 -19.764 -6.024 1.00 0.00 C ATOM 1788 CD GLU A 125 4.878 -19.999 -5.550 1.00 0.00 C ATOM 1789 OE1 GLU A 125 5.128 -21.045 -4.916 1.00 0.00 O ATOM 1790 OE2 GLU A 125 5.741 -19.135 -5.815 1.00 0.00 O ATOM 0 H GLU A 125 1.000 -18.154 -3.359 1.00 0.00 H new ATOM 0 HA GLU A 125 1.578 -17.759 -6.026 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.082 -18.668 -4.226 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.231 -20.196 -4.325 1.00 0.00 H new ATOM 0 HG2 GLU A 125 3.070 -20.681 -6.469 1.00 0.00 H new ATOM 0 HG3 GLU A 125 3.460 -19.006 -6.807 1.00 0.00 H new ATOM 1797 N LYS A 126 -0.104 -20.578 -5.561 1.00 0.00 N ATOM 1798 CA LYS A 126 -0.950 -21.559 -6.229 1.00 0.00 C ATOM 1799 C LYS A 126 -2.410 -21.117 -6.217 1.00 0.00 C ATOM 1800 O LYS A 126 -2.964 -20.748 -7.251 1.00 0.00 O ATOM 1801 CB LYS A 126 -0.814 -22.925 -5.552 1.00 0.00 C ATOM 1802 CG LYS A 126 0.595 -23.491 -5.601 1.00 0.00 C ATOM 1803 CD LYS A 126 0.794 -24.388 -6.811 1.00 0.00 C ATOM 1804 CE LYS A 126 1.373 -23.617 -7.987 1.00 0.00 C ATOM 1805 NZ LYS A 126 2.812 -23.294 -7.785 1.00 0.00 N ATOM 0 H LYS A 126 0.048 -20.759 -4.569 1.00 0.00 H new ATOM 0 HA LYS A 126 -0.622 -21.639 -7.265 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -1.125 -22.838 -4.511 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -1.496 -23.628 -6.031 1.00 0.00 H new ATOM 0 HG2 LYS A 126 1.316 -22.674 -5.631 1.00 0.00 H new ATOM 0 HG3 LYS A 126 0.792 -24.057 -4.691 1.00 0.00 H new ATOM 0 HD2 LYS A 126 1.460 -25.210 -6.550 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -0.160 -24.830 -7.099 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.257 -24.204 -8.898 1.00 0.00 H new ATOM 0 HE3 LYS A 126 0.810 -22.694 -8.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 3.007 -22.337 -8.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.038 -23.336 -6.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.398 -23.982 -8.299 1.00 0.00 H new ATOM 1819 N ASN A 127 -3.026 -21.157 -5.040 1.00 0.00 N ATOM 1820 CA ASN A 127 -4.422 -20.759 -4.894 1.00 0.00 C ATOM 1821 C ASN A 127 -4.661 -19.380 -5.501 1.00 0.00 C ATOM 1822 O ASN A 127 -4.078 -18.389 -5.062 1.00 0.00 O ATOM 1823 CB ASN A 127 -4.821 -20.755 -3.417 1.00 0.00 C ATOM 1824 CG ASN A 127 -4.286 -21.962 -2.670 1.00 0.00 C ATOM 1825 OD1 ASN A 127 -4.129 -23.040 -3.243 1.00 0.00 O ATOM 1826 ND2 ASN A 127 -4.005 -21.785 -1.385 1.00 0.00 N ATOM 0 H ASN A 127 -2.581 -21.461 -4.174 1.00 0.00 H new ATOM 0 HA ASN A 127 -5.038 -21.483 -5.428 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -4.449 -19.845 -2.946 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.908 -20.734 -3.337 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.643 -22.561 -0.831 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -4.151 -20.873 -0.952 1.00 0.00 H new ATOM 1833 N GLU A 128 -5.522 -19.326 -6.513 1.00 0.00 N ATOM 1834 CA GLU A 128 -5.837 -18.068 -7.180 1.00 0.00 C ATOM 1835 C GLU A 128 -7.006 -17.367 -6.494 1.00 0.00 C ATOM 1836 O GLU A 128 -7.159 -16.150 -6.596 1.00 0.00 O ATOM 1837 CB GLU A 128 -6.170 -18.315 -8.652 1.00 0.00 C ATOM 1838 CG GLU A 128 -6.601 -17.064 -9.398 1.00 0.00 C ATOM 1839 CD GLU A 128 -6.371 -17.166 -10.893 1.00 0.00 C ATOM 1840 OE1 GLU A 128 -5.209 -17.377 -11.301 1.00 0.00 O ATOM 1841 OE2 GLU A 128 -7.351 -17.036 -11.655 1.00 0.00 O ATOM 0 H GLU A 128 -6.013 -20.138 -6.888 1.00 0.00 H new ATOM 0 HA GLU A 128 -4.960 -17.423 -7.117 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -5.297 -18.740 -9.147 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.965 -19.058 -8.716 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -7.658 -16.879 -9.209 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.053 -16.206 -9.008 1.00 0.00 H new ATOM 1848 N GLU A 129 -7.828 -18.144 -5.796 1.00 0.00 N ATOM 1849 CA GLU A 129 -8.984 -17.598 -5.094 1.00 0.00 C ATOM 1850 C GLU A 129 -8.723 -17.523 -3.592 1.00 0.00 C ATOM 1851 O GLU A 129 -9.613 -17.785 -2.784 1.00 0.00 O ATOM 1852 CB GLU A 129 -10.224 -18.452 -5.366 1.00 0.00 C ATOM 1853 CG GLU A 129 -10.613 -18.511 -6.833 1.00 0.00 C ATOM 1854 CD GLU A 129 -11.533 -17.375 -7.238 1.00 0.00 C ATOM 1855 OE1 GLU A 129 -12.762 -17.516 -7.065 1.00 0.00 O ATOM 1856 OE2 GLU A 129 -11.024 -16.345 -7.728 1.00 0.00 O ATOM 0 H GLU A 129 -7.715 -19.153 -5.701 1.00 0.00 H new ATOM 0 HA GLU A 129 -9.159 -16.588 -5.465 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -10.043 -19.465 -5.006 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -11.061 -18.054 -4.793 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -9.712 -18.480 -7.446 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -11.105 -19.462 -7.037 1.00 0.00 H new ATOM 1863 N GLU A 130 -7.497 -17.163 -3.228 1.00 0.00 N ATOM 1864 CA GLU A 130 -7.119 -17.055 -1.824 1.00 0.00 C ATOM 1865 C GLU A 130 -7.245 -15.614 -1.336 1.00 0.00 C ATOM 1866 O GLU A 130 -7.703 -15.363 -0.220 1.00 0.00 O ATOM 1867 CB GLU A 130 -5.686 -17.550 -1.618 1.00 0.00 C ATOM 1868 CG GLU A 130 -5.162 -17.331 -0.209 1.00 0.00 C ATOM 1869 CD GLU A 130 -5.879 -18.184 0.819 1.00 0.00 C ATOM 1870 OE1 GLU A 130 -6.337 -19.289 0.460 1.00 0.00 O ATOM 1871 OE2 GLU A 130 -5.983 -17.746 1.984 1.00 0.00 O ATOM 0 H GLU A 130 -6.749 -16.941 -3.885 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.798 -17.679 -1.243 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -5.641 -18.614 -1.852 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -5.030 -17.041 -2.324 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -4.096 -17.556 -0.183 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.272 -16.280 0.056 1.00 0.00 H new ATOM 1878 N VAL A 131 -6.836 -14.672 -2.179 1.00 0.00 N ATOM 1879 CA VAL A 131 -6.904 -13.257 -1.835 1.00 0.00 C ATOM 1880 C VAL A 131 -6.441 -13.016 -0.402 1.00 0.00 C ATOM 1881 O VAL A 131 -7.092 -12.302 0.361 1.00 0.00 O ATOM 1882 CB VAL A 131 -8.333 -12.706 -2.000 1.00 0.00 C ATOM 1883 CG1 VAL A 131 -9.308 -13.482 -1.128 1.00 0.00 C ATOM 1884 CG2 VAL A 131 -8.374 -11.222 -1.670 1.00 0.00 C ATOM 0 H VAL A 131 -6.454 -14.863 -3.105 1.00 0.00 H new ATOM 0 HA VAL A 131 -6.239 -12.733 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.634 -12.831 -3.040 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -10.312 -13.079 -1.258 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.299 -14.533 -1.418 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.013 -13.391 -0.083 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.391 -10.850 -1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.053 -11.069 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.707 -10.681 -2.342 1.00 0.00 H new ATOM 1894 N LEU A 132 -5.312 -13.617 -0.043 1.00 0.00 N ATOM 1895 CA LEU A 132 -4.760 -13.469 1.300 1.00 0.00 C ATOM 1896 C LEU A 132 -4.995 -12.058 1.832 1.00 0.00 C ATOM 1897 O LEU A 132 -5.296 -11.870 3.010 1.00 0.00 O ATOM 1898 CB LEU A 132 -3.263 -13.782 1.294 1.00 0.00 C ATOM 1899 CG LEU A 132 -2.885 -15.248 1.082 1.00 0.00 C ATOM 1900 CD1 LEU A 132 -1.381 -15.391 0.903 1.00 0.00 C ATOM 1901 CD2 LEU A 132 -3.367 -16.098 2.249 1.00 0.00 C ATOM 0 H LEU A 132 -4.761 -14.211 -0.662 1.00 0.00 H new ATOM 0 HA LEU A 132 -5.269 -14.174 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -2.791 -13.189 0.510 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -2.839 -13.452 2.242 1.00 0.00 H new ATOM 0 HG LEU A 132 -3.374 -15.601 0.174 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -1.131 -16.441 0.753 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -1.061 -14.815 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.872 -15.020 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -3.089 -17.138 2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -2.907 -15.744 3.171 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.451 -16.021 2.332 1.00 0.00 H new ATOM 1913 N VAL A 133 -4.856 -11.070 0.954 1.00 0.00 N ATOM 1914 CA VAL A 133 -5.056 -9.676 1.334 1.00 0.00 C ATOM 1915 C VAL A 133 -5.642 -8.870 0.181 1.00 0.00 C ATOM 1916 O VAL A 133 -5.131 -8.909 -0.938 1.00 0.00 O ATOM 1917 CB VAL A 133 -3.736 -9.023 1.785 1.00 0.00 C ATOM 1918 CG1 VAL A 133 -3.943 -7.543 2.069 1.00 0.00 C ATOM 1919 CG2 VAL A 133 -3.178 -9.736 3.007 1.00 0.00 C ATOM 0 H VAL A 133 -4.606 -11.209 -0.025 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.758 -9.673 2.168 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.010 -9.116 0.977 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -3.000 -7.098 2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.293 -7.045 1.165 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.684 -7.424 2.859 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.245 -9.261 3.311 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.898 -9.677 3.823 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -2.990 -10.782 2.764 1.00 0.00 H new ATOM 1929 N GLU A 134 -6.716 -8.140 0.461 1.00 0.00 N ATOM 1930 CA GLU A 134 -7.372 -7.325 -0.554 1.00 0.00 C ATOM 1931 C GLU A 134 -7.243 -5.840 -0.226 1.00 0.00 C ATOM 1932 O GLU A 134 -7.929 -5.327 0.659 1.00 0.00 O ATOM 1933 CB GLU A 134 -8.849 -7.706 -0.671 1.00 0.00 C ATOM 1934 CG GLU A 134 -9.442 -7.431 -2.043 1.00 0.00 C ATOM 1935 CD GLU A 134 -10.720 -8.208 -2.293 1.00 0.00 C ATOM 1936 OE1 GLU A 134 -11.539 -8.320 -1.356 1.00 0.00 O ATOM 1937 OE2 GLU A 134 -10.902 -8.705 -3.424 1.00 0.00 O ATOM 0 H GLU A 134 -7.151 -8.096 1.383 1.00 0.00 H new ATOM 0 HA GLU A 134 -6.880 -7.513 -1.508 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -8.961 -8.766 -0.442 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.418 -7.156 0.078 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -9.645 -6.364 -2.140 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.710 -7.687 -2.809 1.00 0.00 H new ATOM 1944 N CYS A 135 -6.360 -5.156 -0.945 1.00 0.00 N ATOM 1945 CA CYS A 135 -6.140 -3.730 -0.731 1.00 0.00 C ATOM 1946 C CYS A 135 -6.471 -2.934 -1.988 1.00 0.00 C ATOM 1947 O CYS A 135 -6.275 -3.410 -3.107 1.00 0.00 O ATOM 1948 CB CYS A 135 -4.690 -3.474 -0.317 1.00 0.00 C ATOM 1949 SG CYS A 135 -4.300 -1.731 -0.037 1.00 0.00 S ATOM 0 H CYS A 135 -5.785 -5.566 -1.681 1.00 0.00 H new ATOM 0 HA CYS A 135 -6.803 -3.401 0.069 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -4.479 -4.033 0.594 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -4.028 -3.864 -1.090 1.00 0.00 H new ATOM 0 HG CYS A 135 -3.146 -1.634 0.554 1.00 0.00 H new ATOM 1955 N ARG A 136 -6.977 -1.719 -1.797 1.00 0.00 N ATOM 1956 CA ARG A 136 -7.338 -0.857 -2.916 1.00 0.00 C ATOM 1957 C ARG A 136 -6.536 0.440 -2.884 1.00 0.00 C ATOM 1958 O ARG A 136 -6.576 1.183 -1.903 1.00 0.00 O ATOM 1959 CB ARG A 136 -8.836 -0.545 -2.884 1.00 0.00 C ATOM 1960 CG ARG A 136 -9.717 -1.782 -2.935 1.00 0.00 C ATOM 1961 CD ARG A 136 -11.182 -1.416 -3.117 1.00 0.00 C ATOM 1962 NE ARG A 136 -12.009 -2.588 -3.390 1.00 0.00 N ATOM 1963 CZ ARG A 136 -13.322 -2.531 -3.584 1.00 0.00 C ATOM 1964 NH1 ARG A 136 -13.953 -1.366 -3.535 1.00 0.00 N ATOM 1965 NH2 ARG A 136 -14.007 -3.641 -3.827 1.00 0.00 N ATOM 0 H ARG A 136 -7.146 -1.310 -0.878 1.00 0.00 H new ATOM 0 HA ARG A 136 -7.104 -1.385 -3.840 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -9.063 0.015 -1.977 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -9.082 0.101 -3.727 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.397 -2.424 -3.755 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.595 -2.355 -2.016 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.545 -0.917 -2.218 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -11.279 -0.705 -3.937 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.554 -3.500 -3.434 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -13.430 -0.510 -3.348 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -14.961 -1.325 -3.684 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -13.526 -4.539 -3.865 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -15.015 -3.596 -3.976 1.00 0.00 H new ATOM 1979 N VAL A 137 -5.808 0.707 -3.964 1.00 0.00 N ATOM 1980 CA VAL A 137 -4.997 1.914 -4.060 1.00 0.00 C ATOM 1981 C VAL A 137 -5.728 3.115 -3.470 1.00 0.00 C ATOM 1982 O VAL A 137 -5.173 3.854 -2.656 1.00 0.00 O ATOM 1983 CB VAL A 137 -4.622 2.223 -5.522 1.00 0.00 C ATOM 1984 CG1 VAL A 137 -3.890 3.553 -5.616 1.00 0.00 C ATOM 1985 CG2 VAL A 137 -3.778 1.099 -6.104 1.00 0.00 C ATOM 0 H VAL A 137 -5.764 0.103 -4.785 1.00 0.00 H new ATOM 0 HA VAL A 137 -4.086 1.730 -3.490 1.00 0.00 H new ATOM 0 HB VAL A 137 -5.539 2.298 -6.106 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.633 3.754 -6.656 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -4.533 4.349 -5.240 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -2.979 3.510 -5.019 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -3.522 1.334 -7.137 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -2.864 0.990 -5.520 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -4.342 0.167 -6.073 1.00 0.00 H new ATOM 1995 N ARG A 138 -6.976 3.304 -3.885 1.00 0.00 N ATOM 1996 CA ARG A 138 -7.783 4.416 -3.398 1.00 0.00 C ATOM 1997 C ARG A 138 -7.761 4.478 -1.874 1.00 0.00 C ATOM 1998 O ARG A 138 -7.672 5.556 -1.286 1.00 0.00 O ATOM 1999 CB ARG A 138 -9.224 4.283 -3.893 1.00 0.00 C ATOM 2000 CG ARG A 138 -9.377 4.502 -5.389 1.00 0.00 C ATOM 2001 CD ARG A 138 -10.777 4.980 -5.742 1.00 0.00 C ATOM 2002 NE ARG A 138 -11.025 4.933 -7.180 1.00 0.00 N ATOM 2003 CZ ARG A 138 -12.081 5.490 -7.763 1.00 0.00 C ATOM 2004 NH1 ARG A 138 -12.982 6.134 -7.033 1.00 0.00 N ATOM 2005 NH2 ARG A 138 -12.237 5.405 -9.077 1.00 0.00 N ATOM 0 H ARG A 138 -7.450 2.701 -4.557 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.356 5.340 -3.788 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -9.596 3.290 -3.640 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.849 5.002 -3.363 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.645 5.235 -5.727 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -9.165 3.573 -5.917 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -11.512 4.361 -5.227 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -10.913 6.001 -5.384 1.00 0.00 H new ATOM 0 HE ARG A 138 -10.350 4.446 -7.770 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -12.865 6.202 -6.022 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -13.792 6.561 -7.483 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -11.546 4.911 -9.642 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -13.048 5.833 -9.523 1.00 0.00 H new ATOM 2019 N PHE A 139 -7.842 3.313 -1.239 1.00 0.00 N ATOM 2020 CA PHE A 139 -7.833 3.234 0.218 1.00 0.00 C ATOM 2021 C PHE A 139 -6.436 3.504 0.768 1.00 0.00 C ATOM 2022 O PHE A 139 -6.282 4.036 1.868 1.00 0.00 O ATOM 2023 CB PHE A 139 -8.317 1.857 0.678 1.00 0.00 C ATOM 2024 CG PHE A 139 -9.813 1.742 0.753 1.00 0.00 C ATOM 2025 CD1 PHE A 139 -10.582 1.770 -0.399 1.00 0.00 C ATOM 2026 CD2 PHE A 139 -10.450 1.607 1.976 1.00 0.00 C ATOM 2027 CE1 PHE A 139 -11.959 1.664 -0.333 1.00 0.00 C ATOM 2028 CE2 PHE A 139 -11.826 1.501 2.048 1.00 0.00 C ATOM 2029 CZ PHE A 139 -12.581 1.530 0.892 1.00 0.00 C ATOM 0 H PHE A 139 -7.915 2.411 -1.710 1.00 0.00 H new ATOM 0 HA PHE A 139 -8.510 3.997 0.603 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -7.936 1.099 -0.007 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -7.894 1.641 1.659 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.100 1.876 -1.360 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -9.865 1.584 2.883 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.547 1.686 -1.239 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -12.310 1.396 3.007 1.00 0.00 H new ATOM 0 HZ PHE A 139 -13.657 1.448 0.946 1.00 0.00 H new ATOM 2039 N LEU A 140 -5.420 3.134 -0.005 1.00 0.00 N ATOM 2040 CA LEU A 140 -4.035 3.336 0.405 1.00 0.00 C ATOM 2041 C LEU A 140 -3.798 4.780 0.833 1.00 0.00 C ATOM 2042 O LEU A 140 -4.036 5.713 0.066 1.00 0.00 O ATOM 2043 CB LEU A 140 -3.086 2.969 -0.738 1.00 0.00 C ATOM 2044 CG LEU A 140 -1.616 2.792 -0.359 1.00 0.00 C ATOM 2045 CD1 LEU A 140 -0.941 1.796 -1.289 1.00 0.00 C ATOM 2046 CD2 LEU A 140 -0.892 4.130 -0.393 1.00 0.00 C ATOM 0 H LEU A 140 -5.530 2.693 -0.918 1.00 0.00 H new ATOM 0 HA LEU A 140 -3.836 2.687 1.258 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.437 2.042 -1.192 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -3.153 3.744 -1.502 1.00 0.00 H new ATOM 0 HG LEU A 140 -1.567 2.400 0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 140 0.105 1.683 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.443 0.831 -1.216 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.000 2.159 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.153 3.985 -0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.950 4.550 -1.397 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.360 4.815 0.314 1.00 0.00 H new ATOM 2058 N SER A 141 -3.326 4.958 2.063 1.00 0.00 N ATOM 2059 CA SER A 141 -3.058 6.289 2.594 1.00 0.00 C ATOM 2060 C SER A 141 -1.604 6.687 2.355 1.00 0.00 C ATOM 2061 O SER A 141 -1.323 7.748 1.796 1.00 0.00 O ATOM 2062 CB SER A 141 -3.371 6.336 4.091 1.00 0.00 C ATOM 2063 OG SER A 141 -2.398 5.628 4.838 1.00 0.00 O ATOM 0 H SER A 141 -3.121 4.197 2.710 1.00 0.00 H new ATOM 0 HA SER A 141 -3.701 6.998 2.072 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.407 7.373 4.426 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.357 5.907 4.273 1.00 0.00 H new ATOM 0 HG SER A 141 -2.047 6.205 5.548 1.00 0.00 H new ATOM 2069 N PHE A 142 -0.684 5.828 2.781 1.00 0.00 N ATOM 2070 CA PHE A 142 0.741 6.090 2.615 1.00 0.00 C ATOM 2071 C PHE A 142 1.521 4.785 2.481 1.00 0.00 C ATOM 2072 O PHE A 142 1.118 3.751 3.013 1.00 0.00 O ATOM 2073 CB PHE A 142 1.275 6.897 3.800 1.00 0.00 C ATOM 2074 CG PHE A 142 2.765 6.807 3.964 1.00 0.00 C ATOM 2075 CD1 PHE A 142 3.609 7.577 3.179 1.00 0.00 C ATOM 2076 CD2 PHE A 142 3.322 5.953 4.902 1.00 0.00 C ATOM 2077 CE1 PHE A 142 4.981 7.495 3.327 1.00 0.00 C ATOM 2078 CE2 PHE A 142 4.693 5.868 5.055 1.00 0.00 C ATOM 2079 CZ PHE A 142 5.523 6.641 4.267 1.00 0.00 C ATOM 0 H PHE A 142 -0.900 4.945 3.244 1.00 0.00 H new ATOM 0 HA PHE A 142 0.875 6.669 1.701 1.00 0.00 H new ATOM 0 HB2 PHE A 142 0.994 7.943 3.673 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.795 6.546 4.714 1.00 0.00 H new ATOM 0 HD1 PHE A 142 3.190 8.248 2.444 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.677 5.347 5.521 1.00 0.00 H new ATOM 0 HE1 PHE A 142 5.628 8.098 2.708 1.00 0.00 H new ATOM 0 HE2 PHE A 142 5.115 5.198 5.790 1.00 0.00 H new ATOM 0 HZ PHE A 142 6.595 6.578 4.386 1.00 0.00 H new ATOM 2089 N MET A 143 2.639 4.842 1.765 1.00 0.00 N ATOM 2090 CA MET A 143 3.476 3.666 1.561 1.00 0.00 C ATOM 2091 C MET A 143 4.949 4.054 1.481 1.00 0.00 C ATOM 2092 O MET A 143 5.284 5.209 1.221 1.00 0.00 O ATOM 2093 CB MET A 143 3.060 2.933 0.284 1.00 0.00 C ATOM 2094 CG MET A 143 3.227 3.766 -0.977 1.00 0.00 C ATOM 2095 SD MET A 143 3.557 2.759 -2.436 1.00 0.00 S ATOM 2096 CE MET A 143 2.499 3.555 -3.642 1.00 0.00 C ATOM 0 H MET A 143 2.986 5.690 1.317 1.00 0.00 H new ATOM 0 HA MET A 143 3.339 3.001 2.414 1.00 0.00 H new ATOM 0 HB2 MET A 143 3.651 2.022 0.189 1.00 0.00 H new ATOM 0 HB3 MET A 143 2.017 2.628 0.373 1.00 0.00 H new ATOM 0 HG2 MET A 143 2.324 4.353 -1.142 1.00 0.00 H new ATOM 0 HG3 MET A 143 4.045 4.473 -0.835 1.00 0.00 H new ATOM 0 HE1 MET A 143 1.818 2.820 -4.070 1.00 0.00 H new ATOM 0 HE2 MET A 143 1.923 4.343 -3.157 1.00 0.00 H new ATOM 0 HE3 MET A 143 3.111 3.987 -4.434 1.00 0.00 H new ATOM 2106 N GLY A 144 5.827 3.081 1.708 1.00 0.00 N ATOM 2107 CA GLY A 144 7.253 3.342 1.658 1.00 0.00 C ATOM 2108 C GLY A 144 8.079 2.078 1.799 1.00 0.00 C ATOM 2109 O GLY A 144 7.549 0.970 1.720 1.00 0.00 O ATOM 0 H GLY A 144 5.575 2.117 1.926 1.00 0.00 H new ATOM 0 HA2 GLY A 144 7.497 3.829 0.714 1.00 0.00 H new ATOM 0 HA3 GLY A 144 7.520 4.038 2.454 1.00 0.00 H new ATOM 2113 N VAL A 145 9.381 2.244 2.006 1.00 0.00 N ATOM 2114 CA VAL A 145 10.282 1.108 2.157 1.00 0.00 C ATOM 2115 C VAL A 145 11.008 1.156 3.497 1.00 0.00 C ATOM 2116 O VAL A 145 11.249 2.230 4.046 1.00 0.00 O ATOM 2117 CB VAL A 145 11.324 1.063 1.023 1.00 0.00 C ATOM 2118 CG1 VAL A 145 10.636 1.016 -0.333 1.00 0.00 C ATOM 2119 CG2 VAL A 145 12.262 2.257 1.114 1.00 0.00 C ATOM 0 H VAL A 145 9.836 3.155 2.073 1.00 0.00 H new ATOM 0 HA VAL A 145 9.667 0.209 2.112 1.00 0.00 H new ATOM 0 HB VAL A 145 11.917 0.155 1.134 1.00 0.00 H new ATOM 0 HG11 VAL A 145 11.388 0.985 -1.122 1.00 0.00 H new ATOM 0 HG12 VAL A 145 10.010 0.126 -0.393 1.00 0.00 H new ATOM 0 HG13 VAL A 145 10.016 1.904 -0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 145 12.991 2.209 0.305 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.687 3.179 1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 145 12.781 2.240 2.072 1.00 0.00 H new ATOM 2129 N GLY A 146 11.354 -0.017 4.019 1.00 0.00 N ATOM 2130 CA GLY A 146 12.049 -0.086 5.291 1.00 0.00 C ATOM 2131 C GLY A 146 13.532 0.198 5.158 1.00 0.00 C ATOM 2132 O GLY A 146 13.990 0.672 4.118 1.00 0.00 O ATOM 0 H GLY A 146 11.165 -0.920 3.584 1.00 0.00 H new ATOM 0 HA2 GLY A 146 11.606 0.630 5.983 1.00 0.00 H new ATOM 0 HA3 GLY A 146 11.909 -1.076 5.724 1.00 0.00 H new ATOM 2136 N LYS A 147 14.286 -0.090 6.213 1.00 0.00 N ATOM 2137 CA LYS A 147 15.726 0.138 6.211 1.00 0.00 C ATOM 2138 C LYS A 147 16.365 -0.431 4.948 1.00 0.00 C ATOM 2139 O LYS A 147 17.339 0.117 4.433 1.00 0.00 O ATOM 2140 CB LYS A 147 16.365 -0.496 7.449 1.00 0.00 C ATOM 2141 CG LYS A 147 15.973 0.181 8.751 1.00 0.00 C ATOM 2142 CD LYS A 147 16.611 -0.501 9.949 1.00 0.00 C ATOM 2143 CE LYS A 147 17.980 0.083 10.259 1.00 0.00 C ATOM 2144 NZ LYS A 147 18.799 -0.836 11.097 1.00 0.00 N ATOM 0 H LYS A 147 13.923 -0.482 7.082 1.00 0.00 H new ATOM 0 HA LYS A 147 15.899 1.214 6.231 1.00 0.00 H new ATOM 0 HB2 LYS A 147 16.081 -1.547 7.496 1.00 0.00 H new ATOM 0 HB3 LYS A 147 17.450 -0.463 7.345 1.00 0.00 H new ATOM 0 HG2 LYS A 147 16.276 1.228 8.723 1.00 0.00 H new ATOM 0 HG3 LYS A 147 14.888 0.166 8.858 1.00 0.00 H new ATOM 0 HD2 LYS A 147 15.963 -0.393 10.819 1.00 0.00 H new ATOM 0 HD3 LYS A 147 16.706 -1.569 9.753 1.00 0.00 H new ATOM 0 HE2 LYS A 147 18.506 0.290 9.327 1.00 0.00 H new ATOM 0 HE3 LYS A 147 17.860 1.035 10.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 19.725 -0.401 11.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 18.310 -1.014 11.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 18.936 -1.736 10.594 1.00 0.00 H new ATOM 2158 N ASP A 148 15.809 -1.532 4.454 1.00 0.00 N ATOM 2159 CA ASP A 148 16.323 -2.174 3.250 1.00 0.00 C ATOM 2160 C ASP A 148 15.285 -2.145 2.133 1.00 0.00 C ATOM 2161 O ASP A 148 14.240 -2.790 2.226 1.00 0.00 O ATOM 2162 CB ASP A 148 16.729 -3.618 3.549 1.00 0.00 C ATOM 2163 CG ASP A 148 18.138 -3.721 4.101 1.00 0.00 C ATOM 2164 OD1 ASP A 148 18.578 -2.773 4.785 1.00 0.00 O ATOM 2165 OD2 ASP A 148 18.799 -4.749 3.849 1.00 0.00 O ATOM 0 H ASP A 148 15.002 -1.998 4.869 1.00 0.00 H new ATOM 0 HA ASP A 148 17.201 -1.619 2.920 1.00 0.00 H new ATOM 0 HB2 ASP A 148 16.029 -4.048 4.265 1.00 0.00 H new ATOM 0 HB3 ASP A 148 16.655 -4.209 2.636 1.00 0.00 H new ATOM 2170 N VAL A 149 15.578 -1.391 1.078 1.00 0.00 N ATOM 2171 CA VAL A 149 14.670 -1.278 -0.057 1.00 0.00 C ATOM 2172 C VAL A 149 13.961 -2.601 -0.327 1.00 0.00 C ATOM 2173 O VAL A 149 12.766 -2.627 -0.625 1.00 0.00 O ATOM 2174 CB VAL A 149 15.415 -0.838 -1.331 1.00 0.00 C ATOM 2175 CG1 VAL A 149 16.024 0.543 -1.143 1.00 0.00 C ATOM 2176 CG2 VAL A 149 16.484 -1.855 -1.700 1.00 0.00 C ATOM 0 H VAL A 149 16.437 -0.849 0.986 1.00 0.00 H new ATOM 0 HA VAL A 149 13.932 -0.519 0.203 1.00 0.00 H new ATOM 0 HB VAL A 149 14.698 -0.784 -2.150 1.00 0.00 H new ATOM 0 HG11 VAL A 149 16.546 0.837 -2.053 1.00 0.00 H new ATOM 0 HG12 VAL A 149 15.234 1.263 -0.929 1.00 0.00 H new ATOM 0 HG13 VAL A 149 16.729 0.520 -0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 149 17.001 -1.529 -2.603 1.00 0.00 H new ATOM 0 HG22 VAL A 149 17.200 -1.942 -0.883 1.00 0.00 H new ATOM 0 HG23 VAL A 149 16.018 -2.824 -1.879 1.00 0.00 H new ATOM 2186 N HIS A 150 14.705 -3.697 -0.221 1.00 0.00 N ATOM 2187 CA HIS A 150 14.147 -5.025 -0.453 1.00 0.00 C ATOM 2188 C HIS A 150 12.754 -5.143 0.157 1.00 0.00 C ATOM 2189 O HIS A 150 11.817 -5.612 -0.492 1.00 0.00 O ATOM 2190 CB HIS A 150 15.066 -6.097 0.133 1.00 0.00 C ATOM 2191 CG HIS A 150 16.423 -6.133 -0.499 1.00 0.00 C ATOM 2192 ND1 HIS A 150 17.406 -5.206 -0.224 1.00 0.00 N ATOM 2193 CD2 HIS A 150 16.959 -6.993 -1.396 1.00 0.00 C ATOM 2194 CE1 HIS A 150 18.488 -5.493 -0.926 1.00 0.00 C ATOM 2195 NE2 HIS A 150 18.243 -6.574 -1.645 1.00 0.00 N ATOM 0 H HIS A 150 15.695 -3.692 0.024 1.00 0.00 H new ATOM 0 HA HIS A 150 14.067 -5.175 -1.530 1.00 0.00 H new ATOM 0 HB2 HIS A 150 15.177 -5.923 1.203 1.00 0.00 H new ATOM 0 HB3 HIS A 150 14.594 -7.072 0.016 1.00 0.00 H new ATOM 0 HD2 HIS A 150 16.468 -7.849 -1.834 1.00 0.00 H new ATOM 0 HE1 HIS A 150 19.415 -4.938 -0.914 1.00 0.00 H new ATOM 0 HE2 HIS A 150 18.901 -7.024 -2.282 1.00 0.00 H new ATOM 2204 N THR A 151 12.623 -4.716 1.409 1.00 0.00 N ATOM 2205 CA THR A 151 11.345 -4.775 2.108 1.00 0.00 C ATOM 2206 C THR A 151 10.405 -3.676 1.628 1.00 0.00 C ATOM 2207 O THR A 151 10.762 -2.497 1.625 1.00 0.00 O ATOM 2208 CB THR A 151 11.531 -4.648 3.631 1.00 0.00 C ATOM 2209 OG1 THR A 151 12.204 -3.423 3.942 1.00 0.00 O ATOM 2210 CG2 THR A 151 12.327 -5.823 4.179 1.00 0.00 C ATOM 0 H THR A 151 13.387 -4.325 1.960 1.00 0.00 H new ATOM 0 HA THR A 151 10.907 -5.747 1.884 1.00 0.00 H new ATOM 0 HB THR A 151 10.545 -4.649 4.096 1.00 0.00 H new ATOM 0 HG1 THR A 151 12.840 -3.209 3.228 1.00 0.00 H new ATOM 0 HG21 THR A 151 12.446 -5.711 5.257 1.00 0.00 H new ATOM 0 HG22 THR A 151 11.798 -6.752 3.967 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.309 -5.849 3.707 1.00 0.00 H new ATOM 2218 N PHE A 152 9.201 -4.068 1.225 1.00 0.00 N ATOM 2219 CA PHE A 152 8.208 -3.114 0.743 1.00 0.00 C ATOM 2220 C PHE A 152 6.900 -3.254 1.515 1.00 0.00 C ATOM 2221 O PHE A 152 6.275 -4.314 1.512 1.00 0.00 O ATOM 2222 CB PHE A 152 7.955 -3.321 -0.752 1.00 0.00 C ATOM 2223 CG PHE A 152 6.668 -2.713 -1.232 1.00 0.00 C ATOM 2224 CD1 PHE A 152 6.413 -1.363 -1.049 1.00 0.00 C ATOM 2225 CD2 PHE A 152 5.713 -3.491 -1.867 1.00 0.00 C ATOM 2226 CE1 PHE A 152 5.229 -0.802 -1.489 1.00 0.00 C ATOM 2227 CE2 PHE A 152 4.528 -2.935 -2.309 1.00 0.00 C ATOM 2228 CZ PHE A 152 4.286 -1.589 -2.121 1.00 0.00 C ATOM 0 H PHE A 152 8.889 -5.039 1.222 1.00 0.00 H new ATOM 0 HA PHE A 152 8.598 -2.109 0.903 1.00 0.00 H new ATOM 0 HB2 PHE A 152 8.783 -2.891 -1.315 1.00 0.00 H new ATOM 0 HB3 PHE A 152 7.945 -4.390 -0.966 1.00 0.00 H new ATOM 0 HD1 PHE A 152 7.148 -0.743 -0.557 1.00 0.00 H new ATOM 0 HD2 PHE A 152 5.897 -4.544 -2.018 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.041 0.251 -1.339 1.00 0.00 H new ATOM 0 HE2 PHE A 152 3.792 -3.553 -2.801 1.00 0.00 H new ATOM 0 HZ PHE A 152 3.361 -1.152 -2.467 1.00 0.00 H new ATOM 2238 N ALA A 153 6.492 -2.176 2.177 1.00 0.00 N ATOM 2239 CA ALA A 153 5.258 -2.177 2.953 1.00 0.00 C ATOM 2240 C ALA A 153 4.383 -0.980 2.594 1.00 0.00 C ATOM 2241 O ALA A 153 4.856 -0.007 2.007 1.00 0.00 O ATOM 2242 CB ALA A 153 5.571 -2.177 4.442 1.00 0.00 C ATOM 0 H ALA A 153 6.998 -1.291 2.191 1.00 0.00 H new ATOM 0 HA ALA A 153 4.705 -3.084 2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 153 4.640 -2.178 5.009 1.00 0.00 H new ATOM 0 HB2 ALA A 153 6.149 -3.066 4.692 1.00 0.00 H new ATOM 0 HB3 ALA A 153 6.148 -1.287 4.693 1.00 0.00 H new ATOM 2248 N PHE A 154 3.105 -1.060 2.950 1.00 0.00 N ATOM 2249 CA PHE A 154 2.164 0.016 2.664 1.00 0.00 C ATOM 2250 C PHE A 154 1.040 0.044 3.696 1.00 0.00 C ATOM 2251 O PHE A 154 0.579 -1.001 4.155 1.00 0.00 O ATOM 2252 CB PHE A 154 1.578 -0.150 1.260 1.00 0.00 C ATOM 2253 CG PHE A 154 0.777 -1.408 1.090 1.00 0.00 C ATOM 2254 CD1 PHE A 154 -0.453 -1.552 1.713 1.00 0.00 C ATOM 2255 CD2 PHE A 154 1.253 -2.448 0.307 1.00 0.00 C ATOM 2256 CE1 PHE A 154 -1.193 -2.709 1.558 1.00 0.00 C ATOM 2257 CE2 PHE A 154 0.517 -3.607 0.148 1.00 0.00 C ATOM 2258 CZ PHE A 154 -0.707 -3.738 0.775 1.00 0.00 C ATOM 0 H PHE A 154 2.698 -1.858 3.437 1.00 0.00 H new ATOM 0 HA PHE A 154 2.705 0.961 2.715 1.00 0.00 H new ATOM 0 HB2 PHE A 154 0.944 0.708 1.036 1.00 0.00 H new ATOM 0 HB3 PHE A 154 2.390 -0.145 0.533 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.837 -0.751 2.327 1.00 0.00 H new ATOM 0 HD2 PHE A 154 2.210 -2.352 -0.184 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.150 -2.808 2.048 1.00 0.00 H new ATOM 0 HE2 PHE A 154 0.898 -4.410 -0.466 1.00 0.00 H new ATOM 0 HZ PHE A 154 -1.283 -4.643 0.653 1.00 0.00 H new ATOM 2268 N ILE A 155 0.605 1.247 4.056 1.00 0.00 N ATOM 2269 CA ILE A 155 -0.464 1.412 5.033 1.00 0.00 C ATOM 2270 C ILE A 155 -1.809 1.625 4.345 1.00 0.00 C ATOM 2271 O ILE A 155 -1.926 2.438 3.429 1.00 0.00 O ATOM 2272 CB ILE A 155 -0.188 2.598 5.975 1.00 0.00 C ATOM 2273 CG1 ILE A 155 1.116 2.375 6.743 1.00 0.00 C ATOM 2274 CG2 ILE A 155 -1.350 2.791 6.938 1.00 0.00 C ATOM 2275 CD1 ILE A 155 1.466 3.508 7.682 1.00 0.00 C ATOM 0 H ILE A 155 0.977 2.122 3.686 1.00 0.00 H new ATOM 0 HA ILE A 155 -0.500 0.494 5.620 1.00 0.00 H new ATOM 0 HB ILE A 155 -0.084 3.502 5.376 1.00 0.00 H new ATOM 0 HG12 ILE A 155 1.037 1.451 7.315 1.00 0.00 H new ATOM 0 HG13 ILE A 155 1.929 2.240 6.030 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.140 3.633 7.597 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -2.261 2.990 6.374 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -1.483 1.888 7.534 1.00 0.00 H new ATOM 0 HD11 ILE A 155 2.402 3.281 8.193 1.00 0.00 H new ATOM 0 HD12 ILE A 155 1.577 4.431 7.113 1.00 0.00 H new ATOM 0 HD13 ILE A 155 0.671 3.629 8.418 1.00 0.00 H new ATOM 2287 N MET A 156 -2.820 0.890 4.795 1.00 0.00 N ATOM 2288 CA MET A 156 -4.158 1.001 4.225 1.00 0.00 C ATOM 2289 C MET A 156 -5.214 1.062 5.324 1.00 0.00 C ATOM 2290 O MET A 156 -4.918 0.829 6.496 1.00 0.00 O ATOM 2291 CB MET A 156 -4.439 -0.181 3.296 1.00 0.00 C ATOM 2292 CG MET A 156 -4.400 -1.528 3.998 1.00 0.00 C ATOM 2293 SD MET A 156 -5.984 -1.975 4.735 1.00 0.00 S ATOM 2294 CE MET A 156 -6.617 -3.117 3.509 1.00 0.00 C ATOM 0 H MET A 156 -2.739 0.211 5.552 1.00 0.00 H new ATOM 0 HA MET A 156 -4.205 1.925 3.649 1.00 0.00 H new ATOM 0 HB2 MET A 156 -5.419 -0.048 2.838 1.00 0.00 H new ATOM 0 HB3 MET A 156 -3.707 -0.180 2.489 1.00 0.00 H new ATOM 0 HG2 MET A 156 -4.106 -2.297 3.284 1.00 0.00 H new ATOM 0 HG3 MET A 156 -3.636 -1.506 4.775 1.00 0.00 H new ATOM 0 HE1 MET A 156 -7.699 -3.011 3.437 1.00 0.00 H new ATOM 0 HE2 MET A 156 -6.166 -2.898 2.541 1.00 0.00 H new ATOM 0 HE3 MET A 156 -6.371 -4.138 3.802 1.00 0.00 H new ATOM 2304 N ASP A 157 -6.446 1.376 4.938 1.00 0.00 N ATOM 2305 CA ASP A 157 -7.546 1.466 5.891 1.00 0.00 C ATOM 2306 C ASP A 157 -8.568 0.360 5.648 1.00 0.00 C ATOM 2307 O ASP A 157 -8.975 0.114 4.512 1.00 0.00 O ATOM 2308 CB ASP A 157 -8.223 2.834 5.792 1.00 0.00 C ATOM 2309 CG ASP A 157 -9.501 2.907 6.604 1.00 0.00 C ATOM 2310 OD1 ASP A 157 -10.407 2.082 6.360 1.00 0.00 O ATOM 2311 OD2 ASP A 157 -9.597 3.789 7.483 1.00 0.00 O ATOM 0 H ASP A 157 -6.708 1.572 3.972 1.00 0.00 H new ATOM 0 HA ASP A 157 -7.137 1.343 6.894 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -7.532 3.604 6.137 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -8.447 3.051 4.747 1.00 0.00 H new ATOM 2316 N THR A 158 -8.979 -0.306 6.723 1.00 0.00 N ATOM 2317 CA THR A 158 -9.951 -1.387 6.626 1.00 0.00 C ATOM 2318 C THR A 158 -11.287 -0.982 7.238 1.00 0.00 C ATOM 2319 O THR A 158 -12.244 -1.755 7.231 1.00 0.00 O ATOM 2320 CB THR A 158 -9.444 -2.662 7.327 1.00 0.00 C ATOM 2321 OG1 THR A 158 -9.117 -2.375 8.691 1.00 0.00 O ATOM 2322 CG2 THR A 158 -8.222 -3.222 6.614 1.00 0.00 C ATOM 0 H THR A 158 -8.653 -0.115 7.671 1.00 0.00 H new ATOM 0 HA THR A 158 -10.089 -1.594 5.565 1.00 0.00 H new ATOM 0 HB THR A 158 -10.238 -3.408 7.294 1.00 0.00 H new ATOM 0 HG1 THR A 158 -8.143 -2.380 8.802 1.00 0.00 H new ATOM 0 HG21 THR A 158 -7.882 -4.122 7.127 1.00 0.00 H new ATOM 0 HG22 THR A 158 -8.482 -3.468 5.584 1.00 0.00 H new ATOM 0 HG23 THR A 158 -7.425 -2.478 6.619 1.00 0.00 H new ATOM 2368 N ARG A 162 -9.266 2.387 11.233 1.00 0.00 N ATOM 2369 CA ARG A 162 -8.143 1.486 11.465 1.00 0.00 C ATOM 2370 C ARG A 162 -7.163 1.528 10.296 1.00 0.00 C ATOM 2371 O ARG A 162 -7.561 1.696 9.143 1.00 0.00 O ATOM 2372 CB ARG A 162 -8.645 0.055 11.673 1.00 0.00 C ATOM 2373 CG ARG A 162 -9.236 -0.188 13.051 1.00 0.00 C ATOM 2374 CD ARG A 162 -9.054 -1.633 13.488 1.00 0.00 C ATOM 2375 NE ARG A 162 -10.058 -2.514 12.899 1.00 0.00 N ATOM 2376 CZ ARG A 162 -10.329 -3.731 13.358 1.00 0.00 C ATOM 2377 NH1 ARG A 162 -9.673 -4.209 14.406 1.00 0.00 N ATOM 2378 NH2 ARG A 162 -11.257 -4.473 12.767 1.00 0.00 N ATOM 0 HA ARG A 162 -7.623 1.816 12.365 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -9.399 -0.170 10.919 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -7.819 -0.638 11.514 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -8.760 0.475 13.774 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -10.297 0.060 13.042 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -8.059 -1.975 13.203 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -9.112 -1.693 14.575 1.00 0.00 H new ATOM 0 HE ARG A 162 -10.580 -2.177 12.090 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -8.958 -3.642 14.862 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -9.883 -5.144 14.756 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -11.763 -4.109 11.960 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -11.464 -5.407 13.120 1.00 0.00 H new ATOM 2392 N PHE A 163 -5.879 1.374 10.602 1.00 0.00 N ATOM 2393 CA PHE A 163 -4.841 1.396 9.578 1.00 0.00 C ATOM 2394 C PHE A 163 -3.909 0.196 9.723 1.00 0.00 C ATOM 2395 O PHE A 163 -3.293 -0.001 10.770 1.00 0.00 O ATOM 2396 CB PHE A 163 -4.036 2.694 9.665 1.00 0.00 C ATOM 2397 CG PHE A 163 -4.862 3.886 10.056 1.00 0.00 C ATOM 2398 CD1 PHE A 163 -5.988 4.236 9.326 1.00 0.00 C ATOM 2399 CD2 PHE A 163 -4.514 4.658 11.153 1.00 0.00 C ATOM 2400 CE1 PHE A 163 -6.750 5.331 9.684 1.00 0.00 C ATOM 2401 CE2 PHE A 163 -5.273 5.754 11.515 1.00 0.00 C ATOM 2402 CZ PHE A 163 -6.391 6.092 10.779 1.00 0.00 C ATOM 0 H PHE A 163 -5.532 1.233 11.551 1.00 0.00 H new ATOM 0 HA PHE A 163 -5.326 1.342 8.603 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -3.232 2.566 10.390 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -3.568 2.887 8.700 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -6.272 3.646 8.468 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -3.639 4.400 11.732 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -7.626 5.592 9.108 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -4.992 6.346 12.373 1.00 0.00 H new ATOM 0 HZ PHE A 163 -6.984 6.950 11.059 1.00 0.00 H new ATOM 2412 N GLU A 164 -3.811 -0.601 8.664 1.00 0.00 N ATOM 2413 CA GLU A 164 -2.956 -1.782 8.674 1.00 0.00 C ATOM 2414 C GLU A 164 -1.762 -1.597 7.741 1.00 0.00 C ATOM 2415 O GLU A 164 -1.854 -0.902 6.728 1.00 0.00 O ATOM 2416 CB GLU A 164 -3.753 -3.021 8.259 1.00 0.00 C ATOM 2417 CG GLU A 164 -4.662 -3.554 9.354 1.00 0.00 C ATOM 2418 CD GLU A 164 -5.662 -2.522 9.837 1.00 0.00 C ATOM 2419 OE1 GLU A 164 -6.448 -2.022 9.006 1.00 0.00 O ATOM 2420 OE2 GLU A 164 -5.658 -2.215 11.048 1.00 0.00 O ATOM 0 H GLU A 164 -4.313 -0.451 7.789 1.00 0.00 H new ATOM 0 HA GLU A 164 -2.585 -1.921 9.689 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -4.356 -2.779 7.384 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -3.059 -3.806 7.960 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -5.198 -4.427 8.983 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -4.054 -3.887 10.195 1.00 0.00 H new ATOM 2427 N CYS A 165 -0.643 -2.222 8.091 1.00 0.00 N ATOM 2428 CA CYS A 165 0.570 -2.125 7.287 1.00 0.00 C ATOM 2429 C CYS A 165 1.051 -3.508 6.861 1.00 0.00 C ATOM 2430 O CYS A 165 1.595 -4.264 7.668 1.00 0.00 O ATOM 2431 CB CYS A 165 1.670 -1.408 8.070 1.00 0.00 C ATOM 2432 SG CYS A 165 3.175 -1.100 7.117 1.00 0.00 S ATOM 0 H CYS A 165 -0.551 -2.801 8.926 1.00 0.00 H new ATOM 0 HA CYS A 165 0.338 -1.549 6.391 1.00 0.00 H new ATOM 0 HB2 CYS A 165 1.281 -0.456 8.433 1.00 0.00 H new ATOM 0 HB3 CYS A 165 1.924 -2.004 8.947 1.00 0.00 H new ATOM 0 HG CYS A 165 4.045 -0.488 7.865 1.00 0.00 H new ATOM 2438 N HIS A 166 0.847 -3.835 5.589 1.00 0.00 N ATOM 2439 CA HIS A 166 1.259 -5.128 5.056 1.00 0.00 C ATOM 2440 C HIS A 166 2.661 -5.048 4.460 1.00 0.00 C ATOM 2441 O HIS A 166 2.936 -4.207 3.603 1.00 0.00 O ATOM 2442 CB HIS A 166 0.268 -5.606 3.995 1.00 0.00 C ATOM 2443 CG HIS A 166 -1.115 -5.831 4.525 1.00 0.00 C ATOM 2444 ND1 HIS A 166 -2.257 -5.126 4.348 1.00 0.00 N flip ATOM 2445 CD2 HIS A 166 -1.443 -6.888 5.347 1.00 0.00 C flip ATOM 2446 CE1 HIS A 166 -3.244 -5.765 5.057 1.00 0.00 C flip ATOM 2447 NE2 HIS A 166 -2.727 -6.825 5.651 1.00 0.00 N flip ATOM 0 H HIS A 166 0.399 -3.222 4.908 1.00 0.00 H new ATOM 0 HA HIS A 166 1.273 -5.844 5.878 1.00 0.00 H new ATOM 0 HB2 HIS A 166 0.225 -4.870 3.192 1.00 0.00 H new ATOM 0 HB3 HIS A 166 0.636 -6.534 3.558 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -0.757 -7.649 5.689 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -4.276 -5.452 5.119 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -3.233 -7.483 6.244 1.00 0.00 H new ATOM 2455 N VAL A 167 3.546 -5.928 4.919 1.00 0.00 N ATOM 2456 CA VAL A 167 4.919 -5.957 4.430 1.00 0.00 C ATOM 2457 C VAL A 167 5.132 -7.109 3.456 1.00 0.00 C ATOM 2458 O VAL A 167 4.432 -8.121 3.511 1.00 0.00 O ATOM 2459 CB VAL A 167 5.925 -6.088 5.590 1.00 0.00 C ATOM 2460 CG1 VAL A 167 7.333 -5.763 5.116 1.00 0.00 C ATOM 2461 CG2 VAL A 167 5.522 -5.187 6.748 1.00 0.00 C ATOM 0 H VAL A 167 3.336 -6.630 5.629 1.00 0.00 H new ATOM 0 HA VAL A 167 5.091 -5.012 3.914 1.00 0.00 H new ATOM 0 HB VAL A 167 5.916 -7.120 5.941 1.00 0.00 H new ATOM 0 HG11 VAL A 167 8.029 -5.861 5.949 1.00 0.00 H new ATOM 0 HG12 VAL A 167 7.618 -6.453 4.322 1.00 0.00 H new ATOM 0 HG13 VAL A 167 7.363 -4.742 4.737 1.00 0.00 H new ATOM 0 HG21 VAL A 167 6.243 -5.292 7.559 1.00 0.00 H new ATOM 0 HG22 VAL A 167 5.502 -4.150 6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 167 4.532 -5.473 7.104 1.00 0.00 H new ATOM 2471 N PHE A 168 6.104 -6.951 2.563 1.00 0.00 N ATOM 2472 CA PHE A 168 6.409 -7.978 1.574 1.00 0.00 C ATOM 2473 C PHE A 168 7.865 -7.888 1.128 1.00 0.00 C ATOM 2474 O PHE A 168 8.426 -6.797 1.020 1.00 0.00 O ATOM 2475 CB PHE A 168 5.483 -7.842 0.363 1.00 0.00 C ATOM 2476 CG PHE A 168 4.024 -7.908 0.714 1.00 0.00 C ATOM 2477 CD1 PHE A 168 3.361 -9.124 0.749 1.00 0.00 C ATOM 2478 CD2 PHE A 168 3.316 -6.754 1.008 1.00 0.00 C ATOM 2479 CE1 PHE A 168 2.018 -9.187 1.070 1.00 0.00 C ATOM 2480 CE2 PHE A 168 1.973 -6.811 1.331 1.00 0.00 C ATOM 2481 CZ PHE A 168 1.324 -8.029 1.363 1.00 0.00 C ATOM 0 H PHE A 168 6.694 -6.121 2.504 1.00 0.00 H new ATOM 0 HA PHE A 168 6.249 -8.952 2.037 1.00 0.00 H new ATOM 0 HB2 PHE A 168 5.686 -6.894 -0.135 1.00 0.00 H new ATOM 0 HB3 PHE A 168 5.713 -8.633 -0.351 1.00 0.00 H new ATOM 0 HD1 PHE A 168 3.899 -10.033 0.523 1.00 0.00 H new ATOM 0 HD2 PHE A 168 3.819 -5.799 0.985 1.00 0.00 H new ATOM 0 HE1 PHE A 168 1.512 -10.141 1.092 1.00 0.00 H new ATOM 0 HE2 PHE A 168 1.432 -5.904 1.558 1.00 0.00 H new ATOM 0 HZ PHE A 168 0.275 -8.077 1.617 1.00 0.00 H new ATOM 2491 N TRP A 169 8.471 -9.041 0.871 1.00 0.00 N ATOM 2492 CA TRP A 169 9.863 -9.093 0.437 1.00 0.00 C ATOM 2493 C TRP A 169 9.957 -9.171 -1.083 1.00 0.00 C ATOM 2494 O TRP A 169 9.338 -10.033 -1.708 1.00 0.00 O ATOM 2495 CB TRP A 169 10.570 -10.295 1.067 1.00 0.00 C ATOM 2496 CG TRP A 169 12.062 -10.240 0.938 1.00 0.00 C ATOM 2497 CD1 TRP A 169 12.815 -10.727 -0.093 1.00 0.00 C ATOM 2498 CD2 TRP A 169 12.983 -9.667 1.874 1.00 0.00 C ATOM 2499 NE1 TRP A 169 14.147 -10.491 0.146 1.00 0.00 N ATOM 2500 CE2 TRP A 169 14.277 -9.842 1.345 1.00 0.00 C ATOM 2501 CE3 TRP A 169 12.839 -9.022 3.105 1.00 0.00 C ATOM 2502 CZ2 TRP A 169 15.417 -9.396 2.007 1.00 0.00 C ATOM 2503 CZ3 TRP A 169 13.973 -8.580 3.761 1.00 0.00 C ATOM 2504 CH2 TRP A 169 15.248 -8.768 3.211 1.00 0.00 C ATOM 0 H TRP A 169 8.021 -9.953 0.955 1.00 0.00 H new ATOM 0 HA TRP A 169 10.355 -8.178 0.766 1.00 0.00 H new ATOM 0 HB2 TRP A 169 10.305 -10.351 2.123 1.00 0.00 H new ATOM 0 HB3 TRP A 169 10.205 -11.209 0.598 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.421 -11.224 -0.967 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.915 -10.756 -0.470 1.00 0.00 H new ATOM 0 HE3 TRP A 169 11.860 -8.872 3.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.401 -9.540 1.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 13.874 -8.081 4.714 1.00 0.00 H new ATOM 0 HH2 TRP A 169 16.114 -8.410 3.748 1.00 0.00 H new ATOM 2515 N CYS A 170 10.732 -8.267 -1.670 1.00 0.00 N ATOM 2516 CA CYS A 170 10.906 -8.234 -3.118 1.00 0.00 C ATOM 2517 C CYS A 170 12.353 -8.531 -3.499 1.00 0.00 C ATOM 2518 O CYS A 170 13.275 -8.259 -2.731 1.00 0.00 O ATOM 2519 CB CYS A 170 10.490 -6.870 -3.671 1.00 0.00 C ATOM 2520 SG CYS A 170 8.779 -6.416 -3.307 1.00 0.00 S ATOM 0 H CYS A 170 11.250 -7.547 -1.166 1.00 0.00 H new ATOM 0 HA CYS A 170 10.270 -9.004 -3.553 1.00 0.00 H new ATOM 0 HB2 CYS A 170 11.152 -6.107 -3.262 1.00 0.00 H new ATOM 0 HB3 CYS A 170 10.633 -6.869 -4.752 1.00 0.00 H new ATOM 0 HG CYS A 170 8.510 -5.266 -3.850 1.00 0.00 H new ATOM 2526 N GLU A 171 12.542 -9.093 -4.689 1.00 0.00 N ATOM 2527 CA GLU A 171 13.877 -9.430 -5.170 1.00 0.00 C ATOM 2528 C GLU A 171 13.998 -9.169 -6.668 1.00 0.00 C ATOM 2529 O GLU A 171 13.087 -9.449 -7.448 1.00 0.00 O ATOM 2530 CB GLU A 171 14.197 -10.896 -4.869 1.00 0.00 C ATOM 2531 CG GLU A 171 14.597 -11.147 -3.425 1.00 0.00 C ATOM 2532 CD GLU A 171 15.344 -12.455 -3.246 1.00 0.00 C ATOM 2533 OE1 GLU A 171 15.037 -13.418 -3.980 1.00 0.00 O ATOM 2534 OE2 GLU A 171 16.235 -12.515 -2.373 1.00 0.00 O ATOM 0 H GLU A 171 11.789 -9.324 -5.337 1.00 0.00 H new ATOM 0 HA GLU A 171 14.594 -8.795 -4.649 1.00 0.00 H new ATOM 0 HB2 GLU A 171 13.325 -11.506 -5.107 1.00 0.00 H new ATOM 0 HB3 GLU A 171 15.004 -11.225 -5.523 1.00 0.00 H new ATOM 0 HG2 GLU A 171 15.222 -10.325 -3.077 1.00 0.00 H new ATOM 0 HG3 GLU A 171 13.704 -11.154 -2.800 1.00 0.00 H new ATOM 2541 N PRO A 172 15.149 -8.618 -7.082 1.00 0.00 N ATOM 2542 CA PRO A 172 16.240 -8.280 -6.163 1.00 0.00 C ATOM 2543 C PRO A 172 15.890 -7.105 -5.256 1.00 0.00 C ATOM 2544 O PRO A 172 16.094 -7.163 -4.044 1.00 0.00 O ATOM 2545 CB PRO A 172 17.391 -7.907 -7.101 1.00 0.00 C ATOM 2546 CG PRO A 172 16.726 -7.460 -8.357 1.00 0.00 C ATOM 2547 CD PRO A 172 15.473 -8.283 -8.479 1.00 0.00 C ATOM 0 HA PRO A 172 16.473 -9.102 -5.486 1.00 0.00 H new ATOM 0 HB2 PRO A 172 18.007 -7.115 -6.676 1.00 0.00 H new ATOM 0 HB3 PRO A 172 18.047 -8.759 -7.282 1.00 0.00 H new ATOM 0 HG2 PRO A 172 16.492 -6.396 -8.317 1.00 0.00 H new ATOM 0 HG3 PRO A 172 17.377 -7.611 -9.218 1.00 0.00 H new ATOM 0 HD2 PRO A 172 14.668 -7.722 -8.955 1.00 0.00 H new ATOM 0 HD3 PRO A 172 15.637 -9.178 -9.080 1.00 0.00 H new ATOM 2555 N ASN A 173 15.362 -6.040 -5.851 1.00 0.00 N ATOM 2556 CA ASN A 173 14.984 -4.852 -5.096 1.00 0.00 C ATOM 2557 C ASN A 173 13.517 -4.503 -5.328 1.00 0.00 C ATOM 2558 O ASN A 173 12.928 -4.893 -6.335 1.00 0.00 O ATOM 2559 CB ASN A 173 15.870 -3.668 -5.491 1.00 0.00 C ATOM 2560 CG ASN A 173 15.893 -3.437 -6.989 1.00 0.00 C ATOM 2561 OD1 ASN A 173 15.271 -4.177 -7.752 1.00 0.00 O ATOM 2562 ND2 ASN A 173 16.613 -2.408 -7.418 1.00 0.00 N ATOM 0 H ASN A 173 15.186 -5.976 -6.854 1.00 0.00 H new ATOM 0 HA ASN A 173 15.125 -5.066 -4.036 1.00 0.00 H new ATOM 0 HB2 ASN A 173 15.511 -2.767 -4.993 1.00 0.00 H new ATOM 0 HB3 ASN A 173 16.886 -3.844 -5.138 1.00 0.00 H new ATOM 0 HD21 ASN A 173 16.667 -2.204 -8.416 1.00 0.00 H new ATOM 0 HD22 ASN A 173 17.112 -1.821 -6.750 1.00 0.00 H new ATOM 2569 N ALA A 174 12.935 -3.764 -4.389 1.00 0.00 N ATOM 2570 CA ALA A 174 11.538 -3.361 -4.493 1.00 0.00 C ATOM 2571 C ALA A 174 11.388 -2.123 -5.371 1.00 0.00 C ATOM 2572 O ALA A 174 10.623 -1.213 -5.053 1.00 0.00 O ATOM 2573 CB ALA A 174 10.959 -3.101 -3.110 1.00 0.00 C ATOM 0 H ALA A 174 13.409 -3.433 -3.549 1.00 0.00 H new ATOM 0 HA ALA A 174 10.985 -4.176 -4.960 1.00 0.00 H new ATOM 0 HB1 ALA A 174 9.915 -2.801 -3.203 1.00 0.00 H new ATOM 0 HB2 ALA A 174 11.023 -4.010 -2.512 1.00 0.00 H new ATOM 0 HB3 ALA A 174 11.523 -2.306 -2.623 1.00 0.00 H new ATOM 2579 N ALA A 175 12.124 -2.096 -6.478 1.00 0.00 N ATOM 2580 CA ALA A 175 12.071 -0.971 -7.403 1.00 0.00 C ATOM 2581 C ALA A 175 10.952 -1.150 -8.423 1.00 0.00 C ATOM 2582 O ALA A 175 10.224 -0.208 -8.733 1.00 0.00 O ATOM 2583 CB ALA A 175 13.409 -0.804 -8.108 1.00 0.00 C ATOM 0 H ALA A 175 12.764 -2.840 -6.755 1.00 0.00 H new ATOM 0 HA ALA A 175 11.861 -0.069 -6.828 1.00 0.00 H new ATOM 0 HB1 ALA A 175 13.355 0.040 -8.796 1.00 0.00 H new ATOM 0 HB2 ALA A 175 14.189 -0.621 -7.369 1.00 0.00 H new ATOM 0 HB3 ALA A 175 13.643 -1.711 -8.665 1.00 0.00 H new ATOM 2589 N ASN A 176 10.821 -2.367 -8.943 1.00 0.00 N ATOM 2590 CA ASN A 176 9.791 -2.669 -9.930 1.00 0.00 C ATOM 2591 C ASN A 176 8.419 -2.768 -9.271 1.00 0.00 C ATOM 2592 O ASN A 176 7.392 -2.547 -9.914 1.00 0.00 O ATOM 2593 CB ASN A 176 10.117 -3.977 -10.653 1.00 0.00 C ATOM 2594 CG ASN A 176 11.579 -4.072 -11.045 1.00 0.00 C ATOM 2595 OD1 ASN A 176 12.301 -4.956 -10.583 1.00 0.00 O ATOM 2596 ND2 ASN A 176 12.023 -3.159 -11.901 1.00 0.00 N ATOM 0 H ASN A 176 11.415 -3.159 -8.697 1.00 0.00 H new ATOM 0 HA ASN A 176 9.768 -1.856 -10.656 1.00 0.00 H new ATOM 0 HB2 ASN A 176 9.861 -4.818 -10.009 1.00 0.00 H new ATOM 0 HB3 ASN A 176 9.498 -4.059 -11.546 1.00 0.00 H new ATOM 0 HD21 ASN A 176 12.998 -3.172 -12.201 1.00 0.00 H new ATOM 0 HD22 ASN A 176 11.389 -2.444 -12.259 1.00 0.00 H new ATOM 2603 N VAL A 177 8.408 -3.101 -7.984 1.00 0.00 N ATOM 2604 CA VAL A 177 7.163 -3.227 -7.237 1.00 0.00 C ATOM 2605 C VAL A 177 6.687 -1.871 -6.729 1.00 0.00 C ATOM 2606 O VAL A 177 5.506 -1.537 -6.833 1.00 0.00 O ATOM 2607 CB VAL A 177 7.321 -4.185 -6.041 1.00 0.00 C ATOM 2608 CG1 VAL A 177 6.003 -4.329 -5.295 1.00 0.00 C ATOM 2609 CG2 VAL A 177 7.830 -5.540 -6.507 1.00 0.00 C ATOM 0 H VAL A 177 9.248 -3.288 -7.437 1.00 0.00 H new ATOM 0 HA VAL A 177 6.421 -3.635 -7.924 1.00 0.00 H new ATOM 0 HB VAL A 177 8.056 -3.764 -5.355 1.00 0.00 H new ATOM 0 HG11 VAL A 177 6.134 -5.009 -4.453 1.00 0.00 H new ATOM 0 HG12 VAL A 177 5.685 -3.354 -4.927 1.00 0.00 H new ATOM 0 HG13 VAL A 177 5.245 -4.727 -5.969 1.00 0.00 H new ATOM 0 HG21 VAL A 177 7.936 -6.204 -5.649 1.00 0.00 H new ATOM 0 HG22 VAL A 177 7.122 -5.971 -7.214 1.00 0.00 H new ATOM 0 HG23 VAL A 177 8.798 -5.418 -6.992 1.00 0.00 H new ATOM 2619 N SER A 178 7.613 -1.092 -6.180 1.00 0.00 N ATOM 2620 CA SER A 178 7.288 0.227 -5.652 1.00 0.00 C ATOM 2621 C SER A 178 6.863 1.171 -6.773 1.00 0.00 C ATOM 2622 O SER A 178 5.971 2.000 -6.596 1.00 0.00 O ATOM 2623 CB SER A 178 8.489 0.812 -4.906 1.00 0.00 C ATOM 2624 OG SER A 178 9.617 0.915 -5.757 1.00 0.00 O ATOM 0 H SER A 178 8.595 -1.352 -6.089 1.00 0.00 H new ATOM 0 HA SER A 178 6.456 0.117 -4.957 1.00 0.00 H new ATOM 0 HB2 SER A 178 8.234 1.797 -4.515 1.00 0.00 H new ATOM 0 HB3 SER A 178 8.732 0.182 -4.050 1.00 0.00 H new ATOM 0 HG SER A 178 10.300 0.271 -5.475 1.00 0.00 H new ATOM 2630 N GLU A 179 7.510 1.038 -7.927 1.00 0.00 N ATOM 2631 CA GLU A 179 7.200 1.879 -9.077 1.00 0.00 C ATOM 2632 C GLU A 179 5.870 1.474 -9.705 1.00 0.00 C ATOM 2633 O GLU A 179 5.117 2.318 -10.190 1.00 0.00 O ATOM 2634 CB GLU A 179 8.317 1.789 -10.119 1.00 0.00 C ATOM 2635 CG GLU A 179 8.301 0.497 -10.919 1.00 0.00 C ATOM 2636 CD GLU A 179 9.440 0.414 -11.916 1.00 0.00 C ATOM 2637 OE1 GLU A 179 10.396 1.208 -11.791 1.00 0.00 O ATOM 2638 OE2 GLU A 179 9.376 -0.444 -12.821 1.00 0.00 O ATOM 0 H GLU A 179 8.251 0.357 -8.090 1.00 0.00 H new ATOM 0 HA GLU A 179 7.119 2.909 -8.730 1.00 0.00 H new ATOM 0 HB2 GLU A 179 8.231 2.632 -10.805 1.00 0.00 H new ATOM 0 HB3 GLU A 179 9.280 1.883 -9.616 1.00 0.00 H new ATOM 0 HG2 GLU A 179 8.359 -0.350 -10.235 1.00 0.00 H new ATOM 0 HG3 GLU A 179 7.352 0.414 -11.449 1.00 0.00 H new ATOM 2645 N ALA A 180 5.588 0.175 -9.693 1.00 0.00 N ATOM 2646 CA ALA A 180 4.349 -0.343 -10.260 1.00 0.00 C ATOM 2647 C ALA A 180 3.143 0.096 -9.436 1.00 0.00 C ATOM 2648 O ALA A 180 2.148 0.573 -9.981 1.00 0.00 O ATOM 2649 CB ALA A 180 4.405 -1.861 -10.350 1.00 0.00 C ATOM 0 H ALA A 180 6.201 -0.538 -9.297 1.00 0.00 H new ATOM 0 HA ALA A 180 4.238 0.066 -11.264 1.00 0.00 H new ATOM 0 HB1 ALA A 180 3.474 -2.235 -10.775 1.00 0.00 H new ATOM 0 HB2 ALA A 180 5.239 -2.157 -10.986 1.00 0.00 H new ATOM 0 HB3 ALA A 180 4.543 -2.280 -9.353 1.00 0.00 H new ATOM 2655 N VAL A 181 3.239 -0.070 -8.121 1.00 0.00 N ATOM 2656 CA VAL A 181 2.155 0.310 -7.222 1.00 0.00 C ATOM 2657 C VAL A 181 1.953 1.821 -7.212 1.00 0.00 C ATOM 2658 O VAL A 181 0.822 2.305 -7.201 1.00 0.00 O ATOM 2659 CB VAL A 181 2.425 -0.170 -5.784 1.00 0.00 C ATOM 2660 CG1 VAL A 181 3.626 0.555 -5.195 1.00 0.00 C ATOM 2661 CG2 VAL A 181 1.192 0.030 -4.915 1.00 0.00 C ATOM 0 H VAL A 181 4.056 -0.465 -7.654 1.00 0.00 H new ATOM 0 HA VAL A 181 1.251 -0.172 -7.595 1.00 0.00 H new ATOM 0 HB VAL A 181 2.652 -1.236 -5.812 1.00 0.00 H new ATOM 0 HG11 VAL A 181 3.801 0.203 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 181 4.507 0.355 -5.805 1.00 0.00 H new ATOM 0 HG13 VAL A 181 3.432 1.627 -5.179 1.00 0.00 H new ATOM 0 HG21 VAL A 181 1.401 -0.315 -3.902 1.00 0.00 H new ATOM 0 HG22 VAL A 181 0.931 1.088 -4.892 1.00 0.00 H new ATOM 0 HG23 VAL A 181 0.360 -0.540 -5.328 1.00 0.00 H new ATOM 2671 N GLN A 182 3.058 2.560 -7.217 1.00 0.00 N ATOM 2672 CA GLN A 182 3.001 4.017 -7.209 1.00 0.00 C ATOM 2673 C GLN A 182 2.392 4.546 -8.503 1.00 0.00 C ATOM 2674 O GLN A 182 1.678 5.548 -8.500 1.00 0.00 O ATOM 2675 CB GLN A 182 4.401 4.602 -7.015 1.00 0.00 C ATOM 2676 CG GLN A 182 4.487 6.089 -7.316 1.00 0.00 C ATOM 2677 CD GLN A 182 5.551 6.791 -6.495 1.00 0.00 C ATOM 2678 OE1 GLN A 182 6.586 6.053 -6.112 1.00 0.00 O flip ATOM 2679 NE2 GLN A 182 5.443 7.984 -6.208 1.00 0.00 N flip ATOM 0 H GLN A 182 4.002 2.174 -7.227 1.00 0.00 H new ATOM 0 HA GLN A 182 2.367 4.325 -6.378 1.00 0.00 H new ATOM 0 HB2 GLN A 182 4.718 4.429 -5.987 1.00 0.00 H new ATOM 0 HB3 GLN A 182 5.101 4.069 -7.658 1.00 0.00 H new ATOM 0 HG2 GLN A 182 4.700 6.229 -8.376 1.00 0.00 H new ATOM 0 HG3 GLN A 182 3.519 6.552 -7.121 1.00 0.00 H new ATOM 0 HE21 GLN A 182 4.630 8.513 -6.524 1.00 0.00 H new ATOM 0 HE22 GLN A 182 6.167 8.443 -5.655 1.00 0.00 H new ATOM 2688 N ALA A 183 2.679 3.865 -9.608 1.00 0.00 N ATOM 2689 CA ALA A 183 2.158 4.265 -10.909 1.00 0.00 C ATOM 2690 C ALA A 183 0.633 4.230 -10.924 1.00 0.00 C ATOM 2691 O ALA A 183 -0.011 5.087 -11.528 1.00 0.00 O ATOM 2692 CB ALA A 183 2.720 3.368 -12.002 1.00 0.00 C ATOM 0 H ALA A 183 3.270 3.034 -9.628 1.00 0.00 H new ATOM 0 HA ALA A 183 2.474 5.291 -11.099 1.00 0.00 H new ATOM 0 HB1 ALA A 183 2.322 3.679 -12.968 1.00 0.00 H new ATOM 0 HB2 ALA A 183 3.807 3.447 -12.015 1.00 0.00 H new ATOM 0 HB3 ALA A 183 2.434 2.334 -11.807 1.00 0.00 H new ATOM 2698 N ALA A 184 0.063 3.232 -10.258 1.00 0.00 N ATOM 2699 CA ALA A 184 -1.386 3.085 -10.194 1.00 0.00 C ATOM 2700 C ALA A 184 -2.025 4.261 -9.461 1.00 0.00 C ATOM 2701 O ALA A 184 -3.130 4.688 -9.798 1.00 0.00 O ATOM 2702 CB ALA A 184 -1.755 1.775 -9.515 1.00 0.00 C ATOM 0 H ALA A 184 0.582 2.513 -9.755 1.00 0.00 H new ATOM 0 HA ALA A 184 -1.770 3.073 -11.214 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -2.840 1.679 -9.474 1.00 0.00 H new ATOM 0 HB2 ALA A 184 -1.338 0.942 -10.081 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -1.352 1.764 -8.502 1.00 0.00 H new ATOM 2708 N CYS A 185 -1.324 4.778 -8.458 1.00 0.00 N ATOM 2709 CA CYS A 185 -1.824 5.903 -7.677 1.00 0.00 C ATOM 2710 C CYS A 185 -2.081 7.113 -8.569 1.00 0.00 C ATOM 2711 O CYS A 185 -3.192 7.640 -8.613 1.00 0.00 O ATOM 2712 CB CYS A 185 -0.827 6.269 -6.576 1.00 0.00 C ATOM 2713 SG CYS A 185 -0.668 5.018 -5.280 1.00 0.00 S ATOM 0 H CYS A 185 -0.408 4.436 -8.167 1.00 0.00 H new ATOM 0 HA CYS A 185 -2.767 5.605 -7.219 1.00 0.00 H new ATOM 0 HB2 CYS A 185 0.151 6.436 -7.027 1.00 0.00 H new ATOM 0 HB3 CYS A 185 -1.133 7.211 -6.121 1.00 0.00 H new ATOM 0 HG CYS A 185 -1.180 5.471 -4.174 1.00 0.00 H new