USER MOD reduce.3.24.130724 H: found=0, std=0, add=1042, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1041 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 81 TYR OH : rot 150:sc= 0 USER MOD Set 1.2: A 104 MET CE :methyl 160:sc= -0.723! (180deg=-1.8!) USER MOD Set 2.1: A 64 TYR OH : rot 137:sc= 1.23 USER MOD Set 2.2: A 114 SER OG : rot -146:sc= 0.71 USER MOD Set 3.1: A 61 CYS SG : rot 155:sc= -0.849 USER MOD Set 3.2: A 119 GLN : amide:sc= -3.91 K(o=-4.8,f=-14!) USER MOD Set 4.1: A 24 GLN : amide:sc= 0.00261 X(o=0.0045,f=0) USER MOD Set 4.2: A 31 LYS NZ :NH3+ -111:sc= 0.0019 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot -108:sc= 1.22 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 35 ASN : amide:sc= -2.98! C(o=-3!,f=-2.4!) USER MOD Single : A 36 ASN : amide:sc= 0.273 K(o=0.27,f=-2.5!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -128:sc= 0.731 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -2.19 K(o=-2.2,f=-9!) USER MOD Single : A 65 LYS NZ :NH3+ 171:sc= 0.0084 (180deg=0.00585) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ -162:sc= -0.474 (180deg=-1.01) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 176:sc= 0 (180deg=-0.0332) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.793 K(o=-0.79,f=0) USER MOD Single : A 86 GLN : amide:sc= -1.83 X(o=-1.8,f=-1.8) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 97 HIS : no HD1:sc= -0.0419 X(o=-0.042,f=-0.042) USER MOD Single : A 99 THR OG1 : rot -130:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 110:sc= -1.25 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.117 K(o=-0.12,f=-1.6!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= -0.699 USER MOD Single : A 117 MET CE :methyl -179:sc= -0.0691 (180deg=-0.0742) USER MOD Single : A 120 LYS NZ :NH3+ 148:sc= -0.113 (180deg=-1.25) USER MOD Single : A 123 HIS : no HE2:sc= -3.84! C(o=-3.8!,f=-8.1!) USER MOD Single : A 126 MET CE :methyl -179:sc= -1.19 (180deg=-1.2) USER MOD Single : A 128 LYS NZ :NH3+ 158:sc= -0.0878 (180deg=-0.484) USER MOD Single : A 130 SER OG : rot 12:sc= -0.993! USER MOD Single : A 137 SER OG : rot -61:sc= 0.296 USER MOD Single : A 140 TYR OH : rot 177:sc= 0.672 USER MOD Single : A 141 GLN : amide:sc= 0.074 X(o=0.074,f=-0.08) USER MOD ----------------------------------------------------------------- ATOM 230 N SER A 18 17.041 -9.700 -6.010 1.00 0.00 N ATOM 231 CA SER A 18 17.976 -9.742 -7.129 1.00 0.00 C ATOM 232 C SER A 18 18.057 -8.384 -7.819 1.00 0.00 C ATOM 233 O SER A 18 17.054 -7.680 -7.952 1.00 0.00 O ATOM 234 CB SER A 18 17.553 -10.813 -8.135 1.00 0.00 C ATOM 235 OG SER A 18 18.111 -12.074 -7.803 1.00 0.00 O ATOM 0 HA SER A 18 18.962 -9.991 -6.737 1.00 0.00 H new ATOM 0 HB2 SER A 18 16.466 -10.887 -8.156 1.00 0.00 H new ATOM 0 HB3 SER A 18 17.872 -10.523 -9.136 1.00 0.00 H new ATOM 0 HG SER A 18 17.824 -12.742 -8.460 1.00 0.00 H new ATOM 241 N LEU A 19 19.257 -8.020 -8.257 1.00 0.00 N ATOM 242 CA LEU A 19 19.472 -6.747 -8.934 1.00 0.00 C ATOM 243 C LEU A 19 18.398 -6.503 -9.989 1.00 0.00 C ATOM 244 O LEU A 19 17.627 -5.548 -9.896 1.00 0.00 O ATOM 245 CB LEU A 19 20.857 -6.718 -9.583 1.00 0.00 C ATOM 246 CG LEU A 19 21.475 -5.334 -9.783 1.00 0.00 C ATOM 247 CD1 LEU A 19 20.642 -4.512 -10.754 1.00 0.00 C ATOM 248 CD2 LEU A 19 21.613 -4.613 -8.451 1.00 0.00 C ATOM 0 H LEU A 19 20.097 -8.590 -8.155 1.00 0.00 H new ATOM 0 HA LEU A 19 19.411 -5.953 -8.189 1.00 0.00 H new ATOM 0 HB2 LEU A 19 21.536 -7.312 -8.971 1.00 0.00 H new ATOM 0 HB3 LEU A 19 20.792 -7.209 -10.554 1.00 0.00 H new ATOM 0 HG LEU A 19 22.471 -5.460 -10.208 1.00 0.00 H new ATOM 0 HD11 LEU A 19 21.098 -3.530 -10.884 1.00 0.00 H new ATOM 0 HD12 LEU A 19 20.597 -5.021 -11.717 1.00 0.00 H new ATOM 0 HD13 LEU A 19 19.633 -4.394 -10.359 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.055 -3.630 -8.614 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.629 -4.498 -7.996 1.00 0.00 H new ATOM 0 HD23 LEU A 19 22.254 -5.194 -7.788 1.00 0.00 H new ATOM 260 N ASP A 20 18.351 -7.375 -10.991 1.00 0.00 N ATOM 261 CA ASP A 20 17.370 -7.257 -12.062 1.00 0.00 C ATOM 262 C ASP A 20 15.971 -7.034 -11.495 1.00 0.00 C ATOM 263 O ASP A 20 15.074 -6.568 -12.198 1.00 0.00 O ATOM 264 CB ASP A 20 17.386 -8.511 -12.938 1.00 0.00 C ATOM 265 CG ASP A 20 18.615 -8.584 -13.822 1.00 0.00 C ATOM 266 OD1 ASP A 20 18.696 -7.800 -14.791 1.00 0.00 O ATOM 267 OD2 ASP A 20 19.495 -9.426 -13.547 1.00 0.00 O ATOM 0 H ASP A 20 18.982 -8.171 -11.083 1.00 0.00 H new ATOM 0 HA ASP A 20 17.637 -6.394 -12.672 1.00 0.00 H new ATOM 0 HB2 ASP A 20 17.346 -9.395 -12.302 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.492 -8.526 -13.562 1.00 0.00 H new ATOM 272 N GLU A 21 15.793 -7.372 -10.223 1.00 0.00 N ATOM 273 CA GLU A 21 14.502 -7.211 -9.563 1.00 0.00 C ATOM 274 C GLU A 21 14.361 -5.807 -8.980 1.00 0.00 C ATOM 275 O GLU A 21 13.441 -5.069 -9.332 1.00 0.00 O ATOM 276 CB GLU A 21 14.337 -8.253 -8.455 1.00 0.00 C ATOM 277 CG GLU A 21 12.894 -8.668 -8.220 1.00 0.00 C ATOM 278 CD GLU A 21 12.770 -9.817 -7.239 1.00 0.00 C ATOM 279 OE1 GLU A 21 12.847 -10.983 -7.679 1.00 0.00 O ATOM 280 OE2 GLU A 21 12.596 -9.550 -6.032 1.00 0.00 O ATOM 0 H GLU A 21 16.526 -7.759 -9.628 1.00 0.00 H new ATOM 0 HA GLU A 21 13.721 -7.357 -10.309 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.924 -9.136 -8.708 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.747 -7.853 -7.528 1.00 0.00 H new ATOM 0 HG2 GLU A 21 12.330 -7.813 -7.846 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.443 -8.956 -9.170 1.00 0.00 H new ATOM 287 N ALA A 22 15.278 -5.448 -8.088 1.00 0.00 N ATOM 288 CA ALA A 22 15.257 -4.134 -7.459 1.00 0.00 C ATOM 289 C ALA A 22 14.918 -3.045 -8.471 1.00 0.00 C ATOM 290 O ALA A 22 14.308 -2.031 -8.128 1.00 0.00 O ATOM 291 CB ALA A 22 16.595 -3.844 -6.796 1.00 0.00 C ATOM 0 H ALA A 22 16.045 -6.049 -7.785 1.00 0.00 H new ATOM 0 HA ALA A 22 14.479 -4.137 -6.695 1.00 0.00 H new ATOM 0 HB1 ALA A 22 16.564 -2.859 -6.330 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.795 -4.599 -6.036 1.00 0.00 H new ATOM 0 HB3 ALA A 22 17.385 -3.866 -7.546 1.00 0.00 H new ATOM 297 N LEU A 23 15.319 -3.259 -9.719 1.00 0.00 N ATOM 298 CA LEU A 23 15.059 -2.295 -10.783 1.00 0.00 C ATOM 299 C LEU A 23 13.602 -2.357 -11.228 1.00 0.00 C ATOM 300 O LEU A 23 13.001 -1.334 -11.558 1.00 0.00 O ATOM 301 CB LEU A 23 15.980 -2.560 -11.974 1.00 0.00 C ATOM 302 CG LEU A 23 17.414 -2.970 -11.636 1.00 0.00 C ATOM 303 CD1 LEU A 23 17.977 -3.882 -12.716 1.00 0.00 C ATOM 304 CD2 LEU A 23 18.293 -1.741 -11.462 1.00 0.00 C ATOM 0 H LEU A 23 15.826 -4.092 -10.019 1.00 0.00 H new ATOM 0 HA LEU A 23 15.259 -1.297 -10.393 1.00 0.00 H new ATOM 0 HB2 LEU A 23 15.534 -3.344 -12.585 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.016 -1.660 -12.587 1.00 0.00 H new ATOM 0 HG LEU A 23 17.402 -3.520 -10.695 1.00 0.00 H new ATOM 0 HD11 LEU A 23 18.998 -4.164 -12.459 1.00 0.00 H new ATOM 0 HD12 LEU A 23 17.362 -4.778 -12.792 1.00 0.00 H new ATOM 0 HD13 LEU A 23 17.975 -3.358 -13.672 1.00 0.00 H new ATOM 0 HD21 LEU A 23 19.310 -2.052 -11.222 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.299 -1.164 -12.387 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.901 -1.125 -10.653 1.00 0.00 H new ATOM 316 N GLN A 24 13.040 -3.560 -11.234 1.00 0.00 N ATOM 317 CA GLN A 24 11.651 -3.753 -11.638 1.00 0.00 C ATOM 318 C GLN A 24 10.721 -2.853 -10.834 1.00 0.00 C ATOM 319 O GLN A 24 9.622 -2.523 -11.280 1.00 0.00 O ATOM 320 CB GLN A 24 11.245 -5.217 -11.458 1.00 0.00 C ATOM 321 CG GLN A 24 11.986 -6.172 -12.380 1.00 0.00 C ATOM 322 CD GLN A 24 11.174 -7.406 -12.717 1.00 0.00 C ATOM 323 OE1 GLN A 24 10.927 -7.702 -13.887 1.00 0.00 O ATOM 324 NE2 GLN A 24 10.753 -8.137 -11.691 1.00 0.00 N ATOM 0 H GLN A 24 13.524 -4.416 -10.964 1.00 0.00 H new ATOM 0 HA GLN A 24 11.564 -3.486 -12.691 1.00 0.00 H new ATOM 0 HB2 GLN A 24 11.425 -5.511 -10.424 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.174 -5.313 -11.635 1.00 0.00 H new ATOM 0 HG2 GLN A 24 12.248 -5.652 -13.301 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.921 -6.475 -11.908 1.00 0.00 H new ATOM 0 HE21 GLN A 24 10.980 -7.856 -10.737 1.00 0.00 H new ATOM 0 HE22 GLN A 24 10.203 -8.980 -11.857 1.00 0.00 H new ATOM 333 N TRP A 25 11.167 -2.457 -9.646 1.00 0.00 N ATOM 334 CA TRP A 25 10.373 -1.594 -8.780 1.00 0.00 C ATOM 335 C TRP A 25 10.317 -0.173 -9.330 1.00 0.00 C ATOM 336 O TRP A 25 9.395 0.583 -9.026 1.00 0.00 O ATOM 337 CB TRP A 25 10.954 -1.584 -7.365 1.00 0.00 C ATOM 338 CG TRP A 25 11.031 -2.947 -6.745 1.00 0.00 C ATOM 339 CD1 TRP A 25 10.229 -4.018 -7.018 1.00 0.00 C ATOM 340 CD2 TRP A 25 11.960 -3.382 -5.746 1.00 0.00 C ATOM 341 NE1 TRP A 25 10.604 -5.093 -6.249 1.00 0.00 N ATOM 342 CE2 TRP A 25 11.663 -4.730 -5.461 1.00 0.00 C ATOM 343 CE3 TRP A 25 13.013 -2.766 -5.065 1.00 0.00 C ATOM 344 CZ2 TRP A 25 12.382 -5.468 -4.525 1.00 0.00 C ATOM 345 CZ3 TRP A 25 13.726 -3.500 -4.137 1.00 0.00 C ATOM 346 CH2 TRP A 25 13.409 -4.840 -3.874 1.00 0.00 C ATOM 0 H TRP A 25 12.074 -2.720 -9.261 1.00 0.00 H new ATOM 0 HA TRP A 25 9.358 -1.990 -8.746 1.00 0.00 H new ATOM 0 HB2 TRP A 25 11.953 -1.148 -7.393 1.00 0.00 H new ATOM 0 HB3 TRP A 25 10.343 -0.939 -6.733 1.00 0.00 H new ATOM 0 HD1 TRP A 25 9.419 -4.020 -7.733 1.00 0.00 H new ATOM 0 HE1 TRP A 25 10.164 -6.013 -6.263 1.00 0.00 H new ATOM 0 HE3 TRP A 25 13.265 -1.734 -5.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 12.138 -6.500 -4.320 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 14.542 -3.033 -3.605 1.00 0.00 H new ATOM 0 HH2 TRP A 25 13.986 -5.387 -3.144 1.00 0.00 H new ATOM 357 N ARG A 26 11.308 0.182 -10.141 1.00 0.00 N ATOM 358 CA ARG A 26 11.371 1.513 -10.732 1.00 0.00 C ATOM 359 C ARG A 26 10.342 1.661 -11.850 1.00 0.00 C ATOM 360 O ARG A 26 9.687 2.696 -11.971 1.00 0.00 O ATOM 361 CB ARG A 26 12.775 1.786 -11.277 1.00 0.00 C ATOM 362 CG ARG A 26 13.801 2.081 -10.195 1.00 0.00 C ATOM 363 CD ARG A 26 15.137 2.493 -10.792 1.00 0.00 C ATOM 364 NE ARG A 26 15.192 3.925 -11.074 1.00 0.00 N ATOM 365 CZ ARG A 26 14.800 4.463 -12.223 1.00 0.00 C ATOM 366 NH1 ARG A 26 14.327 3.693 -13.193 1.00 0.00 N ATOM 367 NH2 ARG A 26 14.880 5.775 -12.405 1.00 0.00 N ATOM 0 H ARG A 26 12.078 -0.433 -10.404 1.00 0.00 H new ATOM 0 HA ARG A 26 11.143 2.240 -9.953 1.00 0.00 H new ATOM 0 HB2 ARG A 26 13.106 0.923 -11.854 1.00 0.00 H new ATOM 0 HB3 ARG A 26 12.731 2.631 -11.964 1.00 0.00 H new ATOM 0 HG2 ARG A 26 13.430 2.875 -9.547 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.937 1.198 -9.571 1.00 0.00 H new ATOM 0 HD2 ARG A 26 15.939 2.228 -10.103 1.00 0.00 H new ATOM 0 HD3 ARG A 26 15.310 1.935 -11.712 1.00 0.00 H new ATOM 0 HE ARG A 26 15.551 4.546 -10.349 1.00 0.00 H new ATOM 0 HH11 ARG A 26 14.263 2.684 -13.058 1.00 0.00 H new ATOM 0 HH12 ARG A 26 14.027 4.110 -14.074 1.00 0.00 H new ATOM 0 HH21 ARG A 26 15.243 6.372 -11.662 1.00 0.00 H new ATOM 0 HH22 ARG A 26 14.578 6.187 -13.288 1.00 0.00 H new ATOM 381 N ASP A 27 10.208 0.620 -12.664 1.00 0.00 N ATOM 382 CA ASP A 27 9.259 0.633 -13.771 1.00 0.00 C ATOM 383 C ASP A 27 7.841 0.885 -13.269 1.00 0.00 C ATOM 384 O ASP A 27 7.174 1.823 -13.706 1.00 0.00 O ATOM 385 CB ASP A 27 9.315 -0.690 -14.536 1.00 0.00 C ATOM 386 CG ASP A 27 8.638 -0.607 -15.889 1.00 0.00 C ATOM 387 OD1 ASP A 27 9.189 0.064 -16.787 1.00 0.00 O ATOM 388 OD2 ASP A 27 7.557 -1.212 -16.050 1.00 0.00 O ATOM 0 H ASP A 27 10.744 -0.243 -12.578 1.00 0.00 H new ATOM 0 HA ASP A 27 9.536 1.444 -14.444 1.00 0.00 H new ATOM 0 HB2 ASP A 27 10.356 -0.984 -14.672 1.00 0.00 H new ATOM 0 HB3 ASP A 27 8.838 -1.470 -13.942 1.00 0.00 H new ATOM 393 N SER A 28 7.386 0.040 -12.348 1.00 0.00 N ATOM 394 CA SER A 28 6.044 0.168 -11.790 1.00 0.00 C ATOM 395 C SER A 28 6.070 0.004 -10.274 1.00 0.00 C ATOM 396 O SER A 28 6.755 -0.873 -9.743 1.00 0.00 O ATOM 397 CB SER A 28 5.110 -0.871 -12.412 1.00 0.00 C ATOM 398 OG SER A 28 3.754 -0.472 -12.296 1.00 0.00 O ATOM 0 H SER A 28 7.926 -0.740 -11.973 1.00 0.00 H new ATOM 0 HA SER A 28 5.672 1.166 -12.024 1.00 0.00 H new ATOM 0 HB2 SER A 28 5.363 -1.009 -13.463 1.00 0.00 H new ATOM 0 HB3 SER A 28 5.253 -1.833 -11.921 1.00 0.00 H new ATOM 0 HG SER A 28 3.305 -1.029 -11.626 1.00 0.00 H new ATOM 404 N LEU A 29 5.320 0.852 -9.580 1.00 0.00 N ATOM 405 CA LEU A 29 5.254 0.802 -8.124 1.00 0.00 C ATOM 406 C LEU A 29 4.823 -0.581 -7.645 1.00 0.00 C ATOM 407 O LEU A 29 5.348 -1.098 -6.659 1.00 0.00 O ATOM 408 CB LEU A 29 4.282 1.861 -7.601 1.00 0.00 C ATOM 409 CG LEU A 29 3.774 1.659 -6.173 1.00 0.00 C ATOM 410 CD1 LEU A 29 4.801 2.151 -5.165 1.00 0.00 C ATOM 411 CD2 LEU A 29 2.445 2.373 -5.974 1.00 0.00 C ATOM 0 H LEU A 29 4.748 1.583 -10.003 1.00 0.00 H new ATOM 0 HA LEU A 29 6.250 1.007 -7.733 1.00 0.00 H new ATOM 0 HB2 LEU A 29 4.771 2.834 -7.657 1.00 0.00 H new ATOM 0 HB3 LEU A 29 3.422 1.898 -8.270 1.00 0.00 H new ATOM 0 HG LEU A 29 3.619 0.592 -6.011 1.00 0.00 H new ATOM 0 HD11 LEU A 29 4.421 1.999 -4.155 1.00 0.00 H new ATOM 0 HD12 LEU A 29 5.730 1.595 -5.291 1.00 0.00 H new ATOM 0 HD13 LEU A 29 4.989 3.213 -5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 29 2.098 2.218 -4.952 1.00 0.00 H new ATOM 0 HD22 LEU A 29 2.574 3.440 -6.156 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.709 1.973 -6.671 1.00 0.00 H new ATOM 423 N ASP A 30 3.867 -1.174 -8.351 1.00 0.00 N ATOM 424 CA ASP A 30 3.368 -2.498 -8.000 1.00 0.00 C ATOM 425 C ASP A 30 4.518 -3.435 -7.643 1.00 0.00 C ATOM 426 O ASP A 30 4.612 -3.919 -6.515 1.00 0.00 O ATOM 427 CB ASP A 30 2.557 -3.084 -9.157 1.00 0.00 C ATOM 428 CG ASP A 30 1.539 -2.104 -9.705 1.00 0.00 C ATOM 429 OD1 ASP A 30 1.932 -1.224 -10.501 1.00 0.00 O ATOM 430 OD2 ASP A 30 0.351 -2.214 -9.339 1.00 0.00 O ATOM 0 H ASP A 30 3.422 -0.759 -9.170 1.00 0.00 H new ATOM 0 HA ASP A 30 2.722 -2.396 -7.128 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.235 -3.384 -9.956 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.044 -3.984 -8.818 1.00 0.00 H new ATOM 435 N LYS A 31 5.391 -3.688 -8.612 1.00 0.00 N ATOM 436 CA LYS A 31 6.535 -4.567 -8.402 1.00 0.00 C ATOM 437 C LYS A 31 7.110 -4.387 -7.000 1.00 0.00 C ATOM 438 O LYS A 31 7.539 -5.351 -6.365 1.00 0.00 O ATOM 439 CB LYS A 31 7.617 -4.289 -9.447 1.00 0.00 C ATOM 440 CG LYS A 31 7.167 -4.551 -10.874 1.00 0.00 C ATOM 441 CD LYS A 31 7.500 -5.967 -11.313 1.00 0.00 C ATOM 442 CE LYS A 31 7.766 -6.038 -12.809 1.00 0.00 C ATOM 443 NZ LYS A 31 7.632 -7.427 -13.330 1.00 0.00 N ATOM 0 H LYS A 31 5.328 -3.296 -9.552 1.00 0.00 H new ATOM 0 HA LYS A 31 6.193 -5.597 -8.506 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.935 -3.250 -9.360 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.487 -4.908 -9.230 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.092 -4.388 -10.953 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.648 -3.839 -11.545 1.00 0.00 H new ATOM 0 HD2 LYS A 31 8.376 -6.321 -10.769 1.00 0.00 H new ATOM 0 HD3 LYS A 31 6.675 -6.632 -11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.069 -5.384 -13.333 1.00 0.00 H new ATOM 0 HE3 LYS A 31 8.769 -5.667 -13.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 8.568 -7.785 -13.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 7.235 -8.039 -12.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.000 -7.429 -14.156 1.00 0.00 H new ATOM 457 N LEU A 32 7.112 -3.147 -6.522 1.00 0.00 N ATOM 458 CA LEU A 32 7.632 -2.840 -5.194 1.00 0.00 C ATOM 459 C LEU A 32 6.676 -3.326 -4.109 1.00 0.00 C ATOM 460 O LEU A 32 7.001 -4.231 -3.340 1.00 0.00 O ATOM 461 CB LEU A 32 7.863 -1.335 -5.051 1.00 0.00 C ATOM 462 CG LEU A 32 8.604 -0.886 -3.791 1.00 0.00 C ATOM 463 CD1 LEU A 32 10.068 -1.295 -3.859 1.00 0.00 C ATOM 464 CD2 LEU A 32 8.477 0.618 -3.603 1.00 0.00 C ATOM 0 H LEU A 32 6.759 -2.338 -7.034 1.00 0.00 H new ATOM 0 HA LEU A 32 8.582 -3.360 -5.073 1.00 0.00 H new ATOM 0 HB2 LEU A 32 8.423 -0.990 -5.920 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.895 -0.835 -5.076 1.00 0.00 H new ATOM 0 HG LEU A 32 8.149 -1.378 -2.931 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.580 -0.967 -2.954 1.00 0.00 H new ATOM 0 HD12 LEU A 32 10.139 -2.379 -3.944 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.535 -0.832 -4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.011 0.918 -2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.905 1.130 -4.465 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.425 0.885 -3.508 1.00 0.00 H new ATOM 476 N LEU A 33 5.495 -2.721 -4.055 1.00 0.00 N ATOM 477 CA LEU A 33 4.489 -3.092 -3.066 1.00 0.00 C ATOM 478 C LEU A 33 4.319 -4.607 -3.006 1.00 0.00 C ATOM 479 O LEU A 33 4.388 -5.205 -1.933 1.00 0.00 O ATOM 480 CB LEU A 33 3.150 -2.430 -3.397 1.00 0.00 C ATOM 481 CG LEU A 33 3.146 -0.902 -3.425 1.00 0.00 C ATOM 482 CD1 LEU A 33 1.794 -0.380 -3.887 1.00 0.00 C ATOM 483 CD2 LEU A 33 3.496 -0.342 -2.053 1.00 0.00 C ATOM 0 H LEU A 33 5.210 -1.971 -4.685 1.00 0.00 H new ATOM 0 HA LEU A 33 4.828 -2.743 -2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.819 -2.792 -4.370 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.413 -2.762 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 33 3.903 -0.569 -4.135 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.810 0.710 -3.901 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.583 -0.752 -4.890 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.018 -0.723 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.488 0.747 -2.092 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.763 -0.684 -1.323 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.488 -0.688 -1.761 1.00 0.00 H new ATOM 495 N GLN A 34 4.099 -5.220 -4.164 1.00 0.00 N ATOM 496 CA GLN A 34 3.921 -6.665 -4.242 1.00 0.00 C ATOM 497 C GLN A 34 5.094 -7.393 -3.594 1.00 0.00 C ATOM 498 O GLN A 34 4.907 -8.367 -2.867 1.00 0.00 O ATOM 499 CB GLN A 34 3.775 -7.103 -5.700 1.00 0.00 C ATOM 500 CG GLN A 34 2.554 -6.519 -6.392 1.00 0.00 C ATOM 501 CD GLN A 34 1.263 -7.187 -5.962 1.00 0.00 C ATOM 502 OE1 GLN A 34 0.722 -6.891 -4.897 1.00 0.00 O ATOM 503 NE2 GLN A 34 0.761 -8.094 -6.793 1.00 0.00 N ATOM 0 H GLN A 34 4.040 -4.739 -5.061 1.00 0.00 H new ATOM 0 HA GLN A 34 3.012 -6.925 -3.699 1.00 0.00 H new ATOM 0 HB2 GLN A 34 4.669 -6.809 -6.250 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.719 -8.191 -5.740 1.00 0.00 H new ATOM 0 HG2 GLN A 34 2.495 -5.452 -6.177 1.00 0.00 H new ATOM 0 HG3 GLN A 34 2.669 -6.621 -7.471 1.00 0.00 H new ATOM 0 HE21 GLN A 34 1.243 -8.308 -7.666 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -0.107 -8.576 -6.558 1.00 0.00 H new ATOM 512 N ASN A 35 6.304 -6.914 -3.865 1.00 0.00 N ATOM 513 CA ASN A 35 7.508 -7.521 -3.309 1.00 0.00 C ATOM 514 C ASN A 35 7.601 -7.268 -1.807 1.00 0.00 C ATOM 515 O ASN A 35 7.562 -6.124 -1.357 1.00 0.00 O ATOM 516 CB ASN A 35 8.752 -6.969 -4.009 1.00 0.00 C ATOM 517 CG ASN A 35 9.077 -7.718 -5.287 1.00 0.00 C ATOM 518 OD1 ASN A 35 8.303 -7.701 -6.243 1.00 0.00 O ATOM 519 ND2 ASN A 35 10.228 -8.381 -5.307 1.00 0.00 N ATOM 0 H ASN A 35 6.477 -6.108 -4.466 1.00 0.00 H new ATOM 0 HA ASN A 35 7.453 -8.597 -3.475 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.599 -5.914 -4.238 1.00 0.00 H new ATOM 0 HB3 ASN A 35 9.603 -7.027 -3.331 1.00 0.00 H new ATOM 0 HD21 ASN A 35 10.501 -8.904 -6.139 1.00 0.00 H new ATOM 0 HD22 ASN A 35 10.839 -8.367 -4.490 1.00 0.00 H new ATOM 526 N ASN A 36 7.725 -8.345 -1.038 1.00 0.00 N ATOM 527 CA ASN A 36 7.824 -8.241 0.412 1.00 0.00 C ATOM 528 C ASN A 36 9.003 -7.361 0.815 1.00 0.00 C ATOM 529 O ASN A 36 8.868 -6.470 1.654 1.00 0.00 O ATOM 530 CB ASN A 36 7.974 -9.630 1.036 1.00 0.00 C ATOM 531 CG ASN A 36 8.953 -10.503 0.274 1.00 0.00 C ATOM 532 OD1 ASN A 36 8.656 -10.976 -0.823 1.00 0.00 O ATOM 533 ND2 ASN A 36 10.127 -10.721 0.855 1.00 0.00 N ATOM 0 H ASN A 36 7.759 -9.300 -1.396 1.00 0.00 H new ATOM 0 HA ASN A 36 6.907 -7.782 0.781 1.00 0.00 H new ATOM 0 HB2 ASN A 36 8.310 -9.528 2.068 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.001 -10.120 1.065 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.826 -11.301 0.391 1.00 0.00 H new ATOM 0 HD22 ASN A 36 10.330 -10.308 1.765 1.00 0.00 H new ATOM 540 N TYR A 37 10.159 -7.617 0.212 1.00 0.00 N ATOM 541 CA TYR A 37 11.362 -6.849 0.509 1.00 0.00 C ATOM 542 C TYR A 37 11.182 -5.383 0.129 1.00 0.00 C ATOM 543 O TYR A 37 11.384 -4.488 0.948 1.00 0.00 O ATOM 544 CB TYR A 37 12.563 -7.436 -0.236 1.00 0.00 C ATOM 545 CG TYR A 37 13.873 -7.269 0.502 1.00 0.00 C ATOM 546 CD1 TYR A 37 14.038 -7.768 1.788 1.00 0.00 C ATOM 547 CD2 TYR A 37 14.945 -6.610 -0.089 1.00 0.00 C ATOM 548 CE1 TYR A 37 15.233 -7.616 2.464 1.00 0.00 C ATOM 549 CE2 TYR A 37 16.144 -6.455 0.580 1.00 0.00 C ATOM 550 CZ TYR A 37 16.282 -6.960 1.857 1.00 0.00 C ATOM 551 OH TYR A 37 17.475 -6.806 2.527 1.00 0.00 O ATOM 0 H TYR A 37 10.288 -8.350 -0.485 1.00 0.00 H new ATOM 0 HA TYR A 37 11.543 -6.907 1.582 1.00 0.00 H new ATOM 0 HB2 TYR A 37 12.387 -8.497 -0.412 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.642 -6.959 -1.213 1.00 0.00 H new ATOM 0 HD1 TYR A 37 13.219 -8.283 2.267 1.00 0.00 H new ATOM 0 HD2 TYR A 37 14.839 -6.213 -1.088 1.00 0.00 H new ATOM 0 HE1 TYR A 37 15.345 -8.009 3.464 1.00 0.00 H new ATOM 0 HE2 TYR A 37 16.968 -5.942 0.107 1.00 0.00 H new ATOM 0 HH TYR A 37 18.110 -6.323 1.958 1.00 0.00 H new ATOM 561 N GLY A 38 10.797 -5.146 -1.122 1.00 0.00 N ATOM 562 CA GLY A 38 10.595 -3.788 -1.590 1.00 0.00 C ATOM 563 C GLY A 38 9.546 -3.047 -0.785 1.00 0.00 C ATOM 564 O GLY A 38 9.699 -1.860 -0.495 1.00 0.00 O ATOM 0 H GLY A 38 10.622 -5.870 -1.819 1.00 0.00 H new ATOM 0 HA2 GLY A 38 11.539 -3.245 -1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 38 10.296 -3.809 -2.638 1.00 0.00 H new ATOM 568 N LEU A 39 8.476 -3.747 -0.424 1.00 0.00 N ATOM 569 CA LEU A 39 7.395 -3.148 0.352 1.00 0.00 C ATOM 570 C LEU A 39 7.895 -2.693 1.720 1.00 0.00 C ATOM 571 O LEU A 39 7.851 -1.507 2.044 1.00 0.00 O ATOM 572 CB LEU A 39 6.249 -4.146 0.521 1.00 0.00 C ATOM 573 CG LEU A 39 5.054 -3.662 1.343 1.00 0.00 C ATOM 574 CD1 LEU A 39 4.243 -2.643 0.559 1.00 0.00 C ATOM 575 CD2 LEU A 39 4.181 -4.837 1.757 1.00 0.00 C ATOM 0 H LEU A 39 8.334 -4.730 -0.656 1.00 0.00 H new ATOM 0 HA LEU A 39 7.031 -2.275 -0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 39 5.892 -4.430 -0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 39 6.645 -5.048 0.988 1.00 0.00 H new ATOM 0 HG LEU A 39 5.430 -3.179 2.245 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.397 -2.311 1.161 1.00 0.00 H new ATOM 0 HD12 LEU A 39 4.873 -1.788 0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 39 3.877 -3.099 -0.361 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.335 -4.474 2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.814 -5.349 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 39 4.767 -5.531 2.360 1.00 0.00 H new ATOM 587 N ALA A 40 8.372 -3.643 2.516 1.00 0.00 N ATOM 588 CA ALA A 40 8.884 -3.341 3.847 1.00 0.00 C ATOM 589 C ALA A 40 9.731 -2.072 3.833 1.00 0.00 C ATOM 590 O ALA A 40 9.516 -1.162 4.633 1.00 0.00 O ATOM 591 CB ALA A 40 9.694 -4.513 4.380 1.00 0.00 C ATOM 0 H ALA A 40 8.415 -4.630 2.262 1.00 0.00 H new ATOM 0 HA ALA A 40 8.033 -3.172 4.507 1.00 0.00 H new ATOM 0 HB1 ALA A 40 10.070 -4.273 5.375 1.00 0.00 H new ATOM 0 HB2 ALA A 40 9.060 -5.398 4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 40 10.533 -4.709 3.712 1.00 0.00 H new ATOM 597 N SER A 41 10.694 -2.020 2.919 1.00 0.00 N ATOM 598 CA SER A 41 11.577 -0.865 2.804 1.00 0.00 C ATOM 599 C SER A 41 10.802 0.368 2.348 1.00 0.00 C ATOM 600 O SER A 41 10.970 1.458 2.894 1.00 0.00 O ATOM 601 CB SER A 41 12.713 -1.159 1.823 1.00 0.00 C ATOM 602 OG SER A 41 13.524 -2.225 2.286 1.00 0.00 O ATOM 0 H SER A 41 10.883 -2.764 2.247 1.00 0.00 H new ATOM 0 HA SER A 41 12.000 -0.664 3.788 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.299 -1.411 0.847 1.00 0.00 H new ATOM 0 HB3 SER A 41 13.323 -0.265 1.690 1.00 0.00 H new ATOM 0 HG SER A 41 14.242 -2.394 1.640 1.00 0.00 H new ATOM 608 N PHE A 42 9.952 0.186 1.343 1.00 0.00 N ATOM 609 CA PHE A 42 9.152 1.283 0.811 1.00 0.00 C ATOM 610 C PHE A 42 8.410 2.007 1.930 1.00 0.00 C ATOM 611 O PHE A 42 8.327 3.235 1.944 1.00 0.00 O ATOM 612 CB PHE A 42 8.152 0.759 -0.222 1.00 0.00 C ATOM 613 CG PHE A 42 7.268 1.828 -0.798 1.00 0.00 C ATOM 614 CD1 PHE A 42 7.816 2.954 -1.391 1.00 0.00 C ATOM 615 CD2 PHE A 42 5.889 1.706 -0.746 1.00 0.00 C ATOM 616 CE1 PHE A 42 7.006 3.939 -1.922 1.00 0.00 C ATOM 617 CE2 PHE A 42 5.073 2.688 -1.276 1.00 0.00 C ATOM 618 CZ PHE A 42 5.632 3.807 -1.863 1.00 0.00 C ATOM 0 H PHE A 42 9.799 -0.710 0.881 1.00 0.00 H new ATOM 0 HA PHE A 42 9.826 1.990 0.328 1.00 0.00 H new ATOM 0 HB2 PHE A 42 8.698 0.275 -1.032 1.00 0.00 H new ATOM 0 HB3 PHE A 42 7.529 -0.005 0.243 1.00 0.00 H new ATOM 0 HD1 PHE A 42 8.889 3.063 -1.439 1.00 0.00 H new ATOM 0 HD2 PHE A 42 5.447 0.834 -0.287 1.00 0.00 H new ATOM 0 HE1 PHE A 42 7.446 4.811 -2.383 1.00 0.00 H new ATOM 0 HE2 PHE A 42 3.999 2.581 -1.231 1.00 0.00 H new ATOM 0 HZ PHE A 42 4.996 4.577 -2.275 1.00 0.00 H new ATOM 628 N LYS A 43 7.870 1.236 2.869 1.00 0.00 N ATOM 629 CA LYS A 43 7.135 1.802 3.994 1.00 0.00 C ATOM 630 C LYS A 43 8.030 2.715 4.825 1.00 0.00 C ATOM 631 O LYS A 43 7.792 3.920 4.914 1.00 0.00 O ATOM 632 CB LYS A 43 6.571 0.685 4.875 1.00 0.00 C ATOM 633 CG LYS A 43 5.568 -0.205 4.161 1.00 0.00 C ATOM 634 CD LYS A 43 5.240 -1.443 4.979 1.00 0.00 C ATOM 635 CE LYS A 43 4.044 -1.208 5.889 1.00 0.00 C ATOM 636 NZ LYS A 43 3.472 -2.486 6.394 1.00 0.00 N ATOM 0 H LYS A 43 7.928 0.218 2.873 1.00 0.00 H new ATOM 0 HA LYS A 43 6.311 2.394 3.596 1.00 0.00 H new ATOM 0 HB2 LYS A 43 7.394 0.071 5.240 1.00 0.00 H new ATOM 0 HB3 LYS A 43 6.093 1.129 5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.654 0.357 3.968 1.00 0.00 H new ATOM 0 HG3 LYS A 43 5.970 -0.503 3.193 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.031 -2.278 4.310 1.00 0.00 H new ATOM 0 HD3 LYS A 43 6.106 -1.724 5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 43 4.346 -0.587 6.732 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.277 -0.656 5.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 2.659 -2.283 7.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.160 -3.068 5.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 4.196 -3.001 6.934 1.00 0.00 H new ATOM 650 N SER A 44 9.060 2.135 5.431 1.00 0.00 N ATOM 651 CA SER A 44 9.991 2.897 6.257 1.00 0.00 C ATOM 652 C SER A 44 10.305 4.246 5.617 1.00 0.00 C ATOM 653 O SER A 44 10.368 5.269 6.298 1.00 0.00 O ATOM 654 CB SER A 44 11.283 2.107 6.469 1.00 0.00 C ATOM 655 OG SER A 44 12.346 2.961 6.852 1.00 0.00 O ATOM 0 H SER A 44 9.272 1.139 5.366 1.00 0.00 H new ATOM 0 HA SER A 44 9.520 3.074 7.224 1.00 0.00 H new ATOM 0 HB2 SER A 44 11.127 1.349 7.236 1.00 0.00 H new ATOM 0 HB3 SER A 44 11.547 1.582 5.551 1.00 0.00 H new ATOM 0 HG SER A 44 13.116 2.809 6.265 1.00 0.00 H new ATOM 661 N PHE A 45 10.502 4.239 4.303 1.00 0.00 N ATOM 662 CA PHE A 45 10.812 5.461 3.570 1.00 0.00 C ATOM 663 C PHE A 45 9.719 6.507 3.770 1.00 0.00 C ATOM 664 O PHE A 45 10.003 7.674 4.041 1.00 0.00 O ATOM 665 CB PHE A 45 10.976 5.159 2.078 1.00 0.00 C ATOM 666 CG PHE A 45 10.805 6.364 1.200 1.00 0.00 C ATOM 667 CD1 PHE A 45 11.815 7.307 1.091 1.00 0.00 C ATOM 668 CD2 PHE A 45 9.635 6.556 0.483 1.00 0.00 C ATOM 669 CE1 PHE A 45 11.659 8.418 0.284 1.00 0.00 C ATOM 670 CE2 PHE A 45 9.474 7.665 -0.327 1.00 0.00 C ATOM 671 CZ PHE A 45 10.489 8.596 -0.427 1.00 0.00 C ATOM 0 H PHE A 45 10.453 3.401 3.724 1.00 0.00 H new ATOM 0 HA PHE A 45 11.749 5.860 3.959 1.00 0.00 H new ATOM 0 HB2 PHE A 45 11.965 4.733 1.908 1.00 0.00 H new ATOM 0 HB3 PHE A 45 10.249 4.401 1.787 1.00 0.00 H new ATOM 0 HD1 PHE A 45 12.734 7.172 1.643 1.00 0.00 H new ATOM 0 HD2 PHE A 45 8.839 5.830 0.558 1.00 0.00 H new ATOM 0 HE1 PHE A 45 12.452 9.147 0.210 1.00 0.00 H new ATOM 0 HE2 PHE A 45 8.557 7.803 -0.880 1.00 0.00 H new ATOM 0 HZ PHE A 45 10.368 9.462 -1.061 1.00 0.00 H new ATOM 681 N LEU A 46 8.468 6.080 3.635 1.00 0.00 N ATOM 682 CA LEU A 46 7.331 6.979 3.801 1.00 0.00 C ATOM 683 C LEU A 46 7.343 7.622 5.183 1.00 0.00 C ATOM 684 O LEU A 46 7.228 8.841 5.315 1.00 0.00 O ATOM 685 CB LEU A 46 6.021 6.220 3.590 1.00 0.00 C ATOM 686 CG LEU A 46 5.685 5.846 2.145 1.00 0.00 C ATOM 687 CD1 LEU A 46 4.415 5.013 2.090 1.00 0.00 C ATOM 688 CD2 LEU A 46 5.542 7.097 1.291 1.00 0.00 C ATOM 0 H LEU A 46 8.215 5.117 3.411 1.00 0.00 H new ATOM 0 HA LEU A 46 7.411 7.768 3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.055 5.305 4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.206 6.826 3.986 1.00 0.00 H new ATOM 0 HG LEU A 46 6.504 5.248 1.745 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.192 4.757 1.054 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.554 4.099 2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.587 5.585 2.508 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.303 6.813 0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.742 7.721 1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.478 7.655 1.304 1.00 0.00 H new ATOM 700 N LYS A 47 7.484 6.796 6.214 1.00 0.00 N ATOM 701 CA LYS A 47 7.514 7.283 7.588 1.00 0.00 C ATOM 702 C LYS A 47 8.388 8.527 7.705 1.00 0.00 C ATOM 703 O LYS A 47 7.987 9.525 8.304 1.00 0.00 O ATOM 704 CB LYS A 47 8.034 6.191 8.527 1.00 0.00 C ATOM 705 CG LYS A 47 6.956 5.230 8.998 1.00 0.00 C ATOM 706 CD LYS A 47 7.547 3.900 9.431 1.00 0.00 C ATOM 707 CE LYS A 47 8.320 4.031 10.734 1.00 0.00 C ATOM 708 NZ LYS A 47 8.737 2.704 11.268 1.00 0.00 N ATOM 0 H LYS A 47 7.579 5.784 6.124 1.00 0.00 H new ATOM 0 HA LYS A 47 6.496 7.547 7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 47 8.815 5.627 8.017 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.496 6.660 9.396 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.409 5.674 9.830 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.237 5.066 8.195 1.00 0.00 H new ATOM 0 HD2 LYS A 47 6.748 3.168 9.553 1.00 0.00 H new ATOM 0 HD3 LYS A 47 8.208 3.523 8.651 1.00 0.00 H new ATOM 0 HE2 LYS A 47 9.202 4.651 10.572 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.703 4.542 11.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.261 2.836 12.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 7.894 2.121 11.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 9.347 2.227 10.574 1.00 0.00 H new ATOM 722 N SER A 48 9.584 8.461 7.127 1.00 0.00 N ATOM 723 CA SER A 48 10.516 9.583 7.169 1.00 0.00 C ATOM 724 C SER A 48 9.962 10.778 6.400 1.00 0.00 C ATOM 725 O SER A 48 10.078 11.921 6.842 1.00 0.00 O ATOM 726 CB SER A 48 11.868 9.170 6.586 1.00 0.00 C ATOM 727 OG SER A 48 12.787 10.249 6.616 1.00 0.00 O ATOM 0 H SER A 48 9.930 7.643 6.625 1.00 0.00 H new ATOM 0 HA SER A 48 10.650 9.874 8.211 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.270 8.330 7.152 1.00 0.00 H new ATOM 0 HB3 SER A 48 11.736 8.829 5.559 1.00 0.00 H new ATOM 0 HG SER A 48 13.644 9.959 6.239 1.00 0.00 H new ATOM 733 N GLU A 49 9.358 10.505 5.248 1.00 0.00 N ATOM 734 CA GLU A 49 8.787 11.558 4.416 1.00 0.00 C ATOM 735 C GLU A 49 7.411 11.972 4.932 1.00 0.00 C ATOM 736 O GLU A 49 6.806 12.919 4.429 1.00 0.00 O ATOM 737 CB GLU A 49 8.680 11.091 2.963 1.00 0.00 C ATOM 738 CG GLU A 49 9.994 10.596 2.385 1.00 0.00 C ATOM 739 CD GLU A 49 10.924 11.729 1.995 1.00 0.00 C ATOM 740 OE1 GLU A 49 10.799 12.236 0.861 1.00 0.00 O ATOM 741 OE2 GLU A 49 11.776 12.109 2.825 1.00 0.00 O ATOM 0 H GLU A 49 9.251 9.564 4.869 1.00 0.00 H new ATOM 0 HA GLU A 49 9.450 12.422 4.463 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.941 10.292 2.900 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.311 11.915 2.352 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.491 9.958 3.116 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.792 9.979 1.509 1.00 0.00 H new ATOM 748 N PHE A 50 6.924 11.255 5.939 1.00 0.00 N ATOM 749 CA PHE A 50 5.619 11.545 6.523 1.00 0.00 C ATOM 750 C PHE A 50 4.509 11.361 5.492 1.00 0.00 C ATOM 751 O PHE A 50 3.532 12.109 5.476 1.00 0.00 O ATOM 752 CB PHE A 50 5.588 12.973 7.071 1.00 0.00 C ATOM 753 CG PHE A 50 6.046 13.078 8.498 1.00 0.00 C ATOM 754 CD1 PHE A 50 7.387 13.252 8.798 1.00 0.00 C ATOM 755 CD2 PHE A 50 5.135 13.002 9.539 1.00 0.00 C ATOM 756 CE1 PHE A 50 7.811 13.348 10.110 1.00 0.00 C ATOM 757 CE2 PHE A 50 5.553 13.098 10.853 1.00 0.00 C ATOM 758 CZ PHE A 50 6.893 13.272 11.138 1.00 0.00 C ATOM 0 H PHE A 50 7.413 10.469 6.368 1.00 0.00 H new ATOM 0 HA PHE A 50 5.451 10.845 7.341 1.00 0.00 H new ATOM 0 HB2 PHE A 50 6.219 13.607 6.448 1.00 0.00 H new ATOM 0 HB3 PHE A 50 4.572 13.361 6.994 1.00 0.00 H new ATOM 0 HD1 PHE A 50 8.110 13.313 7.998 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.086 12.866 9.321 1.00 0.00 H new ATOM 0 HE1 PHE A 50 8.860 13.482 10.331 1.00 0.00 H new ATOM 0 HE2 PHE A 50 4.833 13.037 11.656 1.00 0.00 H new ATOM 0 HZ PHE A 50 7.222 13.349 12.164 1.00 0.00 H new ATOM 768 N SER A 51 4.667 10.358 4.635 1.00 0.00 N ATOM 769 CA SER A 51 3.681 10.076 3.597 1.00 0.00 C ATOM 770 C SER A 51 3.292 8.602 3.605 1.00 0.00 C ATOM 771 O SER A 51 3.032 8.012 2.556 1.00 0.00 O ATOM 772 CB SER A 51 4.231 10.463 2.223 1.00 0.00 C ATOM 773 OG SER A 51 4.386 11.868 2.113 1.00 0.00 O ATOM 0 H SER A 51 5.468 9.727 4.638 1.00 0.00 H new ATOM 0 HA SER A 51 2.791 10.670 3.804 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.192 9.974 2.062 1.00 0.00 H new ATOM 0 HB3 SER A 51 3.557 10.106 1.444 1.00 0.00 H new ATOM 0 HG SER A 51 4.740 12.090 1.227 1.00 0.00 H new ATOM 779 N GLU A 52 3.253 8.012 4.796 1.00 0.00 N ATOM 780 CA GLU A 52 2.896 6.605 4.940 1.00 0.00 C ATOM 781 C GLU A 52 1.392 6.407 4.781 1.00 0.00 C ATOM 782 O GLU A 52 0.928 5.304 4.491 1.00 0.00 O ATOM 783 CB GLU A 52 3.350 6.078 6.303 1.00 0.00 C ATOM 784 CG GLU A 52 3.696 4.598 6.299 1.00 0.00 C ATOM 785 CD GLU A 52 4.064 4.081 7.676 1.00 0.00 C ATOM 786 OE1 GLU A 52 3.419 4.502 8.659 1.00 0.00 O ATOM 787 OE2 GLU A 52 4.995 3.257 7.771 1.00 0.00 O ATOM 0 H GLU A 52 3.464 8.486 5.674 1.00 0.00 H new ATOM 0 HA GLU A 52 3.404 6.045 4.155 1.00 0.00 H new ATOM 0 HB2 GLU A 52 4.221 6.645 6.631 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.561 6.256 7.033 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.847 4.031 5.917 1.00 0.00 H new ATOM 0 HG3 GLU A 52 4.528 4.425 5.616 1.00 0.00 H new ATOM 794 N GLU A 53 0.635 7.482 4.975 1.00 0.00 N ATOM 795 CA GLU A 53 -0.817 7.427 4.854 1.00 0.00 C ATOM 796 C GLU A 53 -1.231 6.995 3.450 1.00 0.00 C ATOM 797 O GLU A 53 -2.263 6.352 3.266 1.00 0.00 O ATOM 798 CB GLU A 53 -1.432 8.788 5.183 1.00 0.00 C ATOM 799 CG GLU A 53 -1.201 9.836 4.108 1.00 0.00 C ATOM 800 CD GLU A 53 0.097 10.596 4.303 1.00 0.00 C ATOM 801 OE1 GLU A 53 0.723 10.436 5.373 1.00 0.00 O ATOM 802 OE2 GLU A 53 0.487 11.350 3.388 1.00 0.00 O ATOM 0 H GLU A 53 1.003 8.402 5.217 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.186 6.689 5.566 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.504 8.666 5.335 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.016 9.147 6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.191 9.353 3.131 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.033 10.540 4.107 1.00 0.00 H new ATOM 809 N ASN A 54 -0.416 7.356 2.464 1.00 0.00 N ATOM 810 CA ASN A 54 -0.698 7.008 1.075 1.00 0.00 C ATOM 811 C ASN A 54 -0.749 5.495 0.894 1.00 0.00 C ATOM 812 O ASN A 54 -1.690 4.960 0.306 1.00 0.00 O ATOM 813 CB ASN A 54 0.365 7.609 0.153 1.00 0.00 C ATOM 814 CG ASN A 54 0.522 9.104 0.347 1.00 0.00 C ATOM 815 OD1 ASN A 54 -0.023 9.679 1.290 1.00 0.00 O ATOM 816 ND2 ASN A 54 1.268 9.742 -0.546 1.00 0.00 N ATOM 0 H ASN A 54 0.443 7.888 2.600 1.00 0.00 H new ATOM 0 HA ASN A 54 -1.672 7.420 0.812 1.00 0.00 H new ATOM 0 HB2 ASN A 54 1.321 7.119 0.338 1.00 0.00 H new ATOM 0 HB3 ASN A 54 0.099 7.406 -0.884 1.00 0.00 H new ATOM 0 HD21 ASN A 54 1.409 10.749 -0.467 1.00 0.00 H new ATOM 0 HD22 ASN A 54 1.701 9.225 -1.312 1.00 0.00 H new ATOM 823 N LEU A 55 0.269 4.809 1.403 1.00 0.00 N ATOM 824 CA LEU A 55 0.340 3.355 1.298 1.00 0.00 C ATOM 825 C LEU A 55 -0.769 2.695 2.109 1.00 0.00 C ATOM 826 O LEU A 55 -1.417 1.757 1.645 1.00 0.00 O ATOM 827 CB LEU A 55 1.705 2.857 1.776 1.00 0.00 C ATOM 828 CG LEU A 55 2.282 1.655 1.026 1.00 0.00 C ATOM 829 CD1 LEU A 55 3.631 1.260 1.607 1.00 0.00 C ATOM 830 CD2 LEU A 55 1.314 0.481 1.075 1.00 0.00 C ATOM 0 H LEU A 55 1.056 5.236 1.892 1.00 0.00 H new ATOM 0 HA LEU A 55 0.207 3.083 0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 55 2.416 3.680 1.703 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.625 2.597 2.832 1.00 0.00 H new ATOM 0 HG LEU A 55 2.427 1.938 -0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.026 0.403 1.061 1.00 0.00 H new ATOM 0 HD12 LEU A 55 4.324 2.097 1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.511 0.996 2.658 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.741 -0.365 0.536 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.137 0.199 2.113 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.370 0.768 0.611 1.00 0.00 H new ATOM 842 N GLU A 56 -0.984 3.194 3.323 1.00 0.00 N ATOM 843 CA GLU A 56 -2.017 2.652 4.199 1.00 0.00 C ATOM 844 C GLU A 56 -3.314 2.420 3.430 1.00 0.00 C ATOM 845 O GLU A 56 -3.828 1.303 3.381 1.00 0.00 O ATOM 846 CB GLU A 56 -2.269 3.599 5.374 1.00 0.00 C ATOM 847 CG GLU A 56 -1.180 3.557 6.434 1.00 0.00 C ATOM 848 CD GLU A 56 -1.437 2.500 7.490 1.00 0.00 C ATOM 849 OE1 GLU A 56 -2.610 2.111 7.667 1.00 0.00 O ATOM 850 OE2 GLU A 56 -0.465 2.061 8.140 1.00 0.00 O ATOM 0 H GLU A 56 -0.458 3.971 3.722 1.00 0.00 H new ATOM 0 HA GLU A 56 -1.667 1.694 4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -2.358 4.618 4.996 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -3.224 3.346 5.835 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -0.220 3.362 5.956 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -1.106 4.533 6.913 1.00 0.00 H new ATOM 857 N PHE A 57 -3.840 3.486 2.834 1.00 0.00 N ATOM 858 CA PHE A 57 -5.079 3.400 2.070 1.00 0.00 C ATOM 859 C PHE A 57 -5.034 2.231 1.089 1.00 0.00 C ATOM 860 O PHE A 57 -6.059 1.622 0.787 1.00 0.00 O ATOM 861 CB PHE A 57 -5.327 4.706 1.312 1.00 0.00 C ATOM 862 CG PHE A 57 -6.665 4.760 0.632 1.00 0.00 C ATOM 863 CD1 PHE A 57 -7.822 4.445 1.325 1.00 0.00 C ATOM 864 CD2 PHE A 57 -6.765 5.124 -0.701 1.00 0.00 C ATOM 865 CE1 PHE A 57 -9.056 4.494 0.703 1.00 0.00 C ATOM 866 CE2 PHE A 57 -7.996 5.176 -1.329 1.00 0.00 C ATOM 867 CZ PHE A 57 -9.142 4.859 -0.626 1.00 0.00 C ATOM 0 H PHE A 57 -3.428 4.418 2.866 1.00 0.00 H new ATOM 0 HA PHE A 57 -5.897 3.233 2.770 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -5.248 5.541 2.008 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.544 4.838 0.566 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -7.760 4.158 2.364 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -5.872 5.370 -1.256 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -9.951 4.247 1.255 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.061 5.464 -2.368 1.00 0.00 H new ATOM 0 HZ PHE A 57 -10.104 4.897 -1.115 1.00 0.00 H new ATOM 877 N TRP A 58 -3.839 1.926 0.597 1.00 0.00 N ATOM 878 CA TRP A 58 -3.659 0.832 -0.349 1.00 0.00 C ATOM 879 C TRP A 58 -3.754 -0.518 0.354 1.00 0.00 C ATOM 880 O TRP A 58 -4.647 -1.317 0.067 1.00 0.00 O ATOM 881 CB TRP A 58 -2.308 0.957 -1.056 1.00 0.00 C ATOM 882 CG TRP A 58 -2.170 0.048 -2.240 1.00 0.00 C ATOM 883 CD1 TRP A 58 -2.718 0.225 -3.478 1.00 0.00 C ATOM 884 CD2 TRP A 58 -1.438 -1.181 -2.295 1.00 0.00 C ATOM 885 NE1 TRP A 58 -2.370 -0.820 -4.300 1.00 0.00 N ATOM 886 CE2 TRP A 58 -1.585 -1.696 -3.598 1.00 0.00 C ATOM 887 CE3 TRP A 58 -0.671 -1.896 -1.372 1.00 0.00 C ATOM 888 CZ2 TRP A 58 -0.994 -2.892 -3.997 1.00 0.00 C ATOM 889 CZ3 TRP A 58 -0.085 -3.083 -1.769 1.00 0.00 C ATOM 890 CH2 TRP A 58 -0.249 -3.571 -3.072 1.00 0.00 C ATOM 0 H TRP A 58 -2.980 2.421 0.838 1.00 0.00 H new ATOM 0 HA TRP A 58 -4.456 0.892 -1.090 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -2.170 1.988 -1.381 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.512 0.738 -0.344 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -3.334 1.063 -3.769 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -2.651 -0.926 -5.275 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -0.538 -1.528 -0.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -1.119 -3.270 -5.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 0.509 -3.644 -1.063 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.222 -4.502 -3.352 1.00 0.00 H new ATOM 901 N ILE A 59 -2.830 -0.766 1.276 1.00 0.00 N ATOM 902 CA ILE A 59 -2.812 -2.018 2.022 1.00 0.00 C ATOM 903 C ILE A 59 -4.205 -2.377 2.527 1.00 0.00 C ATOM 904 O ILE A 59 -4.619 -3.535 2.466 1.00 0.00 O ATOM 905 CB ILE A 59 -1.846 -1.947 3.218 1.00 0.00 C ATOM 906 CG1 ILE A 59 -0.410 -1.747 2.732 1.00 0.00 C ATOM 907 CG2 ILE A 59 -1.955 -3.209 4.062 1.00 0.00 C ATOM 908 CD1 ILE A 59 0.506 -1.151 3.778 1.00 0.00 C ATOM 0 H ILE A 59 -2.084 -0.116 1.524 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.468 -2.790 1.334 1.00 0.00 H new ATOM 0 HB ILE A 59 -2.121 -1.093 3.838 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.006 -2.708 2.413 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -0.419 -1.098 1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -1.266 -3.144 4.904 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.974 -3.311 4.434 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.703 -4.077 3.453 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.507 -1.038 3.363 1.00 0.00 H new ATOM 0 HD12 ILE A 59 0.126 -0.175 4.081 1.00 0.00 H new ATOM 0 HD13 ILE A 59 0.545 -1.810 4.645 1.00 0.00 H new ATOM 920 N ALA A 60 -4.924 -1.376 3.025 1.00 0.00 N ATOM 921 CA ALA A 60 -6.272 -1.586 3.538 1.00 0.00 C ATOM 922 C ALA A 60 -7.211 -2.064 2.435 1.00 0.00 C ATOM 923 O ALA A 60 -7.938 -3.043 2.607 1.00 0.00 O ATOM 924 CB ALA A 60 -6.803 -0.306 4.167 1.00 0.00 C ATOM 0 H ALA A 60 -4.595 -0.412 3.084 1.00 0.00 H new ATOM 0 HA ALA A 60 -6.226 -2.362 4.302 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -7.811 -0.478 4.546 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.152 -0.007 4.989 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.827 0.485 3.417 1.00 0.00 H new ATOM 930 N CYS A 61 -7.190 -1.368 1.304 1.00 0.00 N ATOM 931 CA CYS A 61 -8.042 -1.721 0.174 1.00 0.00 C ATOM 932 C CYS A 61 -7.971 -3.216 -0.114 1.00 0.00 C ATOM 933 O CYS A 61 -8.994 -3.898 -0.159 1.00 0.00 O ATOM 934 CB CYS A 61 -7.628 -0.930 -1.069 1.00 0.00 C ATOM 935 SG CYS A 61 -8.105 0.814 -1.027 1.00 0.00 S ATOM 0 H CYS A 61 -6.593 -0.557 1.145 1.00 0.00 H new ATOM 0 HA CYS A 61 -9.070 -1.468 0.432 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -6.546 -0.997 -1.186 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -8.073 -1.396 -1.948 1.00 0.00 H new ATOM 0 HG CYS A 61 -7.303 1.502 -1.784 1.00 0.00 H new ATOM 941 N GLU A 62 -6.756 -3.719 -0.310 1.00 0.00 N ATOM 942 CA GLU A 62 -6.553 -5.134 -0.596 1.00 0.00 C ATOM 943 C GLU A 62 -7.155 -6.004 0.504 1.00 0.00 C ATOM 944 O GLU A 62 -7.815 -7.005 0.226 1.00 0.00 O ATOM 945 CB GLU A 62 -5.061 -5.438 -0.742 1.00 0.00 C ATOM 946 CG GLU A 62 -4.397 -4.698 -1.890 1.00 0.00 C ATOM 947 CD GLU A 62 -4.762 -5.273 -3.245 1.00 0.00 C ATOM 948 OE1 GLU A 62 -5.037 -6.490 -3.318 1.00 0.00 O ATOM 949 OE2 GLU A 62 -4.773 -4.508 -4.232 1.00 0.00 O ATOM 0 H GLU A 62 -5.898 -3.168 -0.276 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.058 -5.365 -1.534 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.554 -5.179 0.187 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.930 -6.510 -0.888 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.686 -3.648 -1.856 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.315 -4.735 -1.763 1.00 0.00 H new ATOM 956 N ASP A 63 -6.921 -5.614 1.752 1.00 0.00 N ATOM 957 CA ASP A 63 -7.441 -6.357 2.895 1.00 0.00 C ATOM 958 C ASP A 63 -8.966 -6.330 2.913 1.00 0.00 C ATOM 959 O ASP A 63 -9.603 -7.115 3.614 1.00 0.00 O ATOM 960 CB ASP A 63 -6.893 -5.776 4.199 1.00 0.00 C ATOM 961 CG ASP A 63 -7.049 -6.729 5.368 1.00 0.00 C ATOM 962 OD1 ASP A 63 -6.510 -7.852 5.293 1.00 0.00 O ATOM 963 OD2 ASP A 63 -7.712 -6.352 6.358 1.00 0.00 O ATOM 0 H ASP A 63 -6.375 -4.788 1.998 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.115 -7.393 2.802 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.838 -5.533 4.070 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.410 -4.843 4.423 1.00 0.00 H new ATOM 968 N TYR A 64 -9.545 -5.421 2.136 1.00 0.00 N ATOM 969 CA TYR A 64 -10.996 -5.290 2.065 1.00 0.00 C ATOM 970 C TYR A 64 -11.568 -6.162 0.953 1.00 0.00 C ATOM 971 O TYR A 64 -12.698 -6.643 1.043 1.00 0.00 O ATOM 972 CB TYR A 64 -11.386 -3.829 1.835 1.00 0.00 C ATOM 973 CG TYR A 64 -12.813 -3.648 1.371 1.00 0.00 C ATOM 974 CD1 TYR A 64 -13.210 -4.061 0.104 1.00 0.00 C ATOM 975 CD2 TYR A 64 -13.765 -3.065 2.198 1.00 0.00 C ATOM 976 CE1 TYR A 64 -14.513 -3.897 -0.325 1.00 0.00 C ATOM 977 CE2 TYR A 64 -15.071 -2.900 1.778 1.00 0.00 C ATOM 978 CZ TYR A 64 -15.440 -3.317 0.516 1.00 0.00 C ATOM 979 OH TYR A 64 -16.739 -3.153 0.093 1.00 0.00 O ATOM 0 H TYR A 64 -9.033 -4.765 1.547 1.00 0.00 H new ATOM 0 HA TYR A 64 -11.413 -5.625 3.015 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -11.241 -3.273 2.761 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.714 -3.395 1.094 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -12.487 -4.518 -0.556 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -13.479 -2.735 3.186 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -14.804 -4.221 -1.313 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -15.799 -2.447 2.434 1.00 0.00 H new ATOM 0 HH TYR A 64 -17.352 -3.402 0.816 1.00 0.00 H new ATOM 989 N LYS A 65 -10.780 -6.362 -0.098 1.00 0.00 N ATOM 990 CA LYS A 65 -11.205 -7.177 -1.230 1.00 0.00 C ATOM 991 C LYS A 65 -11.377 -8.635 -0.816 1.00 0.00 C ATOM 992 O LYS A 65 -12.228 -9.346 -1.349 1.00 0.00 O ATOM 993 CB LYS A 65 -10.187 -7.076 -2.368 1.00 0.00 C ATOM 994 CG LYS A 65 -9.803 -5.648 -2.717 1.00 0.00 C ATOM 995 CD LYS A 65 -10.703 -5.078 -3.800 1.00 0.00 C ATOM 996 CE LYS A 65 -10.100 -3.831 -4.427 1.00 0.00 C ATOM 997 NZ LYS A 65 -10.665 -3.561 -5.778 1.00 0.00 N ATOM 0 H LYS A 65 -9.843 -5.970 -0.189 1.00 0.00 H new ATOM 0 HA LYS A 65 -12.167 -6.800 -1.577 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -9.289 -7.627 -2.090 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -10.597 -7.560 -3.255 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -9.866 -5.025 -1.825 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -8.766 -5.621 -3.052 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -10.868 -5.831 -4.571 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -11.678 -4.838 -3.375 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.283 -2.974 -3.779 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -9.019 -3.949 -4.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -10.346 -2.628 -6.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -10.340 -4.292 -6.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -11.704 -3.575 -5.729 1.00 0.00 H new ATOM 1011 N LYS A 66 -10.565 -9.074 0.141 1.00 0.00 N ATOM 1012 CA LYS A 66 -10.628 -10.446 0.628 1.00 0.00 C ATOM 1013 C LYS A 66 -11.737 -10.604 1.664 1.00 0.00 C ATOM 1014 O LYS A 66 -11.758 -11.575 2.422 1.00 0.00 O ATOM 1015 CB LYS A 66 -9.285 -10.856 1.237 1.00 0.00 C ATOM 1016 CG LYS A 66 -8.891 -10.031 2.450 1.00 0.00 C ATOM 1017 CD LYS A 66 -7.538 -10.455 2.997 1.00 0.00 C ATOM 1018 CE LYS A 66 -6.404 -10.019 2.084 1.00 0.00 C ATOM 1019 NZ LYS A 66 -5.249 -10.955 2.146 1.00 0.00 N ATOM 0 H LYS A 66 -9.855 -8.498 0.594 1.00 0.00 H new ATOM 0 HA LYS A 66 -10.849 -11.096 -0.219 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.330 -11.907 1.522 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -8.508 -10.765 0.478 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.860 -8.976 2.179 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -9.648 -10.139 3.226 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -7.394 -10.024 3.988 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -7.516 -11.538 3.114 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -6.767 -9.958 1.058 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -6.076 -9.018 2.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.497 -10.622 1.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.886 -10.994 3.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -5.556 -11.905 1.853 1.00 0.00 H new ATOM 1033 N ILE A 67 -12.658 -9.646 1.690 1.00 0.00 N ATOM 1034 CA ILE A 67 -13.770 -9.681 2.631 1.00 0.00 C ATOM 1035 C ILE A 67 -15.000 -10.329 2.004 1.00 0.00 C ATOM 1036 O ILE A 67 -15.540 -9.835 1.014 1.00 0.00 O ATOM 1037 CB ILE A 67 -14.140 -8.267 3.117 1.00 0.00 C ATOM 1038 CG1 ILE A 67 -12.956 -7.629 3.847 1.00 0.00 C ATOM 1039 CG2 ILE A 67 -15.361 -8.322 4.024 1.00 0.00 C ATOM 1040 CD1 ILE A 67 -13.295 -6.313 4.512 1.00 0.00 C ATOM 0 H ILE A 67 -12.656 -8.836 1.070 1.00 0.00 H new ATOM 0 HA ILE A 67 -13.444 -10.276 3.484 1.00 0.00 H new ATOM 0 HB ILE A 67 -14.382 -7.652 2.250 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -12.587 -8.324 4.602 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -12.145 -7.470 3.137 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -15.611 -7.315 4.360 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -16.204 -8.741 3.474 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -15.144 -8.949 4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -12.409 -5.918 5.010 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -13.635 -5.602 3.759 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -14.085 -6.469 5.247 1.00 0.00 H new ATOM 1052 N LYS A 68 -15.438 -11.439 2.588 1.00 0.00 N ATOM 1053 CA LYS A 68 -16.607 -12.155 2.089 1.00 0.00 C ATOM 1054 C LYS A 68 -17.856 -11.771 2.876 1.00 0.00 C ATOM 1055 O LYS A 68 -18.955 -11.713 2.324 1.00 0.00 O ATOM 1056 CB LYS A 68 -16.381 -13.666 2.177 1.00 0.00 C ATOM 1057 CG LYS A 68 -16.345 -14.194 3.601 1.00 0.00 C ATOM 1058 CD LYS A 68 -17.726 -14.618 4.073 1.00 0.00 C ATOM 1059 CE LYS A 68 -17.994 -16.083 3.768 1.00 0.00 C ATOM 1060 NZ LYS A 68 -18.260 -16.309 2.321 1.00 0.00 N ATOM 0 H LYS A 68 -15.002 -11.863 3.407 1.00 0.00 H new ATOM 0 HA LYS A 68 -16.755 -11.876 1.046 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -17.174 -14.176 1.629 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -15.442 -13.914 1.683 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -15.663 -15.043 3.658 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -15.953 -13.424 4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.813 -14.447 5.146 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -18.483 -14.000 3.589 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -17.137 -16.681 4.077 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.848 -16.425 4.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -18.728 -17.229 2.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -18.877 -15.554 1.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.361 -16.303 1.798 1.00 0.00 H new ATOM 1074 N SER A 69 -17.681 -11.510 4.167 1.00 0.00 N ATOM 1075 CA SER A 69 -18.794 -11.133 5.030 1.00 0.00 C ATOM 1076 C SER A 69 -19.646 -10.049 4.376 1.00 0.00 C ATOM 1077 O SER A 69 -19.138 -9.060 3.846 1.00 0.00 O ATOM 1078 CB SER A 69 -18.276 -10.644 6.383 1.00 0.00 C ATOM 1079 OG SER A 69 -18.082 -11.726 7.277 1.00 0.00 O ATOM 0 H SER A 69 -16.778 -11.553 4.639 1.00 0.00 H new ATOM 0 HA SER A 69 -19.416 -12.015 5.185 1.00 0.00 H new ATOM 0 HB2 SER A 69 -17.336 -10.110 6.244 1.00 0.00 H new ATOM 0 HB3 SER A 69 -18.985 -9.936 6.813 1.00 0.00 H new ATOM 0 HG SER A 69 -17.749 -11.387 8.134 1.00 0.00 H new ATOM 1085 N PRO A 70 -20.973 -10.238 4.413 1.00 0.00 N ATOM 1086 CA PRO A 70 -21.924 -9.287 3.830 1.00 0.00 C ATOM 1087 C PRO A 70 -21.990 -7.980 4.610 1.00 0.00 C ATOM 1088 O PRO A 70 -22.304 -6.929 4.053 1.00 0.00 O ATOM 1089 CB PRO A 70 -23.262 -10.028 3.912 1.00 0.00 C ATOM 1090 CG PRO A 70 -23.095 -10.985 5.041 1.00 0.00 C ATOM 1091 CD PRO A 70 -21.647 -11.394 5.028 1.00 0.00 C ATOM 0 HA PRO A 70 -21.642 -8.998 2.817 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -24.086 -9.339 4.096 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -23.484 -10.549 2.981 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -23.360 -10.519 5.990 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -23.746 -11.851 4.918 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -21.275 -11.588 6.034 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -21.492 -12.305 4.450 1.00 0.00 H new ATOM 1099 N ALA A 71 -21.692 -8.052 5.903 1.00 0.00 N ATOM 1100 CA ALA A 71 -21.715 -6.873 6.760 1.00 0.00 C ATOM 1101 C ALA A 71 -20.377 -6.143 6.725 1.00 0.00 C ATOM 1102 O ALA A 71 -20.329 -4.916 6.654 1.00 0.00 O ATOM 1103 CB ALA A 71 -22.067 -7.265 8.187 1.00 0.00 C ATOM 0 H ALA A 71 -21.432 -8.915 6.380 1.00 0.00 H new ATOM 0 HA ALA A 71 -22.480 -6.194 6.382 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -22.081 -6.375 8.816 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -23.050 -7.736 8.203 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -21.323 -7.966 8.566 1.00 0.00 H new ATOM 1109 N LYS A 72 -19.290 -6.906 6.776 1.00 0.00 N ATOM 1110 CA LYS A 72 -17.950 -6.333 6.749 1.00 0.00 C ATOM 1111 C LYS A 72 -17.700 -5.594 5.438 1.00 0.00 C ATOM 1112 O LYS A 72 -17.284 -4.436 5.438 1.00 0.00 O ATOM 1113 CB LYS A 72 -16.899 -7.430 6.936 1.00 0.00 C ATOM 1114 CG LYS A 72 -15.623 -6.943 7.600 1.00 0.00 C ATOM 1115 CD LYS A 72 -15.715 -7.028 9.115 1.00 0.00 C ATOM 1116 CE LYS A 72 -14.883 -5.945 9.785 1.00 0.00 C ATOM 1117 NZ LYS A 72 -14.379 -6.377 11.117 1.00 0.00 N ATOM 0 H LYS A 72 -19.312 -7.924 6.836 1.00 0.00 H new ATOM 0 HA LYS A 72 -17.871 -5.619 7.569 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -17.327 -8.233 7.536 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -16.653 -7.855 5.963 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -14.780 -7.540 7.252 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -15.428 -5.912 7.304 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -16.756 -6.932 9.423 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -15.374 -8.008 9.447 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -14.040 -5.686 9.144 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -15.485 -5.043 9.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -13.817 -5.611 11.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -15.184 -6.600 11.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -13.784 -7.222 11.005 1.00 0.00 H new ATOM 1131 N MET A 73 -17.957 -6.271 4.324 1.00 0.00 N ATOM 1132 CA MET A 73 -17.762 -5.677 3.007 1.00 0.00 C ATOM 1133 C MET A 73 -18.317 -4.256 2.964 1.00 0.00 C ATOM 1134 O MET A 73 -17.762 -3.384 2.297 1.00 0.00 O ATOM 1135 CB MET A 73 -18.437 -6.533 1.933 1.00 0.00 C ATOM 1136 CG MET A 73 -17.516 -7.576 1.321 1.00 0.00 C ATOM 1137 SD MET A 73 -18.399 -9.057 0.792 1.00 0.00 S ATOM 1138 CE MET A 73 -19.462 -8.380 -0.481 1.00 0.00 C ATOM 0 H MET A 73 -18.301 -7.231 4.307 1.00 0.00 H new ATOM 0 HA MET A 73 -16.691 -5.636 2.809 1.00 0.00 H new ATOM 0 HB2 MET A 73 -19.301 -7.034 2.369 1.00 0.00 H new ATOM 0 HB3 MET A 73 -18.811 -5.882 1.143 1.00 0.00 H new ATOM 0 HG2 MET A 73 -16.999 -7.141 0.466 1.00 0.00 H new ATOM 0 HG3 MET A 73 -16.753 -7.853 2.048 1.00 0.00 H new ATOM 0 HE1 MET A 73 -20.021 -9.187 -0.955 1.00 0.00 H new ATOM 0 HE2 MET A 73 -20.158 -7.670 -0.034 1.00 0.00 H new ATOM 0 HE3 MET A 73 -18.855 -7.871 -1.230 1.00 0.00 H new ATOM 1148 N ALA A 74 -19.414 -4.033 3.680 1.00 0.00 N ATOM 1149 CA ALA A 74 -20.042 -2.717 3.724 1.00 0.00 C ATOM 1150 C ALA A 74 -19.482 -1.880 4.870 1.00 0.00 C ATOM 1151 O ALA A 74 -18.886 -0.828 4.648 1.00 0.00 O ATOM 1152 CB ALA A 74 -21.550 -2.858 3.857 1.00 0.00 C ATOM 0 H ALA A 74 -19.886 -4.745 4.237 1.00 0.00 H new ATOM 0 HA ALA A 74 -19.818 -2.202 2.790 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -22.007 -1.869 3.889 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -21.941 -3.411 3.002 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -21.786 -3.396 4.775 1.00 0.00 H new ATOM 1158 N GLU A 75 -19.681 -2.357 6.096 1.00 0.00 N ATOM 1159 CA GLU A 75 -19.197 -1.649 7.276 1.00 0.00 C ATOM 1160 C GLU A 75 -17.731 -1.262 7.114 1.00 0.00 C ATOM 1161 O GLU A 75 -17.380 -0.081 7.157 1.00 0.00 O ATOM 1162 CB GLU A 75 -19.372 -2.517 8.523 1.00 0.00 C ATOM 1163 CG GLU A 75 -20.794 -3.012 8.727 1.00 0.00 C ATOM 1164 CD GLU A 75 -21.630 -2.059 9.559 1.00 0.00 C ATOM 1165 OE1 GLU A 75 -22.094 -1.040 9.007 1.00 0.00 O ATOM 1166 OE2 GLU A 75 -21.819 -2.332 10.763 1.00 0.00 O ATOM 0 H GLU A 75 -20.172 -3.228 6.297 1.00 0.00 H new ATOM 0 HA GLU A 75 -19.784 -0.738 7.390 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -18.704 -3.376 8.454 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -19.066 -1.945 9.399 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -21.269 -3.153 7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -20.769 -3.987 9.214 1.00 0.00 H new ATOM 1173 N LYS A 76 -16.876 -2.262 6.929 1.00 0.00 N ATOM 1174 CA LYS A 76 -15.447 -2.028 6.760 1.00 0.00 C ATOM 1175 C LYS A 76 -15.195 -0.882 5.786 1.00 0.00 C ATOM 1176 O LYS A 76 -14.383 0.004 6.051 1.00 0.00 O ATOM 1177 CB LYS A 76 -14.757 -3.299 6.260 1.00 0.00 C ATOM 1178 CG LYS A 76 -13.285 -3.105 5.936 1.00 0.00 C ATOM 1179 CD LYS A 76 -12.501 -2.651 7.157 1.00 0.00 C ATOM 1180 CE LYS A 76 -11.124 -2.132 6.773 1.00 0.00 C ATOM 1181 NZ LYS A 76 -10.501 -1.345 7.874 1.00 0.00 N ATOM 0 H LYS A 76 -17.149 -3.244 6.892 1.00 0.00 H new ATOM 0 HA LYS A 76 -15.031 -1.754 7.730 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -14.854 -4.077 7.017 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -15.273 -3.656 5.368 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -12.868 -4.040 5.561 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.181 -2.367 5.140 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -13.054 -1.868 7.676 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.396 -3.483 7.854 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.478 -2.972 6.516 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.206 -1.509 5.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.564 -1.009 7.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.105 -0.529 8.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.399 -1.947 8.716 1.00 0.00 H new ATOM 1195 N ALA A 77 -15.897 -0.906 4.657 1.00 0.00 N ATOM 1196 CA ALA A 77 -15.752 0.133 3.645 1.00 0.00 C ATOM 1197 C ALA A 77 -15.801 1.522 4.273 1.00 0.00 C ATOM 1198 O ALA A 77 -14.938 2.362 4.016 1.00 0.00 O ATOM 1199 CB ALA A 77 -16.834 -0.008 2.585 1.00 0.00 C ATOM 0 H ALA A 77 -16.572 -1.634 4.421 1.00 0.00 H new ATOM 0 HA ALA A 77 -14.778 0.011 3.172 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -16.713 0.774 1.836 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -16.750 -0.984 2.107 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -17.815 0.084 3.052 1.00 0.00 H new ATOM 1205 N LYS A 78 -16.816 1.759 5.097 1.00 0.00 N ATOM 1206 CA LYS A 78 -16.978 3.046 5.763 1.00 0.00 C ATOM 1207 C LYS A 78 -15.784 3.347 6.663 1.00 0.00 C ATOM 1208 O LYS A 78 -15.321 4.484 6.734 1.00 0.00 O ATOM 1209 CB LYS A 78 -18.268 3.057 6.587 1.00 0.00 C ATOM 1210 CG LYS A 78 -18.060 2.693 8.046 1.00 0.00 C ATOM 1211 CD LYS A 78 -19.359 2.253 8.702 1.00 0.00 C ATOM 1212 CE LYS A 78 -19.106 1.558 10.030 1.00 0.00 C ATOM 1213 NZ LYS A 78 -20.285 1.647 10.937 1.00 0.00 N ATOM 0 H LYS A 78 -17.540 1.076 5.320 1.00 0.00 H new ATOM 0 HA LYS A 78 -17.036 3.819 4.997 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -18.718 4.048 6.529 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -18.978 2.358 6.144 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -17.324 1.892 8.121 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -17.653 3.551 8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -20.000 3.121 8.861 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -19.895 1.579 8.034 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -18.864 0.510 9.851 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -18.240 2.007 10.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -20.072 1.161 11.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -20.501 2.646 11.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -21.106 1.196 10.485 1.00 0.00 H new ATOM 1227 N GLN A 79 -15.292 2.320 7.349 1.00 0.00 N ATOM 1228 CA GLN A 79 -14.152 2.476 8.244 1.00 0.00 C ATOM 1229 C GLN A 79 -12.977 3.127 7.520 1.00 0.00 C ATOM 1230 O GLN A 79 -12.396 4.097 8.009 1.00 0.00 O ATOM 1231 CB GLN A 79 -13.729 1.118 8.808 1.00 0.00 C ATOM 1232 CG GLN A 79 -14.809 0.441 9.637 1.00 0.00 C ATOM 1233 CD GLN A 79 -14.239 -0.471 10.705 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -14.061 -0.066 11.854 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -13.949 -1.712 10.330 1.00 0.00 N ATOM 0 H GLN A 79 -15.665 1.372 7.302 1.00 0.00 H new ATOM 0 HA GLN A 79 -14.454 3.125 9.066 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -13.451 0.462 7.983 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -12.839 1.251 9.424 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -15.430 1.202 10.109 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -15.458 -0.137 8.979 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -14.113 -2.005 9.367 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -13.563 -2.372 11.005 1.00 0.00 H new ATOM 1244 N ILE A 80 -12.634 2.587 6.356 1.00 0.00 N ATOM 1245 CA ILE A 80 -11.529 3.116 5.566 1.00 0.00 C ATOM 1246 C ILE A 80 -11.790 4.562 5.155 1.00 0.00 C ATOM 1247 O ILE A 80 -10.858 5.348 4.985 1.00 0.00 O ATOM 1248 CB ILE A 80 -11.285 2.271 4.302 1.00 0.00 C ATOM 1249 CG1 ILE A 80 -11.067 0.804 4.677 1.00 0.00 C ATOM 1250 CG2 ILE A 80 -10.090 2.808 3.528 1.00 0.00 C ATOM 1251 CD1 ILE A 80 -11.233 -0.149 3.514 1.00 0.00 C ATOM 0 H ILE A 80 -13.105 1.784 5.939 1.00 0.00 H new ATOM 0 HA ILE A 80 -10.641 3.074 6.197 1.00 0.00 H new ATOM 0 HB ILE A 80 -12.166 2.337 3.664 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -10.065 0.688 5.091 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.770 0.530 5.464 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.930 2.200 2.637 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -10.281 3.840 3.234 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -9.201 2.769 4.158 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.064 -1.171 3.854 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -12.243 -0.062 3.114 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.512 0.098 2.735 1.00 0.00 H new ATOM 1263 N TYR A 81 -13.063 4.906 4.999 1.00 0.00 N ATOM 1264 CA TYR A 81 -13.447 6.256 4.607 1.00 0.00 C ATOM 1265 C TYR A 81 -13.358 7.213 5.792 1.00 0.00 C ATOM 1266 O TYR A 81 -12.820 8.314 5.675 1.00 0.00 O ATOM 1267 CB TYR A 81 -14.868 6.261 4.039 1.00 0.00 C ATOM 1268 CG TYR A 81 -15.480 7.640 3.949 1.00 0.00 C ATOM 1269 CD1 TYR A 81 -15.748 8.378 5.095 1.00 0.00 C ATOM 1270 CD2 TYR A 81 -15.790 8.205 2.718 1.00 0.00 C ATOM 1271 CE1 TYR A 81 -16.308 9.640 5.017 1.00 0.00 C ATOM 1272 CE2 TYR A 81 -16.347 9.466 2.631 1.00 0.00 C ATOM 1273 CZ TYR A 81 -16.605 10.179 3.783 1.00 0.00 C ATOM 1274 OH TYR A 81 -17.163 11.434 3.701 1.00 0.00 O ATOM 0 H TYR A 81 -13.847 4.268 5.138 1.00 0.00 H new ATOM 0 HA TYR A 81 -12.754 6.594 3.837 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -14.854 5.813 3.045 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -15.502 5.632 4.664 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -15.515 7.959 6.063 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -15.592 7.649 1.814 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -16.512 10.200 5.918 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -16.579 9.891 1.666 1.00 0.00 H new ATOM 0 HH TYR A 81 -16.886 11.861 2.863 1.00 0.00 H new ATOM 1284 N GLU A 82 -13.890 6.783 6.932 1.00 0.00 N ATOM 1285 CA GLU A 82 -13.870 7.602 8.139 1.00 0.00 C ATOM 1286 C GLU A 82 -12.442 7.803 8.637 1.00 0.00 C ATOM 1287 O GLU A 82 -12.199 8.588 9.553 1.00 0.00 O ATOM 1288 CB GLU A 82 -14.719 6.954 9.235 1.00 0.00 C ATOM 1289 CG GLU A 82 -16.138 6.633 8.796 1.00 0.00 C ATOM 1290 CD GLU A 82 -17.137 6.732 9.933 1.00 0.00 C ATOM 1291 OE1 GLU A 82 -17.436 7.867 10.361 1.00 0.00 O ATOM 1292 OE2 GLU A 82 -17.619 5.677 10.394 1.00 0.00 O ATOM 0 H GLU A 82 -14.339 5.874 7.045 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.290 8.577 7.893 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -14.233 6.036 9.564 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.756 7.621 10.096 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -16.431 7.317 7.999 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -16.166 5.626 8.379 1.00 0.00 H new ATOM 1299 N GLU A 83 -11.503 7.086 8.028 1.00 0.00 N ATOM 1300 CA GLU A 83 -10.100 7.184 8.412 1.00 0.00 C ATOM 1301 C GLU A 83 -9.313 7.998 7.389 1.00 0.00 C ATOM 1302 O GLU A 83 -8.618 8.952 7.741 1.00 0.00 O ATOM 1303 CB GLU A 83 -9.487 5.789 8.550 1.00 0.00 C ATOM 1304 CG GLU A 83 -8.008 5.805 8.896 1.00 0.00 C ATOM 1305 CD GLU A 83 -7.567 4.554 9.631 1.00 0.00 C ATOM 1306 OE1 GLU A 83 -7.860 3.443 9.142 1.00 0.00 O ATOM 1307 OE2 GLU A 83 -6.927 4.686 10.695 1.00 0.00 O ATOM 0 H GLU A 83 -11.688 6.432 7.268 1.00 0.00 H new ATOM 0 HA GLU A 83 -10.048 7.692 9.375 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.026 5.239 9.322 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.627 5.246 7.615 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.426 5.908 7.980 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.792 6.678 9.511 1.00 0.00 H new ATOM 1314 N PHE A 84 -9.426 7.615 6.123 1.00 0.00 N ATOM 1315 CA PHE A 84 -8.723 8.308 5.048 1.00 0.00 C ATOM 1316 C PHE A 84 -9.668 9.239 4.293 1.00 0.00 C ATOM 1317 O PHE A 84 -9.392 10.430 4.142 1.00 0.00 O ATOM 1318 CB PHE A 84 -8.104 7.297 4.081 1.00 0.00 C ATOM 1319 CG PHE A 84 -7.238 6.272 4.756 1.00 0.00 C ATOM 1320 CD1 PHE A 84 -5.935 6.575 5.115 1.00 0.00 C ATOM 1321 CD2 PHE A 84 -7.730 5.006 5.034 1.00 0.00 C ATOM 1322 CE1 PHE A 84 -5.137 5.634 5.738 1.00 0.00 C ATOM 1323 CE2 PHE A 84 -6.936 4.062 5.656 1.00 0.00 C ATOM 1324 CZ PHE A 84 -5.638 4.375 6.008 1.00 0.00 C ATOM 0 H PHE A 84 -9.998 6.828 5.815 1.00 0.00 H new ATOM 0 HA PHE A 84 -7.929 8.908 5.493 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -8.902 6.787 3.541 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.509 7.832 3.341 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -5.538 7.557 4.906 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -8.745 4.755 4.761 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.123 5.883 6.013 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.331 3.079 5.867 1.00 0.00 H new ATOM 0 HZ PHE A 84 -5.016 3.637 6.493 1.00 0.00 H new ATOM 1334 N ILE A 85 -10.780 8.687 3.821 1.00 0.00 N ATOM 1335 CA ILE A 85 -11.765 9.467 3.083 1.00 0.00 C ATOM 1336 C ILE A 85 -12.640 10.285 4.028 1.00 0.00 C ATOM 1337 O ILE A 85 -13.783 10.607 3.708 1.00 0.00 O ATOM 1338 CB ILE A 85 -12.667 8.565 2.219 1.00 0.00 C ATOM 1339 CG1 ILE A 85 -11.844 7.437 1.591 1.00 0.00 C ATOM 1340 CG2 ILE A 85 -13.361 9.385 1.143 1.00 0.00 C ATOM 1341 CD1 ILE A 85 -11.272 7.790 0.236 1.00 0.00 C ATOM 0 H ILE A 85 -11.021 7.703 3.936 1.00 0.00 H new ATOM 0 HA ILE A 85 -11.208 10.141 2.432 1.00 0.00 H new ATOM 0 HB ILE A 85 -13.431 8.120 2.857 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -11.028 7.175 2.264 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -12.472 6.551 1.492 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -13.995 8.734 0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -13.974 10.155 1.611 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -12.613 9.855 0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -10.701 6.945 -0.149 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -12.084 8.023 -0.452 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.618 8.657 0.332 1.00 0.00 H new ATOM 1353 N GLN A 86 -12.092 10.618 5.192 1.00 0.00 N ATOM 1354 CA GLN A 86 -12.822 11.401 6.183 1.00 0.00 C ATOM 1355 C GLN A 86 -12.323 12.841 6.216 1.00 0.00 C ATOM 1356 O GLN A 86 -11.146 13.108 5.971 1.00 0.00 O ATOM 1357 CB GLN A 86 -12.681 10.767 7.567 1.00 0.00 C ATOM 1358 CG GLN A 86 -12.320 11.763 8.659 1.00 0.00 C ATOM 1359 CD GLN A 86 -12.609 11.234 10.049 1.00 0.00 C ATOM 1360 OE1 GLN A 86 -11.733 11.227 10.916 1.00 0.00 O ATOM 1361 NE2 GLN A 86 -13.840 10.790 10.271 1.00 0.00 N ATOM 0 H GLN A 86 -11.146 10.358 5.472 1.00 0.00 H new ATOM 0 HA GLN A 86 -13.875 11.409 5.900 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -13.618 10.276 7.830 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -11.916 9.992 7.526 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -11.262 12.013 8.582 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -12.878 12.686 8.502 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -14.534 10.815 9.524 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -14.092 10.424 11.189 1.00 0.00 H new ATOM 1370 N THR A 87 -13.226 13.769 6.520 1.00 0.00 N ATOM 1371 CA THR A 87 -12.877 15.182 6.583 1.00 0.00 C ATOM 1372 C THR A 87 -11.715 15.420 7.541 1.00 0.00 C ATOM 1373 O THR A 87 -11.780 15.050 8.713 1.00 0.00 O ATOM 1374 CB THR A 87 -14.078 16.037 7.031 1.00 0.00 C ATOM 1375 OG1 THR A 87 -15.072 16.065 5.999 1.00 0.00 O ATOM 1376 CG2 THR A 87 -13.641 17.456 7.358 1.00 0.00 C ATOM 0 H THR A 87 -14.204 13.566 6.726 1.00 0.00 H new ATOM 0 HA THR A 87 -12.582 15.479 5.577 1.00 0.00 H new ATOM 0 HB THR A 87 -14.500 15.587 7.930 1.00 0.00 H new ATOM 0 HG1 THR A 87 -15.833 16.609 6.292 1.00 0.00 H new ATOM 0 HG21 THR A 87 -14.506 18.040 7.672 1.00 0.00 H new ATOM 0 HG22 THR A 87 -12.907 17.434 8.163 1.00 0.00 H new ATOM 0 HG23 THR A 87 -13.196 17.913 6.474 1.00 0.00 H new ATOM 1384 N GLU A 88 -10.654 16.039 7.034 1.00 0.00 N ATOM 1385 CA GLU A 88 -9.477 16.325 7.846 1.00 0.00 C ATOM 1386 C GLU A 88 -9.042 15.089 8.628 1.00 0.00 C ATOM 1387 O GLU A 88 -8.545 15.194 9.748 1.00 0.00 O ATOM 1388 CB GLU A 88 -9.763 17.478 8.810 1.00 0.00 C ATOM 1389 CG GLU A 88 -10.380 18.694 8.138 1.00 0.00 C ATOM 1390 CD GLU A 88 -10.275 19.945 8.988 1.00 0.00 C ATOM 1391 OE1 GLU A 88 -9.276 20.078 9.725 1.00 0.00 O ATOM 1392 OE2 GLU A 88 -11.191 20.790 8.916 1.00 0.00 O ATOM 0 H GLU A 88 -10.585 16.352 6.066 1.00 0.00 H new ATOM 0 HA GLU A 88 -8.667 16.614 7.177 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.434 17.127 9.594 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -8.833 17.774 9.295 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -9.886 18.866 7.182 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.429 18.492 7.923 1.00 0.00 H new ATOM 1399 N ALA A 89 -9.233 13.918 8.028 1.00 0.00 N ATOM 1400 CA ALA A 89 -8.860 12.662 8.667 1.00 0.00 C ATOM 1401 C ALA A 89 -7.403 12.687 9.118 1.00 0.00 C ATOM 1402 O ALA A 89 -6.609 13.522 8.684 1.00 0.00 O ATOM 1403 CB ALA A 89 -9.101 11.497 7.720 1.00 0.00 C ATOM 0 H ALA A 89 -9.644 13.813 7.100 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.484 12.533 9.551 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.818 10.565 8.210 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.157 11.459 7.451 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.501 11.630 6.820 1.00 0.00 H new ATOM 1409 N PRO A 90 -7.044 11.753 10.010 1.00 0.00 N ATOM 1410 CA PRO A 90 -5.681 11.647 10.539 1.00 0.00 C ATOM 1411 C PRO A 90 -4.685 11.168 9.488 1.00 0.00 C ATOM 1412 O PRO A 90 -3.520 11.563 9.495 1.00 0.00 O ATOM 1413 CB PRO A 90 -5.814 10.613 11.659 1.00 0.00 C ATOM 1414 CG PRO A 90 -6.998 9.792 11.278 1.00 0.00 C ATOM 1415 CD PRO A 90 -7.939 10.726 10.570 1.00 0.00 C ATOM 0 HA PRO A 90 -5.299 12.611 10.873 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.917 10.000 11.740 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.960 11.094 12.626 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.707 8.965 10.630 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.470 9.356 12.158 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.501 10.214 9.789 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.667 11.159 11.256 1.00 0.00 H new ATOM 1423 N LYS A 91 -5.153 10.313 8.584 1.00 0.00 N ATOM 1424 CA LYS A 91 -4.306 9.780 7.523 1.00 0.00 C ATOM 1425 C LYS A 91 -4.882 10.107 6.150 1.00 0.00 C ATOM 1426 O LYS A 91 -4.516 9.490 5.151 1.00 0.00 O ATOM 1427 CB LYS A 91 -4.154 8.266 7.677 1.00 0.00 C ATOM 1428 CG LYS A 91 -3.750 7.833 9.076 1.00 0.00 C ATOM 1429 CD LYS A 91 -2.919 6.562 9.049 1.00 0.00 C ATOM 1430 CE LYS A 91 -1.449 6.862 8.798 1.00 0.00 C ATOM 1431 NZ LYS A 91 -0.718 7.149 10.063 1.00 0.00 N ATOM 0 H LYS A 91 -6.115 9.974 8.565 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.325 10.248 7.606 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -5.097 7.786 7.416 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -3.408 7.910 6.966 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -3.181 8.630 9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -4.643 7.672 9.680 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -3.027 6.035 9.997 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -3.294 5.897 8.271 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.986 6.013 8.295 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -1.362 7.716 8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.280 7.348 9.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.144 7.975 10.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -0.779 6.324 10.694 1.00 0.00 H new ATOM 1445 N GLU A 92 -5.785 11.083 6.109 1.00 0.00 N ATOM 1446 CA GLU A 92 -6.410 11.491 4.856 1.00 0.00 C ATOM 1447 C GLU A 92 -5.388 11.525 3.724 1.00 0.00 C ATOM 1448 O GLU A 92 -4.555 12.429 3.652 1.00 0.00 O ATOM 1449 CB GLU A 92 -7.063 12.866 5.011 1.00 0.00 C ATOM 1450 CG GLU A 92 -7.875 13.294 3.801 1.00 0.00 C ATOM 1451 CD GLU A 92 -8.050 14.798 3.718 1.00 0.00 C ATOM 1452 OE1 GLU A 92 -8.537 15.393 4.703 1.00 0.00 O ATOM 1453 OE2 GLU A 92 -7.702 15.380 2.669 1.00 0.00 O ATOM 0 H GLU A 92 -6.099 11.604 6.927 1.00 0.00 H new ATOM 0 HA GLU A 92 -7.178 10.758 4.606 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -7.711 12.854 5.887 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -6.287 13.608 5.198 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -7.385 12.939 2.895 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -8.856 12.820 3.840 1.00 0.00 H new ATOM 1460 N VAL A 93 -5.459 10.535 2.841 1.00 0.00 N ATOM 1461 CA VAL A 93 -4.542 10.451 1.711 1.00 0.00 C ATOM 1462 C VAL A 93 -4.685 11.662 0.796 1.00 0.00 C ATOM 1463 O VAL A 93 -5.446 12.584 1.084 1.00 0.00 O ATOM 1464 CB VAL A 93 -4.779 9.170 0.888 1.00 0.00 C ATOM 1465 CG1 VAL A 93 -4.526 7.935 1.740 1.00 0.00 C ATOM 1466 CG2 VAL A 93 -6.189 9.156 0.320 1.00 0.00 C ATOM 0 H VAL A 93 -6.143 9.779 2.886 1.00 0.00 H new ATOM 0 HA VAL A 93 -3.534 10.427 2.124 1.00 0.00 H new ATOM 0 HB VAL A 93 -4.076 9.158 0.055 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -4.698 7.040 1.143 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -3.495 7.942 2.094 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.203 7.937 2.594 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -6.339 8.244 -0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -6.910 9.191 1.136 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.330 10.023 -0.326 1.00 0.00 H new ATOM 1476 N ASN A 94 -3.947 11.652 -0.310 1.00 0.00 N ATOM 1477 CA ASN A 94 -3.992 12.750 -1.269 1.00 0.00 C ATOM 1478 C ASN A 94 -4.908 12.412 -2.441 1.00 0.00 C ATOM 1479 O ASN A 94 -4.506 11.717 -3.376 1.00 0.00 O ATOM 1480 CB ASN A 94 -2.584 13.064 -1.781 1.00 0.00 C ATOM 1481 CG ASN A 94 -1.877 14.101 -0.929 1.00 0.00 C ATOM 1482 OD1 ASN A 94 -2.291 15.259 -0.869 1.00 0.00 O ATOM 1483 ND2 ASN A 94 -0.804 13.687 -0.264 1.00 0.00 N ATOM 0 H ASN A 94 -3.311 10.896 -0.564 1.00 0.00 H new ATOM 0 HA ASN A 94 -4.392 13.628 -0.761 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -1.994 12.148 -1.798 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -2.645 13.423 -2.809 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -0.287 14.339 0.326 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.497 12.718 -0.344 1.00 0.00 H new ATOM 1490 N ILE A 95 -6.139 12.908 -2.385 1.00 0.00 N ATOM 1491 CA ILE A 95 -7.111 12.661 -3.443 1.00 0.00 C ATOM 1492 C ILE A 95 -8.030 13.861 -3.637 1.00 0.00 C ATOM 1493 O ILE A 95 -8.836 14.187 -2.765 1.00 0.00 O ATOM 1494 CB ILE A 95 -7.966 11.416 -3.141 1.00 0.00 C ATOM 1495 CG1 ILE A 95 -8.298 11.349 -1.648 1.00 0.00 C ATOM 1496 CG2 ILE A 95 -7.243 10.155 -3.585 1.00 0.00 C ATOM 1497 CD1 ILE A 95 -8.978 10.061 -1.238 1.00 0.00 C ATOM 0 H ILE A 95 -6.487 13.483 -1.618 1.00 0.00 H new ATOM 0 HA ILE A 95 -6.545 12.490 -4.359 1.00 0.00 H new ATOM 0 HB ILE A 95 -8.899 11.491 -3.699 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -7.379 11.464 -1.074 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -8.942 12.189 -1.389 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -7.861 9.285 -3.364 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -7.053 10.203 -4.657 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -6.296 10.072 -3.052 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -9.184 10.083 -0.168 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -9.915 9.954 -1.785 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -8.326 9.217 -1.465 1.00 0.00 H new ATOM 1509 N ASP A 96 -7.905 14.515 -4.786 1.00 0.00 N ATOM 1510 CA ASP A 96 -8.727 15.679 -5.097 1.00 0.00 C ATOM 1511 C ASP A 96 -10.204 15.379 -4.865 1.00 0.00 C ATOM 1512 O ASP A 96 -10.621 14.220 -4.864 1.00 0.00 O ATOM 1513 CB ASP A 96 -8.504 16.116 -6.546 1.00 0.00 C ATOM 1514 CG ASP A 96 -9.119 17.469 -6.844 1.00 0.00 C ATOM 1515 OD1 ASP A 96 -8.716 18.458 -6.199 1.00 0.00 O ATOM 1516 OD2 ASP A 96 -10.003 17.538 -7.723 1.00 0.00 O ATOM 0 H ASP A 96 -7.242 14.259 -5.518 1.00 0.00 H new ATOM 0 HA ASP A 96 -8.431 16.490 -4.432 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -7.434 16.154 -6.750 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -8.931 15.370 -7.217 1.00 0.00 H new ATOM 1521 N HIS A 97 -10.993 16.430 -4.668 1.00 0.00 N ATOM 1522 CA HIS A 97 -12.425 16.279 -4.434 1.00 0.00 C ATOM 1523 C HIS A 97 -13.048 15.344 -5.467 1.00 0.00 C ATOM 1524 O HIS A 97 -13.979 14.598 -5.162 1.00 0.00 O ATOM 1525 CB HIS A 97 -13.117 17.642 -4.480 1.00 0.00 C ATOM 1526 CG HIS A 97 -12.628 18.597 -3.436 1.00 0.00 C ATOM 1527 ND1 HIS A 97 -12.813 18.396 -2.085 1.00 0.00 N ATOM 1528 CD2 HIS A 97 -11.955 19.766 -3.552 1.00 0.00 C ATOM 1529 CE1 HIS A 97 -12.277 19.399 -1.414 1.00 0.00 C ATOM 1530 NE2 HIS A 97 -11.750 20.245 -2.280 1.00 0.00 N ATOM 0 H HIS A 97 -10.665 17.396 -4.666 1.00 0.00 H new ATOM 0 HA HIS A 97 -12.563 15.843 -3.445 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -12.966 18.084 -5.465 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -14.191 17.500 -4.356 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -11.638 20.235 -4.472 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -12.271 19.509 -0.340 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -11.269 21.113 -2.044 1.00 0.00 H new ATOM 1538 N PHE A 98 -12.529 15.390 -6.689 1.00 0.00 N ATOM 1539 CA PHE A 98 -13.035 14.548 -7.766 1.00 0.00 C ATOM 1540 C PHE A 98 -13.086 13.085 -7.335 1.00 0.00 C ATOM 1541 O PHE A 98 -14.162 12.520 -7.137 1.00 0.00 O ATOM 1542 CB PHE A 98 -12.159 14.694 -9.012 1.00 0.00 C ATOM 1543 CG PHE A 98 -12.707 13.985 -10.217 1.00 0.00 C ATOM 1544 CD1 PHE A 98 -12.830 12.605 -10.229 1.00 0.00 C ATOM 1545 CD2 PHE A 98 -13.099 14.699 -11.339 1.00 0.00 C ATOM 1546 CE1 PHE A 98 -13.333 11.949 -11.336 1.00 0.00 C ATOM 1547 CE2 PHE A 98 -13.604 14.048 -12.449 1.00 0.00 C ATOM 1548 CZ PHE A 98 -13.720 12.672 -12.448 1.00 0.00 C ATOM 0 H PHE A 98 -11.758 16.001 -6.958 1.00 0.00 H new ATOM 0 HA PHE A 98 -14.048 14.874 -8.002 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -12.045 15.753 -9.244 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -11.164 14.307 -8.794 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -12.529 12.035 -9.362 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -13.009 15.775 -11.346 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -13.424 10.873 -11.332 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -13.908 14.615 -13.316 1.00 0.00 H new ATOM 0 HZ PHE A 98 -14.113 12.162 -13.315 1.00 0.00 H new ATOM 1558 N THR A 99 -11.913 12.475 -7.194 1.00 0.00 N ATOM 1559 CA THR A 99 -11.822 11.078 -6.788 1.00 0.00 C ATOM 1560 C THR A 99 -12.455 10.861 -5.419 1.00 0.00 C ATOM 1561 O THR A 99 -13.277 9.961 -5.239 1.00 0.00 O ATOM 1562 CB THR A 99 -10.358 10.600 -6.746 1.00 0.00 C ATOM 1563 OG1 THR A 99 -9.739 10.806 -8.021 1.00 0.00 O ATOM 1564 CG2 THR A 99 -10.280 9.127 -6.372 1.00 0.00 C ATOM 0 H THR A 99 -11.013 12.927 -7.355 1.00 0.00 H new ATOM 0 HA THR A 99 -12.365 10.496 -7.532 1.00 0.00 H new ATOM 0 HB THR A 99 -9.831 11.180 -5.988 1.00 0.00 H new ATOM 0 HG1 THR A 99 -9.294 9.981 -8.306 1.00 0.00 H new ATOM 0 HG21 THR A 99 -9.237 8.812 -6.349 1.00 0.00 H new ATOM 0 HG22 THR A 99 -10.726 8.977 -5.389 1.00 0.00 H new ATOM 0 HG23 THR A 99 -10.821 8.535 -7.110 1.00 0.00 H new ATOM 1572 N LYS A 100 -12.069 11.688 -4.455 1.00 0.00 N ATOM 1573 CA LYS A 100 -12.600 11.589 -3.101 1.00 0.00 C ATOM 1574 C LYS A 100 -14.115 11.418 -3.122 1.00 0.00 C ATOM 1575 O LYS A 100 -14.665 10.579 -2.408 1.00 0.00 O ATOM 1576 CB LYS A 100 -12.226 12.833 -2.291 1.00 0.00 C ATOM 1577 CG LYS A 100 -12.033 12.560 -0.810 1.00 0.00 C ATOM 1578 CD LYS A 100 -13.361 12.526 -0.071 1.00 0.00 C ATOM 1579 CE LYS A 100 -13.166 12.661 1.431 1.00 0.00 C ATOM 1580 NZ LYS A 100 -13.164 14.086 1.864 1.00 0.00 N ATOM 0 H LYS A 100 -11.389 12.436 -4.586 1.00 0.00 H new ATOM 0 HA LYS A 100 -12.160 10.711 -2.628 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -11.307 13.257 -2.696 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -13.006 13.585 -2.415 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -11.518 11.608 -0.679 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -11.394 13.330 -0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -13.999 13.333 -0.430 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -13.876 11.591 -0.290 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -13.960 12.125 1.950 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -12.225 12.193 1.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -13.029 14.136 2.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -12.390 14.592 1.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -14.072 14.526 1.613 1.00 0.00 H new ATOM 1594 N ASP A 101 -14.785 12.218 -3.945 1.00 0.00 N ATOM 1595 CA ASP A 101 -16.236 12.154 -4.062 1.00 0.00 C ATOM 1596 C ASP A 101 -16.680 10.787 -4.575 1.00 0.00 C ATOM 1597 O ASP A 101 -17.619 10.190 -4.047 1.00 0.00 O ATOM 1598 CB ASP A 101 -16.744 13.253 -4.995 1.00 0.00 C ATOM 1599 CG ASP A 101 -17.060 14.539 -4.258 1.00 0.00 C ATOM 1600 OD1 ASP A 101 -16.326 14.872 -3.303 1.00 0.00 O ATOM 1601 OD2 ASP A 101 -18.041 15.213 -4.635 1.00 0.00 O ATOM 0 H ASP A 101 -14.345 12.919 -4.541 1.00 0.00 H new ATOM 0 HA ASP A 101 -16.662 12.306 -3.070 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -15.993 13.451 -5.760 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -17.639 12.903 -5.510 1.00 0.00 H new ATOM 1606 N ILE A 102 -16.002 10.300 -5.608 1.00 0.00 N ATOM 1607 CA ILE A 102 -16.326 9.005 -6.192 1.00 0.00 C ATOM 1608 C ILE A 102 -16.557 7.956 -5.111 1.00 0.00 C ATOM 1609 O ILE A 102 -17.658 7.421 -4.972 1.00 0.00 O ATOM 1610 CB ILE A 102 -15.210 8.518 -7.135 1.00 0.00 C ATOM 1611 CG1 ILE A 102 -14.944 9.557 -8.227 1.00 0.00 C ATOM 1612 CG2 ILE A 102 -15.587 7.179 -7.754 1.00 0.00 C ATOM 1613 CD1 ILE A 102 -16.117 9.771 -9.157 1.00 0.00 C ATOM 0 H ILE A 102 -15.224 10.783 -6.058 1.00 0.00 H new ATOM 0 HA ILE A 102 -17.243 9.139 -6.766 1.00 0.00 H new ATOM 0 HB ILE A 102 -14.297 8.386 -6.554 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -14.685 10.506 -7.758 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -14.079 9.244 -8.812 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -14.789 6.848 -8.418 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -15.732 6.441 -6.965 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -16.510 7.288 -8.323 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -15.857 10.520 -9.905 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -16.363 8.833 -9.654 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -16.978 10.115 -8.584 1.00 0.00 H new ATOM 1625 N THR A 103 -15.511 7.665 -4.342 1.00 0.00 N ATOM 1626 CA THR A 103 -15.598 6.681 -3.272 1.00 0.00 C ATOM 1627 C THR A 103 -16.903 6.826 -2.497 1.00 0.00 C ATOM 1628 O THR A 103 -17.665 5.871 -2.362 1.00 0.00 O ATOM 1629 CB THR A 103 -14.416 6.808 -2.294 1.00 0.00 C ATOM 1630 OG1 THR A 103 -13.179 6.652 -2.997 1.00 0.00 O ATOM 1631 CG2 THR A 103 -14.512 5.766 -1.190 1.00 0.00 C ATOM 0 H THR A 103 -14.593 8.098 -4.442 1.00 0.00 H new ATOM 0 HA THR A 103 -15.565 5.698 -3.743 1.00 0.00 H new ATOM 0 HB THR A 103 -14.454 7.799 -1.841 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.712 7.513 -3.032 1.00 0.00 H new ATOM 0 HG21 THR A 103 -13.666 5.876 -0.512 1.00 0.00 H new ATOM 0 HG22 THR A 103 -15.441 5.906 -0.637 1.00 0.00 H new ATOM 0 HG23 THR A 103 -14.498 4.768 -1.629 1.00 0.00 H new ATOM 1639 N MET A 104 -17.153 8.029 -1.989 1.00 0.00 N ATOM 1640 CA MET A 104 -18.368 8.299 -1.228 1.00 0.00 C ATOM 1641 C MET A 104 -19.581 7.659 -1.895 1.00 0.00 C ATOM 1642 O MET A 104 -20.318 6.897 -1.267 1.00 0.00 O ATOM 1643 CB MET A 104 -18.584 9.808 -1.092 1.00 0.00 C ATOM 1644 CG MET A 104 -17.291 10.604 -1.032 1.00 0.00 C ATOM 1645 SD MET A 104 -17.554 12.322 -0.554 1.00 0.00 S ATOM 1646 CE MET A 104 -18.756 12.128 0.760 1.00 0.00 C ATOM 0 H MET A 104 -16.531 8.831 -2.090 1.00 0.00 H new ATOM 0 HA MET A 104 -18.250 7.864 -0.236 1.00 0.00 H new ATOM 0 HB2 MET A 104 -19.178 10.159 -1.936 1.00 0.00 H new ATOM 0 HB3 MET A 104 -19.164 10.004 -0.190 1.00 0.00 H new ATOM 0 HG2 MET A 104 -16.612 10.133 -0.321 1.00 0.00 H new ATOM 0 HG3 MET A 104 -16.804 10.573 -2.007 1.00 0.00 H new ATOM 0 HE1 MET A 104 -18.758 13.021 1.386 1.00 0.00 H new ATOM 0 HE2 MET A 104 -19.747 11.985 0.329 1.00 0.00 H new ATOM 0 HE3 MET A 104 -18.495 11.261 1.366 1.00 0.00 H new ATOM 1656 N LYS A 105 -19.784 7.971 -3.170 1.00 0.00 N ATOM 1657 CA LYS A 105 -20.907 7.425 -3.924 1.00 0.00 C ATOM 1658 C LYS A 105 -20.819 5.904 -4.004 1.00 0.00 C ATOM 1659 O LYS A 105 -21.829 5.225 -4.185 1.00 0.00 O ATOM 1660 CB LYS A 105 -20.940 8.021 -5.333 1.00 0.00 C ATOM 1661 CG LYS A 105 -20.802 9.533 -5.357 1.00 0.00 C ATOM 1662 CD LYS A 105 -20.054 10.004 -6.593 1.00 0.00 C ATOM 1663 CE LYS A 105 -20.393 11.448 -6.933 1.00 0.00 C ATOM 1664 NZ LYS A 105 -21.549 11.540 -7.868 1.00 0.00 N ATOM 0 H LYS A 105 -19.185 8.600 -3.704 1.00 0.00 H new ATOM 0 HA LYS A 105 -21.827 7.691 -3.403 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -20.136 7.582 -5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -21.877 7.742 -5.814 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -21.791 9.990 -5.333 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -20.275 9.866 -4.463 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -18.981 9.910 -6.428 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -20.304 9.362 -7.438 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -20.622 11.993 -6.017 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -19.524 11.929 -7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -21.749 12.539 -8.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -21.321 11.042 -8.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -22.385 11.103 -7.430 1.00 0.00 H new ATOM 1678 N ASN A 106 -19.607 5.378 -3.868 1.00 0.00 N ATOM 1679 CA ASN A 106 -19.389 3.937 -3.925 1.00 0.00 C ATOM 1680 C ASN A 106 -19.560 3.305 -2.547 1.00 0.00 C ATOM 1681 O ASN A 106 -19.277 2.122 -2.354 1.00 0.00 O ATOM 1682 CB ASN A 106 -17.990 3.632 -4.467 1.00 0.00 C ATOM 1683 CG ASN A 106 -17.895 3.840 -5.967 1.00 0.00 C ATOM 1684 OD1 ASN A 106 -18.903 3.822 -6.673 1.00 0.00 O ATOM 1685 ND2 ASN A 106 -16.677 4.034 -6.460 1.00 0.00 N ATOM 0 H ASN A 106 -18.761 5.927 -3.718 1.00 0.00 H new ATOM 0 HA ASN A 106 -20.134 3.509 -4.597 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -17.262 4.271 -3.967 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -17.727 2.602 -4.228 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.549 4.176 -7.462 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.870 4.041 -5.837 1.00 0.00 H new ATOM 1692 N LEU A 107 -20.026 4.102 -1.592 1.00 0.00 N ATOM 1693 CA LEU A 107 -20.237 3.622 -0.230 1.00 0.00 C ATOM 1694 C LEU A 107 -21.675 3.153 -0.035 1.00 0.00 C ATOM 1695 O LEU A 107 -22.034 2.643 1.026 1.00 0.00 O ATOM 1696 CB LEU A 107 -19.906 4.725 0.777 1.00 0.00 C ATOM 1697 CG LEU A 107 -18.429 5.103 0.898 1.00 0.00 C ATOM 1698 CD1 LEU A 107 -18.220 6.080 2.045 1.00 0.00 C ATOM 1699 CD2 LEU A 107 -17.574 3.860 1.090 1.00 0.00 C ATOM 0 H LEU A 107 -20.265 5.083 -1.735 1.00 0.00 H new ATOM 0 HA LEU A 107 -19.573 2.774 -0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -20.468 5.618 0.505 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -20.262 4.412 1.759 1.00 0.00 H new ATOM 0 HG LEU A 107 -18.122 5.591 -0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -17.163 6.337 2.116 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.802 6.984 1.864 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -18.545 5.620 2.978 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -16.526 4.149 1.174 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -17.882 3.343 1.999 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -17.700 3.196 0.235 1.00 0.00 H new ATOM 1711 N VAL A 108 -22.494 3.327 -1.067 1.00 0.00 N ATOM 1712 CA VAL A 108 -23.892 2.918 -1.009 1.00 0.00 C ATOM 1713 C VAL A 108 -24.031 1.409 -1.168 1.00 0.00 C ATOM 1714 O VAL A 108 -24.577 0.731 -0.299 1.00 0.00 O ATOM 1715 CB VAL A 108 -24.726 3.616 -2.100 1.00 0.00 C ATOM 1716 CG1 VAL A 108 -26.212 3.413 -1.849 1.00 0.00 C ATOM 1717 CG2 VAL A 108 -24.386 5.099 -2.164 1.00 0.00 C ATOM 0 H VAL A 108 -22.214 3.748 -1.953 1.00 0.00 H new ATOM 0 HA VAL A 108 -24.267 3.213 -0.029 1.00 0.00 H new ATOM 0 HB VAL A 108 -24.480 3.168 -3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -26.785 3.913 -2.630 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -26.440 2.347 -1.858 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -26.478 3.833 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -24.984 5.576 -2.940 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -24.602 5.564 -1.202 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -23.328 5.220 -2.396 1.00 0.00 H new ATOM 1727 N GLU A 109 -23.532 0.889 -2.286 1.00 0.00 N ATOM 1728 CA GLU A 109 -23.601 -0.543 -2.559 1.00 0.00 C ATOM 1729 C GLU A 109 -22.208 -1.117 -2.803 1.00 0.00 C ATOM 1730 O GLU A 109 -21.957 -1.799 -3.797 1.00 0.00 O ATOM 1731 CB GLU A 109 -24.495 -0.811 -3.771 1.00 0.00 C ATOM 1732 CG GLU A 109 -25.735 0.067 -3.819 1.00 0.00 C ATOM 1733 CD GLU A 109 -26.407 0.052 -5.177 1.00 0.00 C ATOM 1734 OE1 GLU A 109 -25.772 0.493 -6.158 1.00 0.00 O ATOM 1735 OE2 GLU A 109 -27.569 -0.399 -5.260 1.00 0.00 O ATOM 0 H GLU A 109 -23.076 1.437 -3.016 1.00 0.00 H new ATOM 0 HA GLU A 109 -24.030 -1.034 -1.685 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.915 -0.656 -4.681 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -24.801 -1.857 -3.762 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -26.444 -0.270 -3.063 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -25.461 1.091 -3.565 1.00 0.00 H new ATOM 1742 N PRO A 110 -21.281 -0.836 -1.877 1.00 0.00 N ATOM 1743 CA PRO A 110 -19.899 -1.314 -1.969 1.00 0.00 C ATOM 1744 C PRO A 110 -19.792 -2.821 -1.759 1.00 0.00 C ATOM 1745 O PRO A 110 -20.397 -3.374 -0.841 1.00 0.00 O ATOM 1746 CB PRO A 110 -19.188 -0.565 -0.838 1.00 0.00 C ATOM 1747 CG PRO A 110 -20.264 -0.252 0.143 1.00 0.00 C ATOM 1748 CD PRO A 110 -21.511 -0.028 -0.666 1.00 0.00 C ATOM 0 HA PRO A 110 -19.470 -1.133 -2.954 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -18.407 -1.177 -0.387 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -18.709 0.343 -1.204 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -20.399 -1.072 0.849 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -20.014 0.634 0.727 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -22.402 -0.353 -0.129 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -21.650 1.026 -0.906 1.00 0.00 H new ATOM 1756 N SER A 111 -19.017 -3.479 -2.615 1.00 0.00 N ATOM 1757 CA SER A 111 -18.833 -4.922 -2.526 1.00 0.00 C ATOM 1758 C SER A 111 -17.354 -5.289 -2.610 1.00 0.00 C ATOM 1759 O SER A 111 -16.769 -5.786 -1.647 1.00 0.00 O ATOM 1760 CB SER A 111 -19.609 -5.627 -3.640 1.00 0.00 C ATOM 1761 OG SER A 111 -20.983 -5.737 -3.314 1.00 0.00 O ATOM 0 H SER A 111 -18.506 -3.035 -3.378 1.00 0.00 H new ATOM 0 HA SER A 111 -19.217 -5.252 -1.561 1.00 0.00 H new ATOM 0 HB2 SER A 111 -19.497 -5.073 -4.572 1.00 0.00 H new ATOM 0 HB3 SER A 111 -19.191 -6.620 -3.806 1.00 0.00 H new ATOM 0 HG SER A 111 -21.457 -6.190 -4.043 1.00 0.00 H new ATOM 1767 N LEU A 112 -16.755 -5.039 -3.769 1.00 0.00 N ATOM 1768 CA LEU A 112 -15.343 -5.342 -3.981 1.00 0.00 C ATOM 1769 C LEU A 112 -14.637 -4.182 -4.677 1.00 0.00 C ATOM 1770 O LEU A 112 -13.543 -3.780 -4.279 1.00 0.00 O ATOM 1771 CB LEU A 112 -15.194 -6.616 -4.812 1.00 0.00 C ATOM 1772 CG LEU A 112 -15.272 -7.934 -4.039 1.00 0.00 C ATOM 1773 CD1 LEU A 112 -14.959 -9.108 -4.954 1.00 0.00 C ATOM 1774 CD2 LEU A 112 -14.322 -7.912 -2.852 1.00 0.00 C ATOM 0 H LEU A 112 -17.224 -4.628 -4.576 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.879 -5.495 -3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -15.970 -6.620 -5.577 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -14.236 -6.578 -5.330 1.00 0.00 H new ATOM 0 HG LEU A 112 -16.288 -8.054 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -15.019 -10.037 -4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -15.679 -9.134 -5.772 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -13.954 -8.995 -5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -14.391 -8.857 -2.314 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -13.301 -7.769 -3.206 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -14.593 -7.094 -2.185 1.00 0.00 H new ATOM 1786 N SER A 113 -15.271 -3.646 -5.715 1.00 0.00 N ATOM 1787 CA SER A 113 -14.702 -2.534 -6.467 1.00 0.00 C ATOM 1788 C SER A 113 -15.135 -1.198 -5.871 1.00 0.00 C ATOM 1789 O SER A 113 -15.122 -0.171 -6.549 1.00 0.00 O ATOM 1790 CB SER A 113 -15.127 -2.613 -7.934 1.00 0.00 C ATOM 1791 OG SER A 113 -14.141 -2.048 -8.782 1.00 0.00 O ATOM 0 H SER A 113 -16.179 -3.964 -6.054 1.00 0.00 H new ATOM 0 HA SER A 113 -13.616 -2.604 -6.407 1.00 0.00 H new ATOM 0 HB2 SER A 113 -15.297 -3.653 -8.211 1.00 0.00 H new ATOM 0 HB3 SER A 113 -16.073 -2.088 -8.071 1.00 0.00 H new ATOM 0 HG SER A 113 -14.436 -2.112 -9.714 1.00 0.00 H new ATOM 1797 N SER A 114 -15.519 -1.222 -4.599 1.00 0.00 N ATOM 1798 CA SER A 114 -15.960 -0.013 -3.912 1.00 0.00 C ATOM 1799 C SER A 114 -14.854 1.037 -3.895 1.00 0.00 C ATOM 1800 O SER A 114 -15.114 2.231 -4.042 1.00 0.00 O ATOM 1801 CB SER A 114 -16.388 -0.343 -2.480 1.00 0.00 C ATOM 1802 OG SER A 114 -15.406 -1.124 -1.821 1.00 0.00 O ATOM 0 H SER A 114 -15.534 -2.064 -4.023 1.00 0.00 H new ATOM 0 HA SER A 114 -16.813 0.393 -4.455 1.00 0.00 H new ATOM 0 HB2 SER A 114 -16.555 0.580 -1.925 1.00 0.00 H new ATOM 0 HB3 SER A 114 -17.335 -0.882 -2.495 1.00 0.00 H new ATOM 0 HG SER A 114 -15.844 -1.749 -1.206 1.00 0.00 H new ATOM 1808 N PHE A 115 -13.619 0.583 -3.714 1.00 0.00 N ATOM 1809 CA PHE A 115 -12.471 1.483 -3.677 1.00 0.00 C ATOM 1810 C PHE A 115 -11.546 1.234 -4.864 1.00 0.00 C ATOM 1811 O PHE A 115 -10.330 1.132 -4.708 1.00 0.00 O ATOM 1812 CB PHE A 115 -11.698 1.302 -2.369 1.00 0.00 C ATOM 1813 CG PHE A 115 -12.459 1.754 -1.156 1.00 0.00 C ATOM 1814 CD1 PHE A 115 -12.367 3.064 -0.711 1.00 0.00 C ATOM 1815 CD2 PHE A 115 -13.268 0.871 -0.460 1.00 0.00 C ATOM 1816 CE1 PHE A 115 -13.067 3.481 0.406 1.00 0.00 C ATOM 1817 CE2 PHE A 115 -13.970 1.283 0.658 1.00 0.00 C ATOM 1818 CZ PHE A 115 -13.869 2.590 1.090 1.00 0.00 C ATOM 0 H PHE A 115 -13.387 -0.402 -3.591 1.00 0.00 H new ATOM 0 HA PHE A 115 -12.841 2.507 -3.735 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -11.437 0.250 -2.253 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.762 1.858 -2.429 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -11.742 3.766 -1.243 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -13.352 -0.152 -0.795 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -12.986 4.504 0.743 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -14.596 0.583 1.192 1.00 0.00 H new ATOM 0 HZ PHE A 115 -14.417 2.915 1.962 1.00 0.00 H new ATOM 1828 N ASP A 116 -12.133 1.138 -6.052 1.00 0.00 N ATOM 1829 CA ASP A 116 -11.363 0.903 -7.269 1.00 0.00 C ATOM 1830 C ASP A 116 -10.669 2.181 -7.728 1.00 0.00 C ATOM 1831 O ASP A 116 -9.465 2.189 -7.980 1.00 0.00 O ATOM 1832 CB ASP A 116 -12.273 0.375 -8.380 1.00 0.00 C ATOM 1833 CG ASP A 116 -11.775 0.747 -9.762 1.00 0.00 C ATOM 1834 OD1 ASP A 116 -10.607 0.433 -10.077 1.00 0.00 O ATOM 1835 OD2 ASP A 116 -12.552 1.352 -10.529 1.00 0.00 O ATOM 0 H ASP A 116 -13.139 1.219 -6.199 1.00 0.00 H new ATOM 0 HA ASP A 116 -10.601 0.156 -7.048 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.344 -0.710 -8.302 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -13.279 0.771 -8.241 1.00 0.00 H new ATOM 1840 N MET A 117 -11.438 3.260 -7.836 1.00 0.00 N ATOM 1841 CA MET A 117 -10.895 4.545 -8.265 1.00 0.00 C ATOM 1842 C MET A 117 -9.890 5.078 -7.248 1.00 0.00 C ATOM 1843 O MET A 117 -8.727 5.311 -7.575 1.00 0.00 O ATOM 1844 CB MET A 117 -12.024 5.558 -8.464 1.00 0.00 C ATOM 1845 CG MET A 117 -11.546 6.906 -8.978 1.00 0.00 C ATOM 1846 SD MET A 117 -11.494 6.983 -10.780 1.00 0.00 S ATOM 1847 CE MET A 117 -12.900 8.040 -11.114 1.00 0.00 C ATOM 0 H MET A 117 -12.438 3.271 -7.633 1.00 0.00 H new ATOM 0 HA MET A 117 -10.379 4.395 -9.214 1.00 0.00 H new ATOM 0 HB2 MET A 117 -12.750 5.147 -9.166 1.00 0.00 H new ATOM 0 HB3 MET A 117 -12.543 5.703 -7.516 1.00 0.00 H new ATOM 0 HG2 MET A 117 -12.206 7.688 -8.604 1.00 0.00 H new ATOM 0 HG3 MET A 117 -10.552 7.111 -8.580 1.00 0.00 H new ATOM 0 HE1 MET A 117 -13.011 8.168 -12.191 1.00 0.00 H new ATOM 0 HE2 MET A 117 -13.803 7.584 -10.708 1.00 0.00 H new ATOM 0 HE3 MET A 117 -12.743 9.012 -10.647 1.00 0.00 H new ATOM 1857 N ALA A 118 -10.347 5.268 -6.015 1.00 0.00 N ATOM 1858 CA ALA A 118 -9.488 5.771 -4.951 1.00 0.00 C ATOM 1859 C ALA A 118 -8.184 4.984 -4.879 1.00 0.00 C ATOM 1860 O ALA A 118 -7.109 5.560 -4.713 1.00 0.00 O ATOM 1861 CB ALA A 118 -10.215 5.717 -3.615 1.00 0.00 C ATOM 0 H ALA A 118 -11.308 5.081 -5.728 1.00 0.00 H new ATOM 0 HA ALA A 118 -9.243 6.809 -5.176 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -9.561 6.096 -2.829 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.115 6.330 -3.665 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.490 4.686 -3.392 1.00 0.00 H new ATOM 1867 N GLN A 119 -8.288 3.665 -5.004 1.00 0.00 N ATOM 1868 CA GLN A 119 -7.116 2.798 -4.952 1.00 0.00 C ATOM 1869 C GLN A 119 -6.137 3.139 -6.069 1.00 0.00 C ATOM 1870 O GLN A 119 -4.975 3.460 -5.815 1.00 0.00 O ATOM 1871 CB GLN A 119 -7.536 1.331 -5.054 1.00 0.00 C ATOM 1872 CG GLN A 119 -6.365 0.361 -5.034 1.00 0.00 C ATOM 1873 CD GLN A 119 -5.865 0.079 -3.632 1.00 0.00 C ATOM 1874 OE1 GLN A 119 -5.822 0.971 -2.784 1.00 0.00 O ATOM 1875 NE2 GLN A 119 -5.483 -1.167 -3.378 1.00 0.00 N ATOM 0 H GLN A 119 -9.171 3.173 -5.142 1.00 0.00 H new ATOM 0 HA GLN A 119 -6.618 2.959 -3.996 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -8.207 1.095 -4.228 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -8.101 1.187 -5.975 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -6.666 -0.576 -5.504 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -5.550 0.769 -5.631 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -5.535 -1.876 -4.110 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -5.138 -1.416 -2.451 1.00 0.00 H new ATOM 1884 N LYS A 120 -6.612 3.067 -7.307 1.00 0.00 N ATOM 1885 CA LYS A 120 -5.779 3.369 -8.466 1.00 0.00 C ATOM 1886 C LYS A 120 -5.303 4.818 -8.432 1.00 0.00 C ATOM 1887 O LYS A 120 -4.249 5.148 -8.973 1.00 0.00 O ATOM 1888 CB LYS A 120 -6.553 3.106 -9.759 1.00 0.00 C ATOM 1889 CG LYS A 120 -7.342 4.307 -10.251 1.00 0.00 C ATOM 1890 CD LYS A 120 -7.994 4.034 -11.596 1.00 0.00 C ATOM 1891 CE LYS A 120 -7.054 4.358 -12.747 1.00 0.00 C ATOM 1892 NZ LYS A 120 -6.187 3.199 -13.098 1.00 0.00 N ATOM 0 H LYS A 120 -7.570 2.802 -7.535 1.00 0.00 H new ATOM 0 HA LYS A 120 -4.906 2.717 -8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -5.853 2.799 -10.536 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -7.237 2.273 -9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -8.108 4.564 -9.520 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -6.680 5.169 -10.335 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -8.291 2.987 -11.651 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -8.903 4.629 -11.688 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.637 4.653 -13.620 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.430 5.210 -12.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -5.983 3.214 -14.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -5.295 3.259 -12.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -6.676 2.314 -12.856 1.00 0.00 H new ATOM 1906 N ARG A 121 -6.088 5.679 -7.790 1.00 0.00 N ATOM 1907 CA ARG A 121 -5.747 7.092 -7.686 1.00 0.00 C ATOM 1908 C ARG A 121 -4.498 7.288 -6.829 1.00 0.00 C ATOM 1909 O ARG A 121 -3.537 7.927 -7.256 1.00 0.00 O ATOM 1910 CB ARG A 121 -6.916 7.879 -7.090 1.00 0.00 C ATOM 1911 CG ARG A 121 -6.845 9.372 -7.358 1.00 0.00 C ATOM 1912 CD ARG A 121 -5.493 9.946 -6.963 1.00 0.00 C ATOM 1913 NE ARG A 121 -5.544 11.394 -6.782 1.00 0.00 N ATOM 1914 CZ ARG A 121 -5.413 12.264 -7.778 1.00 0.00 C ATOM 1915 NH1 ARG A 121 -5.227 11.834 -9.018 1.00 0.00 N ATOM 1916 NH2 ARG A 121 -5.471 13.567 -7.534 1.00 0.00 N ATOM 0 H ARG A 121 -6.964 5.422 -7.335 1.00 0.00 H new ATOM 0 HA ARG A 121 -5.541 7.465 -8.689 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -7.850 7.490 -7.496 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -6.943 7.713 -6.013 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -7.027 9.562 -8.416 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -7.633 9.880 -6.803 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -5.156 9.477 -6.038 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -4.758 9.702 -7.730 1.00 0.00 H new ATOM 0 HE ARG A 121 -5.688 11.758 -5.840 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -5.184 10.833 -9.210 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -5.127 12.504 -9.781 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -5.616 13.902 -6.581 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -5.370 14.234 -8.299 1.00 0.00 H new ATOM 1930 N ILE A 122 -4.523 6.734 -5.623 1.00 0.00 N ATOM 1931 CA ILE A 122 -3.394 6.848 -4.708 1.00 0.00 C ATOM 1932 C ILE A 122 -2.188 6.071 -5.224 1.00 0.00 C ATOM 1933 O ILE A 122 -1.062 6.568 -5.208 1.00 0.00 O ATOM 1934 CB ILE A 122 -3.756 6.336 -3.301 1.00 0.00 C ATOM 1935 CG1 ILE A 122 -4.625 7.361 -2.569 1.00 0.00 C ATOM 1936 CG2 ILE A 122 -2.494 6.039 -2.504 1.00 0.00 C ATOM 1937 CD1 ILE A 122 -4.036 8.754 -2.557 1.00 0.00 C ATOM 0 H ILE A 122 -5.312 6.202 -5.256 1.00 0.00 H new ATOM 0 HA ILE A 122 -3.143 7.907 -4.647 1.00 0.00 H new ATOM 0 HB ILE A 122 -4.325 5.412 -3.403 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -5.607 7.395 -3.040 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -4.775 7.030 -1.541 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -2.767 5.678 -1.512 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -1.909 5.277 -3.019 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -1.901 6.949 -2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -4.705 9.427 -2.022 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -3.066 8.735 -2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -3.911 9.105 -3.581 1.00 0.00 H new ATOM 1949 N HIS A 123 -2.431 4.847 -5.684 1.00 0.00 N ATOM 1950 CA HIS A 123 -1.365 4.002 -6.209 1.00 0.00 C ATOM 1951 C HIS A 123 -0.577 4.731 -7.293 1.00 0.00 C ATOM 1952 O HIS A 123 0.642 4.589 -7.389 1.00 0.00 O ATOM 1953 CB HIS A 123 -1.945 2.702 -6.769 1.00 0.00 C ATOM 1954 CG HIS A 123 -0.925 1.828 -7.431 1.00 0.00 C ATOM 1955 ND1 HIS A 123 -0.222 2.209 -8.555 1.00 0.00 N ATOM 1956 CD2 HIS A 123 -0.490 0.585 -7.121 1.00 0.00 C ATOM 1957 CE1 HIS A 123 0.600 1.237 -8.908 1.00 0.00 C ATOM 1958 NE2 HIS A 123 0.458 0.240 -8.053 1.00 0.00 N ATOM 0 H HIS A 123 -3.357 4.419 -5.704 1.00 0.00 H new ATOM 0 HA HIS A 123 -0.686 3.765 -5.390 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -2.417 2.146 -5.959 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -2.727 2.943 -7.489 1.00 0.00 H new ATOM 0 HD1 HIS A 123 -0.321 3.102 -9.038 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -0.826 -0.023 -6.294 1.00 0.00 H new ATOM 0 HE1 HIS A 123 1.274 1.254 -9.752 1.00 0.00 H new ATOM 1966 N ALA A 124 -1.282 5.510 -8.107 1.00 0.00 N ATOM 1967 CA ALA A 124 -0.648 6.261 -9.182 1.00 0.00 C ATOM 1968 C ALA A 124 0.178 7.420 -8.632 1.00 0.00 C ATOM 1969 O ALA A 124 1.071 7.934 -9.305 1.00 0.00 O ATOM 1970 CB ALA A 124 -1.697 6.776 -10.157 1.00 0.00 C ATOM 0 H ALA A 124 -2.292 5.637 -8.042 1.00 0.00 H new ATOM 0 HA ALA A 124 0.026 5.588 -9.711 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -1.209 7.335 -10.955 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -2.241 5.934 -10.585 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.394 7.428 -9.631 1.00 0.00 H new ATOM 1976 N LEU A 125 -0.127 7.825 -7.405 1.00 0.00 N ATOM 1977 CA LEU A 125 0.585 8.924 -6.762 1.00 0.00 C ATOM 1978 C LEU A 125 1.838 8.419 -6.052 1.00 0.00 C ATOM 1979 O LEU A 125 2.905 9.025 -6.148 1.00 0.00 O ATOM 1980 CB LEU A 125 -0.328 9.638 -5.764 1.00 0.00 C ATOM 1981 CG LEU A 125 0.370 10.342 -4.600 1.00 0.00 C ATOM 1982 CD1 LEU A 125 0.627 11.803 -4.938 1.00 0.00 C ATOM 1983 CD2 LEU A 125 -0.460 10.224 -3.330 1.00 0.00 C ATOM 0 H LEU A 125 -0.863 7.409 -6.835 1.00 0.00 H new ATOM 0 HA LEU A 125 0.887 9.630 -7.536 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -0.919 10.376 -6.307 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -1.026 8.908 -5.355 1.00 0.00 H new ATOM 0 HG LEU A 125 1.330 9.855 -4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 125 1.124 12.289 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 125 1.262 11.866 -5.822 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -0.321 12.303 -5.136 1.00 0.00 H new ATOM 0 HD21 LEU A 125 0.052 10.731 -2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -1.435 10.685 -3.488 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -0.593 9.172 -3.078 1.00 0.00 H new ATOM 1995 N MET A 126 1.700 7.305 -5.341 1.00 0.00 N ATOM 1996 CA MET A 126 2.821 6.716 -4.617 1.00 0.00 C ATOM 1997 C MET A 126 3.856 6.153 -5.586 1.00 0.00 C ATOM 1998 O MET A 126 4.959 5.784 -5.183 1.00 0.00 O ATOM 1999 CB MET A 126 2.329 5.614 -3.680 1.00 0.00 C ATOM 2000 CG MET A 126 1.113 6.013 -2.858 1.00 0.00 C ATOM 2001 SD MET A 126 0.717 4.809 -1.575 1.00 0.00 S ATOM 2002 CE MET A 126 0.240 3.398 -2.570 1.00 0.00 C ATOM 0 H MET A 126 0.823 6.792 -5.251 1.00 0.00 H new ATOM 0 HA MET A 126 3.292 7.501 -4.025 1.00 0.00 H new ATOM 0 HB2 MET A 126 2.085 4.730 -4.269 1.00 0.00 H new ATOM 0 HB3 MET A 126 3.138 5.334 -3.005 1.00 0.00 H new ATOM 0 HG2 MET A 126 1.294 6.984 -2.397 1.00 0.00 H new ATOM 0 HG3 MET A 126 0.254 6.129 -3.519 1.00 0.00 H new ATOM 0 HE1 MET A 126 -0.051 2.575 -1.918 1.00 0.00 H new ATOM 0 HE2 MET A 126 -0.601 3.670 -3.208 1.00 0.00 H new ATOM 0 HE3 MET A 126 1.081 3.089 -3.191 1.00 0.00 H new ATOM 2012 N GLU A 127 3.493 6.089 -6.863 1.00 0.00 N ATOM 2013 CA GLU A 127 4.391 5.567 -7.887 1.00 0.00 C ATOM 2014 C GLU A 127 5.112 6.703 -8.606 1.00 0.00 C ATOM 2015 O GLU A 127 6.190 6.512 -9.169 1.00 0.00 O ATOM 2016 CB GLU A 127 3.613 4.721 -8.896 1.00 0.00 C ATOM 2017 CG GLU A 127 2.867 5.543 -9.933 1.00 0.00 C ATOM 2018 CD GLU A 127 2.511 4.740 -11.169 1.00 0.00 C ATOM 2019 OE1 GLU A 127 3.433 4.173 -11.793 1.00 0.00 O ATOM 2020 OE2 GLU A 127 1.312 4.679 -11.513 1.00 0.00 O ATOM 0 H GLU A 127 2.584 6.392 -7.213 1.00 0.00 H new ATOM 0 HA GLU A 127 5.135 4.939 -7.397 1.00 0.00 H new ATOM 0 HB2 GLU A 127 4.305 4.051 -9.406 1.00 0.00 H new ATOM 0 HB3 GLU A 127 2.900 4.095 -8.359 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.955 5.941 -9.488 1.00 0.00 H new ATOM 0 HG3 GLU A 127 3.479 6.397 -10.223 1.00 0.00 H new ATOM 2027 N LYS A 128 4.509 7.887 -8.585 1.00 0.00 N ATOM 2028 CA LYS A 128 5.091 9.056 -9.235 1.00 0.00 C ATOM 2029 C LYS A 128 5.540 10.084 -8.202 1.00 0.00 C ATOM 2030 O LYS A 128 6.159 11.092 -8.545 1.00 0.00 O ATOM 2031 CB LYS A 128 4.080 9.687 -10.195 1.00 0.00 C ATOM 2032 CG LYS A 128 2.786 10.110 -9.522 1.00 0.00 C ATOM 2033 CD LYS A 128 2.867 11.536 -9.002 1.00 0.00 C ATOM 2034 CE LYS A 128 2.454 12.541 -10.066 1.00 0.00 C ATOM 2035 NZ LYS A 128 1.007 12.431 -10.403 1.00 0.00 N ATOM 0 H LYS A 128 3.616 8.063 -8.124 1.00 0.00 H new ATOM 0 HA LYS A 128 5.964 8.731 -9.801 1.00 0.00 H new ATOM 0 HB2 LYS A 128 4.535 10.557 -10.668 1.00 0.00 H new ATOM 0 HB3 LYS A 128 3.852 8.975 -10.988 1.00 0.00 H new ATOM 0 HG2 LYS A 128 1.962 10.027 -10.231 1.00 0.00 H new ATOM 0 HG3 LYS A 128 2.566 9.433 -8.697 1.00 0.00 H new ATOM 0 HD2 LYS A 128 2.223 11.643 -8.129 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.885 11.748 -8.675 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.669 13.550 -9.715 1.00 0.00 H new ATOM 0 HE3 LYS A 128 3.049 12.383 -10.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 0.679 13.325 -10.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 0.867 11.657 -11.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 0.463 12.234 -9.539 1.00 0.00 H new ATOM 2049 N ASP A 129 5.227 9.823 -6.938 1.00 0.00 N ATOM 2050 CA ASP A 129 5.601 10.725 -5.855 1.00 0.00 C ATOM 2051 C ASP A 129 6.654 10.087 -4.955 1.00 0.00 C ATOM 2052 O ASP A 129 7.795 10.546 -4.898 1.00 0.00 O ATOM 2053 CB ASP A 129 4.370 11.103 -5.030 1.00 0.00 C ATOM 2054 CG ASP A 129 4.693 12.094 -3.929 1.00 0.00 C ATOM 2055 OD1 ASP A 129 5.484 13.026 -4.182 1.00 0.00 O ATOM 2056 OD2 ASP A 129 4.156 11.936 -2.813 1.00 0.00 O ATOM 0 H ASP A 129 4.715 8.994 -6.638 1.00 0.00 H new ATOM 0 HA ASP A 129 6.025 11.627 -6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 129 3.612 11.529 -5.688 1.00 0.00 H new ATOM 0 HB3 ASP A 129 3.941 10.203 -4.590 1.00 0.00 H new ATOM 2061 N SER A 130 6.264 9.028 -4.255 1.00 0.00 N ATOM 2062 CA SER A 130 7.173 8.329 -3.354 1.00 0.00 C ATOM 2063 C SER A 130 8.115 7.416 -4.133 1.00 0.00 C ATOM 2064 O SER A 130 9.337 7.543 -4.042 1.00 0.00 O ATOM 2065 CB SER A 130 6.383 7.511 -2.330 1.00 0.00 C ATOM 2066 OG SER A 130 5.382 6.732 -2.963 1.00 0.00 O ATOM 0 H SER A 130 5.324 8.634 -4.294 1.00 0.00 H new ATOM 0 HA SER A 130 7.769 9.076 -2.829 1.00 0.00 H new ATOM 0 HB2 SER A 130 7.061 6.859 -1.779 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.922 8.180 -1.603 1.00 0.00 H new ATOM 0 HG SER A 130 5.526 6.740 -3.932 1.00 0.00 H new ATOM 2072 N LEU A 131 7.538 6.497 -4.898 1.00 0.00 N ATOM 2073 CA LEU A 131 8.325 5.560 -5.694 1.00 0.00 C ATOM 2074 C LEU A 131 9.604 6.219 -6.202 1.00 0.00 C ATOM 2075 O LEU A 131 10.711 5.720 -5.999 1.00 0.00 O ATOM 2076 CB LEU A 131 7.500 5.046 -6.875 1.00 0.00 C ATOM 2077 CG LEU A 131 8.294 4.480 -8.053 1.00 0.00 C ATOM 2078 CD1 LEU A 131 9.282 3.428 -7.574 1.00 0.00 C ATOM 2079 CD2 LEU A 131 7.354 3.896 -9.097 1.00 0.00 C ATOM 0 H LEU A 131 6.528 6.380 -4.985 1.00 0.00 H new ATOM 0 HA LEU A 131 8.599 4.719 -5.056 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.826 4.271 -6.511 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.878 5.863 -7.241 1.00 0.00 H new ATOM 0 HG LEU A 131 8.856 5.293 -8.513 1.00 0.00 H new ATOM 0 HD11 LEU A 131 9.838 3.036 -8.426 1.00 0.00 H new ATOM 0 HD12 LEU A 131 9.976 3.877 -6.863 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.741 2.615 -7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 131 7.936 3.498 -9.928 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.765 3.095 -8.649 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.686 4.676 -9.462 1.00 0.00 H new ATOM 2091 N PRO A 132 9.451 7.368 -6.877 1.00 0.00 N ATOM 2092 CA PRO A 132 10.583 8.121 -7.425 1.00 0.00 C ATOM 2093 C PRO A 132 11.435 8.761 -6.335 1.00 0.00 C ATOM 2094 O PRO A 132 12.638 8.956 -6.509 1.00 0.00 O ATOM 2095 CB PRO A 132 9.911 9.198 -8.280 1.00 0.00 C ATOM 2096 CG PRO A 132 8.560 9.373 -7.677 1.00 0.00 C ATOM 2097 CD PRO A 132 8.161 8.020 -7.156 1.00 0.00 C ATOM 0 HA PRO A 132 11.268 7.481 -7.982 1.00 0.00 H new ATOM 0 HB2 PRO A 132 10.477 10.129 -8.260 1.00 0.00 H new ATOM 0 HB3 PRO A 132 9.842 8.889 -9.323 1.00 0.00 H new ATOM 0 HG2 PRO A 132 8.584 10.109 -6.874 1.00 0.00 H new ATOM 0 HG3 PRO A 132 7.846 9.732 -8.418 1.00 0.00 H new ATOM 0 HD2 PRO A 132 7.549 8.100 -6.258 1.00 0.00 H new ATOM 0 HD3 PRO A 132 7.579 7.462 -7.890 1.00 0.00 H new ATOM 2105 N ARG A 133 10.804 9.087 -5.211 1.00 0.00 N ATOM 2106 CA ARG A 133 11.506 9.705 -4.093 1.00 0.00 C ATOM 2107 C ARG A 133 12.145 8.647 -3.198 1.00 0.00 C ATOM 2108 O ARG A 133 12.983 8.958 -2.353 1.00 0.00 O ATOM 2109 CB ARG A 133 10.543 10.568 -3.274 1.00 0.00 C ATOM 2110 CG ARG A 133 10.112 11.841 -3.983 1.00 0.00 C ATOM 2111 CD ARG A 133 11.082 12.981 -3.719 1.00 0.00 C ATOM 2112 NE ARG A 133 10.537 14.272 -4.131 1.00 0.00 N ATOM 2113 CZ ARG A 133 11.019 15.439 -3.721 1.00 0.00 C ATOM 2114 NH1 ARG A 133 12.051 15.478 -2.890 1.00 0.00 N ATOM 2115 NH2 ARG A 133 10.468 16.571 -4.142 1.00 0.00 N ATOM 0 H ARG A 133 9.808 8.933 -5.051 1.00 0.00 H new ATOM 0 HA ARG A 133 12.296 10.337 -4.498 1.00 0.00 H new ATOM 0 HB2 ARG A 133 9.658 9.980 -3.032 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.019 10.832 -2.329 1.00 0.00 H new ATOM 0 HG2 ARG A 133 10.048 11.658 -5.056 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.115 12.126 -3.648 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.324 13.012 -2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.014 12.794 -4.252 1.00 0.00 H new ATOM 0 HE ARG A 133 9.742 14.277 -4.769 1.00 0.00 H new ATOM 0 HH11 ARG A 133 12.477 14.610 -2.564 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.420 16.376 -2.576 1.00 0.00 H new ATOM 0 HH21 ARG A 133 9.673 16.545 -4.781 1.00 0.00 H new ATOM 0 HH22 ARG A 133 10.839 17.467 -3.826 1.00 0.00 H new ATOM 2129 N PHE A 134 11.741 7.395 -3.391 1.00 0.00 N ATOM 2130 CA PHE A 134 12.272 6.291 -2.601 1.00 0.00 C ATOM 2131 C PHE A 134 13.574 5.768 -3.202 1.00 0.00 C ATOM 2132 O PHE A 134 14.577 5.619 -2.505 1.00 0.00 O ATOM 2133 CB PHE A 134 11.247 5.158 -2.514 1.00 0.00 C ATOM 2134 CG PHE A 134 11.814 3.876 -1.978 1.00 0.00 C ATOM 2135 CD1 PHE A 134 12.504 3.856 -0.776 1.00 0.00 C ATOM 2136 CD2 PHE A 134 11.658 2.688 -2.676 1.00 0.00 C ATOM 2137 CE1 PHE A 134 13.028 2.677 -0.281 1.00 0.00 C ATOM 2138 CE2 PHE A 134 12.179 1.505 -2.185 1.00 0.00 C ATOM 2139 CZ PHE A 134 12.865 1.500 -0.986 1.00 0.00 C ATOM 0 H PHE A 134 11.048 7.121 -4.087 1.00 0.00 H new ATOM 0 HA PHE A 134 12.479 6.663 -1.597 1.00 0.00 H new ATOM 0 HB2 PHE A 134 10.421 5.475 -1.877 1.00 0.00 H new ATOM 0 HB3 PHE A 134 10.833 4.976 -3.506 1.00 0.00 H new ATOM 0 HD1 PHE A 134 12.634 4.773 -0.220 1.00 0.00 H new ATOM 0 HD2 PHE A 134 11.123 2.687 -3.614 1.00 0.00 H new ATOM 0 HE1 PHE A 134 13.565 2.676 0.656 1.00 0.00 H new ATOM 0 HE2 PHE A 134 12.050 0.586 -2.738 1.00 0.00 H new ATOM 0 HZ PHE A 134 13.273 0.578 -0.600 1.00 0.00 H new ATOM 2149 N VAL A 135 13.549 5.492 -4.502 1.00 0.00 N ATOM 2150 CA VAL A 135 14.725 4.986 -5.199 1.00 0.00 C ATOM 2151 C VAL A 135 15.950 5.844 -4.901 1.00 0.00 C ATOM 2152 O VAL A 135 17.084 5.368 -4.963 1.00 0.00 O ATOM 2153 CB VAL A 135 14.500 4.943 -6.722 1.00 0.00 C ATOM 2154 CG1 VAL A 135 13.290 4.084 -7.059 1.00 0.00 C ATOM 2155 CG2 VAL A 135 14.335 6.351 -7.276 1.00 0.00 C ATOM 0 H VAL A 135 12.727 5.610 -5.094 1.00 0.00 H new ATOM 0 HA VAL A 135 14.897 3.972 -4.837 1.00 0.00 H new ATOM 0 HB VAL A 135 15.376 4.493 -7.189 1.00 0.00 H new ATOM 0 HG11 VAL A 135 13.147 4.065 -8.139 1.00 0.00 H new ATOM 0 HG12 VAL A 135 13.452 3.069 -6.697 1.00 0.00 H new ATOM 0 HG13 VAL A 135 12.403 4.502 -6.582 1.00 0.00 H new ATOM 0 HG21 VAL A 135 14.177 6.302 -8.353 1.00 0.00 H new ATOM 0 HG22 VAL A 135 13.476 6.829 -6.805 1.00 0.00 H new ATOM 0 HG23 VAL A 135 15.233 6.932 -7.067 1.00 0.00 H new ATOM 2165 N ARG A 136 15.714 7.111 -4.578 1.00 0.00 N ATOM 2166 CA ARG A 136 16.798 8.036 -4.271 1.00 0.00 C ATOM 2167 C ARG A 136 17.373 7.759 -2.885 1.00 0.00 C ATOM 2168 O ARG A 136 18.588 7.774 -2.691 1.00 0.00 O ATOM 2169 CB ARG A 136 16.303 9.481 -4.350 1.00 0.00 C ATOM 2170 CG ARG A 136 15.753 9.862 -5.715 1.00 0.00 C ATOM 2171 CD ARG A 136 15.961 11.340 -6.007 1.00 0.00 C ATOM 2172 NE ARG A 136 17.222 11.589 -6.701 1.00 0.00 N ATOM 2173 CZ ARG A 136 17.493 11.135 -7.919 1.00 0.00 C ATOM 2174 NH1 ARG A 136 16.596 10.412 -8.575 1.00 0.00 N ATOM 2175 NH2 ARG A 136 18.664 11.404 -8.482 1.00 0.00 N ATOM 0 H ARG A 136 14.782 7.521 -4.522 1.00 0.00 H new ATOM 0 HA ARG A 136 17.587 7.889 -5.009 1.00 0.00 H new ATOM 0 HB2 ARG A 136 15.527 9.632 -3.600 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.124 10.152 -4.098 1.00 0.00 H new ATOM 0 HG2 ARG A 136 16.242 9.266 -6.485 1.00 0.00 H new ATOM 0 HG3 ARG A 136 14.689 9.628 -5.758 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.134 11.709 -6.614 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.945 11.900 -5.072 1.00 0.00 H new ATOM 0 HE ARG A 136 17.934 12.142 -6.224 1.00 0.00 H new ATOM 0 HH11 ARG A 136 15.695 10.203 -8.144 1.00 0.00 H new ATOM 0 HH12 ARG A 136 16.807 10.064 -9.511 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.356 11.960 -7.979 1.00 0.00 H new ATOM 0 HH22 ARG A 136 18.872 11.055 -9.418 1.00 0.00 H new ATOM 2189 N SER A 137 16.489 7.509 -1.923 1.00 0.00 N ATOM 2190 CA SER A 137 16.908 7.234 -0.553 1.00 0.00 C ATOM 2191 C SER A 137 17.798 5.996 -0.496 1.00 0.00 C ATOM 2192 O SER A 137 17.480 4.963 -1.085 1.00 0.00 O ATOM 2193 CB SER A 137 15.686 7.041 0.347 1.00 0.00 C ATOM 2194 OG SER A 137 15.182 5.720 0.245 1.00 0.00 O ATOM 0 H SER A 137 15.479 7.491 -2.067 1.00 0.00 H new ATOM 0 HA SER A 137 17.482 8.089 -0.195 1.00 0.00 H new ATOM 0 HB2 SER A 137 15.955 7.252 1.382 1.00 0.00 H new ATOM 0 HB3 SER A 137 14.909 7.753 0.068 1.00 0.00 H new ATOM 0 HG SER A 137 14.908 5.545 -0.680 1.00 0.00 H new ATOM 2200 N GLU A 138 18.913 6.108 0.219 1.00 0.00 N ATOM 2201 CA GLU A 138 19.849 4.998 0.355 1.00 0.00 C ATOM 2202 C GLU A 138 19.106 3.667 0.425 1.00 0.00 C ATOM 2203 O GLU A 138 19.525 2.676 -0.176 1.00 0.00 O ATOM 2204 CB GLU A 138 20.713 5.179 1.603 1.00 0.00 C ATOM 2205 CG GLU A 138 20.040 5.990 2.698 1.00 0.00 C ATOM 2206 CD GLU A 138 20.296 7.479 2.563 1.00 0.00 C ATOM 2207 OE1 GLU A 138 21.309 7.852 1.933 1.00 0.00 O ATOM 2208 OE2 GLU A 138 19.483 8.270 3.084 1.00 0.00 O ATOM 0 H GLU A 138 19.190 6.956 0.713 1.00 0.00 H new ATOM 0 HA GLU A 138 20.493 4.990 -0.524 1.00 0.00 H new ATOM 0 HB2 GLU A 138 20.975 4.198 1.998 1.00 0.00 H new ATOM 0 HB3 GLU A 138 21.645 5.668 1.321 1.00 0.00 H new ATOM 0 HG2 GLU A 138 18.966 5.806 2.673 1.00 0.00 H new ATOM 0 HG3 GLU A 138 20.399 5.650 3.669 1.00 0.00 H new ATOM 2215 N PHE A 139 18.003 3.649 1.163 1.00 0.00 N ATOM 2216 CA PHE A 139 17.202 2.440 1.316 1.00 0.00 C ATOM 2217 C PHE A 139 17.232 1.604 0.039 1.00 0.00 C ATOM 2218 O PHE A 139 17.368 0.381 0.088 1.00 0.00 O ATOM 2219 CB PHE A 139 15.757 2.800 1.668 1.00 0.00 C ATOM 2220 CG PHE A 139 15.602 3.375 3.047 1.00 0.00 C ATOM 2221 CD1 PHE A 139 15.383 2.547 4.137 1.00 0.00 C ATOM 2222 CD2 PHE A 139 15.676 4.742 3.254 1.00 0.00 C ATOM 2223 CE1 PHE A 139 15.240 3.074 5.406 1.00 0.00 C ATOM 2224 CE2 PHE A 139 15.534 5.276 4.522 1.00 0.00 C ATOM 2225 CZ PHE A 139 15.317 4.439 5.600 1.00 0.00 C ATOM 0 H PHE A 139 17.642 4.459 1.666 1.00 0.00 H new ATOM 0 HA PHE A 139 17.630 1.851 2.127 1.00 0.00 H new ATOM 0 HB2 PHE A 139 15.382 3.518 0.939 1.00 0.00 H new ATOM 0 HB3 PHE A 139 15.137 1.907 1.583 1.00 0.00 H new ATOM 0 HD1 PHE A 139 15.324 1.478 3.993 1.00 0.00 H new ATOM 0 HD2 PHE A 139 15.847 5.400 2.415 1.00 0.00 H new ATOM 0 HE1 PHE A 139 15.068 2.418 6.247 1.00 0.00 H new ATOM 0 HE2 PHE A 139 15.593 6.344 4.669 1.00 0.00 H new ATOM 0 HZ PHE A 139 15.208 4.852 6.592 1.00 0.00 H new ATOM 2235 N TYR A 140 17.104 2.273 -1.102 1.00 0.00 N ATOM 2236 CA TYR A 140 17.114 1.593 -2.392 1.00 0.00 C ATOM 2237 C TYR A 140 18.542 1.283 -2.833 1.00 0.00 C ATOM 2238 O TYR A 140 18.832 0.181 -3.298 1.00 0.00 O ATOM 2239 CB TYR A 140 16.416 2.451 -3.449 1.00 0.00 C ATOM 2240 CG TYR A 140 16.301 1.774 -4.796 1.00 0.00 C ATOM 2241 CD1 TYR A 140 17.346 1.819 -5.710 1.00 0.00 C ATOM 2242 CD2 TYR A 140 15.145 1.091 -5.156 1.00 0.00 C ATOM 2243 CE1 TYR A 140 17.245 1.204 -6.943 1.00 0.00 C ATOM 2244 CE2 TYR A 140 15.036 0.471 -6.385 1.00 0.00 C ATOM 2245 CZ TYR A 140 16.087 0.531 -7.276 1.00 0.00 C ATOM 2246 OH TYR A 140 15.981 -0.084 -8.502 1.00 0.00 O ATOM 0 H TYR A 140 16.992 3.285 -1.160 1.00 0.00 H new ATOM 0 HA TYR A 140 16.575 0.652 -2.283 1.00 0.00 H new ATOM 0 HB2 TYR A 140 15.418 2.709 -3.095 1.00 0.00 H new ATOM 0 HB3 TYR A 140 16.964 3.386 -3.567 1.00 0.00 H new ATOM 0 HD1 TYR A 140 18.254 2.344 -5.452 1.00 0.00 H new ATOM 0 HD2 TYR A 140 14.318 1.045 -4.463 1.00 0.00 H new ATOM 0 HE1 TYR A 140 18.067 1.250 -7.642 1.00 0.00 H new ATOM 0 HE2 TYR A 140 14.132 -0.058 -6.647 1.00 0.00 H new ATOM 0 HH TYR A 140 15.123 -0.554 -8.559 1.00 0.00 H new ATOM 2256 N GLN A 141 19.427 2.263 -2.684 1.00 0.00 N ATOM 2257 CA GLN A 141 20.823 2.095 -3.067 1.00 0.00 C ATOM 2258 C GLN A 141 21.393 0.802 -2.494 1.00 0.00 C ATOM 2259 O GLN A 141 22.220 0.144 -3.125 1.00 0.00 O ATOM 2260 CB GLN A 141 21.653 3.288 -2.587 1.00 0.00 C ATOM 2261 CG GLN A 141 21.184 4.620 -3.151 1.00 0.00 C ATOM 2262 CD GLN A 141 21.232 4.663 -4.665 1.00 0.00 C ATOM 2263 OE1 GLN A 141 22.302 4.577 -5.267 1.00 0.00 O ATOM 2264 NE2 GLN A 141 20.068 4.795 -5.291 1.00 0.00 N ATOM 0 H GLN A 141 19.202 3.181 -2.301 1.00 0.00 H new ATOM 0 HA GLN A 141 20.871 2.042 -4.155 1.00 0.00 H new ATOM 0 HB2 GLN A 141 21.617 3.331 -1.498 1.00 0.00 H new ATOM 0 HB3 GLN A 141 22.695 3.131 -2.866 1.00 0.00 H new ATOM 0 HG2 GLN A 141 20.164 4.812 -2.818 1.00 0.00 H new ATOM 0 HG3 GLN A 141 21.806 5.420 -2.749 1.00 0.00 H new ATOM 0 HE21 GLN A 141 19.204 4.863 -4.753 1.00 0.00 H new ATOM 0 HE22 GLN A 141 20.038 4.828 -6.310 1.00 0.00 H new ATOM 2273 N GLU A 142 20.947 0.445 -1.294 1.00 0.00 N ATOM 2274 CA GLU A 142 21.414 -0.770 -0.636 1.00 0.00 C ATOM 2275 C GLU A 142 20.738 -2.004 -1.227 1.00 0.00 C ATOM 2276 O GLU A 142 21.282 -3.108 -1.177 1.00 0.00 O ATOM 2277 CB GLU A 142 21.143 -0.699 0.868 1.00 0.00 C ATOM 2278 CG GLU A 142 19.676 -0.852 1.230 1.00 0.00 C ATOM 2279 CD GLU A 142 19.474 -1.499 2.586 1.00 0.00 C ATOM 2280 OE1 GLU A 142 19.561 -0.783 3.605 1.00 0.00 O ATOM 2281 OE2 GLU A 142 19.229 -2.723 2.629 1.00 0.00 O ATOM 0 H GLU A 142 20.263 0.979 -0.758 1.00 0.00 H new ATOM 0 HA GLU A 142 22.488 -0.851 -0.801 1.00 0.00 H new ATOM 0 HB2 GLU A 142 21.715 -1.480 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 142 21.505 0.256 1.249 1.00 0.00 H new ATOM 0 HG2 GLU A 142 19.200 0.129 1.225 1.00 0.00 H new ATOM 0 HG3 GLU A 142 19.178 -1.452 0.468 1.00 0.00 H new ATOM 2288 N LEU A 143 19.550 -1.809 -1.788 1.00 0.00 N ATOM 2289 CA LEU A 143 18.798 -2.905 -2.389 1.00 0.00 C ATOM 2290 C LEU A 143 19.464 -3.380 -3.677 1.00 0.00 C ATOM 2291 O LEU A 143 19.430 -4.567 -4.003 1.00 0.00 O ATOM 2292 CB LEU A 143 17.361 -2.466 -2.678 1.00 0.00 C ATOM 2293 CG LEU A 143 16.459 -2.279 -1.457 1.00 0.00 C ATOM 2294 CD1 LEU A 143 15.252 -1.425 -1.812 1.00 0.00 C ATOM 2295 CD2 LEU A 143 16.018 -3.628 -0.908 1.00 0.00 C ATOM 0 H LEU A 143 19.086 -0.902 -1.839 1.00 0.00 H new ATOM 0 HA LEU A 143 18.783 -3.734 -1.681 1.00 0.00 H new ATOM 0 HB2 LEU A 143 17.393 -1.526 -3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 143 16.902 -3.205 -3.335 1.00 0.00 H new ATOM 0 HG LEU A 143 17.028 -1.764 -0.683 1.00 0.00 H new ATOM 0 HD11 LEU A 143 14.621 -1.302 -0.931 1.00 0.00 H new ATOM 0 HD12 LEU A 143 15.587 -0.447 -2.157 1.00 0.00 H new ATOM 0 HD13 LEU A 143 14.681 -1.913 -2.602 1.00 0.00 H new ATOM 0 HD21 LEU A 143 15.377 -3.476 -0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 143 15.466 -4.170 -1.676 1.00 0.00 H new ATOM 0 HD23 LEU A 143 16.895 -4.206 -0.615 1.00 0.00 H new ATOM 2307 N ILE A 144 20.071 -2.447 -4.403 1.00 0.00 N ATOM 2308 CA ILE A 144 20.748 -2.772 -5.652 1.00 0.00 C ATOM 2309 C ILE A 144 22.256 -2.875 -5.449 1.00 0.00 C ATOM 2310 O ILE A 144 22.907 -3.763 -6.000 1.00 0.00 O ATOM 2311 CB ILE A 144 20.459 -1.720 -6.739 1.00 0.00 C ATOM 2312 CG1 ILE A 144 20.796 -0.318 -6.226 1.00 0.00 C ATOM 2313 CG2 ILE A 144 19.003 -1.794 -7.174 1.00 0.00 C ATOM 2314 CD1 ILE A 144 20.705 0.752 -7.291 1.00 0.00 C ATOM 0 H ILE A 144 20.108 -1.460 -4.148 1.00 0.00 H new ATOM 0 HA ILE A 144 20.361 -3.737 -5.979 1.00 0.00 H new ATOM 0 HB ILE A 144 21.088 -1.931 -7.604 1.00 0.00 H new ATOM 0 HG12 ILE A 144 20.119 -0.066 -5.410 1.00 0.00 H new ATOM 0 HG13 ILE A 144 21.805 -0.324 -5.813 1.00 0.00 H new ATOM 0 HG21 ILE A 144 18.814 -1.044 -7.943 1.00 0.00 H new ATOM 0 HG22 ILE A 144 18.793 -2.786 -7.575 1.00 0.00 H new ATOM 0 HG23 ILE A 144 18.357 -1.605 -6.317 1.00 0.00 H new ATOM 0 HD11 ILE A 144 20.957 1.720 -6.857 1.00 0.00 H new ATOM 0 HD12 ILE A 144 21.402 0.523 -8.097 1.00 0.00 H new ATOM 0 HD13 ILE A 144 19.690 0.785 -7.688 1.00 0.00 H new