USER MOD reduce.3.24.130724 H: found=0, std=0, add=520, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 521 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 Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 100:sc= -2.49! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 CYS SG : rot 160:sc= -1.5 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -156:sc= 1.16 (180deg=0.745) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -0.0356 X(o=-0.036,f=-0.036) USER MOD Single : A 55 ASN : amide:sc=-0.000577 K(o=-0.00058,f=-0.93) USER MOD Single : A 62 GLN : amide:sc= -0.14 K(o=-0.14,f=-1.7!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc=-0.00082 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= -0.113 USER MOD Single : A 77 GLN : amide:sc= -0.448 K(o=-0.45,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 180 N PHE A 15 4.330 -19.770 -17.166 1.00 0.00 N ATOM 181 CA PHE A 15 5.406 -20.749 -17.071 1.00 0.00 C ATOM 182 C PHE A 15 5.456 -21.624 -18.320 1.00 0.00 C ATOM 183 O PHE A 15 4.443 -21.830 -18.988 1.00 0.00 O ATOM 184 CB PHE A 15 5.220 -21.624 -15.829 1.00 0.00 C ATOM 185 CG PHE A 15 5.865 -21.059 -14.596 1.00 0.00 C ATOM 186 CD1 PHE A 15 5.478 -19.824 -14.100 1.00 0.00 C ATOM 187 CD2 PHE A 15 6.858 -21.762 -13.933 1.00 0.00 C ATOM 188 CE1 PHE A 15 6.071 -19.302 -12.966 1.00 0.00 C ATOM 189 CE2 PHE A 15 7.454 -21.245 -12.798 1.00 0.00 C ATOM 190 CZ PHE A 15 7.059 -20.013 -12.313 1.00 0.00 C ATOM 0 HA PHE A 15 6.349 -20.209 -16.989 1.00 0.00 H new ATOM 0 HB2 PHE A 15 4.154 -21.756 -15.644 1.00 0.00 H new ATOM 0 HB3 PHE A 15 5.634 -22.613 -16.026 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.705 -19.264 -14.605 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.170 -22.726 -14.308 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.762 -18.338 -12.590 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.227 -21.803 -12.291 1.00 0.00 H new ATOM 0 HZ PHE A 15 7.522 -19.607 -11.426 1.00 0.00 H new ATOM 200 N ARG A 16 6.644 -22.135 -18.630 1.00 0.00 N ATOM 201 CA ARG A 16 6.828 -22.986 -19.800 1.00 0.00 C ATOM 202 C ARG A 16 5.959 -24.237 -19.704 1.00 0.00 C ATOM 203 O ARG A 16 5.134 -24.500 -20.578 1.00 0.00 O ATOM 204 CB ARG A 16 8.298 -23.382 -19.942 1.00 0.00 C ATOM 205 CG ARG A 16 8.577 -24.268 -21.145 1.00 0.00 C ATOM 206 CD ARG A 16 10.068 -24.390 -21.414 1.00 0.00 C ATOM 207 NE ARG A 16 10.463 -25.769 -21.692 1.00 0.00 N ATOM 208 CZ ARG A 16 11.709 -26.215 -21.570 1.00 0.00 C ATOM 209 NH1 ARG A 16 12.674 -25.396 -21.176 1.00 0.00 N ATOM 210 NH2 ARG A 16 11.990 -27.483 -21.841 1.00 0.00 N ATOM 0 H ARG A 16 7.493 -21.974 -18.087 1.00 0.00 H new ATOM 0 HA ARG A 16 6.525 -22.421 -20.681 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.903 -22.479 -20.019 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.614 -23.902 -19.038 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.155 -25.258 -20.974 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.080 -23.857 -22.024 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.337 -23.758 -22.261 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.623 -24.021 -20.552 1.00 0.00 H new ATOM 0 HE ARG A 16 9.743 -26.425 -21.996 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.461 -24.421 -20.966 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.629 -25.741 -21.083 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.250 -28.116 -22.143 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.946 -27.825 -21.747 1.00 0.00 H new ATOM 224 N SER A 17 6.152 -25.005 -18.636 1.00 0.00 N ATOM 225 CA SER A 17 5.390 -26.230 -18.428 1.00 0.00 C ATOM 226 C SER A 17 3.893 -25.969 -18.568 1.00 0.00 C ATOM 227 O SER A 17 3.137 -26.844 -18.989 1.00 0.00 O ATOM 228 CB SER A 17 5.691 -26.814 -17.046 1.00 0.00 C ATOM 229 OG SER A 17 4.519 -27.343 -16.450 1.00 0.00 O ATOM 0 H SER A 17 6.830 -24.800 -17.902 1.00 0.00 H new ATOM 0 HA SER A 17 5.688 -26.949 -19.191 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.443 -27.598 -17.135 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.112 -26.040 -16.404 1.00 0.00 H new ATOM 0 HG SER A 17 4.738 -27.712 -15.569 1.00 0.00 H new ATOM 235 N GLU A 18 3.474 -24.759 -18.210 1.00 0.00 N ATOM 236 CA GLU A 18 2.068 -24.383 -18.295 1.00 0.00 C ATOM 237 C GLU A 18 1.638 -24.207 -19.748 1.00 0.00 C ATOM 238 O GLU A 18 0.544 -24.615 -20.138 1.00 0.00 O ATOM 239 CB GLU A 18 1.815 -23.091 -17.516 1.00 0.00 C ATOM 240 CG GLU A 18 0.427 -22.510 -17.734 1.00 0.00 C ATOM 241 CD GLU A 18 -0.673 -23.424 -17.230 1.00 0.00 C ATOM 242 OE1 GLU A 18 -0.346 -24.482 -16.652 1.00 0.00 O ATOM 243 OE2 GLU A 18 -1.859 -23.083 -17.414 1.00 0.00 O ATOM 0 H GLU A 18 4.087 -24.024 -17.859 1.00 0.00 H new ATOM 0 HA GLU A 18 1.477 -25.186 -17.855 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.956 -23.284 -16.453 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.560 -22.350 -17.806 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.356 -21.548 -17.227 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.279 -22.321 -18.797 1.00 0.00 H new ATOM 250 N VAL A 19 2.507 -23.594 -20.546 1.00 0.00 N ATOM 251 CA VAL A 19 2.219 -23.362 -21.956 1.00 0.00 C ATOM 252 C VAL A 19 2.301 -24.659 -22.754 1.00 0.00 C ATOM 253 O VAL A 19 1.551 -24.861 -23.710 1.00 0.00 O ATOM 254 CB VAL A 19 3.191 -22.335 -22.567 1.00 0.00 C ATOM 255 CG1 VAL A 19 2.880 -22.115 -24.039 1.00 0.00 C ATOM 256 CG2 VAL A 19 3.131 -21.024 -21.799 1.00 0.00 C ATOM 0 H VAL A 19 3.417 -23.249 -20.239 1.00 0.00 H new ATOM 0 HA VAL A 19 1.204 -22.968 -22.010 1.00 0.00 H new ATOM 0 HB VAL A 19 4.204 -22.729 -22.490 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.577 -21.386 -24.453 1.00 0.00 H new ATOM 0 HG12 VAL A 19 2.979 -23.058 -24.577 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.861 -21.743 -24.144 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.824 -20.310 -22.244 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.118 -20.623 -21.843 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.408 -21.198 -20.759 1.00 0.00 H new ATOM 266 N LEU A 20 3.215 -25.536 -22.354 1.00 0.00 N ATOM 267 CA LEU A 20 3.395 -26.816 -23.031 1.00 0.00 C ATOM 268 C LEU A 20 2.122 -27.652 -22.962 1.00 0.00 C ATOM 269 O LEU A 20 1.919 -28.560 -23.767 1.00 0.00 O ATOM 270 CB LEU A 20 4.559 -27.587 -22.405 1.00 0.00 C ATOM 271 CG LEU A 20 5.929 -27.376 -23.052 1.00 0.00 C ATOM 272 CD1 LEU A 20 5.940 -27.928 -24.469 1.00 0.00 C ATOM 273 CD2 LEU A 20 6.298 -25.899 -23.050 1.00 0.00 C ATOM 0 H LEU A 20 3.843 -25.385 -21.565 1.00 0.00 H new ATOM 0 HA LEU A 20 3.620 -26.616 -24.079 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.629 -27.309 -21.353 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.324 -28.651 -22.438 1.00 0.00 H new ATOM 0 HG LEU A 20 6.673 -27.917 -22.467 1.00 0.00 H new ATOM 0 HD11 LEU A 20 6.922 -27.769 -24.914 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.721 -28.995 -24.445 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.185 -27.416 -25.065 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.276 -25.768 -23.514 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.551 -25.337 -23.611 1.00 0.00 H new ATOM 0 HD23 LEU A 20 6.332 -25.534 -22.024 1.00 0.00 H new ATOM 285 N GLY A 21 1.264 -27.337 -21.996 1.00 0.00 N ATOM 286 CA GLY A 21 0.019 -28.067 -21.842 1.00 0.00 C ATOM 287 C GLY A 21 -1.193 -27.227 -22.191 1.00 0.00 C ATOM 288 O GLY A 21 -2.314 -27.550 -21.797 1.00 0.00 O ATOM 0 H GLY A 21 1.409 -26.589 -21.317 1.00 0.00 H new ATOM 0 HA2 GLY A 21 0.039 -28.952 -22.478 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -0.069 -28.416 -20.813 1.00 0.00 H new ATOM 292 N TRP A 22 -0.969 -26.146 -22.928 1.00 0.00 N ATOM 293 CA TRP A 22 -2.053 -25.255 -23.328 1.00 0.00 C ATOM 294 C TRP A 22 -2.697 -25.729 -24.626 1.00 0.00 C ATOM 295 O TRP A 22 -2.311 -26.759 -25.181 1.00 0.00 O ATOM 296 CB TRP A 22 -1.531 -23.827 -23.495 1.00 0.00 C ATOM 297 CG TRP A 22 -1.584 -23.024 -22.231 1.00 0.00 C ATOM 298 CD1 TRP A 22 -1.965 -23.464 -20.995 1.00 0.00 C ATOM 299 CD2 TRP A 22 -1.245 -21.641 -22.080 1.00 0.00 C ATOM 300 NE1 TRP A 22 -1.884 -22.437 -20.085 1.00 0.00 N ATOM 301 CE2 TRP A 22 -1.444 -21.309 -20.725 1.00 0.00 C ATOM 302 CE3 TRP A 22 -0.792 -20.651 -22.956 1.00 0.00 C ATOM 303 CZ2 TRP A 22 -1.206 -20.030 -20.230 1.00 0.00 C ATOM 304 CZ3 TRP A 22 -0.556 -19.382 -22.462 1.00 0.00 C ATOM 305 CH2 TRP A 22 -0.763 -19.080 -21.110 1.00 0.00 C ATOM 0 H TRP A 22 -0.047 -25.864 -23.261 1.00 0.00 H new ATOM 0 HA TRP A 22 -2.809 -25.269 -22.543 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -0.501 -23.863 -23.851 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -2.116 -23.321 -24.263 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -2.283 -24.471 -20.767 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -2.114 -22.504 -19.094 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -0.629 -20.873 -24.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -1.365 -19.795 -19.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -0.206 -18.609 -23.130 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -0.569 -18.078 -20.755 1.00 0.00 H new ATOM 316 N ASP A 23 -3.678 -24.973 -25.105 1.00 0.00 N ATOM 317 CA ASP A 23 -4.375 -25.316 -26.339 1.00 0.00 C ATOM 318 C ASP A 23 -4.500 -24.098 -27.249 1.00 0.00 C ATOM 319 O ASP A 23 -4.332 -22.955 -26.824 1.00 0.00 O ATOM 320 CB ASP A 23 -5.762 -25.881 -26.028 1.00 0.00 C ATOM 321 CG ASP A 23 -5.910 -26.280 -24.573 1.00 0.00 C ATOM 322 OD1 ASP A 23 -5.094 -27.096 -24.095 1.00 0.00 O ATOM 323 OD2 ASP A 23 -6.843 -25.778 -23.911 1.00 0.00 O ATOM 0 H ASP A 23 -4.009 -24.118 -24.658 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.791 -26.076 -26.857 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -6.519 -25.137 -26.277 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.948 -26.749 -26.661 1.00 0.00 H new ATOM 328 N PRO A 24 -4.802 -24.346 -28.532 1.00 0.00 N ATOM 329 CA PRO A 24 -4.957 -23.282 -29.529 1.00 0.00 C ATOM 330 C PRO A 24 -6.209 -22.445 -29.294 1.00 0.00 C ATOM 331 O PRO A 24 -6.421 -21.429 -29.956 1.00 0.00 O ATOM 332 CB PRO A 24 -5.065 -24.047 -30.850 1.00 0.00 C ATOM 333 CG PRO A 24 -5.586 -25.390 -30.469 1.00 0.00 C ATOM 334 CD PRO A 24 -5.017 -25.684 -29.109 1.00 0.00 C ATOM 0 HA PRO A 24 -4.131 -22.571 -29.498 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -5.738 -23.544 -31.545 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.096 -24.124 -31.343 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -6.676 -25.393 -30.445 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -5.281 -26.147 -31.192 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -5.705 -26.276 -28.505 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -4.086 -26.247 -29.176 1.00 0.00 H new ATOM 342 N ASP A 25 -7.036 -22.878 -28.348 1.00 0.00 N ATOM 343 CA ASP A 25 -8.267 -22.167 -28.025 1.00 0.00 C ATOM 344 C ASP A 25 -8.165 -21.497 -26.658 1.00 0.00 C ATOM 345 O ASP A 25 -8.891 -20.547 -26.366 1.00 0.00 O ATOM 346 CB ASP A 25 -9.457 -23.128 -28.047 1.00 0.00 C ATOM 347 CG ASP A 25 -10.785 -22.403 -28.144 1.00 0.00 C ATOM 348 OD1 ASP A 25 -11.013 -21.715 -29.161 1.00 0.00 O ATOM 349 OD2 ASP A 25 -11.597 -22.525 -27.203 1.00 0.00 O ATOM 0 H ASP A 25 -6.876 -23.718 -27.792 1.00 0.00 H new ATOM 0 HA ASP A 25 -8.419 -21.394 -28.779 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.355 -23.808 -28.892 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -9.444 -23.738 -27.144 1.00 0.00 H new ATOM 354 N SER A 26 -7.259 -21.998 -25.825 1.00 0.00 N ATOM 355 CA SER A 26 -7.065 -21.451 -24.487 1.00 0.00 C ATOM 356 C SER A 26 -5.967 -20.392 -24.488 1.00 0.00 C ATOM 357 O SER A 26 -6.107 -19.335 -23.871 1.00 0.00 O ATOM 358 CB SER A 26 -6.711 -22.568 -23.503 1.00 0.00 C ATOM 359 OG SER A 26 -7.712 -22.708 -22.510 1.00 0.00 O ATOM 0 H SER A 26 -6.647 -22.782 -26.053 1.00 0.00 H new ATOM 0 HA SER A 26 -7.998 -20.983 -24.173 1.00 0.00 H new ATOM 0 HB2 SER A 26 -6.595 -23.508 -24.042 1.00 0.00 H new ATOM 0 HB3 SER A 26 -5.753 -22.351 -23.030 1.00 0.00 H new ATOM 0 HG SER A 26 -7.464 -23.429 -21.894 1.00 0.00 H new ATOM 365 N LEU A 27 -4.874 -20.682 -25.184 1.00 0.00 N ATOM 366 CA LEU A 27 -3.750 -19.755 -25.267 1.00 0.00 C ATOM 367 C LEU A 27 -4.220 -18.365 -25.684 1.00 0.00 C ATOM 368 O LEU A 27 -3.635 -17.357 -25.289 1.00 0.00 O ATOM 369 CB LEU A 27 -2.708 -20.273 -26.260 1.00 0.00 C ATOM 370 CG LEU A 27 -1.702 -19.243 -26.775 1.00 0.00 C ATOM 371 CD1 LEU A 27 -0.926 -18.630 -25.620 1.00 0.00 C ATOM 372 CD2 LEU A 27 -0.754 -19.880 -27.780 1.00 0.00 C ATOM 0 H LEU A 27 -4.741 -21.552 -25.700 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.296 -19.683 -24.278 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.156 -21.085 -25.786 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.231 -20.700 -27.116 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.251 -18.447 -27.278 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.215 -17.900 -26.006 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.618 -18.137 -24.938 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.388 -19.414 -25.087 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.045 -19.132 -28.136 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.212 -20.696 -27.302 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.325 -20.269 -28.623 1.00 0.00 H new ATOM 384 N ALA A 28 -5.281 -18.320 -26.482 1.00 0.00 N ATOM 385 CA ALA A 28 -5.833 -17.054 -26.949 1.00 0.00 C ATOM 386 C ALA A 28 -6.200 -16.150 -25.777 1.00 0.00 C ATOM 387 O ALA A 28 -6.108 -14.926 -25.872 1.00 0.00 O ATOM 388 CB ALA A 28 -7.049 -17.301 -27.829 1.00 0.00 C ATOM 0 H ALA A 28 -5.776 -19.146 -26.819 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.069 -16.548 -27.539 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.451 -16.347 -28.170 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -6.758 -17.902 -28.691 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.810 -17.831 -27.257 1.00 0.00 H new ATOM 394 N ASP A 29 -6.618 -16.760 -24.674 1.00 0.00 N ATOM 395 CA ASP A 29 -6.999 -16.010 -23.483 1.00 0.00 C ATOM 396 C ASP A 29 -5.806 -15.248 -22.915 1.00 0.00 C ATOM 397 O ASP A 29 -5.926 -14.086 -22.525 1.00 0.00 O ATOM 398 CB ASP A 29 -7.570 -16.952 -22.421 1.00 0.00 C ATOM 399 CG ASP A 29 -8.004 -16.217 -21.168 1.00 0.00 C ATOM 400 OD1 ASP A 29 -8.824 -15.283 -21.282 1.00 0.00 O ATOM 401 OD2 ASP A 29 -7.521 -16.576 -20.073 1.00 0.00 O ATOM 0 H ASP A 29 -6.702 -17.772 -24.580 1.00 0.00 H new ATOM 0 HA ASP A 29 -7.765 -15.289 -23.768 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -8.422 -17.490 -22.837 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -6.819 -17.698 -22.160 1.00 0.00 H new ATOM 406 N TYR A 30 -4.655 -15.910 -22.871 1.00 0.00 N ATOM 407 CA TYR A 30 -3.440 -15.296 -22.348 1.00 0.00 C ATOM 408 C TYR A 30 -3.177 -13.951 -23.018 1.00 0.00 C ATOM 409 O TYR A 30 -2.857 -12.965 -22.354 1.00 0.00 O ATOM 410 CB TYR A 30 -2.243 -16.225 -22.557 1.00 0.00 C ATOM 411 CG TYR A 30 -0.910 -15.568 -22.279 1.00 0.00 C ATOM 412 CD1 TYR A 30 -0.739 -14.736 -21.180 1.00 0.00 C ATOM 413 CD2 TYR A 30 0.179 -15.780 -23.116 1.00 0.00 C ATOM 414 CE1 TYR A 30 0.477 -14.132 -20.923 1.00 0.00 C ATOM 415 CE2 TYR A 30 1.399 -15.182 -22.866 1.00 0.00 C ATOM 416 CZ TYR A 30 1.543 -14.359 -21.769 1.00 0.00 C ATOM 417 OH TYR A 30 2.756 -13.761 -21.516 1.00 0.00 O ATOM 0 H TYR A 30 -4.538 -16.871 -23.191 1.00 0.00 H new ATOM 0 HA TYR A 30 -3.579 -15.128 -21.280 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -2.352 -17.095 -21.909 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -2.252 -16.589 -23.584 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -1.571 -14.558 -20.515 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.070 -16.423 -23.977 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.592 -13.486 -20.065 1.00 0.00 H new ATOM 0 HE2 TYR A 30 2.235 -15.358 -23.526 1.00 0.00 H new ATOM 0 HH TYR A 30 3.354 -14.405 -21.081 1.00 0.00 H new ATOM 427 N PHE A 31 -3.315 -13.919 -24.339 1.00 0.00 N ATOM 428 CA PHE A 31 -3.093 -12.695 -25.102 1.00 0.00 C ATOM 429 C PHE A 31 -4.147 -11.645 -24.764 1.00 0.00 C ATOM 430 O PHE A 31 -3.839 -10.460 -24.634 1.00 0.00 O ATOM 431 CB PHE A 31 -3.115 -12.993 -26.602 1.00 0.00 C ATOM 432 CG PHE A 31 -1.966 -13.844 -27.062 1.00 0.00 C ATOM 433 CD1 PHE A 31 -0.677 -13.335 -27.086 1.00 0.00 C ATOM 434 CD2 PHE A 31 -2.174 -15.151 -27.471 1.00 0.00 C ATOM 435 CE1 PHE A 31 0.383 -14.115 -27.509 1.00 0.00 C ATOM 436 CE2 PHE A 31 -1.118 -15.936 -27.894 1.00 0.00 C ATOM 437 CZ PHE A 31 0.162 -15.417 -27.914 1.00 0.00 C ATOM 0 H PHE A 31 -3.579 -14.726 -24.904 1.00 0.00 H new ATOM 0 HA PHE A 31 -2.113 -12.300 -24.832 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.050 -13.494 -26.851 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -3.102 -12.052 -27.151 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -0.499 -12.318 -26.771 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -3.173 -15.561 -27.459 1.00 0.00 H new ATOM 0 HE1 PHE A 31 1.383 -13.707 -27.523 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.293 -16.954 -28.209 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.988 -16.028 -28.246 1.00 0.00 H new ATOM 447 N LYS A 32 -5.391 -12.088 -24.624 1.00 0.00 N ATOM 448 CA LYS A 32 -6.492 -11.189 -24.301 1.00 0.00 C ATOM 449 C LYS A 32 -6.194 -10.396 -23.032 1.00 0.00 C ATOM 450 O LYS A 32 -6.700 -9.290 -22.845 1.00 0.00 O ATOM 451 CB LYS A 32 -7.790 -11.980 -24.127 1.00 0.00 C ATOM 452 CG LYS A 32 -9.028 -11.105 -24.030 1.00 0.00 C ATOM 453 CD LYS A 32 -10.125 -11.778 -23.221 1.00 0.00 C ATOM 454 CE LYS A 32 -11.468 -11.096 -23.428 1.00 0.00 C ATOM 455 NZ LYS A 32 -12.425 -11.411 -22.331 1.00 0.00 N ATOM 0 H LYS A 32 -5.662 -13.066 -24.729 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.609 -10.488 -25.127 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.904 -12.664 -24.968 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.716 -12.591 -23.227 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.766 -10.153 -23.568 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.397 -10.883 -25.031 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.200 -12.827 -23.509 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.864 -11.756 -22.163 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.323 -10.017 -23.484 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.892 -11.411 -24.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -13.328 -10.927 -22.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.584 -12.438 -22.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.032 -11.088 -21.424 1.00 0.00 H new ATOM 469 N LYS A 33 -5.367 -10.968 -22.164 1.00 0.00 N ATOM 470 CA LYS A 33 -4.998 -10.315 -20.914 1.00 0.00 C ATOM 471 C LYS A 33 -3.864 -9.319 -21.135 1.00 0.00 C ATOM 472 O LYS A 33 -3.717 -8.353 -20.384 1.00 0.00 O ATOM 473 CB LYS A 33 -4.580 -11.357 -19.874 1.00 0.00 C ATOM 474 CG LYS A 33 -5.675 -12.354 -19.537 1.00 0.00 C ATOM 475 CD LYS A 33 -5.101 -13.716 -19.187 1.00 0.00 C ATOM 476 CE LYS A 33 -4.931 -13.880 -17.685 1.00 0.00 C ATOM 477 NZ LYS A 33 -3.500 -14.035 -17.302 1.00 0.00 N ATOM 0 H LYS A 33 -4.939 -11.883 -22.303 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.869 -9.772 -20.546 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.709 -11.898 -20.244 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -4.273 -10.845 -18.962 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.263 -11.980 -18.699 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.353 -12.451 -20.385 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.759 -14.498 -19.567 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.137 -13.843 -19.679 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.351 -13.013 -17.175 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.493 -14.751 -17.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -3.427 -14.144 -16.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.105 -14.877 -17.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.968 -13.193 -17.600 1.00 0.00 H new ATOM 491 N LEU A 34 -3.065 -9.558 -22.169 1.00 0.00 N ATOM 492 CA LEU A 34 -1.945 -8.681 -22.490 1.00 0.00 C ATOM 493 C LEU A 34 -2.357 -7.619 -23.504 1.00 0.00 C ATOM 494 O LEU A 34 -1.511 -6.980 -24.127 1.00 0.00 O ATOM 495 CB LEU A 34 -0.773 -9.497 -23.037 1.00 0.00 C ATOM 496 CG LEU A 34 -0.274 -10.637 -22.147 1.00 0.00 C ATOM 497 CD1 LEU A 34 0.786 -11.454 -22.870 1.00 0.00 C ATOM 498 CD2 LEU A 34 0.273 -10.089 -20.837 1.00 0.00 C ATOM 0 H LEU A 34 -3.172 -10.352 -22.800 1.00 0.00 H new ATOM 0 HA LEU A 34 -1.634 -8.180 -21.573 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.066 -9.916 -23.999 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.059 -8.819 -23.225 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.116 -11.292 -21.921 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.129 -12.260 -22.222 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.361 -11.877 -23.781 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.628 -10.812 -23.127 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.624 -10.913 -20.216 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.102 -9.412 -21.044 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.514 -9.548 -20.312 1.00 0.00 H new ATOM 510 N ASN A 35 -3.664 -7.436 -23.663 1.00 0.00 N ATOM 511 CA ASN A 35 -4.190 -6.451 -24.600 1.00 0.00 C ATOM 512 C ASN A 35 -3.799 -6.800 -26.033 1.00 0.00 C ATOM 513 O ASN A 35 -3.800 -5.941 -26.915 1.00 0.00 O ATOM 514 CB ASN A 35 -3.675 -5.054 -24.246 1.00 0.00 C ATOM 515 CG ASN A 35 -4.784 -4.130 -23.780 1.00 0.00 C ATOM 516 OD1 ASN A 35 -5.098 -3.138 -24.438 1.00 0.00 O ATOM 517 ND2 ASN A 35 -5.382 -4.453 -22.639 1.00 0.00 N ATOM 0 H ASN A 35 -4.378 -7.957 -23.155 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.277 -6.461 -24.526 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -2.921 -5.135 -23.463 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.185 -4.619 -25.117 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -6.135 -3.869 -22.275 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -5.089 -5.285 -22.127 1.00 0.00 H new ATOM 524 N TYR A 36 -3.467 -8.067 -26.257 1.00 0.00 N ATOM 525 CA TYR A 36 -3.072 -8.530 -27.582 1.00 0.00 C ATOM 526 C TYR A 36 -4.229 -9.243 -28.277 1.00 0.00 C ATOM 527 O TYR A 36 -4.176 -10.449 -28.518 1.00 0.00 O ATOM 528 CB TYR A 36 -1.869 -9.469 -27.480 1.00 0.00 C ATOM 529 CG TYR A 36 -0.592 -8.773 -27.063 1.00 0.00 C ATOM 530 CD1 TYR A 36 -0.239 -7.544 -27.607 1.00 0.00 C ATOM 531 CD2 TYR A 36 0.261 -9.345 -26.128 1.00 0.00 C ATOM 532 CE1 TYR A 36 0.926 -6.905 -27.230 1.00 0.00 C ATOM 533 CE2 TYR A 36 1.428 -8.713 -25.744 1.00 0.00 C ATOM 534 CZ TYR A 36 1.756 -7.493 -26.298 1.00 0.00 C ATOM 535 OH TYR A 36 2.918 -6.860 -25.920 1.00 0.00 O ATOM 0 H TYR A 36 -3.464 -8.791 -25.539 1.00 0.00 H new ATOM 0 HA TYR A 36 -2.795 -7.659 -28.176 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -2.094 -10.258 -26.762 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -1.712 -9.951 -28.445 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -0.886 -7.081 -28.337 1.00 0.00 H new ATOM 0 HD2 TYR A 36 0.008 -10.301 -25.693 1.00 0.00 H new ATOM 0 HE1 TYR A 36 1.186 -5.950 -27.663 1.00 0.00 H new ATOM 0 HE2 TYR A 36 2.079 -9.171 -25.015 1.00 0.00 H new ATOM 0 HH TYR A 36 3.387 -7.407 -25.256 1.00 0.00 H new ATOM 545 N LYS A 37 -5.274 -8.487 -28.597 1.00 0.00 N ATOM 546 CA LYS A 37 -6.444 -9.042 -29.265 1.00 0.00 C ATOM 547 C LYS A 37 -6.124 -9.404 -30.712 1.00 0.00 C ATOM 548 O LYS A 37 -6.811 -10.222 -31.324 1.00 0.00 O ATOM 549 CB LYS A 37 -7.603 -8.044 -29.223 1.00 0.00 C ATOM 550 CG LYS A 37 -8.501 -8.206 -28.009 1.00 0.00 C ATOM 551 CD LYS A 37 -9.058 -6.870 -27.544 1.00 0.00 C ATOM 552 CE LYS A 37 -8.109 -6.177 -26.578 1.00 0.00 C ATOM 553 NZ LYS A 37 -8.783 -5.821 -25.299 1.00 0.00 N ATOM 0 H LYS A 37 -5.334 -7.487 -28.404 1.00 0.00 H new ATOM 0 HA LYS A 37 -6.735 -9.950 -28.737 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -7.200 -7.031 -29.234 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -8.203 -8.158 -30.126 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -9.323 -8.879 -28.251 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -7.938 -8.668 -27.198 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.234 -6.228 -28.407 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.022 -7.025 -27.060 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -7.260 -6.829 -26.372 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -7.712 -5.275 -27.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.103 -5.351 -24.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.578 -5.179 -25.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -9.139 -6.685 -24.842 1.00 0.00 H new ATOM 567 N ASP A 38 -5.077 -8.790 -31.252 1.00 0.00 N ATOM 568 CA ASP A 38 -4.664 -9.050 -32.627 1.00 0.00 C ATOM 569 C ASP A 38 -3.946 -10.392 -32.735 1.00 0.00 C ATOM 570 O ASP A 38 -3.897 -10.996 -33.807 1.00 0.00 O ATOM 571 CB ASP A 38 -3.752 -7.928 -33.128 1.00 0.00 C ATOM 572 CG ASP A 38 -4.407 -6.564 -33.035 1.00 0.00 C ATOM 573 OD1 ASP A 38 -5.389 -6.327 -33.769 1.00 0.00 O ATOM 574 OD2 ASP A 38 -3.938 -5.734 -32.228 1.00 0.00 O ATOM 0 H ASP A 38 -4.499 -8.109 -30.759 1.00 0.00 H new ATOM 0 HA ASP A 38 -5.559 -9.086 -33.248 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -2.830 -7.926 -32.546 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.474 -8.125 -34.164 1.00 0.00 H new ATOM 579 N CYS A 39 -3.391 -10.851 -31.619 1.00 0.00 N ATOM 580 CA CYS A 39 -2.674 -12.121 -31.588 1.00 0.00 C ATOM 581 C CYS A 39 -3.620 -13.271 -31.259 1.00 0.00 C ATOM 582 O CYS A 39 -3.627 -14.296 -31.941 1.00 0.00 O ATOM 583 CB CYS A 39 -1.542 -12.067 -30.562 1.00 0.00 C ATOM 584 SG CYS A 39 -0.399 -10.685 -30.797 1.00 0.00 S ATOM 0 H CYS A 39 -3.424 -10.363 -30.724 1.00 0.00 H new ATOM 0 HA CYS A 39 -2.250 -12.294 -32.577 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.974 -12.002 -29.563 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.981 -13.000 -30.606 1.00 0.00 H new ATOM 0 HG CYS A 39 0.245 -10.461 -29.690 1.00 0.00 H new ATOM 590 N GLU A 40 -4.416 -13.095 -30.209 1.00 0.00 N ATOM 591 CA GLU A 40 -5.364 -14.120 -29.788 1.00 0.00 C ATOM 592 C GLU A 40 -6.232 -14.571 -30.959 1.00 0.00 C ATOM 593 O GLU A 40 -6.680 -15.716 -31.009 1.00 0.00 O ATOM 594 CB GLU A 40 -6.248 -13.594 -28.655 1.00 0.00 C ATOM 595 CG GLU A 40 -7.352 -12.664 -29.127 1.00 0.00 C ATOM 596 CD GLU A 40 -8.030 -11.935 -27.983 1.00 0.00 C ATOM 597 OE1 GLU A 40 -7.313 -11.434 -27.092 1.00 0.00 O ATOM 598 OE2 GLU A 40 -9.277 -11.867 -27.978 1.00 0.00 O ATOM 0 H GLU A 40 -4.423 -12.252 -29.634 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.797 -14.978 -29.427 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.695 -14.439 -28.132 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.624 -13.067 -27.933 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.935 -11.935 -29.821 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.096 -13.240 -29.678 1.00 0.00 H new ATOM 605 N LYS A 41 -6.467 -13.661 -31.899 1.00 0.00 N ATOM 606 CA LYS A 41 -7.281 -13.963 -33.070 1.00 0.00 C ATOM 607 C LYS A 41 -6.646 -15.072 -33.902 1.00 0.00 C ATOM 608 O LYS A 41 -7.273 -16.097 -34.171 1.00 0.00 O ATOM 609 CB LYS A 41 -7.463 -12.708 -33.927 1.00 0.00 C ATOM 610 CG LYS A 41 -8.365 -11.664 -33.292 1.00 0.00 C ATOM 611 CD LYS A 41 -9.765 -11.703 -33.884 1.00 0.00 C ATOM 612 CE LYS A 41 -10.742 -12.408 -32.956 1.00 0.00 C ATOM 613 NZ LYS A 41 -11.817 -11.492 -32.483 1.00 0.00 N ATOM 0 H LYS A 41 -6.105 -12.708 -31.872 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.257 -14.305 -32.725 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.486 -12.264 -34.118 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -7.878 -12.995 -34.893 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -8.419 -11.834 -32.217 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -7.935 -10.673 -33.437 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.110 -10.686 -34.073 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.741 -12.215 -34.846 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.189 -13.255 -33.476 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -10.203 -12.809 -32.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -12.462 -12.010 -31.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.392 -10.696 -31.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.348 -11.129 -33.300 1.00 0.00 H new ATOM 627 N ALA A 42 -5.398 -14.862 -34.307 1.00 0.00 N ATOM 628 CA ALA A 42 -4.677 -15.845 -35.106 1.00 0.00 C ATOM 629 C ALA A 42 -4.439 -17.127 -34.314 1.00 0.00 C ATOM 630 O ALA A 42 -4.376 -18.217 -34.883 1.00 0.00 O ATOM 631 CB ALA A 42 -3.355 -15.267 -35.588 1.00 0.00 C ATOM 0 H ALA A 42 -4.865 -14.019 -34.095 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.290 -16.092 -35.973 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -2.828 -16.012 -36.183 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.545 -14.384 -36.198 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.744 -14.990 -34.729 1.00 0.00 H new ATOM 637 N VAL A 43 -4.308 -16.989 -32.999 1.00 0.00 N ATOM 638 CA VAL A 43 -4.077 -18.137 -32.129 1.00 0.00 C ATOM 639 C VAL A 43 -5.237 -19.123 -32.202 1.00 0.00 C ATOM 640 O VAL A 43 -5.044 -20.335 -32.097 1.00 0.00 O ATOM 641 CB VAL A 43 -3.880 -17.701 -30.665 1.00 0.00 C ATOM 642 CG1 VAL A 43 -3.675 -18.913 -29.770 1.00 0.00 C ATOM 643 CG2 VAL A 43 -2.707 -16.738 -30.550 1.00 0.00 C ATOM 0 H VAL A 43 -4.358 -16.094 -32.512 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.167 -18.623 -32.481 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.780 -17.183 -30.334 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.538 -18.585 -28.740 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.549 -19.562 -29.831 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.792 -19.462 -30.097 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.582 -16.440 -29.509 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.798 -17.228 -30.899 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.900 -15.855 -31.160 1.00 0.00 H new ATOM 653 N LYS A 44 -6.444 -18.597 -32.383 1.00 0.00 N ATOM 654 CA LYS A 44 -7.637 -19.430 -32.472 1.00 0.00 C ATOM 655 C LYS A 44 -7.976 -19.741 -33.927 1.00 0.00 C ATOM 656 O LYS A 44 -8.422 -20.842 -34.250 1.00 0.00 O ATOM 657 CB LYS A 44 -8.822 -18.734 -31.799 1.00 0.00 C ATOM 658 CG LYS A 44 -8.772 -18.782 -30.281 1.00 0.00 C ATOM 659 CD LYS A 44 -9.644 -17.703 -29.661 1.00 0.00 C ATOM 660 CE LYS A 44 -10.288 -18.182 -28.368 1.00 0.00 C ATOM 661 NZ LYS A 44 -11.523 -18.974 -28.624 1.00 0.00 N ATOM 0 H LYS A 44 -6.622 -17.596 -32.471 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.434 -20.368 -31.956 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.852 -17.693 -32.121 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -9.747 -19.199 -32.139 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.103 -19.762 -29.936 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.742 -18.657 -29.946 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.042 -16.816 -29.462 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.420 -17.409 -30.368 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -9.575 -18.790 -27.811 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -10.531 -17.323 -27.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -12.139 -18.937 -27.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -12.027 -18.576 -29.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -11.267 -19.962 -28.822 1.00 0.00 H new ATOM 675 N LYS A 45 -7.761 -18.764 -34.801 1.00 0.00 N ATOM 676 CA LYS A 45 -8.042 -18.932 -36.222 1.00 0.00 C ATOM 677 C LYS A 45 -7.099 -19.957 -36.844 1.00 0.00 C ATOM 678 O LYS A 45 -7.539 -20.905 -37.496 1.00 0.00 O ATOM 679 CB LYS A 45 -7.910 -17.594 -36.952 1.00 0.00 C ATOM 680 CG LYS A 45 -8.551 -17.586 -38.328 1.00 0.00 C ATOM 681 CD LYS A 45 -7.662 -18.257 -39.362 1.00 0.00 C ATOM 682 CE LYS A 45 -8.088 -17.901 -40.778 1.00 0.00 C ATOM 683 NZ LYS A 45 -7.522 -18.846 -41.781 1.00 0.00 N ATOM 0 H LYS A 45 -7.393 -17.847 -34.550 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.065 -19.294 -36.324 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.365 -16.812 -36.344 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.853 -17.347 -37.051 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.512 -18.099 -38.286 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.751 -16.558 -38.631 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.627 -17.954 -39.205 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.701 -19.338 -39.230 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.176 -17.911 -40.843 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.764 -16.887 -41.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -7.835 -18.570 -42.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -6.483 -18.818 -41.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.852 -19.810 -41.574 1.00 0.00 H new ATOM 697 N TYR A 46 -5.801 -19.762 -36.638 1.00 0.00 N ATOM 698 CA TYR A 46 -4.796 -20.669 -37.180 1.00 0.00 C ATOM 699 C TYR A 46 -4.629 -21.894 -36.286 1.00 0.00 C ATOM 700 O TYR A 46 -3.948 -22.854 -36.648 1.00 0.00 O ATOM 701 CB TYR A 46 -3.456 -19.947 -37.332 1.00 0.00 C ATOM 702 CG TYR A 46 -3.456 -18.891 -38.413 1.00 0.00 C ATOM 703 CD1 TYR A 46 -4.138 -17.692 -38.240 1.00 0.00 C ATOM 704 CD2 TYR A 46 -2.776 -19.091 -39.608 1.00 0.00 C ATOM 705 CE1 TYR A 46 -4.142 -16.724 -39.226 1.00 0.00 C ATOM 706 CE2 TYR A 46 -2.774 -18.128 -40.599 1.00 0.00 C ATOM 707 CZ TYR A 46 -3.458 -16.947 -40.403 1.00 0.00 C ATOM 708 OH TYR A 46 -3.458 -15.985 -41.388 1.00 0.00 O ATOM 0 H TYR A 46 -5.420 -18.984 -36.100 1.00 0.00 H new ATOM 0 HA TYR A 46 -5.135 -21.002 -38.161 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -3.194 -19.482 -36.382 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -2.681 -20.681 -37.553 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -4.674 -17.514 -37.319 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -2.240 -20.015 -39.765 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -4.678 -15.798 -39.076 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -2.240 -18.299 -41.522 1.00 0.00 H new ATOM 0 HH TYR A 46 -2.929 -16.298 -42.151 1.00 0.00 H new ATOM 718 N HIS A 47 -5.255 -21.853 -35.114 1.00 0.00 N ATOM 719 CA HIS A 47 -5.178 -22.959 -34.166 1.00 0.00 C ATOM 720 C HIS A 47 -3.745 -23.157 -33.679 1.00 0.00 C ATOM 721 O HIS A 47 -3.133 -24.196 -33.930 1.00 0.00 O ATOM 722 CB HIS A 47 -5.693 -24.246 -34.810 1.00 0.00 C ATOM 723 CG HIS A 47 -6.998 -24.078 -35.525 1.00 0.00 C ATOM 724 ND1 HIS A 47 -8.201 -23.919 -34.869 1.00 0.00 N ATOM 725 CD2 HIS A 47 -7.285 -24.042 -36.847 1.00 0.00 C ATOM 726 CE1 HIS A 47 -9.171 -23.795 -35.757 1.00 0.00 C ATOM 727 NE2 HIS A 47 -8.642 -23.865 -36.965 1.00 0.00 N ATOM 0 H HIS A 47 -5.821 -21.066 -34.798 1.00 0.00 H new ATOM 0 HA HIS A 47 -5.804 -22.715 -33.308 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.947 -24.614 -35.515 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -5.806 -25.008 -34.039 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -6.578 -24.135 -37.658 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -10.219 -23.659 -35.533 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -9.157 -23.798 -37.843 1.00 0.00 H new ATOM 735 N ILE A 48 -3.218 -22.156 -32.984 1.00 0.00 N ATOM 736 CA ILE A 48 -1.858 -22.221 -32.463 1.00 0.00 C ATOM 737 C ILE A 48 -1.858 -22.456 -30.956 1.00 0.00 C ATOM 738 O ILE A 48 -2.151 -21.550 -30.176 1.00 0.00 O ATOM 739 CB ILE A 48 -1.075 -20.931 -32.769 1.00 0.00 C ATOM 740 CG1 ILE A 48 -1.161 -20.599 -34.260 1.00 0.00 C ATOM 741 CG2 ILE A 48 0.377 -21.078 -32.337 1.00 0.00 C ATOM 742 CD1 ILE A 48 -0.405 -19.346 -34.645 1.00 0.00 C ATOM 0 H ILE A 48 -3.712 -21.290 -32.768 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.370 -23.059 -32.960 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.520 -20.110 -32.206 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -0.771 -21.440 -34.834 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -2.208 -20.481 -34.538 1.00 0.00 H new ATOM 0 HG21 ILE A 48 0.918 -20.158 -32.560 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.420 -21.274 -31.266 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.835 -21.908 -32.876 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.510 -19.172 -35.716 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -0.810 -18.494 -34.098 1.00 0.00 H new ATOM 0 HD13 ILE A 48 0.650 -19.467 -34.399 1.00 0.00 H new ATOM 754 N ASP A 49 -1.527 -23.678 -30.554 1.00 0.00 N ATOM 755 CA ASP A 49 -1.486 -24.033 -29.140 1.00 0.00 C ATOM 756 C ASP A 49 -0.244 -23.452 -28.470 1.00 0.00 C ATOM 757 O ASP A 49 0.694 -23.025 -29.141 1.00 0.00 O ATOM 758 CB ASP A 49 -1.507 -25.553 -28.972 1.00 0.00 C ATOM 759 CG ASP A 49 -0.134 -26.173 -29.139 1.00 0.00 C ATOM 760 OD1 ASP A 49 0.530 -25.881 -30.156 1.00 0.00 O ATOM 761 OD2 ASP A 49 0.278 -26.950 -28.253 1.00 0.00 O ATOM 0 H ASP A 49 -1.283 -24.440 -31.187 1.00 0.00 H new ATOM 0 HA ASP A 49 -2.368 -23.610 -28.659 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -1.897 -25.801 -27.985 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -2.190 -25.987 -29.703 1.00 0.00 H new ATOM 766 N GLY A 50 -0.246 -23.439 -27.140 1.00 0.00 N ATOM 767 CA GLY A 50 0.884 -22.908 -26.401 1.00 0.00 C ATOM 768 C GLY A 50 2.203 -23.503 -26.853 1.00 0.00 C ATOM 769 O GLY A 50 3.176 -22.781 -27.067 1.00 0.00 O ATOM 0 H GLY A 50 -1.011 -23.787 -26.562 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.917 -21.825 -26.522 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.745 -23.106 -25.338 1.00 0.00 H new ATOM 773 N ALA A 51 2.236 -24.824 -26.996 1.00 0.00 N ATOM 774 CA ALA A 51 3.446 -25.515 -27.425 1.00 0.00 C ATOM 775 C ALA A 51 3.968 -24.944 -28.739 1.00 0.00 C ATOM 776 O ALA A 51 5.167 -24.989 -29.013 1.00 0.00 O ATOM 777 CB ALA A 51 3.179 -27.007 -27.564 1.00 0.00 C ATOM 0 H ALA A 51 1.439 -25.437 -26.821 1.00 0.00 H new ATOM 0 HA ALA A 51 4.212 -25.363 -26.664 1.00 0.00 H new ATOM 0 HB1 ALA A 51 4.090 -27.511 -27.885 1.00 0.00 H new ATOM 0 HB2 ALA A 51 2.860 -27.411 -26.603 1.00 0.00 H new ATOM 0 HB3 ALA A 51 2.395 -27.169 -28.304 1.00 0.00 H new ATOM 783 N ARG A 52 3.060 -24.409 -29.549 1.00 0.00 N ATOM 784 CA ARG A 52 3.429 -23.831 -30.835 1.00 0.00 C ATOM 785 C ARG A 52 3.925 -22.398 -30.665 1.00 0.00 C ATOM 786 O ARG A 52 4.688 -21.893 -31.489 1.00 0.00 O ATOM 787 CB ARG A 52 2.236 -23.859 -31.792 1.00 0.00 C ATOM 788 CG ARG A 52 2.296 -24.988 -32.808 1.00 0.00 C ATOM 789 CD ARG A 52 1.022 -25.062 -33.634 1.00 0.00 C ATOM 790 NE ARG A 52 1.234 -25.746 -34.908 1.00 0.00 N ATOM 791 CZ ARG A 52 1.367 -27.062 -35.022 1.00 0.00 C ATOM 792 NH1 ARG A 52 1.311 -27.833 -33.944 1.00 0.00 N ATOM 793 NH2 ARG A 52 1.558 -27.610 -36.215 1.00 0.00 N ATOM 0 H ARG A 52 2.063 -24.364 -29.337 1.00 0.00 H new ATOM 0 HA ARG A 52 4.237 -24.429 -31.255 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.318 -23.952 -31.212 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.183 -22.908 -32.321 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.151 -24.840 -33.468 1.00 0.00 H new ATOM 0 HG3 ARG A 52 2.452 -25.935 -32.292 1.00 0.00 H new ATOM 0 HD2 ARG A 52 0.252 -25.584 -33.066 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.652 -24.054 -33.821 1.00 0.00 H new ATOM 0 HE ARG A 52 1.282 -25.181 -35.756 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.165 -27.415 -33.025 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.413 -28.844 -34.034 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.603 -27.020 -37.046 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.660 -28.621 -36.301 1.00 0.00 H new ATOM 807 N PHE A 53 3.487 -21.749 -29.592 1.00 0.00 N ATOM 808 CA PHE A 53 3.885 -20.374 -29.314 1.00 0.00 C ATOM 809 C PHE A 53 5.359 -20.302 -28.928 1.00 0.00 C ATOM 810 O PHE A 53 6.135 -19.557 -29.528 1.00 0.00 O ATOM 811 CB PHE A 53 3.023 -19.788 -28.194 1.00 0.00 C ATOM 812 CG PHE A 53 3.337 -18.351 -27.886 1.00 0.00 C ATOM 813 CD1 PHE A 53 3.266 -17.386 -28.877 1.00 0.00 C ATOM 814 CD2 PHE A 53 3.702 -17.967 -26.606 1.00 0.00 C ATOM 815 CE1 PHE A 53 3.554 -16.063 -28.596 1.00 0.00 C ATOM 816 CE2 PHE A 53 3.991 -16.646 -26.319 1.00 0.00 C ATOM 817 CZ PHE A 53 3.916 -15.693 -27.316 1.00 0.00 C ATOM 0 H PHE A 53 2.856 -22.153 -28.900 1.00 0.00 H new ATOM 0 HA PHE A 53 3.737 -19.788 -30.221 1.00 0.00 H new ATOM 0 HB2 PHE A 53 1.973 -19.870 -28.474 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.160 -20.383 -27.291 1.00 0.00 H new ATOM 0 HD1 PHE A 53 2.983 -17.670 -29.880 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.761 -18.708 -25.823 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.496 -15.320 -29.377 1.00 0.00 H new ATOM 0 HE2 PHE A 53 4.275 -16.360 -25.317 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.140 -14.660 -27.095 1.00 0.00 H new ATOM 827 N LEU A 54 5.740 -21.082 -27.921 1.00 0.00 N ATOM 828 CA LEU A 54 7.121 -21.108 -27.453 1.00 0.00 C ATOM 829 C LEU A 54 8.075 -21.460 -28.590 1.00 0.00 C ATOM 830 O LEU A 54 9.232 -21.042 -28.594 1.00 0.00 O ATOM 831 CB LEU A 54 7.275 -22.115 -26.312 1.00 0.00 C ATOM 832 CG LEU A 54 6.305 -21.955 -25.141 1.00 0.00 C ATOM 833 CD1 LEU A 54 6.689 -22.885 -24.000 1.00 0.00 C ATOM 834 CD2 LEU A 54 6.275 -20.510 -24.666 1.00 0.00 C ATOM 0 H LEU A 54 5.111 -21.705 -27.413 1.00 0.00 H new ATOM 0 HA LEU A 54 7.373 -20.113 -27.087 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.157 -23.118 -26.721 1.00 0.00 H new ATOM 0 HB3 LEU A 54 8.292 -22.045 -25.927 1.00 0.00 H new ATOM 0 HG LEU A 54 5.306 -22.224 -25.483 1.00 0.00 H new ATOM 0 HD11 LEU A 54 5.988 -22.758 -23.175 1.00 0.00 H new ATOM 0 HD12 LEU A 54 6.658 -23.918 -24.346 1.00 0.00 H new ATOM 0 HD13 LEU A 54 7.697 -22.647 -23.660 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.579 -20.415 -23.832 1.00 0.00 H new ATOM 0 HD22 LEU A 54 7.272 -20.213 -24.342 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.952 -19.865 -25.483 1.00 0.00 H new ATOM 846 N ASN A 55 7.580 -22.230 -29.554 1.00 0.00 N ATOM 847 CA ASN A 55 8.388 -22.637 -30.697 1.00 0.00 C ATOM 848 C ASN A 55 8.156 -21.709 -31.886 1.00 0.00 C ATOM 849 O ASN A 55 8.263 -22.122 -33.041 1.00 0.00 O ATOM 850 CB ASN A 55 8.063 -24.079 -31.091 1.00 0.00 C ATOM 851 CG ASN A 55 8.535 -25.082 -30.056 1.00 0.00 C ATOM 852 OD1 ASN A 55 9.553 -24.875 -29.395 1.00 0.00 O ATOM 853 ND2 ASN A 55 7.796 -26.175 -29.911 1.00 0.00 N ATOM 0 H ASN A 55 6.624 -22.584 -29.566 1.00 0.00 H new ATOM 0 HA ASN A 55 9.437 -22.574 -30.409 1.00 0.00 H new ATOM 0 HB2 ASN A 55 6.986 -24.181 -31.228 1.00 0.00 H new ATOM 0 HB3 ASN A 55 8.529 -24.304 -32.050 1.00 0.00 H new ATOM 0 HD21 ASN A 55 8.064 -26.885 -29.230 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.960 -26.305 -30.481 1.00 0.00 H new ATOM 860 N LEU A 56 7.838 -20.452 -31.595 1.00 0.00 N ATOM 861 CA LEU A 56 7.591 -19.464 -32.639 1.00 0.00 C ATOM 862 C LEU A 56 8.732 -19.444 -33.651 1.00 0.00 C ATOM 863 O LEU A 56 9.826 -18.960 -33.360 1.00 0.00 O ATOM 864 CB LEU A 56 7.416 -18.075 -32.022 1.00 0.00 C ATOM 865 CG LEU A 56 6.099 -17.363 -32.334 1.00 0.00 C ATOM 866 CD1 LEU A 56 5.984 -17.080 -33.824 1.00 0.00 C ATOM 867 CD2 LEU A 56 4.918 -18.195 -31.855 1.00 0.00 C ATOM 0 H LEU A 56 7.745 -20.093 -30.645 1.00 0.00 H new ATOM 0 HA LEU A 56 6.674 -19.742 -33.159 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.509 -18.166 -30.940 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.237 -17.443 -32.361 1.00 0.00 H new ATOM 0 HG LEU A 56 6.088 -16.411 -31.803 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.040 -16.573 -34.026 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.812 -16.445 -34.139 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.017 -18.019 -34.376 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.989 -17.674 -32.085 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.926 -19.162 -32.358 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.992 -18.346 -30.778 1.00 0.00 H new ATOM 922 N ASP A 60 5.811 -19.724 -38.352 1.00 0.00 N ATOM 923 CA ASP A 60 4.678 -19.315 -37.530 1.00 0.00 C ATOM 924 C ASP A 60 4.529 -17.797 -37.526 1.00 0.00 C ATOM 925 O ASP A 60 3.423 -17.272 -37.658 1.00 0.00 O ATOM 926 CB ASP A 60 4.849 -19.826 -36.098 1.00 0.00 C ATOM 927 CG ASP A 60 5.444 -21.220 -36.048 1.00 0.00 C ATOM 928 OD1 ASP A 60 5.165 -22.017 -36.968 1.00 0.00 O ATOM 929 OD2 ASP A 60 6.189 -21.514 -35.090 1.00 0.00 O ATOM 0 HA ASP A 60 3.775 -19.750 -37.958 1.00 0.00 H new ATOM 0 HB2 ASP A 60 5.491 -19.140 -35.545 1.00 0.00 H new ATOM 0 HB3 ASP A 60 3.880 -19.829 -35.598 1.00 0.00 H new ATOM 934 N ILE A 61 5.649 -17.098 -37.374 1.00 0.00 N ATOM 935 CA ILE A 61 5.643 -15.641 -37.353 1.00 0.00 C ATOM 936 C ILE A 61 4.948 -15.077 -38.588 1.00 0.00 C ATOM 937 O ILE A 61 4.263 -14.057 -38.515 1.00 0.00 O ATOM 938 CB ILE A 61 7.072 -15.072 -37.277 1.00 0.00 C ATOM 939 CG1 ILE A 61 7.759 -15.530 -35.989 1.00 0.00 C ATOM 940 CG2 ILE A 61 7.043 -13.553 -37.357 1.00 0.00 C ATOM 941 CD1 ILE A 61 9.200 -15.084 -35.881 1.00 0.00 C ATOM 0 H ILE A 61 6.572 -17.518 -37.264 1.00 0.00 H new ATOM 0 HA ILE A 61 5.094 -15.341 -36.460 1.00 0.00 H new ATOM 0 HB ILE A 61 7.643 -15.450 -38.125 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.203 -15.145 -35.134 1.00 0.00 H new ATOM 0 HG13 ILE A 61 7.719 -16.618 -35.932 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.061 -13.166 -37.302 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.589 -13.247 -38.299 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.459 -13.156 -36.527 1.00 0.00 H new ATOM 0 HD11 ILE A 61 9.623 -15.444 -34.943 1.00 0.00 H new ATOM 0 HD12 ILE A 61 9.770 -15.490 -36.716 1.00 0.00 H new ATOM 0 HD13 ILE A 61 9.247 -13.995 -35.905 1.00 0.00 H new ATOM 953 N GLN A 62 5.129 -15.748 -39.720 1.00 0.00 N ATOM 954 CA GLN A 62 4.519 -15.314 -40.971 1.00 0.00 C ATOM 955 C GLN A 62 3.000 -15.257 -40.845 1.00 0.00 C ATOM 956 O GLN A 62 2.332 -14.524 -41.576 1.00 0.00 O ATOM 957 CB GLN A 62 4.912 -16.258 -42.110 1.00 0.00 C ATOM 958 CG GLN A 62 6.376 -16.158 -42.504 1.00 0.00 C ATOM 959 CD GLN A 62 6.614 -15.152 -43.613 1.00 0.00 C ATOM 960 OE1 GLN A 62 5.739 -14.908 -44.444 1.00 0.00 O ATOM 961 NE2 GLN A 62 7.803 -14.561 -43.632 1.00 0.00 N ATOM 0 H GLN A 62 5.693 -16.594 -39.797 1.00 0.00 H new ATOM 0 HA GLN A 62 4.885 -14.312 -41.196 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.693 -17.284 -41.813 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.294 -16.040 -42.981 1.00 0.00 H new ATOM 0 HG2 GLN A 62 6.965 -15.877 -41.631 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.730 -17.138 -42.825 1.00 0.00 H new ATOM 0 HE21 GLN A 62 8.499 -14.793 -42.924 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.020 -13.875 -44.355 1.00 0.00 H new ATOM 970 N LYS A 63 2.459 -16.034 -39.913 1.00 0.00 N ATOM 971 CA LYS A 63 1.019 -16.071 -39.688 1.00 0.00 C ATOM 972 C LYS A 63 0.603 -15.036 -38.647 1.00 0.00 C ATOM 973 O LYS A 63 -0.524 -15.057 -38.153 1.00 0.00 O ATOM 974 CB LYS A 63 0.588 -17.468 -39.235 1.00 0.00 C ATOM 975 CG LYS A 63 1.339 -18.591 -39.929 1.00 0.00 C ATOM 976 CD LYS A 63 0.535 -19.880 -39.933 1.00 0.00 C ATOM 977 CE LYS A 63 0.225 -20.348 -38.519 1.00 0.00 C ATOM 978 NZ LYS A 63 0.691 -21.742 -38.281 1.00 0.00 N ATOM 0 H LYS A 63 2.997 -16.647 -39.301 1.00 0.00 H new ATOM 0 HA LYS A 63 0.524 -15.832 -40.629 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.737 -17.554 -38.159 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.480 -17.588 -39.420 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.565 -18.299 -40.955 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.292 -18.757 -39.427 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.396 -19.728 -40.479 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.091 -20.655 -40.460 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.701 -19.679 -37.802 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.849 -20.290 -38.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.461 -22.023 -37.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.218 -22.385 -38.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 1.720 -21.793 -38.422 1.00 0.00 H new ATOM 992 N PHE A 64 1.520 -14.132 -38.320 1.00 0.00 N ATOM 993 CA PHE A 64 1.248 -13.089 -37.338 1.00 0.00 C ATOM 994 C PHE A 64 1.469 -11.704 -37.940 1.00 0.00 C ATOM 995 O PHE A 64 2.147 -11.541 -38.955 1.00 0.00 O ATOM 996 CB PHE A 64 2.141 -13.271 -36.109 1.00 0.00 C ATOM 997 CG PHE A 64 1.551 -14.179 -35.068 1.00 0.00 C ATOM 998 CD1 PHE A 64 0.322 -13.891 -34.495 1.00 0.00 C ATOM 999 CD2 PHE A 64 2.223 -15.321 -34.664 1.00 0.00 C ATOM 1000 CE1 PHE A 64 -0.223 -14.724 -33.537 1.00 0.00 C ATOM 1001 CE2 PHE A 64 1.683 -16.158 -33.706 1.00 0.00 C ATOM 1002 CZ PHE A 64 0.458 -15.860 -33.143 1.00 0.00 C ATOM 0 H PHE A 64 2.458 -14.100 -38.720 1.00 0.00 H new ATOM 0 HA PHE A 64 0.204 -13.173 -37.036 1.00 0.00 H new ATOM 0 HB2 PHE A 64 3.104 -13.672 -36.426 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.333 -12.296 -35.662 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.215 -13.006 -34.801 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.180 -15.560 -35.103 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.180 -14.488 -33.096 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.218 -17.044 -33.398 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.033 -16.514 -32.396 1.00 0.00 H new ATOM 1012 N PRO A 65 0.882 -10.681 -37.301 1.00 0.00 N ATOM 1013 CA PRO A 65 0.999 -9.292 -37.755 1.00 0.00 C ATOM 1014 C PRO A 65 2.405 -8.735 -37.560 1.00 0.00 C ATOM 1015 O PRO A 65 3.123 -9.139 -36.645 1.00 0.00 O ATOM 1016 CB PRO A 65 0.000 -8.544 -36.869 1.00 0.00 C ATOM 1017 CG PRO A 65 -0.113 -9.376 -35.639 1.00 0.00 C ATOM 1018 CD PRO A 65 0.059 -10.802 -36.086 1.00 0.00 C ATOM 0 HA PRO A 65 0.800 -9.194 -38.822 1.00 0.00 H new ATOM 0 HB2 PRO A 65 0.352 -7.539 -36.636 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.965 -8.436 -37.364 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.650 -9.101 -34.910 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -1.080 -9.232 -35.158 1.00 0.00 H new ATOM 0 HD2 PRO A 65 0.553 -11.405 -35.324 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -0.900 -11.276 -36.296 1.00 0.00 H new ATOM 1026 N LYS A 66 2.793 -7.805 -38.426 1.00 0.00 N ATOM 1027 CA LYS A 66 4.113 -7.190 -38.348 1.00 0.00 C ATOM 1028 C LYS A 66 4.213 -6.268 -37.137 1.00 0.00 C ATOM 1029 O LYS A 66 5.282 -5.734 -36.838 1.00 0.00 O ATOM 1030 CB LYS A 66 4.408 -6.404 -39.627 1.00 0.00 C ATOM 1031 CG LYS A 66 5.074 -7.234 -40.711 1.00 0.00 C ATOM 1032 CD LYS A 66 4.090 -7.613 -41.806 1.00 0.00 C ATOM 1033 CE LYS A 66 4.575 -8.818 -42.598 1.00 0.00 C ATOM 1034 NZ LYS A 66 3.973 -8.865 -43.960 1.00 0.00 N ATOM 0 H LYS A 66 2.212 -7.460 -39.190 1.00 0.00 H new ATOM 0 HA LYS A 66 4.851 -7.985 -38.239 1.00 0.00 H new ATOM 0 HB2 LYS A 66 3.475 -5.995 -40.016 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.050 -5.557 -39.383 1.00 0.00 H new ATOM 0 HG2 LYS A 66 5.902 -6.673 -41.143 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.496 -8.138 -40.271 1.00 0.00 H new ATOM 0 HD2 LYS A 66 3.119 -7.834 -41.363 1.00 0.00 H new ATOM 0 HD3 LYS A 66 3.949 -6.767 -42.479 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.661 -8.784 -42.682 1.00 0.00 H new ATOM 0 HE3 LYS A 66 4.325 -9.732 -42.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 4.328 -9.700 -44.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 2.938 -8.923 -43.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 4.232 -8.005 -44.484 1.00 0.00 H new ATOM 1048 N LEU A 67 3.095 -6.086 -36.444 1.00 0.00 N ATOM 1049 CA LEU A 67 3.057 -5.229 -35.264 1.00 0.00 C ATOM 1050 C LEU A 67 3.234 -6.049 -33.990 1.00 0.00 C ATOM 1051 O LEU A 67 3.543 -5.506 -32.929 1.00 0.00 O ATOM 1052 CB LEU A 67 1.737 -4.459 -35.210 1.00 0.00 C ATOM 1053 CG LEU A 67 1.847 -2.952 -34.981 1.00 0.00 C ATOM 1054 CD1 LEU A 67 2.082 -2.228 -36.298 1.00 0.00 C ATOM 1055 CD2 LEU A 67 0.596 -2.423 -34.296 1.00 0.00 C ATOM 0 H LEU A 67 2.202 -6.520 -36.679 1.00 0.00 H new ATOM 0 HA LEU A 67 3.881 -4.519 -35.334 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.204 -4.626 -36.146 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.125 -4.883 -34.414 1.00 0.00 H new ATOM 0 HG LEU A 67 2.700 -2.765 -34.329 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.158 -1.156 -36.115 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.007 -2.585 -36.750 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.249 -2.423 -36.974 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.693 -1.348 -34.141 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.274 -2.623 -34.922 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.471 -2.918 -33.333 1.00 0.00 H new ATOM 1067 N ARG A 68 3.036 -7.358 -34.103 1.00 0.00 N ATOM 1068 CA ARG A 68 3.174 -8.253 -32.960 1.00 0.00 C ATOM 1069 C ARG A 68 4.210 -9.338 -33.241 1.00 0.00 C ATOM 1070 O ARG A 68 4.553 -10.127 -32.360 1.00 0.00 O ATOM 1071 CB ARG A 68 1.827 -8.894 -32.621 1.00 0.00 C ATOM 1072 CG ARG A 68 0.664 -7.915 -32.643 1.00 0.00 C ATOM 1073 CD ARG A 68 0.800 -6.864 -31.553 1.00 0.00 C ATOM 1074 NE ARG A 68 -0.232 -5.836 -31.652 1.00 0.00 N ATOM 1075 CZ ARG A 68 -0.232 -4.723 -30.927 1.00 0.00 C ATOM 1076 NH1 ARG A 68 0.740 -4.496 -30.054 1.00 0.00 N ATOM 1077 NH2 ARG A 68 -1.207 -3.834 -31.074 1.00 0.00 N ATOM 0 H ARG A 68 2.780 -7.823 -34.974 1.00 0.00 H new ATOM 0 HA ARG A 68 3.512 -7.664 -32.108 1.00 0.00 H new ATOM 0 HB2 ARG A 68 1.628 -9.698 -33.330 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.889 -9.349 -31.633 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.616 -7.427 -33.616 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.272 -8.458 -32.512 1.00 0.00 H new ATOM 0 HD2 ARG A 68 0.740 -7.345 -30.577 1.00 0.00 H new ATOM 0 HD3 ARG A 68 1.783 -6.398 -31.619 1.00 0.00 H new ATOM 0 HE ARG A 68 -0.995 -5.980 -32.314 1.00 0.00 H new ATOM 0 HH11 ARG A 68 1.490 -5.177 -29.938 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.737 -3.640 -29.499 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -1.957 -4.005 -31.744 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -1.206 -2.980 -30.517 1.00 0.00 H new ATOM 1091 N VAL A 69 4.704 -9.372 -34.475 1.00 0.00 N ATOM 1092 CA VAL A 69 5.700 -10.360 -34.872 1.00 0.00 C ATOM 1093 C VAL A 69 6.854 -10.408 -33.877 1.00 0.00 C ATOM 1094 O VAL A 69 7.172 -11.452 -33.307 1.00 0.00 O ATOM 1095 CB VAL A 69 6.259 -10.059 -36.275 1.00 0.00 C ATOM 1096 CG1 VAL A 69 7.701 -10.531 -36.388 1.00 0.00 C ATOM 1097 CG2 VAL A 69 5.392 -10.708 -37.344 1.00 0.00 C ATOM 0 H VAL A 69 4.431 -8.727 -35.216 1.00 0.00 H new ATOM 0 HA VAL A 69 5.198 -11.327 -34.888 1.00 0.00 H new ATOM 0 HB VAL A 69 6.242 -8.980 -36.430 1.00 0.00 H new ATOM 0 HG11 VAL A 69 8.079 -10.310 -37.386 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.312 -10.016 -35.646 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.747 -11.606 -36.213 1.00 0.00 H new ATOM 0 HG21 VAL A 69 5.801 -10.485 -38.329 1.00 0.00 H new ATOM 0 HG22 VAL A 69 5.376 -11.787 -37.193 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.377 -10.317 -37.276 1.00 0.00 H new ATOM 1107 N PRO A 70 7.497 -9.251 -33.660 1.00 0.00 N ATOM 1108 CA PRO A 70 8.625 -9.134 -32.732 1.00 0.00 C ATOM 1109 C PRO A 70 8.196 -9.281 -31.276 1.00 0.00 C ATOM 1110 O PRO A 70 8.972 -9.731 -30.433 1.00 0.00 O ATOM 1111 CB PRO A 70 9.155 -7.722 -32.993 1.00 0.00 C ATOM 1112 CG PRO A 70 7.984 -6.970 -33.525 1.00 0.00 C ATOM 1113 CD PRO A 70 7.171 -7.967 -34.304 1.00 0.00 C ATOM 0 HA PRO A 70 9.365 -9.918 -32.891 1.00 0.00 H new ATOM 0 HB2 PRO A 70 9.536 -7.267 -32.079 1.00 0.00 H new ATOM 0 HB3 PRO A 70 9.977 -7.734 -33.709 1.00 0.00 H new ATOM 0 HG2 PRO A 70 7.398 -6.536 -32.715 1.00 0.00 H new ATOM 0 HG3 PRO A 70 8.306 -6.146 -34.162 1.00 0.00 H new ATOM 0 HD2 PRO A 70 6.105 -7.748 -34.247 1.00 0.00 H new ATOM 0 HD3 PRO A 70 7.440 -7.967 -35.360 1.00 0.00 H new ATOM 1121 N ILE A 71 6.956 -8.900 -30.988 1.00 0.00 N ATOM 1122 CA ILE A 71 6.424 -8.992 -29.634 1.00 0.00 C ATOM 1123 C ILE A 71 6.231 -10.445 -29.217 1.00 0.00 C ATOM 1124 O ILE A 71 6.534 -10.823 -28.084 1.00 0.00 O ATOM 1125 CB ILE A 71 5.080 -8.249 -29.506 1.00 0.00 C ATOM 1126 CG1 ILE A 71 5.307 -6.736 -29.510 1.00 0.00 C ATOM 1127 CG2 ILE A 71 4.357 -8.679 -28.239 1.00 0.00 C ATOM 1128 CD1 ILE A 71 5.628 -6.176 -30.878 1.00 0.00 C ATOM 0 H ILE A 71 6.301 -8.525 -31.674 1.00 0.00 H new ATOM 0 HA ILE A 71 7.154 -8.522 -28.975 1.00 0.00 H new ATOM 0 HB ILE A 71 4.456 -8.506 -30.362 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.415 -6.242 -29.124 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.123 -6.498 -28.828 1.00 0.00 H new ATOM 0 HG21 ILE A 71 3.409 -8.146 -28.162 1.00 0.00 H new ATOM 0 HG22 ILE A 71 4.168 -9.752 -28.274 1.00 0.00 H new ATOM 0 HG23 ILE A 71 4.975 -8.448 -27.371 1.00 0.00 H new ATOM 0 HD11 ILE A 71 5.776 -5.099 -30.804 1.00 0.00 H new ATOM 0 HD12 ILE A 71 6.537 -6.642 -31.258 1.00 0.00 H new ATOM 0 HD13 ILE A 71 4.802 -6.383 -31.559 1.00 0.00 H new ATOM 1140 N LEU A 72 5.726 -11.258 -30.139 1.00 0.00 N ATOM 1141 CA LEU A 72 5.494 -12.672 -29.867 1.00 0.00 C ATOM 1142 C LEU A 72 6.812 -13.434 -29.782 1.00 0.00 C ATOM 1143 O LEU A 72 6.973 -14.325 -28.948 1.00 0.00 O ATOM 1144 CB LEU A 72 4.609 -13.282 -30.956 1.00 0.00 C ATOM 1145 CG LEU A 72 3.184 -12.736 -31.048 1.00 0.00 C ATOM 1146 CD1 LEU A 72 2.386 -13.497 -32.095 1.00 0.00 C ATOM 1147 CD2 LEU A 72 2.496 -12.810 -29.692 1.00 0.00 C ATOM 0 H LEU A 72 5.470 -10.962 -31.081 1.00 0.00 H new ATOM 0 HA LEU A 72 4.986 -12.753 -28.906 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.097 -13.132 -31.919 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.554 -14.358 -30.791 1.00 0.00 H new ATOM 0 HG LEU A 72 3.236 -11.690 -31.351 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.375 -13.094 -32.146 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.868 -13.392 -33.067 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.343 -14.552 -31.824 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.483 -12.417 -29.776 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.457 -13.848 -29.360 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.055 -12.218 -28.967 1.00 0.00 H new ATOM 1159 N SER A 73 7.754 -13.075 -30.649 1.00 0.00 N ATOM 1160 CA SER A 73 9.059 -13.726 -30.672 1.00 0.00 C ATOM 1161 C SER A 73 9.822 -13.461 -29.377 1.00 0.00 C ATOM 1162 O SER A 73 10.579 -14.309 -28.904 1.00 0.00 O ATOM 1163 CB SER A 73 9.876 -13.234 -31.868 1.00 0.00 C ATOM 1164 OG SER A 73 10.227 -14.309 -32.723 1.00 0.00 O ATOM 0 H SER A 73 7.638 -12.338 -31.344 1.00 0.00 H new ATOM 0 HA SER A 73 8.900 -14.800 -30.766 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.301 -12.495 -32.426 1.00 0.00 H new ATOM 0 HB3 SER A 73 10.779 -12.736 -31.515 1.00 0.00 H new ATOM 0 HG SER A 73 10.747 -13.968 -33.480 1.00 0.00 H new ATOM 1170 N LYS A 74 9.616 -12.278 -28.809 1.00 0.00 N ATOM 1171 CA LYS A 74 10.282 -11.899 -27.568 1.00 0.00 C ATOM 1172 C LYS A 74 9.550 -12.476 -26.360 1.00 0.00 C ATOM 1173 O LYS A 74 10.168 -12.813 -25.350 1.00 0.00 O ATOM 1174 CB LYS A 74 10.359 -10.375 -27.451 1.00 0.00 C ATOM 1175 CG LYS A 74 10.824 -9.893 -26.088 1.00 0.00 C ATOM 1176 CD LYS A 74 10.831 -8.375 -26.007 1.00 0.00 C ATOM 1177 CE LYS A 74 12.247 -7.828 -25.919 1.00 0.00 C ATOM 1178 NZ LYS A 74 12.271 -6.340 -25.968 1.00 0.00 N ATOM 0 H LYS A 74 8.993 -11.565 -29.188 1.00 0.00 H new ATOM 0 HA LYS A 74 11.293 -12.307 -27.588 1.00 0.00 H new ATOM 0 HB2 LYS A 74 11.039 -9.994 -28.213 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.376 -9.953 -27.661 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.170 -10.297 -25.315 1.00 0.00 H new ATOM 0 HG3 LYS A 74 11.826 -10.274 -25.888 1.00 0.00 H new ATOM 0 HD2 LYS A 74 10.334 -7.961 -26.884 1.00 0.00 H new ATOM 0 HD3 LYS A 74 10.261 -8.053 -25.135 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.711 -8.168 -24.993 1.00 0.00 H new ATOM 0 HE3 LYS A 74 12.842 -8.228 -26.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.254 -6.006 -25.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 11.852 -6.015 -26.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 11.724 -5.958 -25.170 1.00 0.00 H new ATOM 1192 N LEU A 75 8.231 -12.587 -26.471 1.00 0.00 N ATOM 1193 CA LEU A 75 7.414 -13.124 -25.388 1.00 0.00 C ATOM 1194 C LEU A 75 7.564 -14.639 -25.293 1.00 0.00 C ATOM 1195 O LEU A 75 7.756 -15.187 -24.208 1.00 0.00 O ATOM 1196 CB LEU A 75 5.945 -12.758 -25.601 1.00 0.00 C ATOM 1197 CG LEU A 75 5.071 -12.733 -24.347 1.00 0.00 C ATOM 1198 CD1 LEU A 75 3.916 -11.758 -24.520 1.00 0.00 C ATOM 1199 CD2 LEU A 75 4.551 -14.128 -24.030 1.00 0.00 C ATOM 0 H LEU A 75 7.704 -12.312 -27.300 1.00 0.00 H new ATOM 0 HA LEU A 75 7.759 -12.684 -24.453 1.00 0.00 H new ATOM 0 HB2 LEU A 75 5.901 -11.775 -26.070 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.513 -13.468 -26.307 1.00 0.00 H new ATOM 0 HG LEU A 75 5.682 -12.396 -23.509 1.00 0.00 H new ATOM 0 HD11 LEU A 75 3.305 -11.754 -23.617 1.00 0.00 H new ATOM 0 HD12 LEU A 75 4.309 -10.757 -24.697 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.306 -12.064 -25.370 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.931 -14.090 -23.134 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.957 -14.494 -24.867 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.392 -14.800 -23.861 1.00 0.00 H new ATOM 1211 N SER A 76 7.478 -15.310 -26.437 1.00 0.00 N ATOM 1212 CA SER A 76 7.602 -16.762 -26.483 1.00 0.00 C ATOM 1213 C SER A 76 8.868 -17.222 -25.766 1.00 0.00 C ATOM 1214 O SER A 76 8.888 -18.281 -25.138 1.00 0.00 O ATOM 1215 CB SER A 76 7.620 -17.248 -27.934 1.00 0.00 C ATOM 1216 OG SER A 76 8.604 -18.249 -28.125 1.00 0.00 O ATOM 0 H SER A 76 7.323 -14.871 -27.345 1.00 0.00 H new ATOM 0 HA SER A 76 6.739 -17.192 -25.974 1.00 0.00 H new ATOM 0 HB2 SER A 76 6.639 -17.642 -28.201 1.00 0.00 H new ATOM 0 HB3 SER A 76 7.818 -16.408 -28.600 1.00 0.00 H new ATOM 0 HG SER A 76 8.594 -18.544 -29.060 1.00 0.00 H new ATOM 1222 N GLN A 77 9.921 -16.418 -25.864 1.00 0.00 N ATOM 1223 CA GLN A 77 11.191 -16.742 -25.226 1.00 0.00 C ATOM 1224 C GLN A 77 11.121 -16.501 -23.721 1.00 0.00 C ATOM 1225 O GLN A 77 11.684 -17.263 -22.935 1.00 0.00 O ATOM 1226 CB GLN A 77 12.320 -15.909 -25.835 1.00 0.00 C ATOM 1227 CG GLN A 77 12.689 -16.327 -27.250 1.00 0.00 C ATOM 1228 CD GLN A 77 13.390 -15.225 -28.019 1.00 0.00 C ATOM 1229 OE1 GLN A 77 13.077 -14.969 -29.183 1.00 0.00 O ATOM 1230 NE2 GLN A 77 14.344 -14.566 -27.373 1.00 0.00 N ATOM 0 H GLN A 77 9.920 -15.538 -26.379 1.00 0.00 H new ATOM 0 HA GLN A 77 11.395 -17.799 -25.398 1.00 0.00 H new ATOM 0 HB2 GLN A 77 12.024 -14.860 -25.840 1.00 0.00 H new ATOM 0 HB3 GLN A 77 13.202 -15.988 -25.200 1.00 0.00 H new ATOM 0 HG2 GLN A 77 13.335 -17.204 -27.209 1.00 0.00 H new ATOM 0 HG3 GLN A 77 11.786 -16.621 -27.785 1.00 0.00 H new ATOM 0 HE21 GLN A 77 14.570 -14.811 -26.409 1.00 0.00 H new ATOM 0 HE22 GLN A 77 14.851 -13.814 -27.840 1.00 0.00 H new ATOM 1239 N GLU A 78 10.427 -15.438 -23.329 1.00 0.00 N ATOM 1240 CA GLU A 78 10.285 -15.097 -21.918 1.00 0.00 C ATOM 1241 C GLU A 78 9.690 -16.263 -21.134 1.00 0.00 C ATOM 1242 O GLU A 78 10.092 -16.533 -20.002 1.00 0.00 O ATOM 1243 CB GLU A 78 9.405 -13.856 -21.756 1.00 0.00 C ATOM 1244 CG GLU A 78 10.192 -12.574 -21.545 1.00 0.00 C ATOM 1245 CD GLU A 78 10.302 -12.192 -20.081 1.00 0.00 C ATOM 1246 OE1 GLU A 78 10.780 -13.027 -19.285 1.00 0.00 O ATOM 1247 OE2 GLU A 78 9.911 -11.058 -19.733 1.00 0.00 O ATOM 0 H GLU A 78 9.954 -14.798 -23.968 1.00 0.00 H new ATOM 0 HA GLU A 78 11.277 -14.883 -21.520 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.780 -13.747 -22.642 1.00 0.00 H new ATOM 0 HB3 GLU A 78 8.735 -14.004 -20.909 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.192 -12.693 -21.962 1.00 0.00 H new ATOM 0 HG3 GLU A 78 9.713 -11.763 -22.093 1.00 0.00 H new