USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1066 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 110 GLN : amide:sc= -0.884 K(o=0.0094,f=-2.2!) USER MOD Set 1.2: A 119 THR OG1 : rot -114:sc= 0.893 USER MOD Set 2.1: A 104 CYS SG : rot -98:sc= 0.819 USER MOD Set 2.2: A 105 CYS SG : rot 62:sc= -0.0665 USER MOD Set 2.3: A 108 CYS SG : rot -11:sc= 0.629 USER MOD Set 2.4: A 120 CYS SG : rot -124:sc= 0.138 USER MOD Set 2.5: A 122 CYS SG : rot 85:sc= 1.26 USER MOD Set 2.6: A 145 CYS SG : rot -135:sc= 1.14 USER MOD Set 2.7: A 147 HIS : no HD1:sc= -0.539 K(o=3.4,f=4.9) USER MOD Set 2.8: A 148 CYS SG : rot -35:sc= -1.23 USER MOD Set 2.9: A 150 CYS SG : rot -148:sc= -0.2 USER MOD Set 2.10: A 153 CYS SG : rot 24:sc= 1.41 USER MOD Set 3.1: A 68 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 78 TYR OH : rot 180:sc= -0.0115 USER MOD Set 4.1: A 67 TYR OH : rot 180:sc= 0.0263 USER MOD Set 4.2: A 75 LYS NZ :NH3+ 176:sc= 0.0258 (180deg=0) USER MOD Set 5.1: A 20 LYS NZ :NH3+ -153:sc= 0.44 (180deg=-0.0597) USER MOD Set 5.2: A 24 THR OG1 : rot -64:sc= -1.05! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 35 LYS NZ :NH3+ -112:sc= 0 (180deg=-0.0119) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= -0.279 X(o=-0.28,f=-0.28) USER MOD Single : A 53 MET CE :methyl -171:sc= -6.8! (180deg=-7.4!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 HIS : no HD1:sc= -2.14! C(o=-2.1!,f=-10!) USER MOD Single : A 57 HIS : no HD1:sc= -4.79! C(o=-4.8!,f=-5.8!) USER MOD Single : A 58 GLN : amide:sc= -0.588 K(o=-0.59,f=-4.4!) USER MOD Single : A 60 SER OG : rot -23:sc= 0.601 USER MOD Single : A 62 TYR OH : rot 180:sc= -5.24! USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 103:sc= 0.998 USER MOD Single : A 69 LYS NZ :NH3+ -121:sc= 0.993 (180deg=-0.0697) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 155:sc= 0.654 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 158:sc=-0.00207 (180deg=-0.613) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0831 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HE2:sc= -0.298 K(o=-0.3,f=-4.7!) USER MOD Single : A 144 GLN : amide:sc= -3.32 K(o=-3.3,f=-9!) USER MOD Single : A 155 SER OG : rot 180:sc= 0.616 USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.430 -7.956 18.028 1.00 0.00 N ATOM 217 CA ALA A 12 -13.968 -7.733 18.314 1.00 0.00 C ATOM 218 C ALA A 12 -13.711 -7.841 19.826 1.00 0.00 C ATOM 219 O ALA A 12 -14.559 -7.477 20.617 1.00 0.00 O ATOM 220 CB ALA A 12 -13.629 -6.320 17.812 1.00 0.00 C ATOM 0 HA ALA A 12 -13.348 -8.479 17.817 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.576 -6.111 17.998 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.828 -6.256 16.742 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.242 -5.590 18.339 1.00 0.00 H new ATOM 226 N PRO A 13 -12.550 -8.345 20.191 1.00 0.00 N ATOM 227 CA PRO A 13 -12.213 -8.496 21.630 1.00 0.00 C ATOM 228 C PRO A 13 -11.935 -7.129 22.271 1.00 0.00 C ATOM 229 O PRO A 13 -11.687 -6.156 21.584 1.00 0.00 O ATOM 230 CB PRO A 13 -10.953 -9.357 21.620 1.00 0.00 C ATOM 231 CG PRO A 13 -10.333 -9.123 20.281 1.00 0.00 C ATOM 232 CD PRO A 13 -11.454 -8.814 19.323 1.00 0.00 C ATOM 0 HA PRO A 13 -13.023 -8.940 22.209 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.274 -9.072 22.424 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.194 -10.410 21.764 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.624 -8.296 20.324 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.778 -10.002 19.954 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.163 -8.051 18.601 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.746 -9.696 18.753 1.00 0.00 H new ATOM 240 N ASP A 14 -11.978 -7.050 23.587 1.00 0.00 N ATOM 241 CA ASP A 14 -11.716 -5.730 24.281 1.00 0.00 C ATOM 242 C ASP A 14 -10.431 -5.062 23.750 1.00 0.00 C ATOM 243 O ASP A 14 -10.339 -3.850 23.704 1.00 0.00 O ATOM 244 CB ASP A 14 -11.558 -6.045 25.776 1.00 0.00 C ATOM 245 CG ASP A 14 -11.681 -4.754 26.587 1.00 0.00 C ATOM 246 OD1 ASP A 14 -10.904 -3.846 26.341 1.00 0.00 O ATOM 247 OD2 ASP A 14 -12.552 -4.694 27.440 1.00 0.00 O ATOM 0 H ASP A 14 -12.181 -7.833 24.209 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.537 -5.037 24.097 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.320 -6.758 26.090 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.590 -6.511 25.960 1.00 0.00 H new ATOM 252 N GLY A 15 -9.441 -5.835 23.342 1.00 0.00 N ATOM 253 CA GLY A 15 -8.174 -5.231 22.814 1.00 0.00 C ATOM 254 C GLY A 15 -8.487 -4.213 21.698 1.00 0.00 C ATOM 255 O GLY A 15 -7.806 -3.212 21.570 1.00 0.00 O ATOM 0 H GLY A 15 -9.460 -6.855 23.354 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.634 -4.739 23.623 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.523 -6.015 22.427 1.00 0.00 H new ATOM 259 N PHE A 16 -9.509 -4.448 20.893 1.00 0.00 N ATOM 260 CA PHE A 16 -9.842 -3.465 19.795 1.00 0.00 C ATOM 261 C PHE A 16 -10.036 -2.050 20.373 1.00 0.00 C ATOM 262 O PHE A 16 -9.730 -1.070 19.721 1.00 0.00 O ATOM 263 CB PHE A 16 -11.148 -3.950 19.146 1.00 0.00 C ATOM 264 CG PHE A 16 -11.471 -3.087 17.948 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.520 -2.907 16.935 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.723 -2.469 17.850 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.822 -2.109 15.825 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.024 -1.670 16.739 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.074 -1.491 15.728 1.00 0.00 C ATOM 0 H PHE A 16 -10.118 -5.264 20.946 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.033 -3.414 19.067 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.049 -4.992 18.840 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.963 -3.906 19.869 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.554 -3.384 17.010 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.457 -2.608 18.630 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.089 -1.970 15.044 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.990 -1.192 16.663 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.307 -0.875 14.872 1.00 0.00 H new ATOM 279 N GLU A 17 -10.536 -1.929 21.590 1.00 0.00 N ATOM 280 CA GLU A 17 -10.734 -0.555 22.186 1.00 0.00 C ATOM 281 C GLU A 17 -9.412 0.230 22.161 1.00 0.00 C ATOM 282 O GLU A 17 -9.397 1.416 21.893 1.00 0.00 O ATOM 283 CB GLU A 17 -11.196 -0.762 23.637 1.00 0.00 C ATOM 284 CG GLU A 17 -11.793 0.542 24.174 1.00 0.00 C ATOM 285 CD GLU A 17 -11.920 0.455 25.696 1.00 0.00 C ATOM 286 OE1 GLU A 17 -12.936 -0.036 26.160 1.00 0.00 O ATOM 287 OE2 GLU A 17 -11.001 0.884 26.373 1.00 0.00 O ATOM 0 H GLU A 17 -10.812 -2.708 22.188 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.470 0.014 21.617 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.937 -1.560 23.684 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.355 -1.072 24.257 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.159 1.385 23.899 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.771 0.719 23.726 1.00 0.00 H new ATOM 294 N LYS A 18 -8.299 -0.425 22.427 1.00 0.00 N ATOM 295 CA LYS A 18 -6.977 0.305 22.401 1.00 0.00 C ATOM 296 C LYS A 18 -6.749 0.935 21.017 1.00 0.00 C ATOM 297 O LYS A 18 -6.223 2.026 20.911 1.00 0.00 O ATOM 298 CB LYS A 18 -5.887 -0.739 22.693 1.00 0.00 C ATOM 299 CG LYS A 18 -6.044 -1.256 24.125 1.00 0.00 C ATOM 300 CD LYS A 18 -4.747 -1.933 24.569 1.00 0.00 C ATOM 301 CE LYS A 18 -5.042 -2.898 25.720 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.872 -2.775 26.634 1.00 0.00 N ATOM 0 H LYS A 18 -8.246 -1.417 22.658 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.958 1.107 23.139 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.962 -1.566 21.987 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.900 -0.296 22.561 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.284 -0.431 24.796 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.872 -1.963 24.179 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.302 -2.473 23.733 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.023 -1.183 24.886 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.970 -2.635 26.228 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.155 -3.920 25.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.000 -3.408 27.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.004 -3.038 26.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.793 -1.793 26.967 1.00 0.00 H new ATOM 316 N ILE A 19 -7.148 0.263 19.955 1.00 0.00 N ATOM 317 CA ILE A 19 -6.957 0.840 18.587 1.00 0.00 C ATOM 318 C ILE A 19 -8.325 1.134 17.933 1.00 0.00 C ATOM 319 O ILE A 19 -8.487 0.980 16.737 1.00 0.00 O ATOM 320 CB ILE A 19 -6.176 -0.225 17.790 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.003 -1.521 17.664 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.857 -0.536 18.508 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.955 -2.034 16.220 1.00 0.00 C ATOM 0 H ILE A 19 -7.594 -0.654 19.981 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.416 1.786 18.615 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.974 0.165 16.792 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.611 -2.280 18.342 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.036 -1.333 17.958 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.305 -1.289 17.945 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.260 0.373 18.581 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.068 -0.914 19.509 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.541 -2.949 16.139 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.368 -1.279 15.552 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.922 -2.239 15.941 1.00 0.00 H new ATOM 335 N LYS A 20 -9.318 1.536 18.708 1.00 0.00 N ATOM 336 CA LYS A 20 -10.676 1.812 18.109 1.00 0.00 C ATOM 337 C LYS A 20 -10.810 3.240 17.525 1.00 0.00 C ATOM 338 O LYS A 20 -11.388 3.391 16.466 1.00 0.00 O ATOM 339 CB LYS A 20 -11.694 1.606 19.245 1.00 0.00 C ATOM 340 CG LYS A 20 -13.121 1.746 18.697 1.00 0.00 C ATOM 341 CD LYS A 20 -13.712 3.094 19.124 1.00 0.00 C ATOM 342 CE LYS A 20 -14.593 3.656 18.001 1.00 0.00 C ATOM 343 NZ LYS A 20 -13.829 4.809 17.448 1.00 0.00 N ATOM 0 H LYS A 20 -9.249 1.683 19.715 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.844 1.140 17.268 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.561 0.620 19.690 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.525 2.338 20.035 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.112 1.671 17.610 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.744 0.932 19.067 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.301 2.971 20.033 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.911 3.796 19.355 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.782 2.904 17.235 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.564 3.973 18.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.490 5.498 17.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -13.286 5.263 18.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.177 4.472 16.711 1.00 0.00 H new ATOM 357 N PRO A 21 -10.320 4.254 18.220 1.00 0.00 N ATOM 358 CA PRO A 21 -10.468 5.641 17.706 1.00 0.00 C ATOM 359 C PRO A 21 -9.491 5.924 16.551 1.00 0.00 C ATOM 360 O PRO A 21 -9.833 6.625 15.618 1.00 0.00 O ATOM 361 CB PRO A 21 -10.152 6.514 18.915 1.00 0.00 C ATOM 362 CG PRO A 21 -9.290 5.672 19.798 1.00 0.00 C ATOM 363 CD PRO A 21 -9.598 4.226 19.501 1.00 0.00 C ATOM 0 HA PRO A 21 -11.461 5.827 17.296 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.636 7.426 18.617 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.064 6.817 19.430 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.236 5.883 19.616 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.484 5.896 20.847 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.686 3.634 19.429 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.206 3.781 20.289 1.00 0.00 H new ATOM 371 N THR A 22 -8.284 5.396 16.598 1.00 0.00 N ATOM 372 CA THR A 22 -7.315 5.671 15.474 1.00 0.00 C ATOM 373 C THR A 22 -7.890 5.153 14.149 1.00 0.00 C ATOM 374 O THR A 22 -7.822 5.827 13.137 1.00 0.00 O ATOM 375 CB THR A 22 -6.009 4.932 15.813 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.537 5.367 17.080 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.957 5.233 14.744 1.00 0.00 C ATOM 0 H THR A 22 -7.932 4.800 17.347 1.00 0.00 H new ATOM 0 HA THR A 22 -7.136 6.741 15.365 1.00 0.00 H new ATOM 0 HB THR A 22 -6.196 3.859 15.843 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.706 4.896 17.299 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.032 4.709 14.986 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.320 4.899 13.772 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.768 6.306 14.712 1.00 0.00 H new ATOM 385 N LEU A 23 -8.464 3.970 14.143 1.00 0.00 N ATOM 386 CA LEU A 23 -9.049 3.435 12.862 1.00 0.00 C ATOM 387 C LEU A 23 -10.213 4.333 12.413 1.00 0.00 C ATOM 388 O LEU A 23 -10.371 4.601 11.237 1.00 0.00 O ATOM 389 CB LEU A 23 -9.553 2.015 13.160 1.00 0.00 C ATOM 390 CG LEU A 23 -8.401 1.022 12.985 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.569 -0.143 13.968 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.405 0.489 11.550 1.00 0.00 C ATOM 0 H LEU A 23 -8.553 3.358 14.954 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.308 3.419 12.063 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.943 1.961 14.176 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.373 1.760 12.489 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.455 1.525 13.184 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.747 -0.848 13.841 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.565 0.239 14.989 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.515 -0.649 13.774 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.586 -0.218 11.422 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.352 -0.013 11.351 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.280 1.318 10.854 1.00 0.00 H new ATOM 404 N THR A 24 -11.029 4.809 13.336 1.00 0.00 N ATOM 405 CA THR A 24 -12.176 5.701 12.929 1.00 0.00 C ATOM 406 C THR A 24 -11.645 6.949 12.203 1.00 0.00 C ATOM 407 O THR A 24 -12.253 7.423 11.263 1.00 0.00 O ATOM 408 CB THR A 24 -12.906 6.110 14.223 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.749 5.090 15.218 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.395 6.332 13.925 1.00 0.00 C ATOM 0 H THR A 24 -10.953 4.623 14.336 1.00 0.00 H new ATOM 0 HA THR A 24 -12.851 5.182 12.248 1.00 0.00 H new ATOM 0 HB THR A 24 -12.475 7.037 14.601 1.00 0.00 H new ATOM 0 HG1 THR A 24 -13.185 4.267 14.914 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.910 6.621 14.841 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.504 7.123 13.183 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.830 5.410 13.540 1.00 0.00 H new ATOM 418 N ASP A 25 -10.514 7.485 12.626 1.00 0.00 N ATOM 419 CA ASP A 25 -9.963 8.709 11.932 1.00 0.00 C ATOM 420 C ASP A 25 -9.750 8.423 10.434 1.00 0.00 C ATOM 421 O ASP A 25 -9.958 9.288 9.604 1.00 0.00 O ATOM 422 CB ASP A 25 -8.617 9.028 12.604 1.00 0.00 C ATOM 423 CG ASP A 25 -8.043 10.317 12.013 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.652 11.356 12.205 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.003 10.243 11.377 1.00 0.00 O ATOM 0 H ASP A 25 -9.957 7.137 13.406 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.654 9.548 12.014 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.753 9.138 13.680 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.919 8.204 12.453 1.00 0.00 H new ATOM 430 N PHE A 26 -9.337 7.221 10.077 1.00 0.00 N ATOM 431 CA PHE A 26 -9.118 6.907 8.616 1.00 0.00 C ATOM 432 C PHE A 26 -10.408 7.148 7.815 1.00 0.00 C ATOM 433 O PHE A 26 -10.363 7.626 6.696 1.00 0.00 O ATOM 434 CB PHE A 26 -8.734 5.421 8.539 1.00 0.00 C ATOM 435 CG PHE A 26 -7.242 5.279 8.702 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.672 5.287 9.980 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.430 5.135 7.573 1.00 0.00 C ATOM 438 CE1 PHE A 26 -5.286 5.154 10.127 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.046 5.001 7.720 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.473 5.010 8.997 1.00 0.00 C ATOM 0 H PHE A 26 -9.144 6.454 10.722 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.340 7.545 8.196 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.251 4.860 9.318 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -9.048 5.002 7.583 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.300 5.396 10.852 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.872 5.127 6.587 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.844 5.163 11.112 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.419 4.890 6.848 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.404 4.906 9.110 1.00 0.00 H new ATOM 450 N GLU A 27 -11.557 6.815 8.369 1.00 0.00 N ATOM 451 CA GLU A 27 -12.842 7.027 7.607 1.00 0.00 C ATOM 452 C GLU A 27 -13.094 8.518 7.311 1.00 0.00 C ATOM 453 O GLU A 27 -13.819 8.838 6.388 1.00 0.00 O ATOM 454 CB GLU A 27 -13.973 6.468 8.484 1.00 0.00 C ATOM 455 CG GLU A 27 -13.805 4.955 8.633 1.00 0.00 C ATOM 456 CD GLU A 27 -14.593 4.242 7.533 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.705 4.662 7.261 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.070 3.288 6.981 1.00 0.00 O ATOM 0 H GLU A 27 -11.662 6.412 9.300 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.790 6.521 6.643 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.956 6.944 9.464 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.940 6.694 8.036 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.750 4.688 8.570 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.157 4.634 9.613 1.00 0.00 H new ATOM 465 N ILE A 28 -12.513 9.436 8.063 1.00 0.00 N ATOM 466 CA ILE A 28 -12.757 10.894 7.767 1.00 0.00 C ATOM 467 C ILE A 28 -11.844 11.357 6.611 1.00 0.00 C ATOM 468 O ILE A 28 -12.243 12.181 5.808 1.00 0.00 O ATOM 469 CB ILE A 28 -12.478 11.667 9.081 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.634 11.431 10.060 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.373 13.175 8.811 1.00 0.00 C ATOM 472 CD1 ILE A 28 -13.478 10.067 10.734 1.00 0.00 C ATOM 0 H ILE A 28 -11.894 9.245 8.851 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.781 11.079 7.443 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.537 11.309 9.499 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.650 12.219 10.813 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.585 11.477 9.530 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -12.177 13.699 9.746 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.558 13.364 8.112 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -13.309 13.534 8.383 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.303 9.907 11.428 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -13.485 9.284 9.976 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -12.535 10.036 11.279 1.00 0.00 H new ATOM 484 N GLN A 29 -10.643 10.830 6.500 1.00 0.00 N ATOM 485 CA GLN A 29 -9.760 11.254 5.359 1.00 0.00 C ATOM 486 C GLN A 29 -10.148 10.473 4.095 1.00 0.00 C ATOM 487 O GLN A 29 -10.098 11.008 3.002 1.00 0.00 O ATOM 488 CB GLN A 29 -8.315 10.938 5.774 1.00 0.00 C ATOM 489 CG GLN A 29 -7.347 11.709 4.874 1.00 0.00 C ATOM 490 CD GLN A 29 -6.075 12.047 5.662 1.00 0.00 C ATOM 491 OE1 GLN A 29 -6.136 12.739 6.658 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.914 11.588 5.259 1.00 0.00 N ATOM 0 H GLN A 29 -10.242 10.140 7.135 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.867 12.316 5.140 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.156 11.213 6.817 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.128 9.867 5.694 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -7.096 11.113 3.997 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.818 12.624 4.514 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.858 11.006 4.423 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.067 11.813 5.782 1.00 0.00 H new ATOM 501 N LEU A 30 -10.556 9.223 4.225 1.00 0.00 N ATOM 502 CA LEU A 30 -10.966 8.451 3.002 1.00 0.00 C ATOM 503 C LEU A 30 -12.358 8.911 2.533 1.00 0.00 C ATOM 504 O LEU A 30 -12.635 8.908 1.348 1.00 0.00 O ATOM 505 CB LEU A 30 -10.994 6.966 3.401 1.00 0.00 C ATOM 506 CG LEU A 30 -10.395 6.124 2.270 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.571 4.975 2.860 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.523 5.557 1.404 1.00 0.00 C ATOM 0 H LEU A 30 -10.621 8.715 5.107 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.270 8.615 2.179 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.429 6.814 4.321 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.018 6.651 3.601 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.747 6.751 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.147 4.379 2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.766 5.382 3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.213 4.346 3.476 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.098 4.958 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.173 4.932 2.017 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.102 6.377 0.979 1.00 0.00 H new ATOM 520 N ARG A 31 -13.239 9.319 3.437 1.00 0.00 N ATOM 521 CA ARG A 31 -14.595 9.784 2.975 1.00 0.00 C ATOM 522 C ARG A 31 -14.462 11.109 2.201 1.00 0.00 C ATOM 523 O ARG A 31 -15.188 11.341 1.250 1.00 0.00 O ATOM 524 CB ARG A 31 -15.479 9.954 4.232 1.00 0.00 C ATOM 525 CG ARG A 31 -14.982 11.121 5.096 1.00 0.00 C ATOM 526 CD ARG A 31 -15.976 11.376 6.232 1.00 0.00 C ATOM 527 NE ARG A 31 -15.863 12.838 6.523 1.00 0.00 N ATOM 528 CZ ARG A 31 -16.323 13.746 5.675 1.00 0.00 C ATOM 529 NH1 ARG A 31 -16.898 13.399 4.546 1.00 0.00 N ATOM 530 NH2 ARG A 31 -16.205 15.016 5.963 1.00 0.00 N ATOM 0 H ARG A 31 -13.081 9.348 4.444 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.049 9.060 2.299 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -16.512 10.131 3.934 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.469 9.034 4.816 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.998 10.891 5.505 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.873 12.018 4.486 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -16.991 11.110 5.936 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.733 10.779 7.111 1.00 0.00 H new ATOM 0 HE ARG A 31 -15.423 13.142 7.391 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.998 12.413 4.307 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.245 14.116 3.909 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -15.761 15.302 6.836 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -16.557 15.721 5.315 1.00 0.00 H new ATOM 544 N ASP A 32 -13.541 11.979 2.584 1.00 0.00 N ATOM 545 CA ASP A 32 -13.393 13.275 1.828 1.00 0.00 C ATOM 546 C ASP A 32 -12.852 12.989 0.419 1.00 0.00 C ATOM 547 O ASP A 32 -13.304 13.575 -0.547 1.00 0.00 O ATOM 548 CB ASP A 32 -12.400 14.143 2.617 1.00 0.00 C ATOM 549 CG ASP A 32 -13.138 14.868 3.743 1.00 0.00 C ATOM 550 OD1 ASP A 32 -14.100 15.557 3.446 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.729 14.722 4.883 1.00 0.00 O ATOM 0 H ASP A 32 -12.901 11.851 3.368 1.00 0.00 H new ATOM 0 HA ASP A 32 -14.350 13.786 1.724 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.606 13.521 3.030 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.926 14.867 1.954 1.00 0.00 H new ATOM 556 N ALA A 33 -11.899 12.086 0.288 1.00 0.00 N ATOM 557 CA ALA A 33 -11.358 11.774 -1.081 1.00 0.00 C ATOM 558 C ALA A 33 -12.450 11.091 -1.915 1.00 0.00 C ATOM 559 O ALA A 33 -12.640 11.411 -3.073 1.00 0.00 O ATOM 560 CB ALA A 33 -10.171 10.819 -0.885 1.00 0.00 C ATOM 0 H ALA A 33 -11.480 11.561 1.055 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.044 12.679 -1.601 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.745 10.564 -1.855 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.412 11.304 -0.271 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.513 9.911 -0.389 1.00 0.00 H new ATOM 566 N GLN A 34 -13.175 10.156 -1.333 1.00 0.00 N ATOM 567 CA GLN A 34 -14.264 9.469 -2.115 1.00 0.00 C ATOM 568 C GLN A 34 -15.324 10.496 -2.545 1.00 0.00 C ATOM 569 O GLN A 34 -15.844 10.427 -3.643 1.00 0.00 O ATOM 570 CB GLN A 34 -14.890 8.420 -1.181 1.00 0.00 C ATOM 571 CG GLN A 34 -14.086 7.121 -1.260 1.00 0.00 C ATOM 572 CD GLN A 34 -14.734 6.179 -2.283 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.833 6.512 -3.448 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.184 5.008 -1.902 1.00 0.00 N ATOM 0 H GLN A 34 -13.064 9.843 -0.369 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.867 8.999 -3.015 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.902 8.791 -0.156 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.926 8.237 -1.465 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.057 7.335 -1.548 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.050 6.643 -0.281 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.103 4.724 -0.926 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.615 4.381 -2.582 1.00 0.00 H new ATOM 583 N LYS A 35 -15.652 11.452 -1.693 1.00 0.00 N ATOM 584 CA LYS A 35 -16.688 12.476 -2.086 1.00 0.00 C ATOM 585 C LYS A 35 -16.207 13.287 -3.301 1.00 0.00 C ATOM 586 O LYS A 35 -16.996 13.641 -4.159 1.00 0.00 O ATOM 587 CB LYS A 35 -16.879 13.403 -0.875 1.00 0.00 C ATOM 588 CG LYS A 35 -17.643 12.659 0.223 1.00 0.00 C ATOM 589 CD LYS A 35 -19.115 12.536 -0.173 1.00 0.00 C ATOM 590 CE LYS A 35 -19.913 11.958 0.998 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.704 10.486 0.916 1.00 0.00 N ATOM 0 H LYS A 35 -15.255 11.566 -0.760 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.625 11.992 -2.363 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.910 13.732 -0.499 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.427 14.298 -1.171 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.212 11.669 0.374 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.553 13.193 1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.511 13.513 -0.449 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.215 11.893 -1.047 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.560 12.354 1.950 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.970 12.212 0.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -20.598 10.022 0.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -18.985 10.277 0.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -19.382 10.129 1.838 1.00 0.00 H new ATOM 605 N ASP A 36 -14.927 13.589 -3.388 1.00 0.00 N ATOM 606 CA ASP A 36 -14.424 14.386 -4.567 1.00 0.00 C ATOM 607 C ASP A 36 -14.749 13.650 -5.878 1.00 0.00 C ATOM 608 O ASP A 36 -15.146 14.261 -6.851 1.00 0.00 O ATOM 609 CB ASP A 36 -12.901 14.515 -4.399 1.00 0.00 C ATOM 610 CG ASP A 36 -12.362 15.541 -5.397 1.00 0.00 C ATOM 611 OD1 ASP A 36 -12.081 15.157 -6.520 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.238 16.695 -5.020 1.00 0.00 O ATOM 0 H ASP A 36 -14.217 13.324 -2.706 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.898 15.367 -4.607 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.662 14.822 -3.381 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.424 13.549 -4.561 1.00 0.00 H new ATOM 744 N SER A 45 -8.227 15.198 -9.466 1.00 0.00 N ATOM 745 CA SER A 45 -9.096 14.036 -9.091 1.00 0.00 C ATOM 746 C SER A 45 -8.240 12.779 -8.891 1.00 0.00 C ATOM 747 O SER A 45 -8.326 12.124 -7.868 1.00 0.00 O ATOM 748 CB SER A 45 -10.065 13.848 -10.261 1.00 0.00 C ATOM 749 OG SER A 45 -11.067 14.857 -10.207 1.00 0.00 O ATOM 0 HA SER A 45 -9.629 14.212 -8.157 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.527 13.904 -11.207 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.524 12.860 -10.213 1.00 0.00 H new ATOM 0 HG SER A 45 -11.689 14.741 -10.956 1.00 0.00 H new ATOM 755 N ASN A 46 -7.408 12.436 -9.853 1.00 0.00 N ATOM 756 CA ASN A 46 -6.542 11.210 -9.691 1.00 0.00 C ATOM 757 C ASN A 46 -5.677 11.346 -8.426 1.00 0.00 C ATOM 758 O ASN A 46 -5.485 10.388 -7.699 1.00 0.00 O ATOM 759 CB ASN A 46 -5.645 11.131 -10.937 1.00 0.00 C ATOM 760 CG ASN A 46 -6.417 10.460 -12.080 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.443 9.248 -12.175 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.051 11.194 -12.961 1.00 0.00 N ATOM 0 H ASN A 46 -7.290 12.941 -10.731 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.148 10.310 -9.590 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.329 12.131 -11.235 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.741 10.565 -10.712 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.563 10.748 -13.722 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.032 12.211 -12.886 1.00 0.00 H new ATOM 769 N GLU A 47 -5.157 12.528 -8.150 1.00 0.00 N ATOM 770 CA GLU A 47 -4.311 12.700 -6.915 1.00 0.00 C ATOM 771 C GLU A 47 -5.137 12.359 -5.662 1.00 0.00 C ATOM 772 O GLU A 47 -4.630 11.762 -4.731 1.00 0.00 O ATOM 773 CB GLU A 47 -3.879 14.175 -6.873 1.00 0.00 C ATOM 774 CG GLU A 47 -2.821 14.427 -7.949 1.00 0.00 C ATOM 775 CD GLU A 47 -1.880 15.542 -7.490 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.376 16.547 -7.008 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.680 15.373 -7.628 1.00 0.00 O ATOM 0 H GLU A 47 -5.279 13.367 -8.716 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.445 12.039 -6.938 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.741 14.822 -7.036 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.478 14.420 -5.889 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.255 13.515 -8.138 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.301 14.705 -8.887 1.00 0.00 H new ATOM 784 N GLN A 48 -6.407 12.728 -5.626 1.00 0.00 N ATOM 785 CA GLN A 48 -7.242 12.404 -4.410 1.00 0.00 C ATOM 786 C GLN A 48 -7.273 10.885 -4.187 1.00 0.00 C ATOM 787 O GLN A 48 -7.148 10.420 -3.070 1.00 0.00 O ATOM 788 CB GLN A 48 -8.662 12.924 -4.692 1.00 0.00 C ATOM 789 CG GLN A 48 -9.364 13.240 -3.369 1.00 0.00 C ATOM 790 CD GLN A 48 -8.645 14.400 -2.670 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.578 15.491 -3.203 1.00 0.00 O ATOM 792 NE2 GLN A 48 -8.100 14.218 -1.493 1.00 0.00 N ATOM 0 H GLN A 48 -6.893 13.229 -6.370 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.828 12.868 -3.515 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.616 13.818 -5.314 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.230 12.178 -5.248 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.406 13.502 -3.552 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.365 12.359 -2.727 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.154 13.305 -1.042 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.622 14.990 -1.027 1.00 0.00 H new ATOM 801 N LEU A 49 -7.428 10.104 -5.240 1.00 0.00 N ATOM 802 CA LEU A 49 -7.451 8.606 -5.060 1.00 0.00 C ATOM 803 C LEU A 49 -6.138 8.134 -4.417 1.00 0.00 C ATOM 804 O LEU A 49 -6.139 7.241 -3.590 1.00 0.00 O ATOM 805 CB LEU A 49 -7.587 7.988 -6.464 1.00 0.00 C ATOM 806 CG LEU A 49 -9.068 7.807 -6.834 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.742 6.861 -5.837 1.00 0.00 C ATOM 808 CD2 LEU A 49 -9.781 9.165 -6.811 1.00 0.00 C ATOM 0 H LEU A 49 -7.538 10.431 -6.200 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.276 8.306 -4.414 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.099 8.629 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.079 7.024 -6.494 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.132 7.382 -7.836 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.791 6.737 -6.105 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.244 5.892 -5.862 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.671 7.280 -4.833 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -10.830 9.030 -7.074 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.710 9.596 -5.812 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.310 9.835 -7.530 1.00 0.00 H new ATOM 820 N TRP A 50 -5.016 8.727 -4.782 1.00 0.00 N ATOM 821 CA TRP A 50 -3.710 8.291 -4.165 1.00 0.00 C ATOM 822 C TRP A 50 -3.770 8.496 -2.641 1.00 0.00 C ATOM 823 O TRP A 50 -3.254 7.693 -1.888 1.00 0.00 O ATOM 824 CB TRP A 50 -2.595 9.153 -4.809 1.00 0.00 C ATOM 825 CG TRP A 50 -2.585 8.988 -6.315 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.365 8.134 -7.035 1.00 0.00 C ATOM 827 CD2 TRP A 50 -1.759 9.690 -7.294 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.065 8.273 -8.377 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.087 9.216 -8.586 1.00 0.00 C ATOM 830 CE3 TRP A 50 -0.767 10.683 -7.190 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.461 9.704 -9.725 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.130 11.174 -8.343 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.481 10.683 -9.608 1.00 0.00 C ATOM 0 H TRP A 50 -4.947 9.480 -5.467 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.510 7.235 -4.344 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.749 10.202 -4.555 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.626 8.865 -4.401 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.099 7.457 -6.623 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.515 7.741 -9.122 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.494 11.070 -6.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -1.734 9.324 -10.698 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.633 11.933 -8.254 1.00 0.00 H new ATOM 0 HH2 TRP A 50 0.010 11.065 -10.491 1.00 0.00 H new ATOM 844 N GLU A 51 -4.418 9.542 -2.168 1.00 0.00 N ATOM 845 CA GLU A 51 -4.513 9.729 -0.678 1.00 0.00 C ATOM 846 C GLU A 51 -5.332 8.576 -0.066 1.00 0.00 C ATOM 847 O GLU A 51 -5.063 8.151 1.042 1.00 0.00 O ATOM 848 CB GLU A 51 -5.218 11.074 -0.438 1.00 0.00 C ATOM 849 CG GLU A 51 -4.197 12.209 -0.532 1.00 0.00 C ATOM 850 CD GLU A 51 -3.470 12.356 0.806 1.00 0.00 C ATOM 851 OE1 GLU A 51 -4.135 12.307 1.827 1.00 0.00 O ATOM 852 OE2 GLU A 51 -2.261 12.515 0.786 1.00 0.00 O ATOM 0 H GLU A 51 -4.875 10.258 -2.733 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.527 9.726 -0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.008 11.219 -1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.693 11.078 0.543 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.480 12.002 -1.326 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.698 13.142 -0.790 1.00 0.00 H new ATOM 859 N ILE A 52 -6.320 8.052 -0.776 1.00 0.00 N ATOM 860 CA ILE A 52 -7.123 6.915 -0.203 1.00 0.00 C ATOM 861 C ILE A 52 -6.261 5.645 -0.177 1.00 0.00 C ATOM 862 O ILE A 52 -6.086 5.046 0.868 1.00 0.00 O ATOM 863 CB ILE A 52 -8.356 6.737 -1.109 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.202 8.013 -1.033 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.187 5.540 -0.630 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.423 7.905 -1.953 1.00 0.00 C ATOM 0 H ILE A 52 -6.598 8.358 -1.709 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.440 7.117 0.820 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.039 6.556 -2.136 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.527 8.180 -0.006 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.598 8.874 -1.320 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.057 5.420 -1.275 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.579 4.636 -0.669 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.516 5.712 0.395 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.011 8.820 -1.886 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.092 7.761 -2.982 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.035 7.057 -1.647 1.00 0.00 H new ATOM 878 N MET A 53 -5.701 5.228 -1.302 1.00 0.00 N ATOM 879 CA MET A 53 -4.838 3.994 -1.266 1.00 0.00 C ATOM 880 C MET A 53 -3.646 4.226 -0.311 1.00 0.00 C ATOM 881 O MET A 53 -3.192 3.303 0.340 1.00 0.00 O ATOM 882 CB MET A 53 -4.354 3.700 -2.706 1.00 0.00 C ATOM 883 CG MET A 53 -3.486 4.840 -3.232 1.00 0.00 C ATOM 884 SD MET A 53 -1.756 4.535 -2.802 1.00 0.00 S ATOM 885 CE MET A 53 -1.123 6.108 -3.408 1.00 0.00 C ATOM 0 H MET A 53 -5.801 5.674 -2.214 1.00 0.00 H new ATOM 0 HA MET A 53 -5.400 3.137 -0.896 1.00 0.00 H new ATOM 0 HB2 MET A 53 -3.787 2.769 -2.720 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.214 3.560 -3.361 1.00 0.00 H new ATOM 0 HG2 MET A 53 -3.593 4.923 -4.314 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.815 5.788 -2.806 1.00 0.00 H new ATOM 0 HE1 MET A 53 -0.033 6.091 -3.395 1.00 0.00 H new ATOM 0 HE2 MET A 53 -1.471 6.272 -4.428 1.00 0.00 H new ATOM 0 HE3 MET A 53 -1.481 6.915 -2.768 1.00 0.00 H new ATOM 895 N GLN A 54 -3.145 5.452 -0.197 1.00 0.00 N ATOM 896 CA GLN A 54 -2.000 5.699 0.752 1.00 0.00 C ATOM 897 C GLN A 54 -2.451 5.356 2.178 1.00 0.00 C ATOM 898 O GLN A 54 -1.718 4.745 2.932 1.00 0.00 O ATOM 899 CB GLN A 54 -1.641 7.193 0.655 1.00 0.00 C ATOM 900 CG GLN A 54 -0.578 7.404 -0.433 1.00 0.00 C ATOM 901 CD GLN A 54 0.768 7.758 0.215 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.632 6.911 0.337 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.989 8.977 0.641 1.00 0.00 N ATOM 0 H GLN A 54 -3.474 6.270 -0.710 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.135 5.084 0.502 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.532 7.776 0.423 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.268 7.550 1.615 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.476 6.501 -1.034 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.888 8.202 -1.107 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.267 9.691 0.541 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.883 9.212 1.073 1.00 0.00 H new ATOM 912 N LEU A 55 -3.666 5.725 2.551 1.00 0.00 N ATOM 913 CA LEU A 55 -4.159 5.384 3.937 1.00 0.00 C ATOM 914 C LEU A 55 -4.025 3.867 4.180 1.00 0.00 C ATOM 915 O LEU A 55 -3.751 3.439 5.285 1.00 0.00 O ATOM 916 CB LEU A 55 -5.640 5.797 3.994 1.00 0.00 C ATOM 917 CG LEU A 55 -5.747 7.289 4.315 1.00 0.00 C ATOM 918 CD1 LEU A 55 -7.170 7.775 4.018 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.430 7.519 5.795 1.00 0.00 C ATOM 0 H LEU A 55 -4.326 6.238 1.967 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.579 5.901 4.701 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.124 5.585 3.041 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.161 5.214 4.753 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.037 7.843 3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.247 8.838 4.247 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.397 7.613 2.964 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.880 7.220 4.632 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.507 8.582 6.023 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.139 6.964 6.409 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.418 7.174 6.008 1.00 0.00 H new ATOM 931 N HIS A 56 -4.201 3.049 3.154 1.00 0.00 N ATOM 932 CA HIS A 56 -4.061 1.560 3.349 1.00 0.00 C ATOM 933 C HIS A 56 -2.670 1.245 3.925 1.00 0.00 C ATOM 934 O HIS A 56 -2.536 0.416 4.805 1.00 0.00 O ATOM 935 CB HIS A 56 -4.221 0.925 1.958 1.00 0.00 C ATOM 936 CG HIS A 56 -4.729 -0.482 2.099 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.857 -0.788 2.843 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.281 -1.673 1.588 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.050 -2.117 2.758 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.117 -2.705 2.004 1.00 0.00 N ATOM 0 H HIS A 56 -4.432 3.344 2.205 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.806 1.171 4.043 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.914 1.513 1.357 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.265 0.926 1.435 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.412 -1.792 0.958 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.860 -2.644 3.240 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -5.035 -3.697 1.781 1.00 0.00 H new ATOM 948 N HIS A 57 -1.632 1.915 3.450 1.00 0.00 N ATOM 949 CA HIS A 57 -0.256 1.649 4.008 1.00 0.00 C ATOM 950 C HIS A 57 -0.251 1.985 5.504 1.00 0.00 C ATOM 951 O HIS A 57 0.170 1.186 6.321 1.00 0.00 O ATOM 952 CB HIS A 57 0.722 2.573 3.261 1.00 0.00 C ATOM 953 CG HIS A 57 1.252 1.879 2.037 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.358 2.348 1.343 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.842 0.750 1.372 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.572 1.513 0.310 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.677 0.520 0.282 1.00 0.00 N ATOM 0 H HIS A 57 -1.677 2.620 2.715 1.00 0.00 H new ATOM 0 HA HIS A 57 0.031 0.605 3.882 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.217 3.496 2.976 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.547 2.850 3.918 1.00 0.00 H new ATOM 0 HD2 HIS A 57 0.000 0.134 1.652 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.369 1.630 -0.409 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.619 -0.242 -0.393 1.00 0.00 H new ATOM 965 N GLN A 58 -0.735 3.155 5.876 1.00 0.00 N ATOM 966 CA GLN A 58 -0.768 3.515 7.338 1.00 0.00 C ATOM 967 C GLN A 58 -1.641 2.497 8.093 1.00 0.00 C ATOM 968 O GLN A 58 -1.317 2.102 9.198 1.00 0.00 O ATOM 969 CB GLN A 58 -1.382 4.921 7.439 1.00 0.00 C ATOM 970 CG GLN A 58 -1.013 5.545 8.786 1.00 0.00 C ATOM 971 CD GLN A 58 0.399 6.140 8.705 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.302 5.510 8.194 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.633 7.336 9.190 1.00 0.00 N ATOM 0 H GLN A 58 -1.103 3.865 5.242 1.00 0.00 H new ATOM 0 HA GLN A 58 0.230 3.500 7.776 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.018 5.547 6.624 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.466 4.864 7.338 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.732 6.321 9.048 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.057 4.791 9.572 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.123 7.869 9.620 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.571 7.733 9.137 1.00 0.00 H new ATOM 982 N ARG A 59 -2.739 2.056 7.502 1.00 0.00 N ATOM 983 CA ARG A 59 -3.603 1.045 8.210 1.00 0.00 C ATOM 984 C ARG A 59 -2.804 -0.251 8.398 1.00 0.00 C ATOM 985 O ARG A 59 -2.743 -0.789 9.489 1.00 0.00 O ATOM 986 CB ARG A 59 -4.841 0.790 7.324 1.00 0.00 C ATOM 987 CG ARG A 59 -6.099 0.763 8.197 1.00 0.00 C ATOM 988 CD ARG A 59 -6.775 2.136 8.165 1.00 0.00 C ATOM 989 NE ARG A 59 -8.242 1.846 8.171 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.843 1.321 7.114 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.177 1.031 6.020 1.00 0.00 N ATOM 992 NH2 ARG A 59 -10.128 1.082 7.156 1.00 0.00 N ATOM 0 H ARG A 59 -3.067 2.346 6.581 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.914 1.406 9.190 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.927 1.571 6.568 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.733 -0.156 6.794 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.788 -0.001 7.837 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.837 0.499 9.222 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.488 2.737 9.028 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.487 2.697 7.276 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.790 2.057 9.005 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.174 1.209 5.971 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.663 0.627 5.219 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.660 1.300 7.999 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.598 0.678 6.346 1.00 0.00 H new ATOM 1006 N SER A 60 -2.170 -0.752 7.352 1.00 0.00 N ATOM 1007 CA SER A 60 -1.360 -2.005 7.513 1.00 0.00 C ATOM 1008 C SER A 60 -0.163 -1.708 8.420 1.00 0.00 C ATOM 1009 O SER A 60 0.175 -2.503 9.266 1.00 0.00 O ATOM 1010 CB SER A 60 -0.884 -2.423 6.113 1.00 0.00 C ATOM 1011 OG SER A 60 -0.122 -1.366 5.543 1.00 0.00 O ATOM 0 H SER A 60 -2.180 -0.353 6.413 1.00 0.00 H new ATOM 0 HA SER A 60 -1.945 -2.807 7.964 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.281 -3.329 6.176 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.740 -2.653 5.479 1.00 0.00 H new ATOM 0 HG SER A 60 -0.370 -0.518 5.967 1.00 0.00 H new ATOM 1017 N ARG A 61 0.471 -0.562 8.270 1.00 0.00 N ATOM 1018 CA ARG A 61 1.635 -0.239 9.169 1.00 0.00 C ATOM 1019 C ARG A 61 1.144 -0.121 10.623 1.00 0.00 C ATOM 1020 O ARG A 61 1.826 -0.535 11.542 1.00 0.00 O ATOM 1021 CB ARG A 61 2.214 1.102 8.691 1.00 0.00 C ATOM 1022 CG ARG A 61 3.671 1.221 9.145 1.00 0.00 C ATOM 1023 CD ARG A 61 4.239 2.569 8.697 1.00 0.00 C ATOM 1024 NE ARG A 61 5.636 2.594 9.226 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.596 1.875 8.666 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.361 1.112 7.623 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.809 1.921 9.157 1.00 0.00 N ATOM 0 H ARG A 61 0.239 0.151 7.578 1.00 0.00 H new ATOM 0 HA ARG A 61 2.395 -1.020 9.130 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.154 1.169 7.605 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.628 1.928 9.094 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.733 1.131 10.229 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.262 0.408 8.723 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.226 2.661 7.611 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.651 3.397 9.094 1.00 0.00 H new ATOM 0 HE ARG A 61 5.854 3.176 10.034 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.422 1.064 7.227 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.117 0.567 7.209 1.00 0.00 H new ATOM 0 HH21 ARG A 61 8.010 2.508 9.966 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.553 1.369 8.730 1.00 0.00 H new ATOM 1041 N TYR A 62 -0.039 0.428 10.844 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.553 0.547 12.256 1.00 0.00 C ATOM 1043 C TYR A 62 -0.687 -0.857 12.869 1.00 0.00 C ATOM 1044 O TYR A 62 -0.198 -1.111 13.957 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.931 1.231 12.165 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.531 1.373 13.544 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.221 0.298 14.117 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.399 2.576 14.249 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.779 0.425 15.393 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.958 2.703 15.525 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.648 1.627 16.098 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.199 1.752 17.358 1.00 0.00 O ATOM 0 H TYR A 62 -0.659 0.792 10.121 1.00 0.00 H new ATOM 0 HA TYR A 62 0.123 1.125 12.886 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.829 2.212 11.701 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.595 0.646 11.529 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.322 -0.630 13.573 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.866 3.405 13.808 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.311 -0.405 15.835 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.858 3.631 16.068 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.016 2.649 17.708 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.327 -1.779 12.175 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.458 -3.169 12.738 1.00 0.00 C ATOM 1064 C ILE A 63 -0.113 -3.899 12.588 1.00 0.00 C ATOM 1065 O ILE A 63 0.341 -4.562 13.502 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.563 -3.870 11.927 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.879 -3.106 12.108 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.734 -5.306 12.426 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.963 -3.718 11.216 1.00 0.00 C ATOM 0 H ILE A 63 -1.756 -1.633 11.261 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.717 -3.162 13.797 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.288 -3.887 10.872 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.191 -3.143 13.152 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.738 -2.055 11.855 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.517 -5.800 11.851 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.796 -5.848 12.303 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.011 -5.294 13.480 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.896 -3.170 11.349 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.653 -3.658 10.173 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.113 -4.762 11.490 1.00 0.00 H new ATOM 1081 N TYR A 64 0.537 -3.762 11.452 1.00 0.00 N ATOM 1082 CA TYR A 64 1.873 -4.433 11.264 1.00 0.00 C ATOM 1083 C TYR A 64 2.871 -3.946 12.329 1.00 0.00 C ATOM 1084 O TYR A 64 3.792 -4.655 12.674 1.00 0.00 O ATOM 1085 CB TYR A 64 2.369 -4.040 9.862 1.00 0.00 C ATOM 1086 CG TYR A 64 3.565 -4.877 9.488 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.434 -6.263 9.382 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.802 -4.270 9.238 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.533 -7.047 9.029 1.00 0.00 C ATOM 1090 CE2 TYR A 64 5.905 -5.055 8.882 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.770 -6.444 8.776 1.00 0.00 C ATOM 1092 OH TYR A 64 6.858 -7.219 8.425 1.00 0.00 O ATOM 0 H TYR A 64 0.206 -3.221 10.653 1.00 0.00 H new ATOM 0 HA TYR A 64 1.783 -5.515 11.364 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.572 -4.182 9.132 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.634 -2.983 9.843 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.479 -6.730 9.574 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.905 -3.198 9.320 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.429 -8.119 8.951 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.860 -4.589 8.689 1.00 0.00 H new ATOM 0 HH TYR A 64 7.638 -6.643 8.284 1.00 0.00 H new ATOM 1102 N THR A 65 2.706 -2.746 12.858 1.00 0.00 N ATOM 1103 CA THR A 65 3.670 -2.260 13.902 1.00 0.00 C ATOM 1104 C THR A 65 3.222 -2.712 15.302 1.00 0.00 C ATOM 1105 O THR A 65 4.048 -2.988 16.152 1.00 0.00 O ATOM 1106 CB THR A 65 3.671 -0.725 13.811 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.010 -0.332 12.488 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.697 -0.154 14.792 1.00 0.00 C ATOM 0 H THR A 65 1.959 -2.096 12.615 1.00 0.00 H new ATOM 0 HA THR A 65 4.667 -2.667 13.735 1.00 0.00 H new ATOM 0 HB THR A 65 2.681 -0.345 14.062 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.199 -0.062 12.009 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.697 0.934 14.726 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.438 -0.457 15.807 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.688 -0.532 14.543 1.00 0.00 H new ATOM 1116 N LEU A 66 1.930 -2.780 15.568 1.00 0.00 N ATOM 1117 CA LEU A 66 1.488 -3.204 16.942 1.00 0.00 C ATOM 1118 C LEU A 66 1.470 -4.743 17.100 1.00 0.00 C ATOM 1119 O LEU A 66 1.742 -5.247 18.175 1.00 0.00 O ATOM 1120 CB LEU A 66 0.090 -2.585 17.179 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.982 -3.261 16.311 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.506 -4.521 17.016 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.141 -2.278 16.091 1.00 0.00 C ATOM 0 H LEU A 66 1.181 -2.566 14.910 1.00 0.00 H new ATOM 0 HA LEU A 66 2.195 -2.848 17.691 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.178 -2.682 18.231 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.121 -1.519 16.955 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.549 -3.544 15.352 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.266 -4.996 16.395 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.683 -5.217 17.177 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.942 -4.246 17.976 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.907 -2.750 15.475 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.570 -2.000 17.054 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.770 -1.385 15.587 1.00 0.00 H new ATOM 1135 N TYR A 67 1.146 -5.497 16.065 1.00 0.00 N ATOM 1136 CA TYR A 67 1.115 -7.000 16.223 1.00 0.00 C ATOM 1137 C TYR A 67 2.503 -7.632 15.985 1.00 0.00 C ATOM 1138 O TYR A 67 2.849 -8.606 16.629 1.00 0.00 O ATOM 1139 CB TYR A 67 0.098 -7.536 15.194 1.00 0.00 C ATOM 1140 CG TYR A 67 0.008 -9.048 15.303 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.902 -9.852 14.586 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.958 -9.643 16.127 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.831 -11.247 14.689 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.028 -11.039 16.234 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.135 -11.840 15.513 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.202 -13.215 15.617 1.00 0.00 O ATOM 0 H TYR A 67 0.906 -5.148 15.137 1.00 0.00 H new ATOM 0 HA TYR A 67 0.828 -7.261 17.242 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.881 -7.090 15.370 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.401 -7.252 14.186 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.648 -9.396 13.952 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.649 -9.025 16.680 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.520 -11.865 14.134 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.770 -11.496 16.872 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.926 -13.462 16.229 1.00 0.00 H new ATOM 1156 N TYR A 68 3.286 -7.122 15.056 1.00 0.00 N ATOM 1157 CA TYR A 68 4.627 -7.759 14.791 1.00 0.00 C ATOM 1158 C TYR A 68 5.780 -7.066 15.549 1.00 0.00 C ATOM 1159 O TYR A 68 6.826 -7.664 15.731 1.00 0.00 O ATOM 1160 CB TYR A 68 4.849 -7.659 13.275 1.00 0.00 C ATOM 1161 CG TYR A 68 4.089 -8.761 12.571 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.412 -10.101 12.819 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.066 -8.444 11.664 1.00 0.00 C ATOM 1164 CE1 TYR A 68 3.715 -11.122 12.161 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.370 -9.465 11.008 1.00 0.00 C ATOM 1166 CZ TYR A 68 2.696 -10.805 11.256 1.00 0.00 C ATOM 1167 OH TYR A 68 2.010 -11.812 10.609 1.00 0.00 O ATOM 0 H TYR A 68 3.063 -6.310 14.480 1.00 0.00 H new ATOM 0 HA TYR A 68 4.625 -8.790 15.144 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.516 -6.686 12.913 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.912 -7.736 13.048 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.198 -10.347 13.517 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.816 -7.411 11.472 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.964 -12.155 12.352 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.582 -9.221 10.311 1.00 0.00 H new ATOM 0 HH TYR A 68 1.335 -11.420 10.017 1.00 0.00 H new ATOM 1177 N LYS A 69 5.629 -5.830 15.985 1.00 0.00 N ATOM 1178 CA LYS A 69 6.757 -5.162 16.712 1.00 0.00 C ATOM 1179 C LYS A 69 6.343 -4.772 18.141 1.00 0.00 C ATOM 1180 O LYS A 69 6.964 -5.197 19.098 1.00 0.00 O ATOM 1181 CB LYS A 69 7.089 -3.915 15.889 1.00 0.00 C ATOM 1182 CG LYS A 69 7.636 -4.335 14.522 1.00 0.00 C ATOM 1183 CD LYS A 69 6.472 -4.612 13.558 1.00 0.00 C ATOM 1184 CE LYS A 69 6.619 -3.750 12.300 1.00 0.00 C ATOM 1185 NZ LYS A 69 7.687 -4.415 11.502 1.00 0.00 N ATOM 0 H LYS A 69 4.787 -5.266 15.870 1.00 0.00 H new ATOM 0 HA LYS A 69 7.615 -5.826 16.812 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.197 -3.302 15.763 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.824 -3.305 16.414 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.275 -3.549 14.119 1.00 0.00 H new ATOM 0 HG3 LYS A 69 8.254 -5.227 14.626 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.457 -5.667 13.286 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.523 -4.396 14.049 1.00 0.00 H new ATOM 0 HE2 LYS A 69 5.683 -3.700 11.744 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.894 -2.726 12.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.470 -3.749 11.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.037 -5.248 12.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.300 -4.713 10.584 1.00 0.00 H new ATOM 1199 N ARG A 70 5.309 -3.971 18.304 1.00 0.00 N ATOM 1200 CA ARG A 70 4.891 -3.575 19.700 1.00 0.00 C ATOM 1201 C ARG A 70 4.406 -4.804 20.491 1.00 0.00 C ATOM 1202 O ARG A 70 4.545 -4.853 21.698 1.00 0.00 O ATOM 1203 CB ARG A 70 3.749 -2.559 19.554 1.00 0.00 C ATOM 1204 CG ARG A 70 3.772 -1.591 20.739 1.00 0.00 C ATOM 1205 CD ARG A 70 4.566 -0.339 20.359 1.00 0.00 C ATOM 1206 NE ARG A 70 3.914 0.775 21.114 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.731 1.248 20.754 1.00 0.00 C ATOM 1208 NH1 ARG A 70 2.083 0.760 19.721 1.00 0.00 N ATOM 1209 NH2 ARG A 70 2.190 2.224 21.437 1.00 0.00 N ATOM 0 H ARG A 70 4.745 -3.580 17.549 1.00 0.00 H new ATOM 0 HA ARG A 70 5.732 -3.146 20.244 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.855 -2.009 18.619 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.791 -3.077 19.512 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.755 -1.318 21.019 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.224 -2.072 21.607 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.616 -0.439 20.632 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.532 -0.161 19.284 1.00 0.00 H new ATOM 0 HE ARG A 70 4.390 1.178 21.921 1.00 0.00 H new ATOM 0 HH11 ARG A 70 2.490 -0.000 19.176 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.173 1.141 19.463 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.679 2.616 22.242 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.279 2.593 21.165 1.00 0.00 H new ATOM 1223 N LYS A 71 3.834 -5.799 19.833 1.00 0.00 N ATOM 1224 CA LYS A 71 3.342 -7.013 20.563 1.00 0.00 C ATOM 1225 C LYS A 71 2.299 -6.608 21.615 1.00 0.00 C ATOM 1226 O LYS A 71 2.322 -7.087 22.733 1.00 0.00 O ATOM 1227 CB LYS A 71 4.575 -7.640 21.230 1.00 0.00 C ATOM 1228 CG LYS A 71 4.547 -9.159 21.043 1.00 0.00 C ATOM 1229 CD LYS A 71 3.362 -9.748 21.811 1.00 0.00 C ATOM 1230 CE LYS A 71 3.018 -11.126 21.240 1.00 0.00 C ATOM 1231 NZ LYS A 71 3.853 -12.083 22.017 1.00 0.00 N ATOM 0 H LYS A 71 3.690 -5.817 18.823 1.00 0.00 H new ATOM 0 HA LYS A 71 2.861 -7.722 19.889 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.485 -7.227 20.795 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.590 -7.395 22.292 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.465 -9.404 19.984 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.479 -9.597 21.400 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.607 -9.832 22.870 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.500 -9.085 21.735 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.956 -11.346 21.353 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.243 -11.180 20.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.673 -13.051 21.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.859 -11.853 21.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.612 -12.014 23.026 1.00 0.00 H new ATOM 1245 N ALA A 72 1.377 -5.739 21.260 1.00 0.00 N ATOM 1246 CA ALA A 72 0.326 -5.318 22.234 1.00 0.00 C ATOM 1247 C ALA A 72 -1.059 -5.766 21.734 1.00 0.00 C ATOM 1248 O ALA A 72 -2.036 -5.058 21.887 1.00 0.00 O ATOM 1249 CB ALA A 72 0.412 -3.793 22.279 1.00 0.00 C ATOM 0 H ALA A 72 1.311 -5.307 20.339 1.00 0.00 H new ATOM 0 HA ALA A 72 0.471 -5.760 23.220 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.332 -3.407 22.976 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.407 -3.494 22.609 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.223 -3.388 21.285 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.151 -6.937 21.131 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.474 -7.418 20.619 1.00 0.00 C ATOM 1257 C ILE A 73 -2.476 -8.956 20.518 1.00 0.00 C ATOM 1258 O ILE A 73 -1.429 -9.576 20.521 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.616 -6.773 19.231 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.944 -7.201 18.595 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.457 -7.211 18.326 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.153 -6.446 17.280 1.00 0.00 C ATOM 0 H ILE A 73 -0.369 -7.573 20.975 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.301 -7.149 21.276 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.596 -5.689 19.343 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.941 -8.276 18.412 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.768 -6.996 19.278 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.567 -6.749 17.345 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.511 -6.900 18.770 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.469 -8.296 18.219 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.098 -6.753 16.831 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.175 -5.374 17.476 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.335 -6.673 16.596 1.00 0.00 H new ATOM 1274 N SER A 74 -3.633 -9.576 20.422 1.00 0.00 N ATOM 1275 CA SER A 74 -3.669 -11.067 20.313 1.00 0.00 C ATOM 1276 C SER A 74 -4.078 -11.483 18.891 1.00 0.00 C ATOM 1277 O SER A 74 -4.837 -10.792 18.241 1.00 0.00 O ATOM 1278 CB SER A 74 -4.717 -11.527 21.330 1.00 0.00 C ATOM 1279 OG SER A 74 -6.010 -11.425 20.749 1.00 0.00 O ATOM 0 H SER A 74 -4.543 -9.116 20.415 1.00 0.00 H new ATOM 0 HA SER A 74 -2.695 -11.515 20.511 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.521 -12.556 21.632 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.661 -10.915 22.230 1.00 0.00 H new ATOM 0 HG SER A 74 -6.684 -11.720 21.397 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.573 -12.602 18.399 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.935 -13.061 17.000 1.00 0.00 C ATOM 1287 C LYS A 75 -5.454 -12.958 16.744 1.00 0.00 C ATOM 1288 O LYS A 75 -5.872 -12.694 15.633 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.494 -14.529 16.897 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.304 -14.904 15.426 1.00 0.00 C ATOM 1291 CD LYS A 75 -2.966 -16.392 15.316 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.019 -16.616 14.136 1.00 0.00 C ATOM 1293 NZ LYS A 75 -0.654 -16.405 14.694 1.00 0.00 N ATOM 0 H LYS A 75 -2.930 -13.215 18.900 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.443 -12.431 16.259 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.564 -14.679 17.444 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.241 -15.177 17.355 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.212 -14.684 14.864 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.505 -14.306 14.988 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.502 -16.739 16.239 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.878 -16.973 15.179 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.128 -17.621 13.727 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.226 -15.918 13.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.056 -16.607 13.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.556 -15.418 15.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.507 -17.042 15.503 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.285 -13.156 17.752 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.769 -13.049 17.517 1.00 0.00 C ATOM 1309 C ASP A 76 -8.113 -11.625 17.059 1.00 0.00 C ATOM 1310 O ASP A 76 -8.790 -11.443 16.063 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.461 -13.361 18.854 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.541 -14.876 19.047 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -7.604 -15.553 18.658 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.538 -15.334 19.580 1.00 0.00 O ATOM 0 H ASP A 76 -6.007 -13.382 18.707 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.099 -13.743 16.745 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.907 -12.908 19.676 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.462 -12.929 18.867 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.637 -10.612 17.758 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.939 -9.206 17.313 1.00 0.00 C ATOM 1321 C LEU A 77 -7.221 -8.949 15.983 1.00 0.00 C ATOM 1322 O LEU A 77 -7.796 -8.405 15.059 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.408 -8.258 18.404 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.707 -6.808 18.012 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.219 -6.567 18.046 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.018 -5.856 18.997 1.00 0.00 C ATOM 0 H LEU A 77 -7.065 -10.695 18.599 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.008 -9.047 17.169 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.875 -8.491 19.361 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.334 -8.397 18.531 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.332 -6.624 17.005 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.429 -5.535 17.767 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.711 -7.240 17.344 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.595 -6.754 19.052 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.232 -4.825 18.716 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.390 -6.043 20.004 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.941 -6.023 18.972 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.970 -9.357 15.868 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.234 -9.147 14.570 1.00 0.00 C ATOM 1340 C TYR A 78 -5.962 -9.899 13.441 1.00 0.00 C ATOM 1341 O TYR A 78 -6.071 -9.398 12.336 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.810 -9.702 14.778 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.001 -9.582 13.502 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -2.980 -8.374 12.792 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.272 -10.680 13.034 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.228 -8.267 11.614 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.519 -10.573 11.857 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.498 -9.367 11.147 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.758 -9.261 9.988 1.00 0.00 O ATOM 0 H TYR A 78 -5.435 -9.819 16.604 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.193 -8.094 14.290 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.315 -9.157 15.582 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.862 -10.746 15.086 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.543 -7.526 13.152 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.289 -11.611 13.580 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.212 -7.336 11.067 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.955 -11.421 11.498 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.311 -10.114 9.806 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.482 -11.085 13.707 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.221 -11.828 12.628 1.00 0.00 C ATOM 1361 C ASP A 79 -8.586 -11.161 12.409 1.00 0.00 C ATOM 1362 O ASP A 79 -9.013 -10.969 11.285 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.403 -13.272 13.124 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.964 -14.134 11.992 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -9.039 -13.817 11.510 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.309 -15.096 11.626 1.00 0.00 O ATOM 0 H ASP A 79 -6.427 -11.560 14.608 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.677 -11.817 11.683 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.448 -13.674 13.463 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.079 -13.292 13.979 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.269 -10.784 13.475 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.606 -10.103 13.308 1.00 0.00 C ATOM 1373 C TRP A 80 -10.435 -8.824 12.465 1.00 0.00 C ATOM 1374 O TRP A 80 -11.284 -8.499 11.656 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.098 -9.752 14.725 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.436 -9.085 14.655 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.617 -9.725 14.492 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.750 -7.665 14.747 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.635 -8.788 14.478 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.150 -7.504 14.631 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.961 -6.513 14.917 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.747 -6.244 14.682 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.560 -5.243 14.967 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.950 -5.108 14.851 1.00 0.00 C ATOM 0 H TRP A 80 -8.965 -10.916 14.440 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.323 -10.745 12.796 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.165 -10.657 15.329 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.380 -9.094 15.215 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.744 -10.793 14.390 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.623 -9.017 14.368 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.889 -6.605 15.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.819 -6.147 14.591 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.945 -4.365 15.096 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.404 -4.129 14.892 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.340 -8.104 12.634 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.139 -6.860 11.811 1.00 0.00 C ATOM 1397 C LEU A 81 -8.901 -7.262 10.348 1.00 0.00 C ATOM 1398 O LEU A 81 -9.530 -6.737 9.447 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.898 -6.143 12.376 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.137 -5.761 13.840 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.792 -5.646 14.561 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.859 -4.415 13.908 1.00 0.00 C ATOM 0 H LEU A 81 -8.592 -8.320 13.293 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.009 -6.205 11.852 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.026 -6.792 12.298 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.684 -5.250 11.788 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.748 -6.527 14.318 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.960 -5.374 15.603 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.271 -6.603 14.515 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.185 -4.879 14.079 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.028 -4.145 14.950 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.248 -3.650 13.430 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.817 -4.489 13.393 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.011 -8.206 10.100 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.759 -8.644 8.677 1.00 0.00 C ATOM 1416 C ILE A 82 -9.078 -9.128 8.028 1.00 0.00 C ATOM 1417 O ILE A 82 -9.260 -8.993 6.832 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.727 -9.800 8.744 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.370 -9.260 9.233 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.545 -10.439 7.358 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.831 -8.197 8.263 1.00 0.00 C ATOM 0 H ILE A 82 -7.456 -8.686 10.809 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.380 -7.821 8.071 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.097 -10.554 9.439 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.481 -8.829 10.228 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.656 -10.079 9.318 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.818 -11.248 7.423 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.499 -10.836 7.012 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.189 -9.687 6.654 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.872 -7.827 8.625 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.700 -8.639 7.275 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.538 -7.370 8.200 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.998 -9.687 8.796 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.289 -10.167 8.185 1.00 0.00 C ATOM 1435 C LYS A 83 -12.351 -9.048 8.136 1.00 0.00 C ATOM 1436 O LYS A 83 -13.270 -9.117 7.342 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.778 -11.324 9.069 1.00 0.00 C ATOM 1438 CG LYS A 83 -10.971 -12.585 8.753 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.853 -13.819 8.950 1.00 0.00 C ATOM 1440 CE LYS A 83 -11.398 -14.930 8.001 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.794 -16.198 8.674 1.00 0.00 N ATOM 0 H LYS A 83 -9.912 -9.829 9.802 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.127 -10.482 7.154 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.668 -11.063 10.122 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.839 -11.505 8.895 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.604 -12.547 7.727 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.097 -12.642 9.402 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.792 -14.161 9.983 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.896 -13.568 8.759 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.875 -14.835 7.025 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.321 -14.891 7.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -11.515 -17.007 8.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.320 -16.264 9.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.825 -16.210 8.813 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.249 -8.022 8.962 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.283 -6.928 8.918 1.00 0.00 C ATOM 1457 C GLU A 84 -12.783 -5.688 8.135 1.00 0.00 C ATOM 1458 O GLU A 84 -13.302 -4.603 8.309 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.542 -6.558 10.373 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.195 -7.731 11.100 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.581 -7.996 10.509 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.366 -7.064 10.447 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.834 -9.128 10.127 1.00 0.00 O ATOM 0 H GLU A 84 -11.508 -7.897 9.652 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.183 -7.267 8.405 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.605 -6.292 10.862 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.188 -5.682 10.425 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.573 -8.621 11.007 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.279 -7.511 12.164 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.790 -5.839 7.272 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.249 -4.691 6.453 1.00 0.00 C ATOM 1472 C LYS A 85 -10.413 -3.736 7.310 1.00 0.00 C ATOM 1473 O LYS A 85 -10.877 -2.689 7.720 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.450 -3.964 5.826 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.079 -3.481 4.423 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.339 -3.399 3.560 1.00 0.00 C ATOM 1477 CE LYS A 85 -14.104 -2.117 3.894 1.00 0.00 C ATOM 1478 NZ LYS A 85 -14.710 -1.685 2.603 1.00 0.00 N ATOM 0 H LYS A 85 -11.324 -6.729 7.099 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.584 -5.068 5.676 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.308 -4.634 5.776 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.742 -3.118 6.448 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.600 -2.504 4.479 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.360 -4.164 3.971 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.070 -3.410 2.504 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.971 -4.269 3.737 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -14.869 -2.299 4.648 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.438 -1.352 4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.252 -0.810 2.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.957 -1.513 1.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.344 -2.430 2.251 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.175 -4.096 7.584 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.298 -3.222 8.410 1.00 0.00 C ATOM 1494 C TYR A 86 -6.893 -3.171 7.795 1.00 0.00 C ATOM 1495 O TYR A 86 -6.449 -2.137 7.338 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.258 -3.899 9.778 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.506 -3.558 10.549 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.732 -4.162 10.225 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.433 -2.632 11.593 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.881 -3.827 10.958 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.580 -2.304 12.323 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.803 -2.900 12.004 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.935 -2.577 12.723 1.00 0.00 O ATOM 0 H TYR A 86 -8.741 -4.963 7.266 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.661 -2.196 8.472 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.177 -4.979 9.658 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.377 -3.573 10.331 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.790 -4.878 9.419 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.488 -2.168 11.837 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.828 -4.286 10.714 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.521 -1.591 13.132 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.677 -2.257 13.613 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.197 -4.287 7.769 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.831 -4.307 7.172 1.00 0.00 C ATOM 1515 C ALA A 87 -4.834 -5.214 5.935 1.00 0.00 C ATOM 1516 O ALA A 87 -5.818 -5.875 5.656 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.922 -4.877 8.264 1.00 0.00 C ATOM 0 H ALA A 87 -6.521 -5.181 8.137 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.494 -3.321 6.853 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.897 -4.922 7.897 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.964 -4.235 9.144 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.257 -5.880 8.530 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.753 -5.255 5.185 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.726 -6.123 3.972 1.00 0.00 C ATOM 1525 C ASP A 88 -2.654 -7.212 4.117 1.00 0.00 C ATOM 1526 O ASP A 88 -1.475 -6.945 3.972 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.384 -5.182 2.821 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.024 -5.701 1.533 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.841 -6.870 1.234 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.686 -4.922 0.869 1.00 0.00 O ATOM 0 H ASP A 88 -2.898 -4.728 5.363 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.674 -6.636 3.812 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.744 -4.177 3.039 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.303 -5.114 2.701 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.048 -8.440 4.393 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.022 -9.536 4.534 1.00 0.00 C ATOM 1537 C LYS A 89 -1.229 -9.681 3.224 1.00 0.00 C ATOM 1538 O LYS A 89 -0.031 -9.891 3.246 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.794 -10.833 4.830 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.169 -10.881 6.313 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.142 -11.721 7.076 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.503 -13.204 6.958 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.219 -13.776 8.303 1.00 0.00 N ATOM 0 H LYS A 89 -4.017 -8.728 4.525 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.315 -9.312 5.333 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.693 -10.881 4.216 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.184 -11.698 4.571 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.204 -9.871 6.722 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.165 -11.308 6.433 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.144 -11.546 6.675 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.121 -11.424 8.124 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.550 -13.335 6.686 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -1.910 -13.695 6.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -2.442 -14.792 8.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -1.213 -13.642 8.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.803 -13.294 9.016 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.883 -9.565 2.082 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.134 -9.698 0.782 1.00 0.00 C ATOM 1559 C LEU A 90 -0.056 -8.607 0.684 1.00 0.00 C ATOM 1560 O LEU A 90 1.048 -8.868 0.243 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.164 -9.529 -0.347 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.538 -9.955 -1.676 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.379 -11.476 -1.703 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.446 -9.519 -2.829 1.00 0.00 C ATOM 0 H LEU A 90 -2.884 -9.387 1.995 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.638 -10.666 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.049 -10.131 -0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.491 -8.491 -0.403 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.560 -9.486 -1.783 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.933 -11.778 -2.650 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.734 -11.789 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.357 -11.946 -1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.001 -9.822 -3.777 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.423 -9.989 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.561 -8.435 -2.812 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.355 -7.390 1.101 1.00 0.00 N ATOM 1577 CA LEU A 91 0.691 -6.309 1.028 1.00 0.00 C ATOM 1578 C LEU A 91 1.772 -6.594 2.075 1.00 0.00 C ATOM 1579 O LEU A 91 2.949 -6.598 1.764 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.011 -4.974 1.326 1.00 0.00 C ATOM 1581 CG LEU A 91 0.976 -3.816 1.134 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.463 -3.768 -0.326 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.281 -2.498 1.488 1.00 0.00 C ATOM 0 H LEU A 91 -1.258 -7.104 1.480 1.00 0.00 H new ATOM 0 HA LEU A 91 1.163 -6.271 0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.868 -4.847 0.665 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.393 -4.973 2.347 1.00 0.00 H new ATOM 0 HG LEU A 91 1.836 -3.967 1.786 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.163 -2.942 -0.449 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.961 -4.705 -0.575 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.610 -3.623 -0.989 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.978 -1.671 1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.581 -2.355 0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.049 -2.528 2.526 1.00 0.00 H new ATOM 1595 N ILE A 92 1.388 -6.864 3.309 1.00 0.00 N ATOM 1596 CA ILE A 92 2.427 -7.185 4.350 1.00 0.00 C ATOM 1597 C ILE A 92 3.177 -8.470 3.930 1.00 0.00 C ATOM 1598 O ILE A 92 4.356 -8.608 4.200 1.00 0.00 O ATOM 1599 CB ILE A 92 1.674 -7.363 5.692 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.155 -5.989 6.149 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.616 -7.939 6.760 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.405 -6.110 7.484 1.00 0.00 C ATOM 0 H ILE A 92 0.421 -6.876 3.634 1.00 0.00 H new ATOM 0 HA ILE A 92 3.171 -6.396 4.454 1.00 0.00 H new ATOM 0 HB ILE A 92 0.842 -8.054 5.554 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.990 -5.296 6.256 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.492 -5.574 5.390 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.073 -8.059 7.698 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.990 -8.909 6.431 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.455 -7.259 6.910 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.046 -5.127 7.790 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.442 -6.785 7.365 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.079 -6.503 8.245 1.00 0.00 H new ATOM 1614 N ALA A 93 2.519 -9.398 3.253 1.00 0.00 N ATOM 1615 CA ALA A 93 3.240 -10.644 2.813 1.00 0.00 C ATOM 1616 C ALA A 93 4.210 -10.290 1.674 1.00 0.00 C ATOM 1617 O ALA A 93 5.334 -10.755 1.650 1.00 0.00 O ATOM 1618 CB ALA A 93 2.170 -11.629 2.318 1.00 0.00 C ATOM 0 H ALA A 93 1.534 -9.346 2.992 1.00 0.00 H new ATOM 0 HA ALA A 93 3.815 -11.084 3.627 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.649 -12.551 1.988 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.477 -11.851 3.129 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.624 -11.185 1.485 1.00 0.00 H new ATOM 1624 N LYS A 94 3.794 -9.459 0.731 1.00 0.00 N ATOM 1625 CA LYS A 94 4.730 -9.083 -0.390 1.00 0.00 C ATOM 1626 C LYS A 94 5.975 -8.385 0.175 1.00 0.00 C ATOM 1627 O LYS A 94 7.076 -8.632 -0.277 1.00 0.00 O ATOM 1628 CB LYS A 94 3.967 -8.136 -1.335 1.00 0.00 C ATOM 1629 CG LYS A 94 3.266 -8.954 -2.422 1.00 0.00 C ATOM 1630 CD LYS A 94 1.925 -8.312 -2.767 1.00 0.00 C ATOM 1631 CE LYS A 94 1.462 -8.801 -4.142 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.284 -10.272 -3.986 1.00 0.00 N ATOM 0 H LYS A 94 2.867 -9.034 0.690 1.00 0.00 H new ATOM 0 HA LYS A 94 5.060 -9.971 -0.929 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.235 -7.556 -0.773 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.657 -7.424 -1.789 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.894 -9.008 -3.312 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.112 -9.977 -2.078 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.183 -8.566 -2.010 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.020 -7.226 -2.769 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.530 -8.320 -4.439 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.199 -8.572 -4.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 0.637 -10.623 -4.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.205 -10.745 -4.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.885 -10.476 -3.047 1.00 0.00 H new ATOM 1646 N TRP A 95 5.821 -7.525 1.165 1.00 0.00 N ATOM 1647 CA TRP A 95 7.036 -6.837 1.738 1.00 0.00 C ATOM 1648 C TRP A 95 7.944 -7.866 2.431 1.00 0.00 C ATOM 1649 O TRP A 95 9.154 -7.782 2.346 1.00 0.00 O ATOM 1650 CB TRP A 95 6.532 -5.795 2.755 1.00 0.00 C ATOM 1651 CG TRP A 95 6.291 -4.476 2.077 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.061 -3.944 1.094 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.228 -3.512 2.325 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.531 -2.723 0.722 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.403 -2.412 1.451 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.137 -3.487 3.211 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.529 -1.326 1.457 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.254 -2.393 3.221 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.451 -1.315 2.345 1.00 0.00 C ATOM 0 H TRP A 95 4.930 -7.274 1.593 1.00 0.00 H new ATOM 0 HA TRP A 95 7.618 -6.355 0.952 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.610 -6.146 3.219 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.264 -5.673 3.553 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.944 -4.400 0.671 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.926 -2.125 -0.004 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.976 -4.313 3.888 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.684 -0.499 0.780 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.420 -2.382 3.907 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.770 -0.477 2.357 1.00 0.00 H new ATOM 1670 N ARG A 96 7.375 -8.844 3.107 1.00 0.00 N ATOM 1671 CA ARG A 96 8.234 -9.879 3.788 1.00 0.00 C ATOM 1672 C ARG A 96 8.833 -10.841 2.746 1.00 0.00 C ATOM 1673 O ARG A 96 9.951 -11.296 2.896 1.00 0.00 O ATOM 1674 CB ARG A 96 7.320 -10.642 4.759 1.00 0.00 C ATOM 1675 CG ARG A 96 7.235 -9.888 6.096 1.00 0.00 C ATOM 1676 CD ARG A 96 5.766 -9.664 6.486 1.00 0.00 C ATOM 1677 NE ARG A 96 5.588 -10.402 7.776 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.412 -11.715 7.803 1.00 0.00 C ATOM 1679 NH1 ARG A 96 5.390 -12.428 6.700 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.258 -12.321 8.951 1.00 0.00 N ATOM 0 H ARG A 96 6.369 -8.971 3.217 1.00 0.00 H new ATOM 0 HA ARG A 96 9.064 -9.413 4.319 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.325 -10.749 4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.707 -11.648 4.922 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.743 -10.456 6.875 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.748 -8.929 6.015 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.547 -8.603 6.606 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.092 -10.044 5.718 1.00 0.00 H new ATOM 0 HE ARG A 96 5.603 -9.883 8.654 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.510 -11.972 5.796 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.253 -13.438 6.748 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.274 -11.783 9.818 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.122 -13.331 8.980 1.00 0.00 H new ATOM 1694 N LYS A 97 8.103 -11.158 1.693 1.00 0.00 N ATOM 1695 CA LYS A 97 8.654 -12.099 0.645 1.00 0.00 C ATOM 1696 C LYS A 97 10.024 -11.608 0.141 1.00 0.00 C ATOM 1697 O LYS A 97 10.522 -10.590 0.585 1.00 0.00 O ATOM 1698 CB LYS A 97 7.653 -12.088 -0.523 1.00 0.00 C ATOM 1699 CG LYS A 97 6.598 -13.176 -0.323 1.00 0.00 C ATOM 1700 CD LYS A 97 7.265 -14.553 -0.352 1.00 0.00 C ATOM 1701 CE LYS A 97 6.285 -15.583 -0.919 1.00 0.00 C ATOM 1702 NZ LYS A 97 6.814 -16.903 -0.477 1.00 0.00 N ATOM 0 H LYS A 97 7.161 -10.812 1.513 1.00 0.00 H new ATOM 0 HA LYS A 97 8.786 -13.098 1.060 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.172 -11.112 -0.590 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.179 -12.249 -1.464 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.086 -13.029 0.628 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.842 -13.111 -1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.167 -14.519 -0.963 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.571 -14.842 0.653 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.276 -15.416 -0.543 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.234 -15.522 -2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 6.194 -17.661 -0.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.773 -17.037 -0.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.845 -16.934 0.562 1.00 0.00 H new ATOM 1716 N THR A 98 10.626 -12.311 -0.796 1.00 0.00 N ATOM 1717 CA THR A 98 11.949 -11.865 -1.334 1.00 0.00 C ATOM 1718 C THR A 98 11.762 -11.306 -2.750 1.00 0.00 C ATOM 1719 O THR A 98 10.964 -11.817 -3.515 1.00 0.00 O ATOM 1720 CB THR A 98 12.831 -13.117 -1.356 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.753 -13.773 -0.099 1.00 0.00 O ATOM 1722 CG2 THR A 98 14.281 -12.718 -1.637 1.00 0.00 C ATOM 0 H THR A 98 10.258 -13.169 -1.207 1.00 0.00 H new ATOM 0 HA THR A 98 12.400 -11.078 -0.729 1.00 0.00 H new ATOM 0 HB THR A 98 12.484 -13.791 -2.139 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.316 -14.575 -0.113 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.907 -13.610 -1.652 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.340 -12.217 -2.603 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.630 -12.043 -0.856 1.00 0.00 H new ATOM 1730 N GLY A 99 12.473 -10.256 -3.108 1.00 0.00 N ATOM 1731 CA GLY A 99 12.304 -9.676 -4.474 1.00 0.00 C ATOM 1732 C GLY A 99 11.433 -8.404 -4.412 1.00 0.00 C ATOM 1733 O GLY A 99 11.543 -7.545 -5.266 1.00 0.00 O ATOM 0 H GLY A 99 13.155 -9.783 -2.515 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.279 -9.437 -4.898 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.841 -10.410 -5.133 1.00 0.00 H new ATOM 1737 N TYR A 100 10.569 -8.262 -3.417 1.00 0.00 N ATOM 1738 CA TYR A 100 9.715 -7.027 -3.340 1.00 0.00 C ATOM 1739 C TYR A 100 10.414 -5.952 -2.486 1.00 0.00 C ATOM 1740 O TYR A 100 9.869 -5.488 -1.501 1.00 0.00 O ATOM 1741 CB TYR A 100 8.397 -7.453 -2.675 1.00 0.00 C ATOM 1742 CG TYR A 100 7.670 -8.442 -3.555 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.251 -8.066 -4.835 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.406 -9.733 -3.082 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.568 -8.982 -5.645 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.726 -10.650 -3.890 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.306 -10.275 -5.173 1.00 0.00 C ATOM 1748 OH TYR A 100 5.633 -11.177 -5.970 1.00 0.00 O ATOM 0 H TYR A 100 10.424 -8.940 -2.669 1.00 0.00 H new ATOM 0 HA TYR A 100 9.542 -6.603 -4.329 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.599 -7.900 -1.702 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.769 -6.579 -2.500 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.454 -7.070 -5.199 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.728 -10.021 -2.092 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.243 -8.692 -6.633 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.525 -11.646 -3.525 1.00 0.00 H new ATOM 0 HH TYR A 100 5.535 -12.027 -5.492 1.00 0.00 H new ATOM 1758 N GLU A 101 11.612 -5.546 -2.855 1.00 0.00 N ATOM 1759 CA GLU A 101 12.321 -4.490 -2.046 1.00 0.00 C ATOM 1760 C GLU A 101 11.628 -3.131 -2.236 1.00 0.00 C ATOM 1761 O GLU A 101 11.508 -2.361 -1.302 1.00 0.00 O ATOM 1762 CB GLU A 101 13.765 -4.427 -2.569 1.00 0.00 C ATOM 1763 CG GLU A 101 14.702 -4.009 -1.433 1.00 0.00 C ATOM 1764 CD GLU A 101 15.989 -3.428 -2.021 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.797 -4.202 -2.509 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.145 -2.219 -1.975 1.00 0.00 O ATOM 0 H GLU A 101 12.123 -5.892 -3.667 1.00 0.00 H new ATOM 0 HA GLU A 101 12.302 -4.729 -0.983 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.063 -5.399 -2.962 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.834 -3.716 -3.392 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.214 -3.270 -0.798 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.933 -4.868 -0.803 1.00 0.00 H new ATOM 1773 N LYS A 102 11.171 -2.826 -3.436 1.00 0.00 N ATOM 1774 CA LYS A 102 10.492 -1.518 -3.670 1.00 0.00 C ATOM 1775 C LYS A 102 9.039 -1.748 -4.118 1.00 0.00 C ATOM 1776 O LYS A 102 8.757 -1.823 -5.299 1.00 0.00 O ATOM 1777 CB LYS A 102 11.305 -0.850 -4.782 1.00 0.00 C ATOM 1778 CG LYS A 102 12.675 -0.416 -4.236 1.00 0.00 C ATOM 1779 CD LYS A 102 12.787 1.117 -4.245 1.00 0.00 C ATOM 1780 CE LYS A 102 13.724 1.564 -5.371 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.538 2.663 -4.780 1.00 0.00 N ATOM 0 H LYS A 102 11.242 -3.429 -4.255 1.00 0.00 H new ATOM 0 HA LYS A 102 10.449 -0.902 -2.771 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.437 -1.542 -5.614 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.767 0.015 -5.169 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.806 -0.792 -3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.470 -0.850 -4.842 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.801 1.562 -4.382 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.164 1.469 -3.285 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.356 0.742 -5.709 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.162 1.911 -6.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.205 3.022 -5.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.910 3.434 -4.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.067 2.301 -3.961 1.00 0.00 H new ATOM 1795 N LEU A 103 8.113 -1.864 -3.186 1.00 0.00 N ATOM 1796 CA LEU A 103 6.686 -2.092 -3.567 1.00 0.00 C ATOM 1797 C LEU A 103 5.810 -0.940 -3.023 1.00 0.00 C ATOM 1798 O LEU A 103 5.925 -0.558 -1.874 1.00 0.00 O ATOM 1799 CB LEU A 103 6.333 -3.452 -2.924 1.00 0.00 C ATOM 1800 CG LEU A 103 4.815 -3.649 -2.841 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.225 -3.641 -4.251 1.00 0.00 C ATOM 1802 CD2 LEU A 103 4.514 -4.989 -2.166 1.00 0.00 C ATOM 0 H LEU A 103 8.289 -1.810 -2.183 1.00 0.00 H new ATOM 0 HA LEU A 103 6.518 -2.110 -4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.776 -4.259 -3.508 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.765 -3.508 -1.925 1.00 0.00 H new ATOM 0 HG LEU A 103 4.372 -2.842 -2.258 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.146 -3.781 -4.195 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.443 -2.687 -4.731 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.666 -4.449 -4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.435 -5.132 -2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.955 -5.797 -2.749 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.937 -4.994 -1.162 1.00 0.00 H new ATOM 1814 N CYS A 104 4.936 -0.384 -3.845 1.00 0.00 N ATOM 1815 CA CYS A 104 4.064 0.740 -3.361 1.00 0.00 C ATOM 1816 C CYS A 104 2.605 0.290 -3.137 1.00 0.00 C ATOM 1817 O CYS A 104 1.971 0.743 -2.207 1.00 0.00 O ATOM 1818 CB CYS A 104 4.176 1.872 -4.404 1.00 0.00 C ATOM 1819 SG CYS A 104 3.634 1.354 -6.064 1.00 0.00 S ATOM 0 H CYS A 104 4.793 -0.659 -4.817 1.00 0.00 H new ATOM 0 HA CYS A 104 4.399 1.090 -2.385 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.575 2.721 -4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.210 2.214 -4.454 1.00 0.00 H new ATOM 0 HG CYS A 104 4.672 1.043 -6.782 1.00 0.00 H new ATOM 1824 N CYS A 105 2.059 -0.597 -3.943 1.00 0.00 N ATOM 1825 CA CYS A 105 0.644 -1.050 -3.695 1.00 0.00 C ATOM 1826 C CYS A 105 0.537 -2.564 -3.955 1.00 0.00 C ATOM 1827 O CYS A 105 1.536 -3.233 -4.118 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.264 -0.300 -4.682 1.00 0.00 C ATOM 1829 SG CYS A 105 0.168 1.461 -4.817 1.00 0.00 S ATOM 0 H CYS A 105 2.521 -1.021 -4.748 1.00 0.00 H new ATOM 0 HA CYS A 105 0.350 -0.845 -2.666 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.191 -0.766 -5.665 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.301 -0.394 -4.361 1.00 0.00 H new ATOM 0 HG CYS A 105 1.380 1.577 -5.272 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.664 -3.110 -4.004 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.803 -4.586 -4.267 1.00 0.00 C ATOM 1836 C LEU A 106 -1.123 -4.846 -5.752 1.00 0.00 C ATOM 1837 O LEU A 106 -0.634 -5.800 -6.328 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.946 -5.070 -3.372 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.401 -5.420 -1.984 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.565 -5.815 -1.076 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.404 -6.589 -2.090 1.00 0.00 C ATOM 0 H LEU A 106 -1.541 -2.605 -3.875 1.00 0.00 H new ATOM 0 HA LEU A 106 0.123 -5.118 -4.048 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.709 -4.296 -3.289 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.424 -5.943 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.886 -4.555 -1.566 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.185 -6.066 -0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.263 -4.982 -0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.078 -6.680 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.021 -6.832 -1.099 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.908 -7.460 -2.508 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.424 -6.303 -2.739 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.904 -3.993 -6.393 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.197 -4.193 -7.852 1.00 0.00 C ATOM 1855 C ARG A 107 -1.358 -3.194 -8.676 1.00 0.00 C ATOM 1856 O ARG A 107 -1.803 -2.679 -9.683 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.694 -3.913 -8.020 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.176 -4.486 -9.354 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.482 -3.800 -9.763 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.554 -4.556 -9.047 1.00 0.00 N ATOM 1861 CZ ARG A 107 -6.889 -5.785 -9.410 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.295 -6.389 -10.414 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.833 -6.416 -8.761 1.00 0.00 N ATOM 0 H ARG A 107 -2.345 -3.176 -5.970 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.949 -5.198 -8.194 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.253 -4.360 -7.198 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.880 -2.840 -7.985 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.417 -4.335 -10.122 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -4.330 -5.561 -9.265 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.482 -2.748 -9.477 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.626 -3.837 -10.843 1.00 0.00 H new ATOM 0 HE ARG A 107 -7.037 -4.117 -8.263 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.558 -5.911 -10.933 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.571 -7.336 -10.675 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.307 -5.962 -7.980 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.096 -7.363 -9.036 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.151 -2.903 -8.235 1.00 0.00 N ATOM 1878 CA CYS A 108 0.729 -1.929 -8.949 1.00 0.00 C ATOM 1879 C CYS A 108 2.125 -2.581 -9.180 1.00 0.00 C ATOM 1880 O CYS A 108 3.098 -1.892 -9.407 1.00 0.00 O ATOM 1881 CB CYS A 108 0.808 -0.800 -7.911 1.00 0.00 C ATOM 1882 SG CYS A 108 1.001 0.859 -8.608 1.00 0.00 S ATOM 0 H CYS A 108 0.263 -3.309 -7.396 1.00 0.00 H new ATOM 0 HA CYS A 108 0.380 -1.603 -9.929 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.096 -0.820 -7.303 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.646 -0.998 -7.243 1.00 0.00 H new ATOM 0 HG CYS A 108 1.264 0.768 -9.878 1.00 0.00 H new ATOM 1887 N ILE A 109 2.228 -3.912 -9.104 1.00 0.00 N ATOM 1888 CA ILE A 109 3.552 -4.607 -9.293 1.00 0.00 C ATOM 1889 C ILE A 109 3.330 -6.082 -9.698 1.00 0.00 C ATOM 1890 O ILE A 109 4.046 -6.959 -9.248 1.00 0.00 O ATOM 1891 CB ILE A 109 4.237 -4.577 -7.911 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.284 -5.155 -6.842 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.615 -3.142 -7.540 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.028 -6.159 -5.951 1.00 0.00 C ATOM 0 H ILE A 109 1.444 -4.537 -8.918 1.00 0.00 H new ATOM 0 HA ILE A 109 4.143 -4.122 -10.070 1.00 0.00 H new ATOM 0 HB ILE A 109 5.142 -5.183 -7.954 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.879 -4.348 -6.232 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.439 -5.644 -7.325 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.098 -3.134 -6.563 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.301 -2.742 -8.287 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.716 -2.526 -7.506 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.344 -6.558 -5.202 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.411 -6.975 -6.564 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.858 -5.658 -5.453 1.00 0.00 H new ATOM 1906 N GLN A 110 2.343 -6.371 -10.521 1.00 0.00 N ATOM 1907 CA GLN A 110 2.095 -7.808 -10.911 1.00 0.00 C ATOM 1908 C GLN A 110 3.224 -8.331 -11.814 1.00 0.00 C ATOM 1909 O GLN A 110 3.031 -8.528 -12.999 1.00 0.00 O ATOM 1910 CB GLN A 110 0.754 -7.836 -11.663 1.00 0.00 C ATOM 1911 CG GLN A 110 0.063 -9.181 -11.426 1.00 0.00 C ATOM 1912 CD GLN A 110 0.629 -10.226 -12.394 1.00 0.00 C ATOM 1913 OE1 GLN A 110 0.924 -9.914 -13.531 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.797 -11.464 -11.996 1.00 0.00 N ATOM 0 H GLN A 110 1.707 -5.689 -10.935 1.00 0.00 H new ATOM 0 HA GLN A 110 2.066 -8.448 -10.029 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.116 -7.022 -11.320 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.920 -7.683 -12.729 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.216 -9.504 -10.396 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -1.012 -9.080 -11.572 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.551 -11.731 -11.043 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.174 -12.160 -12.640 1.00 0.00 H new ATOM 2034 N THR A 119 0.392 -5.883 -15.137 1.00 0.00 N ATOM 2035 CA THR A 119 1.376 -5.280 -14.186 1.00 0.00 C ATOM 2036 C THR A 119 1.389 -3.752 -14.337 1.00 0.00 C ATOM 2037 O THR A 119 0.829 -3.217 -15.275 1.00 0.00 O ATOM 2038 CB THR A 119 2.736 -5.863 -14.591 1.00 0.00 C ATOM 2039 OG1 THR A 119 2.578 -7.234 -14.934 1.00 0.00 O ATOM 2040 CG2 THR A 119 3.727 -5.734 -13.428 1.00 0.00 C ATOM 0 HA THR A 119 1.129 -5.500 -13.147 1.00 0.00 H new ATOM 0 HB THR A 119 3.122 -5.314 -15.450 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.053 -7.791 -14.282 1.00 0.00 H new ATOM 0 HG21 THR A 119 4.690 -6.150 -13.723 1.00 0.00 H new ATOM 0 HG22 THR A 119 3.850 -4.682 -13.170 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.346 -6.278 -12.564 1.00 0.00 H new ATOM 2048 N CYS A 120 2.034 -3.044 -13.432 1.00 0.00 N ATOM 2049 CA CYS A 120 2.085 -1.553 -13.551 1.00 0.00 C ATOM 2050 C CYS A 120 3.457 -1.122 -14.097 1.00 0.00 C ATOM 2051 O CYS A 120 4.432 -1.836 -13.953 1.00 0.00 O ATOM 2052 CB CYS A 120 1.875 -1.011 -12.137 1.00 0.00 C ATOM 2053 SG CYS A 120 1.751 0.788 -12.219 1.00 0.00 S ATOM 0 H CYS A 120 2.522 -3.434 -12.625 1.00 0.00 H new ATOM 0 HA CYS A 120 1.326 -1.172 -14.235 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.969 -1.433 -11.701 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.704 -1.304 -11.493 1.00 0.00 H new ATOM 0 HG CYS A 120 2.642 1.321 -11.436 1.00 0.00 H new ATOM 2058 N ILE A 121 3.542 0.030 -14.732 1.00 0.00 N ATOM 2059 CA ILE A 121 4.867 0.477 -15.291 1.00 0.00 C ATOM 2060 C ILE A 121 5.818 0.932 -14.164 1.00 0.00 C ATOM 2061 O ILE A 121 7.012 0.711 -14.246 1.00 0.00 O ATOM 2062 CB ILE A 121 4.553 1.629 -16.277 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.787 1.928 -17.157 1.00 0.00 C ATOM 2064 CG2 ILE A 121 4.106 2.894 -15.526 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.931 2.563 -16.346 1.00 0.00 C ATOM 0 H ILE A 121 2.764 0.672 -14.886 1.00 0.00 H new ATOM 0 HA ILE A 121 5.379 -0.338 -15.802 1.00 0.00 H new ATOM 0 HB ILE A 121 3.731 1.314 -16.920 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.137 1.004 -17.617 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.501 2.599 -17.967 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.892 3.686 -16.243 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.208 2.676 -14.948 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.900 3.218 -14.854 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.779 2.757 -17.003 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.589 3.501 -15.908 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.236 1.881 -15.552 1.00 0.00 H new ATOM 2077 N CYS A 122 5.320 1.578 -13.125 1.00 0.00 N ATOM 2078 CA CYS A 122 6.254 2.050 -12.034 1.00 0.00 C ATOM 2079 C CYS A 122 7.126 0.890 -11.502 1.00 0.00 C ATOM 2080 O CYS A 122 8.261 1.103 -11.119 1.00 0.00 O ATOM 2081 CB CYS A 122 5.380 2.718 -10.934 1.00 0.00 C ATOM 2082 SG CYS A 122 4.617 1.502 -9.809 1.00 0.00 S ATOM 0 H CYS A 122 4.333 1.795 -12.985 1.00 0.00 H new ATOM 0 HA CYS A 122 6.966 2.782 -12.415 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.995 3.407 -10.355 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.597 3.311 -11.407 1.00 0.00 H new ATOM 0 HG CYS A 122 5.454 1.204 -8.860 1.00 0.00 H new ATOM 2087 N ARG A 123 6.627 -0.332 -11.502 1.00 0.00 N ATOM 2088 CA ARG A 123 7.484 -1.477 -11.020 1.00 0.00 C ATOM 2089 C ARG A 123 8.741 -1.596 -11.905 1.00 0.00 C ATOM 2090 O ARG A 123 9.797 -1.972 -11.431 1.00 0.00 O ATOM 2091 CB ARG A 123 6.637 -2.753 -11.140 1.00 0.00 C ATOM 2092 CG ARG A 123 7.043 -3.740 -10.045 1.00 0.00 C ATOM 2093 CD ARG A 123 8.155 -4.652 -10.567 1.00 0.00 C ATOM 2094 NE ARG A 123 8.640 -5.398 -9.365 1.00 0.00 N ATOM 2095 CZ ARG A 123 7.945 -6.401 -8.852 1.00 0.00 C ATOM 2096 NH1 ARG A 123 6.801 -6.781 -9.375 1.00 0.00 N ATOM 2097 NH2 ARG A 123 8.401 -7.033 -7.801 1.00 0.00 N ATOM 0 H ARG A 123 5.687 -0.583 -11.807 1.00 0.00 H new ATOM 0 HA ARG A 123 7.806 -1.319 -9.991 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.578 -2.509 -11.050 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.778 -3.205 -12.122 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.385 -3.200 -9.162 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.183 -4.336 -9.740 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.780 -5.334 -11.330 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.958 -4.074 -11.023 1.00 0.00 H new ATOM 0 HE ARG A 123 9.523 -5.129 -8.932 1.00 0.00 H new ATOM 0 HH11 ARG A 123 6.430 -6.300 -10.195 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.284 -7.557 -8.961 1.00 0.00 H new ATOM 0 HH21 ARG A 123 9.287 -6.752 -7.382 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.870 -7.807 -7.401 1.00 0.00 H new ATOM 2111 N VAL A 124 8.643 -1.278 -13.185 1.00 0.00 N ATOM 2112 CA VAL A 124 9.852 -1.381 -14.076 1.00 0.00 C ATOM 2113 C VAL A 124 10.737 -0.129 -13.914 1.00 0.00 C ATOM 2114 O VAL A 124 10.261 0.975 -14.081 1.00 0.00 O ATOM 2115 CB VAL A 124 9.324 -1.465 -15.519 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.498 -1.628 -16.489 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.382 -2.663 -15.652 1.00 0.00 C ATOM 0 H VAL A 124 7.790 -0.957 -13.643 1.00 0.00 H new ATOM 0 HA VAL A 124 10.456 -2.252 -13.822 1.00 0.00 H new ATOM 0 HB VAL A 124 8.783 -0.550 -15.757 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.121 -1.687 -17.510 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.167 -0.772 -16.398 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.043 -2.541 -16.250 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.009 -2.721 -16.675 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.922 -3.579 -15.410 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.543 -2.544 -14.966 1.00 0.00 H new ATOM 2127 N PRO A 125 12.003 -0.330 -13.603 1.00 0.00 N ATOM 2128 CA PRO A 125 12.930 0.823 -13.440 1.00 0.00 C ATOM 2129 C PRO A 125 13.157 1.531 -14.787 1.00 0.00 C ATOM 2130 O PRO A 125 12.671 1.090 -15.811 1.00 0.00 O ATOM 2131 CB PRO A 125 14.222 0.182 -12.933 1.00 0.00 C ATOM 2132 CG PRO A 125 14.149 -1.234 -13.398 1.00 0.00 C ATOM 2133 CD PRO A 125 12.693 -1.610 -13.374 1.00 0.00 C ATOM 0 HA PRO A 125 12.546 1.585 -12.762 1.00 0.00 H new ATOM 0 HB2 PRO A 125 15.100 0.687 -13.337 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.293 0.239 -11.847 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.561 -1.335 -14.402 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.730 -1.888 -12.748 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.454 -2.339 -14.148 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.409 -2.054 -12.420 1.00 0.00 H new ATOM 2141 N ARG A 126 13.892 2.626 -14.795 1.00 0.00 N ATOM 2142 CA ARG A 126 14.138 3.352 -16.095 1.00 0.00 C ATOM 2143 C ARG A 126 15.163 2.596 -16.955 1.00 0.00 C ATOM 2144 O ARG A 126 15.046 2.561 -18.166 1.00 0.00 O ATOM 2145 CB ARG A 126 14.678 4.745 -15.731 1.00 0.00 C ATOM 2146 CG ARG A 126 13.507 5.707 -15.518 1.00 0.00 C ATOM 2147 CD ARG A 126 13.087 6.308 -16.863 1.00 0.00 C ATOM 2148 NE ARG A 126 12.801 7.746 -16.569 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.773 8.596 -16.280 1.00 0.00 C ATOM 2150 NH1 ARG A 126 15.030 8.213 -16.239 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.485 9.847 -16.029 1.00 0.00 N ATOM 0 H ARG A 126 14.327 3.044 -13.972 1.00 0.00 H new ATOM 0 HA ARG A 126 13.218 3.424 -16.675 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.284 4.687 -14.827 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.326 5.115 -16.526 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.667 5.180 -15.065 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.795 6.500 -14.828 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.878 6.206 -17.606 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.207 5.804 -17.264 1.00 0.00 H new ATOM 0 HE ARG A 126 11.837 8.078 -16.592 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.274 7.242 -16.432 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.761 8.887 -16.014 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.515 10.163 -16.057 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.230 10.507 -15.806 1.00 0.00 H new ATOM 2165 N ALA A 127 16.172 1.992 -16.352 1.00 0.00 N ATOM 2166 CA ALA A 127 17.195 1.247 -17.177 1.00 0.00 C ATOM 2167 C ALA A 127 16.506 0.155 -18.008 1.00 0.00 C ATOM 2168 O ALA A 127 16.821 -0.031 -19.168 1.00 0.00 O ATOM 2169 CB ALA A 127 18.190 0.614 -16.192 1.00 0.00 C ATOM 0 H ALA A 127 16.330 1.981 -15.344 1.00 0.00 H new ATOM 0 HA ALA A 127 17.706 1.919 -17.866 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.950 0.063 -16.746 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.667 1.397 -15.603 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.660 -0.068 -15.528 1.00 0.00 H new ATOM 2175 N GLN A 128 15.559 -0.559 -17.433 1.00 0.00 N ATOM 2176 CA GLN A 128 14.853 -1.625 -18.229 1.00 0.00 C ATOM 2177 C GLN A 128 14.001 -0.961 -19.318 1.00 0.00 C ATOM 2178 O GLN A 128 13.967 -1.416 -20.445 1.00 0.00 O ATOM 2179 CB GLN A 128 13.960 -2.400 -17.247 1.00 0.00 C ATOM 2180 CG GLN A 128 13.552 -3.735 -17.871 1.00 0.00 C ATOM 2181 CD GLN A 128 13.435 -4.801 -16.773 1.00 0.00 C ATOM 2182 OE1 GLN A 128 12.925 -4.527 -15.705 1.00 0.00 O ATOM 2183 NE2 GLN A 128 13.888 -6.012 -16.986 1.00 0.00 N ATOM 0 H GLN A 128 15.249 -0.454 -16.467 1.00 0.00 H new ATOM 0 HA GLN A 128 15.560 -2.299 -18.713 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.493 -2.572 -16.312 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.073 -1.814 -17.005 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.600 -3.629 -18.392 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.289 -4.042 -18.613 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.317 -6.246 -17.881 1.00 0.00 H new ATOM 0 HE22 GLN A 128 13.812 -6.721 -16.256 1.00 0.00 H new ATOM 2192 N LEU A 129 13.321 0.124 -18.997 1.00 0.00 N ATOM 2193 CA LEU A 129 12.487 0.815 -20.041 1.00 0.00 C ATOM 2194 C LEU A 129 13.394 1.329 -21.171 1.00 0.00 C ATOM 2195 O LEU A 129 13.038 1.254 -22.333 1.00 0.00 O ATOM 2196 CB LEU A 129 11.792 1.996 -19.346 1.00 0.00 C ATOM 2197 CG LEU A 129 10.507 1.512 -18.672 1.00 0.00 C ATOM 2198 CD1 LEU A 129 10.294 2.280 -17.363 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.318 1.752 -19.607 1.00 0.00 C ATOM 0 H LEU A 129 13.308 0.554 -18.072 1.00 0.00 H new ATOM 0 HA LEU A 129 11.755 0.134 -20.476 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.458 2.438 -18.606 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.562 2.775 -20.073 1.00 0.00 H new ATOM 0 HG LEU A 129 10.589 0.447 -18.457 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.378 1.935 -16.883 1.00 0.00 H new ATOM 0 HD12 LEU A 129 11.140 2.107 -16.698 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.212 3.346 -17.576 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.402 1.407 -19.127 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.235 2.817 -19.824 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.469 1.203 -20.536 1.00 0.00 H new ATOM 2211 N GLU A 130 14.564 1.850 -20.846 1.00 0.00 N ATOM 2212 CA GLU A 130 15.478 2.361 -21.931 1.00 0.00 C ATOM 2213 C GLU A 130 15.823 1.224 -22.908 1.00 0.00 C ATOM 2214 O GLU A 130 15.882 1.434 -24.105 1.00 0.00 O ATOM 2215 CB GLU A 130 16.753 2.869 -21.239 1.00 0.00 C ATOM 2216 CG GLU A 130 16.572 4.337 -20.852 1.00 0.00 C ATOM 2217 CD GLU A 130 17.139 5.232 -21.957 1.00 0.00 C ATOM 2218 OE1 GLU A 130 16.867 4.955 -23.113 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.835 6.178 -21.627 1.00 0.00 O ATOM 0 H GLU A 130 14.920 1.942 -19.895 1.00 0.00 H new ATOM 0 HA GLU A 130 15.001 3.158 -22.501 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.961 2.271 -20.352 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.609 2.760 -21.905 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.515 4.556 -20.699 1.00 0.00 H new ATOM 0 HG3 GLU A 130 17.079 4.540 -19.909 1.00 0.00 H new ATOM 2226 N GLU A 131 16.047 0.020 -22.412 1.00 0.00 N ATOM 2227 CA GLU A 131 16.382 -1.115 -23.347 1.00 0.00 C ATOM 2228 C GLU A 131 15.231 -1.336 -24.341 1.00 0.00 C ATOM 2229 O GLU A 131 15.461 -1.600 -25.507 1.00 0.00 O ATOM 2230 CB GLU A 131 16.577 -2.368 -22.476 1.00 0.00 C ATOM 2231 CG GLU A 131 17.043 -3.532 -23.353 1.00 0.00 C ATOM 2232 CD GLU A 131 18.568 -3.507 -23.466 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.216 -4.023 -22.570 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.062 -2.975 -24.446 1.00 0.00 O ATOM 0 H GLU A 131 16.013 -0.222 -21.422 1.00 0.00 H new ATOM 0 HA GLU A 131 17.282 -0.896 -23.922 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.311 -2.170 -21.695 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.643 -2.626 -21.977 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.715 -4.479 -22.924 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.593 -3.458 -24.343 1.00 0.00 H new ATOM 2241 N GLU A 132 13.996 -1.228 -23.896 1.00 0.00 N ATOM 2242 CA GLU A 132 12.843 -1.435 -24.844 1.00 0.00 C ATOM 2243 C GLU A 132 12.891 -0.381 -25.960 1.00 0.00 C ATOM 2244 O GLU A 132 12.740 -0.704 -27.124 1.00 0.00 O ATOM 2245 CB GLU A 132 11.555 -1.275 -24.021 1.00 0.00 C ATOM 2246 CG GLU A 132 11.158 -2.627 -23.426 1.00 0.00 C ATOM 2247 CD GLU A 132 10.120 -2.415 -22.322 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.329 -1.538 -21.500 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.133 -3.133 -22.318 1.00 0.00 O ATOM 0 H GLU A 132 13.738 -1.009 -22.934 1.00 0.00 H new ATOM 0 HA GLU A 132 12.887 -2.420 -25.309 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.708 -0.546 -23.225 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.752 -0.894 -24.652 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.750 -3.273 -24.204 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.036 -3.130 -23.022 1.00 0.00 H new ATOM 2256 N ALA A 133 13.102 0.877 -25.622 1.00 0.00 N ATOM 2257 CA ALA A 133 13.156 1.935 -26.695 1.00 0.00 C ATOM 2258 C ALA A 133 14.314 1.642 -27.661 1.00 0.00 C ATOM 2259 O ALA A 133 14.171 1.783 -28.861 1.00 0.00 O ATOM 2260 CB ALA A 133 13.383 3.281 -25.989 1.00 0.00 C ATOM 0 H ALA A 133 13.237 1.213 -24.668 1.00 0.00 H new ATOM 0 HA ALA A 133 12.232 1.953 -27.273 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.429 4.078 -26.731 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.561 3.474 -25.300 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.321 3.247 -25.434 1.00 0.00 H new ATOM 2266 N ARG A 134 15.458 1.229 -27.153 1.00 0.00 N ATOM 2267 CA ARG A 134 16.615 0.925 -28.073 1.00 0.00 C ATOM 2268 C ARG A 134 16.283 -0.283 -28.970 1.00 0.00 C ATOM 2269 O ARG A 134 16.708 -0.340 -30.109 1.00 0.00 O ATOM 2270 CB ARG A 134 17.822 0.602 -27.178 1.00 0.00 C ATOM 2271 CG ARG A 134 18.396 1.900 -26.607 1.00 0.00 C ATOM 2272 CD ARG A 134 19.045 2.711 -27.732 1.00 0.00 C ATOM 2273 NE ARG A 134 20.258 3.327 -27.112 1.00 0.00 N ATOM 2274 CZ ARG A 134 20.157 4.316 -26.238 1.00 0.00 C ATOM 2275 NH1 ARG A 134 18.989 4.796 -25.879 1.00 0.00 N ATOM 2276 NH2 ARG A 134 21.241 4.831 -25.717 1.00 0.00 N ATOM 0 H ARG A 134 15.641 1.091 -26.159 1.00 0.00 H new ATOM 0 HA ARG A 134 16.825 1.773 -28.725 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.520 -0.062 -26.368 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.584 0.077 -27.753 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.605 2.482 -26.134 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.132 1.676 -25.835 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.313 2.074 -28.575 1.00 0.00 H new ATOM 0 HD3 ARG A 134 18.365 3.473 -28.112 1.00 0.00 H new ATOM 0 HE ARG A 134 21.182 2.978 -27.368 1.00 0.00 H new ATOM 0 HH11 ARG A 134 18.134 4.406 -26.275 1.00 0.00 H new ATOM 0 HH12 ARG A 134 18.937 5.559 -25.204 1.00 0.00 H new ATOM 0 HH21 ARG A 134 22.157 4.470 -25.985 1.00 0.00 H new ATOM 0 HH22 ARG A 134 21.170 5.593 -25.043 1.00 0.00 H new ATOM 2290 N LYS A 135 15.531 -1.250 -28.474 1.00 0.00 N ATOM 2291 CA LYS A 135 15.192 -2.445 -29.329 1.00 0.00 C ATOM 2292 C LYS A 135 14.093 -2.099 -30.351 1.00 0.00 C ATOM 2293 O LYS A 135 14.073 -2.650 -31.436 1.00 0.00 O ATOM 2294 CB LYS A 135 14.698 -3.542 -28.373 1.00 0.00 C ATOM 2295 CG LYS A 135 14.693 -4.888 -29.099 1.00 0.00 C ATOM 2296 CD LYS A 135 13.657 -5.812 -28.455 1.00 0.00 C ATOM 2297 CE LYS A 135 14.095 -6.156 -27.031 1.00 0.00 C ATOM 2298 NZ LYS A 135 13.240 -7.309 -26.634 1.00 0.00 N ATOM 0 H LYS A 135 15.144 -1.264 -27.531 1.00 0.00 H new ATOM 0 HA LYS A 135 16.064 -2.772 -29.895 1.00 0.00 H new ATOM 0 HB2 LYS A 135 15.343 -3.592 -27.496 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.695 -3.305 -28.018 1.00 0.00 H new ATOM 0 HG2 LYS A 135 14.461 -4.743 -30.154 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.682 -5.343 -29.050 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.681 -5.327 -28.439 1.00 0.00 H new ATOM 0 HD3 LYS A 135 13.551 -6.723 -29.044 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.152 -6.418 -26.996 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.953 -5.310 -26.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.482 -7.603 -25.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.239 -7.028 -26.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.401 -8.102 -27.287 1.00 0.00 H new ATOM 2312 N LYS A 136 13.179 -1.201 -30.028 1.00 0.00 N ATOM 2313 CA LYS A 136 12.099 -0.857 -31.017 1.00 0.00 C ATOM 2314 C LYS A 136 12.407 0.457 -31.767 1.00 0.00 C ATOM 2315 O LYS A 136 11.505 1.095 -32.277 1.00 0.00 O ATOM 2316 CB LYS A 136 10.815 -0.708 -30.192 1.00 0.00 C ATOM 2317 CG LYS A 136 9.612 -1.122 -31.041 1.00 0.00 C ATOM 2318 CD LYS A 136 9.566 -2.647 -31.155 1.00 0.00 C ATOM 2319 CE LYS A 136 9.031 -3.241 -29.851 1.00 0.00 C ATOM 2320 NZ LYS A 136 9.289 -4.704 -29.961 1.00 0.00 N ATOM 0 H LYS A 136 13.136 -0.702 -29.140 1.00 0.00 H new ATOM 0 HA LYS A 136 12.013 -1.631 -31.780 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.872 -1.327 -29.296 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.701 0.324 -29.860 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.691 -0.753 -30.590 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.683 -0.675 -32.033 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.929 -2.941 -31.989 1.00 0.00 H new ATOM 0 HD3 LYS A 136 10.563 -3.037 -31.363 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.538 -2.815 -28.985 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.967 -3.035 -29.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.949 -5.182 -29.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.788 -5.083 -30.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.310 -4.869 -30.068 1.00 0.00 H new ATOM 2334 N GLY A 137 13.663 0.868 -31.859 1.00 0.00 N ATOM 2335 CA GLY A 137 13.998 2.131 -32.595 1.00 0.00 C ATOM 2336 C GLY A 137 13.121 3.300 -32.110 1.00 0.00 C ATOM 2337 O GLY A 137 12.578 4.039 -32.911 1.00 0.00 O ATOM 0 H GLY A 137 14.462 0.380 -31.455 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.050 2.375 -32.447 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.853 1.982 -33.665 1.00 0.00 H new ATOM 2341 N THR A 138 12.977 3.480 -30.813 1.00 0.00 N ATOM 2342 CA THR A 138 12.135 4.608 -30.306 1.00 0.00 C ATOM 2343 C THR A 138 12.710 5.152 -28.986 1.00 0.00 C ATOM 2344 O THR A 138 13.850 4.889 -28.654 1.00 0.00 O ATOM 2345 CB THR A 138 10.739 4.006 -30.099 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.856 5.019 -29.639 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.797 2.875 -29.070 1.00 0.00 C ATOM 0 H THR A 138 13.404 2.898 -30.093 1.00 0.00 H new ATOM 0 HA THR A 138 12.107 5.449 -30.999 1.00 0.00 H new ATOM 0 HB THR A 138 10.380 3.603 -31.046 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.962 4.639 -29.507 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.800 2.457 -28.933 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.472 2.096 -29.424 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.161 3.266 -28.120 1.00 0.00 H new ATOM 2355 N GLN A 139 11.938 5.909 -28.231 1.00 0.00 N ATOM 2356 CA GLN A 139 12.459 6.459 -26.945 1.00 0.00 C ATOM 2357 C GLN A 139 11.398 6.334 -25.840 1.00 0.00 C ATOM 2358 O GLN A 139 10.212 6.355 -26.113 1.00 0.00 O ATOM 2359 CB GLN A 139 12.758 7.930 -27.235 1.00 0.00 C ATOM 2360 CG GLN A 139 14.084 8.043 -27.991 1.00 0.00 C ATOM 2361 CD GLN A 139 14.686 9.436 -27.765 1.00 0.00 C ATOM 2362 OE1 GLN A 139 15.103 9.754 -26.669 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.750 10.289 -28.757 1.00 0.00 N ATOM 0 H GLN A 139 10.976 6.164 -28.454 1.00 0.00 H new ATOM 0 HA GLN A 139 13.342 5.923 -26.597 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.952 8.366 -27.826 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.810 8.492 -26.303 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.777 7.276 -27.647 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.923 7.873 -29.056 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.401 10.026 -29.679 1.00 0.00 H new ATOM 0 HE22 GLN A 139 15.149 11.216 -28.608 1.00 0.00 H new ATOM 2372 N VAL A 140 11.810 6.206 -24.596 1.00 0.00 N ATOM 2373 CA VAL A 140 10.818 6.084 -23.484 1.00 0.00 C ATOM 2374 C VAL A 140 11.199 7.030 -22.333 1.00 0.00 C ATOM 2375 O VAL A 140 12.329 7.473 -22.243 1.00 0.00 O ATOM 2376 CB VAL A 140 10.894 4.617 -23.036 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.322 4.276 -22.584 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.920 4.390 -21.874 1.00 0.00 C ATOM 0 H VAL A 140 12.788 6.181 -24.308 1.00 0.00 H new ATOM 0 HA VAL A 140 9.809 6.355 -23.795 1.00 0.00 H new ATOM 0 HB VAL A 140 10.625 3.973 -23.873 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.365 3.234 -22.268 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.013 4.433 -23.412 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.603 4.919 -21.750 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.972 3.349 -21.554 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.189 5.040 -21.041 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.905 4.619 -22.200 1.00 0.00 H new ATOM 2388 N SER A 141 10.269 7.345 -21.450 1.00 0.00 N ATOM 2389 CA SER A 141 10.604 8.266 -20.314 1.00 0.00 C ATOM 2390 C SER A 141 9.474 8.292 -19.265 1.00 0.00 C ATOM 2391 O SER A 141 8.718 9.243 -19.190 1.00 0.00 O ATOM 2392 CB SER A 141 10.764 9.637 -20.964 1.00 0.00 C ATOM 2393 OG SER A 141 11.068 10.601 -19.964 1.00 0.00 O ATOM 0 H SER A 141 9.307 7.007 -21.469 1.00 0.00 H new ATOM 0 HA SER A 141 11.502 7.948 -19.784 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.558 9.608 -21.710 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.848 9.914 -21.485 1.00 0.00 H new ATOM 0 HG SER A 141 11.173 11.482 -20.380 1.00 0.00 H new ATOM 2399 N PHE A 142 9.359 7.261 -18.452 1.00 0.00 N ATOM 2400 CA PHE A 142 8.279 7.247 -17.410 1.00 0.00 C ATOM 2401 C PHE A 142 8.813 7.841 -16.089 1.00 0.00 C ATOM 2402 O PHE A 142 10.006 7.917 -15.870 1.00 0.00 O ATOM 2403 CB PHE A 142 7.885 5.762 -17.241 1.00 0.00 C ATOM 2404 CG PHE A 142 7.091 5.556 -15.962 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.715 5.822 -15.919 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.748 5.106 -14.814 1.00 0.00 C ATOM 2407 CE1 PHE A 142 5.006 5.635 -14.721 1.00 0.00 C ATOM 2408 CE2 PHE A 142 7.043 4.922 -13.631 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.675 5.184 -13.576 1.00 0.00 C ATOM 0 H PHE A 142 9.961 6.438 -18.466 1.00 0.00 H new ATOM 0 HA PHE A 142 7.417 7.849 -17.698 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.294 5.438 -18.097 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.782 5.143 -17.221 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.202 6.169 -16.804 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.808 4.900 -14.846 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.946 5.839 -14.683 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.558 4.574 -12.748 1.00 0.00 H new ATOM 0 HZ PHE A 142 5.133 5.040 -12.653 1.00 0.00 H new ATOM 2419 N HIS A 143 7.924 8.243 -15.205 1.00 0.00 N ATOM 2420 CA HIS A 143 8.356 8.811 -13.893 1.00 0.00 C ATOM 2421 C HIS A 143 7.431 8.283 -12.786 1.00 0.00 C ATOM 2422 O HIS A 143 7.867 7.609 -11.872 1.00 0.00 O ATOM 2423 CB HIS A 143 8.209 10.325 -14.045 1.00 0.00 C ATOM 2424 CG HIS A 143 9.507 10.910 -14.530 1.00 0.00 C ATOM 2425 ND1 HIS A 143 9.572 11.759 -15.624 1.00 0.00 N ATOM 2426 CD2 HIS A 143 10.798 10.777 -14.082 1.00 0.00 C ATOM 2427 CE1 HIS A 143 10.862 12.101 -15.796 1.00 0.00 C ATOM 2428 NE2 HIS A 143 11.652 11.530 -14.882 1.00 0.00 N ATOM 0 H HIS A 143 6.914 8.200 -15.342 1.00 0.00 H new ATOM 0 HA HIS A 143 9.377 8.536 -13.627 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.409 10.554 -14.749 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.931 10.772 -13.090 1.00 0.00 H new ATOM 0 HD1 HIS A 143 8.785 12.068 -16.195 1.00 0.00 H new ATOM 0 HD2 HIS A 143 11.104 10.179 -13.237 1.00 0.00 H new ATOM 0 HE1 HIS A 143 11.216 12.757 -16.578 1.00 0.00 H new ATOM 2436 N GLN A 144 6.153 8.574 -12.874 1.00 0.00 N ATOM 2437 CA GLN A 144 5.188 8.084 -11.847 1.00 0.00 C ATOM 2438 C GLN A 144 3.981 7.447 -12.563 1.00 0.00 C ATOM 2439 O GLN A 144 3.653 7.817 -13.676 1.00 0.00 O ATOM 2440 CB GLN A 144 4.805 9.351 -11.048 1.00 0.00 C ATOM 2441 CG GLN A 144 3.414 9.228 -10.399 1.00 0.00 C ATOM 2442 CD GLN A 144 2.359 9.816 -11.344 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.691 9.087 -12.050 1.00 0.00 O ATOM 2444 NE2 GLN A 144 2.178 11.114 -11.396 1.00 0.00 N ATOM 0 H GLN A 144 5.739 9.134 -13.619 1.00 0.00 H new ATOM 0 HA GLN A 144 5.589 7.318 -11.183 1.00 0.00 H new ATOM 0 HB2 GLN A 144 5.551 9.530 -10.274 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.820 10.216 -11.711 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.189 8.182 -10.190 1.00 0.00 H new ATOM 0 HG3 GLN A 144 3.398 9.754 -9.445 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.736 11.731 -10.806 1.00 0.00 H new ATOM 0 HE22 GLN A 144 1.479 11.507 -12.027 1.00 0.00 H new ATOM 2453 N CYS A 145 3.318 6.500 -11.934 1.00 0.00 N ATOM 2454 CA CYS A 145 2.134 5.859 -12.597 1.00 0.00 C ATOM 2455 C CYS A 145 0.824 6.484 -12.084 1.00 0.00 C ATOM 2456 O CYS A 145 0.777 7.029 -10.997 1.00 0.00 O ATOM 2457 CB CYS A 145 2.213 4.349 -12.291 1.00 0.00 C ATOM 2458 SG CYS A 145 1.953 4.001 -10.523 1.00 0.00 S ATOM 0 H CYS A 145 3.542 6.148 -11.003 1.00 0.00 H new ATOM 0 HA CYS A 145 2.146 6.020 -13.675 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.464 3.820 -12.879 1.00 0.00 H new ATOM 0 HB3 CYS A 145 3.187 3.967 -12.597 1.00 0.00 H new ATOM 0 HG CYS A 145 2.839 3.141 -10.115 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.236 6.424 -12.866 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.538 7.042 -12.414 1.00 0.00 C ATOM 2465 C VAL A 146 -2.245 6.185 -11.345 1.00 0.00 C ATOM 2466 O VAL A 146 -3.039 6.704 -10.583 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.422 7.182 -13.671 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.781 5.798 -14.233 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -3.705 7.934 -13.302 1.00 0.00 C ATOM 0 H VAL A 146 -0.259 5.981 -13.785 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.350 8.010 -11.949 1.00 0.00 H new ATOM 0 HB VAL A 146 -1.872 7.735 -14.432 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.405 5.916 -15.119 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.868 5.266 -14.500 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.325 5.229 -13.479 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.334 8.036 -14.186 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.245 7.378 -12.535 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.450 8.923 -12.922 1.00 0.00 H new ATOM 2479 N HIS A 147 -1.978 4.887 -11.264 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.671 4.048 -10.208 1.00 0.00 C ATOM 2481 C HIS A 147 -2.488 4.704 -8.824 1.00 0.00 C ATOM 2482 O HIS A 147 -3.424 4.812 -8.055 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.005 2.655 -10.231 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.204 1.981 -11.575 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.135 2.415 -12.516 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.589 0.887 -12.146 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.047 1.598 -13.581 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.123 0.652 -13.408 1.00 0.00 N ATOM 0 H HIS A 147 -1.327 4.383 -11.867 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.740 3.967 -10.405 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -0.939 2.754 -10.024 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.427 2.033 -9.442 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.809 0.301 -11.682 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.652 1.696 -14.470 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.863 -0.086 -14.062 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.289 5.151 -8.511 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.043 5.805 -7.200 1.00 0.00 C ATOM 2498 C CYS A 148 -0.099 7.013 -7.365 1.00 0.00 C ATOM 2499 O CYS A 148 0.210 7.416 -8.471 1.00 0.00 O ATOM 2500 CB CYS A 148 -0.387 4.711 -6.359 1.00 0.00 C ATOM 2501 SG CYS A 148 1.194 4.189 -7.086 1.00 0.00 S ATOM 0 H CYS A 148 -0.472 5.086 -9.118 1.00 0.00 H new ATOM 0 HA CYS A 148 -1.954 6.193 -6.744 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -0.222 5.077 -5.345 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.057 3.854 -6.284 1.00 0.00 H new ATOM 0 HG CYS A 148 1.114 4.241 -8.382 1.00 0.00 H new ATOM 2506 N GLY A 149 0.385 7.568 -6.274 1.00 0.00 N ATOM 2507 CA GLY A 149 1.332 8.713 -6.363 1.00 0.00 C ATOM 2508 C GLY A 149 2.749 8.152 -6.187 1.00 0.00 C ATOM 2509 O GLY A 149 3.477 8.551 -5.299 1.00 0.00 O ATOM 0 H GLY A 149 0.159 7.270 -5.325 1.00 0.00 H new ATOM 0 HA2 GLY A 149 1.236 9.217 -7.325 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.114 9.452 -5.592 1.00 0.00 H new ATOM 2513 N CYS A 150 3.137 7.210 -7.024 1.00 0.00 N ATOM 2514 CA CYS A 150 4.497 6.597 -6.900 1.00 0.00 C ATOM 2515 C CYS A 150 5.438 7.210 -7.948 1.00 0.00 C ATOM 2516 O CYS A 150 5.035 7.472 -9.063 1.00 0.00 O ATOM 2517 CB CYS A 150 4.260 5.092 -7.154 1.00 0.00 C ATOM 2518 SG CYS A 150 5.818 4.176 -7.283 1.00 0.00 S ATOM 0 H CYS A 150 2.567 6.843 -7.786 1.00 0.00 H new ATOM 0 HA CYS A 150 4.965 6.770 -5.931 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.661 4.677 -6.344 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.687 4.965 -8.072 1.00 0.00 H new ATOM 0 HG CYS A 150 5.670 3.182 -8.108 1.00 0.00 H new ATOM 2523 N ARG A 151 6.691 7.429 -7.605 1.00 0.00 N ATOM 2524 CA ARG A 151 7.645 8.012 -8.602 1.00 0.00 C ATOM 2525 C ARG A 151 8.456 6.883 -9.251 1.00 0.00 C ATOM 2526 O ARG A 151 9.672 6.915 -9.265 1.00 0.00 O ATOM 2527 CB ARG A 151 8.562 8.957 -7.810 1.00 0.00 C ATOM 2528 CG ARG A 151 9.089 10.066 -8.733 1.00 0.00 C ATOM 2529 CD ARG A 151 8.857 11.436 -8.085 1.00 0.00 C ATOM 2530 NE ARG A 151 9.635 11.398 -6.809 1.00 0.00 N ATOM 2531 CZ ARG A 151 10.955 11.520 -6.804 1.00 0.00 C ATOM 2532 NH1 ARG A 151 11.632 11.679 -7.918 1.00 0.00 N ATOM 2533 NH2 ARG A 151 11.602 11.483 -5.668 1.00 0.00 N ATOM 0 H ARG A 151 7.088 7.230 -6.687 1.00 0.00 H new ATOM 0 HA ARG A 151 7.131 8.549 -9.399 1.00 0.00 H new ATOM 0 HB2 ARG A 151 8.014 9.395 -6.976 1.00 0.00 H new ATOM 0 HB3 ARG A 151 9.396 8.398 -7.385 1.00 0.00 H new ATOM 0 HG2 ARG A 151 10.152 9.919 -8.923 1.00 0.00 H new ATOM 0 HG3 ARG A 151 8.583 10.020 -9.698 1.00 0.00 H new ATOM 0 HD2 ARG A 151 9.201 12.242 -8.733 1.00 0.00 H new ATOM 0 HD3 ARG A 151 7.797 11.609 -7.896 1.00 0.00 H new ATOM 0 HE ARG A 151 9.141 11.276 -5.925 1.00 0.00 H new ATOM 0 HH11 ARG A 151 11.142 11.711 -8.812 1.00 0.00 H new ATOM 0 HH12 ARG A 151 12.647 11.771 -7.889 1.00 0.00 H new ATOM 0 HH21 ARG A 151 11.091 11.361 -4.794 1.00 0.00 H new ATOM 0 HH22 ARG A 151 12.618 11.576 -5.656 1.00 0.00 H new ATOM 2547 N GLY A 152 7.790 5.879 -9.786 1.00 0.00 N ATOM 2548 CA GLY A 152 8.519 4.750 -10.425 1.00 0.00 C ATOM 2549 C GLY A 152 9.304 3.976 -9.358 1.00 0.00 C ATOM 2550 O GLY A 152 10.396 4.362 -8.987 1.00 0.00 O ATOM 0 H GLY A 152 6.773 5.801 -9.803 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.815 4.086 -10.926 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.199 5.128 -11.188 1.00 0.00 H new ATOM 2554 N CYS A 153 8.759 2.881 -8.863 1.00 0.00 N ATOM 2555 CA CYS A 153 9.491 2.089 -7.824 1.00 0.00 C ATOM 2556 C CYS A 153 10.022 0.775 -8.428 1.00 0.00 C ATOM 2557 O CYS A 153 9.287 0.034 -9.055 1.00 0.00 O ATOM 2558 CB CYS A 153 8.477 1.835 -6.686 1.00 0.00 C ATOM 2559 SG CYS A 153 7.136 0.724 -7.215 1.00 0.00 S ATOM 0 H CYS A 153 7.849 2.509 -9.133 1.00 0.00 H new ATOM 0 HA CYS A 153 10.363 2.621 -7.443 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.993 1.401 -5.829 1.00 0.00 H new ATOM 0 HB3 CYS A 153 8.055 2.784 -6.356 1.00 0.00 H new ATOM 0 HG CYS A 153 7.543 -0.003 -8.213 1.00 0.00 H new ATOM 2564 N ALA A 154 11.294 0.485 -8.254 1.00 0.00 N ATOM 2565 CA ALA A 154 11.866 -0.771 -8.825 1.00 0.00 C ATOM 2566 C ALA A 154 12.785 -1.446 -7.799 1.00 0.00 C ATOM 2567 O ALA A 154 13.516 -0.780 -7.090 1.00 0.00 O ATOM 2568 CB ALA A 154 12.668 -0.316 -10.042 1.00 0.00 C ATOM 0 H ALA A 154 11.956 1.067 -7.741 1.00 0.00 H new ATOM 0 HA ALA A 154 11.096 -1.496 -9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.124 -1.182 -10.522 1.00 0.00 H new ATOM 0 HB2 ALA A 154 12.005 0.184 -10.749 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.449 0.376 -9.725 1.00 0.00 H new ATOM 2574 N SER A 155 12.768 -2.761 -7.718 1.00 0.00 N ATOM 2575 CA SER A 155 13.659 -3.457 -6.736 1.00 0.00 C ATOM 2576 C SER A 155 14.849 -4.087 -7.474 1.00 0.00 C ATOM 2577 O SER A 155 15.243 -5.201 -7.186 1.00 0.00 O ATOM 2578 CB SER A 155 12.795 -4.541 -6.087 1.00 0.00 C ATOM 2579 OG SER A 155 11.440 -4.109 -6.063 1.00 0.00 O ATOM 0 H SER A 155 12.181 -3.373 -8.284 1.00 0.00 H new ATOM 0 HA SER A 155 14.062 -2.772 -5.990 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.882 -5.474 -6.644 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.143 -4.742 -5.074 1.00 0.00 H new ATOM 0 HG SER A 155 10.883 -4.801 -5.650 1.00 0.00 H new