USER MOD reduce.3.24.130724 H: found=0, std=0, add=640, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 641 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: D 71 THR OG1 : rot 136:sc= 0.234 USER MOD Set 1.2: D 74 ASN : amide:sc= 0.198 K(o=0.43,f=-1.3) USER MOD Set 2.1: D 53 ASN : amide:sc= -2.09! K(o=-5.4!,f=-3.2) USER MOD Set 2.2: D 67 ASN : amide:sc= -3.35! C(o=-5.4!,f=-6.3!) USER MOD Set 3.1: D 62 LYS NZ :NH3+ 165:sc= 1.29 (180deg=-0.025) USER MOD Set 3.2: D 65 THR OG1 : rot 120:sc= 0.982 USER MOD Set 4.1: D 17 ASN : amide:sc= -4.98! C(o=-3.8!,f=-5.7!) USER MOD Set 4.2: D 28 SER OG : rot 41:sc= 1.2 USER MOD Single : D 14 ASN : amide:sc= -0.0575 K(o=-0.057,f=-1.1) USER MOD Single : D 15 SER OG : rot 180:sc= 0 USER MOD Single : D 19 LYS NZ :NH3+ -162:sc= -0.0511 (180deg=-0.311) USER MOD Single : D 21 ASN : amide:sc= -7.62! C(o=-7.6!,f=-11!) USER MOD Single : D 22 LYS NZ :NH3+ -156:sc= -3.23! (180deg=-4.64!) USER MOD Single : D 24 LYS NZ :NH3+ 154:sc= 1.57 (180deg=0.909) USER MOD Single : D 26 LYS NZ :NH3+ -127:sc= -2.7! (180deg=-5.44!) USER MOD Single : D 30 SER OG : rot 180:sc= -0.0116 USER MOD Single : D 31 MET CE :methyl -161:sc= -0.148 (180deg=-0.9) USER MOD Single : D 32 ASN : amide:sc= -0.193 K(o=-0.19,f=-1.3) USER MOD Single : D 34 ASN : amide:sc= -2.24! K(o=-2.2!,f=0) USER MOD Single : D 35 GLN : amide:sc= -0.772 K(o=-0.77,f=-0.038) USER MOD Single : D 37 LYS NZ :NH3+ -169:sc= -0.015 (180deg=-0.169) USER MOD Single : D 39 THR OG1 : rot 41:sc= -2.76! USER MOD Single : D 40 SER OG : rot 164:sc= 0.572 USER MOD Single : D 41 SER OG : rot 180:sc= 0 USER MOD Single : D 42 ASN : amide:sc= -0.252 X(o=-0.25,f=-0.03) USER MOD Single : D 45 TYR OH : rot 180:sc= 0 USER MOD Single : D 48 SER OG : rot -110:sc= 0.00646 USER MOD Single : D 49 TYR OH : rot 180:sc= 0 USER MOD Single : D 52 LYS NZ :NH3+ -146:sc= 1.14 (180deg=0.499) USER MOD Single : D 59 ASN : amide:sc=-0.00161 K(o=-0.0016,f=-1.7) USER MOD Single : D 64 TYR OH : rot 180:sc= 0 USER MOD Single : D 69 LYS NZ :NH3+ 180:sc= 0.255 (180deg=0.255) USER MOD Single : D 70 SER OG : rot 180:sc= 0 USER MOD Single : D 76 SER OG : rot 180:sc= -0.312 USER MOD Single : D 77 ASN : amide:sc= -4.9! K(o=-4.9!,f=-1) USER MOD Single : D 80 ASN : amide:sc= -1.81! K(o=-1.8!,f=-0.0069) USER MOD Single : D 81 LYS NZ :NH3+ -133:sc= 0.591 (180deg=0) USER MOD Single : D 83 ASN : amide:sc= -2.4 K(o=-2.4,f=-0.075) USER MOD Single : D 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 88 TYR OH : rot 180:sc= 0 USER MOD Single : D 92 LYS NZ :NH3+ -176:sc= 1.02 (180deg=0.919) USER MOD Single : D 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 184 N ILE D 13 6.405 5.376 3.236 1.00 0.00 N ATOM 185 CA ILE D 13 5.521 4.336 3.724 1.00 0.00 C ATOM 186 C ILE D 13 4.542 4.900 4.754 1.00 0.00 C ATOM 187 O ILE D 13 3.626 4.220 5.221 1.00 0.00 O ATOM 188 CB ILE D 13 6.381 3.236 4.343 1.00 0.00 C ATOM 189 CG1 ILE D 13 7.445 2.826 3.339 1.00 0.00 C ATOM 190 CG2 ILE D 13 5.556 2.030 4.774 1.00 0.00 C ATOM 191 CD1 ILE D 13 8.403 1.778 3.860 1.00 0.00 C ATOM 0 HA ILE D 13 4.931 3.931 2.902 1.00 0.00 H new ATOM 0 HB ILE D 13 6.847 3.630 5.246 1.00 0.00 H new ATOM 0 HG12 ILE D 13 6.957 2.445 2.442 1.00 0.00 H new ATOM 0 HG13 ILE D 13 8.012 3.709 3.043 1.00 0.00 H new ATOM 0 HG21 ILE D 13 6.213 1.276 5.208 1.00 0.00 H new ATOM 0 HG22 ILE D 13 4.819 2.339 5.515 1.00 0.00 H new ATOM 0 HG23 ILE D 13 5.045 1.611 3.908 1.00 0.00 H new ATOM 0 HD11 ILE D 13 9.133 1.536 3.088 1.00 0.00 H new ATOM 0 HD12 ILE D 13 8.919 2.162 4.740 1.00 0.00 H new ATOM 0 HD13 ILE D 13 7.848 0.879 4.129 1.00 0.00 H new ATOM 203 N ASN D 14 4.782 6.130 5.158 1.00 0.00 N ATOM 204 CA ASN D 14 3.955 6.758 6.190 1.00 0.00 C ATOM 205 C ASN D 14 2.819 7.578 5.579 1.00 0.00 C ATOM 206 O ASN D 14 1.641 7.281 5.803 1.00 0.00 O ATOM 207 CB ASN D 14 4.804 7.624 7.117 1.00 0.00 C ATOM 208 CG ASN D 14 5.833 6.812 7.882 1.00 0.00 C ATOM 209 OD1 ASN D 14 6.681 6.146 7.287 1.00 0.00 O ATOM 210 ND2 ASN D 14 5.770 6.862 9.204 1.00 0.00 N ATOM 0 H ASN D 14 5.534 6.717 4.797 1.00 0.00 H new ATOM 0 HA ASN D 14 3.507 5.958 6.780 1.00 0.00 H new ATOM 0 HB2 ASN D 14 5.312 8.390 6.531 1.00 0.00 H new ATOM 0 HB3 ASN D 14 4.155 8.141 7.823 1.00 0.00 H new ATOM 0 HD21 ASN D 14 6.439 6.337 9.767 1.00 0.00 H new ATOM 0 HD22 ASN D 14 5.052 7.426 9.659 1.00 0.00 H new ATOM 217 N SER D 15 3.150 8.546 4.729 1.00 0.00 N ATOM 218 CA SER D 15 2.114 9.294 4.034 1.00 0.00 C ATOM 219 C SER D 15 1.422 8.407 3.013 1.00 0.00 C ATOM 220 O SER D 15 0.304 8.686 2.619 1.00 0.00 O ATOM 221 CB SER D 15 2.631 10.568 3.360 1.00 0.00 C ATOM 222 OG SER D 15 3.519 10.284 2.291 1.00 0.00 O ATOM 0 H SER D 15 4.106 8.825 4.510 1.00 0.00 H new ATOM 0 HA SER D 15 1.401 9.613 4.795 1.00 0.00 H new ATOM 0 HB2 SER D 15 1.787 11.147 2.985 1.00 0.00 H new ATOM 0 HB3 SER D 15 3.140 11.187 4.099 1.00 0.00 H new ATOM 0 HG SER D 15 3.824 11.123 1.887 1.00 0.00 H new ATOM 228 N VAL D 16 2.041 7.274 2.675 1.00 0.00 N ATOM 229 CA VAL D 16 1.411 6.286 1.795 1.00 0.00 C ATOM 230 C VAL D 16 0.064 5.871 2.390 1.00 0.00 C ATOM 231 O VAL D 16 -0.850 5.438 1.692 1.00 0.00 O ATOM 232 CB VAL D 16 2.301 5.021 1.645 1.00 0.00 C ATOM 233 CG1 VAL D 16 2.084 4.035 2.776 1.00 0.00 C ATOM 234 CG2 VAL D 16 2.088 4.326 0.329 1.00 0.00 C ATOM 0 H VAL D 16 2.975 7.018 2.996 1.00 0.00 H new ATOM 0 HA VAL D 16 1.277 6.738 0.812 1.00 0.00 H new ATOM 0 HB VAL D 16 3.330 5.379 1.684 1.00 0.00 H new ATOM 0 HG11 VAL D 16 2.726 3.167 2.630 1.00 0.00 H new ATOM 0 HG12 VAL D 16 2.328 4.511 3.726 1.00 0.00 H new ATOM 0 HG13 VAL D 16 1.041 3.717 2.787 1.00 0.00 H new ATOM 0 HG21 VAL D 16 2.732 3.449 0.272 1.00 0.00 H new ATOM 0 HG22 VAL D 16 1.046 4.017 0.245 1.00 0.00 H new ATOM 0 HG23 VAL D 16 2.331 5.008 -0.486 1.00 0.00 H new ATOM 244 N ASN D 17 -0.033 6.046 3.701 1.00 0.00 N ATOM 245 CA ASN D 17 -1.229 5.726 4.455 1.00 0.00 C ATOM 246 C ASN D 17 -2.198 6.877 4.406 1.00 0.00 C ATOM 247 O ASN D 17 -3.386 6.673 4.384 1.00 0.00 O ATOM 248 CB ASN D 17 -0.879 5.402 5.910 1.00 0.00 C ATOM 249 CG ASN D 17 -0.064 4.133 6.060 1.00 0.00 C ATOM 250 OD1 ASN D 17 0.396 3.806 7.152 1.00 0.00 O ATOM 251 ND2 ASN D 17 0.083 3.383 4.980 1.00 0.00 N ATOM 0 H ASN D 17 0.726 6.418 4.273 1.00 0.00 H new ATOM 0 HA ASN D 17 -1.694 4.849 4.004 1.00 0.00 H new ATOM 0 HB2 ASN D 17 -0.322 6.236 6.337 1.00 0.00 H new ATOM 0 HB3 ASN D 17 -1.800 5.305 6.485 1.00 0.00 H new ATOM 0 HD21 ASN D 17 0.592 2.501 5.037 1.00 0.00 H new ATOM 0 HD22 ASN D 17 -0.313 3.687 4.090 1.00 0.00 H new ATOM 258 N ASP D 18 -1.677 8.086 4.343 1.00 0.00 N ATOM 259 CA ASP D 18 -2.516 9.283 4.240 1.00 0.00 C ATOM 260 C ASP D 18 -3.367 9.294 2.962 1.00 0.00 C ATOM 261 O ASP D 18 -4.370 10.005 2.898 1.00 0.00 O ATOM 262 CB ASP D 18 -1.649 10.543 4.290 1.00 0.00 C ATOM 263 CG ASP D 18 -0.970 10.724 5.626 1.00 0.00 C ATOM 264 OD1 ASP D 18 -1.678 10.765 6.648 1.00 0.00 O ATOM 265 OD2 ASP D 18 0.269 10.840 5.658 1.00 0.00 O1- ATOM 0 H ASP D 18 -0.675 8.275 4.361 1.00 0.00 H new ATOM 0 HA ASP D 18 -3.198 9.267 5.090 1.00 0.00 H new ATOM 0 HB2 ASP D 18 -0.894 10.492 3.506 1.00 0.00 H new ATOM 0 HB3 ASP D 18 -2.268 11.415 4.080 1.00 0.00 H new ATOM 270 N LYS D 19 -3.041 8.435 1.990 1.00 0.00 N ATOM 271 CA LYS D 19 -3.886 8.309 0.799 1.00 0.00 C ATOM 272 C LYS D 19 -4.959 7.318 1.104 1.00 0.00 C ATOM 273 O LYS D 19 -6.129 7.503 0.806 1.00 0.00 O ATOM 274 CB LYS D 19 -3.163 7.783 -0.444 1.00 0.00 C ATOM 275 CG LYS D 19 -2.202 8.737 -1.154 1.00 0.00 C ATOM 276 CD LYS D 19 -0.912 9.002 -0.401 1.00 0.00 C ATOM 277 CE LYS D 19 -1.062 10.023 0.711 1.00 0.00 C ATOM 278 NZ LYS D 19 -1.394 11.380 0.201 1.00 0.00 N1+ ATOM 0 H LYS D 19 -2.219 7.831 2.002 1.00 0.00 H new ATOM 0 HA LYS D 19 -4.245 9.314 0.575 1.00 0.00 H new ATOM 0 HB2 LYS D 19 -2.603 6.893 -0.157 1.00 0.00 H new ATOM 0 HB3 LYS D 19 -3.918 7.467 -1.164 1.00 0.00 H new ATOM 0 HG2 LYS D 19 -1.959 8.326 -2.134 1.00 0.00 H new ATOM 0 HG3 LYS D 19 -2.711 9.686 -1.324 1.00 0.00 H new ATOM 0 HD2 LYS D 19 -0.548 8.066 0.022 1.00 0.00 H new ATOM 0 HD3 LYS D 19 -0.155 9.350 -1.104 1.00 0.00 H new ATOM 0 HE2 LYS D 19 -1.843 9.696 1.397 1.00 0.00 H new ATOM 0 HE3 LYS D 19 -0.135 10.071 1.283 1.00 0.00 H new ATOM 0 HZ1 LYS D 19 -1.189 12.087 0.936 1.00 0.00 H new ATOM 0 HZ2 LYS D 19 -0.822 11.583 -0.644 1.00 0.00 H new ATOM 0 HZ3 LYS D 19 -2.403 11.420 -0.047 1.00 0.00 H new ATOM 292 N LEU D 20 -4.484 6.219 1.637 1.00 0.00 N ATOM 293 CA LEU D 20 -5.293 5.079 1.949 1.00 0.00 C ATOM 294 C LEU D 20 -6.303 5.423 3.040 1.00 0.00 C ATOM 295 O LEU D 20 -7.461 5.014 3.008 1.00 0.00 O ATOM 296 CB LEU D 20 -4.351 4.000 2.444 1.00 0.00 C ATOM 297 CG LEU D 20 -3.227 3.628 1.467 1.00 0.00 C ATOM 298 CD1 LEU D 20 -2.266 2.638 2.096 1.00 0.00 C ATOM 299 CD2 LEU D 20 -3.802 3.062 0.179 1.00 0.00 C ATOM 0 H LEU D 20 -3.499 6.095 1.870 1.00 0.00 H new ATOM 0 HA LEU D 20 -5.851 4.750 1.073 1.00 0.00 H new ATOM 0 HB2 LEU D 20 -3.904 4.330 3.382 1.00 0.00 H new ATOM 0 HB3 LEU D 20 -4.931 3.104 2.666 1.00 0.00 H new ATOM 0 HG LEU D 20 -2.674 4.537 1.230 1.00 0.00 H new ATOM 0 HD11 LEU D 20 -1.479 2.391 1.383 1.00 0.00 H new ATOM 0 HD12 LEU D 20 -1.822 3.079 2.988 1.00 0.00 H new ATOM 0 HD13 LEU D 20 -2.805 1.731 2.370 1.00 0.00 H new ATOM 0 HD21 LEU D 20 -2.989 2.805 -0.500 1.00 0.00 H new ATOM 0 HD22 LEU D 20 -4.385 2.168 0.403 1.00 0.00 H new ATOM 0 HD23 LEU D 20 -4.445 3.807 -0.290 1.00 0.00 H new ATOM 311 N ASN D 21 -5.820 6.179 4.010 1.00 0.00 N ATOM 312 CA ASN D 21 -6.602 6.616 5.148 1.00 0.00 C ATOM 313 C ASN D 21 -7.370 7.885 4.809 1.00 0.00 C ATOM 314 O ASN D 21 -6.791 8.970 4.843 1.00 0.00 O ATOM 315 CB ASN D 21 -5.683 6.912 6.345 1.00 0.00 C ATOM 316 CG ASN D 21 -5.060 5.675 6.966 1.00 0.00 C ATOM 317 OD1 ASN D 21 -5.752 4.736 7.349 1.00 0.00 O ATOM 318 ND2 ASN D 21 -3.748 5.684 7.117 1.00 0.00 N ATOM 0 H ASN D 21 -4.856 6.511 4.027 1.00 0.00 H new ATOM 0 HA ASN D 21 -7.299 5.817 5.402 1.00 0.00 H new ATOM 0 HB2 ASN D 21 -4.888 7.584 6.022 1.00 0.00 H new ATOM 0 HB3 ASN D 21 -6.256 7.440 7.108 1.00 0.00 H new ATOM 0 HD21 ASN D 21 -3.281 4.895 7.563 1.00 0.00 H new ATOM 0 HD22 ASN D 21 -3.202 6.480 6.787 1.00 0.00 H new ATOM 325 N LYS D 22 -8.645 7.780 4.444 1.00 0.00 N ATOM 326 CA LYS D 22 -9.376 8.997 4.074 1.00 0.00 C ATOM 327 C LYS D 22 -10.638 9.240 4.895 1.00 0.00 C ATOM 328 O LYS D 22 -10.933 10.382 5.246 1.00 0.00 O ATOM 329 CB LYS D 22 -9.699 9.015 2.582 1.00 0.00 C ATOM 330 CG LYS D 22 -8.453 9.043 1.710 1.00 0.00 C ATOM 331 CD LYS D 22 -8.760 9.245 0.230 1.00 0.00 C ATOM 332 CE LYS D 22 -9.192 10.677 -0.099 1.00 0.00 C ATOM 333 NZ LYS D 22 -10.389 11.123 0.664 1.00 0.00 N1+ ATOM 0 H LYS D 22 -9.177 6.911 4.396 1.00 0.00 H new ATOM 0 HA LYS D 22 -8.700 9.820 4.307 1.00 0.00 H new ATOM 0 HB2 LYS D 22 -10.292 8.135 2.333 1.00 0.00 H new ATOM 0 HB3 LYS D 22 -10.313 9.887 2.358 1.00 0.00 H new ATOM 0 HG2 LYS D 22 -7.797 9.844 2.051 1.00 0.00 H new ATOM 0 HG3 LYS D 22 -7.907 8.108 1.837 1.00 0.00 H new ATOM 0 HD2 LYS D 22 -7.876 8.994 -0.357 1.00 0.00 H new ATOM 0 HD3 LYS D 22 -9.549 8.555 -0.070 1.00 0.00 H new ATOM 0 HE2 LYS D 22 -8.364 11.355 0.109 1.00 0.00 H new ATOM 0 HE3 LYS D 22 -9.403 10.749 -1.166 1.00 0.00 H new ATOM 0 HZ1 LYS D 22 -10.868 11.885 0.144 1.00 0.00 H new ATOM 0 HZ2 LYS D 22 -11.042 10.323 0.785 1.00 0.00 H new ATOM 0 HZ3 LYS D 22 -10.095 11.473 1.598 1.00 0.00 H new ATOM 347 N GLY D 23 -11.407 8.200 5.160 1.00 0.00 N ATOM 348 CA GLY D 23 -12.635 8.383 5.883 1.00 0.00 C ATOM 349 C GLY D 23 -13.455 7.123 5.955 1.00 0.00 C ATOM 350 O GLY D 23 -13.365 6.391 6.940 1.00 0.00 O ATOM 0 H GLY D 23 -11.202 7.239 4.888 1.00 0.00 H new ATOM 0 HA2 GLY D 23 -12.410 8.725 6.893 1.00 0.00 H new ATOM 0 HA3 GLY D 23 -13.221 9.167 5.404 1.00 0.00 H new ATOM 354 N LYS D 24 -14.219 6.852 4.890 1.00 0.00 N ATOM 355 CA LYS D 24 -15.033 5.639 4.792 1.00 0.00 C ATOM 356 C LYS D 24 -14.180 4.442 5.164 1.00 0.00 C ATOM 357 O LYS D 24 -14.409 3.785 6.171 1.00 0.00 O ATOM 358 CB LYS D 24 -15.545 5.475 3.358 1.00 0.00 C ATOM 359 CG LYS D 24 -16.592 4.388 3.152 1.00 0.00 C ATOM 360 CD LYS D 24 -17.877 4.685 3.910 1.00 0.00 C ATOM 361 CE LYS D 24 -19.021 3.793 3.439 1.00 0.00 C ATOM 362 NZ LYS D 24 -18.688 2.344 3.523 1.00 0.00 N1+ ATOM 0 H LYS D 24 -14.289 7.465 4.077 1.00 0.00 H new ATOM 0 HA LYS D 24 -15.884 5.713 5.469 1.00 0.00 H new ATOM 0 HB2 LYS D 24 -15.966 6.426 3.031 1.00 0.00 H new ATOM 0 HB3 LYS D 24 -14.695 5.263 2.710 1.00 0.00 H new ATOM 0 HG2 LYS D 24 -16.812 4.293 2.089 1.00 0.00 H new ATOM 0 HG3 LYS D 24 -16.190 3.430 3.481 1.00 0.00 H new ATOM 0 HD2 LYS D 24 -17.714 4.537 4.977 1.00 0.00 H new ATOM 0 HD3 LYS D 24 -18.149 5.731 3.772 1.00 0.00 H new ATOM 0 HE2 LYS D 24 -19.906 3.994 4.042 1.00 0.00 H new ATOM 0 HE3 LYS D 24 -19.273 4.045 2.409 1.00 0.00 H new ATOM 0 HZ1 LYS D 24 -19.563 1.792 3.628 1.00 0.00 H new ATOM 0 HZ2 LYS D 24 -18.195 2.050 2.656 1.00 0.00 H new ATOM 0 HZ3 LYS D 24 -18.073 2.176 4.344 1.00 0.00 H new ATOM 376 N GLY D 25 -13.130 4.242 4.393 1.00 0.00 N ATOM 377 CA GLY D 25 -12.172 3.219 4.691 1.00 0.00 C ATOM 378 C GLY D 25 -10.771 3.724 4.551 1.00 0.00 C ATOM 379 O GLY D 25 -10.542 4.840 4.078 1.00 0.00 O ATOM 0 H GLY D 25 -12.926 4.783 3.553 1.00 0.00 H new ATOM 0 HA2 GLY D 25 -12.329 2.856 5.707 1.00 0.00 H new ATOM 0 HA3 GLY D 25 -12.323 2.371 4.023 1.00 0.00 H new ATOM 383 N LYS D 26 -9.869 3.011 5.181 1.00 0.00 N ATOM 384 CA LYS D 26 -8.520 3.479 5.355 1.00 0.00 C ATOM 385 C LYS D 26 -7.544 2.323 5.402 1.00 0.00 C ATOM 386 O LYS D 26 -7.946 1.193 5.644 1.00 0.00 O ATOM 387 CB LYS D 26 -8.500 4.283 6.624 1.00 0.00 C ATOM 388 CG LYS D 26 -9.469 3.723 7.622 1.00 0.00 C ATOM 389 CD LYS D 26 -9.734 4.666 8.787 1.00 0.00 C ATOM 390 CE LYS D 26 -10.356 5.984 8.329 1.00 0.00 C ATOM 391 NZ LYS D 26 -9.354 6.909 7.730 1.00 0.00 N1+ ATOM 0 H LYS D 26 -10.051 2.093 5.586 1.00 0.00 H new ATOM 0 HA LYS D 26 -8.208 4.097 4.513 1.00 0.00 H new ATOM 0 HB2 LYS D 26 -7.495 4.281 7.045 1.00 0.00 H new ATOM 0 HB3 LYS D 26 -8.753 5.321 6.407 1.00 0.00 H new ATOM 0 HG2 LYS D 26 -10.411 3.500 7.120 1.00 0.00 H new ATOM 0 HG3 LYS D 26 -9.082 2.779 8.006 1.00 0.00 H new ATOM 0 HD2 LYS D 26 -10.399 4.181 9.502 1.00 0.00 H new ATOM 0 HD3 LYS D 26 -8.799 4.869 9.309 1.00 0.00 H new ATOM 0 HE2 LYS D 26 -11.138 5.778 7.598 1.00 0.00 H new ATOM 0 HE3 LYS D 26 -10.834 6.472 9.179 1.00 0.00 H new ATOM 0 HZ1 LYS D 26 -9.408 7.833 8.203 1.00 0.00 H new ATOM 0 HZ2 LYS D 26 -8.400 6.513 7.852 1.00 0.00 H new ATOM 0 HZ3 LYS D 26 -9.553 7.027 6.716 1.00 0.00 H new ATOM 405 N LEU D 27 -6.276 2.601 5.145 1.00 0.00 N ATOM 406 CA LEU D 27 -5.261 1.562 5.134 1.00 0.00 C ATOM 407 C LEU D 27 -3.922 2.062 5.695 1.00 0.00 C ATOM 408 O LEU D 27 -3.453 3.145 5.344 1.00 0.00 O ATOM 409 CB LEU D 27 -5.085 1.036 3.722 1.00 0.00 C ATOM 410 CG LEU D 27 -3.913 0.073 3.524 1.00 0.00 C ATOM 411 CD1 LEU D 27 -4.058 -1.148 4.418 1.00 0.00 C ATOM 412 CD2 LEU D 27 -3.809 -0.359 2.070 1.00 0.00 C ATOM 0 H LEU D 27 -5.926 3.537 4.941 1.00 0.00 H new ATOM 0 HA LEU D 27 -5.598 0.754 5.783 1.00 0.00 H new ATOM 0 HB2 LEU D 27 -6.003 0.531 3.423 1.00 0.00 H new ATOM 0 HB3 LEU D 27 -4.955 1.884 3.050 1.00 0.00 H new ATOM 0 HG LEU D 27 -3.000 0.600 3.799 1.00 0.00 H new ATOM 0 HD11 LEU D 27 -3.213 -1.818 4.259 1.00 0.00 H new ATOM 0 HD12 LEU D 27 -4.081 -0.834 5.462 1.00 0.00 H new ATOM 0 HD13 LEU D 27 -4.984 -1.669 4.175 1.00 0.00 H new ATOM 0 HD21 LEU D 27 -2.969 -1.043 1.953 1.00 0.00 H new ATOM 0 HD22 LEU D 27 -4.730 -0.861 1.773 1.00 0.00 H new ATOM 0 HD23 LEU D 27 -3.654 0.517 1.440 1.00 0.00 H new ATOM 424 N SER D 28 -3.268 1.220 6.483 1.00 0.00 N ATOM 425 CA SER D 28 -1.935 1.507 7.002 1.00 0.00 C ATOM 426 C SER D 28 -1.037 0.327 6.675 1.00 0.00 C ATOM 427 O SER D 28 -1.525 -0.790 6.550 1.00 0.00 O ATOM 428 CB SER D 28 -1.970 1.701 8.519 1.00 0.00 C ATOM 429 OG SER D 28 -0.765 2.277 9.002 1.00 0.00 O ATOM 0 H SER D 28 -3.644 0.320 6.781 1.00 0.00 H new ATOM 0 HA SER D 28 -1.561 2.424 6.547 1.00 0.00 H new ATOM 0 HB2 SER D 28 -2.811 2.341 8.785 1.00 0.00 H new ATOM 0 HB3 SER D 28 -2.134 0.739 9.005 1.00 0.00 H new ATOM 0 HG SER D 28 -0.472 2.984 8.390 1.00 0.00 H new ATOM 435 N LEU D 29 0.264 0.548 6.558 1.00 0.00 N ATOM 436 CA LEU D 29 1.167 -0.558 6.273 1.00 0.00 C ATOM 437 C LEU D 29 2.387 -0.510 7.181 1.00 0.00 C ATOM 438 O LEU D 29 2.942 0.562 7.437 1.00 0.00 O ATOM 439 CB LEU D 29 1.625 -0.531 4.820 1.00 0.00 C ATOM 440 CG LEU D 29 0.510 -0.381 3.790 1.00 0.00 C ATOM 441 CD1 LEU D 29 1.081 -0.033 2.427 1.00 0.00 C ATOM 442 CD2 LEU D 29 -0.294 -1.661 3.684 1.00 0.00 C ATOM 0 H LEU D 29 0.711 1.460 6.653 1.00 0.00 H new ATOM 0 HA LEU D 29 0.617 -1.481 6.457 1.00 0.00 H new ATOM 0 HB2 LEU D 29 2.328 0.292 4.693 1.00 0.00 H new ATOM 0 HB3 LEU D 29 2.170 -1.451 4.610 1.00 0.00 H new ATOM 0 HG LEU D 29 -0.142 0.427 4.121 1.00 0.00 H new ATOM 0 HD11 LEU D 29 0.269 0.069 1.708 1.00 0.00 H new ATOM 0 HD12 LEU D 29 1.629 0.907 2.491 1.00 0.00 H new ATOM 0 HD13 LEU D 29 1.756 -0.825 2.102 1.00 0.00 H new ATOM 0 HD21 LEU D 29 -1.084 -1.534 2.944 1.00 0.00 H new ATOM 0 HD22 LEU D 29 0.360 -2.478 3.379 1.00 0.00 H new ATOM 0 HD23 LEU D 29 -0.737 -1.894 4.652 1.00 0.00 H new ATOM 454 N SER D 30 2.817 -1.673 7.633 1.00 0.00 N ATOM 455 CA SER D 30 3.995 -1.798 8.477 1.00 0.00 C ATOM 456 C SER D 30 4.625 -3.172 8.281 1.00 0.00 C ATOM 457 O SER D 30 4.169 -3.955 7.448 1.00 0.00 O ATOM 458 CB SER D 30 3.629 -1.592 9.951 1.00 0.00 C ATOM 459 OG SER D 30 3.062 -0.306 10.166 1.00 0.00 O ATOM 0 H SER D 30 2.360 -2.561 7.426 1.00 0.00 H new ATOM 0 HA SER D 30 4.713 -1.029 8.191 1.00 0.00 H new ATOM 0 HB2 SER D 30 2.922 -2.361 10.264 1.00 0.00 H new ATOM 0 HB3 SER D 30 4.519 -1.707 10.569 1.00 0.00 H new ATOM 0 HG SER D 30 2.837 -0.202 11.114 1.00 0.00 H new ATOM 465 N MET D 31 5.668 -3.461 9.044 1.00 0.00 N ATOM 466 CA MET D 31 6.360 -4.742 8.949 1.00 0.00 C ATOM 467 C MET D 31 6.660 -5.289 10.332 1.00 0.00 C ATOM 468 O MET D 31 6.571 -4.575 11.330 1.00 0.00 O ATOM 469 CB MET D 31 7.659 -4.592 8.152 1.00 0.00 C ATOM 470 CG MET D 31 7.440 -4.166 6.708 1.00 0.00 C ATOM 471 SD MET D 31 8.982 -3.963 5.800 1.00 0.00 S ATOM 472 CE MET D 31 9.760 -2.667 6.757 1.00 0.00 C ATOM 0 H MET D 31 6.057 -2.824 9.739 1.00 0.00 H new ATOM 0 HA MET D 31 5.708 -5.444 8.429 1.00 0.00 H new ATOM 0 HB2 MET D 31 8.296 -3.859 8.646 1.00 0.00 H new ATOM 0 HB3 MET D 31 8.195 -5.541 8.165 1.00 0.00 H new ATOM 0 HG2 MET D 31 6.822 -4.909 6.204 1.00 0.00 H new ATOM 0 HG3 MET D 31 6.887 -3.227 6.691 1.00 0.00 H new ATOM 0 HE1 MET D 31 10.540 -2.193 6.161 1.00 0.00 H new ATOM 0 HE2 MET D 31 9.014 -1.923 7.036 1.00 0.00 H new ATOM 0 HE3 MET D 31 10.200 -3.094 7.658 1.00 0.00 H new ATOM 482 N ASN D 32 7.026 -6.557 10.369 1.00 0.00 N ATOM 483 CA ASN D 32 7.363 -7.237 11.611 1.00 0.00 C ATOM 484 C ASN D 32 8.461 -8.249 11.325 1.00 0.00 C ATOM 485 O ASN D 32 8.182 -9.353 10.863 1.00 0.00 O ATOM 486 CB ASN D 32 6.118 -7.938 12.176 1.00 0.00 C ATOM 487 CG ASN D 32 6.354 -8.568 13.537 1.00 0.00 C ATOM 488 OD1 ASN D 32 7.184 -9.464 13.688 1.00 0.00 O ATOM 489 ND2 ASN D 32 5.621 -8.104 14.537 1.00 0.00 N ATOM 0 H ASN D 32 7.099 -7.147 9.540 1.00 0.00 H new ATOM 0 HA ASN D 32 7.714 -6.518 12.351 1.00 0.00 H new ATOM 0 HB2 ASN D 32 5.305 -7.216 12.253 1.00 0.00 H new ATOM 0 HB3 ASN D 32 5.794 -8.709 11.477 1.00 0.00 H new ATOM 0 HD21 ASN D 32 5.734 -8.490 15.474 1.00 0.00 H new ATOM 0 HD22 ASN D 32 4.943 -7.360 14.370 1.00 0.00 H new ATOM 496 N GLY D 33 9.707 -7.807 11.411 1.00 0.00 N ATOM 497 CA GLY D 33 10.807 -8.640 10.953 1.00 0.00 C ATOM 498 C GLY D 33 10.855 -8.681 9.441 1.00 0.00 C ATOM 499 O GLY D 33 11.121 -7.662 8.799 1.00 0.00 O ATOM 0 H GLY D 33 9.978 -6.897 11.785 1.00 0.00 H new ATOM 0 HA2 GLY D 33 11.749 -8.252 11.341 1.00 0.00 H new ATOM 0 HA3 GLY D 33 10.692 -9.650 11.345 1.00 0.00 H new ATOM 503 N ASN D 34 10.433 -9.800 8.868 1.00 0.00 N ATOM 504 CA ASN D 34 10.255 -9.902 7.421 1.00 0.00 C ATOM 505 C ASN D 34 8.781 -10.091 7.091 1.00 0.00 C ATOM 506 O ASN D 34 8.426 -10.750 6.113 1.00 0.00 O ATOM 507 CB ASN D 34 11.066 -11.063 6.829 1.00 0.00 C ATOM 508 CG ASN D 34 12.570 -10.854 6.889 1.00 0.00 C ATOM 509 OD1 ASN D 34 13.338 -11.720 6.472 1.00 0.00 O ATOM 510 ND2 ASN D 34 13.005 -9.707 7.391 1.00 0.00 N ATOM 0 H ASN D 34 10.207 -10.652 9.381 1.00 0.00 H new ATOM 0 HA ASN D 34 10.619 -8.975 6.978 1.00 0.00 H new ATOM 0 HB2 ASN D 34 10.814 -11.979 7.363 1.00 0.00 H new ATOM 0 HB3 ASN D 34 10.770 -11.208 5.790 1.00 0.00 H new ATOM 0 HD21 ASN D 34 14.006 -9.519 7.441 1.00 0.00 H new ATOM 0 HD22 ASN D 34 12.338 -9.012 7.727 1.00 0.00 H new ATOM 517 N GLN D 35 7.922 -9.544 7.939 1.00 0.00 N ATOM 518 CA GLN D 35 6.484 -9.683 7.764 1.00 0.00 C ATOM 519 C GLN D 35 5.900 -8.408 7.184 1.00 0.00 C ATOM 520 O GLN D 35 6.429 -7.324 7.396 1.00 0.00 O ATOM 521 CB GLN D 35 5.812 -9.995 9.105 1.00 0.00 C ATOM 522 CG GLN D 35 4.323 -10.302 9.017 1.00 0.00 C ATOM 523 CD GLN D 35 4.006 -11.436 8.065 1.00 0.00 C ATOM 524 OE1 GLN D 35 4.512 -12.548 8.213 1.00 0.00 O ATOM 525 NE2 GLN D 35 3.154 -11.164 7.090 1.00 0.00 N ATOM 0 H GLN D 35 8.197 -8.999 8.756 1.00 0.00 H new ATOM 0 HA GLN D 35 6.299 -10.506 7.074 1.00 0.00 H new ATOM 0 HB2 GLN D 35 6.318 -10.847 9.559 1.00 0.00 H new ATOM 0 HB3 GLN D 35 5.955 -9.146 9.773 1.00 0.00 H new ATOM 0 HG2 GLN D 35 3.951 -10.554 10.010 1.00 0.00 H new ATOM 0 HG3 GLN D 35 3.792 -9.406 8.695 1.00 0.00 H new ATOM 0 HE21 GLN D 35 2.758 -10.228 7.005 1.00 0.00 H new ATOM 0 HE22 GLN D 35 2.893 -11.891 6.424 1.00 0.00 H new ATOM 534 N LEU D 36 4.766 -8.543 6.529 1.00 0.00 N ATOM 535 CA LEU D 36 4.042 -7.408 5.994 1.00 0.00 C ATOM 536 C LEU D 36 2.730 -7.262 6.736 1.00 0.00 C ATOM 537 O LEU D 36 2.070 -8.259 7.030 1.00 0.00 O ATOM 538 CB LEU D 36 3.861 -7.620 4.493 1.00 0.00 C ATOM 539 CG LEU D 36 3.047 -6.582 3.698 1.00 0.00 C ATOM 540 CD1 LEU D 36 1.573 -6.653 4.042 1.00 0.00 C ATOM 541 CD2 LEU D 36 3.565 -5.173 3.938 1.00 0.00 C ATOM 0 H LEU D 36 4.320 -9.443 6.352 1.00 0.00 H new ATOM 0 HA LEU D 36 4.590 -6.476 6.134 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.853 -7.678 4.044 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.389 -8.592 4.350 1.00 0.00 H new ATOM 0 HG LEU D 36 3.168 -6.823 2.642 1.00 0.00 H new ATOM 0 HD11 LEU D 36 1.028 -5.907 3.463 1.00 0.00 H new ATOM 0 HD12 LEU D 36 1.191 -7.646 3.805 1.00 0.00 H new ATOM 0 HD13 LEU D 36 1.438 -6.457 5.106 1.00 0.00 H new ATOM 0 HD21 LEU D 36 2.970 -4.464 3.363 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.490 -4.934 4.999 1.00 0.00 H new ATOM 0 HD23 LEU D 36 4.607 -5.110 3.625 1.00 0.00 H new ATOM 553 N LYS D 37 2.467 -6.056 7.214 1.00 0.00 N ATOM 554 CA LYS D 37 1.363 -5.840 8.132 1.00 0.00 C ATOM 555 C LYS D 37 0.562 -4.593 7.777 1.00 0.00 C ATOM 556 O LYS D 37 0.908 -3.484 8.170 1.00 0.00 O ATOM 557 CB LYS D 37 1.933 -5.706 9.544 1.00 0.00 C ATOM 558 CG LYS D 37 2.767 -6.911 9.977 1.00 0.00 C ATOM 559 CD LYS D 37 1.926 -8.170 10.180 1.00 0.00 C ATOM 560 CE LYS D 37 0.926 -8.037 11.326 1.00 0.00 C ATOM 561 NZ LYS D 37 1.601 -7.759 12.623 1.00 0.00 N1+ ATOM 0 H LYS D 37 3.000 -5.218 6.983 1.00 0.00 H new ATOM 0 HA LYS D 37 0.682 -6.689 8.066 1.00 0.00 H new ATOM 0 HB2 LYS D 37 2.550 -4.809 9.595 1.00 0.00 H new ATOM 0 HB3 LYS D 37 1.112 -5.569 10.248 1.00 0.00 H new ATOM 0 HG2 LYS D 37 3.531 -7.107 9.225 1.00 0.00 H new ATOM 0 HG3 LYS D 37 3.287 -6.673 10.905 1.00 0.00 H new ATOM 0 HD2 LYS D 37 1.388 -8.394 9.259 1.00 0.00 H new ATOM 0 HD3 LYS D 37 2.587 -9.014 10.377 1.00 0.00 H new ATOM 0 HE2 LYS D 37 0.223 -7.234 11.103 1.00 0.00 H new ATOM 0 HE3 LYS D 37 0.345 -8.955 11.409 1.00 0.00 H new ATOM 0 HZ1 LYS D 37 0.916 -7.860 13.399 1.00 0.00 H new ATOM 0 HZ2 LYS D 37 2.381 -8.433 12.760 1.00 0.00 H new ATOM 0 HZ3 LYS D 37 1.978 -6.790 12.618 1.00 0.00 H new ATOM 575 N ALA D 38 -0.550 -4.800 7.100 1.00 0.00 N ATOM 576 CA ALA D 38 -1.462 -3.724 6.760 1.00 0.00 C ATOM 577 C ALA D 38 -2.622 -3.660 7.744 1.00 0.00 C ATOM 578 O ALA D 38 -3.080 -4.688 8.237 1.00 0.00 O ATOM 579 CB ALA D 38 -1.994 -3.930 5.353 1.00 0.00 C ATOM 0 H ALA D 38 -0.847 -5.718 6.770 1.00 0.00 H new ATOM 0 HA ALA D 38 -0.916 -2.782 6.812 1.00 0.00 H new ATOM 0 HB1 ALA D 38 -2.679 -3.120 5.101 1.00 0.00 H new ATOM 0 HB2 ALA D 38 -1.163 -3.936 4.647 1.00 0.00 H new ATOM 0 HB3 ALA D 38 -2.522 -4.882 5.300 1.00 0.00 H new ATOM 585 N THR D 39 -3.162 -2.467 7.943 1.00 0.00 N ATOM 586 CA THR D 39 -4.348 -2.297 8.764 1.00 0.00 C ATOM 587 C THR D 39 -5.345 -1.396 8.056 1.00 0.00 C ATOM 588 O THR D 39 -5.046 -0.245 7.750 1.00 0.00 O ATOM 589 CB THR D 39 -4.001 -1.701 10.122 1.00 0.00 C ATOM 590 OG1 THR D 39 -3.357 -0.460 9.956 1.00 0.00 O ATOM 591 CG2 THR D 39 -3.110 -2.579 10.975 1.00 0.00 C ATOM 0 H THR D 39 -2.796 -1.602 7.546 1.00 0.00 H new ATOM 0 HA THR D 39 -4.788 -3.281 8.923 1.00 0.00 H new ATOM 0 HB THR D 39 -4.954 -1.596 10.641 1.00 0.00 H new ATOM 0 HG1 THR D 39 -3.795 0.042 9.237 1.00 0.00 H new ATOM 0 HG21 THR D 39 -2.911 -2.082 11.924 1.00 0.00 H new ATOM 0 HG22 THR D 39 -3.608 -3.531 11.161 1.00 0.00 H new ATOM 0 HG23 THR D 39 -2.169 -2.757 10.454 1.00 0.00 H new ATOM 599 N SER D 40 -6.535 -1.901 7.854 1.00 0.00 N ATOM 600 CA SER D 40 -7.602 -1.132 7.243 1.00 0.00 C ATOM 601 C SER D 40 -8.705 -0.955 8.252 1.00 0.00 C ATOM 602 O SER D 40 -9.079 -1.903 8.943 1.00 0.00 O ATOM 603 CB SER D 40 -8.114 -1.862 6.024 1.00 0.00 C ATOM 604 OG SER D 40 -7.036 -2.168 5.157 1.00 0.00 O ATOM 0 H SER D 40 -6.797 -2.854 8.106 1.00 0.00 H new ATOM 0 HA SER D 40 -7.235 -0.154 6.932 1.00 0.00 H new ATOM 0 HB2 SER D 40 -8.622 -2.779 6.325 1.00 0.00 H new ATOM 0 HB3 SER D 40 -8.848 -1.247 5.503 1.00 0.00 H new ATOM 0 HG SER D 40 -7.318 -2.849 4.512 1.00 0.00 H new ATOM 610 N SER D 41 -9.130 0.270 8.438 1.00 0.00 N ATOM 611 CA SER D 41 -10.083 0.548 9.499 1.00 0.00 C ATOM 612 C SER D 41 -11.478 0.779 8.945 1.00 0.00 C ATOM 613 O SER D 41 -11.660 0.906 7.724 1.00 0.00 O ATOM 614 CB SER D 41 -9.619 1.730 10.345 1.00 0.00 C ATOM 615 OG SER D 41 -8.318 1.496 10.869 1.00 0.00 O ATOM 0 H SER D 41 -8.843 1.078 7.886 1.00 0.00 H new ATOM 0 HA SER D 41 -10.132 -0.329 10.144 1.00 0.00 H new ATOM 0 HB2 SER D 41 -9.615 2.637 9.740 1.00 0.00 H new ATOM 0 HB3 SER D 41 -10.321 1.896 11.162 1.00 0.00 H new ATOM 0 HG SER D 41 -8.039 2.266 11.407 1.00 0.00 H new ATOM 621 N ASN D 42 -12.455 0.664 9.853 1.00 0.00 N ATOM 622 CA ASN D 42 -13.883 0.669 9.526 1.00 0.00 C ATOM 623 C ASN D 42 -14.305 -0.678 8.960 1.00 0.00 C ATOM 624 O ASN D 42 -15.471 -0.880 8.622 1.00 0.00 O ATOM 625 CB ASN D 42 -14.264 1.810 8.585 1.00 0.00 C ATOM 626 CG ASN D 42 -14.110 3.158 9.254 1.00 0.00 C ATOM 627 OD1 ASN D 42 -14.756 3.438 10.263 1.00 0.00 O ATOM 628 ND2 ASN D 42 -13.253 4.001 8.705 1.00 0.00 N ATOM 0 H ASN D 42 -12.271 0.563 10.851 1.00 0.00 H new ATOM 0 HA ASN D 42 -14.427 0.841 10.455 1.00 0.00 H new ATOM 0 HB2 ASN D 42 -13.638 1.772 7.694 1.00 0.00 H new ATOM 0 HB3 ASN D 42 -15.295 1.682 8.256 1.00 0.00 H new ATOM 0 HD21 ASN D 42 -13.108 4.922 9.118 1.00 0.00 H new ATOM 0 HD22 ASN D 42 -12.737 3.730 7.868 1.00 0.00 H new ATOM 635 N ALA D 43 -13.387 -1.640 9.062 1.00 0.00 N ATOM 636 CA ALA D 43 -13.663 -3.048 8.779 1.00 0.00 C ATOM 637 C ALA D 43 -14.380 -3.280 7.447 1.00 0.00 C ATOM 638 O ALA D 43 -15.411 -3.950 7.413 1.00 0.00 O ATOM 639 CB ALA D 43 -14.463 -3.651 9.923 1.00 0.00 C ATOM 0 H ALA D 43 -12.424 -1.462 9.346 1.00 0.00 H new ATOM 0 HA ALA D 43 -12.697 -3.545 8.689 1.00 0.00 H new ATOM 0 HB1 ALA D 43 -14.668 -4.700 9.710 1.00 0.00 H new ATOM 0 HB2 ALA D 43 -13.891 -3.573 10.848 1.00 0.00 H new ATOM 0 HB3 ALA D 43 -15.404 -3.113 10.032 1.00 0.00 H new ATOM 645 N GLY D 44 -13.758 -2.882 6.339 1.00 0.00 N ATOM 646 CA GLY D 44 -14.305 -3.251 5.050 1.00 0.00 C ATOM 647 C GLY D 44 -14.965 -2.110 4.312 1.00 0.00 C ATOM 648 O GLY D 44 -15.952 -2.319 3.615 1.00 0.00 O ATOM 0 H GLY D 44 -12.905 -2.324 6.312 1.00 0.00 H new ATOM 0 HA2 GLY D 44 -13.505 -3.656 4.430 1.00 0.00 H new ATOM 0 HA3 GLY D 44 -15.034 -4.049 5.191 1.00 0.00 H new ATOM 652 N TYR D 45 -14.407 -0.914 4.416 1.00 0.00 N ATOM 653 CA TYR D 45 -14.933 0.238 3.686 1.00 0.00 C ATOM 654 C TYR D 45 -13.910 0.717 2.656 1.00 0.00 C ATOM 655 O TYR D 45 -12.706 0.542 2.848 1.00 0.00 O ATOM 656 CB TYR D 45 -15.272 1.384 4.645 1.00 0.00 C ATOM 657 CG TYR D 45 -16.439 1.133 5.591 1.00 0.00 C ATOM 658 CD1 TYR D 45 -17.045 2.194 6.257 1.00 0.00 C ATOM 659 CD2 TYR D 45 -16.949 -0.141 5.805 1.00 0.00 C ATOM 660 CE1 TYR D 45 -18.112 1.990 7.105 1.00 0.00 C ATOM 661 CE2 TYR D 45 -18.018 -0.351 6.653 1.00 0.00 C ATOM 662 CZ TYR D 45 -18.593 0.717 7.301 1.00 0.00 C ATOM 663 OH TYR D 45 -19.657 0.514 8.148 1.00 0.00 O ATOM 0 H TYR D 45 -13.593 -0.712 4.996 1.00 0.00 H new ATOM 0 HA TYR D 45 -15.846 -0.071 3.176 1.00 0.00 H new ATOM 0 HB2 TYR D 45 -14.387 1.608 5.241 1.00 0.00 H new ATOM 0 HB3 TYR D 45 -15.492 2.274 4.055 1.00 0.00 H new ATOM 0 HD1 TYR D 45 -16.672 3.196 6.106 1.00 0.00 H new ATOM 0 HD2 TYR D 45 -16.501 -0.983 5.299 1.00 0.00 H new ATOM 0 HE1 TYR D 45 -18.568 2.826 7.613 1.00 0.00 H new ATOM 0 HE2 TYR D 45 -18.401 -1.349 6.807 1.00 0.00 H new ATOM 0 HH TYR D 45 -19.875 -0.441 8.176 1.00 0.00 H new ATOM 673 N GLY D 46 -14.390 1.346 1.587 1.00 0.00 N ATOM 674 CA GLY D 46 -13.503 1.885 0.559 1.00 0.00 C ATOM 675 C GLY D 46 -13.258 3.362 0.755 1.00 0.00 C ATOM 676 O GLY D 46 -13.385 3.848 1.864 1.00 0.00 O ATOM 0 H GLY D 46 -15.383 1.495 1.410 1.00 0.00 H new ATOM 0 HA2 GLY D 46 -12.553 1.352 0.582 1.00 0.00 H new ATOM 0 HA3 GLY D 46 -13.940 1.716 -0.425 1.00 0.00 H new ATOM 680 N ILE D 47 -12.908 4.080 -0.308 1.00 0.00 N ATOM 681 CA ILE D 47 -12.652 5.514 -0.208 1.00 0.00 C ATOM 682 C ILE D 47 -13.860 6.179 0.413 1.00 0.00 C ATOM 683 O ILE D 47 -13.766 6.936 1.385 1.00 0.00 O ATOM 684 CB ILE D 47 -12.522 6.208 -1.572 1.00 0.00 C ATOM 685 CG1 ILE D 47 -11.918 5.352 -2.651 1.00 0.00 C ATOM 686 CG2 ILE D 47 -11.763 7.512 -1.448 1.00 0.00 C ATOM 687 CD1 ILE D 47 -12.928 4.416 -3.269 1.00 0.00 C ATOM 0 H ILE D 47 -12.795 3.695 -1.246 1.00 0.00 H new ATOM 0 HA ILE D 47 -11.727 5.608 0.360 1.00 0.00 H new ATOM 0 HB ILE D 47 -13.546 6.408 -1.888 1.00 0.00 H new ATOM 0 HG12 ILE D 47 -11.496 5.992 -3.426 1.00 0.00 H new ATOM 0 HG13 ILE D 47 -11.095 4.772 -2.234 1.00 0.00 H new ATOM 0 HG21 ILE D 47 -11.685 7.982 -2.428 1.00 0.00 H new ATOM 0 HG22 ILE D 47 -12.293 8.178 -0.767 1.00 0.00 H new ATOM 0 HG23 ILE D 47 -10.764 7.316 -1.060 1.00 0.00 H new ATOM 0 HD11 ILE D 47 -12.445 3.819 -4.042 1.00 0.00 H new ATOM 0 HD12 ILE D 47 -13.331 3.757 -2.500 1.00 0.00 H new ATOM 0 HD13 ILE D 47 -13.738 4.996 -3.711 1.00 0.00 H new ATOM 699 N SER D 48 -14.970 5.931 -0.273 1.00 0.00 N ATOM 700 CA SER D 48 -16.277 6.507 0.003 1.00 0.00 C ATOM 701 C SER D 48 -17.120 6.312 -1.249 1.00 0.00 C ATOM 702 O SER D 48 -18.092 5.552 -1.261 1.00 0.00 O ATOM 703 CB SER D 48 -16.177 8.000 0.329 1.00 0.00 C ATOM 704 OG SER D 48 -17.434 8.525 0.723 1.00 0.00 O ATOM 0 H SER D 48 -14.982 5.295 -1.071 1.00 0.00 H new ATOM 0 HA SER D 48 -16.721 6.018 0.870 1.00 0.00 H new ATOM 0 HB2 SER D 48 -15.450 8.153 1.127 1.00 0.00 H new ATOM 0 HB3 SER D 48 -15.811 8.542 -0.543 1.00 0.00 H new ATOM 0 HG SER D 48 -17.773 9.123 0.024 1.00 0.00 H new ATOM 710 N TYR D 49 -16.626 6.900 -2.334 1.00 0.00 N ATOM 711 CA TYR D 49 -17.181 6.718 -3.668 1.00 0.00 C ATOM 712 C TYR D 49 -16.254 7.316 -4.719 1.00 0.00 C ATOM 713 O TYR D 49 -16.515 8.389 -5.267 1.00 0.00 O ATOM 714 CB TYR D 49 -18.591 7.311 -3.773 1.00 0.00 C ATOM 715 CG TYR D 49 -18.823 8.584 -2.954 1.00 0.00 C ATOM 716 CD1 TYR D 49 -17.945 9.663 -3.022 1.00 0.00 C ATOM 717 CD2 TYR D 49 -19.919 8.698 -2.090 1.00 0.00 C ATOM 718 CE1 TYR D 49 -18.147 10.800 -2.269 1.00 0.00 C ATOM 719 CE2 TYR D 49 -20.121 9.837 -1.339 1.00 0.00 C ATOM 720 CZ TYR D 49 -19.234 10.883 -1.431 1.00 0.00 C ATOM 721 OH TYR D 49 -19.434 12.015 -0.678 1.00 0.00 O ATOM 0 H TYR D 49 -15.819 7.524 -2.310 1.00 0.00 H new ATOM 0 HA TYR D 49 -17.264 5.647 -3.855 1.00 0.00 H new ATOM 0 HB2 TYR D 49 -18.800 7.528 -4.820 1.00 0.00 H new ATOM 0 HB3 TYR D 49 -19.310 6.557 -3.455 1.00 0.00 H new ATOM 0 HD1 TYR D 49 -17.089 9.608 -3.678 1.00 0.00 H new ATOM 0 HD2 TYR D 49 -20.619 7.879 -2.010 1.00 0.00 H new ATOM 0 HE1 TYR D 49 -17.453 11.624 -2.337 1.00 0.00 H new ATOM 0 HE2 TYR D 49 -20.974 9.907 -0.680 1.00 0.00 H new ATOM 0 HH TYR D 49 -20.247 11.911 -0.141 1.00 0.00 H new ATOM 731 N GLU D 50 -15.170 6.602 -5.002 1.00 0.00 N ATOM 732 CA GLU D 50 -14.189 7.039 -5.988 1.00 0.00 C ATOM 733 C GLU D 50 -13.528 5.842 -6.665 1.00 0.00 C ATOM 734 O GLU D 50 -13.772 4.700 -6.286 1.00 0.00 O ATOM 735 CB GLU D 50 -13.099 7.890 -5.326 1.00 0.00 C ATOM 736 CG GLU D 50 -13.576 9.220 -4.772 1.00 0.00 C ATOM 737 CD GLU D 50 -12.444 10.048 -4.216 1.00 0.00 C ATOM 738 OE1 GLU D 50 -11.543 10.414 -4.993 1.00 0.00 O ATOM 739 OE2 GLU D 50 -12.445 10.322 -3.004 1.00 0.00 O1- ATOM 0 H GLU D 50 -14.948 5.711 -4.558 1.00 0.00 H new ATOM 0 HA GLU D 50 -14.718 7.633 -6.734 1.00 0.00 H new ATOM 0 HB2 GLU D 50 -12.651 7.315 -4.516 1.00 0.00 H new ATOM 0 HB3 GLU D 50 -12.312 8.078 -6.056 1.00 0.00 H new ATOM 0 HG2 GLU D 50 -14.079 9.780 -5.560 1.00 0.00 H new ATOM 0 HG3 GLU D 50 -14.312 9.042 -3.988 1.00 0.00 H new ATOM 746 N ASP D 51 -12.579 6.121 -7.559 1.00 0.00 N ATOM 747 CA ASP D 51 -11.755 5.074 -8.163 1.00 0.00 C ATOM 748 C ASP D 51 -10.280 5.403 -8.055 1.00 0.00 C ATOM 749 O ASP D 51 -9.841 6.504 -8.389 1.00 0.00 O ATOM 750 CB ASP D 51 -12.179 4.800 -9.615 1.00 0.00 C ATOM 751 CG ASP D 51 -11.180 3.974 -10.414 1.00 0.00 C ATOM 752 OD1 ASP D 51 -10.048 4.446 -10.645 1.00 0.00 O ATOM 753 OD2 ASP D 51 -11.532 2.856 -10.825 1.00 0.00 O1- ATOM 0 H ASP D 51 -12.362 7.064 -7.881 1.00 0.00 H new ATOM 0 HA ASP D 51 -11.919 4.154 -7.602 1.00 0.00 H new ATOM 0 HB2 ASP D 51 -13.138 4.283 -9.610 1.00 0.00 H new ATOM 0 HB3 ASP D 51 -12.333 5.752 -10.122 1.00 0.00 H new ATOM 758 N LYS D 52 -9.527 4.422 -7.571 1.00 0.00 N ATOM 759 CA LYS D 52 -8.094 4.540 -7.387 1.00 0.00 C ATOM 760 C LYS D 52 -7.421 3.234 -7.744 1.00 0.00 C ATOM 761 O LYS D 52 -7.374 2.319 -6.924 1.00 0.00 O ATOM 762 CB LYS D 52 -7.717 4.891 -5.953 1.00 0.00 C ATOM 763 CG LYS D 52 -8.081 6.291 -5.499 1.00 0.00 C ATOM 764 CD LYS D 52 -9.552 6.444 -5.163 1.00 0.00 C ATOM 765 CE LYS D 52 -9.843 7.876 -4.756 1.00 0.00 C ATOM 766 NZ LYS D 52 -9.008 8.303 -3.600 1.00 0.00 N1+ ATOM 0 H LYS D 52 -9.902 3.515 -7.294 1.00 0.00 H new ATOM 0 HA LYS D 52 -7.760 5.347 -8.039 1.00 0.00 H new ATOM 0 HB2 LYS D 52 -8.198 4.176 -5.285 1.00 0.00 H new ATOM 0 HB3 LYS D 52 -6.641 4.760 -5.838 1.00 0.00 H new ATOM 0 HG2 LYS D 52 -7.486 6.549 -4.623 1.00 0.00 H new ATOM 0 HG3 LYS D 52 -7.818 7.001 -6.283 1.00 0.00 H new ATOM 0 HD2 LYS D 52 -10.161 6.171 -6.025 1.00 0.00 H new ATOM 0 HD3 LYS D 52 -9.822 5.765 -4.354 1.00 0.00 H new ATOM 0 HE2 LYS D 52 -9.659 8.539 -5.602 1.00 0.00 H new ATOM 0 HE3 LYS D 52 -10.898 7.973 -4.498 1.00 0.00 H new ATOM 0 HZ1 LYS D 52 -9.551 8.959 -3.003 1.00 0.00 H new ATOM 0 HZ2 LYS D 52 -8.737 7.469 -3.041 1.00 0.00 H new ATOM 0 HZ3 LYS D 52 -8.152 8.780 -3.948 1.00 0.00 H new ATOM 780 N ASN D 53 -6.847 3.166 -8.929 1.00 0.00 N ATOM 781 CA ASN D 53 -6.110 1.981 -9.328 1.00 0.00 C ATOM 782 C ASN D 53 -4.747 1.988 -8.677 1.00 0.00 C ATOM 783 O ASN D 53 -4.054 3.006 -8.679 1.00 0.00 O ATOM 784 CB ASN D 53 -5.980 1.876 -10.846 1.00 0.00 C ATOM 785 CG ASN D 53 -7.308 1.605 -11.529 1.00 0.00 C ATOM 786 OD1 ASN D 53 -7.356 1.410 -12.743 1.00 0.00 O ATOM 787 ND2 ASN D 53 -8.395 1.607 -10.767 1.00 0.00 N ATOM 0 H ASN D 53 -6.875 3.909 -9.627 1.00 0.00 H new ATOM 0 HA ASN D 53 -6.668 1.106 -8.993 1.00 0.00 H new ATOM 0 HB2 ASN D 53 -5.558 2.802 -11.236 1.00 0.00 H new ATOM 0 HB3 ASN D 53 -5.280 1.078 -11.092 1.00 0.00 H new ATOM 0 HD21 ASN D 53 -9.311 1.443 -11.185 1.00 0.00 H new ATOM 0 HD22 ASN D 53 -8.314 1.773 -9.764 1.00 0.00 H new ATOM 794 N TRP D 54 -4.443 0.910 -7.984 1.00 0.00 N ATOM 795 CA TRP D 54 -3.247 0.857 -7.171 1.00 0.00 C ATOM 796 C TRP D 54 -2.285 -0.224 -7.628 1.00 0.00 C ATOM 797 O TRP D 54 -2.698 -1.241 -8.186 1.00 0.00 O ATOM 798 CB TRP D 54 -3.611 0.600 -5.719 1.00 0.00 C ATOM 799 CG TRP D 54 -3.253 1.731 -4.838 1.00 0.00 C ATOM 800 CD1 TRP D 54 -3.920 2.899 -4.630 1.00 0.00 C ATOM 801 CD2 TRP D 54 -2.062 1.806 -4.106 1.00 0.00 C ATOM 802 NE1 TRP D 54 -3.199 3.694 -3.767 1.00 0.00 N ATOM 803 CE2 TRP D 54 -2.042 3.035 -3.439 1.00 0.00 C ATOM 804 CE3 TRP D 54 -1.010 0.926 -3.949 1.00 0.00 C ATOM 805 CZ2 TRP D 54 -0.982 3.402 -2.625 1.00 0.00 C ATOM 806 CZ3 TRP D 54 0.024 1.288 -3.150 1.00 0.00 C ATOM 807 CH2 TRP D 54 0.036 2.515 -2.497 1.00 0.00 C ATOM 0 H TRP D 54 -5.007 0.060 -7.968 1.00 0.00 H new ATOM 0 HA TRP D 54 -2.753 1.823 -7.277 1.00 0.00 H new ATOM 0 HB2 TRP D 54 -4.682 0.410 -5.644 1.00 0.00 H new ATOM 0 HB3 TRP D 54 -3.103 -0.300 -5.374 1.00 0.00 H new ATOM 0 HD1 TRP D 54 -4.869 3.162 -5.074 1.00 0.00 H new ATOM 0 HE1 TRP D 54 -3.478 4.615 -3.430 1.00 0.00 H new ATOM 0 HE3 TRP D 54 -1.011 -0.030 -4.452 1.00 0.00 H new ATOM 0 HZ2 TRP D 54 -0.967 4.354 -2.114 1.00 0.00 H new ATOM 0 HZ3 TRP D 54 0.854 0.610 -3.018 1.00 0.00 H new ATOM 0 HH2 TRP D 54 0.879 2.769 -1.871 1.00 0.00 H new ATOM 818 N GLY D 55 -1.007 -0.042 -7.304 1.00 0.00 N ATOM 819 CA GLY D 55 -0.035 -1.062 -7.616 1.00 0.00 C ATOM 820 C GLY D 55 1.113 -1.155 -6.626 1.00 0.00 C ATOM 821 O GLY D 55 1.393 -0.240 -5.854 1.00 0.00 O ATOM 0 H GLY D 55 -0.636 0.785 -6.837 1.00 0.00 H new ATOM 0 HA2 GLY D 55 -0.540 -2.027 -7.661 1.00 0.00 H new ATOM 0 HA3 GLY D 55 0.371 -0.869 -8.609 1.00 0.00 H new ATOM 825 N ILE D 56 1.765 -2.295 -6.694 1.00 0.00 N ATOM 826 CA ILE D 56 2.918 -2.666 -5.871 1.00 0.00 C ATOM 827 C ILE D 56 3.945 -3.286 -6.806 1.00 0.00 C ATOM 828 O ILE D 56 3.629 -4.251 -7.504 1.00 0.00 O ATOM 829 CB ILE D 56 2.483 -3.716 -4.824 1.00 0.00 C ATOM 830 CG1 ILE D 56 1.348 -3.173 -3.956 1.00 0.00 C ATOM 831 CG2 ILE D 56 3.650 -4.147 -3.958 1.00 0.00 C ATOM 832 CD1 ILE D 56 0.800 -4.195 -2.988 1.00 0.00 C ATOM 0 H ILE D 56 1.501 -3.029 -7.352 1.00 0.00 H new ATOM 0 HA ILE D 56 3.327 -1.799 -5.352 1.00 0.00 H new ATOM 0 HB ILE D 56 2.122 -4.592 -5.363 1.00 0.00 H new ATOM 0 HG12 ILE D 56 1.708 -2.309 -3.397 1.00 0.00 H new ATOM 0 HG13 ILE D 56 0.542 -2.823 -4.600 1.00 0.00 H new ATOM 0 HG21 ILE D 56 3.311 -4.886 -3.232 1.00 0.00 H new ATOM 0 HG22 ILE D 56 4.427 -4.585 -4.585 1.00 0.00 H new ATOM 0 HG23 ILE D 56 4.053 -3.281 -3.433 1.00 0.00 H new ATOM 0 HD11 ILE D 56 -0.002 -3.747 -2.402 1.00 0.00 H new ATOM 0 HD12 ILE D 56 0.411 -5.049 -3.542 1.00 0.00 H new ATOM 0 HD13 ILE D 56 1.595 -4.527 -2.321 1.00 0.00 H new ATOM 844 N PHE D 57 5.055 -2.600 -7.016 1.00 0.00 N ATOM 845 CA PHE D 57 5.947 -2.980 -8.104 1.00 0.00 C ATOM 846 C PHE D 57 7.260 -3.533 -7.584 1.00 0.00 C ATOM 847 O PHE D 57 8.081 -2.793 -7.050 1.00 0.00 O ATOM 848 CB PHE D 57 6.226 -1.791 -9.038 1.00 0.00 C ATOM 849 CG PHE D 57 4.987 -1.076 -9.508 1.00 0.00 C ATOM 850 CD1 PHE D 57 4.549 -1.209 -10.814 1.00 0.00 C ATOM 851 CD2 PHE D 57 4.264 -0.255 -8.650 1.00 0.00 C ATOM 852 CE1 PHE D 57 3.417 -0.546 -11.246 1.00 0.00 C ATOM 853 CE2 PHE D 57 3.142 0.396 -9.075 1.00 0.00 C ATOM 854 CZ PHE D 57 2.715 0.254 -10.369 1.00 0.00 C ATOM 0 H PHE D 57 5.358 -1.797 -6.465 1.00 0.00 H new ATOM 0 HA PHE D 57 5.438 -3.762 -8.667 1.00 0.00 H new ATOM 0 HB2 PHE D 57 6.869 -1.079 -8.521 1.00 0.00 H new ATOM 0 HB3 PHE D 57 6.779 -2.147 -9.907 1.00 0.00 H new ATOM 0 HD1 PHE D 57 5.097 -1.837 -11.501 1.00 0.00 H new ATOM 0 HD2 PHE D 57 4.596 -0.130 -7.630 1.00 0.00 H new ATOM 0 HE1 PHE D 57 3.083 -0.654 -12.267 1.00 0.00 H new ATOM 0 HE2 PHE D 57 2.590 1.024 -8.391 1.00 0.00 H new ATOM 0 HZ PHE D 57 1.827 0.770 -10.703 1.00 0.00 H new ATOM 864 N VAL D 58 7.492 -4.810 -7.840 1.00 0.00 N ATOM 865 CA VAL D 58 8.758 -5.439 -7.501 1.00 0.00 C ATOM 866 C VAL D 58 9.676 -5.449 -8.720 1.00 0.00 C ATOM 867 O VAL D 58 9.431 -6.185 -9.681 1.00 0.00 O ATOM 868 CB VAL D 58 8.558 -6.881 -6.994 1.00 0.00 C ATOM 869 CG1 VAL D 58 9.883 -7.505 -6.607 1.00 0.00 C ATOM 870 CG2 VAL D 58 7.594 -6.915 -5.821 1.00 0.00 C ATOM 0 H VAL D 58 6.817 -5.433 -8.283 1.00 0.00 H new ATOM 0 HA VAL D 58 9.213 -4.858 -6.699 1.00 0.00 H new ATOM 0 HB VAL D 58 8.128 -7.464 -7.808 1.00 0.00 H new ATOM 0 HG11 VAL D 58 9.716 -8.522 -6.252 1.00 0.00 H new ATOM 0 HG12 VAL D 58 10.542 -7.527 -7.475 1.00 0.00 H new ATOM 0 HG13 VAL D 58 10.345 -6.916 -5.815 1.00 0.00 H new ATOM 0 HG21 VAL D 58 7.470 -7.943 -5.482 1.00 0.00 H new ATOM 0 HG22 VAL D 58 7.991 -6.310 -5.006 1.00 0.00 H new ATOM 0 HG23 VAL D 58 6.628 -6.516 -6.132 1.00 0.00 H new ATOM 880 N ASN D 59 10.686 -4.578 -8.697 1.00 0.00 N ATOM 881 CA ASN D 59 11.613 -4.405 -9.821 1.00 0.00 C ATOM 882 C ASN D 59 10.864 -4.058 -11.104 1.00 0.00 C ATOM 883 O ASN D 59 11.073 -4.685 -12.143 1.00 0.00 O ATOM 884 CB ASN D 59 12.473 -5.656 -10.045 1.00 0.00 C ATOM 885 CG ASN D 59 13.373 -5.973 -8.868 1.00 0.00 C ATOM 886 OD1 ASN D 59 12.902 -6.276 -7.772 1.00 0.00 O ATOM 887 ND2 ASN D 59 14.678 -5.903 -9.087 1.00 0.00 N ATOM 0 H ASN D 59 10.886 -3.973 -7.901 1.00 0.00 H new ATOM 0 HA ASN D 59 12.273 -3.577 -9.562 1.00 0.00 H new ATOM 0 HB2 ASN D 59 11.822 -6.509 -10.237 1.00 0.00 H new ATOM 0 HB3 ASN D 59 13.085 -5.515 -10.936 1.00 0.00 H new ATOM 0 HD21 ASN D 59 15.333 -6.104 -8.332 1.00 0.00 H new ATOM 0 HD22 ASN D 59 15.027 -5.648 -10.011 1.00 0.00 H new ATOM 894 N GLY D 60 10.012 -3.043 -11.028 1.00 0.00 N ATOM 895 CA GLY D 60 9.261 -2.607 -12.186 1.00 0.00 C ATOM 896 C GLY D 60 8.268 -3.641 -12.664 1.00 0.00 C ATOM 897 O GLY D 60 8.167 -3.918 -13.860 1.00 0.00 O ATOM 0 H GLY D 60 9.828 -2.511 -10.177 1.00 0.00 H new ATOM 0 HA2 GLY D 60 8.731 -1.686 -11.944 1.00 0.00 H new ATOM 0 HA3 GLY D 60 9.953 -2.373 -12.995 1.00 0.00 H new ATOM 901 N GLU D 61 7.501 -4.175 -11.729 1.00 0.00 N ATOM 902 CA GLU D 61 6.464 -5.147 -12.047 1.00 0.00 C ATOM 903 C GLU D 61 5.324 -5.048 -11.043 1.00 0.00 C ATOM 904 O GLU D 61 5.511 -5.305 -9.854 1.00 0.00 O ATOM 905 CB GLU D 61 7.027 -6.572 -12.043 1.00 0.00 C ATOM 906 CG GLU D 61 5.997 -7.626 -12.419 1.00 0.00 C ATOM 907 CD GLU D 61 6.540 -9.032 -12.357 1.00 0.00 C ATOM 908 OE1 GLU D 61 5.783 -9.971 -12.661 1.00 0.00 O ATOM 909 OE2 GLU D 61 7.721 -9.200 -11.994 1.00 0.00 O1- ATOM 0 H GLU D 61 7.576 -3.951 -10.737 1.00 0.00 H new ATOM 0 HA GLU D 61 6.089 -4.923 -13.046 1.00 0.00 H new ATOM 0 HB2 GLU D 61 7.864 -6.627 -12.739 1.00 0.00 H new ATOM 0 HB3 GLU D 61 7.422 -6.797 -11.052 1.00 0.00 H new ATOM 0 HG2 GLU D 61 5.141 -7.544 -11.750 1.00 0.00 H new ATOM 0 HG3 GLU D 61 5.634 -7.427 -13.427 1.00 0.00 H new ATOM 916 N LYS D 62 4.144 -4.690 -11.526 1.00 0.00 N ATOM 917 CA LYS D 62 2.971 -4.579 -10.670 1.00 0.00 C ATOM 918 C LYS D 62 2.433 -5.966 -10.327 1.00 0.00 C ATOM 919 O LYS D 62 1.806 -6.624 -11.155 1.00 0.00 O ATOM 920 CB LYS D 62 1.907 -3.719 -11.365 1.00 0.00 C ATOM 921 CG LYS D 62 0.614 -3.556 -10.578 1.00 0.00 C ATOM 922 CD LYS D 62 -0.303 -2.525 -11.228 1.00 0.00 C ATOM 923 CE LYS D 62 -0.641 -2.880 -12.671 1.00 0.00 C ATOM 924 NZ LYS D 62 -1.367 -4.172 -12.781 1.00 0.00 N1+ ATOM 0 H LYS D 62 3.972 -4.471 -12.507 1.00 0.00 H new ATOM 0 HA LYS D 62 3.247 -4.093 -9.734 1.00 0.00 H new ATOM 0 HB2 LYS D 62 2.326 -2.732 -11.559 1.00 0.00 H new ATOM 0 HB3 LYS D 62 1.675 -4.163 -12.333 1.00 0.00 H new ATOM 0 HG2 LYS D 62 0.100 -4.515 -10.516 1.00 0.00 H new ATOM 0 HG3 LYS D 62 0.843 -3.250 -9.557 1.00 0.00 H new ATOM 0 HD2 LYS D 62 -1.224 -2.446 -10.650 1.00 0.00 H new ATOM 0 HD3 LYS D 62 0.176 -1.546 -11.200 1.00 0.00 H new ATOM 0 HE2 LYS D 62 -1.249 -2.086 -13.105 1.00 0.00 H new ATOM 0 HE3 LYS D 62 0.278 -2.932 -13.254 1.00 0.00 H new ATOM 0 HZ1 LYS D 62 -1.794 -4.251 -13.726 1.00 0.00 H new ATOM 0 HZ2 LYS D 62 -0.701 -4.958 -12.635 1.00 0.00 H new ATOM 0 HZ3 LYS D 62 -2.114 -4.213 -12.059 1.00 0.00 H new ATOM 938 N VAL D 63 2.771 -6.439 -9.133 1.00 0.00 N ATOM 939 CA VAL D 63 2.416 -7.788 -8.713 1.00 0.00 C ATOM 940 C VAL D 63 1.009 -7.853 -8.122 1.00 0.00 C ATOM 941 O VAL D 63 0.343 -8.887 -8.199 1.00 0.00 O ATOM 942 CB VAL D 63 3.431 -8.344 -7.702 1.00 0.00 C ATOM 943 CG1 VAL D 63 4.825 -8.371 -8.308 1.00 0.00 C ATOM 944 CG2 VAL D 63 3.430 -7.546 -6.404 1.00 0.00 C ATOM 0 H VAL D 63 3.292 -5.906 -8.437 1.00 0.00 H new ATOM 0 HA VAL D 63 2.436 -8.407 -9.610 1.00 0.00 H new ATOM 0 HB VAL D 63 3.130 -9.364 -7.462 1.00 0.00 H new ATOM 0 HG11 VAL D 63 5.531 -8.767 -7.579 1.00 0.00 H new ATOM 0 HG12 VAL D 63 4.824 -9.005 -9.194 1.00 0.00 H new ATOM 0 HG13 VAL D 63 5.120 -7.359 -8.586 1.00 0.00 H new ATOM 0 HG21 VAL D 63 4.161 -7.970 -5.715 1.00 0.00 H new ATOM 0 HG22 VAL D 63 3.690 -6.509 -6.615 1.00 0.00 H new ATOM 0 HG23 VAL D 63 2.439 -7.587 -5.952 1.00 0.00 H new ATOM 954 N TYR D 64 0.542 -6.744 -7.560 1.00 0.00 N ATOM 955 CA TYR D 64 -0.802 -6.695 -7.000 1.00 0.00 C ATOM 956 C TYR D 64 -1.490 -5.396 -7.388 1.00 0.00 C ATOM 957 O TYR D 64 -0.929 -4.309 -7.217 1.00 0.00 O ATOM 958 CB TYR D 64 -0.772 -6.842 -5.473 1.00 0.00 C ATOM 959 CG TYR D 64 -2.154 -6.897 -4.844 1.00 0.00 C ATOM 960 CD1 TYR D 64 -2.445 -6.197 -3.679 1.00 0.00 C ATOM 961 CD2 TYR D 64 -3.173 -7.647 -5.423 1.00 0.00 C ATOM 962 CE1 TYR D 64 -3.704 -6.243 -3.114 1.00 0.00 C ATOM 963 CE2 TYR D 64 -4.434 -7.696 -4.861 1.00 0.00 C ATOM 964 CZ TYR D 64 -4.694 -6.991 -3.708 1.00 0.00 C ATOM 965 OH TYR D 64 -5.950 -7.031 -3.147 1.00 0.00 O ATOM 0 H TYR D 64 1.069 -5.874 -7.481 1.00 0.00 H new ATOM 0 HA TYR D 64 -1.367 -7.532 -7.410 1.00 0.00 H new ATOM 0 HB2 TYR D 64 -0.227 -7.749 -5.214 1.00 0.00 H new ATOM 0 HB3 TYR D 64 -0.220 -6.005 -5.046 1.00 0.00 H new ATOM 0 HD1 TYR D 64 -1.673 -5.607 -3.208 1.00 0.00 H new ATOM 0 HD2 TYR D 64 -2.974 -8.201 -6.329 1.00 0.00 H new ATOM 0 HE1 TYR D 64 -3.911 -5.693 -2.208 1.00 0.00 H new ATOM 0 HE2 TYR D 64 -5.212 -8.285 -5.324 1.00 0.00 H new ATOM 0 HH TYR D 64 -6.532 -7.603 -3.689 1.00 0.00 H new ATOM 975 N THR D 65 -2.718 -5.516 -7.874 1.00 0.00 N ATOM 976 CA THR D 65 -3.512 -4.359 -8.242 1.00 0.00 C ATOM 977 C THR D 65 -4.769 -4.298 -7.385 1.00 0.00 C ATOM 978 O THR D 65 -5.742 -5.009 -7.646 1.00 0.00 O ATOM 979 CB THR D 65 -3.897 -4.419 -9.701 1.00 0.00 C ATOM 980 OG1 THR D 65 -2.768 -4.688 -10.515 1.00 0.00 O ATOM 981 CG2 THR D 65 -4.544 -3.145 -10.215 1.00 0.00 C ATOM 0 H THR D 65 -3.185 -6.410 -8.022 1.00 0.00 H new ATOM 0 HA THR D 65 -2.913 -3.464 -8.074 1.00 0.00 H new ATOM 0 HB THR D 65 -4.628 -5.225 -9.764 1.00 0.00 H new ATOM 0 HG1 THR D 65 -2.912 -5.522 -11.009 1.00 0.00 H new ATOM 0 HG21 THR D 65 -4.793 -3.263 -11.270 1.00 0.00 H new ATOM 0 HG22 THR D 65 -5.453 -2.944 -9.648 1.00 0.00 H new ATOM 0 HG23 THR D 65 -3.851 -2.312 -10.097 1.00 0.00 H new ATOM 989 N PHE D 66 -4.784 -3.397 -6.419 1.00 0.00 N ATOM 990 CA PHE D 66 -5.973 -3.192 -5.607 1.00 0.00 C ATOM 991 C PHE D 66 -6.509 -1.803 -5.868 1.00 0.00 C ATOM 992 O PHE D 66 -5.832 -0.985 -6.469 1.00 0.00 O ATOM 993 CB PHE D 66 -5.686 -3.437 -4.117 1.00 0.00 C ATOM 994 CG PHE D 66 -4.709 -2.500 -3.440 1.00 0.00 C ATOM 995 CD1 PHE D 66 -3.435 -2.933 -3.105 1.00 0.00 C ATOM 996 CD2 PHE D 66 -5.090 -1.219 -3.067 1.00 0.00 C ATOM 997 CE1 PHE D 66 -2.559 -2.108 -2.425 1.00 0.00 C ATOM 998 CE2 PHE D 66 -4.213 -0.387 -2.393 1.00 0.00 C ATOM 999 CZ PHE D 66 -2.946 -0.834 -2.069 1.00 0.00 C ATOM 0 H PHE D 66 -3.994 -2.799 -6.178 1.00 0.00 H new ATOM 0 HA PHE D 66 -6.736 -3.918 -5.887 1.00 0.00 H new ATOM 0 HB2 PHE D 66 -6.632 -3.387 -3.578 1.00 0.00 H new ATOM 0 HB3 PHE D 66 -5.310 -4.454 -4.008 1.00 0.00 H new ATOM 0 HD1 PHE D 66 -3.123 -3.930 -3.380 1.00 0.00 H new ATOM 0 HD2 PHE D 66 -6.083 -0.867 -3.305 1.00 0.00 H new ATOM 0 HE1 PHE D 66 -1.570 -2.462 -2.172 1.00 0.00 H new ATOM 0 HE2 PHE D 66 -4.519 0.612 -2.120 1.00 0.00 H new ATOM 0 HZ PHE D 66 -2.262 -0.188 -1.539 1.00 0.00 H new ATOM 1009 N ASN D 67 -7.730 -1.544 -5.472 1.00 0.00 N ATOM 1010 CA ASN D 67 -8.330 -0.245 -5.719 1.00 0.00 C ATOM 1011 C ASN D 67 -8.931 0.262 -4.437 1.00 0.00 C ATOM 1012 O ASN D 67 -9.408 -0.535 -3.650 1.00 0.00 O ATOM 1013 CB ASN D 67 -9.416 -0.341 -6.795 1.00 0.00 C ATOM 1014 CG ASN D 67 -8.887 -0.864 -8.111 1.00 0.00 C ATOM 1015 OD1 ASN D 67 -7.984 -0.284 -8.705 1.00 0.00 O ATOM 1016 ND2 ASN D 67 -9.454 -1.962 -8.579 1.00 0.00 N ATOM 0 H ASN D 67 -8.329 -2.207 -4.980 1.00 0.00 H new ATOM 0 HA ASN D 67 -7.561 0.441 -6.073 1.00 0.00 H new ATOM 0 HB2 ASN D 67 -10.214 -0.995 -6.443 1.00 0.00 H new ATOM 0 HB3 ASN D 67 -9.856 0.644 -6.950 1.00 0.00 H new ATOM 0 HD21 ASN D 67 -9.143 -2.358 -9.466 1.00 0.00 H new ATOM 0 HD22 ASN D 67 -10.202 -2.413 -8.053 1.00 0.00 H new ATOM 1023 N GLU D 68 -9.015 1.574 -4.264 1.00 0.00 N ATOM 1024 CA GLU D 68 -9.703 2.105 -3.095 1.00 0.00 C ATOM 1025 C GLU D 68 -11.193 1.827 -3.205 1.00 0.00 C ATOM 1026 O GLU D 68 -11.891 1.742 -2.197 1.00 0.00 O ATOM 1027 CB GLU D 68 -9.440 3.603 -2.905 1.00 0.00 C ATOM 1028 CG GLU D 68 -7.972 3.955 -2.679 1.00 0.00 C ATOM 1029 CD GLU D 68 -7.769 5.393 -2.252 1.00 0.00 C ATOM 1030 OE1 GLU D 68 -6.606 5.798 -2.072 1.00 0.00 O ATOM 1031 OE2 GLU D 68 -8.771 6.123 -2.111 1.00 0.00 O1- ATOM 0 H GLU D 68 -8.628 2.273 -4.898 1.00 0.00 H new ATOM 0 HA GLU D 68 -9.308 1.600 -2.213 1.00 0.00 H new ATOM 0 HB2 GLU D 68 -9.800 4.138 -3.784 1.00 0.00 H new ATOM 0 HB3 GLU D 68 -10.023 3.958 -2.055 1.00 0.00 H new ATOM 0 HG2 GLU D 68 -7.558 3.294 -1.918 1.00 0.00 H new ATOM 0 HG3 GLU D 68 -7.414 3.772 -3.598 1.00 0.00 H new ATOM 1038 N LYS D 69 -11.641 1.546 -4.432 1.00 0.00 N ATOM 1039 CA LYS D 69 -13.011 1.104 -4.669 1.00 0.00 C ATOM 1040 C LYS D 69 -13.217 -0.193 -3.930 1.00 0.00 C ATOM 1041 O LYS D 69 -14.172 -0.357 -3.170 1.00 0.00 O ATOM 1042 CB LYS D 69 -13.236 0.835 -6.143 1.00 0.00 C ATOM 1043 CG LYS D 69 -12.850 1.984 -7.034 1.00 0.00 C ATOM 1044 CD LYS D 69 -13.180 1.680 -8.487 1.00 0.00 C ATOM 1045 CE LYS D 69 -12.485 0.416 -8.982 1.00 0.00 C ATOM 1046 NZ LYS D 69 -12.776 0.145 -10.416 1.00 0.00 N1+ ATOM 0 H LYS D 69 -11.071 1.618 -5.275 1.00 0.00 H new ATOM 0 HA LYS D 69 -13.700 1.879 -4.332 1.00 0.00 H new ATOM 0 HB2 LYS D 69 -12.664 -0.046 -6.434 1.00 0.00 H new ATOM 0 HB3 LYS D 69 -14.288 0.600 -6.304 1.00 0.00 H new ATOM 0 HG2 LYS D 69 -13.375 2.886 -6.719 1.00 0.00 H new ATOM 0 HG3 LYS D 69 -11.783 2.185 -6.934 1.00 0.00 H new ATOM 0 HD2 LYS D 69 -14.258 1.567 -8.597 1.00 0.00 H new ATOM 0 HD3 LYS D 69 -12.883 2.524 -9.110 1.00 0.00 H new ATOM 0 HE2 LYS D 69 -11.409 0.516 -8.843 1.00 0.00 H new ATOM 0 HE3 LYS D 69 -12.806 -0.434 -8.380 1.00 0.00 H new ATOM 0 HZ1 LYS D 69 -12.285 -0.722 -10.712 1.00 0.00 H new ATOM 0 HZ2 LYS D 69 -13.801 0.024 -10.545 1.00 0.00 H new ATOM 0 HZ3 LYS D 69 -12.446 0.944 -10.994 1.00 0.00 H new ATOM 1060 N SER D 70 -12.196 -1.033 -4.034 1.00 0.00 N ATOM 1061 CA SER D 70 -12.121 -2.225 -3.242 1.00 0.00 C ATOM 1062 C SER D 70 -11.919 -1.800 -1.801 1.00 0.00 C ATOM 1063 O SER D 70 -11.039 -0.999 -1.503 1.00 0.00 O ATOM 1064 CB SER D 70 -10.975 -3.121 -3.714 1.00 0.00 C ATOM 1065 OG SER D 70 -10.969 -4.357 -3.018 1.00 0.00 O ATOM 0 H SER D 70 -11.409 -0.898 -4.668 1.00 0.00 H new ATOM 0 HA SER D 70 -13.038 -2.806 -3.341 1.00 0.00 H new ATOM 0 HB2 SER D 70 -11.070 -3.304 -4.784 1.00 0.00 H new ATOM 0 HB3 SER D 70 -10.024 -2.610 -3.561 1.00 0.00 H new ATOM 0 HG SER D 70 -10.228 -4.911 -3.341 1.00 0.00 H new ATOM 1071 N THR D 71 -12.779 -2.264 -0.929 1.00 0.00 N ATOM 1072 CA THR D 71 -12.728 -1.868 0.453 1.00 0.00 C ATOM 1073 C THR D 71 -11.369 -2.219 1.038 1.00 0.00 C ATOM 1074 O THR D 71 -10.977 -3.386 0.998 1.00 0.00 O ATOM 1075 CB THR D 71 -13.828 -2.587 1.192 1.00 0.00 C ATOM 1076 OG1 THR D 71 -13.682 -3.988 1.065 1.00 0.00 O ATOM 1077 CG2 THR D 71 -15.214 -2.223 0.696 1.00 0.00 C ATOM 0 H THR D 71 -13.526 -2.920 -1.155 1.00 0.00 H new ATOM 0 HA THR D 71 -12.869 -0.791 0.547 1.00 0.00 H new ATOM 0 HB THR D 71 -13.735 -2.273 2.232 1.00 0.00 H new ATOM 0 HG1 THR D 71 -13.826 -4.412 1.937 1.00 0.00 H new ATOM 0 HG21 THR D 71 -15.961 -2.773 1.268 1.00 0.00 H new ATOM 0 HG22 THR D 71 -15.376 -1.153 0.823 1.00 0.00 H new ATOM 0 HG23 THR D 71 -15.302 -2.481 -0.359 1.00 0.00 H new ATOM 1085 N VAL D 72 -10.594 -1.205 1.454 1.00 0.00 N ATOM 1086 CA VAL D 72 -9.232 -1.420 1.900 1.00 0.00 C ATOM 1087 C VAL D 72 -9.157 -2.518 2.955 1.00 0.00 C ATOM 1088 O VAL D 72 -8.144 -3.200 3.078 1.00 0.00 O ATOM 1089 CB VAL D 72 -8.526 -0.128 2.396 1.00 0.00 C ATOM 1090 CG1 VAL D 72 -7.252 0.061 1.594 1.00 0.00 C ATOM 1091 CG2 VAL D 72 -9.416 1.106 2.237 1.00 0.00 C ATOM 0 H VAL D 72 -10.899 -0.232 1.486 1.00 0.00 H new ATOM 0 HA VAL D 72 -8.684 -1.746 1.016 1.00 0.00 H new ATOM 0 HB VAL D 72 -8.307 -0.239 3.458 1.00 0.00 H new ATOM 0 HG11 VAL D 72 -6.742 0.964 1.929 1.00 0.00 H new ATOM 0 HG12 VAL D 72 -6.599 -0.799 1.740 1.00 0.00 H new ATOM 0 HG13 VAL D 72 -7.498 0.154 0.536 1.00 0.00 H new ATOM 0 HG21 VAL D 72 -8.884 1.987 2.596 1.00 0.00 H new ATOM 0 HG22 VAL D 72 -9.670 1.239 1.185 1.00 0.00 H new ATOM 0 HG23 VAL D 72 -10.329 0.973 2.817 1.00 0.00 H new ATOM 1101 N GLY D 73 -10.293 -2.785 3.591 1.00 0.00 N ATOM 1102 CA GLY D 73 -10.406 -3.903 4.494 1.00 0.00 C ATOM 1103 C GLY D 73 -10.216 -5.236 3.812 1.00 0.00 C ATOM 1104 O GLY D 73 -9.298 -5.986 4.137 1.00 0.00 O ATOM 0 H GLY D 73 -11.146 -2.235 3.491 1.00 0.00 H new ATOM 0 HA2 GLY D 73 -9.665 -3.798 5.287 1.00 0.00 H new ATOM 0 HA3 GLY D 73 -11.387 -3.881 4.969 1.00 0.00 H new ATOM 1108 N ASN D 74 -11.074 -5.518 2.840 1.00 0.00 N ATOM 1109 CA ASN D 74 -10.981 -6.763 2.080 1.00 0.00 C ATOM 1110 C ASN D 74 -9.716 -6.793 1.243 1.00 0.00 C ATOM 1111 O ASN D 74 -9.218 -7.863 0.907 1.00 0.00 O ATOM 1112 CB ASN D 74 -12.207 -6.963 1.182 1.00 0.00 C ATOM 1113 CG ASN D 74 -13.487 -7.169 1.969 1.00 0.00 C ATOM 1114 OD1 ASN D 74 -13.847 -6.351 2.819 1.00 0.00 O ATOM 1115 ND2 ASN D 74 -14.201 -8.248 1.675 1.00 0.00 N ATOM 0 H ASN D 74 -11.840 -4.906 2.558 1.00 0.00 H new ATOM 0 HA ASN D 74 -10.946 -7.581 2.800 1.00 0.00 H new ATOM 0 HB2 ASN D 74 -12.321 -6.095 0.533 1.00 0.00 H new ATOM 0 HB3 ASN D 74 -12.041 -7.825 0.536 1.00 0.00 H new ATOM 0 HD21 ASN D 74 -15.082 -8.424 2.159 1.00 0.00 H new ATOM 0 HD22 ASN D 74 -13.869 -8.901 0.965 1.00 0.00 H new ATOM 1122 N ILE D 75 -9.135 -5.623 1.020 1.00 0.00 N ATOM 1123 CA ILE D 75 -7.844 -5.543 0.345 1.00 0.00 C ATOM 1124 C ILE D 75 -6.744 -6.049 1.264 1.00 0.00 C ATOM 1125 O ILE D 75 -5.836 -6.735 0.824 1.00 0.00 O ATOM 1126 CB ILE D 75 -7.486 -4.110 -0.078 1.00 0.00 C ATOM 1127 CG1 ILE D 75 -8.518 -3.505 -1.040 1.00 0.00 C ATOM 1128 CG2 ILE D 75 -6.101 -4.069 -0.704 1.00 0.00 C ATOM 1129 CD1 ILE D 75 -8.220 -2.061 -1.366 1.00 0.00 C ATOM 0 H ILE D 75 -9.531 -4.723 1.293 1.00 0.00 H new ATOM 0 HA ILE D 75 -7.925 -6.159 -0.550 1.00 0.00 H new ATOM 0 HB ILE D 75 -7.493 -3.503 0.827 1.00 0.00 H new ATOM 0 HG12 ILE D 75 -8.537 -4.087 -1.962 1.00 0.00 H new ATOM 0 HG13 ILE D 75 -9.511 -3.578 -0.597 1.00 0.00 H new ATOM 0 HG21 ILE D 75 -5.864 -3.046 -0.997 1.00 0.00 H new ATOM 0 HG22 ILE D 75 -5.364 -4.419 0.019 1.00 0.00 H new ATOM 0 HG23 ILE D 75 -6.080 -4.713 -1.583 1.00 0.00 H new ATOM 0 HD11 ILE D 75 -8.978 -1.678 -2.050 1.00 0.00 H new ATOM 0 HD12 ILE D 75 -8.228 -1.472 -0.449 1.00 0.00 H new ATOM 0 HD13 ILE D 75 -7.239 -1.989 -1.835 1.00 0.00 H new ATOM 1141 N SER D 76 -6.799 -5.667 2.536 1.00 0.00 N ATOM 1142 CA SER D 76 -5.758 -6.056 3.481 1.00 0.00 C ATOM 1143 C SER D 76 -5.886 -7.519 3.859 1.00 0.00 C ATOM 1144 O SER D 76 -4.878 -8.189 4.086 1.00 0.00 O ATOM 1145 CB SER D 76 -5.783 -5.165 4.724 1.00 0.00 C ATOM 1146 OG SER D 76 -4.786 -5.550 5.656 1.00 0.00 O ATOM 0 H SER D 76 -7.544 -5.095 2.933 1.00 0.00 H new ATOM 0 HA SER D 76 -4.794 -5.919 2.991 1.00 0.00 H new ATOM 0 HB2 SER D 76 -5.629 -4.126 4.432 1.00 0.00 H new ATOM 0 HB3 SER D 76 -6.765 -5.222 5.195 1.00 0.00 H new ATOM 0 HG SER D 76 -4.825 -4.962 6.439 1.00 0.00 H new ATOM 1152 N ASN D 77 -7.086 -8.065 3.698 1.00 0.00 N ATOM 1153 CA ASN D 77 -7.249 -9.506 3.788 1.00 0.00 C ATOM 1154 C ASN D 77 -6.467 -10.159 2.660 1.00 0.00 C ATOM 1155 O ASN D 77 -5.923 -11.247 2.826 1.00 0.00 O ATOM 1156 CB ASN D 77 -8.722 -9.918 3.721 1.00 0.00 C ATOM 1157 CG ASN D 77 -9.511 -9.446 4.926 1.00 0.00 C ATOM 1158 OD1 ASN D 77 -9.157 -9.746 6.066 1.00 0.00 O ATOM 1159 ND2 ASN D 77 -10.598 -8.729 4.686 1.00 0.00 N ATOM 0 H ASN D 77 -7.942 -7.543 3.509 1.00 0.00 H new ATOM 0 HA ASN D 77 -6.867 -9.840 4.753 1.00 0.00 H new ATOM 0 HB2 ASN D 77 -9.169 -9.510 2.815 1.00 0.00 H new ATOM 0 HB3 ASN D 77 -8.790 -11.003 3.649 1.00 0.00 H new ATOM 0 HD21 ASN D 77 -11.176 -8.404 5.461 1.00 0.00 H new ATOM 0 HD22 ASN D 77 -10.857 -8.501 3.726 1.00 0.00 H new ATOM 1166 N ASP D 78 -6.301 -9.411 1.565 1.00 0.00 N ATOM 1167 CA ASP D 78 -5.453 -9.835 0.455 1.00 0.00 C ATOM 1168 C ASP D 78 -3.990 -9.501 0.698 1.00 0.00 C ATOM 1169 O ASP D 78 -3.107 -10.223 0.250 1.00 0.00 O ATOM 1170 CB ASP D 78 -5.899 -9.194 -0.864 1.00 0.00 C ATOM 1171 CG ASP D 78 -7.223 -9.723 -1.356 1.00 0.00 C ATOM 1172 OD1 ASP D 78 -7.331 -10.945 -1.570 1.00 0.00 O ATOM 1173 OD2 ASP D 78 -8.148 -8.918 -1.552 1.00 0.00 O1- ATOM 0 H ASP D 78 -6.747 -8.504 1.427 1.00 0.00 H new ATOM 0 HA ASP D 78 -5.559 -10.918 0.385 1.00 0.00 H new ATOM 0 HB2 ASP D 78 -5.972 -8.115 -0.731 1.00 0.00 H new ATOM 0 HB3 ASP D 78 -5.138 -9.371 -1.624 1.00 0.00 H new ATOM 1178 N ILE D 79 -3.718 -8.374 1.328 1.00 0.00 N ATOM 1179 CA ILE D 79 -2.339 -7.950 1.507 1.00 0.00 C ATOM 1180 C ILE D 79 -1.608 -8.908 2.451 1.00 0.00 C ATOM 1181 O ILE D 79 -0.379 -8.996 2.440 1.00 0.00 O ATOM 1182 CB ILE D 79 -2.235 -6.487 2.013 1.00 0.00 C ATOM 1183 CG1 ILE D 79 -3.145 -5.590 1.185 1.00 0.00 C ATOM 1184 CG2 ILE D 79 -0.807 -5.988 1.872 1.00 0.00 C ATOM 1185 CD1 ILE D 79 -3.151 -4.146 1.629 1.00 0.00 C ATOM 0 H ILE D 79 -4.418 -7.744 1.719 1.00 0.00 H new ATOM 0 HA ILE D 79 -1.857 -7.980 0.530 1.00 0.00 H new ATOM 0 HB ILE D 79 -2.535 -6.459 3.061 1.00 0.00 H new ATOM 0 HG12 ILE D 79 -2.834 -5.638 0.141 1.00 0.00 H new ATOM 0 HG13 ILE D 79 -4.162 -5.979 1.232 1.00 0.00 H new ATOM 0 HG21 ILE D 79 -0.744 -4.960 2.230 1.00 0.00 H new ATOM 0 HG22 ILE D 79 -0.141 -6.619 2.461 1.00 0.00 H new ATOM 0 HG23 ILE D 79 -0.510 -6.026 0.824 1.00 0.00 H new ATOM 0 HD11 ILE D 79 -3.822 -3.572 0.991 1.00 0.00 H new ATOM 0 HD12 ILE D 79 -3.492 -4.085 2.662 1.00 0.00 H new ATOM 0 HD13 ILE D 79 -2.143 -3.738 1.555 1.00 0.00 H new ATOM 1197 N ASN D 80 -2.384 -9.708 3.177 1.00 0.00 N ATOM 1198 CA ASN D 80 -1.838 -10.752 4.021 1.00 0.00 C ATOM 1199 C ASN D 80 -1.246 -11.880 3.185 1.00 0.00 C ATOM 1200 O ASN D 80 -0.108 -12.287 3.414 1.00 0.00 O ATOM 1201 CB ASN D 80 -2.921 -11.302 4.950 1.00 0.00 C ATOM 1202 CG ASN D 80 -3.361 -10.310 6.011 1.00 0.00 C ATOM 1203 OD1 ASN D 80 -4.223 -10.613 6.836 1.00 0.00 O ATOM 1204 ND2 ASN D 80 -2.768 -9.125 6.008 1.00 0.00 N ATOM 0 H ASN D 80 -3.402 -9.647 3.193 1.00 0.00 H new ATOM 0 HA ASN D 80 -1.039 -10.317 4.621 1.00 0.00 H new ATOM 0 HB2 ASN D 80 -3.786 -11.595 4.355 1.00 0.00 H new ATOM 0 HB3 ASN D 80 -2.549 -12.203 5.437 1.00 0.00 H new ATOM 0 HD21 ASN D 80 -3.022 -8.426 6.706 1.00 0.00 H new ATOM 0 HD22 ASN D 80 -2.058 -8.912 5.307 1.00 0.00 H new ATOM 1211 N LYS D 81 -2.001 -12.365 2.196 1.00 0.00 N ATOM 1212 CA LYS D 81 -1.501 -13.420 1.326 1.00 0.00 C ATOM 1213 C LYS D 81 -0.385 -12.918 0.418 1.00 0.00 C ATOM 1214 O LYS D 81 0.667 -13.544 0.330 1.00 0.00 O ATOM 1215 CB LYS D 81 -2.605 -14.083 0.494 1.00 0.00 C ATOM 1216 CG LYS D 81 -3.571 -13.126 -0.169 1.00 0.00 C ATOM 1217 CD LYS D 81 -4.781 -12.894 0.711 1.00 0.00 C ATOM 1218 CE LYS D 81 -5.555 -14.180 0.963 1.00 0.00 C ATOM 1219 NZ LYS D 81 -6.720 -13.956 1.860 1.00 0.00 N1+ ATOM 0 H LYS D 81 -2.946 -12.047 1.983 1.00 0.00 H new ATOM 0 HA LYS D 81 -1.095 -14.183 1.990 1.00 0.00 H new ATOM 0 HB2 LYS D 81 -2.139 -14.696 -0.277 1.00 0.00 H new ATOM 0 HB3 LYS D 81 -3.170 -14.756 1.139 1.00 0.00 H new ATOM 0 HG2 LYS D 81 -3.072 -12.177 -0.368 1.00 0.00 H new ATOM 0 HG3 LYS D 81 -3.887 -13.528 -1.132 1.00 0.00 H new ATOM 0 HD2 LYS D 81 -4.461 -12.470 1.663 1.00 0.00 H new ATOM 0 HD3 LYS D 81 -5.437 -12.162 0.240 1.00 0.00 H new ATOM 0 HE2 LYS D 81 -5.901 -14.588 0.013 1.00 0.00 H new ATOM 0 HE3 LYS D 81 -4.892 -14.922 1.407 1.00 0.00 H new ATOM 0 HZ1 LYS D 81 -6.736 -14.689 2.598 1.00 0.00 H new ATOM 0 HZ2 LYS D 81 -6.641 -13.019 2.304 1.00 0.00 H new ATOM 0 HZ3 LYS D 81 -7.599 -14.003 1.306 1.00 0.00 H new ATOM 1233 N LEU D 82 -0.602 -11.772 -0.227 1.00 0.00 N ATOM 1234 CA LEU D 82 0.401 -11.167 -1.094 1.00 0.00 C ATOM 1235 C LEU D 82 1.738 -10.967 -0.380 1.00 0.00 C ATOM 1236 O LEU D 82 2.786 -10.970 -1.028 1.00 0.00 O ATOM 1237 CB LEU D 82 -0.120 -9.852 -1.628 1.00 0.00 C ATOM 1238 CG LEU D 82 -1.102 -9.973 -2.795 1.00 0.00 C ATOM 1239 CD1 LEU D 82 -0.383 -10.417 -4.058 1.00 0.00 C ATOM 1240 CD2 LEU D 82 -2.245 -10.929 -2.508 1.00 0.00 C ATOM 0 H LEU D 82 -1.472 -11.243 -0.162 1.00 0.00 H new ATOM 0 HA LEU D 82 0.586 -11.851 -1.922 1.00 0.00 H new ATOM 0 HB2 LEU D 82 -0.609 -9.315 -0.815 1.00 0.00 H new ATOM 0 HB3 LEU D 82 0.727 -9.245 -1.947 1.00 0.00 H new ATOM 0 HG LEU D 82 -1.528 -8.980 -2.937 1.00 0.00 H new ATOM 0 HD11 LEU D 82 -1.099 -10.497 -4.876 1.00 0.00 H new ATOM 0 HD12 LEU D 82 0.383 -9.686 -4.317 1.00 0.00 H new ATOM 0 HD13 LEU D 82 0.084 -11.387 -3.889 1.00 0.00 H new ATOM 0 HD21 LEU D 82 -2.908 -10.973 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU D 82 -1.846 -11.923 -2.306 1.00 0.00 H new ATOM 0 HD23 LEU D 82 -2.803 -10.579 -1.640 1.00 0.00 H new ATOM 1252 N ASN D 83 1.681 -10.880 0.960 1.00 0.00 N ATOM 1253 CA ASN D 83 2.868 -10.772 1.829 1.00 0.00 C ATOM 1254 C ASN D 83 3.928 -9.864 1.205 1.00 0.00 C ATOM 1255 O ASN D 83 4.935 -10.339 0.679 1.00 0.00 O ATOM 1256 CB ASN D 83 3.456 -12.165 2.092 1.00 0.00 C ATOM 1257 CG ASN D 83 4.543 -12.176 3.158 1.00 0.00 C ATOM 1258 OD1 ASN D 83 5.167 -13.205 3.401 1.00 0.00 O ATOM 1259 ND2 ASN D 83 4.755 -11.048 3.825 1.00 0.00 N ATOM 0 H ASN D 83 0.801 -10.883 1.476 1.00 0.00 H new ATOM 0 HA ASN D 83 2.557 -10.329 2.775 1.00 0.00 H new ATOM 0 HB2 ASN D 83 2.654 -12.837 2.396 1.00 0.00 H new ATOM 0 HB3 ASN D 83 3.867 -12.558 1.162 1.00 0.00 H new ATOM 0 HD21 ASN D 83 5.455 -11.018 4.566 1.00 0.00 H new ATOM 0 HD22 ASN D 83 4.218 -10.212 3.596 1.00 0.00 H new ATOM 1266 N ILE D 84 3.627 -8.579 1.146 1.00 0.00 N ATOM 1267 CA ILE D 84 4.477 -7.631 0.444 1.00 0.00 C ATOM 1268 C ILE D 84 5.752 -7.304 1.231 1.00 0.00 C ATOM 1269 O ILE D 84 5.755 -6.408 2.074 1.00 0.00 O ATOM 1270 CB ILE D 84 3.695 -6.335 0.137 1.00 0.00 C ATOM 1271 CG1 ILE D 84 2.424 -6.658 -0.654 1.00 0.00 C ATOM 1272 CG2 ILE D 84 4.549 -5.349 -0.640 1.00 0.00 C ATOM 1273 CD1 ILE D 84 2.698 -7.328 -1.984 1.00 0.00 C ATOM 0 H ILE D 84 2.799 -8.166 1.576 1.00 0.00 H new ATOM 0 HA ILE D 84 4.782 -8.101 -0.491 1.00 0.00 H new ATOM 0 HB ILE D 84 3.421 -5.876 1.087 1.00 0.00 H new ATOM 0 HG12 ILE D 84 1.786 -7.306 -0.053 1.00 0.00 H new ATOM 0 HG13 ILE D 84 1.869 -5.736 -0.827 1.00 0.00 H new ATOM 0 HG21 ILE D 84 3.971 -4.447 -0.841 1.00 0.00 H new ATOM 0 HG22 ILE D 84 5.432 -5.092 -0.054 1.00 0.00 H new ATOM 0 HG23 ILE D 84 4.858 -5.800 -1.583 1.00 0.00 H new ATOM 0 HD11 ILE D 84 1.754 -7.529 -2.492 1.00 0.00 H new ATOM 0 HD12 ILE D 84 3.311 -6.672 -2.603 1.00 0.00 H new ATOM 0 HD13 ILE D 84 3.227 -8.266 -1.817 1.00 0.00 H new ATOM 1285 N LYS D 85 6.864 -7.950 0.867 1.00 0.00 N ATOM 1286 CA LYS D 85 8.159 -7.618 1.463 1.00 0.00 C ATOM 1287 C LYS D 85 9.358 -8.039 0.604 1.00 0.00 C ATOM 1288 O LYS D 85 9.952 -9.096 0.797 1.00 0.00 O ATOM 1289 CB LYS D 85 8.263 -8.152 2.910 1.00 0.00 C ATOM 1290 CG LYS D 85 7.596 -9.508 3.232 1.00 0.00 C ATOM 1291 CD LYS D 85 8.281 -10.746 2.642 1.00 0.00 C ATOM 1292 CE LYS D 85 7.924 -11.000 1.183 1.00 0.00 C ATOM 1293 NZ LYS D 85 8.573 -12.236 0.662 1.00 0.00 N1+ ATOM 0 H LYS D 85 6.893 -8.696 0.172 1.00 0.00 H new ATOM 0 HA LYS D 85 8.205 -6.530 1.503 1.00 0.00 H new ATOM 0 HB2 LYS D 85 9.321 -8.232 3.161 1.00 0.00 H new ATOM 0 HB3 LYS D 85 7.833 -7.402 3.574 1.00 0.00 H new ATOM 0 HG2 LYS D 85 7.553 -9.622 4.315 1.00 0.00 H new ATOM 0 HG3 LYS D 85 6.567 -9.480 2.873 1.00 0.00 H new ATOM 0 HD2 LYS D 85 9.361 -10.630 2.729 1.00 0.00 H new ATOM 0 HD3 LYS D 85 8.006 -11.620 3.233 1.00 0.00 H new ATOM 0 HE2 LYS D 85 6.842 -11.088 1.083 1.00 0.00 H new ATOM 0 HE3 LYS D 85 8.231 -10.146 0.580 1.00 0.00 H new ATOM 0 HZ1 LYS D 85 8.306 -12.375 -0.334 1.00 0.00 H new ATOM 0 HZ2 LYS D 85 9.606 -12.142 0.734 1.00 0.00 H new ATOM 0 HZ3 LYS D 85 8.260 -13.055 1.222 1.00 0.00 H new ATOM 1307 N GLY D 86 9.798 -7.114 -0.243 1.00 0.00 N ATOM 1308 CA GLY D 86 11.014 -7.307 -1.019 1.00 0.00 C ATOM 1309 C GLY D 86 10.898 -8.363 -2.098 1.00 0.00 C ATOM 1310 O GLY D 86 10.085 -9.287 -2.005 1.00 0.00 O ATOM 0 H GLY D 86 9.329 -6.223 -0.408 1.00 0.00 H new ATOM 0 HA2 GLY D 86 11.291 -6.360 -1.481 1.00 0.00 H new ATOM 0 HA3 GLY D 86 11.824 -7.581 -0.343 1.00 0.00 H new ATOM 1314 N PRO D 87 11.720 -8.245 -3.148 1.00 0.00 N ATOM 1315 CA PRO D 87 12.687 -7.156 -3.275 1.00 0.00 C ATOM 1316 C PRO D 87 12.077 -5.919 -3.939 1.00 0.00 C ATOM 1317 O PRO D 87 10.888 -5.922 -4.229 1.00 0.00 O ATOM 1318 CB PRO D 87 13.760 -7.790 -4.142 1.00 0.00 C ATOM 1319 CG PRO D 87 13.013 -8.710 -5.050 1.00 0.00 C ATOM 1320 CD PRO D 87 11.779 -9.160 -4.299 1.00 0.00 C ATOM 0 HA PRO D 87 13.055 -6.786 -2.318 1.00 0.00 H new ATOM 0 HB2 PRO D 87 14.311 -7.037 -4.706 1.00 0.00 H new ATOM 0 HB3 PRO D 87 14.488 -8.333 -3.539 1.00 0.00 H new ATOM 0 HG2 PRO D 87 12.739 -8.202 -5.975 1.00 0.00 H new ATOM 0 HG3 PRO D 87 13.630 -9.565 -5.327 1.00 0.00 H new ATOM 0 HD2 PRO D 87 10.884 -9.085 -4.917 1.00 0.00 H new ATOM 0 HD3 PRO D 87 11.860 -10.199 -3.981 1.00 0.00 H new ATOM 1328 N TYR D 88 12.898 -4.861 -4.074 1.00 0.00 N ATOM 1329 CA TYR D 88 12.500 -3.526 -4.599 1.00 0.00 C ATOM 1330 C TYR D 88 11.007 -3.394 -4.888 1.00 0.00 C ATOM 1331 O TYR D 88 10.548 -3.694 -5.988 1.00 0.00 O ATOM 1332 CB TYR D 88 13.280 -3.193 -5.878 1.00 0.00 C ATOM 1333 CG TYR D 88 14.782 -3.159 -5.693 1.00 0.00 C ATOM 1334 CD1 TYR D 88 15.483 -4.292 -5.301 1.00 0.00 C ATOM 1335 CD2 TYR D 88 15.495 -1.985 -5.888 1.00 0.00 C ATOM 1336 CE1 TYR D 88 16.849 -4.256 -5.109 1.00 0.00 C ATOM 1337 CE2 TYR D 88 16.862 -1.941 -5.704 1.00 0.00 C ATOM 1338 CZ TYR D 88 17.534 -3.079 -5.312 1.00 0.00 C ATOM 1339 OH TYR D 88 18.895 -3.038 -5.118 1.00 0.00 O ATOM 0 H TYR D 88 13.884 -4.904 -3.816 1.00 0.00 H new ATOM 0 HA TYR D 88 12.741 -2.821 -3.803 1.00 0.00 H new ATOM 0 HB2 TYR D 88 13.035 -3.930 -6.643 1.00 0.00 H new ATOM 0 HB3 TYR D 88 12.948 -2.224 -6.251 1.00 0.00 H new ATOM 0 HD1 TYR D 88 14.950 -5.218 -5.144 1.00 0.00 H new ATOM 0 HD2 TYR D 88 14.971 -1.090 -6.189 1.00 0.00 H new ATOM 0 HE1 TYR D 88 17.378 -5.146 -4.801 1.00 0.00 H new ATOM 0 HE2 TYR D 88 17.402 -1.020 -5.866 1.00 0.00 H new ATOM 0 HH TYR D 88 19.225 -2.134 -5.304 1.00 0.00 H new ATOM 1349 N ILE D 89 10.261 -2.931 -3.895 1.00 0.00 N ATOM 1350 CA ILE D 89 8.821 -2.757 -4.027 1.00 0.00 C ATOM 1351 C ILE D 89 8.423 -1.293 -4.026 1.00 0.00 C ATOM 1352 O ILE D 89 8.748 -0.546 -3.099 1.00 0.00 O ATOM 1353 CB ILE D 89 8.074 -3.504 -2.907 1.00 0.00 C ATOM 1354 CG1 ILE D 89 8.281 -5.017 -3.066 1.00 0.00 C ATOM 1355 CG2 ILE D 89 6.596 -3.180 -2.946 1.00 0.00 C ATOM 1356 CD1 ILE D 89 7.600 -5.839 -1.999 1.00 0.00 C ATOM 0 H ILE D 89 10.633 -2.667 -2.982 1.00 0.00 H new ATOM 0 HA ILE D 89 8.537 -3.181 -4.990 1.00 0.00 H new ATOM 0 HB ILE D 89 8.474 -3.183 -1.945 1.00 0.00 H new ATOM 0 HG12 ILE D 89 7.908 -5.325 -4.043 1.00 0.00 H new ATOM 0 HG13 ILE D 89 9.349 -5.232 -3.051 1.00 0.00 H new ATOM 0 HG21 ILE D 89 6.085 -3.717 -2.147 1.00 0.00 H new ATOM 0 HG22 ILE D 89 6.455 -2.108 -2.811 1.00 0.00 H new ATOM 0 HG23 ILE D 89 6.183 -3.482 -3.908 1.00 0.00 H new ATOM 0 HD11 ILE D 89 7.791 -6.897 -2.178 1.00 0.00 H new ATOM 0 HD12 ILE D 89 7.990 -5.560 -1.020 1.00 0.00 H new ATOM 0 HD13 ILE D 89 6.526 -5.654 -2.028 1.00 0.00 H new ATOM 1368 N GLU D 90 7.636 -0.921 -5.023 1.00 0.00 N ATOM 1369 CA GLU D 90 7.092 0.421 -5.098 1.00 0.00 C ATOM 1370 C GLU D 90 5.582 0.380 -4.897 1.00 0.00 C ATOM 1371 O GLU D 90 4.824 0.035 -5.800 1.00 0.00 O ATOM 1372 CB GLU D 90 7.429 1.075 -6.437 1.00 0.00 C ATOM 1373 CG GLU D 90 8.911 1.025 -6.779 1.00 0.00 C ATOM 1374 CD GLU D 90 9.780 1.780 -5.796 1.00 0.00 C ATOM 1375 OE1 GLU D 90 11.017 1.715 -5.934 1.00 0.00 O ATOM 1376 OE2 GLU D 90 9.231 2.453 -4.902 1.00 0.00 O1- ATOM 0 H GLU D 90 7.361 -1.532 -5.792 1.00 0.00 H new ATOM 0 HA GLU D 90 7.543 1.020 -4.307 1.00 0.00 H new ATOM 0 HB2 GLU D 90 6.865 0.579 -7.227 1.00 0.00 H new ATOM 0 HB3 GLU D 90 7.103 2.115 -6.417 1.00 0.00 H new ATOM 0 HG2 GLU D 90 9.234 -0.016 -6.813 1.00 0.00 H new ATOM 0 HG3 GLU D 90 9.060 1.438 -7.777 1.00 0.00 H new ATOM 1383 N ILE D 91 5.174 0.703 -3.692 1.00 0.00 N ATOM 1384 CA ILE D 91 3.783 0.700 -3.292 1.00 0.00 C ATOM 1385 C ILE D 91 3.210 2.112 -3.463 1.00 0.00 C ATOM 1386 O ILE D 91 3.417 2.976 -2.610 1.00 0.00 O ATOM 1387 CB ILE D 91 3.685 0.235 -1.809 1.00 0.00 C ATOM 1388 CG1 ILE D 91 4.246 -1.175 -1.649 1.00 0.00 C ATOM 1389 CG2 ILE D 91 2.274 0.274 -1.259 1.00 0.00 C ATOM 1390 CD1 ILE D 91 4.058 -1.739 -0.257 1.00 0.00 C ATOM 0 H ILE D 91 5.811 0.981 -2.946 1.00 0.00 H new ATOM 0 HA ILE D 91 3.207 0.014 -3.912 1.00 0.00 H new ATOM 0 HB ILE D 91 4.279 0.946 -1.235 1.00 0.00 H new ATOM 0 HG12 ILE D 91 3.763 -1.835 -2.369 1.00 0.00 H new ATOM 0 HG13 ILE D 91 5.309 -1.165 -1.889 1.00 0.00 H new ATOM 0 HG21 ILE D 91 2.278 -0.062 -0.222 1.00 0.00 H new ATOM 0 HG22 ILE D 91 1.892 1.294 -1.308 1.00 0.00 H new ATOM 0 HG23 ILE D 91 1.635 -0.381 -1.850 1.00 0.00 H new ATOM 0 HD11 ILE D 91 4.479 -2.743 -0.211 1.00 0.00 H new ATOM 0 HD12 ILE D 91 4.565 -1.100 0.466 1.00 0.00 H new ATOM 0 HD13 ILE D 91 2.994 -1.780 -0.022 1.00 0.00 H new ATOM 1402 N LYS D 92 2.462 2.333 -4.554 1.00 0.00 N ATOM 1403 CA LYS D 92 1.829 3.632 -4.801 1.00 0.00 C ATOM 1404 C LYS D 92 0.689 3.467 -5.803 1.00 0.00 C ATOM 1405 O LYS D 92 0.645 2.473 -6.533 1.00 0.00 O ATOM 1406 CB LYS D 92 2.845 4.671 -5.319 1.00 0.00 C ATOM 1407 CG LYS D 92 2.928 4.814 -6.841 1.00 0.00 C ATOM 1408 CD LYS D 92 3.391 3.557 -7.569 1.00 0.00 C ATOM 1409 CE LYS D 92 3.328 3.777 -9.079 1.00 0.00 C ATOM 1410 NZ LYS D 92 4.240 2.879 -9.834 1.00 0.00 N1+ ATOM 0 H LYS D 92 2.283 1.633 -5.274 1.00 0.00 H new ATOM 0 HA LYS D 92 1.434 4.001 -3.854 1.00 0.00 H new ATOM 0 HB2 LYS D 92 2.593 5.643 -4.894 1.00 0.00 H new ATOM 0 HB3 LYS D 92 3.833 4.405 -4.943 1.00 0.00 H new ATOM 0 HG2 LYS D 92 1.947 5.098 -7.221 1.00 0.00 H new ATOM 0 HG3 LYS D 92 3.611 5.629 -7.080 1.00 0.00 H new ATOM 0 HD2 LYS D 92 4.410 3.308 -7.271 1.00 0.00 H new ATOM 0 HD3 LYS D 92 2.762 2.712 -7.289 1.00 0.00 H new ATOM 0 HE2 LYS D 92 2.305 3.619 -9.422 1.00 0.00 H new ATOM 0 HE3 LYS D 92 3.582 4.814 -9.301 1.00 0.00 H new ATOM 0 HZ1 LYS D 92 4.205 3.119 -10.845 1.00 0.00 H new ATOM 0 HZ2 LYS D 92 5.212 2.997 -9.484 1.00 0.00 H new ATOM 0 HZ3 LYS D 92 3.942 1.891 -9.702 1.00 0.00 H new ATOM 1424 N GLN D 93 -0.198 4.457 -5.891 1.00 0.00 N ATOM 1425 CA GLN D 93 -1.266 4.385 -6.878 1.00 0.00 C ATOM 1426 C GLN D 93 -0.758 4.777 -8.250 1.00 0.00 C ATOM 1427 O GLN D 93 0.394 5.178 -8.414 1.00 0.00 O ATOM 1428 CB GLN D 93 -2.467 5.238 -6.519 1.00 0.00 C ATOM 1429 CG GLN D 93 -2.141 6.701 -6.390 1.00 0.00 C ATOM 1430 CD GLN D 93 -3.335 7.532 -5.972 1.00 0.00 C ATOM 1431 OE1 GLN D 93 -3.892 7.343 -4.891 1.00 0.00 O ATOM 1432 NE2 GLN D 93 -3.743 8.455 -6.830 1.00 0.00 N ATOM 0 H GLN D 93 -0.199 5.294 -5.308 1.00 0.00 H new ATOM 0 HA GLN D 93 -1.596 3.346 -6.889 1.00 0.00 H new ATOM 0 HB2 GLN D 93 -3.236 5.110 -7.281 1.00 0.00 H new ATOM 0 HB3 GLN D 93 -2.888 4.883 -5.579 1.00 0.00 H new ATOM 0 HG2 GLN D 93 -1.342 6.828 -5.660 1.00 0.00 H new ATOM 0 HG3 GLN D 93 -1.763 7.070 -7.343 1.00 0.00 H new ATOM 0 HE21 GLN D 93 -3.253 8.580 -7.716 1.00 0.00 H new ATOM 0 HE22 GLN D 93 -4.547 9.041 -6.605 1.00 0.00 H new ATOM 1441 N ILE D 94 -1.569 4.498 -9.244 1.00 0.00 N ATOM 1442 CA ILE D 94 -1.162 4.629 -10.625 1.00 0.00 C ATOM 1443 C ILE D 94 -2.259 5.257 -11.475 1.00 0.00 C ATOM 1444 O ILE D 94 -2.015 5.502 -12.671 1.00 0.00 O ATOM 1445 CB ILE D 94 -0.816 3.245 -11.162 1.00 0.00 C ATOM 1446 CG1 ILE D 94 -1.973 2.305 -10.870 1.00 0.00 C ATOM 1447 CG2 ILE D 94 0.462 2.725 -10.540 1.00 0.00 C ATOM 1448 CD1 ILE D 94 -1.728 0.875 -11.260 1.00 0.00 C ATOM 1449 OXT ILE D 94 -3.354 5.508 -10.937 1.00 0.00 O ATOM 0 H ILE D 94 -2.528 4.174 -9.119 1.00 0.00 H new ATOM 0 HA ILE D 94 -0.294 5.286 -10.675 1.00 0.00 H new ATOM 0 HB ILE D 94 -0.654 3.306 -12.238 1.00 0.00 H new ATOM 0 HG12 ILE D 94 -2.196 2.344 -9.804 1.00 0.00 H new ATOM 0 HG13 ILE D 94 -2.858 2.665 -11.395 1.00 0.00 H new ATOM 0 HG21 ILE D 94 0.686 1.736 -10.941 1.00 0.00 H new ATOM 0 HG22 ILE D 94 1.282 3.404 -10.772 1.00 0.00 H new ATOM 0 HG23 ILE D 94 0.340 2.659 -9.459 1.00 0.00 H new ATOM 0 HD11 ILE D 94 -2.605 0.276 -11.016 1.00 0.00 H new ATOM 0 HD12 ILE D 94 -1.536 0.818 -12.332 1.00 0.00 H new ATOM 0 HD13 ILE D 94 -0.864 0.492 -10.716 1.00 0.00 H new