USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1023 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 89 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 97 CYS SG : rot -117:sc= -2.89! USER MOD Set 2.1: A 69 SER OG : rot -119:sc= -0.329! USER MOD Set 2.2: A 120 ASN : amide:sc= 0.98 K(o=0.65,f=-12!) USER MOD Set 3.1: A 48 ASN : amide:sc= -3.09 K(o=-4.3,f=-6.6!) USER MOD Set 3.2: A 95 GLN : amide:sc= -1.25 K(o=-4.3,f=-3.4) USER MOD Set 4.1: A 32 GLN : amide:sc= -0.571 K(o=-0.58,f=-2.1) USER MOD Set 4.2: A 35 LYS NZ :NH3+ -107:sc=-0.00509 (180deg=0) USER MOD Set 5.1: A 24 ASN : amide:sc= -2.31! C(o=-2.7!,f=-2.3!) USER MOD Set 5.2: A 26 LYS NZ :NH3+ 153:sc= -0.403 (180deg=-1.7!) USER MOD Set 6.1: A 19 ASN : amide:sc= -3.03 X(o=-14,f=-14!) USER MOD Set 6.2: A 73 GLN : amide:sc= -10.6! C(o=-14!,f=-24!) USER MOD Set 7.1: A 18 THR OG1 : rot 130:sc= -0.852 USER MOD Set 7.2: A 29 LYS NZ :NH3+ -118:sc= -13.3! (180deg=-17.9!) USER MOD Single : A 10 GLN : amide:sc= -0.235 K(o=-0.23,f=-2.2!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= -2.61! USER MOD Single : A 28 GLN : amide:sc= -5.01! C(o=-5!,f=-5.5!) USER MOD Single : A 30 CYS SG : rot 157:sc= -6.03! USER MOD Single : A 39 SER OG : rot -160:sc= -0.933 USER MOD Single : A 40 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -1.81! K(o=-1.8!,f=-0.72) USER MOD Single : A 57 GLN : amide:sc= -1.86! K(o=-1.9!,f=-1) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -160:sc= -7.68! (180deg=-9.87!) USER MOD Single : A 61 THR OG1 : rot 60:sc= 1.2 USER MOD Single : A 62 SER OG : rot 73:sc= -0.0498 USER MOD Single : A 63 CYS SG : rot -179:sc= -1.36 USER MOD Single : A 65 GLN : amide:sc= -0.418 X(o=-0.42,f=-0.016) USER MOD Single : A 71 GLN : amide:sc= -3.34 K(o=-3.3,f=-1.8) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= -1.15 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 HIS : no HD1:sc= -19.4! C(o=-19!,f=-18!) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 MET CE :methyl -144:sc= -15.2! (180deg=-20.5!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -1.61 K(o=-1.6,f=-15!) USER MOD Single : A 104 ASN : amide:sc= -0.444 K(o=-0.44,f=-2.7!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -4.33! C(o=-4.3!,f=-5.2!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -178:sc= -0.864 (180deg=-0.879) USER MOD Single : A 128 TYR OH : rot -115:sc= 0.00152 USER MOD Single : A 131 GLN : amide:sc= -13.1! C(o=-13!,f=-9.5!) USER MOD Single : A 133 LYS NZ :NH3+ 131:sc= -0.837 (180deg=-2.16!) USER MOD ----------------------------------------------------------------- ATOM 169 N GLN A 10 11.097 -12.224 8.326 1.00 0.00 N ATOM 170 CA GLN A 10 10.923 -11.622 7.015 1.00 0.00 C ATOM 171 C GLN A 10 9.731 -12.255 6.294 1.00 0.00 C ATOM 172 O GLN A 10 9.544 -13.469 6.345 1.00 0.00 O ATOM 173 CB GLN A 10 12.199 -11.747 6.180 1.00 0.00 C ATOM 174 CG GLN A 10 12.721 -13.186 6.189 1.00 0.00 C ATOM 175 CD GLN A 10 13.165 -13.616 4.789 1.00 0.00 C ATOM 176 OE1 GLN A 10 13.235 -12.827 3.862 1.00 0.00 O ATOM 177 NE2 GLN A 10 13.462 -14.909 4.690 1.00 0.00 N ATOM 0 HA GLN A 10 10.719 -10.560 7.149 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.999 -11.435 5.155 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.963 -11.077 6.574 1.00 0.00 H new ATOM 0 HG2 GLN A 10 13.559 -13.269 6.882 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.942 -13.857 6.550 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.382 -15.515 5.507 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.770 -15.295 3.797 1.00 0.00 H new ATOM 186 N PRO A 11 8.936 -11.380 5.622 1.00 0.00 N ATOM 187 CA PRO A 11 7.767 -11.840 4.892 1.00 0.00 C ATOM 188 C PRO A 11 8.172 -12.528 3.586 1.00 0.00 C ATOM 189 O PRO A 11 9.332 -12.896 3.409 1.00 0.00 O ATOM 190 CB PRO A 11 6.925 -10.594 4.670 1.00 0.00 C ATOM 191 CG PRO A 11 7.864 -9.416 4.871 1.00 0.00 C ATOM 192 CD PRO A 11 9.127 -9.935 5.540 1.00 0.00 C ATOM 0 HA PRO A 11 7.201 -12.595 5.438 1.00 0.00 H new ATOM 0 HB2 PRO A 11 6.497 -10.585 3.668 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.093 -10.555 5.373 1.00 0.00 H new ATOM 0 HG2 PRO A 11 8.102 -8.950 3.915 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.391 -8.652 5.488 1.00 0.00 H new ATOM 0 HD2 PRO A 11 10.014 -9.685 4.958 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.260 -9.496 6.529 1.00 0.00 H new ATOM 200 N ARG A 12 7.193 -12.681 2.707 1.00 0.00 N ATOM 201 CA ARG A 12 7.433 -13.318 1.423 1.00 0.00 C ATOM 202 C ARG A 12 6.625 -12.623 0.326 1.00 0.00 C ATOM 203 O ARG A 12 7.140 -12.365 -0.761 1.00 0.00 O ATOM 204 CB ARG A 12 7.055 -14.800 1.464 1.00 0.00 C ATOM 205 CG ARG A 12 8.208 -15.674 0.969 1.00 0.00 C ATOM 206 CD ARG A 12 9.149 -16.045 2.117 1.00 0.00 C ATOM 207 NE ARG A 12 9.898 -17.276 1.781 1.00 0.00 N ATOM 208 CZ ARG A 12 9.397 -18.514 1.892 1.00 0.00 C ATOM 209 NH1 ARG A 12 8.144 -18.693 2.331 1.00 0.00 N ATOM 210 NH2 ARG A 12 10.150 -19.573 1.564 1.00 0.00 N ATOM 0 H ARG A 12 6.232 -12.375 2.858 1.00 0.00 H new ATOM 0 HA ARG A 12 8.497 -13.232 1.204 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.791 -15.083 2.483 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.173 -14.971 0.847 1.00 0.00 H new ATOM 0 HG2 ARG A 12 7.811 -16.581 0.512 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.764 -15.144 0.195 1.00 0.00 H new ATOM 0 HD2 ARG A 12 9.844 -15.227 2.307 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.577 -16.196 3.032 1.00 0.00 H new ATOM 0 HE ARG A 12 10.855 -17.176 1.444 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.571 -17.887 2.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 7.763 -19.635 2.415 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.104 -19.437 1.230 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.769 -20.515 1.648 1.00 0.00 H new ATOM 224 N THR A 13 5.371 -12.339 0.648 1.00 0.00 N ATOM 225 CA THR A 13 4.487 -11.679 -0.296 1.00 0.00 C ATOM 226 C THR A 13 4.260 -10.222 0.114 1.00 0.00 C ATOM 227 O THR A 13 3.644 -9.953 1.145 1.00 0.00 O ATOM 228 CB THR A 13 3.195 -12.494 -0.384 1.00 0.00 C ATOM 229 OG1 THR A 13 3.583 -13.689 -1.056 1.00 0.00 O ATOM 230 CG2 THR A 13 2.164 -11.858 -1.318 1.00 0.00 C ATOM 0 H THR A 13 4.947 -12.554 1.550 1.00 0.00 H new ATOM 0 HA THR A 13 4.931 -11.638 -1.291 1.00 0.00 H new ATOM 0 HB THR A 13 2.765 -12.601 0.612 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.805 -14.277 -1.154 1.00 0.00 H new ATOM 0 HG21 THR A 13 1.267 -12.476 -1.344 1.00 0.00 H new ATOM 0 HG22 THR A 13 1.909 -10.863 -0.954 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.581 -11.781 -2.322 1.00 0.00 H new ATOM 238 N ILE A 14 4.769 -9.322 -0.713 1.00 0.00 N ATOM 239 CA ILE A 14 4.630 -7.900 -0.449 1.00 0.00 C ATOM 240 C ILE A 14 3.441 -7.352 -1.241 1.00 0.00 C ATOM 241 O ILE A 14 3.496 -7.260 -2.467 1.00 0.00 O ATOM 242 CB ILE A 14 5.945 -7.171 -0.732 1.00 0.00 C ATOM 243 CG1 ILE A 14 7.128 -7.910 -0.104 1.00 0.00 C ATOM 244 CG2 ILE A 14 5.873 -5.712 -0.275 1.00 0.00 C ATOM 245 CD1 ILE A 14 6.791 -8.380 1.312 1.00 0.00 C ATOM 0 H ILE A 14 5.279 -9.550 -1.567 1.00 0.00 H new ATOM 0 HA ILE A 14 4.417 -7.728 0.606 1.00 0.00 H new ATOM 0 HB ILE A 14 6.106 -7.163 -1.810 1.00 0.00 H new ATOM 0 HG12 ILE A 14 7.395 -8.767 -0.722 1.00 0.00 H new ATOM 0 HG13 ILE A 14 7.998 -7.254 -0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.820 -5.217 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 14 5.070 -5.203 -0.808 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.677 -5.676 0.797 1.00 0.00 H new ATOM 0 HD11 ILE A 14 7.649 -8.902 1.736 1.00 0.00 H new ATOM 0 HD12 ILE A 14 6.548 -7.518 1.933 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.936 -9.055 1.277 1.00 0.00 H new ATOM 257 N SER A 15 2.393 -7.003 -0.509 1.00 0.00 N ATOM 258 CA SER A 15 1.192 -6.468 -1.128 1.00 0.00 C ATOM 259 C SER A 15 1.246 -4.939 -1.137 1.00 0.00 C ATOM 260 O SER A 15 0.923 -4.296 -0.139 1.00 0.00 O ATOM 261 CB SER A 15 -0.064 -6.950 -0.401 1.00 0.00 C ATOM 262 OG SER A 15 -0.829 -7.851 -1.197 1.00 0.00 O ATOM 0 H SER A 15 2.351 -7.080 0.507 1.00 0.00 H new ATOM 0 HA SER A 15 1.146 -6.830 -2.155 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.222 -7.441 0.529 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.679 -6.091 -0.132 1.00 0.00 H new ATOM 0 HG SER A 15 -1.622 -8.137 -0.697 1.00 0.00 H new ATOM 268 N LEU A 16 1.657 -4.400 -2.276 1.00 0.00 N ATOM 269 CA LEU A 16 1.757 -2.958 -2.429 1.00 0.00 C ATOM 270 C LEU A 16 0.620 -2.465 -3.326 1.00 0.00 C ATOM 271 O LEU A 16 0.456 -2.943 -4.447 1.00 0.00 O ATOM 272 CB LEU A 16 3.149 -2.568 -2.929 1.00 0.00 C ATOM 273 CG LEU A 16 3.504 -1.083 -2.835 1.00 0.00 C ATOM 274 CD1 LEU A 16 2.356 -0.211 -3.349 1.00 0.00 C ATOM 275 CD2 LEU A 16 3.914 -0.707 -1.410 1.00 0.00 C ATOM 0 H LEU A 16 1.925 -4.936 -3.102 1.00 0.00 H new ATOM 0 HA LEU A 16 1.640 -2.463 -1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.888 -3.134 -2.363 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.239 -2.877 -3.970 1.00 0.00 H new ATOM 0 HG LEU A 16 4.364 -0.896 -3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.634 0.840 -3.271 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.152 -0.456 -4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.463 -0.395 -2.751 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.161 0.354 -1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.089 -0.913 -0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.784 -1.294 -1.115 1.00 0.00 H new ATOM 287 N PHE A 17 -0.137 -1.513 -2.798 1.00 0.00 N ATOM 288 CA PHE A 17 -1.253 -0.949 -3.537 1.00 0.00 C ATOM 289 C PHE A 17 -0.866 0.382 -4.185 1.00 0.00 C ATOM 290 O PHE A 17 0.010 1.087 -3.686 1.00 0.00 O ATOM 291 CB PHE A 17 -2.379 -0.705 -2.530 1.00 0.00 C ATOM 292 CG PHE A 17 -2.774 -1.945 -1.726 1.00 0.00 C ATOM 293 CD1 PHE A 17 -2.430 -3.183 -2.172 1.00 0.00 C ATOM 294 CD2 PHE A 17 -3.470 -1.809 -0.565 1.00 0.00 C ATOM 295 CE1 PHE A 17 -2.797 -4.334 -1.425 1.00 0.00 C ATOM 296 CE2 PHE A 17 -3.837 -2.960 0.181 1.00 0.00 C ATOM 297 CZ PHE A 17 -3.492 -4.198 -0.264 1.00 0.00 C ATOM 0 H PHE A 17 0.001 -1.119 -1.867 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.557 -1.633 -4.330 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.071 0.080 -1.840 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.255 -0.336 -3.063 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.878 -3.291 -3.094 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.743 -0.826 -0.211 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.524 -5.317 -1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.390 -2.852 1.102 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.770 -5.073 0.305 1.00 0.00 H new ATOM 307 N THR A 18 -1.538 0.686 -5.285 1.00 0.00 N ATOM 308 CA THR A 18 -1.276 1.920 -6.006 1.00 0.00 C ATOM 309 C THR A 18 -2.392 2.934 -5.751 1.00 0.00 C ATOM 310 O THR A 18 -3.571 2.586 -5.782 1.00 0.00 O ATOM 311 CB THR A 18 -1.095 1.574 -7.485 1.00 0.00 C ATOM 312 OG1 THR A 18 0.284 1.235 -7.597 1.00 0.00 O ATOM 313 CG2 THR A 18 -1.253 2.794 -8.395 1.00 0.00 C ATOM 0 H THR A 18 -2.264 0.099 -5.695 1.00 0.00 H new ATOM 0 HA THR A 18 -0.361 2.397 -5.655 1.00 0.00 H new ATOM 0 HB THR A 18 -1.820 0.811 -7.770 1.00 0.00 H new ATOM 0 HG1 THR A 18 0.373 0.377 -8.062 1.00 0.00 H new ATOM 0 HG21 THR A 18 -1.115 2.493 -9.434 1.00 0.00 H new ATOM 0 HG22 THR A 18 -2.250 3.216 -8.269 1.00 0.00 H new ATOM 0 HG23 THR A 18 -0.506 3.543 -8.132 1.00 0.00 H new ATOM 321 N ASN A 19 -1.981 4.169 -5.504 1.00 0.00 N ATOM 322 CA ASN A 19 -2.932 5.237 -5.243 1.00 0.00 C ATOM 323 C ASN A 19 -2.467 6.511 -5.950 1.00 0.00 C ATOM 324 O ASN A 19 -2.555 7.603 -5.391 1.00 0.00 O ATOM 325 CB ASN A 19 -3.028 5.535 -3.746 1.00 0.00 C ATOM 326 CG ASN A 19 -4.168 4.745 -3.101 1.00 0.00 C ATOM 327 OD1 ASN A 19 -4.151 3.527 -3.029 1.00 0.00 O ATOM 328 ND2 ASN A 19 -5.158 5.503 -2.639 1.00 0.00 N ATOM 0 H ASN A 19 -1.002 4.454 -5.479 1.00 0.00 H new ATOM 0 HA ASN A 19 -3.907 4.918 -5.610 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.086 5.282 -3.260 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.189 6.602 -3.594 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.966 5.070 -2.192 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -5.109 6.518 -2.731 1.00 0.00 H new ATOM 335 N ASP A 20 -1.982 6.330 -7.170 1.00 0.00 N ATOM 336 CA ASP A 20 -1.504 7.452 -7.960 1.00 0.00 C ATOM 337 C ASP A 20 -0.191 7.966 -7.365 1.00 0.00 C ATOM 338 O ASP A 20 0.117 7.696 -6.205 1.00 0.00 O ATOM 339 CB ASP A 20 -2.511 8.604 -7.947 1.00 0.00 C ATOM 340 CG ASP A 20 -2.277 9.679 -9.010 1.00 0.00 C ATOM 341 OD1 ASP A 20 -2.692 9.437 -10.163 1.00 0.00 O ATOM 342 OD2 ASP A 20 -1.688 10.719 -8.644 1.00 0.00 O ATOM 0 H ASP A 20 -1.910 5.423 -7.631 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.363 7.107 -8.984 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.512 8.193 -8.081 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.489 9.075 -6.964 1.00 0.00 H new ATOM 347 N ILE A 21 0.548 8.697 -8.186 1.00 0.00 N ATOM 348 CA ILE A 21 1.820 9.250 -7.756 1.00 0.00 C ATOM 349 C ILE A 21 2.253 10.343 -8.735 1.00 0.00 C ATOM 350 O ILE A 21 2.033 11.528 -8.486 1.00 0.00 O ATOM 351 CB ILE A 21 2.856 8.138 -7.579 1.00 0.00 C ATOM 352 CG1 ILE A 21 2.202 6.759 -7.676 1.00 0.00 C ATOM 353 CG2 ILE A 21 3.631 8.314 -6.271 1.00 0.00 C ATOM 354 CD1 ILE A 21 3.205 5.708 -8.157 1.00 0.00 C ATOM 0 H ILE A 21 0.290 8.919 -9.147 1.00 0.00 H new ATOM 0 HA ILE A 21 1.720 9.719 -6.777 1.00 0.00 H new ATOM 0 HB ILE A 21 3.577 8.210 -8.393 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.807 6.471 -6.702 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.357 6.801 -8.363 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.361 7.511 -6.170 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.147 9.274 -6.280 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.938 8.283 -5.430 1.00 0.00 H new ATOM 0 HD11 ILE A 21 2.714 4.737 -8.217 1.00 0.00 H new ATOM 0 HD12 ILE A 21 3.580 5.987 -9.142 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.037 5.651 -7.455 1.00 0.00 H new ATOM 366 N ALA A 22 2.861 9.907 -9.829 1.00 0.00 N ATOM 367 CA ALA A 22 3.327 10.834 -10.846 1.00 0.00 C ATOM 368 C ALA A 22 3.314 10.137 -12.208 1.00 0.00 C ATOM 369 O ALA A 22 2.252 9.789 -12.722 1.00 0.00 O ATOM 370 CB ALA A 22 4.717 11.351 -10.469 1.00 0.00 C ATOM 0 H ALA A 22 3.041 8.924 -10.033 1.00 0.00 H new ATOM 0 HA ALA A 22 2.665 11.698 -10.910 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.066 12.046 -11.232 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.667 11.863 -9.508 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.410 10.513 -10.398 1.00 0.00 H new ATOM 376 N SER A 23 4.507 9.954 -12.755 1.00 0.00 N ATOM 377 CA SER A 23 4.647 9.305 -14.047 1.00 0.00 C ATOM 378 C SER A 23 3.904 7.967 -14.044 1.00 0.00 C ATOM 379 O SER A 23 2.801 7.865 -14.579 1.00 0.00 O ATOM 380 CB SER A 23 6.120 9.093 -14.401 1.00 0.00 C ATOM 381 OG SER A 23 6.484 9.769 -15.601 1.00 0.00 O ATOM 0 H SER A 23 5.386 10.244 -12.326 1.00 0.00 H new ATOM 0 HA SER A 23 4.209 9.955 -14.805 1.00 0.00 H new ATOM 0 HB2 SER A 23 6.744 9.448 -13.581 1.00 0.00 H new ATOM 0 HB3 SER A 23 6.316 8.027 -14.512 1.00 0.00 H new ATOM 0 HG SER A 23 7.432 9.610 -15.791 1.00 0.00 H new ATOM 387 N ASN A 24 4.539 6.976 -13.436 1.00 0.00 N ATOM 388 CA ASN A 24 3.952 5.649 -13.356 1.00 0.00 C ATOM 389 C ASN A 24 3.256 5.484 -12.004 1.00 0.00 C ATOM 390 O ASN A 24 3.897 5.150 -11.009 1.00 0.00 O ATOM 391 CB ASN A 24 5.025 4.565 -13.471 1.00 0.00 C ATOM 392 CG ASN A 24 5.074 3.990 -14.888 1.00 0.00 C ATOM 393 OD1 ASN A 24 5.789 4.465 -15.755 1.00 0.00 O ATOM 394 ND2 ASN A 24 4.275 2.942 -15.075 1.00 0.00 N ATOM 0 H ASN A 24 5.454 7.065 -12.994 1.00 0.00 H new ATOM 0 HA ASN A 24 3.243 5.544 -14.177 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.998 4.982 -13.210 1.00 0.00 H new ATOM 0 HB3 ASN A 24 4.819 3.767 -12.758 1.00 0.00 H new ATOM 0 HD21 ASN A 24 4.236 2.487 -15.987 1.00 0.00 H new ATOM 0 HD22 ASN A 24 3.702 2.594 -14.306 1.00 0.00 H new ATOM 401 N ILE A 25 1.953 5.727 -12.011 1.00 0.00 N ATOM 402 CA ILE A 25 1.163 5.609 -10.797 1.00 0.00 C ATOM 403 C ILE A 25 1.482 4.278 -10.114 1.00 0.00 C ATOM 404 O ILE A 25 1.586 4.214 -8.890 1.00 0.00 O ATOM 405 CB ILE A 25 -0.323 5.803 -11.104 1.00 0.00 C ATOM 406 CG1 ILE A 25 -0.676 7.290 -11.192 1.00 0.00 C ATOM 407 CG2 ILE A 25 -1.194 5.066 -10.085 1.00 0.00 C ATOM 408 CD1 ILE A 25 -0.220 7.884 -12.526 1.00 0.00 C ATOM 0 H ILE A 25 1.425 6.005 -12.838 1.00 0.00 H new ATOM 0 HA ILE A 25 1.425 6.399 -10.093 1.00 0.00 H new ATOM 0 HB ILE A 25 -0.530 5.365 -12.081 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -1.753 7.419 -11.082 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.205 7.829 -10.370 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -2.246 5.220 -10.326 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.967 4.000 -10.116 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.991 5.452 -9.086 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -0.483 8.941 -12.562 1.00 0.00 H new ATOM 0 HD12 ILE A 25 0.860 7.775 -12.622 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -0.712 7.359 -13.345 1.00 0.00 H new ATOM 420 N LYS A 26 1.627 3.248 -10.934 1.00 0.00 N ATOM 421 CA LYS A 26 1.931 1.922 -10.424 1.00 0.00 C ATOM 422 C LYS A 26 3.439 1.805 -10.187 1.00 0.00 C ATOM 423 O LYS A 26 3.876 1.538 -9.069 1.00 0.00 O ATOM 424 CB LYS A 26 1.370 0.847 -11.356 1.00 0.00 C ATOM 425 CG LYS A 26 1.639 1.197 -12.821 1.00 0.00 C ATOM 426 CD LYS A 26 0.330 1.407 -13.585 1.00 0.00 C ATOM 427 CE LYS A 26 0.079 2.893 -13.845 1.00 0.00 C ATOM 428 NZ LYS A 26 1.261 3.514 -14.485 1.00 0.00 N ATOM 0 H LYS A 26 1.540 3.305 -11.949 1.00 0.00 H new ATOM 0 HA LYS A 26 1.443 1.763 -9.462 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.822 -0.116 -11.120 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.297 0.744 -11.194 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.246 2.101 -12.877 1.00 0.00 H new ATOM 0 HG3 LYS A 26 2.213 0.398 -13.290 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.368 0.870 -14.533 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.499 0.989 -13.014 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.794 3.014 -14.486 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.142 3.400 -12.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.959 4.331 -15.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 1.927 3.830 -13.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.729 2.818 -15.100 1.00 0.00 H new ATOM 442 N SER A 27 4.191 2.010 -11.258 1.00 0.00 N ATOM 443 CA SER A 27 5.640 1.930 -11.181 1.00 0.00 C ATOM 444 C SER A 27 6.158 2.866 -10.087 1.00 0.00 C ATOM 445 O SER A 27 6.690 2.410 -9.076 1.00 0.00 O ATOM 446 CB SER A 27 6.283 2.278 -12.525 1.00 0.00 C ATOM 447 OG SER A 27 7.351 1.393 -12.851 1.00 0.00 O ATOM 0 H SER A 27 3.824 2.231 -12.184 1.00 0.00 H new ATOM 0 HA SER A 27 5.913 0.904 -10.933 1.00 0.00 H new ATOM 0 HB2 SER A 27 5.527 2.239 -13.309 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.657 3.301 -12.494 1.00 0.00 H new ATOM 0 HG SER A 27 7.734 1.647 -13.716 1.00 0.00 H new ATOM 453 N GLN A 28 5.984 4.157 -10.326 1.00 0.00 N ATOM 454 CA GLN A 28 6.428 5.161 -9.374 1.00 0.00 C ATOM 455 C GLN A 28 6.140 4.700 -7.944 1.00 0.00 C ATOM 456 O GLN A 28 6.907 4.990 -7.027 1.00 0.00 O ATOM 457 CB GLN A 28 5.770 6.513 -9.656 1.00 0.00 C ATOM 458 CG GLN A 28 6.076 7.516 -8.541 1.00 0.00 C ATOM 459 CD GLN A 28 6.631 8.821 -9.114 1.00 0.00 C ATOM 460 OE1 GLN A 28 6.275 9.912 -8.700 1.00 0.00 O ATOM 461 NE2 GLN A 28 7.521 8.649 -10.088 1.00 0.00 N ATOM 0 H GLN A 28 5.542 4.531 -11.165 1.00 0.00 H new ATOM 0 HA GLN A 28 7.505 5.288 -9.485 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.127 6.903 -10.609 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.692 6.384 -9.748 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.169 7.721 -7.973 1.00 0.00 H new ATOM 0 HG3 GLN A 28 6.797 7.084 -7.846 1.00 0.00 H new ATOM 0 HE21 GLN A 28 7.775 7.707 -10.387 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.950 9.459 -10.536 1.00 0.00 H new ATOM 470 N LYS A 29 5.031 3.988 -7.797 1.00 0.00 N ATOM 471 CA LYS A 29 4.632 3.484 -6.494 1.00 0.00 C ATOM 472 C LYS A 29 5.804 2.728 -5.864 1.00 0.00 C ATOM 473 O LYS A 29 6.573 3.300 -5.092 1.00 0.00 O ATOM 474 CB LYS A 29 3.355 2.650 -6.611 1.00 0.00 C ATOM 475 CG LYS A 29 2.400 2.945 -5.452 1.00 0.00 C ATOM 476 CD LYS A 29 2.325 4.447 -5.172 1.00 0.00 C ATOM 477 CE LYS A 29 0.892 4.961 -5.323 1.00 0.00 C ATOM 478 NZ LYS A 29 0.412 4.758 -6.709 1.00 0.00 N ATOM 0 H LYS A 29 4.397 3.749 -8.559 1.00 0.00 H new ATOM 0 HA LYS A 29 4.387 4.309 -5.825 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.861 2.866 -7.558 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.608 1.590 -6.618 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.406 2.566 -5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.736 2.421 -4.557 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.684 4.651 -4.163 1.00 0.00 H new ATOM 0 HD3 LYS A 29 2.981 4.982 -5.858 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.237 4.440 -4.625 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.851 6.020 -5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.198 5.680 -7.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.148 4.278 -7.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.448 4.174 -6.696 1.00 0.00 H new ATOM 492 N CYS A 30 5.904 1.455 -6.216 1.00 0.00 N ATOM 493 CA CYS A 30 6.969 0.616 -5.695 1.00 0.00 C ATOM 494 C CYS A 30 8.148 0.676 -6.668 1.00 0.00 C ATOM 495 O CYS A 30 9.270 0.989 -6.271 1.00 0.00 O ATOM 496 CB CYS A 30 6.495 -0.820 -5.461 1.00 0.00 C ATOM 497 SG CYS A 30 7.276 -1.499 -3.952 1.00 0.00 S ATOM 0 H CYS A 30 5.265 0.984 -6.856 1.00 0.00 H new ATOM 0 HA CYS A 30 7.284 0.988 -4.720 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.410 -0.842 -5.360 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.747 -1.440 -6.321 1.00 0.00 H new ATOM 0 HG CYS A 30 6.547 -2.469 -3.485 1.00 0.00 H new ATOM 503 N LEU A 31 7.854 0.371 -7.924 1.00 0.00 N ATOM 504 CA LEU A 31 8.876 0.386 -8.956 1.00 0.00 C ATOM 505 C LEU A 31 9.899 1.478 -8.639 1.00 0.00 C ATOM 506 O LEU A 31 11.103 1.264 -8.773 1.00 0.00 O ATOM 507 CB LEU A 31 8.237 0.525 -10.340 1.00 0.00 C ATOM 508 CG LEU A 31 7.591 -0.739 -10.910 1.00 0.00 C ATOM 509 CD1 LEU A 31 8.643 -1.813 -11.194 1.00 0.00 C ATOM 510 CD2 LEU A 31 6.483 -1.252 -9.987 1.00 0.00 C ATOM 0 H LEU A 31 6.923 0.112 -8.250 1.00 0.00 H new ATOM 0 HA LEU A 31 9.415 -0.561 -8.972 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.479 1.306 -10.291 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.001 0.865 -11.039 1.00 0.00 H new ATOM 0 HG LEU A 31 7.126 -0.485 -11.862 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.157 -2.701 -11.598 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.365 -1.433 -11.917 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.158 -2.071 -10.269 1.00 0.00 H new ATOM 0 HD21 LEU A 31 6.040 -2.151 -10.415 1.00 0.00 H new ATOM 0 HD22 LEU A 31 6.903 -1.485 -9.009 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.716 -0.486 -9.879 1.00 0.00 H new ATOM 522 N GLN A 32 9.383 2.626 -8.224 1.00 0.00 N ATOM 523 CA GLN A 32 10.237 3.752 -7.887 1.00 0.00 C ATOM 524 C GLN A 32 10.797 3.589 -6.472 1.00 0.00 C ATOM 525 O GLN A 32 11.981 3.825 -6.238 1.00 0.00 O ATOM 526 CB GLN A 32 9.482 5.075 -8.028 1.00 0.00 C ATOM 527 CG GLN A 32 9.666 5.665 -9.428 1.00 0.00 C ATOM 528 CD GLN A 32 11.124 6.060 -9.668 1.00 0.00 C ATOM 529 OE1 GLN A 32 11.970 5.973 -8.794 1.00 0.00 O ATOM 530 NE2 GLN A 32 11.370 6.499 -10.900 1.00 0.00 N ATOM 0 H GLN A 32 8.384 2.800 -8.114 1.00 0.00 H new ATOM 0 HA GLN A 32 11.072 3.771 -8.588 1.00 0.00 H new ATOM 0 HB2 GLN A 32 8.421 4.915 -7.833 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.840 5.783 -7.281 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.354 4.937 -10.177 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.025 6.538 -9.546 1.00 0.00 H new ATOM 0 HE21 GLN A 32 10.615 6.547 -11.585 1.00 0.00 H new ATOM 0 HE22 GLN A 32 12.313 6.788 -11.160 1.00 0.00 H new ATOM 539 N LEU A 33 9.918 3.185 -5.566 1.00 0.00 N ATOM 540 CA LEU A 33 10.310 2.987 -4.180 1.00 0.00 C ATOM 541 C LEU A 33 11.508 2.037 -4.124 1.00 0.00 C ATOM 542 O LEU A 33 12.485 2.306 -3.426 1.00 0.00 O ATOM 543 CB LEU A 33 9.115 2.519 -3.348 1.00 0.00 C ATOM 544 CG LEU A 33 9.444 1.922 -1.978 1.00 0.00 C ATOM 545 CD1 LEU A 33 10.538 2.729 -1.277 1.00 0.00 C ATOM 546 CD2 LEU A 33 8.185 1.794 -1.118 1.00 0.00 C ATOM 0 H LEU A 33 8.937 2.990 -5.764 1.00 0.00 H new ATOM 0 HA LEU A 33 10.629 3.930 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU A 33 8.445 3.366 -3.202 1.00 0.00 H new ATOM 0 HB3 LEU A 33 8.566 1.775 -3.924 1.00 0.00 H new ATOM 0 HG LEU A 33 9.833 0.915 -2.129 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.753 2.284 -0.306 1.00 0.00 H new ATOM 0 HD12 LEU A 33 11.442 2.723 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.200 3.756 -1.138 1.00 0.00 H new ATOM 0 HD21 LEU A 33 8.447 1.367 -0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 33 7.742 2.779 -0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 33 7.467 1.144 -1.618 1.00 0.00 H new ATOM 558 N LEU A 34 11.394 0.947 -4.868 1.00 0.00 N ATOM 559 CA LEU A 34 12.455 -0.044 -4.911 1.00 0.00 C ATOM 560 C LEU A 34 13.595 0.475 -5.790 1.00 0.00 C ATOM 561 O LEU A 34 14.720 -0.018 -5.709 1.00 0.00 O ATOM 562 CB LEU A 34 11.904 -1.400 -5.356 1.00 0.00 C ATOM 563 CG LEU A 34 10.396 -1.597 -5.195 1.00 0.00 C ATOM 564 CD1 LEU A 34 9.698 -1.621 -6.557 1.00 0.00 C ATOM 565 CD2 LEU A 34 10.090 -2.850 -4.373 1.00 0.00 C ATOM 0 H LEU A 34 10.583 0.728 -5.446 1.00 0.00 H new ATOM 0 HA LEU A 34 12.867 -0.205 -3.915 1.00 0.00 H new ATOM 0 HB2 LEU A 34 12.159 -1.547 -6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 34 12.415 -2.180 -4.791 1.00 0.00 H new ATOM 0 HG LEU A 34 9.998 -0.745 -4.643 1.00 0.00 H new ATOM 0 HD11 LEU A 34 8.627 -1.762 -6.414 1.00 0.00 H new ATOM 0 HD12 LEU A 34 9.874 -0.677 -7.073 1.00 0.00 H new ATOM 0 HD13 LEU A 34 10.096 -2.441 -7.155 1.00 0.00 H new ATOM 0 HD21 LEU A 34 9.011 -2.966 -4.274 1.00 0.00 H new ATOM 0 HD22 LEU A 34 10.504 -3.724 -4.875 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.537 -2.754 -3.383 1.00 0.00 H new ATOM 577 N LYS A 35 13.266 1.462 -6.610 1.00 0.00 N ATOM 578 CA LYS A 35 14.248 2.053 -7.503 1.00 0.00 C ATOM 579 C LYS A 35 15.417 2.596 -6.680 1.00 0.00 C ATOM 580 O LYS A 35 16.388 3.109 -7.236 1.00 0.00 O ATOM 581 CB LYS A 35 13.591 3.099 -8.405 1.00 0.00 C ATOM 582 CG LYS A 35 14.501 3.458 -9.582 1.00 0.00 C ATOM 583 CD LYS A 35 13.734 3.404 -10.904 1.00 0.00 C ATOM 584 CE LYS A 35 14.328 4.379 -11.923 1.00 0.00 C ATOM 585 NZ LYS A 35 13.280 4.860 -12.851 1.00 0.00 N ATOM 0 H LYS A 35 12.332 1.868 -6.675 1.00 0.00 H new ATOM 0 HA LYS A 35 14.655 1.298 -8.175 1.00 0.00 H new ATOM 0 HB2 LYS A 35 12.641 2.717 -8.779 1.00 0.00 H new ATOM 0 HB3 LYS A 35 13.369 3.995 -7.826 1.00 0.00 H new ATOM 0 HG2 LYS A 35 14.912 4.457 -9.437 1.00 0.00 H new ATOM 0 HG3 LYS A 35 15.344 2.768 -9.618 1.00 0.00 H new ATOM 0 HD2 LYS A 35 13.764 2.391 -11.305 1.00 0.00 H new ATOM 0 HD3 LYS A 35 12.686 3.647 -10.731 1.00 0.00 H new ATOM 0 HE2 LYS A 35 14.780 5.225 -11.405 1.00 0.00 H new ATOM 0 HE3 LYS A 35 15.122 3.888 -12.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.412 4.418 -13.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.343 4.607 -12.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 13.348 5.893 -12.946 1.00 0.00 H new ATOM 599 N GLY A 36 15.287 2.467 -5.368 1.00 0.00 N ATOM 600 CA GLY A 36 16.320 2.939 -4.462 1.00 0.00 C ATOM 601 C GLY A 36 17.504 1.970 -4.428 1.00 0.00 C ATOM 602 O GLY A 36 18.621 2.335 -4.790 1.00 0.00 O ATOM 0 H GLY A 36 14.481 2.042 -4.910 1.00 0.00 H new ATOM 0 HA2 GLY A 36 16.662 3.925 -4.776 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.907 3.049 -3.459 1.00 0.00 H new ATOM 606 N ASP A 37 17.218 0.753 -3.989 1.00 0.00 N ATOM 607 CA ASP A 37 18.245 -0.272 -3.902 1.00 0.00 C ATOM 608 C ASP A 37 17.594 -1.651 -4.027 1.00 0.00 C ATOM 609 O ASP A 37 17.879 -2.550 -3.237 1.00 0.00 O ATOM 610 CB ASP A 37 18.971 -0.212 -2.557 1.00 0.00 C ATOM 611 CG ASP A 37 19.778 1.065 -2.314 1.00 0.00 C ATOM 612 OD1 ASP A 37 20.452 1.501 -3.272 1.00 0.00 O ATOM 613 OD2 ASP A 37 19.702 1.577 -1.176 1.00 0.00 O ATOM 0 H ASP A 37 16.290 0.454 -3.690 1.00 0.00 H new ATOM 0 HA ASP A 37 18.961 -0.101 -4.706 1.00 0.00 H new ATOM 0 HB2 ASP A 37 18.236 -0.316 -1.759 1.00 0.00 H new ATOM 0 HB3 ASP A 37 19.643 -1.067 -2.485 1.00 0.00 H new ATOM 618 N VAL A 38 16.733 -1.776 -5.026 1.00 0.00 N ATOM 619 CA VAL A 38 16.040 -3.030 -5.264 1.00 0.00 C ATOM 620 C VAL A 38 17.056 -4.174 -5.281 1.00 0.00 C ATOM 621 O VAL A 38 18.209 -3.979 -5.661 1.00 0.00 O ATOM 622 CB VAL A 38 15.221 -2.939 -6.554 1.00 0.00 C ATOM 623 CG1 VAL A 38 16.134 -2.854 -7.778 1.00 0.00 C ATOM 624 CG2 VAL A 38 14.252 -4.117 -6.673 1.00 0.00 C ATOM 0 H VAL A 38 16.500 -1.029 -5.680 1.00 0.00 H new ATOM 0 HA VAL A 38 15.333 -3.234 -4.460 1.00 0.00 H new ATOM 0 HB VAL A 38 14.631 -2.023 -6.512 1.00 0.00 H new ATOM 0 HG11 VAL A 38 15.527 -2.790 -8.681 1.00 0.00 H new ATOM 0 HG12 VAL A 38 16.764 -1.968 -7.701 1.00 0.00 H new ATOM 0 HG13 VAL A 38 16.763 -3.743 -7.825 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.683 -4.028 -7.598 1.00 0.00 H new ATOM 0 HG22 VAL A 38 14.814 -5.051 -6.681 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.568 -4.113 -5.824 1.00 0.00 H new ATOM 634 N SER A 39 16.590 -5.342 -4.864 1.00 0.00 N ATOM 635 CA SER A 39 17.444 -6.518 -4.826 1.00 0.00 C ATOM 636 C SER A 39 16.683 -7.735 -5.355 1.00 0.00 C ATOM 637 O SER A 39 15.801 -7.600 -6.202 1.00 0.00 O ATOM 638 CB SER A 39 17.951 -6.784 -3.408 1.00 0.00 C ATOM 639 OG SER A 39 18.457 -5.604 -2.791 1.00 0.00 O ATOM 0 H SER A 39 15.633 -5.500 -4.550 1.00 0.00 H new ATOM 0 HA SER A 39 18.309 -6.334 -5.463 1.00 0.00 H new ATOM 0 HB2 SER A 39 17.140 -7.190 -2.803 1.00 0.00 H new ATOM 0 HB3 SER A 39 18.735 -7.541 -3.439 1.00 0.00 H new ATOM 0 HG SER A 39 19.045 -5.850 -2.047 1.00 0.00 H new ATOM 645 N HIS A 40 17.052 -8.896 -4.835 1.00 0.00 N ATOM 646 CA HIS A 40 16.415 -10.136 -5.244 1.00 0.00 C ATOM 647 C HIS A 40 16.336 -11.091 -4.051 1.00 0.00 C ATOM 648 O HIS A 40 16.975 -12.142 -4.050 1.00 0.00 O ATOM 649 CB HIS A 40 17.137 -10.747 -6.446 1.00 0.00 C ATOM 650 CG HIS A 40 16.248 -11.577 -7.341 1.00 0.00 C ATOM 651 ND1 HIS A 40 15.483 -11.028 -8.355 1.00 0.00 N ATOM 652 CD2 HIS A 40 16.011 -12.920 -7.363 1.00 0.00 C ATOM 653 CE1 HIS A 40 14.819 -12.006 -8.953 1.00 0.00 C ATOM 654 NE2 HIS A 40 15.147 -13.178 -8.337 1.00 0.00 N ATOM 0 H HIS A 40 17.785 -9.004 -4.134 1.00 0.00 H new ATOM 0 HA HIS A 40 15.395 -9.934 -5.571 1.00 0.00 H new ATOM 0 HB2 HIS A 40 17.581 -9.945 -7.036 1.00 0.00 H new ATOM 0 HB3 HIS A 40 17.956 -11.370 -6.086 1.00 0.00 H new ATOM 0 HD2 HIS A 40 16.452 -13.650 -6.700 1.00 0.00 H new ATOM 0 HE1 HIS A 40 14.137 -11.895 -9.783 1.00 0.00 H new ATOM 0 HE2 HIS A 40 14.788 -14.100 -8.584 1.00 0.00 H new ATOM 662 N ARG A 41 15.547 -10.690 -3.065 1.00 0.00 N ATOM 663 CA ARG A 41 15.377 -11.497 -1.868 1.00 0.00 C ATOM 664 C ARG A 41 13.895 -11.598 -1.503 1.00 0.00 C ATOM 665 O ARG A 41 13.535 -12.261 -0.531 1.00 0.00 O ATOM 666 CB ARG A 41 16.147 -10.902 -0.688 1.00 0.00 C ATOM 667 CG ARG A 41 16.354 -9.397 -0.872 1.00 0.00 C ATOM 668 CD ARG A 41 17.799 -9.087 -1.270 1.00 0.00 C ATOM 669 NE ARG A 41 18.735 -9.748 -0.334 1.00 0.00 N ATOM 670 CZ ARG A 41 20.056 -9.847 -0.537 1.00 0.00 C ATOM 671 NH1 ARG A 41 20.604 -9.329 -1.645 1.00 0.00 N ATOM 672 NH2 ARG A 41 20.828 -10.464 0.367 1.00 0.00 N ATOM 0 H ARG A 41 15.019 -9.818 -3.070 1.00 0.00 H new ATOM 0 HA ARG A 41 15.771 -12.491 -2.079 1.00 0.00 H new ATOM 0 HB2 ARG A 41 15.602 -11.087 0.237 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.114 -11.397 -0.593 1.00 0.00 H new ATOM 0 HG2 ARG A 41 15.674 -9.024 -1.638 1.00 0.00 H new ATOM 0 HG3 ARG A 41 16.108 -8.877 0.054 1.00 0.00 H new ATOM 0 HD2 ARG A 41 17.986 -9.430 -2.287 1.00 0.00 H new ATOM 0 HD3 ARG A 41 17.964 -8.010 -1.262 1.00 0.00 H new ATOM 0 HE ARG A 41 18.351 -10.154 0.519 1.00 0.00 H new ATOM 0 HH11 ARG A 41 20.016 -8.860 -2.333 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.609 -9.404 -1.800 1.00 0.00 H new ATOM 0 HH21 ARG A 41 20.410 -10.859 1.210 1.00 0.00 H new ATOM 0 HH22 ARG A 41 21.833 -10.539 0.213 1.00 0.00 H new ATOM 686 N PHE A 42 13.075 -10.931 -2.301 1.00 0.00 N ATOM 687 CA PHE A 42 11.639 -10.937 -2.074 1.00 0.00 C ATOM 688 C PHE A 42 10.880 -10.575 -3.352 1.00 0.00 C ATOM 689 O PHE A 42 11.461 -10.032 -4.290 1.00 0.00 O ATOM 690 CB PHE A 42 11.351 -9.880 -1.006 1.00 0.00 C ATOM 691 CG PHE A 42 11.504 -8.439 -1.500 1.00 0.00 C ATOM 692 CD1 PHE A 42 12.683 -8.027 -2.039 1.00 0.00 C ATOM 693 CD2 PHE A 42 10.461 -7.572 -1.401 1.00 0.00 C ATOM 694 CE1 PHE A 42 12.824 -6.690 -2.498 1.00 0.00 C ATOM 695 CE2 PHE A 42 10.603 -6.236 -1.859 1.00 0.00 C ATOM 696 CZ PHE A 42 11.782 -5.823 -2.398 1.00 0.00 C ATOM 0 H PHE A 42 13.377 -10.382 -3.106 1.00 0.00 H new ATOM 0 HA PHE A 42 11.316 -11.930 -1.761 1.00 0.00 H new ATOM 0 HB2 PHE A 42 10.336 -10.020 -0.635 1.00 0.00 H new ATOM 0 HB3 PHE A 42 12.023 -10.038 -0.163 1.00 0.00 H new ATOM 0 HD1 PHE A 42 13.511 -8.716 -2.118 1.00 0.00 H new ATOM 0 HD2 PHE A 42 9.525 -7.900 -0.974 1.00 0.00 H new ATOM 0 HE1 PHE A 42 13.760 -6.362 -2.927 1.00 0.00 H new ATOM 0 HE2 PHE A 42 9.775 -5.547 -1.780 1.00 0.00 H new ATOM 0 HZ PHE A 42 11.890 -4.806 -2.746 1.00 0.00 H new ATOM 706 N ASP A 43 9.593 -10.891 -3.347 1.00 0.00 N ATOM 707 CA ASP A 43 8.749 -10.606 -4.494 1.00 0.00 C ATOM 708 C ASP A 43 7.878 -9.386 -4.190 1.00 0.00 C ATOM 709 O ASP A 43 7.079 -9.406 -3.255 1.00 0.00 O ATOM 710 CB ASP A 43 7.822 -11.784 -4.802 1.00 0.00 C ATOM 711 CG ASP A 43 8.351 -12.768 -5.847 1.00 0.00 C ATOM 712 OD1 ASP A 43 8.094 -12.516 -7.045 1.00 0.00 O ATOM 713 OD2 ASP A 43 9.001 -13.749 -5.426 1.00 0.00 O ATOM 0 H ASP A 43 9.115 -11.342 -2.567 1.00 0.00 H new ATOM 0 HA ASP A 43 9.396 -10.423 -5.352 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.631 -12.328 -3.877 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.864 -11.393 -5.145 1.00 0.00 H new ATOM 718 N VAL A 44 8.060 -8.352 -4.998 1.00 0.00 N ATOM 719 CA VAL A 44 7.301 -7.125 -4.827 1.00 0.00 C ATOM 720 C VAL A 44 6.051 -7.177 -5.708 1.00 0.00 C ATOM 721 O VAL A 44 6.124 -7.562 -6.874 1.00 0.00 O ATOM 722 CB VAL A 44 8.189 -5.914 -5.122 1.00 0.00 C ATOM 723 CG1 VAL A 44 7.467 -4.609 -4.782 1.00 0.00 C ATOM 724 CG2 VAL A 44 9.520 -6.016 -4.374 1.00 0.00 C ATOM 0 H VAL A 44 8.723 -8.339 -5.773 1.00 0.00 H new ATOM 0 HA VAL A 44 6.968 -7.023 -3.794 1.00 0.00 H new ATOM 0 HB VAL A 44 8.405 -5.908 -6.190 1.00 0.00 H new ATOM 0 HG11 VAL A 44 8.120 -3.764 -5.001 1.00 0.00 H new ATOM 0 HG12 VAL A 44 6.558 -4.530 -5.379 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.207 -4.602 -3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.133 -5.143 -4.601 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.332 -6.059 -3.301 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.045 -6.919 -4.687 1.00 0.00 H new ATOM 734 N GLU A 45 4.932 -6.785 -5.116 1.00 0.00 N ATOM 735 CA GLU A 45 3.668 -6.782 -5.831 1.00 0.00 C ATOM 736 C GLU A 45 3.110 -5.360 -5.917 1.00 0.00 C ATOM 737 O GLU A 45 2.772 -4.759 -4.898 1.00 0.00 O ATOM 738 CB GLU A 45 2.662 -7.727 -5.171 1.00 0.00 C ATOM 739 CG GLU A 45 1.252 -7.135 -5.202 1.00 0.00 C ATOM 740 CD GLU A 45 0.715 -7.071 -6.633 1.00 0.00 C ATOM 741 OE1 GLU A 45 0.968 -6.037 -7.289 1.00 0.00 O ATOM 742 OE2 GLU A 45 0.064 -8.057 -7.040 1.00 0.00 O ATOM 0 H GLU A 45 4.875 -6.467 -4.148 1.00 0.00 H new ATOM 0 HA GLU A 45 3.845 -7.144 -6.844 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.668 -8.688 -5.686 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.958 -7.916 -4.139 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.586 -7.740 -4.587 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.264 -6.135 -4.769 1.00 0.00 H new ATOM 749 N ILE A 46 3.030 -4.863 -7.143 1.00 0.00 N ATOM 750 CA ILE A 46 2.519 -3.523 -7.375 1.00 0.00 C ATOM 751 C ILE A 46 1.188 -3.612 -8.125 1.00 0.00 C ATOM 752 O ILE A 46 1.165 -3.878 -9.326 1.00 0.00 O ATOM 753 CB ILE A 46 3.568 -2.664 -8.084 1.00 0.00 C ATOM 754 CG1 ILE A 46 4.947 -2.846 -7.447 1.00 0.00 C ATOM 755 CG2 ILE A 46 3.141 -1.195 -8.120 1.00 0.00 C ATOM 756 CD1 ILE A 46 5.535 -4.215 -7.792 1.00 0.00 C ATOM 0 H ILE A 46 3.311 -5.364 -7.986 1.00 0.00 H new ATOM 0 HA ILE A 46 2.319 -3.023 -6.427 1.00 0.00 H new ATOM 0 HB ILE A 46 3.644 -3.002 -9.118 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.618 -2.060 -7.794 1.00 0.00 H new ATOM 0 HG13 ILE A 46 4.868 -2.743 -6.365 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.904 -0.607 -8.629 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.196 -1.104 -8.655 1.00 0.00 H new ATOM 0 HG23 ILE A 46 3.019 -0.827 -7.101 1.00 0.00 H new ATOM 0 HD11 ILE A 46 6.515 -4.318 -7.327 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.874 -4.999 -7.422 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.636 -4.306 -8.874 1.00 0.00 H new ATOM 768 N ALA A 47 0.112 -3.386 -7.385 1.00 0.00 N ATOM 769 CA ALA A 47 -1.219 -3.437 -7.965 1.00 0.00 C ATOM 770 C ALA A 47 -2.058 -2.285 -7.409 1.00 0.00 C ATOM 771 O ALA A 47 -1.999 -1.988 -6.217 1.00 0.00 O ATOM 772 CB ALA A 47 -1.846 -4.804 -7.684 1.00 0.00 C ATOM 0 H ALA A 47 0.135 -3.167 -6.389 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.171 -3.317 -9.047 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.845 -4.843 -8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.228 -5.586 -8.125 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.913 -4.959 -6.607 1.00 0.00 H new ATOM 778 N ASN A 48 -2.820 -1.666 -8.300 1.00 0.00 N ATOM 779 CA ASN A 48 -3.669 -0.553 -7.913 1.00 0.00 C ATOM 780 C ASN A 48 -5.064 -1.079 -7.564 1.00 0.00 C ATOM 781 O ASN A 48 -5.743 -1.655 -8.412 1.00 0.00 O ATOM 782 CB ASN A 48 -3.816 0.452 -9.057 1.00 0.00 C ATOM 783 CG ASN A 48 -4.513 -0.185 -10.261 1.00 0.00 C ATOM 784 OD1 ASN A 48 -5.726 -0.177 -10.384 1.00 0.00 O ATOM 785 ND2 ASN A 48 -3.679 -0.736 -11.139 1.00 0.00 N ATOM 0 H ASN A 48 -2.867 -1.915 -9.288 1.00 0.00 H new ATOM 0 HA ASN A 48 -3.209 -0.060 -7.057 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -4.388 1.315 -8.716 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -2.833 0.818 -9.353 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -4.046 -1.187 -11.977 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -2.673 -0.707 -10.974 1.00 0.00 H new ATOM 792 N ARG A 49 -5.448 -0.860 -6.315 1.00 0.00 N ATOM 793 CA ARG A 49 -6.749 -1.305 -5.844 1.00 0.00 C ATOM 794 C ARG A 49 -7.073 -0.661 -4.494 1.00 0.00 C ATOM 795 O ARG A 49 -6.172 -0.227 -3.777 1.00 0.00 O ATOM 796 CB ARG A 49 -6.791 -2.827 -5.698 1.00 0.00 C ATOM 797 CG ARG A 49 -8.162 -3.378 -6.094 1.00 0.00 C ATOM 798 CD ARG A 49 -8.159 -3.867 -7.544 1.00 0.00 C ATOM 799 NE ARG A 49 -9.547 -4.092 -8.006 1.00 0.00 N ATOM 800 CZ ARG A 49 -10.270 -5.180 -7.709 1.00 0.00 C ATOM 801 NH1 ARG A 49 -9.742 -6.149 -6.950 1.00 0.00 N ATOM 802 NH2 ARG A 49 -11.522 -5.299 -8.172 1.00 0.00 N ATOM 0 H ARG A 49 -4.882 -0.381 -5.615 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.491 -1.002 -6.583 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -6.020 -3.277 -6.323 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.568 -3.103 -4.668 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.433 -4.199 -5.430 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -8.919 -2.604 -5.969 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -7.669 -3.132 -8.183 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -7.586 -4.791 -7.623 1.00 0.00 H new ATOM 0 HE ARG A 49 -9.980 -3.374 -8.587 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -8.789 -6.059 -6.598 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -10.293 -6.977 -6.724 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -11.924 -4.561 -8.750 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -12.073 -6.127 -7.946 1.00 0.00 H new ATOM 816 N PHE A 50 -8.361 -0.619 -4.189 1.00 0.00 N ATOM 817 CA PHE A 50 -8.815 -0.036 -2.938 1.00 0.00 C ATOM 818 C PHE A 50 -8.816 -1.076 -1.816 1.00 0.00 C ATOM 819 O PHE A 50 -9.181 -2.230 -2.035 1.00 0.00 O ATOM 820 CB PHE A 50 -10.247 0.453 -3.166 1.00 0.00 C ATOM 821 CG PHE A 50 -10.696 1.540 -2.188 1.00 0.00 C ATOM 822 CD1 PHE A 50 -10.006 2.709 -2.106 1.00 0.00 C ATOM 823 CD2 PHE A 50 -11.787 1.339 -1.401 1.00 0.00 C ATOM 824 CE1 PHE A 50 -10.423 3.719 -1.199 1.00 0.00 C ATOM 825 CE2 PHE A 50 -12.204 2.348 -0.493 1.00 0.00 C ATOM 826 CZ PHE A 50 -11.513 3.517 -0.412 1.00 0.00 C ATOM 0 H PHE A 50 -9.105 -0.979 -4.787 1.00 0.00 H new ATOM 0 HA PHE A 50 -8.150 0.776 -2.643 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -10.332 0.836 -4.183 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.927 -0.395 -3.087 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.140 2.869 -2.731 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -12.336 0.412 -1.467 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.875 4.647 -1.134 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.069 2.187 0.133 1.00 0.00 H new ATOM 0 HZ PHE A 50 -11.830 4.285 0.278 1.00 0.00 H new ATOM 836 N PRO A 51 -8.393 -0.618 -0.607 1.00 0.00 N ATOM 837 CA PRO A 51 -8.341 -1.496 0.549 1.00 0.00 C ATOM 838 C PRO A 51 -9.744 -1.759 1.101 1.00 0.00 C ATOM 839 O PRO A 51 -10.030 -1.441 2.255 1.00 0.00 O ATOM 840 CB PRO A 51 -7.435 -0.786 1.542 1.00 0.00 C ATOM 841 CG PRO A 51 -7.388 0.667 1.098 1.00 0.00 C ATOM 842 CD PRO A 51 -7.953 0.742 -0.311 1.00 0.00 C ATOM 0 HA PRO A 51 -7.949 -2.485 0.309 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -7.824 -0.872 2.557 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.438 -1.226 1.545 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.969 1.292 1.776 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.364 1.040 1.119 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -8.782 1.448 -0.368 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.199 1.078 -1.023 1.00 0.00 H new ATOM 850 N THR A 52 -10.581 -2.335 0.252 1.00 0.00 N ATOM 851 CA THR A 52 -11.947 -2.644 0.640 1.00 0.00 C ATOM 852 C THR A 52 -11.959 -3.559 1.866 1.00 0.00 C ATOM 853 O THR A 52 -11.127 -4.458 1.983 1.00 0.00 O ATOM 854 CB THR A 52 -12.659 -3.244 -0.573 1.00 0.00 C ATOM 855 OG1 THR A 52 -11.860 -4.372 -0.922 1.00 0.00 O ATOM 856 CG2 THR A 52 -12.584 -2.339 -1.804 1.00 0.00 C ATOM 0 H THR A 52 -10.340 -2.596 -0.704 1.00 0.00 H new ATOM 0 HA THR A 52 -12.486 -1.745 0.939 1.00 0.00 H new ATOM 0 HB THR A 52 -13.704 -3.431 -0.324 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.251 -4.822 -1.700 1.00 0.00 H new ATOM 0 HG21 THR A 52 -13.105 -2.813 -2.636 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.053 -1.381 -1.580 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.540 -2.178 -2.074 1.00 0.00 H new ATOM 864 N TRP A 53 -12.911 -3.299 2.750 1.00 0.00 N ATOM 865 CA TRP A 53 -13.043 -4.088 3.963 1.00 0.00 C ATOM 866 C TRP A 53 -12.937 -5.565 3.580 1.00 0.00 C ATOM 867 O TRP A 53 -12.540 -6.395 4.396 1.00 0.00 O ATOM 868 CB TRP A 53 -14.342 -3.753 4.697 1.00 0.00 C ATOM 869 CG TRP A 53 -14.960 -4.938 5.442 1.00 0.00 C ATOM 870 CD1 TRP A 53 -15.660 -5.960 4.930 1.00 0.00 C ATOM 871 CD2 TRP A 53 -14.904 -5.184 6.863 1.00 0.00 C ATOM 872 NE1 TRP A 53 -16.058 -6.843 5.914 1.00 0.00 N ATOM 873 CE2 TRP A 53 -15.583 -6.356 7.126 1.00 0.00 C ATOM 874 CE3 TRP A 53 -14.300 -4.440 7.892 1.00 0.00 C ATOM 875 CZ2 TRP A 53 -15.723 -6.888 8.413 1.00 0.00 C ATOM 876 CZ3 TRP A 53 -14.448 -4.986 9.173 1.00 0.00 C ATOM 877 CH2 TRP A 53 -15.129 -6.165 9.454 1.00 0.00 C ATOM 0 H TRP A 53 -13.599 -2.552 2.650 1.00 0.00 H new ATOM 0 HA TRP A 53 -12.243 -3.852 4.665 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -14.148 -2.951 5.409 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -15.066 -3.372 3.977 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -15.884 -6.078 3.880 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -16.601 -7.696 5.777 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -13.764 -3.520 7.709 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -16.261 -7.807 8.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -14.002 -4.454 10.000 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -15.199 -6.521 10.471 1.00 0.00 H new ATOM 888 N ASP A 54 -13.298 -5.849 2.337 1.00 0.00 N ATOM 889 CA ASP A 54 -13.248 -7.212 1.835 1.00 0.00 C ATOM 890 C ASP A 54 -11.817 -7.740 1.946 1.00 0.00 C ATOM 891 O ASP A 54 -11.567 -8.727 2.636 1.00 0.00 O ATOM 892 CB ASP A 54 -13.662 -7.272 0.364 1.00 0.00 C ATOM 893 CG ASP A 54 -15.005 -7.955 0.097 1.00 0.00 C ATOM 894 OD1 ASP A 54 -15.970 -7.608 0.811 1.00 0.00 O ATOM 895 OD2 ASP A 54 -15.036 -8.809 -0.815 1.00 0.00 O ATOM 0 H ASP A 54 -13.626 -5.158 1.662 1.00 0.00 H new ATOM 0 HA ASP A 54 -13.935 -7.815 2.428 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -13.704 -6.256 -0.028 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -12.887 -7.797 -0.195 1.00 0.00 H new ATOM 900 N GLN A 55 -10.913 -7.058 1.257 1.00 0.00 N ATOM 901 CA GLN A 55 -9.513 -7.446 1.270 1.00 0.00 C ATOM 902 C GLN A 55 -8.814 -6.871 2.504 1.00 0.00 C ATOM 903 O GLN A 55 -8.177 -7.605 3.259 1.00 0.00 O ATOM 904 CB GLN A 55 -8.810 -7.003 -0.014 1.00 0.00 C ATOM 905 CG GLN A 55 -8.816 -8.122 -1.057 1.00 0.00 C ATOM 906 CD GLN A 55 -10.158 -8.183 -1.789 1.00 0.00 C ATOM 907 OE1 GLN A 55 -10.328 -7.649 -2.873 1.00 0.00 O ATOM 908 NE2 GLN A 55 -11.099 -8.860 -1.138 1.00 0.00 N ATOM 0 H GLN A 55 -11.123 -6.239 0.686 1.00 0.00 H new ATOM 0 HA GLN A 55 -9.458 -8.533 1.319 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.307 -6.121 -0.419 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -7.783 -6.716 0.210 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -8.013 -7.958 -1.776 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.619 -9.078 -0.571 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -10.890 -9.283 -0.234 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.030 -8.957 -1.543 1.00 0.00 H new ATOM 917 N LEU A 56 -8.957 -5.565 2.671 1.00 0.00 N ATOM 918 CA LEU A 56 -8.348 -4.883 3.801 1.00 0.00 C ATOM 919 C LEU A 56 -8.656 -5.657 5.084 1.00 0.00 C ATOM 920 O LEU A 56 -7.915 -5.565 6.062 1.00 0.00 O ATOM 921 CB LEU A 56 -8.788 -3.419 3.844 1.00 0.00 C ATOM 922 CG LEU A 56 -9.002 -2.824 5.238 1.00 0.00 C ATOM 923 CD1 LEU A 56 -9.135 -1.302 5.170 1.00 0.00 C ATOM 924 CD2 LEU A 56 -10.200 -3.474 5.933 1.00 0.00 C ATOM 0 H LEU A 56 -9.486 -4.960 2.043 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.263 -4.862 3.694 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.039 -2.820 3.326 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.718 -3.323 3.283 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.121 -3.043 5.842 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.286 -0.905 6.174 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.226 -0.876 4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.987 -1.039 4.543 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -10.330 -3.033 6.921 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.099 -3.307 5.340 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -10.025 -4.545 6.033 1.00 0.00 H new ATOM 936 N GLN A 57 -9.750 -6.403 5.039 1.00 0.00 N ATOM 937 CA GLN A 57 -10.166 -7.192 6.187 1.00 0.00 C ATOM 938 C GLN A 57 -8.963 -7.917 6.795 1.00 0.00 C ATOM 939 O GLN A 57 -8.951 -8.210 7.990 1.00 0.00 O ATOM 940 CB GLN A 57 -11.266 -8.183 5.801 1.00 0.00 C ATOM 941 CG GLN A 57 -12.579 -7.847 6.511 1.00 0.00 C ATOM 942 CD GLN A 57 -12.620 -8.465 7.910 1.00 0.00 C ATOM 943 OE1 GLN A 57 -12.572 -9.672 8.085 1.00 0.00 O ATOM 944 NE2 GLN A 57 -12.711 -7.574 8.893 1.00 0.00 N ATOM 0 H GLN A 57 -10.361 -6.478 4.226 1.00 0.00 H new ATOM 0 HA GLN A 57 -10.578 -6.518 6.938 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -11.416 -8.163 4.722 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -10.956 -9.195 6.061 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -12.690 -6.765 6.584 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -13.419 -8.215 5.922 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -12.747 -6.578 8.677 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -12.745 -7.887 9.863 1.00 0.00 H new ATOM 953 N TYR A 58 -7.982 -8.185 5.946 1.00 0.00 N ATOM 954 CA TYR A 58 -6.779 -8.870 6.386 1.00 0.00 C ATOM 955 C TYR A 58 -5.863 -7.924 7.165 1.00 0.00 C ATOM 956 O TYR A 58 -5.469 -8.223 8.291 1.00 0.00 O ATOM 957 CB TYR A 58 -6.061 -9.321 5.112 1.00 0.00 C ATOM 958 CG TYR A 58 -6.966 -10.039 4.109 1.00 0.00 C ATOM 959 CD1 TYR A 58 -7.984 -10.854 4.559 1.00 0.00 C ATOM 960 CD2 TYR A 58 -6.765 -9.870 2.754 1.00 0.00 C ATOM 961 CE1 TYR A 58 -8.836 -11.530 3.614 1.00 0.00 C ATOM 962 CE2 TYR A 58 -7.616 -10.546 1.809 1.00 0.00 C ATOM 963 CZ TYR A 58 -8.610 -11.343 2.286 1.00 0.00 C ATOM 964 OH TYR A 58 -9.414 -11.981 1.395 1.00 0.00 O ATOM 0 H TYR A 58 -7.996 -7.940 4.956 1.00 0.00 H new ATOM 0 HA TYR A 58 -7.030 -9.703 7.042 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -5.619 -8.450 4.628 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -5.240 -9.984 5.385 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -8.142 -10.985 5.619 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -5.969 -9.230 2.402 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -9.636 -12.171 3.953 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -7.468 -10.423 0.746 1.00 0.00 H new ATOM 0 HH TYR A 58 -9.137 -11.754 0.483 1.00 0.00 H new ATOM 974 N MET A 59 -5.550 -6.801 6.534 1.00 0.00 N ATOM 975 CA MET A 59 -4.688 -5.809 7.154 1.00 0.00 C ATOM 976 C MET A 59 -5.403 -5.109 8.312 1.00 0.00 C ATOM 977 O MET A 59 -4.759 -4.619 9.238 1.00 0.00 O ATOM 978 CB MET A 59 -4.269 -4.773 6.110 1.00 0.00 C ATOM 979 CG MET A 59 -3.986 -5.437 4.761 1.00 0.00 C ATOM 980 SD MET A 59 -3.158 -6.998 5.012 1.00 0.00 S ATOM 981 CE MET A 59 -2.091 -7.017 3.580 1.00 0.00 C ATOM 0 H MET A 59 -5.878 -6.556 5.600 1.00 0.00 H new ATOM 0 HA MET A 59 -3.807 -6.315 7.549 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.057 -4.029 5.995 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.379 -4.245 6.453 1.00 0.00 H new ATOM 0 HG2 MET A 59 -4.919 -5.594 4.220 1.00 0.00 H new ATOM 0 HG3 MET A 59 -3.368 -4.782 4.147 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.771 -8.039 3.378 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.633 -6.629 2.717 1.00 0.00 H new ATOM 0 HE3 MET A 59 -1.217 -6.394 3.769 1.00 0.00 H new ATOM 991 N ARG A 60 -6.724 -5.083 8.221 1.00 0.00 N ATOM 992 CA ARG A 60 -7.533 -4.451 9.249 1.00 0.00 C ATOM 993 C ARG A 60 -7.177 -5.013 10.626 1.00 0.00 C ATOM 994 O ARG A 60 -7.238 -4.301 11.626 1.00 0.00 O ATOM 995 CB ARG A 60 -9.025 -4.668 8.987 1.00 0.00 C ATOM 996 CG ARG A 60 -9.672 -5.459 10.126 1.00 0.00 C ATOM 997 CD ARG A 60 -9.836 -4.589 11.374 1.00 0.00 C ATOM 998 NE ARG A 60 -9.306 -5.299 12.559 1.00 0.00 N ATOM 999 CZ ARG A 60 -8.882 -4.687 13.674 1.00 0.00 C ATOM 1000 NH1 ARG A 60 -8.924 -3.351 13.762 1.00 0.00 N ATOM 1001 NH2 ARG A 60 -8.417 -5.412 14.700 1.00 0.00 N ATOM 0 H ARG A 60 -7.255 -5.490 7.451 1.00 0.00 H new ATOM 0 HA ARG A 60 -7.323 -3.382 9.225 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.523 -3.704 8.880 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -9.159 -5.202 8.046 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.646 -5.831 9.808 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -9.060 -6.329 10.363 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -9.309 -3.644 11.240 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.889 -4.349 11.524 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.260 -6.317 12.526 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.279 -2.799 12.981 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.601 -2.885 14.610 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.386 -6.429 14.633 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.094 -4.947 15.548 1.00 0.00 H new ATOM 1015 N THR A 61 -6.811 -6.287 10.633 1.00 0.00 N ATOM 1016 CA THR A 61 -6.445 -6.954 11.871 1.00 0.00 C ATOM 1017 C THR A 61 -4.948 -6.788 12.143 1.00 0.00 C ATOM 1018 O THR A 61 -4.546 -6.501 13.269 1.00 0.00 O ATOM 1019 CB THR A 61 -6.886 -8.415 11.770 1.00 0.00 C ATOM 1020 OG1 THR A 61 -6.931 -8.668 10.368 1.00 0.00 O ATOM 1021 CG2 THR A 61 -8.329 -8.624 12.233 1.00 0.00 C ATOM 0 H THR A 61 -6.760 -6.875 9.801 1.00 0.00 H new ATOM 0 HA THR A 61 -6.951 -6.506 12.726 1.00 0.00 H new ATOM 0 HB THR A 61 -6.220 -9.037 12.367 1.00 0.00 H new ATOM 0 HG1 THR A 61 -6.042 -8.527 9.981 1.00 0.00 H new ATOM 0 HG21 THR A 61 -8.592 -9.678 12.141 1.00 0.00 H new ATOM 0 HG22 THR A 61 -8.425 -8.316 13.274 1.00 0.00 H new ATOM 0 HG23 THR A 61 -9.000 -8.028 11.614 1.00 0.00 H new ATOM 1029 N SER A 62 -4.164 -6.977 11.091 1.00 0.00 N ATOM 1030 CA SER A 62 -2.721 -6.852 11.203 1.00 0.00 C ATOM 1031 C SER A 62 -2.357 -5.486 11.789 1.00 0.00 C ATOM 1032 O SER A 62 -1.803 -5.405 12.884 1.00 0.00 O ATOM 1033 CB SER A 62 -2.045 -7.043 9.843 1.00 0.00 C ATOM 1034 OG SER A 62 -2.394 -8.287 9.244 1.00 0.00 O ATOM 0 H SER A 62 -4.501 -7.215 10.158 1.00 0.00 H new ATOM 0 HA SER A 62 -2.361 -7.634 11.871 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.331 -6.228 9.178 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.963 -6.990 9.965 1.00 0.00 H new ATOM 0 HG SER A 62 -3.321 -8.250 8.929 1.00 0.00 H new ATOM 1040 N CYS A 63 -2.684 -4.448 11.034 1.00 0.00 N ATOM 1041 CA CYS A 63 -2.399 -3.090 11.465 1.00 0.00 C ATOM 1042 C CYS A 63 -3.588 -2.587 12.286 1.00 0.00 C ATOM 1043 O CYS A 63 -4.732 -2.942 12.010 1.00 0.00 O ATOM 1044 CB CYS A 63 -2.095 -2.172 10.280 1.00 0.00 C ATOM 1045 SG CYS A 63 -0.307 -1.783 10.232 1.00 0.00 S ATOM 0 H CYS A 63 -3.144 -4.520 10.126 1.00 0.00 H new ATOM 0 HA CYS A 63 -1.502 -3.083 12.084 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.396 -2.654 9.350 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -2.674 -1.252 10.364 1.00 0.00 H new ATOM 0 HG CYS A 63 -0.063 -0.988 9.233 1.00 0.00 H new ATOM 1051 N PRO A 64 -3.267 -1.746 13.306 1.00 0.00 N ATOM 1052 CA PRO A 64 -4.296 -1.190 14.169 1.00 0.00 C ATOM 1053 C PRO A 64 -5.073 -0.083 13.454 1.00 0.00 C ATOM 1054 O PRO A 64 -6.234 0.170 13.770 1.00 0.00 O ATOM 1055 CB PRO A 64 -3.552 -0.695 15.399 1.00 0.00 C ATOM 1056 CG PRO A 64 -2.096 -0.568 14.982 1.00 0.00 C ATOM 1057 CD PRO A 64 -1.923 -1.303 13.663 1.00 0.00 C ATOM 0 HA PRO A 64 -5.054 -1.923 14.446 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -3.947 0.264 15.735 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -3.661 -1.393 16.229 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -1.820 0.481 14.873 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -1.442 -0.992 15.744 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -1.505 -0.649 12.897 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -1.242 -2.148 13.767 1.00 0.00 H new ATOM 1065 N GLN A 65 -4.400 0.548 12.502 1.00 0.00 N ATOM 1066 CA GLN A 65 -5.013 1.623 11.740 1.00 0.00 C ATOM 1067 C GLN A 65 -5.813 1.052 10.568 1.00 0.00 C ATOM 1068 O GLN A 65 -6.678 1.729 10.013 1.00 0.00 O ATOM 1069 CB GLN A 65 -3.959 2.618 11.251 1.00 0.00 C ATOM 1070 CG GLN A 65 -2.850 2.797 12.289 1.00 0.00 C ATOM 1071 CD GLN A 65 -1.903 3.931 11.891 1.00 0.00 C ATOM 1072 OE1 GLN A 65 -0.695 3.776 11.838 1.00 0.00 O ATOM 1073 NE2 GLN A 65 -2.519 5.078 11.614 1.00 0.00 N ATOM 0 H GLN A 65 -3.437 0.335 12.241 1.00 0.00 H new ATOM 0 HA GLN A 65 -5.698 2.162 12.394 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -3.530 2.267 10.312 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -4.429 3.580 11.046 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.290 3.011 13.263 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.288 1.868 12.390 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -3.535 5.140 11.678 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -1.975 5.895 11.338 1.00 0.00 H new ATOM 1082 N GLY A 66 -5.498 -0.189 10.225 1.00 0.00 N ATOM 1083 CA GLY A 66 -6.177 -0.859 9.129 1.00 0.00 C ATOM 1084 C GLY A 66 -6.549 0.134 8.026 1.00 0.00 C ATOM 1085 O GLY A 66 -5.704 0.515 7.218 1.00 0.00 O ATOM 0 H GLY A 66 -4.781 -0.748 10.687 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.534 -1.638 8.720 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.077 -1.350 9.500 1.00 0.00 H new ATOM 1089 N PRO A 67 -7.849 0.536 8.029 1.00 0.00 N ATOM 1090 CA PRO A 67 -8.343 1.477 7.039 1.00 0.00 C ATOM 1091 C PRO A 67 -7.867 2.898 7.348 1.00 0.00 C ATOM 1092 O PRO A 67 -7.539 3.658 6.438 1.00 0.00 O ATOM 1093 CB PRO A 67 -9.856 1.335 7.082 1.00 0.00 C ATOM 1094 CG PRO A 67 -10.174 0.666 8.409 1.00 0.00 C ATOM 1095 CD PRO A 67 -8.878 0.106 8.972 1.00 0.00 C ATOM 0 HA PRO A 67 -7.965 1.271 6.038 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -10.342 2.308 7.009 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -10.216 0.735 6.246 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -10.613 1.383 9.102 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -10.905 -0.130 8.269 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -8.683 0.489 9.973 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -8.916 -0.981 9.049 1.00 0.00 H new ATOM 1103 N VAL A 68 -7.845 3.214 8.634 1.00 0.00 N ATOM 1104 CA VAL A 68 -7.415 4.531 9.074 1.00 0.00 C ATOM 1105 C VAL A 68 -6.150 4.930 8.312 1.00 0.00 C ATOM 1106 O VAL A 68 -5.967 6.098 7.974 1.00 0.00 O ATOM 1107 CB VAL A 68 -7.227 4.539 10.593 1.00 0.00 C ATOM 1108 CG1 VAL A 68 -7.202 5.970 11.134 1.00 0.00 C ATOM 1109 CG2 VAL A 68 -8.310 3.710 11.284 1.00 0.00 C ATOM 0 H VAL A 68 -8.118 2.581 9.386 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.178 5.277 8.851 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.263 4.080 10.814 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -7.067 5.948 12.215 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.378 6.517 10.677 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -8.143 6.466 10.896 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.153 3.733 12.362 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.290 4.126 11.051 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.260 2.680 10.932 1.00 0.00 H new ATOM 1119 N SER A 69 -5.308 3.937 8.065 1.00 0.00 N ATOM 1120 CA SER A 69 -4.065 4.170 7.349 1.00 0.00 C ATOM 1121 C SER A 69 -4.345 4.334 5.854 1.00 0.00 C ATOM 1122 O SER A 69 -3.754 5.191 5.199 1.00 0.00 O ATOM 1123 CB SER A 69 -3.074 3.028 7.582 1.00 0.00 C ATOM 1124 OG SER A 69 -2.338 3.198 8.790 1.00 0.00 O ATOM 0 H SER A 69 -5.462 2.969 8.348 1.00 0.00 H new ATOM 0 HA SER A 69 -3.617 5.088 7.730 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.613 2.081 7.616 1.00 0.00 H new ATOM 0 HB3 SER A 69 -2.383 2.971 6.741 1.00 0.00 H new ATOM 0 HG SER A 69 -1.382 3.261 8.584 1.00 0.00 H new ATOM 1130 N LEU A 70 -5.247 3.499 5.358 1.00 0.00 N ATOM 1131 CA LEU A 70 -5.612 3.540 3.953 1.00 0.00 C ATOM 1132 C LEU A 70 -6.456 4.788 3.686 1.00 0.00 C ATOM 1133 O LEU A 70 -6.089 5.627 2.865 1.00 0.00 O ATOM 1134 CB LEU A 70 -6.295 2.236 3.538 1.00 0.00 C ATOM 1135 CG LEU A 70 -5.464 0.962 3.702 1.00 0.00 C ATOM 1136 CD1 LEU A 70 -4.234 1.218 4.576 1.00 0.00 C ATOM 1137 CD2 LEU A 70 -6.320 -0.186 4.240 1.00 0.00 C ATOM 0 H LEU A 70 -5.736 2.790 5.905 1.00 0.00 H new ATOM 0 HA LEU A 70 -4.721 3.618 3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.210 2.127 4.120 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.591 2.321 2.492 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.103 0.661 2.718 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -3.661 0.296 4.676 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.612 1.984 4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -4.552 1.557 5.562 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.705 -1.079 4.347 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.731 0.090 5.211 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.136 -0.388 3.546 1.00 0.00 H new ATOM 1149 N GLN A 71 -7.572 4.872 4.396 1.00 0.00 N ATOM 1150 CA GLN A 71 -8.471 6.003 4.247 1.00 0.00 C ATOM 1151 C GLN A 71 -7.695 7.317 4.363 1.00 0.00 C ATOM 1152 O GLN A 71 -8.016 8.293 3.686 1.00 0.00 O ATOM 1153 CB GLN A 71 -9.604 5.943 5.274 1.00 0.00 C ATOM 1154 CG GLN A 71 -10.097 4.507 5.462 1.00 0.00 C ATOM 1155 CD GLN A 71 -11.626 4.450 5.477 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -12.253 4.199 6.493 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -12.188 4.695 4.297 1.00 0.00 N ATOM 0 H GLN A 71 -7.874 4.174 5.076 1.00 0.00 H new ATOM 0 HA GLN A 71 -8.921 5.956 3.255 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -9.257 6.340 6.228 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -10.430 6.575 4.947 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.714 3.879 4.658 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -9.705 4.103 6.396 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -11.604 4.898 3.486 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.204 4.680 4.203 1.00 0.00 H new ATOM 1166 N ARG A 72 -6.690 7.299 5.225 1.00 0.00 N ATOM 1167 CA ARG A 72 -5.866 8.477 5.439 1.00 0.00 C ATOM 1168 C ARG A 72 -4.847 8.624 4.306 1.00 0.00 C ATOM 1169 O ARG A 72 -4.284 9.700 4.110 1.00 0.00 O ATOM 1170 CB ARG A 72 -5.125 8.396 6.775 1.00 0.00 C ATOM 1171 CG ARG A 72 -6.079 8.638 7.946 1.00 0.00 C ATOM 1172 CD ARG A 72 -6.495 10.108 8.021 1.00 0.00 C ATOM 1173 NE ARG A 72 -6.466 10.572 9.426 1.00 0.00 N ATOM 1174 CZ ARG A 72 -6.481 11.860 9.793 1.00 0.00 C ATOM 1175 NH1 ARG A 72 -6.524 12.822 8.860 1.00 0.00 N ATOM 1176 NH2 ARG A 72 -6.453 12.188 11.092 1.00 0.00 N ATOM 0 H ARG A 72 -6.427 6.487 5.784 1.00 0.00 H new ATOM 0 HA ARG A 72 -6.525 9.345 5.455 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -4.659 7.416 6.878 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -4.323 9.134 6.796 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -6.964 8.011 7.834 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -5.597 8.345 8.879 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -5.823 10.716 7.415 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -7.496 10.232 7.609 1.00 0.00 H new ATOM 0 HE ARG A 72 -6.432 9.866 10.162 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -6.545 12.573 7.871 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -6.535 13.803 9.139 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -6.420 11.457 11.802 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -6.464 13.169 11.371 1.00 0.00 H new ATOM 1190 N GLN A 73 -4.642 7.527 3.592 1.00 0.00 N ATOM 1191 CA GLN A 73 -3.701 7.521 2.485 1.00 0.00 C ATOM 1192 C GLN A 73 -4.206 8.419 1.354 1.00 0.00 C ATOM 1193 O GLN A 73 -3.424 9.128 0.723 1.00 0.00 O ATOM 1194 CB GLN A 73 -3.453 6.097 1.984 1.00 0.00 C ATOM 1195 CG GLN A 73 -4.208 5.834 0.680 1.00 0.00 C ATOM 1196 CD GLN A 73 -3.512 6.511 -0.503 1.00 0.00 C ATOM 1197 OE1 GLN A 73 -3.996 7.474 -1.073 1.00 0.00 O ATOM 1198 NE2 GLN A 73 -2.351 5.954 -0.838 1.00 0.00 N ATOM 0 H GLN A 73 -5.111 6.637 3.758 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.750 7.917 2.841 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.385 5.944 1.827 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.770 5.381 2.742 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.272 4.760 0.503 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -5.230 6.204 0.766 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.003 5.148 -0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.809 6.333 -1.615 1.00 0.00 H new ATOM 1207 N ILE A 74 -5.511 8.359 1.131 1.00 0.00 N ATOM 1208 CA ILE A 74 -6.130 9.159 0.088 1.00 0.00 C ATOM 1209 C ILE A 74 -5.959 10.643 0.418 1.00 0.00 C ATOM 1210 O ILE A 74 -5.478 10.991 1.496 1.00 0.00 O ATOM 1211 CB ILE A 74 -7.586 8.738 -0.117 1.00 0.00 C ATOM 1212 CG1 ILE A 74 -7.828 8.281 -1.557 1.00 0.00 C ATOM 1213 CG2 ILE A 74 -8.544 9.857 0.298 1.00 0.00 C ATOM 1214 CD1 ILE A 74 -9.277 8.537 -1.978 1.00 0.00 C ATOM 0 H ILE A 74 -6.157 7.768 1.655 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.635 8.987 -0.868 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.788 7.884 0.530 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -7.152 8.810 -2.229 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -7.601 7.219 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -9.573 9.532 0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.394 10.093 1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.349 10.745 -0.304 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -9.422 8.203 -3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.950 7.987 -1.320 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.493 9.603 -1.909 1.00 0.00 H new ATOM 1226 N PRO A 75 -6.372 11.499 -0.553 1.00 0.00 N ATOM 1227 CA PRO A 75 -6.270 12.938 -0.376 1.00 0.00 C ATOM 1228 C PRO A 75 -7.347 13.450 0.583 1.00 0.00 C ATOM 1229 O PRO A 75 -7.091 14.342 1.390 1.00 0.00 O ATOM 1230 CB PRO A 75 -6.397 13.517 -1.776 1.00 0.00 C ATOM 1231 CG PRO A 75 -7.027 12.424 -2.623 1.00 0.00 C ATOM 1232 CD PRO A 75 -6.947 11.123 -1.842 1.00 0.00 C ATOM 0 HA PRO A 75 -5.328 13.240 0.081 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.016 14.414 -1.773 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -5.422 13.804 -2.170 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -8.064 12.669 -2.851 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.505 12.330 -3.575 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.932 10.673 -1.720 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.324 10.391 -2.355 1.00 0.00 H new ATOM 1240 N LYS A 76 -8.529 12.864 0.462 1.00 0.00 N ATOM 1241 CA LYS A 76 -9.645 13.250 1.308 1.00 0.00 C ATOM 1242 C LYS A 76 -9.973 12.104 2.267 1.00 0.00 C ATOM 1243 O LYS A 76 -10.763 11.220 1.937 1.00 0.00 O ATOM 1244 CB LYS A 76 -10.834 13.697 0.455 1.00 0.00 C ATOM 1245 CG LYS A 76 -10.377 14.600 -0.693 1.00 0.00 C ATOM 1246 CD LYS A 76 -11.004 15.991 -0.578 1.00 0.00 C ATOM 1247 CE LYS A 76 -11.036 16.691 -1.938 1.00 0.00 C ATOM 1248 NZ LYS A 76 -11.874 17.909 -1.874 1.00 0.00 N ATOM 0 H LYS A 76 -8.738 12.125 -0.209 1.00 0.00 H new ATOM 0 HA LYS A 76 -9.379 14.112 1.920 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -11.347 12.823 0.053 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -11.553 14.230 1.078 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.290 14.685 -0.683 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -10.653 14.150 -1.647 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -12.017 15.906 -0.185 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -10.436 16.593 0.132 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.023 16.955 -2.242 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.429 16.011 -2.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -11.885 18.372 -2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.844 17.649 -1.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.482 18.563 -1.167 1.00 0.00 H new ATOM 1262 N LEU A 77 -9.350 12.155 3.435 1.00 0.00 N ATOM 1263 CA LEU A 77 -9.565 11.133 4.444 1.00 0.00 C ATOM 1264 C LEU A 77 -10.962 11.302 5.046 1.00 0.00 C ATOM 1265 O LEU A 77 -11.797 10.405 4.948 1.00 0.00 O ATOM 1266 CB LEU A 77 -8.441 11.158 5.482 1.00 0.00 C ATOM 1267 CG LEU A 77 -7.124 11.791 5.028 1.00 0.00 C ATOM 1268 CD1 LEU A 77 -6.836 11.465 3.561 1.00 0.00 C ATOM 1269 CD2 LEU A 77 -7.120 13.298 5.291 1.00 0.00 C ATOM 0 H LEU A 77 -8.696 12.889 3.705 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.529 10.141 3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.796 11.697 6.361 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.240 10.134 5.796 1.00 0.00 H new ATOM 0 HG LEU A 77 -6.316 11.359 5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.894 11.927 3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.766 10.385 3.435 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.642 11.851 2.937 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.173 13.723 4.959 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.939 13.765 4.744 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -7.246 13.481 6.358 1.00 0.00 H new ATOM 1281 N ASP A 78 -11.172 12.460 5.656 1.00 0.00 N ATOM 1282 CA ASP A 78 -12.452 12.759 6.273 1.00 0.00 C ATOM 1283 C ASP A 78 -13.580 12.342 5.327 1.00 0.00 C ATOM 1284 O ASP A 78 -14.693 12.060 5.768 1.00 0.00 O ATOM 1285 CB ASP A 78 -12.595 14.257 6.548 1.00 0.00 C ATOM 1286 CG ASP A 78 -12.180 15.169 5.392 1.00 0.00 C ATOM 1287 OD1 ASP A 78 -11.052 14.973 4.891 1.00 0.00 O ATOM 1288 OD2 ASP A 78 -13.001 16.042 5.035 1.00 0.00 O ATOM 0 H ASP A 78 -10.476 13.202 5.736 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.507 12.213 7.215 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -13.634 14.467 6.802 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -11.996 14.509 7.423 1.00 0.00 H new ATOM 1293 N SER A 79 -13.253 12.317 4.043 1.00 0.00 N ATOM 1294 CA SER A 79 -14.224 11.940 3.031 1.00 0.00 C ATOM 1295 C SER A 79 -14.304 10.416 2.924 1.00 0.00 C ATOM 1296 O SER A 79 -15.361 9.829 3.148 1.00 0.00 O ATOM 1297 CB SER A 79 -13.869 12.549 1.673 1.00 0.00 C ATOM 1298 OG SER A 79 -14.730 13.632 1.332 1.00 0.00 O ATOM 0 H SER A 79 -12.329 12.552 3.681 1.00 0.00 H new ATOM 0 HA SER A 79 -15.197 12.329 3.330 1.00 0.00 H new ATOM 0 HB2 SER A 79 -12.837 12.898 1.691 1.00 0.00 H new ATOM 0 HB3 SER A 79 -13.932 11.780 0.903 1.00 0.00 H new ATOM 0 HG SER A 79 -14.470 13.995 0.460 1.00 0.00 H new ATOM 1304 N VAL A 80 -13.172 9.818 2.583 1.00 0.00 N ATOM 1305 CA VAL A 80 -13.100 8.374 2.444 1.00 0.00 C ATOM 1306 C VAL A 80 -13.098 7.732 3.832 1.00 0.00 C ATOM 1307 O VAL A 80 -13.740 6.704 4.046 1.00 0.00 O ATOM 1308 CB VAL A 80 -11.880 7.988 1.605 1.00 0.00 C ATOM 1309 CG1 VAL A 80 -10.583 8.234 2.378 1.00 0.00 C ATOM 1310 CG2 VAL A 80 -11.972 6.534 1.138 1.00 0.00 C ATOM 0 H VAL A 80 -12.297 10.308 2.399 1.00 0.00 H new ATOM 0 HA VAL A 80 -13.974 7.998 1.913 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.869 8.624 0.720 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.731 7.951 1.759 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -10.509 9.290 2.637 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.584 7.636 3.289 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.092 6.286 0.544 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.021 5.876 2.005 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.868 6.403 0.531 1.00 0.00 H new ATOM 1320 N LEU A 81 -12.368 8.364 4.740 1.00 0.00 N ATOM 1321 CA LEU A 81 -12.274 7.867 6.102 1.00 0.00 C ATOM 1322 C LEU A 81 -13.681 7.719 6.685 1.00 0.00 C ATOM 1323 O LEU A 81 -13.871 7.040 7.694 1.00 0.00 O ATOM 1324 CB LEU A 81 -11.354 8.761 6.936 1.00 0.00 C ATOM 1325 CG LEU A 81 -12.028 9.927 7.661 1.00 0.00 C ATOM 1326 CD1 LEU A 81 -13.044 9.421 8.688 1.00 0.00 C ATOM 1327 CD2 LEU A 81 -10.989 10.855 8.293 1.00 0.00 C ATOM 0 H LEU A 81 -11.836 9.215 4.559 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.817 6.877 6.116 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -10.852 8.140 7.678 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.581 9.164 6.281 1.00 0.00 H new ATOM 0 HG LEU A 81 -12.578 10.514 6.925 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -13.509 10.270 9.189 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.811 8.834 8.182 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.537 8.798 9.425 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.495 11.675 8.802 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.391 10.295 9.013 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.339 11.256 7.516 1.00 0.00 H new ATOM 1339 N LYS A 82 -14.631 8.365 6.026 1.00 0.00 N ATOM 1340 CA LYS A 82 -16.015 8.314 6.466 1.00 0.00 C ATOM 1341 C LYS A 82 -16.826 7.462 5.487 1.00 0.00 C ATOM 1342 O LYS A 82 -16.729 6.236 5.498 1.00 0.00 O ATOM 1343 CB LYS A 82 -16.569 9.727 6.657 1.00 0.00 C ATOM 1344 CG LYS A 82 -16.651 10.088 8.141 1.00 0.00 C ATOM 1345 CD LYS A 82 -17.519 9.084 8.902 1.00 0.00 C ATOM 1346 CE LYS A 82 -18.907 9.662 9.184 1.00 0.00 C ATOM 1347 NZ LYS A 82 -19.388 9.230 10.515 1.00 0.00 N ATOM 0 H LYS A 82 -14.470 8.927 5.190 1.00 0.00 H new ATOM 0 HA LYS A 82 -16.087 7.834 7.442 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -15.932 10.444 6.139 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -17.559 9.797 6.207 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -15.649 10.107 8.570 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -17.065 11.090 8.253 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -17.614 8.167 8.321 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -17.034 8.818 9.841 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -18.870 10.750 9.140 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -19.607 9.336 8.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -20.331 9.631 10.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -19.442 8.192 10.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -18.729 9.563 11.247 1.00 0.00 H new ATOM 1361 N TYR A 83 -17.607 8.146 4.664 1.00 0.00 N ATOM 1362 CA TYR A 83 -18.434 7.467 3.681 1.00 0.00 C ATOM 1363 C TYR A 83 -18.463 8.241 2.361 1.00 0.00 C ATOM 1364 O TYR A 83 -19.159 7.852 1.424 1.00 0.00 O ATOM 1365 CB TYR A 83 -19.845 7.432 4.269 1.00 0.00 C ATOM 1366 CG TYR A 83 -20.583 6.112 4.037 1.00 0.00 C ATOM 1367 CD1 TYR A 83 -20.478 5.090 4.959 1.00 0.00 C ATOM 1368 CD2 TYR A 83 -21.355 5.943 2.905 1.00 0.00 C ATOM 1369 CE1 TYR A 83 -21.173 3.848 4.740 1.00 0.00 C ATOM 1370 CE2 TYR A 83 -22.050 4.701 2.686 1.00 0.00 C ATOM 1371 CZ TYR A 83 -21.924 3.715 3.614 1.00 0.00 C ATOM 1372 OH TYR A 83 -22.581 2.542 3.407 1.00 0.00 O ATOM 0 H TYR A 83 -17.685 9.163 4.658 1.00 0.00 H new ATOM 0 HA TYR A 83 -18.043 6.471 3.473 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -19.786 7.620 5.341 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -20.429 8.244 3.835 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -19.874 5.222 5.845 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -21.438 6.742 2.184 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -21.100 3.041 5.454 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -22.657 4.556 1.805 1.00 0.00 H new ATOM 0 HH TYR A 83 -23.078 2.590 2.564 1.00 0.00 H new ATOM 1382 N LYS A 84 -17.700 9.324 2.330 1.00 0.00 N ATOM 1383 CA LYS A 84 -17.631 10.156 1.141 1.00 0.00 C ATOM 1384 C LYS A 84 -17.103 9.324 -0.029 1.00 0.00 C ATOM 1385 O LYS A 84 -17.432 8.145 -0.155 1.00 0.00 O ATOM 1386 CB LYS A 84 -16.810 11.418 1.417 1.00 0.00 C ATOM 1387 CG LYS A 84 -17.584 12.675 1.012 1.00 0.00 C ATOM 1388 CD LYS A 84 -18.155 12.536 -0.400 1.00 0.00 C ATOM 1389 CE LYS A 84 -17.302 13.300 -1.414 1.00 0.00 C ATOM 1390 NZ LYS A 84 -17.623 14.744 -1.377 1.00 0.00 N ATOM 0 H LYS A 84 -17.125 9.644 3.109 1.00 0.00 H new ATOM 0 HA LYS A 84 -18.626 10.504 0.862 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.557 11.468 2.476 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.870 11.372 0.867 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -18.394 12.852 1.720 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -16.926 13.542 1.058 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -18.198 11.483 -0.676 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -19.177 12.914 -0.422 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.245 13.151 -1.195 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.478 12.908 -2.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -17.035 15.248 -2.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -18.627 14.882 -1.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -17.432 15.118 -0.425 1.00 0.00 H new ATOM 1404 N HIS A 85 -16.293 9.969 -0.856 1.00 0.00 N ATOM 1405 CA HIS A 85 -15.716 9.303 -2.011 1.00 0.00 C ATOM 1406 C HIS A 85 -15.529 7.816 -1.705 1.00 0.00 C ATOM 1407 O HIS A 85 -15.612 6.978 -2.602 1.00 0.00 O ATOM 1408 CB HIS A 85 -14.418 9.988 -2.441 1.00 0.00 C ATOM 1409 CG HIS A 85 -14.585 11.442 -2.815 1.00 0.00 C ATOM 1410 ND1 HIS A 85 -15.683 11.915 -3.512 1.00 0.00 N ATOM 1411 CD2 HIS A 85 -13.783 12.520 -2.580 1.00 0.00 C ATOM 1412 CE1 HIS A 85 -15.537 13.221 -3.685 1.00 0.00 C ATOM 1413 NE2 HIS A 85 -14.359 13.593 -3.107 1.00 0.00 N ATOM 0 H HIS A 85 -16.023 10.947 -0.749 1.00 0.00 H new ATOM 0 HA HIS A 85 -16.397 9.381 -2.858 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -13.694 9.913 -1.630 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -14.000 9.450 -3.292 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -12.840 12.503 -2.054 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -16.229 13.875 -4.194 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -13.982 14.541 -3.084 1.00 0.00 H new ATOM 1421 N THR A 86 -15.280 7.532 -0.435 1.00 0.00 N ATOM 1422 CA THR A 86 -15.080 6.161 0.001 1.00 0.00 C ATOM 1423 C THR A 86 -16.132 5.243 -0.626 1.00 0.00 C ATOM 1424 O THR A 86 -15.870 4.066 -0.866 1.00 0.00 O ATOM 1425 CB THR A 86 -15.092 6.144 1.530 1.00 0.00 C ATOM 1426 OG1 THR A 86 -15.569 4.842 1.859 1.00 0.00 O ATOM 1427 CG2 THR A 86 -16.145 7.086 2.118 1.00 0.00 C ATOM 0 H THR A 86 -15.212 8.229 0.307 1.00 0.00 H new ATOM 0 HA THR A 86 -14.117 5.776 -0.334 1.00 0.00 H new ATOM 0 HB THR A 86 -14.107 6.423 1.904 1.00 0.00 H new ATOM 0 HG1 THR A 86 -15.607 4.744 2.833 1.00 0.00 H new ATOM 0 HG21 THR A 86 -16.111 7.036 3.206 1.00 0.00 H new ATOM 0 HG22 THR A 86 -15.941 8.107 1.796 1.00 0.00 H new ATOM 0 HG23 THR A 86 -17.134 6.787 1.772 1.00 0.00 H new ATOM 1435 N ASP A 87 -17.300 5.818 -0.874 1.00 0.00 N ATOM 1436 CA ASP A 87 -18.392 5.067 -1.468 1.00 0.00 C ATOM 1437 C ASP A 87 -17.833 4.104 -2.516 1.00 0.00 C ATOM 1438 O ASP A 87 -16.648 3.772 -2.490 1.00 0.00 O ATOM 1439 CB ASP A 87 -19.386 5.999 -2.165 1.00 0.00 C ATOM 1440 CG ASP A 87 -20.846 5.820 -1.742 1.00 0.00 C ATOM 1441 OD1 ASP A 87 -21.058 5.172 -0.695 1.00 0.00 O ATOM 1442 OD2 ASP A 87 -21.716 6.336 -2.476 1.00 0.00 O ATOM 0 H ASP A 87 -17.513 6.795 -0.674 1.00 0.00 H new ATOM 0 HA ASP A 87 -18.902 4.526 -0.671 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -19.091 7.030 -1.971 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -19.314 5.843 -3.241 1.00 0.00 H new ATOM 1447 N PRO A 88 -18.734 3.670 -3.438 1.00 0.00 N ATOM 1448 CA PRO A 88 -18.342 2.751 -4.493 1.00 0.00 C ATOM 1449 C PRO A 88 -17.531 3.470 -5.573 1.00 0.00 C ATOM 1450 O PRO A 88 -17.436 2.994 -6.703 1.00 0.00 O ATOM 1451 CB PRO A 88 -19.647 2.173 -5.016 1.00 0.00 C ATOM 1452 CG PRO A 88 -20.738 3.128 -4.558 1.00 0.00 C ATOM 1453 CD PRO A 88 -20.144 4.042 -3.500 1.00 0.00 C ATOM 0 HA PRO A 88 -17.685 1.958 -4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -19.630 2.091 -6.103 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -19.815 1.170 -4.623 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -21.113 3.711 -5.399 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -21.584 2.574 -4.152 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -20.265 5.091 -3.770 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -20.633 3.902 -2.536 1.00 0.00 H new ATOM 1461 N THR A 89 -16.967 4.605 -5.187 1.00 0.00 N ATOM 1462 CA THR A 89 -16.167 5.395 -6.108 1.00 0.00 C ATOM 1463 C THR A 89 -14.723 4.891 -6.127 1.00 0.00 C ATOM 1464 O THR A 89 -14.108 4.797 -7.189 1.00 0.00 O ATOM 1465 CB THR A 89 -16.293 6.865 -5.703 1.00 0.00 C ATOM 1466 OG1 THR A 89 -16.327 7.565 -6.944 1.00 0.00 O ATOM 1467 CG2 THR A 89 -15.033 7.391 -5.013 1.00 0.00 C ATOM 0 H THR A 89 -17.048 4.997 -4.249 1.00 0.00 H new ATOM 0 HA THR A 89 -16.527 5.294 -7.132 1.00 0.00 H new ATOM 0 HB THR A 89 -17.149 6.987 -5.039 1.00 0.00 H new ATOM 0 HG1 THR A 89 -16.409 8.527 -6.775 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.175 8.438 -4.746 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.842 6.809 -4.111 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.183 7.301 -5.689 1.00 0.00 H new ATOM 1475 N PHE A 90 -14.223 4.579 -4.941 1.00 0.00 N ATOM 1476 CA PHE A 90 -12.862 4.087 -4.808 1.00 0.00 C ATOM 1477 C PHE A 90 -12.847 2.576 -4.569 1.00 0.00 C ATOM 1478 O PHE A 90 -11.839 1.915 -4.817 1.00 0.00 O ATOM 1479 CB PHE A 90 -12.249 4.789 -3.594 1.00 0.00 C ATOM 1480 CG PHE A 90 -11.807 6.228 -3.866 1.00 0.00 C ATOM 1481 CD1 PHE A 90 -11.039 6.510 -4.952 1.00 0.00 C ATOM 1482 CD2 PHE A 90 -12.182 7.226 -3.021 1.00 0.00 C ATOM 1483 CE1 PHE A 90 -10.628 7.846 -5.205 1.00 0.00 C ATOM 1484 CE2 PHE A 90 -11.771 8.562 -3.273 1.00 0.00 C ATOM 1485 CZ PHE A 90 -11.003 8.844 -4.360 1.00 0.00 C ATOM 0 H PHE A 90 -14.736 4.657 -4.063 1.00 0.00 H new ATOM 0 HA PHE A 90 -12.302 4.290 -5.721 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -12.976 4.790 -2.782 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -11.389 4.214 -3.251 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -10.741 5.718 -5.623 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -12.792 7.002 -2.158 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -10.018 8.069 -6.068 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -12.068 9.354 -2.602 1.00 0.00 H new ATOM 0 HZ PHE A 90 -10.691 9.860 -4.552 1.00 0.00 H new ATOM 1495 N GLY A 91 -13.975 2.073 -4.091 1.00 0.00 N ATOM 1496 CA GLY A 91 -14.104 0.652 -3.817 1.00 0.00 C ATOM 1497 C GLY A 91 -13.555 -0.183 -4.976 1.00 0.00 C ATOM 1498 O GLY A 91 -12.638 0.246 -5.674 1.00 0.00 O ATOM 0 H GLY A 91 -14.808 2.624 -3.886 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -13.568 0.405 -2.901 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.152 0.404 -3.650 1.00 0.00 H new ATOM 1502 N MET A 92 -14.140 -1.360 -5.145 1.00 0.00 N ATOM 1503 CA MET A 92 -13.721 -2.258 -6.207 1.00 0.00 C ATOM 1504 C MET A 92 -12.554 -1.664 -6.999 1.00 0.00 C ATOM 1505 O MET A 92 -11.432 -2.163 -6.925 1.00 0.00 O ATOM 1506 CB MET A 92 -14.898 -2.518 -7.150 1.00 0.00 C ATOM 1507 CG MET A 92 -15.766 -1.267 -7.300 1.00 0.00 C ATOM 1508 SD MET A 92 -16.931 -1.167 -5.951 1.00 0.00 S ATOM 1509 CE MET A 92 -16.789 0.566 -5.547 1.00 0.00 C ATOM 0 H MET A 92 -14.901 -1.712 -4.564 1.00 0.00 H new ATOM 0 HA MET A 92 -13.391 -3.194 -5.757 1.00 0.00 H new ATOM 0 HB2 MET A 92 -14.525 -2.826 -8.127 1.00 0.00 H new ATOM 0 HB3 MET A 92 -15.502 -3.340 -6.766 1.00 0.00 H new ATOM 0 HG2 MET A 92 -15.137 -0.377 -7.315 1.00 0.00 H new ATOM 0 HG3 MET A 92 -16.299 -1.296 -8.250 1.00 0.00 H new ATOM 0 HE1 MET A 92 -16.880 0.697 -4.469 1.00 0.00 H new ATOM 0 HE2 MET A 92 -15.819 0.938 -5.877 1.00 0.00 H new ATOM 0 HE3 MET A 92 -17.581 1.123 -6.048 1.00 0.00 H new ATOM 1519 N ASP A 93 -12.859 -0.608 -7.738 1.00 0.00 N ATOM 1520 CA ASP A 93 -11.849 0.059 -8.542 1.00 0.00 C ATOM 1521 C ASP A 93 -11.549 1.433 -7.941 1.00 0.00 C ATOM 1522 O ASP A 93 -12.348 2.360 -8.072 1.00 0.00 O ATOM 1523 CB ASP A 93 -12.337 0.267 -9.977 1.00 0.00 C ATOM 1524 CG ASP A 93 -11.731 -0.683 -11.011 1.00 0.00 C ATOM 1525 OD1 ASP A 93 -10.585 -1.123 -10.774 1.00 0.00 O ATOM 1526 OD2 ASP A 93 -12.426 -0.948 -12.016 1.00 0.00 O ATOM 0 H ASP A 93 -13.791 -0.198 -7.797 1.00 0.00 H new ATOM 0 HA ASP A 93 -10.957 -0.568 -8.551 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -13.421 0.156 -9.996 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.116 1.292 -10.275 1.00 0.00 H new ATOM 1531 N LEU A 94 -10.397 1.522 -7.293 1.00 0.00 N ATOM 1532 CA LEU A 94 -9.982 2.767 -6.671 1.00 0.00 C ATOM 1533 C LEU A 94 -9.176 3.592 -7.677 1.00 0.00 C ATOM 1534 O LEU A 94 -9.470 4.764 -7.901 1.00 0.00 O ATOM 1535 CB LEU A 94 -9.236 2.491 -5.364 1.00 0.00 C ATOM 1536 CG LEU A 94 -7.981 3.331 -5.117 1.00 0.00 C ATOM 1537 CD1 LEU A 94 -8.334 4.660 -4.447 1.00 0.00 C ATOM 1538 CD2 LEU A 94 -6.942 2.543 -4.317 1.00 0.00 C ATOM 0 H LEU A 94 -9.738 0.751 -7.185 1.00 0.00 H new ATOM 0 HA LEU A 94 -10.852 3.363 -6.395 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -9.925 2.651 -4.535 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.954 1.438 -5.345 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.532 3.567 -6.082 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.424 5.238 -4.283 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.010 5.223 -5.090 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -8.819 4.467 -3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.060 3.163 -4.156 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.365 2.256 -3.354 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.659 1.647 -4.870 1.00 0.00 H new ATOM 1550 N GLN A 95 -8.174 2.945 -8.255 1.00 0.00 N ATOM 1551 CA GLN A 95 -7.324 3.604 -9.232 1.00 0.00 C ATOM 1552 C GLN A 95 -8.176 4.321 -10.280 1.00 0.00 C ATOM 1553 O GLN A 95 -7.767 5.347 -10.822 1.00 0.00 O ATOM 1554 CB GLN A 95 -6.370 2.605 -9.890 1.00 0.00 C ATOM 1555 CG GLN A 95 -5.093 3.299 -10.368 1.00 0.00 C ATOM 1556 CD GLN A 95 -4.974 3.239 -11.892 1.00 0.00 C ATOM 1557 OE1 GLN A 95 -4.681 4.219 -12.557 1.00 0.00 O ATOM 1558 NE2 GLN A 95 -5.217 2.037 -12.407 1.00 0.00 N ATOM 0 H GLN A 95 -7.932 1.972 -8.066 1.00 0.00 H new ATOM 0 HA GLN A 95 -6.719 4.348 -8.715 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.116 1.818 -9.180 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -6.865 2.126 -10.734 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.095 4.339 -10.041 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -4.224 2.823 -9.913 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -5.457 1.258 -11.793 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.163 1.894 -13.415 1.00 0.00 H new ATOM 1567 N LYS A 96 -9.345 3.752 -10.536 1.00 0.00 N ATOM 1568 CA LYS A 96 -10.259 4.325 -11.510 1.00 0.00 C ATOM 1569 C LYS A 96 -10.637 5.743 -11.077 1.00 0.00 C ATOM 1570 O LYS A 96 -10.993 6.576 -11.909 1.00 0.00 O ATOM 1571 CB LYS A 96 -11.463 3.405 -11.720 1.00 0.00 C ATOM 1572 CG LYS A 96 -11.027 2.050 -12.282 1.00 0.00 C ATOM 1573 CD LYS A 96 -9.880 2.215 -13.282 1.00 0.00 C ATOM 1574 CE LYS A 96 -10.294 3.115 -14.448 1.00 0.00 C ATOM 1575 NZ LYS A 96 -10.310 2.349 -15.714 1.00 0.00 N ATOM 0 H LYS A 96 -9.680 2.900 -10.086 1.00 0.00 H new ATOM 0 HA LYS A 96 -9.775 4.407 -12.483 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.983 3.260 -10.773 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.170 3.876 -12.403 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.713 1.398 -11.467 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.873 1.565 -12.770 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -9.013 2.642 -12.779 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -9.580 1.238 -13.661 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -11.282 3.535 -14.258 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.602 3.953 -14.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -10.593 2.975 -16.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -9.360 1.969 -15.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -10.988 1.564 -15.636 1.00 0.00 H new ATOM 1589 N CYS A 97 -10.546 5.973 -9.775 1.00 0.00 N ATOM 1590 CA CYS A 97 -10.874 7.276 -9.221 1.00 0.00 C ATOM 1591 C CYS A 97 -9.567 8.008 -8.908 1.00 0.00 C ATOM 1592 O CYS A 97 -9.401 9.171 -9.271 1.00 0.00 O ATOM 1593 CB CYS A 97 -11.771 7.157 -7.988 1.00 0.00 C ATOM 1594 SG CYS A 97 -12.401 8.807 -7.510 1.00 0.00 S ATOM 0 H CYS A 97 -10.250 5.279 -9.088 1.00 0.00 H new ATOM 0 HA CYS A 97 -11.445 7.851 -9.950 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -12.605 6.487 -8.198 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -11.211 6.719 -7.162 1.00 0.00 H new ATOM 0 HG CYS A 97 -11.954 9.117 -6.329 1.00 0.00 H new ATOM 1600 N VAL A 98 -8.673 7.295 -8.238 1.00 0.00 N ATOM 1601 CA VAL A 98 -7.387 7.862 -7.872 1.00 0.00 C ATOM 1602 C VAL A 98 -6.511 7.978 -9.122 1.00 0.00 C ATOM 1603 O VAL A 98 -5.532 8.722 -9.131 1.00 0.00 O ATOM 1604 CB VAL A 98 -6.741 7.026 -6.766 1.00 0.00 C ATOM 1605 CG1 VAL A 98 -5.217 7.148 -6.804 1.00 0.00 C ATOM 1606 CG2 VAL A 98 -7.289 7.418 -5.392 1.00 0.00 C ATOM 0 H VAL A 98 -8.814 6.330 -7.939 1.00 0.00 H new ATOM 0 HA VAL A 98 -7.514 8.867 -7.469 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.997 5.981 -6.943 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -4.784 6.544 -6.007 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -4.848 6.797 -7.768 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -4.932 8.191 -6.665 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.813 6.809 -4.623 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -7.078 8.471 -5.203 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -8.366 7.254 -5.370 1.00 0.00 H new ATOM 1616 N GLN A 99 -6.896 7.231 -10.146 1.00 0.00 N ATOM 1617 CA GLN A 99 -6.158 7.240 -11.398 1.00 0.00 C ATOM 1618 C GLN A 99 -5.630 8.646 -11.692 1.00 0.00 C ATOM 1619 O GLN A 99 -4.599 8.801 -12.345 1.00 0.00 O ATOM 1620 CB GLN A 99 -7.026 6.728 -12.550 1.00 0.00 C ATOM 1621 CG GLN A 99 -8.472 7.205 -12.400 1.00 0.00 C ATOM 1622 CD GLN A 99 -8.728 8.454 -13.245 1.00 0.00 C ATOM 1623 OE1 GLN A 99 -8.137 9.503 -13.044 1.00 0.00 O ATOM 1624 NE2 GLN A 99 -9.640 8.285 -14.198 1.00 0.00 N ATOM 0 H GLN A 99 -7.709 6.615 -10.135 1.00 0.00 H new ATOM 0 HA GLN A 99 -5.307 6.566 -11.301 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -6.620 7.078 -13.499 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -6.999 5.639 -12.574 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -9.154 6.411 -12.703 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -8.680 7.422 -11.352 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -10.097 7.380 -14.312 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.882 9.060 -14.815 1.00 0.00 H new ATOM 1633 N ARG A 100 -6.361 9.634 -11.197 1.00 0.00 N ATOM 1634 CA ARG A 100 -5.978 11.021 -11.399 1.00 0.00 C ATOM 1635 C ARG A 100 -7.156 11.947 -11.085 1.00 0.00 C ATOM 1636 O ARG A 100 -6.959 13.108 -10.730 1.00 0.00 O ATOM 1637 CB ARG A 100 -5.518 11.262 -12.838 1.00 0.00 C ATOM 1638 CG ARG A 100 -5.432 12.759 -13.142 1.00 0.00 C ATOM 1639 CD ARG A 100 -6.714 13.257 -13.812 1.00 0.00 C ATOM 1640 NE ARG A 100 -7.336 14.318 -12.988 1.00 0.00 N ATOM 1641 CZ ARG A 100 -8.261 15.175 -13.441 1.00 0.00 C ATOM 1642 NH1 ARG A 100 -8.677 15.102 -14.713 1.00 0.00 N ATOM 1643 NH2 ARG A 100 -8.770 16.105 -12.622 1.00 0.00 N ATOM 0 H ARG A 100 -7.216 9.502 -10.657 1.00 0.00 H new ATOM 0 HA ARG A 100 -5.150 11.238 -10.724 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -4.544 10.799 -12.995 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -6.212 10.786 -13.530 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -5.262 13.312 -12.218 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -4.579 12.953 -13.792 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -6.488 13.642 -14.806 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -7.412 12.430 -13.942 1.00 0.00 H new ATOM 0 HE ARG A 100 -7.042 14.402 -12.015 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -8.289 14.394 -15.336 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -9.381 15.755 -15.058 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -8.453 16.160 -11.654 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -9.474 16.758 -12.966 1.00 0.00 H new ATOM 1657 N GLY A 101 -8.353 11.398 -11.228 1.00 0.00 N ATOM 1658 CA GLY A 101 -9.562 12.160 -10.964 1.00 0.00 C ATOM 1659 C GLY A 101 -9.607 12.630 -9.509 1.00 0.00 C ATOM 1660 O GLY A 101 -8.567 12.862 -8.895 1.00 0.00 O ATOM 0 H GLY A 101 -8.512 10.435 -11.523 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.606 13.022 -11.630 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.437 11.547 -11.179 1.00 0.00 H new ATOM 1664 N LEU A 102 -10.824 12.758 -8.999 1.00 0.00 N ATOM 1665 CA LEU A 102 -11.018 13.196 -7.628 1.00 0.00 C ATOM 1666 C LEU A 102 -9.795 13.996 -7.174 1.00 0.00 C ATOM 1667 O LEU A 102 -9.696 15.192 -7.445 1.00 0.00 O ATOM 1668 CB LEU A 102 -11.342 12.004 -6.725 1.00 0.00 C ATOM 1669 CG LEU A 102 -12.193 12.310 -5.491 1.00 0.00 C ATOM 1670 CD1 LEU A 102 -13.388 11.358 -5.399 1.00 0.00 C ATOM 1671 CD2 LEU A 102 -11.343 12.285 -4.219 1.00 0.00 C ATOM 0 H LEU A 102 -11.685 12.566 -9.511 1.00 0.00 H new ATOM 0 HA LEU A 102 -11.878 13.862 -7.560 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -11.859 11.252 -7.321 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.404 11.559 -6.394 1.00 0.00 H new ATOM 0 HG LEU A 102 -12.592 13.319 -5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -13.976 11.597 -4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -14.010 11.467 -6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -13.030 10.331 -5.331 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -11.972 12.506 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -10.896 11.298 -4.099 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -10.554 13.034 -4.294 1.00 0.00 H new ATOM 1683 N TRP A 103 -8.895 13.304 -6.492 1.00 0.00 N ATOM 1684 CA TRP A 103 -7.683 13.936 -5.998 1.00 0.00 C ATOM 1685 C TRP A 103 -6.535 12.935 -6.146 1.00 0.00 C ATOM 1686 O TRP A 103 -6.754 11.725 -6.121 1.00 0.00 O ATOM 1687 CB TRP A 103 -7.866 14.426 -4.561 1.00 0.00 C ATOM 1688 CG TRP A 103 -8.083 15.936 -4.441 1.00 0.00 C ATOM 1689 CD1 TRP A 103 -9.028 16.683 -5.030 1.00 0.00 C ATOM 1690 CD2 TRP A 103 -7.297 16.858 -3.658 1.00 0.00 C ATOM 1691 NE1 TRP A 103 -8.908 18.014 -4.684 1.00 0.00 N ATOM 1692 CE2 TRP A 103 -7.822 18.124 -3.823 1.00 0.00 C ATOM 1693 CE3 TRP A 103 -6.179 16.631 -2.836 1.00 0.00 C ATOM 1694 CZ2 TRP A 103 -7.295 19.260 -3.199 1.00 0.00 C ATOM 1695 CZ3 TRP A 103 -5.663 17.777 -2.220 1.00 0.00 C ATOM 1696 CH2 TRP A 103 -6.181 19.058 -2.376 1.00 0.00 C ATOM 0 H TRP A 103 -8.980 12.312 -6.270 1.00 0.00 H new ATOM 0 HA TRP A 103 -7.447 14.826 -6.581 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -8.718 13.911 -4.118 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -6.988 14.148 -3.979 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -9.787 16.293 -5.692 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -9.506 18.777 -5.002 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -5.752 15.650 -2.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -7.725 20.240 -3.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -4.802 17.658 -1.579 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -5.726 19.893 -1.864 1.00 0.00 H new ATOM 1707 N ASN A 104 -5.335 13.478 -6.298 1.00 0.00 N ATOM 1708 CA ASN A 104 -4.153 12.648 -6.450 1.00 0.00 C ATOM 1709 C ASN A 104 -3.448 12.518 -5.098 1.00 0.00 C ATOM 1710 O ASN A 104 -2.757 13.438 -4.664 1.00 0.00 O ATOM 1711 CB ASN A 104 -3.166 13.271 -7.440 1.00 0.00 C ATOM 1712 CG ASN A 104 -3.799 13.421 -8.825 1.00 0.00 C ATOM 1713 OD1 ASN A 104 -4.966 13.745 -8.970 1.00 0.00 O ATOM 1714 ND2 ASN A 104 -2.967 13.166 -9.830 1.00 0.00 N ATOM 0 H ASN A 104 -5.157 14.482 -6.319 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.471 11.674 -6.822 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -2.846 14.247 -7.075 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -2.274 12.649 -7.510 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -3.294 13.237 -10.793 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -2.001 12.900 -9.638 1.00 0.00 H new ATOM 1721 N PRO A 105 -3.653 11.338 -4.454 1.00 0.00 N ATOM 1722 CA PRO A 105 -3.045 11.077 -3.160 1.00 0.00 C ATOM 1723 C PRO A 105 -1.552 10.778 -3.307 1.00 0.00 C ATOM 1724 O PRO A 105 -0.831 10.696 -2.313 1.00 0.00 O ATOM 1725 CB PRO A 105 -3.831 9.910 -2.585 1.00 0.00 C ATOM 1726 CG PRO A 105 -4.540 9.263 -3.764 1.00 0.00 C ATOM 1727 CD PRO A 105 -4.465 10.226 -4.938 1.00 0.00 C ATOM 0 HA PRO A 105 -3.090 11.937 -2.492 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -3.169 9.200 -2.090 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.548 10.252 -1.838 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -4.069 8.313 -4.018 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.578 9.047 -3.513 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.011 9.754 -5.809 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.457 10.562 -5.239 1.00 0.00 H new ATOM 1735 N LYS A 106 -1.131 10.623 -4.553 1.00 0.00 N ATOM 1736 CA LYS A 106 0.264 10.335 -4.842 1.00 0.00 C ATOM 1737 C LYS A 106 0.901 9.653 -3.630 1.00 0.00 C ATOM 1738 O LYS A 106 2.001 10.016 -3.216 1.00 0.00 O ATOM 1739 CB LYS A 106 0.992 11.604 -5.287 1.00 0.00 C ATOM 1740 CG LYS A 106 0.099 12.836 -5.120 1.00 0.00 C ATOM 1741 CD LYS A 106 -0.112 13.163 -3.640 1.00 0.00 C ATOM 1742 CE LYS A 106 1.126 12.801 -2.817 1.00 0.00 C ATOM 1743 NZ LYS A 106 1.192 13.628 -1.591 1.00 0.00 N ATOM 0 H LYS A 106 -1.731 10.691 -5.375 1.00 0.00 H new ATOM 0 HA LYS A 106 0.344 9.640 -5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.903 11.729 -4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.294 11.508 -6.330 1.00 0.00 H new ATOM 0 HG2 LYS A 106 0.553 13.690 -5.624 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -0.864 12.659 -5.598 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -0.331 14.225 -3.526 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -0.976 12.617 -3.263 1.00 0.00 H new ATOM 0 HE2 LYS A 106 1.096 11.745 -2.549 1.00 0.00 H new ATOM 0 HE3 LYS A 106 2.025 12.953 -3.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 2.038 13.370 -1.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 1.242 14.633 -1.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 0.343 13.462 -1.014 1.00 0.00 H new ATOM 1757 N GLU A 107 0.182 8.677 -3.094 1.00 0.00 N ATOM 1758 CA GLU A 107 0.664 7.942 -1.937 1.00 0.00 C ATOM 1759 C GLU A 107 0.751 6.448 -2.257 1.00 0.00 C ATOM 1760 O GLU A 107 0.003 5.944 -3.092 1.00 0.00 O ATOM 1761 CB GLU A 107 -0.228 8.190 -0.719 1.00 0.00 C ATOM 1762 CG GLU A 107 0.150 9.497 -0.019 1.00 0.00 C ATOM 1763 CD GLU A 107 -1.065 10.125 0.666 1.00 0.00 C ATOM 1764 OE1 GLU A 107 -1.794 10.861 -0.034 1.00 0.00 O ATOM 1765 OE2 GLU A 107 -1.239 9.854 1.874 1.00 0.00 O ATOM 0 H GLU A 107 -0.730 8.379 -3.440 1.00 0.00 H new ATOM 0 HA GLU A 107 1.664 8.301 -1.693 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.272 8.229 -1.030 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.134 7.359 -0.020 1.00 0.00 H new ATOM 0 HG2 GLU A 107 0.929 9.306 0.719 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.564 10.196 -0.746 1.00 0.00 H new ATOM 1772 N ALA A 108 1.672 5.783 -1.575 1.00 0.00 N ATOM 1773 CA ALA A 108 1.867 4.357 -1.775 1.00 0.00 C ATOM 1774 C ALA A 108 1.379 3.600 -0.538 1.00 0.00 C ATOM 1775 O ALA A 108 1.630 4.021 0.590 1.00 0.00 O ATOM 1776 CB ALA A 108 3.341 4.082 -2.083 1.00 0.00 C ATOM 0 H ALA A 108 2.291 6.205 -0.883 1.00 0.00 H new ATOM 0 HA ALA A 108 1.284 4.006 -2.627 1.00 0.00 H new ATOM 0 HB1 ALA A 108 3.488 3.012 -2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 108 3.630 4.618 -2.987 1.00 0.00 H new ATOM 0 HB3 ALA A 108 3.956 4.419 -1.249 1.00 0.00 H new ATOM 1782 N LEU A 109 0.690 2.498 -0.792 1.00 0.00 N ATOM 1783 CA LEU A 109 0.164 1.679 0.287 1.00 0.00 C ATOM 1784 C LEU A 109 0.947 0.366 0.352 1.00 0.00 C ATOM 1785 O LEU A 109 0.931 -0.419 -0.595 1.00 0.00 O ATOM 1786 CB LEU A 109 -1.345 1.487 0.128 1.00 0.00 C ATOM 1787 CG LEU A 109 -2.231 2.461 0.909 1.00 0.00 C ATOM 1788 CD1 LEU A 109 -3.644 2.505 0.324 1.00 0.00 C ATOM 1789 CD2 LEU A 109 -2.237 2.119 2.400 1.00 0.00 C ATOM 0 H LEU A 109 0.484 2.153 -1.729 1.00 0.00 H new ATOM 0 HA LEU A 109 0.299 2.180 1.246 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.592 1.570 -0.930 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.597 0.472 0.435 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.811 3.462 0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.253 3.204 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -3.598 2.831 -0.715 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.089 1.511 0.373 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.874 2.825 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.620 1.108 2.540 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.221 2.179 2.791 1.00 0.00 H new ATOM 1801 N TRP A 110 1.614 0.167 1.480 1.00 0.00 N ATOM 1802 CA TRP A 110 2.401 -1.037 1.682 1.00 0.00 C ATOM 1803 C TRP A 110 1.657 -1.927 2.680 1.00 0.00 C ATOM 1804 O TRP A 110 1.405 -1.519 3.813 1.00 0.00 O ATOM 1805 CB TRP A 110 3.823 -0.694 2.131 1.00 0.00 C ATOM 1806 CG TRP A 110 4.487 -1.781 2.979 1.00 0.00 C ATOM 1807 CD1 TRP A 110 5.194 -1.629 4.107 1.00 0.00 C ATOM 1808 CD2 TRP A 110 4.477 -3.200 2.719 1.00 0.00 C ATOM 1809 NE1 TRP A 110 5.639 -2.843 4.592 1.00 0.00 N ATOM 1810 CE2 TRP A 110 5.189 -3.828 3.721 1.00 0.00 C ATOM 1811 CE3 TRP A 110 3.886 -3.930 1.672 1.00 0.00 C ATOM 1812 CZ2 TRP A 110 5.376 -5.215 3.775 1.00 0.00 C ATOM 1813 CZ3 TRP A 110 4.083 -5.314 1.740 1.00 0.00 C ATOM 1814 CH2 TRP A 110 4.797 -5.962 2.742 1.00 0.00 C ATOM 0 H TRP A 110 1.625 0.820 2.263 1.00 0.00 H new ATOM 0 HA TRP A 110 2.516 -1.584 0.746 1.00 0.00 H new ATOM 0 HB2 TRP A 110 4.437 -0.510 1.249 1.00 0.00 H new ATOM 0 HB3 TRP A 110 3.799 0.234 2.702 1.00 0.00 H new ATOM 0 HD1 TRP A 110 5.391 -0.677 4.578 1.00 0.00 H new ATOM 0 HE1 TRP A 110 6.195 -2.990 5.434 1.00 0.00 H new ATOM 0 HE3 TRP A 110 3.325 -3.460 0.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 5.937 -5.683 4.571 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 3.650 -5.922 0.959 1.00 0.00 H new ATOM 0 HH2 TRP A 110 4.904 -7.036 2.723 1.00 0.00 H new ATOM 1825 N VAL A 111 1.327 -3.126 2.224 1.00 0.00 N ATOM 1826 CA VAL A 111 0.617 -4.076 3.063 1.00 0.00 C ATOM 1827 C VAL A 111 1.125 -5.489 2.768 1.00 0.00 C ATOM 1828 O VAL A 111 1.240 -5.882 1.608 1.00 0.00 O ATOM 1829 CB VAL A 111 -0.892 -3.929 2.858 1.00 0.00 C ATOM 1830 CG1 VAL A 111 -1.270 -2.471 2.593 1.00 0.00 C ATOM 1831 CG2 VAL A 111 -1.384 -4.837 1.729 1.00 0.00 C ATOM 0 H VAL A 111 1.538 -3.461 1.284 1.00 0.00 H new ATOM 0 HA VAL A 111 0.810 -3.874 4.117 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.386 -4.241 3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.348 -2.395 2.451 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.972 -1.858 3.443 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.760 -2.120 1.696 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -2.460 -4.713 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.878 -4.570 0.801 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -1.165 -5.876 1.976 1.00 0.00 H new ATOM 1841 N ASP A 112 1.415 -6.214 3.838 1.00 0.00 N ATOM 1842 CA ASP A 112 1.909 -7.575 3.709 1.00 0.00 C ATOM 1843 C ASP A 112 0.888 -8.542 4.311 1.00 0.00 C ATOM 1844 O ASP A 112 0.271 -8.242 5.332 1.00 0.00 O ATOM 1845 CB ASP A 112 3.230 -7.755 4.458 1.00 0.00 C ATOM 1846 CG ASP A 112 4.120 -8.885 3.937 1.00 0.00 C ATOM 1847 OD1 ASP A 112 3.546 -9.917 3.526 1.00 0.00 O ATOM 1848 OD2 ASP A 112 5.355 -8.692 3.960 1.00 0.00 O ATOM 0 H ASP A 112 1.317 -5.885 4.799 1.00 0.00 H new ATOM 0 HA ASP A 112 2.065 -7.778 2.650 1.00 0.00 H new ATOM 0 HB2 ASP A 112 3.789 -6.820 4.408 1.00 0.00 H new ATOM 0 HB3 ASP A 112 3.012 -7.940 5.510 1.00 0.00 H new ATOM 1853 N TRP A 113 0.742 -9.683 3.654 1.00 0.00 N ATOM 1854 CA TRP A 113 -0.194 -10.696 4.112 1.00 0.00 C ATOM 1855 C TRP A 113 0.605 -11.955 4.458 1.00 0.00 C ATOM 1856 O TRP A 113 0.031 -12.971 4.846 1.00 0.00 O ATOM 1857 CB TRP A 113 -1.284 -10.948 3.069 1.00 0.00 C ATOM 1858 CG TRP A 113 -2.542 -11.612 3.631 1.00 0.00 C ATOM 1859 CD1 TRP A 113 -3.682 -11.024 4.018 1.00 0.00 C ATOM 1860 CD2 TRP A 113 -2.743 -13.024 3.854 1.00 0.00 C ATOM 1861 NE1 TRP A 113 -4.599 -11.950 4.474 1.00 0.00 N ATOM 1862 CE2 TRP A 113 -4.010 -13.204 4.371 1.00 0.00 C ATOM 1863 CE3 TRP A 113 -1.882 -14.113 3.628 1.00 0.00 C ATOM 1864 CZ2 TRP A 113 -4.530 -14.461 4.704 1.00 0.00 C ATOM 1865 CZ3 TRP A 113 -2.417 -15.361 3.966 1.00 0.00 C ATOM 1866 CH2 TRP A 113 -3.691 -15.560 4.486 1.00 0.00 C ATOM 0 H TRP A 113 1.256 -9.929 2.808 1.00 0.00 H new ATOM 0 HA TRP A 113 -0.720 -10.360 5.006 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -1.561 -9.998 2.611 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -0.877 -11.577 2.277 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -3.861 -9.960 3.978 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -5.537 -11.750 4.822 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -0.887 -13.995 3.225 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -5.525 -14.576 5.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.796 -16.231 3.812 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -4.032 -16.558 4.721 1.00 0.00 H new ATOM 1877 N GLU A 114 1.916 -11.845 4.307 1.00 0.00 N ATOM 1878 CA GLU A 114 2.799 -12.962 4.599 1.00 0.00 C ATOM 1879 C GLU A 114 3.215 -12.939 6.071 1.00 0.00 C ATOM 1880 O GLU A 114 3.178 -13.966 6.746 1.00 0.00 O ATOM 1881 CB GLU A 114 4.025 -12.946 3.682 1.00 0.00 C ATOM 1882 CG GLU A 114 4.058 -14.189 2.790 1.00 0.00 C ATOM 1883 CD GLU A 114 3.798 -15.457 3.607 1.00 0.00 C ATOM 1884 OE1 GLU A 114 4.709 -15.835 4.374 1.00 0.00 O ATOM 1885 OE2 GLU A 114 2.694 -16.019 3.445 1.00 0.00 O ATOM 0 H GLU A 114 2.389 -11.000 3.986 1.00 0.00 H new ATOM 0 HA GLU A 114 2.256 -13.888 4.410 1.00 0.00 H new ATOM 0 HB2 GLU A 114 4.009 -12.049 3.062 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.933 -12.901 4.283 1.00 0.00 H new ATOM 0 HG2 GLU A 114 3.307 -14.098 2.005 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.028 -14.262 2.297 1.00 0.00 H new ATOM 1892 N ASN A 115 3.602 -11.756 6.525 1.00 0.00 N ATOM 1893 CA ASN A 115 4.024 -11.585 7.905 1.00 0.00 C ATOM 1894 C ASN A 115 3.022 -10.688 8.633 1.00 0.00 C ATOM 1895 O ASN A 115 3.321 -10.157 9.702 1.00 0.00 O ATOM 1896 CB ASN A 115 5.399 -10.918 7.981 1.00 0.00 C ATOM 1897 CG ASN A 115 6.519 -11.950 7.832 1.00 0.00 C ATOM 1898 OD1 ASN A 115 6.331 -13.036 7.307 1.00 0.00 O ATOM 1899 ND2 ASN A 115 7.690 -11.553 8.321 1.00 0.00 N ATOM 0 H ASN A 115 3.632 -10.906 5.961 1.00 0.00 H new ATOM 0 HA ASN A 115 4.075 -12.571 8.367 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.486 -10.166 7.197 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.503 -10.399 8.934 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.500 -12.171 8.269 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.778 -10.631 8.748 1.00 0.00 H new ATOM 1906 N LYS A 116 1.853 -10.546 8.026 1.00 0.00 N ATOM 1907 CA LYS A 116 0.805 -9.722 8.604 1.00 0.00 C ATOM 1908 C LYS A 116 1.377 -8.347 8.953 1.00 0.00 C ATOM 1909 O LYS A 116 1.053 -7.782 9.996 1.00 0.00 O ATOM 1910 CB LYS A 116 0.154 -10.436 9.790 1.00 0.00 C ATOM 1911 CG LYS A 116 1.094 -10.462 10.998 1.00 0.00 C ATOM 1912 CD LYS A 116 0.310 -10.654 12.298 1.00 0.00 C ATOM 1913 CE LYS A 116 0.539 -9.482 13.254 1.00 0.00 C ATOM 1914 NZ LYS A 116 -0.084 -9.755 14.568 1.00 0.00 N ATOM 0 H LYS A 116 1.608 -10.988 7.140 1.00 0.00 H new ATOM 0 HA LYS A 116 0.005 -9.561 7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.774 -9.931 10.058 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.108 -11.455 9.506 1.00 0.00 H new ATOM 0 HG2 LYS A 116 1.818 -11.269 10.883 1.00 0.00 H new ATOM 0 HG3 LYS A 116 1.659 -9.531 11.044 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -0.753 -10.744 12.076 1.00 0.00 H new ATOM 0 HD3 LYS A 116 0.616 -11.584 12.777 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.608 -9.312 13.380 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.119 -8.571 12.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.081 -8.949 15.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -1.107 -9.895 14.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 0.336 -10.613 14.980 1.00 0.00 H new ATOM 1928 N LEU A 117 2.220 -7.848 8.060 1.00 0.00 N ATOM 1929 CA LEU A 117 2.840 -6.549 8.261 1.00 0.00 C ATOM 1930 C LEU A 117 2.315 -5.570 7.210 1.00 0.00 C ATOM 1931 O LEU A 117 2.463 -5.802 6.011 1.00 0.00 O ATOM 1932 CB LEU A 117 4.365 -6.681 8.272 1.00 0.00 C ATOM 1933 CG LEU A 117 5.071 -6.407 6.943 1.00 0.00 C ATOM 1934 CD1 LEU A 117 5.101 -4.909 6.636 1.00 0.00 C ATOM 1935 CD2 LEU A 117 6.472 -7.023 6.930 1.00 0.00 C ATOM 0 H LEU A 117 2.488 -8.320 7.196 1.00 0.00 H new ATOM 0 HA LEU A 117 2.570 -6.144 9.236 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.764 -5.996 9.021 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.620 -7.690 8.595 1.00 0.00 H new ATOM 0 HG LEU A 117 4.500 -6.887 6.148 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.608 -4.742 5.686 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.081 -4.530 6.574 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.635 -4.386 7.429 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.953 -6.814 5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.066 -6.593 7.737 1.00 0.00 H new ATOM 0 HD23 LEU A 117 6.397 -8.101 7.070 1.00 0.00 H new ATOM 1947 N VAL A 118 1.713 -4.495 7.697 1.00 0.00 N ATOM 1948 CA VAL A 118 1.165 -3.479 6.814 1.00 0.00 C ATOM 1949 C VAL A 118 1.522 -2.093 7.356 1.00 0.00 C ATOM 1950 O VAL A 118 1.953 -1.962 8.500 1.00 0.00 O ATOM 1951 CB VAL A 118 -0.342 -3.687 6.649 1.00 0.00 C ATOM 1952 CG1 VAL A 118 -0.948 -2.611 5.747 1.00 0.00 C ATOM 1953 CG2 VAL A 118 -0.647 -5.087 6.114 1.00 0.00 C ATOM 0 H VAL A 118 1.593 -4.305 8.692 1.00 0.00 H new ATOM 0 HA VAL A 118 1.602 -3.561 5.819 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.802 -3.597 7.633 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -2.020 -2.782 5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.777 -1.629 6.187 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -0.480 -2.654 4.764 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -1.725 -5.208 6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.168 -5.218 5.144 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.266 -5.834 6.810 1.00 0.00 H new ATOM 1963 N GLY A 119 1.329 -1.094 6.507 1.00 0.00 N ATOM 1964 CA GLY A 119 1.625 0.277 6.886 1.00 0.00 C ATOM 1965 C GLY A 119 1.488 1.219 5.688 1.00 0.00 C ATOM 1966 O GLY A 119 2.106 0.999 4.647 1.00 0.00 O ATOM 0 H GLY A 119 0.971 -1.207 5.558 1.00 0.00 H new ATOM 0 HA2 GLY A 119 0.949 0.593 7.680 1.00 0.00 H new ATOM 0 HA3 GLY A 119 2.637 0.337 7.286 1.00 0.00 H new ATOM 1970 N ASN A 120 0.674 2.247 5.874 1.00 0.00 N ATOM 1971 CA ASN A 120 0.449 3.223 4.821 1.00 0.00 C ATOM 1972 C ASN A 120 1.765 3.933 4.498 1.00 0.00 C ATOM 1973 O ASN A 120 2.713 3.875 5.280 1.00 0.00 O ATOM 1974 CB ASN A 120 -0.564 4.283 5.260 1.00 0.00 C ATOM 1975 CG ASN A 120 -0.324 4.702 6.712 1.00 0.00 C ATOM 1976 OD1 ASN A 120 -0.233 3.886 7.614 1.00 0.00 O ATOM 1977 ND2 ASN A 120 -0.228 6.017 6.886 1.00 0.00 N ATOM 0 H ASN A 120 0.162 2.426 6.738 1.00 0.00 H new ATOM 0 HA ASN A 120 0.064 2.694 3.949 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -0.489 5.154 4.609 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -1.575 3.891 5.153 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -0.069 6.398 7.819 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -0.314 6.645 6.087 1.00 0.00 H new ATOM 1984 N GLU A 121 1.782 4.585 3.346 1.00 0.00 N ATOM 1985 CA GLU A 121 2.966 5.305 2.910 1.00 0.00 C ATOM 1986 C GLU A 121 3.981 4.337 2.299 1.00 0.00 C ATOM 1987 O GLU A 121 4.038 3.169 2.681 1.00 0.00 O ATOM 1988 CB GLU A 121 3.587 6.091 4.067 1.00 0.00 C ATOM 1989 CG GLU A 121 3.769 7.564 3.693 1.00 0.00 C ATOM 1990 CD GLU A 121 5.189 8.037 4.010 1.00 0.00 C ATOM 1991 OE1 GLU A 121 6.131 7.357 3.548 1.00 0.00 O ATOM 1992 OE2 GLU A 121 5.301 9.069 4.707 1.00 0.00 O ATOM 0 H GLU A 121 0.994 4.630 2.700 1.00 0.00 H new ATOM 0 HA GLU A 121 2.670 6.022 2.144 1.00 0.00 H new ATOM 0 HB2 GLU A 121 2.951 6.012 4.948 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.552 5.657 4.330 1.00 0.00 H new ATOM 0 HG2 GLU A 121 3.564 7.702 2.631 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.048 8.173 4.238 1.00 0.00 H new ATOM 1999 N PRO A 122 4.777 4.871 1.334 1.00 0.00 N ATOM 2000 CA PRO A 122 5.786 4.067 0.666 1.00 0.00 C ATOM 2001 C PRO A 122 6.991 3.832 1.579 1.00 0.00 C ATOM 2002 O PRO A 122 7.536 2.730 1.621 1.00 0.00 O ATOM 2003 CB PRO A 122 6.137 4.843 -0.593 1.00 0.00 C ATOM 2004 CG PRO A 122 5.659 6.266 -0.352 1.00 0.00 C ATOM 2005 CD PRO A 122 4.737 6.250 0.856 1.00 0.00 C ATOM 0 HA PRO A 122 5.430 3.068 0.415 1.00 0.00 H new ATOM 0 HB2 PRO A 122 7.210 4.818 -0.781 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.650 4.410 -1.467 1.00 0.00 H new ATOM 0 HG2 PRO A 122 6.506 6.929 -0.177 1.00 0.00 H new ATOM 0 HG3 PRO A 122 5.133 6.646 -1.228 1.00 0.00 H new ATOM 0 HD2 PRO A 122 5.078 6.945 1.623 1.00 0.00 H new ATOM 0 HD3 PRO A 122 3.724 6.546 0.585 1.00 0.00 H new ATOM 2013 N ALA A 123 7.373 4.885 2.287 1.00 0.00 N ATOM 2014 CA ALA A 123 8.503 4.806 3.196 1.00 0.00 C ATOM 2015 C ALA A 123 8.295 3.638 4.161 1.00 0.00 C ATOM 2016 O ALA A 123 9.259 3.091 4.696 1.00 0.00 O ATOM 2017 CB ALA A 123 8.667 6.142 3.924 1.00 0.00 C ATOM 0 H ALA A 123 6.919 5.798 2.249 1.00 0.00 H new ATOM 0 HA ALA A 123 9.425 4.619 2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 123 9.515 6.083 4.606 1.00 0.00 H new ATOM 0 HB2 ALA A 123 8.842 6.934 3.196 1.00 0.00 H new ATOM 0 HB3 ALA A 123 7.761 6.362 4.489 1.00 0.00 H new ATOM 2023 N ASP A 124 7.032 3.289 4.355 1.00 0.00 N ATOM 2024 CA ASP A 124 6.685 2.195 5.247 1.00 0.00 C ATOM 2025 C ASP A 124 7.479 0.949 4.850 1.00 0.00 C ATOM 2026 O ASP A 124 8.102 0.310 5.696 1.00 0.00 O ATOM 2027 CB ASP A 124 5.196 1.858 5.152 1.00 0.00 C ATOM 2028 CG ASP A 124 4.596 1.223 6.408 1.00 0.00 C ATOM 2029 OD1 ASP A 124 4.144 1.999 7.276 1.00 0.00 O ATOM 2030 OD2 ASP A 124 4.603 -0.026 6.470 1.00 0.00 O ATOM 0 H ASP A 124 6.236 3.745 3.910 1.00 0.00 H new ATOM 0 HA ASP A 124 6.920 2.502 6.266 1.00 0.00 H new ATOM 0 HB2 ASP A 124 4.646 2.771 4.926 1.00 0.00 H new ATOM 0 HB3 ASP A 124 5.045 1.179 4.312 1.00 0.00 H new ATOM 2035 N ILE A 125 7.429 0.640 3.562 1.00 0.00 N ATOM 2036 CA ILE A 125 8.135 -0.519 3.043 1.00 0.00 C ATOM 2037 C ILE A 125 9.582 -0.494 3.540 1.00 0.00 C ATOM 2038 O ILE A 125 10.058 -1.466 4.125 1.00 0.00 O ATOM 2039 CB ILE A 125 8.009 -0.585 1.520 1.00 0.00 C ATOM 2040 CG1 ILE A 125 7.133 -1.764 1.092 1.00 0.00 C ATOM 2041 CG2 ILE A 125 9.388 -0.624 0.857 1.00 0.00 C ATOM 2042 CD1 ILE A 125 7.373 -2.121 -0.376 1.00 0.00 C ATOM 0 H ILE A 125 6.911 1.172 2.863 1.00 0.00 H new ATOM 0 HA ILE A 125 7.685 -1.439 3.417 1.00 0.00 H new ATOM 0 HB ILE A 125 7.513 0.324 1.179 1.00 0.00 H new ATOM 0 HG12 ILE A 125 7.348 -2.628 1.720 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.083 -1.515 1.242 1.00 0.00 H new ATOM 0 HG21 ILE A 125 9.270 -0.671 -0.226 1.00 0.00 H new ATOM 0 HG22 ILE A 125 9.945 0.274 1.123 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.932 -1.504 1.201 1.00 0.00 H new ATOM 0 HD11 ILE A 125 6.738 -2.962 -0.654 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.134 -1.262 -1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 125 8.419 -2.393 -0.518 1.00 0.00 H new ATOM 2054 N ASP A 126 10.241 0.627 3.289 1.00 0.00 N ATOM 2055 CA ASP A 126 11.624 0.792 3.704 1.00 0.00 C ATOM 2056 C ASP A 126 11.779 0.313 5.149 1.00 0.00 C ATOM 2057 O ASP A 126 12.673 -0.475 5.453 1.00 0.00 O ATOM 2058 CB ASP A 126 12.046 2.261 3.645 1.00 0.00 C ATOM 2059 CG ASP A 126 12.958 2.718 4.785 1.00 0.00 C ATOM 2060 OD1 ASP A 126 13.844 1.919 5.159 1.00 0.00 O ATOM 2061 OD2 ASP A 126 12.749 3.856 5.258 1.00 0.00 O ATOM 0 H ASP A 126 9.843 1.431 2.803 1.00 0.00 H new ATOM 0 HA ASP A 126 12.250 0.210 3.028 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.556 2.439 2.698 1.00 0.00 H new ATOM 0 HB3 ASP A 126 11.150 2.881 3.646 1.00 0.00 H new ATOM 2066 N LYS A 127 10.893 0.808 6.001 1.00 0.00 N ATOM 2067 CA LYS A 127 10.920 0.441 7.407 1.00 0.00 C ATOM 2068 C LYS A 127 10.915 -1.084 7.531 1.00 0.00 C ATOM 2069 O LYS A 127 11.721 -1.653 8.265 1.00 0.00 O ATOM 2070 CB LYS A 127 9.777 1.123 8.161 1.00 0.00 C ATOM 2071 CG LYS A 127 10.125 2.578 8.484 1.00 0.00 C ATOM 2072 CD LYS A 127 10.161 3.429 7.214 1.00 0.00 C ATOM 2073 CE LYS A 127 10.558 4.872 7.531 1.00 0.00 C ATOM 2074 NZ LYS A 127 10.656 5.073 8.994 1.00 0.00 N ATOM 0 H LYS A 127 10.152 1.460 5.745 1.00 0.00 H new ATOM 0 HA LYS A 127 11.837 0.797 7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.868 1.087 7.561 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.571 0.581 9.084 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.390 2.986 9.178 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.093 2.622 8.983 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.870 3.001 6.505 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.182 3.414 6.735 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.514 5.104 7.061 1.00 0.00 H new ATOM 0 HE3 LYS A 127 9.822 5.558 7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.893 6.066 9.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 9.745 4.839 9.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.399 4.456 9.380 1.00 0.00 H new ATOM 2088 N TYR A 128 9.997 -1.702 6.802 1.00 0.00 N ATOM 2089 CA TYR A 128 9.876 -3.150 6.822 1.00 0.00 C ATOM 2090 C TYR A 128 10.815 -3.792 5.798 1.00 0.00 C ATOM 2091 O TYR A 128 11.926 -4.196 6.137 1.00 0.00 O ATOM 2092 CB TYR A 128 8.429 -3.458 6.433 1.00 0.00 C ATOM 2093 CG TYR A 128 7.406 -3.111 7.517 1.00 0.00 C ATOM 2094 CD1 TYR A 128 7.163 -3.998 8.545 1.00 0.00 C ATOM 2095 CD2 TYR A 128 6.727 -1.911 7.466 1.00 0.00 C ATOM 2096 CE1 TYR A 128 6.201 -3.672 9.565 1.00 0.00 C ATOM 2097 CE2 TYR A 128 5.764 -1.585 8.486 1.00 0.00 C ATOM 2098 CZ TYR A 128 5.548 -2.481 9.485 1.00 0.00 C ATOM 2099 OH TYR A 128 4.639 -2.173 10.449 1.00 0.00 O ATOM 0 H TYR A 128 9.330 -1.227 6.194 1.00 0.00 H new ATOM 0 HA TYR A 128 10.137 -3.544 7.804 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.182 -2.907 5.525 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.345 -4.518 6.195 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.695 -4.937 8.585 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.918 -1.216 6.661 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.002 -4.357 10.376 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.225 -0.649 8.458 1.00 0.00 H new ATOM 0 HH TYR A 128 3.746 -2.115 10.050 1.00 0.00 H new ATOM 2109 N ILE A 129 10.333 -3.866 4.566 1.00 0.00 N ATOM 2110 CA ILE A 129 11.114 -4.452 3.491 1.00 0.00 C ATOM 2111 C ILE A 129 11.302 -3.417 2.380 1.00 0.00 C ATOM 2112 O ILE A 129 10.487 -3.331 1.463 1.00 0.00 O ATOM 2113 CB ILE A 129 10.475 -5.758 3.013 1.00 0.00 C ATOM 2114 CG1 ILE A 129 8.962 -5.599 2.850 1.00 0.00 C ATOM 2115 CG2 ILE A 129 10.833 -6.917 3.946 1.00 0.00 C ATOM 2116 CD1 ILE A 129 8.250 -5.716 4.200 1.00 0.00 C ATOM 0 H ILE A 129 9.411 -3.530 4.289 1.00 0.00 H new ATOM 0 HA ILE A 129 12.108 -4.723 3.847 1.00 0.00 H new ATOM 0 HB ILE A 129 10.881 -5.999 2.031 1.00 0.00 H new ATOM 0 HG12 ILE A 129 8.741 -4.631 2.401 1.00 0.00 H new ATOM 0 HG13 ILE A 129 8.584 -6.361 2.168 1.00 0.00 H new ATOM 0 HG21 ILE A 129 10.366 -7.833 3.584 1.00 0.00 H new ATOM 0 HG22 ILE A 129 11.915 -7.045 3.968 1.00 0.00 H new ATOM 0 HG23 ILE A 129 10.473 -6.699 4.951 1.00 0.00 H new ATOM 0 HD11 ILE A 129 7.176 -5.599 4.056 1.00 0.00 H new ATOM 0 HD12 ILE A 129 8.454 -6.694 4.635 1.00 0.00 H new ATOM 0 HD13 ILE A 129 8.613 -4.938 4.871 1.00 0.00 H new ATOM 2128 N ILE A 130 12.382 -2.658 2.498 1.00 0.00 N ATOM 2129 CA ILE A 130 12.687 -1.633 1.515 1.00 0.00 C ATOM 2130 C ILE A 130 12.774 -2.272 0.128 1.00 0.00 C ATOM 2131 O ILE A 130 12.240 -3.357 -0.094 1.00 0.00 O ATOM 2132 CB ILE A 130 13.946 -0.862 1.918 1.00 0.00 C ATOM 2133 CG1 ILE A 130 15.192 -1.473 1.274 1.00 0.00 C ATOM 2134 CG2 ILE A 130 14.072 -0.775 3.440 1.00 0.00 C ATOM 2135 CD1 ILE A 130 15.482 -2.861 1.849 1.00 0.00 C ATOM 0 H ILE A 130 13.056 -2.733 3.260 1.00 0.00 H new ATOM 0 HA ILE A 130 11.887 -0.893 1.475 1.00 0.00 H new ATOM 0 HB ILE A 130 13.857 0.158 1.544 1.00 0.00 H new ATOM 0 HG12 ILE A 130 15.050 -1.545 0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 130 16.049 -0.820 1.440 1.00 0.00 H new ATOM 0 HG21 ILE A 130 14.975 -0.222 3.699 1.00 0.00 H new ATOM 0 HG22 ILE A 130 13.202 -0.261 3.848 1.00 0.00 H new ATOM 0 HG23 ILE A 130 14.129 -1.780 3.858 1.00 0.00 H new ATOM 0 HD11 ILE A 130 16.373 -3.273 1.374 1.00 0.00 H new ATOM 0 HD12 ILE A 130 15.647 -2.782 2.924 1.00 0.00 H new ATOM 0 HD13 ILE A 130 14.633 -3.518 1.659 1.00 0.00 H new ATOM 2147 N GLN A 131 13.452 -1.571 -0.769 1.00 0.00 N ATOM 2148 CA GLN A 131 13.616 -2.057 -2.129 1.00 0.00 C ATOM 2149 C GLN A 131 14.074 -3.517 -2.120 1.00 0.00 C ATOM 2150 O GLN A 131 13.936 -4.220 -3.119 1.00 0.00 O ATOM 2151 CB GLN A 131 14.598 -1.180 -2.909 1.00 0.00 C ATOM 2152 CG GLN A 131 14.439 0.293 -2.528 1.00 0.00 C ATOM 2153 CD GLN A 131 15.589 0.754 -1.630 1.00 0.00 C ATOM 2154 OE1 GLN A 131 15.887 1.932 -1.514 1.00 0.00 O ATOM 2155 NE2 GLN A 131 16.218 -0.237 -1.005 1.00 0.00 N ATOM 0 H GLN A 131 13.894 -0.671 -0.581 1.00 0.00 H new ATOM 0 HA GLN A 131 12.651 -2.003 -2.632 1.00 0.00 H new ATOM 0 HB2 GLN A 131 15.619 -1.503 -2.707 1.00 0.00 H new ATOM 0 HB3 GLN A 131 14.430 -1.303 -3.979 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.409 0.904 -3.430 1.00 0.00 H new ATOM 0 HG3 GLN A 131 13.490 0.439 -2.013 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.917 -1.201 -1.146 1.00 0.00 H new ATOM 0 HE22 GLN A 131 17.001 -0.033 -0.384 1.00 0.00 H new ATOM 2164 N ARG A 132 14.608 -3.929 -0.980 1.00 0.00 N ATOM 2165 CA ARG A 132 15.086 -5.292 -0.827 1.00 0.00 C ATOM 2166 C ARG A 132 14.372 -5.978 0.339 1.00 0.00 C ATOM 2167 O ARG A 132 13.938 -5.317 1.281 1.00 0.00 O ATOM 2168 CB ARG A 132 16.596 -5.322 -0.580 1.00 0.00 C ATOM 2169 CG ARG A 132 16.905 -5.444 0.913 1.00 0.00 C ATOM 2170 CD ARG A 132 17.618 -6.763 1.220 1.00 0.00 C ATOM 2171 NE ARG A 132 19.084 -6.570 1.167 1.00 0.00 N ATOM 2172 CZ ARG A 132 19.976 -7.455 1.633 1.00 0.00 C ATOM 2173 NH1 ARG A 132 19.556 -8.599 2.190 1.00 0.00 N ATOM 2174 NH2 ARG A 132 21.287 -7.196 1.542 1.00 0.00 N ATOM 0 H ARG A 132 14.720 -3.342 -0.153 1.00 0.00 H new ATOM 0 HA ARG A 132 14.870 -5.824 -1.753 1.00 0.00 H new ATOM 0 HB2 ARG A 132 17.039 -6.161 -1.116 1.00 0.00 H new ATOM 0 HB3 ARG A 132 17.051 -4.414 -0.976 1.00 0.00 H new ATOM 0 HG2 ARG A 132 17.529 -4.608 1.228 1.00 0.00 H new ATOM 0 HG3 ARG A 132 15.979 -5.385 1.486 1.00 0.00 H new ATOM 0 HD2 ARG A 132 17.326 -7.123 2.206 1.00 0.00 H new ATOM 0 HD3 ARG A 132 17.317 -7.525 0.501 1.00 0.00 H new ATOM 0 HE ARG A 132 19.438 -5.709 0.750 1.00 0.00 H new ATOM 0 HH11 ARG A 132 18.558 -8.796 2.259 1.00 0.00 H new ATOM 0 HH12 ARG A 132 20.235 -9.273 2.545 1.00 0.00 H new ATOM 0 HH21 ARG A 132 21.607 -6.325 1.118 1.00 0.00 H new ATOM 0 HH22 ARG A 132 21.966 -7.870 1.897 1.00 0.00 H new ATOM 2188 N LYS A 133 14.273 -7.295 0.238 1.00 0.00 N ATOM 2189 CA LYS A 133 13.618 -8.078 1.273 1.00 0.00 C ATOM 2190 C LYS A 133 12.102 -7.909 1.153 1.00 0.00 C ATOM 2191 O LYS A 133 11.342 -8.790 1.551 1.00 0.00 O ATOM 2192 CB LYS A 133 14.171 -7.711 2.652 1.00 0.00 C ATOM 2193 CG LYS A 133 14.623 -8.960 3.412 1.00 0.00 C ATOM 2194 CD LYS A 133 14.154 -8.916 4.868 1.00 0.00 C ATOM 2195 CE LYS A 133 15.085 -9.730 5.768 1.00 0.00 C ATOM 2196 NZ LYS A 133 14.718 -9.550 7.191 1.00 0.00 N ATOM 0 H LYS A 133 14.635 -7.840 -0.544 1.00 0.00 H new ATOM 0 HA LYS A 133 13.831 -9.139 1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.011 -7.025 2.540 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.407 -7.188 3.227 1.00 0.00 H new ATOM 0 HG2 LYS A 133 14.225 -9.850 2.925 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.710 -9.037 3.378 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.121 -7.882 5.212 1.00 0.00 H new ATOM 0 HD3 LYS A 133 13.139 -9.308 4.939 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.027 -10.785 5.502 1.00 0.00 H new ATOM 0 HE3 LYS A 133 16.117 -9.418 5.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.649 -10.480 7.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.446 -8.980 7.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.801 -9.063 7.254 1.00 0.00 H new