USER MOD reduce.3.24.130724 H: found=0, std=0, add=1998, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1997 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 NoAdj-H: B 48 LYS HZ1 : B 48 LYS NZ : C 76 GLY C :(NH2R) USER MOD NoAdj-H: B 48 LYS HZ3 : B 48 LYS NZ : C 76 GLY C :(NH2R) USER MOD Set 1.1: C 25 ASN :FLIP amide:sc= -0.512 F(o=-13!,f=-0.28) USER MOD Set 1.2: C 29 LYS NZ :NH3+ -177:sc= 0.232 (180deg=-0.023) USER MOD Set 2.1: C 7 THR OG1 : rot 122:sc= 0.348 USER MOD Set 2.2: C 9 THR OG1 : rot 180:sc= 0.311 USER MOD Set 3.1: B 55 THR OG1 : rot 116:sc= 0.422 USER MOD Set 3.2: B 57 SER OG : rot -111:sc= 1.94 USER MOD Set 4.1: B 25 ASN :FLIP amide:sc= -0.0354 F(o=-12!,f=0.88) USER MOD Set 4.2: B 29 LYS NZ :NH3+ 156:sc= 0.917 (180deg=-0.0527) USER MOD Set 5.1: B 7 THR OG1 : rot -73:sc= 1.94 USER MOD Set 5.2: B 9 THR OG1 : rot -64:sc= 0.912 USER MOD Set 6.1: A 543 THR OG1 : rot -166:sc= -0.164 USER MOD Set 6.2: A 574 TYR OH : rot 30:sc= 0.0379 USER MOD Single : A 500 SER OG : rot -41:sc= -0.0369! USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 502 ASN : amide:sc= -0.476 K(o=-0.48,f=-4.3!) USER MOD Single : A 515 SER OG : rot -170:sc= -0.0562 USER MOD Single : A 516 THR OG1 : rot -3:sc= 1.41 USER MOD Single : A 522 THR OG1 : rot 180:sc= 0.0442 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 532 HIS : no HD1:sc=-0.000646 X(o=-0.00065,f=0) USER MOD Single : A 537 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 CYS SG : rot 180:sc= 0.0686 USER MOD Single : A 539 ASN : amide:sc= -2.84! C(o=-2.8!,f=-9.1!) USER MOD Single : A 544 THR OG1 : rot 160:sc= -0.706 USER MOD Single : A 545 SER OG : rot -83:sc= 0.726 USER MOD Single : A 547 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 549 ASN : amide:sc= -4.71! C(o=-4.7!,f=-6.5!) USER MOD Single : A 575 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 580 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.21) USER MOD Single : A 587 THR OG1 : rot 71:sc= 0.198 USER MOD Single : A 589 SER OG : rot -44:sc= 1.26 USER MOD Single : A 593 HIS : no HD1:sc= -1.34! C(o=-1.3!,f=-5.5!) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 100:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= -0.428 USER MOD Single : A 605 SER OG : rot 180:sc= 0 USER MOD Single : A 606 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -167:sc= 0 (180deg=-0.427) USER MOD Single : B 1 MET N :NH3+ 154:sc= 0.364! (180deg=-0.909!) USER MOD Single : B 2 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.15) USER MOD Single : B 6 LYS NZ :NH3+ -157:sc= -0.0426 (180deg=-0.312) USER MOD Single : B 11 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.161) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -72:sc= 1.58 USER MOD Single : B 20 SER OG : rot -41:sc= 0.0585 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.0226 USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= -0.781 K(o=-0.78,f=-2.4!) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN :FLIP amide:sc= -0.029 F(o=-1,f=-0.029) USER MOD Single : B 41 GLN : amide:sc= 0.0197 K(o=0.02,f=-1.5!) USER MOD Single : B 48 LYS NZ :NH3+ -91:sc= 1.1 (180deg=-0.8) USER MOD Single : B 49 GLN : amide:sc= -3.64! C(o=-3.6!,f=-3.8!) USER MOD Single : B 59 TYR OH : rot 150:sc= 0.0878 USER MOD Single : B 60 ASN : amide:sc= -0.0191 K(o=-0.019,f=-2!) USER MOD Single : B 62 GLN :FLIP amide:sc= 0 F(o=-1!,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 117:sc= 1.15 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -0.159 X(o=-0.16,f=-0.5) USER MOD Single : C 1 MET CE :methyl -158:sc= -0.0791 (180deg=-1.26) USER MOD Single : C 1 MET N :NH3+ 163:sc= 0.0582 (180deg=-1.09!) USER MOD Single : C 2 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.12) USER MOD Single : C 6 LYS NZ :NH3+ 143:sc= 0.953 (180deg=-0.527!) USER MOD Single : C 11 LYS NZ :NH3+ -132:sc= 1.27 (180deg=0.541) USER MOD Single : C 12 THR OG1 : rot 180:sc= 0 USER MOD Single : C 14 THR OG1 : rot -61:sc= 0.893 USER MOD Single : C 20 SER OG : rot -46:sc= 0.0919 USER MOD Single : C 22 THR OG1 : rot 180:sc= 0.147 USER MOD Single : C 27 LYS NZ :NH3+ -159:sc= 0.642 (180deg=0.4) USER MOD Single : C 31 GLN : amide:sc= -0.921 K(o=-0.92,f=-3!) USER MOD Single : C 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 40 GLN :FLIP amide:sc= -0.25 F(o=-3.5!,f=-0.25) USER MOD Single : C 41 GLN : amide:sc= -2.19! C(o=-2.2!,f=-7.1!) USER MOD Single : C 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 49 GLN : amide:sc= 0 X(o=0,f=0.11) USER MOD Single : C 55 THR OG1 : rot -51:sc= 0.849 USER MOD Single : C 57 SER OG : rot 180:sc= 0 USER MOD Single : C 59 TYR OH : rot 180:sc= 0 USER MOD Single : C 60 ASN : amide:sc= -0.147 X(o=-0.15,f=-0.63) USER MOD Single : C 62 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : C 63 LYS NZ :NH3+ 165:sc= -0.189 (180deg=-0.691) USER MOD Single : C 65 SER OG : rot -170:sc= 0 USER MOD Single : C 66 THR OG1 : rot 180:sc= 0 USER MOD Single : C 68 HIS : no HD1:sc= -0.0469 X(o=-0.047,f=-0.094) USER MOD ----------------------------------------------------------------- ATOM 176 N GLY A 494 -20.752 -4.488 -5.511 1.00 0.00 N ATOM 177 CA GLY A 494 -21.772 -3.869 -4.672 1.00 0.00 C ATOM 178 C GLY A 494 -22.736 -4.916 -4.128 1.00 0.00 C ATOM 179 O GLY A 494 -23.184 -4.827 -2.984 1.00 0.00 O ATOM 0 HA2 GLY A 494 -21.297 -3.341 -3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 494 -22.323 -3.127 -5.250 1.00 0.00 H new ATOM 183 N ILE A 495 -23.053 -5.908 -4.954 1.00 0.00 N ATOM 184 CA ILE A 495 -23.966 -6.969 -4.543 1.00 0.00 C ATOM 185 C ILE A 495 -23.231 -8.013 -3.708 1.00 0.00 C ATOM 186 O ILE A 495 -23.837 -8.707 -2.892 1.00 0.00 O ATOM 187 CB ILE A 495 -24.578 -7.636 -5.775 1.00 0.00 C ATOM 188 CG1 ILE A 495 -25.144 -6.562 -6.708 1.00 0.00 C ATOM 189 CG2 ILE A 495 -25.704 -8.576 -5.340 1.00 0.00 C ATOM 190 CD1 ILE A 495 -25.687 -7.222 -7.977 1.00 0.00 C ATOM 0 H ILE A 495 -22.695 -6.000 -5.905 1.00 0.00 H new ATOM 0 HA ILE A 495 -24.758 -6.528 -3.938 1.00 0.00 H new ATOM 0 HB ILE A 495 -23.810 -8.206 -6.298 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -25.938 -6.010 -6.205 1.00 0.00 H new ATOM 0 HG13 ILE A 495 -24.367 -5.842 -6.964 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -26.141 -9.052 -6.218 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -25.303 -9.341 -4.675 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -26.472 -8.006 -4.817 1.00 0.00 H new ATOM 0 HD11 ILE A 495 -26.090 -6.457 -8.641 1.00 0.00 H new ATOM 0 HD12 ILE A 495 -24.882 -7.755 -8.483 1.00 0.00 H new ATOM 0 HD13 ILE A 495 -26.477 -7.925 -7.712 1.00 0.00 H new ATOM 202 N ALA A 496 -21.923 -8.117 -3.918 1.00 0.00 N ATOM 203 CA ALA A 496 -21.115 -9.080 -3.178 1.00 0.00 C ATOM 204 C ALA A 496 -20.811 -8.560 -1.777 1.00 0.00 C ATOM 205 O ALA A 496 -20.160 -9.237 -0.981 1.00 0.00 O ATOM 206 CB ALA A 496 -19.804 -9.343 -3.922 1.00 0.00 C ATOM 0 H ALA A 496 -21.403 -7.551 -4.589 1.00 0.00 H new ATOM 0 HA ALA A 496 -21.678 -10.010 -3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 496 -19.206 -10.063 -3.363 1.00 0.00 H new ATOM 0 HB2 ALA A 496 -20.022 -9.743 -4.912 1.00 0.00 H new ATOM 0 HB3 ALA A 496 -19.249 -8.410 -4.022 1.00 0.00 H new ATOM 212 N PHE A 497 -21.288 -7.355 -1.481 1.00 0.00 N ATOM 213 CA PHE A 497 -21.061 -6.754 -0.172 1.00 0.00 C ATOM 214 C PHE A 497 -21.243 -7.791 0.933 1.00 0.00 C ATOM 215 O PHE A 497 -20.271 -8.253 1.530 1.00 0.00 O ATOM 216 CB PHE A 497 -22.037 -5.594 0.046 1.00 0.00 C ATOM 217 CG PHE A 497 -21.347 -4.288 -0.267 1.00 0.00 C ATOM 218 CD1 PHE A 497 -20.529 -4.183 -1.398 1.00 0.00 C ATOM 219 CD2 PHE A 497 -21.525 -3.183 0.574 1.00 0.00 C ATOM 220 CE1 PHE A 497 -19.888 -2.973 -1.688 1.00 0.00 C ATOM 221 CE2 PHE A 497 -20.884 -1.972 0.284 1.00 0.00 C ATOM 222 CZ PHE A 497 -20.066 -1.867 -0.847 1.00 0.00 C ATOM 0 H PHE A 497 -21.830 -6.779 -2.125 1.00 0.00 H new ATOM 0 HA PHE A 497 -20.038 -6.379 -0.137 1.00 0.00 H new ATOM 0 HB2 PHE A 497 -22.912 -5.717 -0.592 1.00 0.00 H new ATOM 0 HB3 PHE A 497 -22.391 -5.592 1.077 1.00 0.00 H new ATOM 0 HD1 PHE A 497 -20.392 -5.036 -2.047 1.00 0.00 H new ATOM 0 HD2 PHE A 497 -22.157 -3.264 1.446 1.00 0.00 H new ATOM 0 HE1 PHE A 497 -19.256 -2.892 -2.560 1.00 0.00 H new ATOM 0 HE2 PHE A 497 -21.021 -1.119 0.933 1.00 0.00 H new ATOM 0 HZ PHE A 497 -19.572 -0.933 -1.071 1.00 0.00 H new ATOM 232 N ALA A 498 -22.495 -8.150 1.199 1.00 0.00 N ATOM 233 CA ALA A 498 -22.793 -9.132 2.235 1.00 0.00 C ATOM 234 C ALA A 498 -22.749 -10.546 1.663 1.00 0.00 C ATOM 235 O ALA A 498 -23.181 -11.500 2.309 1.00 0.00 O ATOM 236 CB ALA A 498 -24.178 -8.862 2.827 1.00 0.00 C ATOM 0 H ALA A 498 -23.313 -7.779 0.716 1.00 0.00 H new ATOM 0 HA ALA A 498 -22.040 -9.046 3.018 1.00 0.00 H new ATOM 0 HB1 ALA A 498 -24.393 -9.600 3.600 1.00 0.00 H new ATOM 0 HB2 ALA A 498 -24.199 -7.863 3.263 1.00 0.00 H new ATOM 0 HB3 ALA A 498 -24.930 -8.931 2.041 1.00 0.00 H new ATOM 242 N GLY A 499 -22.225 -10.672 0.449 1.00 0.00 N ATOM 243 CA GLY A 499 -22.129 -11.974 -0.200 1.00 0.00 C ATOM 244 C GLY A 499 -21.654 -13.038 0.784 1.00 0.00 C ATOM 245 O GLY A 499 -22.460 -13.683 1.454 1.00 0.00 O ATOM 0 H GLY A 499 -21.862 -9.894 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -23.101 -12.255 -0.605 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -21.438 -11.916 -1.041 1.00 0.00 H new ATOM 249 N SER A 500 -20.339 -13.216 0.865 1.00 0.00 N ATOM 250 CA SER A 500 -19.766 -14.205 1.772 1.00 0.00 C ATOM 251 C SER A 500 -18.261 -13.999 1.908 1.00 0.00 C ATOM 252 O SER A 500 -17.502 -14.960 2.031 1.00 0.00 O ATOM 253 CB SER A 500 -20.045 -15.614 1.250 1.00 0.00 C ATOM 254 OG SER A 500 -21.406 -15.707 0.851 1.00 0.00 O ATOM 0 H SER A 500 -19.655 -12.693 0.318 1.00 0.00 H new ATOM 0 HA SER A 500 -20.227 -14.083 2.752 1.00 0.00 H new ATOM 0 HB2 SER A 500 -19.391 -15.838 0.407 1.00 0.00 H new ATOM 0 HB3 SER A 500 -19.830 -16.350 2.025 1.00 0.00 H new ATOM 0 HG SER A 500 -21.970 -15.239 1.501 1.00 0.00 H new ATOM 260 N LYS A 501 -17.837 -12.739 1.885 1.00 0.00 N ATOM 261 CA LYS A 501 -16.419 -12.418 2.007 1.00 0.00 C ATOM 262 C LYS A 501 -15.635 -13.001 0.836 1.00 0.00 C ATOM 263 O LYS A 501 -15.304 -14.187 0.827 1.00 0.00 O ATOM 264 CB LYS A 501 -15.868 -12.974 3.321 1.00 0.00 C ATOM 265 CG LYS A 501 -14.541 -12.288 3.650 1.00 0.00 C ATOM 266 CD LYS A 501 -13.990 -12.842 4.965 1.00 0.00 C ATOM 267 CE LYS A 501 -12.908 -11.904 5.502 1.00 0.00 C ATOM 268 NZ LYS A 501 -12.318 -12.483 6.742 1.00 0.00 N1+ ATOM 0 H LYS A 501 -18.449 -11.930 1.784 1.00 0.00 H new ATOM 0 HA LYS A 501 -16.309 -11.334 1.998 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -16.584 -12.809 4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -15.722 -14.051 3.239 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -13.825 -12.454 2.845 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -14.687 -11.211 3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -14.794 -12.942 5.694 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -13.577 -13.838 4.807 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -12.132 -11.759 4.751 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -13.334 -10.923 5.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -11.582 -11.845 7.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -13.062 -12.599 7.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -11.897 -13.409 6.526 1.00 0.00 H new ATOM 282 N ASN A 502 -15.340 -12.160 -0.149 1.00 0.00 N ATOM 283 CA ASN A 502 -14.594 -12.600 -1.322 1.00 0.00 C ATOM 284 C ASN A 502 -13.252 -11.880 -1.404 1.00 0.00 C ATOM 285 O ASN A 502 -13.085 -10.793 -0.851 1.00 0.00 O ATOM 286 CB ASN A 502 -15.402 -12.321 -2.590 1.00 0.00 C ATOM 287 CG ASN A 502 -16.730 -13.069 -2.537 1.00 0.00 C ATOM 288 OD1 ASN A 502 -16.970 -13.845 -1.612 1.00 0.00 O ATOM 289 ND2 ASN A 502 -17.613 -12.880 -3.479 1.00 0.00 N ATOM 0 H ASN A 502 -15.604 -11.175 -0.159 1.00 0.00 H new ATOM 0 HA ASN A 502 -14.415 -13.672 -1.234 1.00 0.00 H new ATOM 0 HB2 ASN A 502 -15.582 -11.250 -2.688 1.00 0.00 H new ATOM 0 HB3 ASN A 502 -14.835 -12.631 -3.468 1.00 0.00 H new ATOM 0 HD21 ASN A 502 -18.504 -13.376 -3.450 1.00 0.00 H new ATOM 0 HD22 ASN A 502 -17.412 -12.237 -4.245 1.00 0.00 H new ATOM 296 N ASP A 503 -12.299 -12.493 -2.099 1.00 0.00 N ATOM 297 CA ASP A 503 -10.975 -11.901 -2.248 1.00 0.00 C ATOM 298 C ASP A 503 -10.957 -10.915 -3.411 1.00 0.00 C ATOM 299 O ASP A 503 -9.925 -10.316 -3.715 1.00 0.00 O ATOM 300 CB ASP A 503 -9.936 -12.998 -2.490 1.00 0.00 C ATOM 301 CG ASP A 503 -10.442 -13.969 -3.552 1.00 0.00 C ATOM 302 OD1 ASP A 503 -10.820 -13.508 -4.616 1.00 0.00 O ATOM 303 OD2 ASP A 503 -10.444 -15.159 -3.285 1.00 0.00 O1- ATOM 0 H ASP A 503 -12.418 -13.393 -2.565 1.00 0.00 H new ATOM 0 HA ASP A 503 -10.731 -11.367 -1.330 1.00 0.00 H new ATOM 0 HB2 ASP A 503 -8.994 -12.554 -2.811 1.00 0.00 H new ATOM 0 HB3 ASP A 503 -9.737 -13.533 -1.561 1.00 0.00 H new ATOM 308 N GLU A 504 -12.108 -10.746 -4.055 1.00 0.00 N ATOM 309 CA GLU A 504 -12.213 -9.826 -5.180 1.00 0.00 C ATOM 310 C GLU A 504 -12.450 -8.409 -4.677 1.00 0.00 C ATOM 311 O GLU A 504 -12.071 -7.435 -5.327 1.00 0.00 O ATOM 312 CB GLU A 504 -13.365 -10.246 -6.096 1.00 0.00 C ATOM 313 CG GLU A 504 -12.978 -11.519 -6.852 1.00 0.00 C ATOM 314 CD GLU A 504 -11.932 -11.197 -7.913 1.00 0.00 C ATOM 315 OE1 GLU A 504 -12.292 -10.586 -8.906 1.00 0.00 O ATOM 316 OE2 GLU A 504 -10.785 -11.565 -7.717 1.00 0.00 O1- ATOM 0 H GLU A 504 -12.974 -11.230 -3.819 1.00 0.00 H new ATOM 0 HA GLU A 504 -11.280 -9.854 -5.742 1.00 0.00 H new ATOM 0 HB2 GLU A 504 -14.266 -10.419 -5.508 1.00 0.00 H new ATOM 0 HB3 GLU A 504 -13.593 -9.447 -6.801 1.00 0.00 H new ATOM 0 HG2 GLU A 504 -12.586 -12.260 -6.156 1.00 0.00 H new ATOM 0 HG3 GLU A 504 -13.860 -11.956 -7.320 1.00 0.00 H new ATOM 323 N VAL A 505 -13.076 -8.306 -3.511 1.00 0.00 N ATOM 324 CA VAL A 505 -13.358 -7.007 -2.919 1.00 0.00 C ATOM 325 C VAL A 505 -12.074 -6.194 -2.786 1.00 0.00 C ATOM 326 O VAL A 505 -11.903 -5.174 -3.451 1.00 0.00 O ATOM 327 CB VAL A 505 -13.995 -7.192 -1.541 1.00 0.00 C ATOM 328 CG1 VAL A 505 -14.621 -5.874 -1.087 1.00 0.00 C ATOM 329 CG2 VAL A 505 -15.081 -8.267 -1.622 1.00 0.00 C ATOM 0 H VAL A 505 -13.396 -9.103 -2.960 1.00 0.00 H new ATOM 0 HA VAL A 505 -14.049 -6.470 -3.568 1.00 0.00 H new ATOM 0 HB VAL A 505 -13.231 -7.498 -0.827 1.00 0.00 H new ATOM 0 HG11 VAL A 505 -15.075 -6.006 -0.105 1.00 0.00 H new ATOM 0 HG12 VAL A 505 -13.850 -5.106 -1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 505 -15.385 -5.569 -1.802 1.00 0.00 H new ATOM 0 HG21 VAL A 505 -15.536 -8.400 -0.640 1.00 0.00 H new ATOM 0 HG22 VAL A 505 -15.844 -7.960 -2.337 1.00 0.00 H new ATOM 0 HG23 VAL A 505 -14.638 -9.208 -1.947 1.00 0.00 H new ATOM 339 N LEU A 506 -11.174 -6.657 -1.925 1.00 0.00 N ATOM 340 CA LEU A 506 -9.907 -5.966 -1.715 1.00 0.00 C ATOM 341 C LEU A 506 -8.996 -6.137 -2.926 1.00 0.00 C ATOM 342 O LEU A 506 -8.099 -5.326 -3.159 1.00 0.00 O ATOM 343 CB LEU A 506 -9.212 -6.518 -0.469 1.00 0.00 C ATOM 344 CG LEU A 506 -10.250 -6.771 0.626 1.00 0.00 C ATOM 345 CD1 LEU A 506 -9.540 -7.167 1.921 1.00 0.00 C ATOM 346 CD2 LEU A 506 -11.063 -5.496 0.861 1.00 0.00 C ATOM 0 H LEU A 506 -11.296 -7.501 -1.365 1.00 0.00 H new ATOM 0 HA LEU A 506 -10.112 -4.904 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 506 -8.690 -7.444 -0.711 1.00 0.00 H new ATOM 0 HB3 LEU A 506 -8.461 -5.812 -0.116 1.00 0.00 H new ATOM 0 HG LEU A 506 -10.916 -7.576 0.316 1.00 0.00 H new ATOM 0 HD11 LEU A 506 -10.280 -7.347 2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 506 -8.959 -8.074 1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 506 -8.874 -6.362 2.232 1.00 0.00 H new ATOM 0 HD21 LEU A 506 -11.803 -5.675 1.641 1.00 0.00 H new ATOM 0 HD22 LEU A 506 -10.396 -4.691 1.171 1.00 0.00 H new ATOM 0 HD23 LEU A 506 -11.570 -5.212 -0.061 1.00 0.00 H new ATOM 358 N GLY A 507 -9.229 -7.197 -3.694 1.00 0.00 N ATOM 359 CA GLY A 507 -8.420 -7.462 -4.878 1.00 0.00 C ATOM 360 C GLY A 507 -8.665 -6.413 -5.957 1.00 0.00 C ATOM 361 O GLY A 507 -7.920 -6.330 -6.934 1.00 0.00 O ATOM 0 H GLY A 507 -9.965 -7.881 -3.520 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -7.364 -7.469 -4.607 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -8.655 -8.452 -5.269 1.00 0.00 H new ATOM 365 N LEU A 508 -9.713 -5.614 -5.777 1.00 0.00 N ATOM 366 CA LEU A 508 -10.046 -4.575 -6.748 1.00 0.00 C ATOM 367 C LEU A 508 -10.112 -3.207 -6.074 1.00 0.00 C ATOM 368 O LEU A 508 -9.582 -2.223 -6.591 1.00 0.00 O ATOM 369 CB LEU A 508 -11.395 -4.888 -7.403 1.00 0.00 C ATOM 370 CG LEU A 508 -11.173 -5.349 -8.846 1.00 0.00 C ATOM 371 CD1 LEU A 508 -10.473 -6.710 -8.848 1.00 0.00 C ATOM 372 CD2 LEU A 508 -12.525 -5.471 -9.553 1.00 0.00 C ATOM 0 H LEU A 508 -10.342 -5.664 -4.975 1.00 0.00 H new ATOM 0 HA LEU A 508 -9.266 -4.553 -7.509 1.00 0.00 H new ATOM 0 HB2 LEU A 508 -11.913 -5.664 -6.839 1.00 0.00 H new ATOM 0 HB3 LEU A 508 -12.032 -4.003 -7.387 1.00 0.00 H new ATOM 0 HG LEU A 508 -10.551 -4.622 -9.368 1.00 0.00 H new ATOM 0 HD11 LEU A 508 -10.316 -7.037 -9.876 1.00 0.00 H new ATOM 0 HD12 LEU A 508 -9.511 -6.625 -8.343 1.00 0.00 H new ATOM 0 HD13 LEU A 508 -11.093 -7.439 -8.326 1.00 0.00 H new ATOM 0 HD21 LEU A 508 -12.370 -5.799 -10.581 1.00 0.00 H new ATOM 0 HD22 LEU A 508 -13.145 -6.199 -9.029 1.00 0.00 H new ATOM 0 HD23 LEU A 508 -13.024 -4.502 -9.553 1.00 0.00 H new ATOM 384 N LEU A 509 -10.769 -3.150 -4.920 1.00 0.00 N ATOM 385 CA LEU A 509 -10.902 -1.895 -4.189 1.00 0.00 C ATOM 386 C LEU A 509 -9.552 -1.437 -3.643 1.00 0.00 C ATOM 387 O LEU A 509 -9.113 -0.318 -3.911 1.00 0.00 O ATOM 388 CB LEU A 509 -11.891 -2.065 -3.033 1.00 0.00 C ATOM 389 CG LEU A 509 -13.314 -1.793 -3.529 1.00 0.00 C ATOM 390 CD1 LEU A 509 -13.704 -2.842 -4.572 1.00 0.00 C ATOM 391 CD2 LEU A 509 -14.285 -1.864 -2.349 1.00 0.00 C ATOM 0 H LEU A 509 -11.215 -3.952 -4.474 1.00 0.00 H new ATOM 0 HA LEU A 509 -11.274 -1.137 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -11.823 -3.075 -2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -11.640 -1.380 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 509 -13.357 -0.801 -3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 509 -14.717 -2.646 -4.924 1.00 0.00 H new ATOM 0 HD12 LEU A 509 -13.012 -2.794 -5.413 1.00 0.00 H new ATOM 0 HD13 LEU A 509 -13.661 -3.835 -4.124 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -15.299 -1.671 -2.700 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -14.240 -2.856 -1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -14.010 -1.116 -1.606 1.00 0.00 H new ATOM 403 N LEU A 510 -8.900 -2.303 -2.873 1.00 0.00 N ATOM 404 CA LEU A 510 -7.605 -1.965 -2.294 1.00 0.00 C ATOM 405 C LEU A 510 -6.701 -1.311 -3.338 1.00 0.00 C ATOM 406 O LEU A 510 -6.272 -0.170 -3.167 1.00 0.00 O ATOM 407 CB LEU A 510 -6.933 -3.220 -1.728 1.00 0.00 C ATOM 408 CG LEU A 510 -6.053 -2.840 -0.534 1.00 0.00 C ATOM 409 CD1 LEU A 510 -6.931 -2.343 0.618 1.00 0.00 C ATOM 410 CD2 LEU A 510 -5.261 -4.068 -0.078 1.00 0.00 C ATOM 0 H LEU A 510 -9.243 -3.234 -2.638 1.00 0.00 H new ATOM 0 HA LEU A 510 -7.767 -1.255 -1.483 1.00 0.00 H new ATOM 0 HB2 LEU A 510 -7.689 -3.942 -1.420 1.00 0.00 H new ATOM 0 HB3 LEU A 510 -6.330 -3.700 -2.498 1.00 0.00 H new ATOM 0 HG LEU A 510 -5.365 -2.048 -0.829 1.00 0.00 H new ATOM 0 HD11 LEU A 510 -6.301 -2.074 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 510 -7.496 -1.469 0.294 1.00 0.00 H new ATOM 0 HD13 LEU A 510 -7.622 -3.132 0.916 1.00 0.00 H new ATOM 0 HD21 LEU A 510 -4.633 -3.801 0.772 1.00 0.00 H new ATOM 0 HD22 LEU A 510 -5.952 -4.858 0.215 1.00 0.00 H new ATOM 0 HD23 LEU A 510 -4.633 -4.420 -0.896 1.00 0.00 H new ATOM 422 N PRO A 511 -6.407 -2.003 -4.409 1.00 0.00 N ATOM 423 CA PRO A 511 -5.539 -1.467 -5.491 1.00 0.00 C ATOM 424 C PRO A 511 -5.960 -0.060 -5.906 1.00 0.00 C ATOM 425 O PRO A 511 -5.142 0.859 -5.942 1.00 0.00 O ATOM 426 CB PRO A 511 -5.714 -2.449 -6.660 1.00 0.00 C ATOM 427 CG PRO A 511 -6.682 -3.503 -6.212 1.00 0.00 C ATOM 428 CD PRO A 511 -6.865 -3.364 -4.701 1.00 0.00 C ATOM 0 HA PRO A 511 -4.502 -1.384 -5.166 1.00 0.00 H new ATOM 0 HB2 PRO A 511 -6.089 -1.933 -7.544 1.00 0.00 H new ATOM 0 HB3 PRO A 511 -4.758 -2.896 -6.934 1.00 0.00 H new ATOM 0 HG2 PRO A 511 -7.637 -3.386 -6.724 1.00 0.00 H new ATOM 0 HG3 PRO A 511 -6.307 -4.496 -6.461 1.00 0.00 H new ATOM 0 HD2 PRO A 511 -7.906 -3.505 -4.411 1.00 0.00 H new ATOM 0 HD3 PRO A 511 -6.280 -4.107 -4.159 1.00 0.00 H new ATOM 436 N ILE A 512 -7.243 0.097 -6.218 1.00 0.00 N ATOM 437 CA ILE A 512 -7.768 1.394 -6.630 1.00 0.00 C ATOM 438 C ILE A 512 -7.475 2.452 -5.572 1.00 0.00 C ATOM 439 O ILE A 512 -7.586 3.650 -5.833 1.00 0.00 O ATOM 440 CB ILE A 512 -9.278 1.298 -6.853 1.00 0.00 C ATOM 441 CG1 ILE A 512 -9.559 0.394 -8.055 1.00 0.00 C ATOM 442 CG2 ILE A 512 -9.846 2.693 -7.123 1.00 0.00 C ATOM 443 CD1 ILE A 512 -11.035 -0.009 -8.059 1.00 0.00 C ATOM 0 H ILE A 512 -7.934 -0.653 -6.194 1.00 0.00 H new ATOM 0 HA ILE A 512 -7.280 1.683 -7.561 1.00 0.00 H new ATOM 0 HB ILE A 512 -9.749 0.880 -5.963 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -9.311 0.914 -8.980 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -8.929 -0.494 -8.010 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -10.922 2.623 -7.282 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -9.646 3.339 -6.268 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -9.375 3.112 -8.012 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -11.234 -0.653 -8.916 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -11.268 -0.546 -7.140 1.00 0.00 H new ATOM 0 HD13 ILE A 512 -11.656 0.884 -8.125 1.00 0.00 H new ATOM 455 N ALA A 513 -7.102 2.003 -4.378 1.00 0.00 N ATOM 456 CA ALA A 513 -6.798 2.924 -3.289 1.00 0.00 C ATOM 457 C ALA A 513 -5.581 2.447 -2.502 1.00 0.00 C ATOM 458 O ALA A 513 -5.491 2.661 -1.293 1.00 0.00 O ATOM 459 CB ALA A 513 -8.002 3.037 -2.351 1.00 0.00 C ATOM 0 H ALA A 513 -7.004 1.016 -4.141 1.00 0.00 H new ATOM 0 HA ALA A 513 -6.576 3.901 -3.718 1.00 0.00 H new ATOM 0 HB1 ALA A 513 -7.768 3.727 -1.540 1.00 0.00 H new ATOM 0 HB2 ALA A 513 -8.863 3.409 -2.907 1.00 0.00 H new ATOM 0 HB3 ALA A 513 -8.234 2.056 -1.937 1.00 0.00 H new ATOM 465 N ALA A 514 -4.648 1.800 -3.193 1.00 0.00 N ATOM 466 CA ALA A 514 -3.443 1.299 -2.540 1.00 0.00 C ATOM 467 C ALA A 514 -2.290 1.198 -3.535 1.00 0.00 C ATOM 468 O ALA A 514 -1.141 1.477 -3.196 1.00 0.00 O ATOM 469 CB ALA A 514 -3.714 -0.077 -1.930 1.00 0.00 C ATOM 0 H ALA A 514 -4.701 1.612 -4.194 1.00 0.00 H new ATOM 0 HA ALA A 514 -3.165 1.999 -1.752 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -2.810 -0.444 -1.444 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -4.514 0.002 -1.194 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -4.011 -0.771 -2.716 1.00 0.00 H new ATOM 475 N SER A 515 -2.605 0.795 -4.762 1.00 0.00 N ATOM 476 CA SER A 515 -1.585 0.659 -5.798 1.00 0.00 C ATOM 477 C SER A 515 -0.476 1.687 -5.600 1.00 0.00 C ATOM 478 O SER A 515 0.694 1.333 -5.453 1.00 0.00 O ATOM 479 CB SER A 515 -2.215 0.846 -7.178 1.00 0.00 C ATOM 480 OG SER A 515 -1.186 0.958 -8.152 1.00 0.00 O ATOM 0 H SER A 515 -3.551 0.558 -5.063 1.00 0.00 H new ATOM 0 HA SER A 515 -1.154 -0.340 -5.727 1.00 0.00 H new ATOM 0 HB2 SER A 515 -2.863 0.001 -7.412 1.00 0.00 H new ATOM 0 HB3 SER A 515 -2.840 1.739 -7.187 1.00 0.00 H new ATOM 0 HG SER A 515 -1.575 1.234 -9.008 1.00 0.00 H new ATOM 486 N THR A 516 -0.853 2.961 -5.596 1.00 0.00 N ATOM 487 CA THR A 516 0.117 4.035 -5.414 1.00 0.00 C ATOM 488 C THR A 516 -0.596 5.372 -5.238 1.00 0.00 C ATOM 489 O THR A 516 -0.263 6.152 -4.346 1.00 0.00 O ATOM 490 CB THR A 516 1.051 4.108 -6.625 1.00 0.00 C ATOM 491 OG1 THR A 516 1.891 2.962 -6.642 1.00 0.00 O ATOM 492 CG2 THR A 516 1.910 5.371 -6.535 1.00 0.00 C ATOM 0 H THR A 516 -1.816 3.274 -5.716 1.00 0.00 H new ATOM 0 HA THR A 516 0.702 3.825 -4.518 1.00 0.00 H new ATOM 0 HB THR A 516 0.459 4.139 -7.540 1.00 0.00 H new ATOM 0 HG1 THR A 516 1.716 2.417 -5.847 1.00 0.00 H new ATOM 0 HG21 THR A 516 2.574 5.421 -7.398 1.00 0.00 H new ATOM 0 HG22 THR A 516 1.265 6.250 -6.522 1.00 0.00 H new ATOM 0 HG23 THR A 516 2.504 5.343 -5.621 1.00 0.00 H new ATOM 500 N ASP A 517 -1.580 5.626 -6.094 1.00 0.00 N ATOM 501 CA ASP A 517 -2.339 6.870 -6.026 1.00 0.00 C ATOM 502 C ASP A 517 -3.789 6.631 -6.430 1.00 0.00 C ATOM 503 O ASP A 517 -4.679 6.573 -5.581 1.00 0.00 O ATOM 504 CB ASP A 517 -1.714 7.915 -6.952 1.00 0.00 C ATOM 505 CG ASP A 517 -2.351 9.278 -6.705 1.00 0.00 C ATOM 506 OD1 ASP A 517 -3.437 9.311 -6.149 1.00 0.00 O ATOM 507 OD2 ASP A 517 -1.743 10.270 -7.074 1.00 0.00 O1- ATOM 0 H ASP A 517 -1.870 4.992 -6.839 1.00 0.00 H new ATOM 0 HA ASP A 517 -2.314 7.235 -4.999 1.00 0.00 H new ATOM 0 HB2 ASP A 517 -0.639 7.970 -6.779 1.00 0.00 H new ATOM 0 HB3 ASP A 517 -1.855 7.622 -7.992 1.00 0.00 H new ATOM 512 N LEU A 518 -4.019 6.489 -7.732 1.00 0.00 N ATOM 513 CA LEU A 518 -5.366 6.253 -8.239 1.00 0.00 C ATOM 514 C LEU A 518 -6.317 7.346 -7.755 1.00 0.00 C ATOM 515 O LEU A 518 -6.135 7.904 -6.674 1.00 0.00 O ATOM 516 CB LEU A 518 -5.871 4.886 -7.766 1.00 0.00 C ATOM 517 CG LEU A 518 -5.187 3.771 -8.564 1.00 0.00 C ATOM 518 CD1 LEU A 518 -5.780 3.707 -9.974 1.00 0.00 C ATOM 519 CD2 LEU A 518 -3.684 4.050 -8.657 1.00 0.00 C ATOM 0 H LEU A 518 -3.296 6.533 -8.450 1.00 0.00 H new ATOM 0 HA LEU A 518 -5.334 6.270 -9.328 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -5.667 4.762 -6.703 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -6.952 4.825 -7.892 1.00 0.00 H new ATOM 0 HG LEU A 518 -5.349 2.819 -8.058 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -5.291 2.913 -10.539 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -6.849 3.502 -9.910 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -5.623 4.660 -10.478 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -3.201 3.255 -9.225 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -3.521 5.004 -9.158 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -3.259 4.089 -7.654 1.00 0.00 H new ATOM 531 N PRO A 519 -7.319 7.657 -8.533 1.00 0.00 N ATOM 532 CA PRO A 519 -8.317 8.704 -8.182 1.00 0.00 C ATOM 533 C PRO A 519 -8.784 8.583 -6.734 1.00 0.00 C ATOM 534 O PRO A 519 -9.135 7.496 -6.273 1.00 0.00 O ATOM 535 CB PRO A 519 -9.484 8.467 -9.155 1.00 0.00 C ATOM 536 CG PRO A 519 -9.108 7.296 -10.015 1.00 0.00 C ATOM 537 CD PRO A 519 -7.612 7.050 -9.832 1.00 0.00 C ATOM 0 HA PRO A 519 -7.895 9.706 -8.268 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -10.406 8.265 -8.610 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -9.663 9.352 -9.766 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -9.679 6.412 -9.730 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -9.337 7.500 -11.061 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -7.377 5.986 -9.839 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -7.030 7.510 -10.630 1.00 0.00 H new ATOM 545 N ILE A 520 -8.787 9.705 -6.022 1.00 0.00 N ATOM 546 CA ILE A 520 -9.213 9.712 -4.627 1.00 0.00 C ATOM 547 C ILE A 520 -10.731 9.598 -4.530 1.00 0.00 C ATOM 548 O ILE A 520 -11.258 8.922 -3.647 1.00 0.00 O ATOM 549 CB ILE A 520 -8.751 11.001 -3.946 1.00 0.00 C ATOM 550 CG1 ILE A 520 -7.222 11.048 -3.930 1.00 0.00 C ATOM 551 CG2 ILE A 520 -9.276 11.036 -2.509 1.00 0.00 C ATOM 552 CD1 ILE A 520 -6.757 12.413 -3.420 1.00 0.00 C ATOM 0 H ILE A 520 -8.502 10.615 -6.384 1.00 0.00 H new ATOM 0 HA ILE A 520 -8.763 8.856 -4.125 1.00 0.00 H new ATOM 0 HB ILE A 520 -9.137 11.860 -4.495 1.00 0.00 H new ATOM 0 HG12 ILE A 520 -6.830 10.257 -3.291 1.00 0.00 H new ATOM 0 HG13 ILE A 520 -6.832 10.871 -4.932 1.00 0.00 H new ATOM 0 HG21 ILE A 520 -8.947 11.955 -2.024 1.00 0.00 H new ATOM 0 HG22 ILE A 520 -10.365 11.001 -2.519 1.00 0.00 H new ATOM 0 HG23 ILE A 520 -8.890 10.177 -1.960 1.00 0.00 H new ATOM 0 HD11 ILE A 520 -5.668 12.445 -3.409 1.00 0.00 H new ATOM 0 HD12 ILE A 520 -7.137 13.196 -4.077 1.00 0.00 H new ATOM 0 HD13 ILE A 520 -7.135 12.572 -2.410 1.00 0.00 H new ATOM 564 N GLU A 521 -11.429 10.265 -5.445 1.00 0.00 N ATOM 565 CA GLU A 521 -12.887 10.231 -5.453 1.00 0.00 C ATOM 566 C GLU A 521 -13.391 8.794 -5.373 1.00 0.00 C ATOM 567 O GLU A 521 -13.769 8.317 -4.303 1.00 0.00 O ATOM 568 CB GLU A 521 -13.417 10.890 -6.728 1.00 0.00 C ATOM 569 CG GLU A 521 -13.127 12.391 -6.686 1.00 0.00 C ATOM 570 CD GLU A 521 -13.572 13.044 -7.990 1.00 0.00 C ATOM 571 OE1 GLU A 521 -12.826 12.968 -8.953 1.00 0.00 O ATOM 572 OE2 GLU A 521 -14.652 13.611 -8.007 1.00 0.00 O1- ATOM 0 H GLU A 521 -11.012 10.831 -6.184 1.00 0.00 H new ATOM 0 HA GLU A 521 -13.249 10.779 -4.583 1.00 0.00 H new ATOM 0 HB2 GLU A 521 -12.947 10.443 -7.604 1.00 0.00 H new ATOM 0 HB3 GLU A 521 -14.490 10.719 -6.820 1.00 0.00 H new ATOM 0 HG2 GLU A 521 -13.649 12.847 -5.845 1.00 0.00 H new ATOM 0 HG3 GLU A 521 -12.062 12.560 -6.530 1.00 0.00 H new ATOM 579 N THR A 522 -13.393 8.109 -6.511 1.00 0.00 N ATOM 580 CA THR A 522 -13.852 6.725 -6.558 1.00 0.00 C ATOM 581 C THR A 522 -13.272 5.928 -5.395 1.00 0.00 C ATOM 582 O THR A 522 -13.987 5.188 -4.719 1.00 0.00 O ATOM 583 CB THR A 522 -13.433 6.080 -7.881 1.00 0.00 C ATOM 584 OG1 THR A 522 -13.711 6.973 -8.950 1.00 0.00 O ATOM 585 CG2 THR A 522 -14.210 4.779 -8.085 1.00 0.00 C ATOM 0 H THR A 522 -13.084 8.485 -7.407 1.00 0.00 H new ATOM 0 HA THR A 522 -14.939 6.720 -6.480 1.00 0.00 H new ATOM 0 HB THR A 522 -12.365 5.862 -7.858 1.00 0.00 H new ATOM 0 HG1 THR A 522 -13.442 6.562 -9.798 1.00 0.00 H new ATOM 0 HG21 THR A 522 -13.911 4.320 -9.028 1.00 0.00 H new ATOM 0 HG22 THR A 522 -13.995 4.095 -7.264 1.00 0.00 H new ATOM 0 HG23 THR A 522 -15.278 4.993 -8.109 1.00 0.00 H new ATOM 593 N ALA A 523 -11.972 6.085 -5.166 1.00 0.00 N ATOM 594 CA ALA A 523 -11.306 5.375 -4.080 1.00 0.00 C ATOM 595 C ALA A 523 -11.985 5.676 -2.748 1.00 0.00 C ATOM 596 O ALA A 523 -12.035 4.826 -1.860 1.00 0.00 O ATOM 597 CB ALA A 523 -9.835 5.788 -4.011 1.00 0.00 C ATOM 0 H ALA A 523 -11.363 6.693 -5.713 1.00 0.00 H new ATOM 0 HA ALA A 523 -11.373 4.305 -4.275 1.00 0.00 H new ATOM 0 HB1 ALA A 523 -9.345 5.253 -3.197 1.00 0.00 H new ATOM 0 HB2 ALA A 523 -9.344 5.544 -4.953 1.00 0.00 H new ATOM 0 HB3 ALA A 523 -9.766 6.861 -3.833 1.00 0.00 H new ATOM 603 N ALA A 524 -12.506 6.891 -2.617 1.00 0.00 N ATOM 604 CA ALA A 524 -13.180 7.294 -1.388 1.00 0.00 C ATOM 605 C ALA A 524 -14.347 6.359 -1.088 1.00 0.00 C ATOM 606 O ALA A 524 -14.376 5.700 -0.049 1.00 0.00 O ATOM 607 CB ALA A 524 -13.692 8.729 -1.519 1.00 0.00 C ATOM 0 H ALA A 524 -12.475 7.609 -3.341 1.00 0.00 H new ATOM 0 HA ALA A 524 -12.465 7.239 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 524 -14.194 9.022 -0.597 1.00 0.00 H new ATOM 0 HB2 ALA A 524 -12.853 9.399 -1.704 1.00 0.00 H new ATOM 0 HB3 ALA A 524 -14.395 8.790 -2.350 1.00 0.00 H new ATOM 613 N MET A 525 -15.308 6.306 -2.006 1.00 0.00 N ATOM 614 CA MET A 525 -16.473 5.447 -1.829 1.00 0.00 C ATOM 615 C MET A 525 -16.042 4.002 -1.596 1.00 0.00 C ATOM 616 O MET A 525 -16.703 3.255 -0.875 1.00 0.00 O ATOM 617 CB MET A 525 -17.370 5.520 -3.066 1.00 0.00 C ATOM 618 CG MET A 525 -18.019 6.904 -3.145 1.00 0.00 C ATOM 619 SD MET A 525 -19.275 6.907 -4.448 1.00 0.00 S ATOM 620 CE MET A 525 -20.371 8.138 -3.703 1.00 0.00 C ATOM 0 H MET A 525 -15.303 6.843 -2.873 1.00 0.00 H new ATOM 0 HA MET A 525 -17.028 5.795 -0.958 1.00 0.00 H new ATOM 0 HB2 MET A 525 -16.784 5.330 -3.965 1.00 0.00 H new ATOM 0 HB3 MET A 525 -18.138 4.749 -3.017 1.00 0.00 H new ATOM 0 HG2 MET A 525 -18.472 7.160 -2.187 1.00 0.00 H new ATOM 0 HG3 MET A 525 -17.263 7.661 -3.352 1.00 0.00 H new ATOM 0 HE1 MET A 525 -21.232 8.299 -4.352 1.00 0.00 H new ATOM 0 HE2 MET A 525 -20.711 7.781 -2.731 1.00 0.00 H new ATOM 0 HE3 MET A 525 -19.831 9.077 -3.576 1.00 0.00 H new ATOM 630 N ALA A 526 -14.929 3.615 -2.211 1.00 0.00 N ATOM 631 CA ALA A 526 -14.418 2.257 -2.063 1.00 0.00 C ATOM 632 C ALA A 526 -13.950 2.014 -0.632 1.00 0.00 C ATOM 633 O ALA A 526 -14.279 0.994 -0.026 1.00 0.00 O ATOM 634 CB ALA A 526 -13.253 2.029 -3.029 1.00 0.00 C ATOM 0 H ALA A 526 -14.367 4.218 -2.812 1.00 0.00 H new ATOM 0 HA ALA A 526 -15.223 1.559 -2.294 1.00 0.00 H new ATOM 0 HB1 ALA A 526 -12.877 1.013 -2.912 1.00 0.00 H new ATOM 0 HB2 ALA A 526 -13.596 2.173 -4.053 1.00 0.00 H new ATOM 0 HB3 ALA A 526 -12.455 2.738 -2.810 1.00 0.00 H new ATOM 640 N SER A 527 -13.181 2.956 -0.098 1.00 0.00 N ATOM 641 CA SER A 527 -12.672 2.834 1.263 1.00 0.00 C ATOM 642 C SER A 527 -13.808 2.526 2.234 1.00 0.00 C ATOM 643 O SER A 527 -13.669 1.682 3.119 1.00 0.00 O ATOM 644 CB SER A 527 -11.980 4.131 1.680 1.00 0.00 C ATOM 645 OG SER A 527 -11.234 3.904 2.869 1.00 0.00 O ATOM 0 H SER A 527 -12.898 3.807 -0.583 1.00 0.00 H new ATOM 0 HA SER A 527 -11.954 2.015 1.290 1.00 0.00 H new ATOM 0 HB2 SER A 527 -11.321 4.477 0.884 1.00 0.00 H new ATOM 0 HB3 SER A 527 -12.720 4.915 1.845 1.00 0.00 H new ATOM 0 HG SER A 527 -10.788 4.734 3.138 1.00 0.00 H new ATOM 651 N LEU A 528 -14.930 3.217 2.062 1.00 0.00 N ATOM 652 CA LEU A 528 -16.084 3.009 2.930 1.00 0.00 C ATOM 653 C LEU A 528 -16.618 1.588 2.781 1.00 0.00 C ATOM 654 O LEU A 528 -16.958 0.936 3.768 1.00 0.00 O ATOM 655 CB LEU A 528 -17.187 4.010 2.581 1.00 0.00 C ATOM 656 CG LEU A 528 -18.239 4.022 3.693 1.00 0.00 C ATOM 657 CD1 LEU A 528 -17.733 4.856 4.872 1.00 0.00 C ATOM 658 CD2 LEU A 528 -19.537 4.633 3.158 1.00 0.00 C ATOM 0 H LEU A 528 -15.065 3.920 1.336 1.00 0.00 H new ATOM 0 HA LEU A 528 -15.770 3.160 3.963 1.00 0.00 H new ATOM 0 HB2 LEU A 528 -16.762 5.006 2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 528 -17.650 3.741 1.632 1.00 0.00 H new ATOM 0 HG LEU A 528 -18.425 3.001 4.026 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -18.484 4.863 5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 528 -16.809 4.423 5.254 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -17.545 5.877 4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -20.288 4.642 3.948 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -19.348 5.653 2.824 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -19.900 4.039 2.320 1.00 0.00 H new ATOM 670 N ALA A 529 -16.690 1.114 1.541 1.00 0.00 N ATOM 671 CA ALA A 529 -17.186 -0.231 1.276 1.00 0.00 C ATOM 672 C ALA A 529 -16.466 -1.251 2.152 1.00 0.00 C ATOM 673 O ALA A 529 -17.081 -2.186 2.666 1.00 0.00 O ATOM 674 CB ALA A 529 -16.976 -0.584 -0.198 1.00 0.00 C ATOM 0 H ALA A 529 -16.413 1.637 0.710 1.00 0.00 H new ATOM 0 HA ALA A 529 -18.251 -0.257 1.508 1.00 0.00 H new ATOM 0 HB1 ALA A 529 -17.349 -1.590 -0.388 1.00 0.00 H new ATOM 0 HB2 ALA A 529 -17.516 0.127 -0.823 1.00 0.00 H new ATOM 0 HB3 ALA A 529 -15.913 -0.541 -0.435 1.00 0.00 H new ATOM 680 N LEU A 530 -15.161 -1.065 2.320 1.00 0.00 N ATOM 681 CA LEU A 530 -14.369 -1.977 3.137 1.00 0.00 C ATOM 682 C LEU A 530 -14.773 -1.872 4.604 1.00 0.00 C ATOM 683 O LEU A 530 -14.919 -2.882 5.291 1.00 0.00 O ATOM 684 CB LEU A 530 -12.880 -1.652 2.991 1.00 0.00 C ATOM 685 CG LEU A 530 -12.533 -1.490 1.510 1.00 0.00 C ATOM 686 CD1 LEU A 530 -11.017 -1.363 1.353 1.00 0.00 C ATOM 687 CD2 LEU A 530 -13.023 -2.714 0.733 1.00 0.00 C ATOM 0 H LEU A 530 -14.633 -0.297 1.905 1.00 0.00 H new ATOM 0 HA LEU A 530 -14.554 -2.995 2.793 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -12.642 -0.737 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -12.279 -2.448 3.431 1.00 0.00 H new ATOM 0 HG LEU A 530 -13.017 -0.594 1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -10.769 -1.248 0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -10.666 -0.492 1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -10.534 -2.259 1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -12.776 -2.598 -0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -12.540 -3.610 1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -14.103 -2.807 0.844 1.00 0.00 H new ATOM 699 N ALA A 531 -14.953 -0.643 5.077 1.00 0.00 N ATOM 700 CA ALA A 531 -15.341 -0.419 6.465 1.00 0.00 C ATOM 701 C ALA A 531 -16.630 -1.167 6.790 1.00 0.00 C ATOM 702 O ALA A 531 -16.615 -2.166 7.509 1.00 0.00 O ATOM 703 CB ALA A 531 -15.539 1.076 6.717 1.00 0.00 C ATOM 0 H ALA A 531 -14.838 0.207 4.525 1.00 0.00 H new ATOM 0 HA ALA A 531 -14.546 -0.794 7.109 1.00 0.00 H new ATOM 0 HB1 ALA A 531 -15.829 1.235 7.756 1.00 0.00 H new ATOM 0 HB2 ALA A 531 -14.608 1.605 6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 531 -16.322 1.455 6.060 1.00 0.00 H new ATOM 709 N HIS A 532 -17.744 -0.676 6.256 1.00 0.00 N ATOM 710 CA HIS A 532 -19.037 -1.306 6.496 1.00 0.00 C ATOM 711 C HIS A 532 -18.924 -2.824 6.395 1.00 0.00 C ATOM 712 O HIS A 532 -19.352 -3.549 7.293 1.00 0.00 O ATOM 713 CB HIS A 532 -20.061 -0.800 5.479 1.00 0.00 C ATOM 714 CG HIS A 532 -21.448 -1.143 5.948 1.00 0.00 C ATOM 715 ND1 HIS A 532 -22.277 -1.999 5.240 1.00 0.00 N ATOM 716 CD2 HIS A 532 -22.166 -0.755 7.052 1.00 0.00 C ATOM 717 CE1 HIS A 532 -23.435 -2.097 5.920 1.00 0.00 C ATOM 718 NE2 HIS A 532 -23.420 -1.358 7.032 1.00 0.00 N ATOM 0 H HIS A 532 -17.778 0.150 5.659 1.00 0.00 H new ATOM 0 HA HIS A 532 -19.364 -1.045 7.502 1.00 0.00 H new ATOM 0 HB2 HIS A 532 -19.964 0.279 5.356 1.00 0.00 H new ATOM 0 HB3 HIS A 532 -19.874 -1.250 4.504 1.00 0.00 H new ATOM 0 HD2 HIS A 532 -21.811 -0.083 7.820 1.00 0.00 H new ATOM 0 HE1 HIS A 532 -24.274 -2.700 5.604 1.00 0.00 H new ATOM 0 HE2 HIS A 532 -24.167 -1.257 7.719 1.00 0.00 H new ATOM 726 N VAL A 533 -18.345 -3.298 5.297 1.00 0.00 N ATOM 727 CA VAL A 533 -18.181 -4.732 5.089 1.00 0.00 C ATOM 728 C VAL A 533 -17.310 -5.337 6.186 1.00 0.00 C ATOM 729 O VAL A 533 -17.806 -6.030 7.074 1.00 0.00 O ATOM 730 CB VAL A 533 -17.542 -4.993 3.724 1.00 0.00 C ATOM 731 CG1 VAL A 533 -17.254 -6.487 3.570 1.00 0.00 C ATOM 732 CG2 VAL A 533 -18.502 -4.544 2.620 1.00 0.00 C ATOM 0 H VAL A 533 -17.984 -2.715 4.542 1.00 0.00 H new ATOM 0 HA VAL A 533 -19.165 -5.199 5.124 1.00 0.00 H new ATOM 0 HB VAL A 533 -16.609 -4.434 3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 533 -16.799 -6.671 2.597 1.00 0.00 H new ATOM 0 HG12 VAL A 533 -16.572 -6.809 4.357 1.00 0.00 H new ATOM 0 HG13 VAL A 533 -18.186 -7.047 3.646 1.00 0.00 H new ATOM 0 HG21 VAL A 533 -18.049 -4.729 1.646 1.00 0.00 H new ATOM 0 HG22 VAL A 533 -19.434 -5.104 2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 533 -18.708 -3.479 2.728 1.00 0.00 H new ATOM 742 N PHE A 534 -16.010 -5.069 6.118 1.00 0.00 N ATOM 743 CA PHE A 534 -15.079 -5.593 7.111 1.00 0.00 C ATOM 744 C PHE A 534 -15.241 -4.858 8.438 1.00 0.00 C ATOM 745 O PHE A 534 -14.288 -4.725 9.205 1.00 0.00 O ATOM 746 CB PHE A 534 -13.640 -5.438 6.614 1.00 0.00 C ATOM 747 CG PHE A 534 -13.396 -6.395 5.471 1.00 0.00 C ATOM 748 CD1 PHE A 534 -13.895 -6.104 4.196 1.00 0.00 C ATOM 749 CD2 PHE A 534 -12.670 -7.572 5.688 1.00 0.00 C ATOM 750 CE1 PHE A 534 -13.668 -6.992 3.137 1.00 0.00 C ATOM 751 CE2 PHE A 534 -12.443 -8.459 4.629 1.00 0.00 C ATOM 752 CZ PHE A 534 -12.942 -8.169 3.353 1.00 0.00 C ATOM 0 H PHE A 534 -15.580 -4.497 5.392 1.00 0.00 H new ATOM 0 HA PHE A 534 -15.299 -6.650 7.263 1.00 0.00 H new ATOM 0 HB2 PHE A 534 -13.465 -4.413 6.288 1.00 0.00 H new ATOM 0 HB3 PHE A 534 -12.940 -5.638 7.425 1.00 0.00 H new ATOM 0 HD1 PHE A 534 -14.455 -5.195 4.029 1.00 0.00 H new ATOM 0 HD2 PHE A 534 -12.285 -7.796 6.672 1.00 0.00 H new ATOM 0 HE1 PHE A 534 -14.053 -6.768 2.153 1.00 0.00 H new ATOM 0 HE2 PHE A 534 -11.883 -9.367 4.796 1.00 0.00 H new ATOM 0 HZ PHE A 534 -12.767 -8.853 2.536 1.00 0.00 H new ATOM 762 N VAL A 535 -16.454 -4.383 8.703 1.00 0.00 N ATOM 763 CA VAL A 535 -16.728 -3.663 9.941 1.00 0.00 C ATOM 764 C VAL A 535 -16.430 -4.544 11.150 1.00 0.00 C ATOM 765 O VAL A 535 -16.053 -4.050 12.213 1.00 0.00 O ATOM 766 CB VAL A 535 -18.193 -3.224 9.977 1.00 0.00 C ATOM 767 CG1 VAL A 535 -19.098 -4.448 9.822 1.00 0.00 C ATOM 768 CG2 VAL A 535 -18.486 -2.541 11.314 1.00 0.00 C ATOM 0 H VAL A 535 -17.257 -4.483 8.082 1.00 0.00 H new ATOM 0 HA VAL A 535 -16.084 -2.784 9.978 1.00 0.00 H new ATOM 0 HB VAL A 535 -18.383 -2.527 9.161 1.00 0.00 H new ATOM 0 HG11 VAL A 535 -20.142 -4.134 9.848 1.00 0.00 H new ATOM 0 HG12 VAL A 535 -18.889 -4.937 8.870 1.00 0.00 H new ATOM 0 HG13 VAL A 535 -18.909 -5.146 10.637 1.00 0.00 H new ATOM 0 HG21 VAL A 535 -19.530 -2.227 11.341 1.00 0.00 H new ATOM 0 HG22 VAL A 535 -18.295 -3.239 12.129 1.00 0.00 H new ATOM 0 HG23 VAL A 535 -17.842 -1.669 11.426 1.00 0.00 H new ATOM 778 N GLY A 536 -16.601 -5.851 10.980 1.00 0.00 N ATOM 779 CA GLY A 536 -16.347 -6.792 12.065 1.00 0.00 C ATOM 780 C GLY A 536 -14.856 -7.079 12.200 1.00 0.00 C ATOM 781 O GLY A 536 -14.183 -6.525 13.070 1.00 0.00 O ATOM 0 H GLY A 536 -16.912 -6.280 10.109 1.00 0.00 H new ATOM 0 HA2 GLY A 536 -16.729 -6.385 13.001 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -16.885 -7.722 11.879 1.00 0.00 H new ATOM 785 N THR A 537 -14.345 -7.947 11.333 1.00 0.00 N ATOM 786 CA THR A 537 -12.930 -8.300 11.364 1.00 0.00 C ATOM 787 C THR A 537 -12.108 -7.292 10.567 1.00 0.00 C ATOM 788 O THR A 537 -12.386 -7.037 9.396 1.00 0.00 O ATOM 789 CB THR A 537 -12.729 -9.701 10.781 1.00 0.00 C ATOM 790 OG1 THR A 537 -11.371 -10.088 10.943 1.00 0.00 O ATOM 791 CG2 THR A 537 -13.086 -9.694 9.293 1.00 0.00 C ATOM 0 H THR A 537 -14.885 -8.416 10.605 1.00 0.00 H new ATOM 0 HA THR A 537 -12.594 -8.286 12.401 1.00 0.00 H new ATOM 0 HB THR A 537 -13.374 -10.408 11.302 1.00 0.00 H new ATOM 0 HG1 THR A 537 -11.240 -10.986 10.572 1.00 0.00 H new ATOM 0 HG21 THR A 537 -12.942 -10.692 8.880 1.00 0.00 H new ATOM 0 HG22 THR A 537 -14.127 -9.397 9.170 1.00 0.00 H new ATOM 0 HG23 THR A 537 -12.443 -8.988 8.768 1.00 0.00 H new ATOM 799 N CYS A 538 -11.093 -6.724 11.211 1.00 0.00 N ATOM 800 CA CYS A 538 -10.234 -5.745 10.554 1.00 0.00 C ATOM 801 C CYS A 538 -8.816 -6.287 10.415 1.00 0.00 C ATOM 802 O CYS A 538 -8.424 -7.217 11.120 1.00 0.00 O ATOM 803 CB CYS A 538 -10.209 -4.446 11.361 1.00 0.00 C ATOM 804 SG CYS A 538 -9.706 -4.803 13.063 1.00 0.00 S ATOM 0 H CYS A 538 -10.846 -6.923 12.181 1.00 0.00 H new ATOM 0 HA CYS A 538 -10.635 -5.546 9.560 1.00 0.00 H new ATOM 0 HB2 CYS A 538 -9.517 -3.737 10.907 1.00 0.00 H new ATOM 0 HB3 CYS A 538 -11.195 -3.980 11.352 1.00 0.00 H new ATOM 0 HG CYS A 538 -9.682 -3.699 13.749 1.00 0.00 H new ATOM 810 N ASN A 539 -8.050 -5.699 9.502 1.00 0.00 N ATOM 811 CA ASN A 539 -6.675 -6.131 9.278 1.00 0.00 C ATOM 812 C ASN A 539 -5.748 -4.925 9.159 1.00 0.00 C ATOM 813 O ASN A 539 -6.185 -3.824 8.823 1.00 0.00 O ATOM 814 CB ASN A 539 -6.592 -6.968 8.001 1.00 0.00 C ATOM 815 CG ASN A 539 -7.223 -8.337 8.233 1.00 0.00 C ATOM 816 OD1 ASN A 539 -8.124 -8.473 9.061 1.00 0.00 O ATOM 817 ND2 ASN A 539 -6.803 -9.364 7.546 1.00 0.00 N ATOM 0 H ASN A 539 -8.355 -4.927 8.909 1.00 0.00 H new ATOM 0 HA ASN A 539 -6.360 -6.735 10.129 1.00 0.00 H new ATOM 0 HB2 ASN A 539 -7.104 -6.456 7.187 1.00 0.00 H new ATOM 0 HB3 ASN A 539 -5.551 -7.085 7.700 1.00 0.00 H new ATOM 0 HD21 ASN A 539 -7.221 -10.282 7.694 1.00 0.00 H new ATOM 0 HD22 ASN A 539 -6.056 -9.248 6.861 1.00 0.00 H new ATOM 824 N GLY A 540 -4.466 -5.141 9.436 1.00 0.00 N ATOM 825 CA GLY A 540 -3.486 -4.064 9.356 1.00 0.00 C ATOM 826 C GLY A 540 -3.223 -3.674 7.906 1.00 0.00 C ATOM 827 O GLY A 540 -3.232 -2.493 7.559 1.00 0.00 O ATOM 0 H GLY A 540 -4.084 -6.044 9.716 1.00 0.00 H new ATOM 0 HA2 GLY A 540 -3.846 -3.197 9.910 1.00 0.00 H new ATOM 0 HA3 GLY A 540 -2.555 -4.379 9.827 1.00 0.00 H new ATOM 831 N ASP A 541 -2.988 -4.674 7.062 1.00 0.00 N ATOM 832 CA ASP A 541 -2.723 -4.423 5.650 1.00 0.00 C ATOM 833 C ASP A 541 -3.691 -3.381 5.100 1.00 0.00 C ATOM 834 O ASP A 541 -3.317 -2.546 4.276 1.00 0.00 O ATOM 835 CB ASP A 541 -2.863 -5.722 4.854 1.00 0.00 C ATOM 836 CG ASP A 541 -1.706 -6.660 5.181 1.00 0.00 C ATOM 837 OD1 ASP A 541 -0.879 -6.288 5.996 1.00 0.00 O ATOM 838 OD2 ASP A 541 -1.664 -7.738 4.610 1.00 0.00 O1- ATOM 0 H ASP A 541 -2.976 -5.658 7.329 1.00 0.00 H new ATOM 0 HA ASP A 541 -1.706 -4.044 5.552 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -3.811 -6.204 5.092 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -2.875 -5.504 3.786 1.00 0.00 H new ATOM 843 N ILE A 542 -4.936 -3.435 5.561 1.00 0.00 N ATOM 844 CA ILE A 542 -5.950 -2.490 5.108 1.00 0.00 C ATOM 845 C ILE A 542 -5.569 -1.065 5.497 1.00 0.00 C ATOM 846 O ILE A 542 -5.635 -0.149 4.678 1.00 0.00 O ATOM 847 CB ILE A 542 -7.305 -2.842 5.723 1.00 0.00 C ATOM 848 CG1 ILE A 542 -7.723 -4.243 5.267 1.00 0.00 C ATOM 849 CG2 ILE A 542 -8.354 -1.826 5.267 1.00 0.00 C ATOM 850 CD1 ILE A 542 -8.933 -4.705 6.080 1.00 0.00 C ATOM 0 H ILE A 542 -5.266 -4.118 6.243 1.00 0.00 H new ATOM 0 HA ILE A 542 -6.016 -2.553 4.022 1.00 0.00 H new ATOM 0 HB ILE A 542 -7.226 -2.820 6.810 1.00 0.00 H new ATOM 0 HG12 ILE A 542 -7.968 -4.233 4.205 1.00 0.00 H new ATOM 0 HG13 ILE A 542 -6.896 -4.941 5.397 1.00 0.00 H new ATOM 0 HG21 ILE A 542 -9.319 -2.078 5.706 1.00 0.00 H new ATOM 0 HG22 ILE A 542 -8.058 -0.828 5.590 1.00 0.00 H new ATOM 0 HG23 ILE A 542 -8.433 -1.847 4.180 1.00 0.00 H new ATOM 0 HD11 ILE A 542 -9.230 -5.702 5.755 1.00 0.00 H new ATOM 0 HD12 ILE A 542 -8.672 -4.731 7.138 1.00 0.00 H new ATOM 0 HD13 ILE A 542 -9.760 -4.012 5.927 1.00 0.00 H new ATOM 862 N THR A 543 -5.169 -0.887 6.752 1.00 0.00 N ATOM 863 CA THR A 543 -4.781 0.431 7.240 1.00 0.00 C ATOM 864 C THR A 543 -3.473 0.880 6.594 1.00 0.00 C ATOM 865 O THR A 543 -3.408 1.942 5.977 1.00 0.00 O ATOM 866 CB THR A 543 -4.615 0.398 8.761 1.00 0.00 C ATOM 867 OG1 THR A 543 -5.702 -0.312 9.338 1.00 0.00 O ATOM 868 CG2 THR A 543 -4.591 1.827 9.305 1.00 0.00 C ATOM 0 H THR A 543 -5.105 -1.633 7.445 1.00 0.00 H new ATOM 0 HA THR A 543 -5.566 1.140 6.975 1.00 0.00 H new ATOM 0 HB THR A 543 -3.679 -0.100 9.014 1.00 0.00 H new ATOM 0 HG1 THR A 543 -5.727 -0.144 10.303 1.00 0.00 H new ATOM 0 HG21 THR A 543 -4.473 1.802 10.388 1.00 0.00 H new ATOM 0 HG22 THR A 543 -3.757 2.371 8.861 1.00 0.00 H new ATOM 0 HG23 THR A 543 -5.526 2.328 9.054 1.00 0.00 H new ATOM 876 N THR A 544 -2.434 0.064 6.741 1.00 0.00 N ATOM 877 CA THR A 544 -1.132 0.389 6.169 1.00 0.00 C ATOM 878 C THR A 544 -1.292 0.977 4.771 1.00 0.00 C ATOM 879 O THR A 544 -0.827 2.084 4.496 1.00 0.00 O ATOM 880 CB THR A 544 -0.262 -0.868 6.100 1.00 0.00 C ATOM 881 OG1 THR A 544 -0.905 -1.843 5.290 1.00 0.00 O ATOM 882 CG2 THR A 544 -0.056 -1.426 7.509 1.00 0.00 C ATOM 0 H THR A 544 -2.467 -0.821 7.247 1.00 0.00 H new ATOM 0 HA THR A 544 -0.650 1.129 6.809 1.00 0.00 H new ATOM 0 HB THR A 544 0.706 -0.617 5.667 1.00 0.00 H new ATOM 0 HG1 THR A 544 -0.245 -2.498 4.980 1.00 0.00 H new ATOM 0 HG21 THR A 544 0.564 -2.321 7.459 1.00 0.00 H new ATOM 0 HG22 THR A 544 0.438 -0.677 8.128 1.00 0.00 H new ATOM 0 HG23 THR A 544 -1.023 -1.678 7.946 1.00 0.00 H new ATOM 890 N SER A 545 -1.955 0.233 3.892 1.00 0.00 N ATOM 891 CA SER A 545 -2.173 0.696 2.526 1.00 0.00 C ATOM 892 C SER A 545 -2.922 2.023 2.531 1.00 0.00 C ATOM 893 O SER A 545 -2.501 2.991 1.897 1.00 0.00 O ATOM 894 CB SER A 545 -2.975 -0.343 1.744 1.00 0.00 C ATOM 895 OG SER A 545 -4.190 -0.613 2.431 1.00 0.00 O ATOM 0 H SER A 545 -2.348 -0.685 4.098 1.00 0.00 H new ATOM 0 HA SER A 545 -1.204 0.838 2.048 1.00 0.00 H new ATOM 0 HB2 SER A 545 -3.186 0.024 0.739 1.00 0.00 H new ATOM 0 HB3 SER A 545 -2.395 -1.259 1.633 1.00 0.00 H new ATOM 0 HG SER A 545 -4.028 -1.278 3.133 1.00 0.00 H new ATOM 901 N ILE A 546 -4.035 2.060 3.257 1.00 0.00 N ATOM 902 CA ILE A 546 -4.839 3.272 3.347 1.00 0.00 C ATOM 903 C ILE A 546 -3.995 4.430 3.871 1.00 0.00 C ATOM 904 O ILE A 546 -4.280 5.595 3.591 1.00 0.00 O ATOM 905 CB ILE A 546 -6.033 3.031 4.277 1.00 0.00 C ATOM 906 CG1 ILE A 546 -7.291 2.785 3.440 1.00 0.00 C ATOM 907 CG2 ILE A 546 -6.250 4.251 5.175 1.00 0.00 C ATOM 908 CD1 ILE A 546 -8.349 2.090 4.299 1.00 0.00 C ATOM 0 H ILE A 546 -4.399 1.269 3.788 1.00 0.00 H new ATOM 0 HA ILE A 546 -5.204 3.529 2.353 1.00 0.00 H new ATOM 0 HB ILE A 546 -5.830 2.159 4.899 1.00 0.00 H new ATOM 0 HG12 ILE A 546 -7.679 3.731 3.061 1.00 0.00 H new ATOM 0 HG13 ILE A 546 -7.049 2.169 2.574 1.00 0.00 H new ATOM 0 HG21 ILE A 546 -7.100 4.072 5.833 1.00 0.00 H new ATOM 0 HG22 ILE A 546 -5.357 4.424 5.775 1.00 0.00 H new ATOM 0 HG23 ILE A 546 -6.448 5.127 4.557 1.00 0.00 H new ATOM 0 HD11 ILE A 546 -9.244 1.915 3.703 1.00 0.00 H new ATOM 0 HD12 ILE A 546 -7.959 1.137 4.656 1.00 0.00 H new ATOM 0 HD13 ILE A 546 -8.598 2.722 5.151 1.00 0.00 H new ATOM 920 N MET A 547 -2.956 4.102 4.631 1.00 0.00 N ATOM 921 CA MET A 547 -2.077 5.123 5.188 1.00 0.00 C ATOM 922 C MET A 547 -1.144 5.667 4.112 1.00 0.00 C ATOM 923 O MET A 547 -1.006 6.880 3.951 1.00 0.00 O ATOM 924 CB MET A 547 -1.252 4.534 6.335 1.00 0.00 C ATOM 925 CG MET A 547 -0.876 5.644 7.319 1.00 0.00 C ATOM 926 SD MET A 547 -2.320 6.071 8.324 1.00 0.00 S ATOM 927 CE MET A 547 -1.654 7.593 9.042 1.00 0.00 C ATOM 0 H MET A 547 -2.703 3.144 4.874 1.00 0.00 H new ATOM 0 HA MET A 547 -2.691 5.939 5.568 1.00 0.00 H new ATOM 0 HB2 MET A 547 -1.823 3.759 6.846 1.00 0.00 H new ATOM 0 HB3 MET A 547 -0.352 4.061 5.943 1.00 0.00 H new ATOM 0 HG2 MET A 547 -0.058 5.315 7.960 1.00 0.00 H new ATOM 0 HG3 MET A 547 -0.524 6.522 6.777 1.00 0.00 H new ATOM 0 HE1 MET A 547 -2.394 8.034 9.710 1.00 0.00 H new ATOM 0 HE2 MET A 547 -0.748 7.364 9.604 1.00 0.00 H new ATOM 0 HE3 MET A 547 -1.418 8.298 8.245 1.00 0.00 H new ATOM 937 N ASP A 548 -0.507 4.763 3.375 1.00 0.00 N ATOM 938 CA ASP A 548 0.409 5.166 2.314 1.00 0.00 C ATOM 939 C ASP A 548 -0.227 6.243 1.443 1.00 0.00 C ATOM 940 O ASP A 548 0.412 7.237 1.101 1.00 0.00 O ATOM 941 CB ASP A 548 0.776 3.957 1.451 1.00 0.00 C ATOM 942 CG ASP A 548 1.735 3.046 2.209 1.00 0.00 C ATOM 943 OD1 ASP A 548 1.258 2.185 2.930 1.00 0.00 O ATOM 944 OD2 ASP A 548 2.933 3.223 2.058 1.00 0.00 O1- ATOM 0 H ASP A 548 -0.607 3.755 3.491 1.00 0.00 H new ATOM 0 HA ASP A 548 1.312 5.570 2.772 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -0.125 3.406 1.181 1.00 0.00 H new ATOM 0 HB3 ASP A 548 1.237 4.290 0.521 1.00 0.00 H new ATOM 949 N ASN A 549 -1.491 6.037 1.087 1.00 0.00 N ATOM 950 CA ASN A 549 -2.206 6.999 0.256 1.00 0.00 C ATOM 951 C ASN A 549 -2.454 8.291 1.027 1.00 0.00 C ATOM 952 O ASN A 549 -2.412 9.383 0.458 1.00 0.00 O ATOM 953 CB ASN A 549 -3.542 6.407 -0.197 1.00 0.00 C ATOM 954 CG ASN A 549 -3.299 5.246 -1.155 1.00 0.00 C ATOM 955 OD1 ASN A 549 -4.247 4.677 -1.695 1.00 0.00 O ATOM 956 ND2 ASN A 549 -2.077 4.859 -1.399 1.00 0.00 N ATOM 0 H ASN A 549 -2.038 5.220 1.358 1.00 0.00 H new ATOM 0 HA ASN A 549 -1.594 7.222 -0.618 1.00 0.00 H new ATOM 0 HB2 ASN A 549 -4.109 6.063 0.668 1.00 0.00 H new ATOM 0 HB3 ASN A 549 -4.142 7.174 -0.687 1.00 0.00 H new ATOM 0 HD21 ASN A 549 -1.906 4.083 -2.039 1.00 0.00 H new ATOM 0 HD22 ASN A 549 -1.293 5.332 -0.950 1.00 0.00 H new ATOM 963 N PHE A 550 -2.712 8.160 2.324 1.00 0.00 N ATOM 964 CA PHE A 550 -2.965 9.325 3.164 1.00 0.00 C ATOM 965 C PHE A 550 -1.808 10.314 3.069 1.00 0.00 C ATOM 966 O PHE A 550 -2.018 11.523 2.969 1.00 0.00 O ATOM 967 CB PHE A 550 -3.149 8.889 4.619 1.00 0.00 C ATOM 968 CG PHE A 550 -3.821 9.996 5.397 1.00 0.00 C ATOM 969 CD1 PHE A 550 -3.083 11.116 5.799 1.00 0.00 C ATOM 970 CD2 PHE A 550 -5.181 9.903 5.716 1.00 0.00 C ATOM 971 CE1 PHE A 550 -3.705 12.143 6.519 1.00 0.00 C ATOM 972 CE2 PHE A 550 -5.803 10.929 6.437 1.00 0.00 C ATOM 973 CZ PHE A 550 -5.065 12.049 6.839 1.00 0.00 C ATOM 0 H PHE A 550 -2.751 7.266 2.813 1.00 0.00 H new ATOM 0 HA PHE A 550 -3.875 9.813 2.814 1.00 0.00 H new ATOM 0 HB2 PHE A 550 -3.751 7.981 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 550 -2.182 8.653 5.064 1.00 0.00 H new ATOM 0 HD1 PHE A 550 -2.034 11.188 5.554 1.00 0.00 H new ATOM 0 HD2 PHE A 550 -5.750 9.039 5.406 1.00 0.00 H new ATOM 0 HE1 PHE A 550 -3.136 13.008 6.828 1.00 0.00 H new ATOM 0 HE2 PHE A 550 -6.852 10.857 6.683 1.00 0.00 H new ATOM 0 HZ PHE A 550 -5.545 12.840 7.396 1.00 0.00 H new ATOM 983 N LEU A 551 -0.586 9.792 3.101 1.00 0.00 N ATOM 984 CA LEU A 551 0.598 10.639 3.017 1.00 0.00 C ATOM 985 C LEU A 551 0.742 11.220 1.614 1.00 0.00 C ATOM 986 O LEU A 551 0.990 12.415 1.449 1.00 0.00 O ATOM 987 CB LEU A 551 1.848 9.828 3.365 1.00 0.00 C ATOM 988 CG LEU A 551 1.589 9.005 4.628 1.00 0.00 C ATOM 989 CD1 LEU A 551 2.816 8.146 4.937 1.00 0.00 C ATOM 990 CD2 LEU A 551 1.319 9.948 5.803 1.00 0.00 C ATOM 0 H LEU A 551 -0.390 8.794 3.184 1.00 0.00 H new ATOM 0 HA LEU A 551 0.487 11.457 3.728 1.00 0.00 H new ATOM 0 HB2 LEU A 551 2.109 9.169 2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 551 2.695 10.496 3.521 1.00 0.00 H new ATOM 0 HG LEU A 551 0.724 8.361 4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 551 2.632 7.559 5.837 1.00 0.00 H new ATOM 0 HD12 LEU A 551 3.011 7.475 4.100 1.00 0.00 H new ATOM 0 HD13 LEU A 551 3.681 8.790 5.094 1.00 0.00 H new ATOM 0 HD21 LEU A 551 1.134 9.363 6.704 1.00 0.00 H new ATOM 0 HD22 LEU A 551 2.185 10.592 5.959 1.00 0.00 H new ATOM 0 HD23 LEU A 551 0.445 10.562 5.584 1.00 0.00 H new ATOM 1002 N GLU A 552 0.583 10.368 0.607 1.00 0.00 N ATOM 1003 CA GLU A 552 0.697 10.808 -0.778 1.00 0.00 C ATOM 1004 C GLU A 552 -0.161 12.046 -1.019 1.00 0.00 C ATOM 1005 O GLU A 552 -0.015 12.726 -2.034 1.00 0.00 O ATOM 1006 CB GLU A 552 0.256 9.687 -1.721 1.00 0.00 C ATOM 1007 CG GLU A 552 1.273 8.545 -1.668 1.00 0.00 C ATOM 1008 CD GLU A 552 2.555 8.953 -2.386 1.00 0.00 C ATOM 1009 OE1 GLU A 552 2.453 9.599 -3.417 1.00 0.00 O ATOM 1010 OE2 GLU A 552 3.619 8.614 -1.896 1.00 0.00 O1- ATOM 0 H GLU A 552 0.376 9.376 0.723 1.00 0.00 H new ATOM 0 HA GLU A 552 1.739 11.058 -0.975 1.00 0.00 H new ATOM 0 HB2 GLU A 552 -0.731 9.323 -1.434 1.00 0.00 H new ATOM 0 HB3 GLU A 552 0.172 10.066 -2.739 1.00 0.00 H new ATOM 0 HG2 GLU A 552 1.493 8.291 -0.631 1.00 0.00 H new ATOM 0 HG3 GLU A 552 0.854 7.653 -2.133 1.00 0.00 H new ATOM 1017 N ARG A 553 -1.056 12.332 -0.079 1.00 0.00 N ATOM 1018 CA ARG A 553 -1.933 13.492 -0.200 1.00 0.00 C ATOM 1019 C ARG A 553 -1.160 14.692 -0.739 1.00 0.00 C ATOM 1020 O ARG A 553 0.009 14.888 -0.409 1.00 0.00 O ATOM 1021 CB ARG A 553 -2.531 13.839 1.165 1.00 0.00 C ATOM 1022 CG ARG A 553 -3.388 15.101 1.042 1.00 0.00 C ATOM 1023 CD ARG A 553 -4.348 15.185 2.230 1.00 0.00 C ATOM 1024 NE ARG A 553 -3.612 15.056 3.483 1.00 0.00 N ATOM 1025 CZ ARG A 553 -4.184 15.345 4.647 1.00 0.00 C ATOM 1026 NH1 ARG A 553 -4.860 14.431 5.287 1.00 0.00 N1+ ATOM 1027 NH2 ARG A 553 -4.068 16.543 5.151 1.00 0.00 N ATOM 0 H ARG A 553 -1.193 11.782 0.769 1.00 0.00 H new ATOM 0 HA ARG A 553 -2.735 13.248 -0.896 1.00 0.00 H new ATOM 0 HB2 ARG A 553 -3.137 13.010 1.530 1.00 0.00 H new ATOM 0 HB3 ARG A 553 -1.735 13.997 1.893 1.00 0.00 H new ATOM 0 HG2 ARG A 553 -2.751 15.985 1.013 1.00 0.00 H new ATOM 0 HG3 ARG A 553 -3.950 15.082 0.108 1.00 0.00 H new ATOM 0 HD2 ARG A 553 -4.881 16.135 2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 553 -5.098 14.397 2.157 1.00 0.00 H new ATOM 0 HE ARG A 553 -2.643 14.739 3.465 1.00 0.00 H new ATOM 0 HH11 ARG A 553 -4.950 13.494 4.894 1.00 0.00 H new ATOM 0 HH12 ARG A 553 -5.299 14.653 6.181 1.00 0.00 H new ATOM 0 HH21 ARG A 553 -3.538 17.257 4.651 1.00 0.00 H new ATOM 0 HH22 ARG A 553 -4.507 16.765 6.044 1.00 0.00 H new ATOM 1154 N ASP A 561 -14.622 16.841 -2.461 1.00 0.00 N ATOM 1155 CA ASP A 561 -15.020 16.348 -1.147 1.00 0.00 C ATOM 1156 C ASP A 561 -14.702 14.862 -1.012 1.00 0.00 C ATOM 1157 O ASP A 561 -15.051 14.062 -1.880 1.00 0.00 O ATOM 1158 CB ASP A 561 -16.519 16.572 -0.938 1.00 0.00 C ATOM 1159 CG ASP A 561 -16.849 18.055 -1.076 1.00 0.00 C ATOM 1160 OD1 ASP A 561 -16.298 18.837 -0.319 1.00 0.00 O ATOM 1161 OD2 ASP A 561 -17.647 18.386 -1.937 1.00 0.00 O1- ATOM 0 HA ASP A 561 -14.461 16.897 -0.389 1.00 0.00 H new ATOM 0 HB2 ASP A 561 -17.087 15.995 -1.668 1.00 0.00 H new ATOM 0 HB3 ASP A 561 -16.814 16.216 0.049 1.00 0.00 H new ATOM 1166 N TRP A 562 -14.039 14.501 0.081 1.00 0.00 N ATOM 1167 CA TRP A 562 -13.679 13.109 0.320 1.00 0.00 C ATOM 1168 C TRP A 562 -12.967 12.961 1.660 1.00 0.00 C ATOM 1169 O TRP A 562 -12.728 11.848 2.129 1.00 0.00 O ATOM 1170 CB TRP A 562 -12.769 12.604 -0.802 1.00 0.00 C ATOM 1171 CG TRP A 562 -11.711 13.622 -1.082 1.00 0.00 C ATOM 1172 CD1 TRP A 562 -11.726 14.495 -2.115 1.00 0.00 C ATOM 1173 CD2 TRP A 562 -10.485 13.888 -0.339 1.00 0.00 C ATOM 1174 NE1 TRP A 562 -10.589 15.280 -2.054 1.00 0.00 N ATOM 1175 CE2 TRP A 562 -9.792 14.944 -0.978 1.00 0.00 C ATOM 1176 CE3 TRP A 562 -9.913 13.322 0.814 1.00 0.00 C ATOM 1177 CZ2 TRP A 562 -8.575 15.421 -0.489 1.00 0.00 C ATOM 1178 CZ3 TRP A 562 -8.688 13.799 1.308 1.00 0.00 C ATOM 1179 CH2 TRP A 562 -8.021 14.847 0.658 1.00 0.00 C ATOM 0 H TRP A 562 -13.742 15.148 0.811 1.00 0.00 H new ATOM 0 HA TRP A 562 -14.594 12.516 0.340 1.00 0.00 H new ATOM 0 HB2 TRP A 562 -12.311 11.657 -0.515 1.00 0.00 H new ATOM 0 HB3 TRP A 562 -13.354 12.415 -1.702 1.00 0.00 H new ATOM 0 HD1 TRP A 562 -12.500 14.567 -2.865 1.00 0.00 H new ATOM 0 HE1 TRP A 562 -10.366 16.017 -2.723 1.00 0.00 H new ATOM 0 HE3 TRP A 562 -10.419 12.515 1.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 -8.065 16.228 -0.994 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 -8.257 13.356 2.194 1.00 0.00 H new ATOM 0 HH2 TRP A 562 -7.080 15.210 1.044 1.00 0.00 H new ATOM 1190 N VAL A 563 -12.631 14.092 2.273 1.00 0.00 N ATOM 1191 CA VAL A 563 -11.946 14.077 3.561 1.00 0.00 C ATOM 1192 C VAL A 563 -12.834 13.452 4.633 1.00 0.00 C ATOM 1193 O VAL A 563 -12.342 12.831 5.575 1.00 0.00 O ATOM 1194 CB VAL A 563 -11.574 15.502 3.971 1.00 0.00 C ATOM 1195 CG1 VAL A 563 -12.847 16.336 4.132 1.00 0.00 C ATOM 1196 CG2 VAL A 563 -10.817 15.468 5.301 1.00 0.00 C ATOM 0 H VAL A 563 -12.820 15.023 1.902 1.00 0.00 H new ATOM 0 HA VAL A 563 -11.040 13.479 3.462 1.00 0.00 H new ATOM 0 HB VAL A 563 -10.942 15.948 3.203 1.00 0.00 H new ATOM 0 HG11 VAL A 563 -12.582 17.352 4.424 1.00 0.00 H new ATOM 0 HG12 VAL A 563 -13.388 16.360 3.186 1.00 0.00 H new ATOM 0 HG13 VAL A 563 -13.479 15.891 4.900 1.00 0.00 H new ATOM 0 HG21 VAL A 563 -10.551 16.484 5.594 1.00 0.00 H new ATOM 0 HG22 VAL A 563 -11.450 15.022 6.069 1.00 0.00 H new ATOM 0 HG23 VAL A 563 -9.910 14.874 5.188 1.00 0.00 H new ATOM 1206 N ARG A 564 -14.143 13.621 4.481 1.00 0.00 N ATOM 1207 CA ARG A 564 -15.091 13.069 5.443 1.00 0.00 C ATOM 1208 C ARG A 564 -14.997 11.547 5.474 1.00 0.00 C ATOM 1209 O ARG A 564 -14.617 10.959 6.486 1.00 0.00 O ATOM 1210 CB ARG A 564 -16.515 13.487 5.072 1.00 0.00 C ATOM 1211 CG ARG A 564 -16.696 14.984 5.338 1.00 0.00 C ATOM 1212 CD ARG A 564 -17.153 15.197 6.782 1.00 0.00 C ATOM 1213 NE ARG A 564 -17.305 16.621 7.058 1.00 0.00 N ATOM 1214 CZ ARG A 564 -18.038 17.048 8.082 1.00 0.00 C ATOM 1215 NH1 ARG A 564 -18.249 16.266 9.105 1.00 0.00 N1+ ATOM 1216 NH2 ARG A 564 -18.546 18.250 8.063 1.00 0.00 N ATOM 0 H ARG A 564 -14.570 14.131 3.708 1.00 0.00 H new ATOM 0 HA ARG A 564 -14.845 13.457 6.431 1.00 0.00 H new ATOM 0 HB2 ARG A 564 -16.707 13.268 4.022 1.00 0.00 H new ATOM 0 HB3 ARG A 564 -17.237 12.914 5.654 1.00 0.00 H new ATOM 0 HG2 ARG A 564 -15.758 15.511 5.161 1.00 0.00 H new ATOM 0 HG3 ARG A 564 -17.430 15.400 4.648 1.00 0.00 H new ATOM 0 HD2 ARG A 564 -18.099 14.683 6.951 1.00 0.00 H new ATOM 0 HD3 ARG A 564 -16.427 14.762 7.469 1.00 0.00 H new ATOM 0 HE ARG A 564 -16.841 17.301 6.455 1.00 0.00 H new ATOM 0 HH11 ARG A 564 -17.852 15.327 9.119 1.00 0.00 H new ATOM 0 HH12 ARG A 564 -18.811 16.594 9.890 1.00 0.00 H new ATOM 0 HH21 ARG A 564 -18.381 18.861 7.263 1.00 0.00 H new ATOM 0 HH22 ARG A 564 -19.108 18.578 8.848 1.00 0.00 H new ATOM 1230 N PHE A 565 -15.345 10.915 4.357 1.00 0.00 N ATOM 1231 CA PHE A 565 -15.295 9.460 4.268 1.00 0.00 C ATOM 1232 C PHE A 565 -13.930 8.942 4.711 1.00 0.00 C ATOM 1233 O PHE A 565 -13.838 7.972 5.463 1.00 0.00 O ATOM 1234 CB PHE A 565 -15.570 9.015 2.830 1.00 0.00 C ATOM 1235 CG PHE A 565 -16.977 9.401 2.444 1.00 0.00 C ATOM 1236 CD1 PHE A 565 -18.038 8.521 2.690 1.00 0.00 C ATOM 1237 CD2 PHE A 565 -17.222 10.640 1.839 1.00 0.00 C ATOM 1238 CE1 PHE A 565 -19.342 8.879 2.331 1.00 0.00 C ATOM 1239 CE2 PHE A 565 -18.527 10.998 1.480 1.00 0.00 C ATOM 1240 CZ PHE A 565 -19.587 10.118 1.727 1.00 0.00 C ATOM 0 H PHE A 565 -15.662 11.383 3.508 1.00 0.00 H new ATOM 0 HA PHE A 565 -16.058 9.048 4.928 1.00 0.00 H new ATOM 0 HB2 PHE A 565 -14.855 9.480 2.151 1.00 0.00 H new ATOM 0 HB3 PHE A 565 -15.440 7.936 2.741 1.00 0.00 H new ATOM 0 HD1 PHE A 565 -17.850 7.566 3.157 1.00 0.00 H new ATOM 0 HD2 PHE A 565 -16.404 11.319 1.649 1.00 0.00 H new ATOM 0 HE1 PHE A 565 -20.160 8.199 2.520 1.00 0.00 H new ATOM 0 HE2 PHE A 565 -18.716 11.953 1.013 1.00 0.00 H new ATOM 0 HZ PHE A 565 -20.594 10.395 1.452 1.00 0.00 H new ATOM 1250 N LEU A 566 -12.874 9.597 4.241 1.00 0.00 N ATOM 1251 CA LEU A 566 -11.518 9.195 4.597 1.00 0.00 C ATOM 1252 C LEU A 566 -11.352 9.158 6.113 1.00 0.00 C ATOM 1253 O LEU A 566 -10.854 8.179 6.669 1.00 0.00 O ATOM 1254 CB LEU A 566 -10.508 10.174 3.990 1.00 0.00 C ATOM 1255 CG LEU A 566 -9.100 9.843 4.493 1.00 0.00 C ATOM 1256 CD1 LEU A 566 -8.793 8.367 4.230 1.00 0.00 C ATOM 1257 CD2 LEU A 566 -8.080 10.714 3.754 1.00 0.00 C ATOM 0 H LEU A 566 -12.929 10.402 3.617 1.00 0.00 H new ATOM 0 HA LEU A 566 -11.337 8.196 4.200 1.00 0.00 H new ATOM 0 HB2 LEU A 566 -10.539 10.115 2.902 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -10.770 11.197 4.261 1.00 0.00 H new ATOM 0 HG LEU A 566 -9.042 10.039 5.564 1.00 0.00 H new ATOM 0 HD11 LEU A 566 -7.790 8.134 4.589 1.00 0.00 H new ATOM 0 HD12 LEU A 566 -9.519 7.745 4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 566 -8.850 8.169 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 566 -7.077 10.481 4.110 1.00 0.00 H new ATOM 0 HD22 LEU A 566 -8.140 10.516 2.684 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -8.296 11.766 3.942 1.00 0.00 H new ATOM 1269 N ALA A 567 -11.773 10.231 6.775 1.00 0.00 N ATOM 1270 CA ALA A 567 -11.668 10.310 8.227 1.00 0.00 C ATOM 1271 C ALA A 567 -12.523 9.233 8.887 1.00 0.00 C ATOM 1272 O ALA A 567 -12.006 8.347 9.567 1.00 0.00 O ATOM 1273 CB ALA A 567 -12.121 11.690 8.709 1.00 0.00 C ATOM 0 H ALA A 567 -12.187 11.052 6.333 1.00 0.00 H new ATOM 0 HA ALA A 567 -10.626 10.151 8.506 1.00 0.00 H new ATOM 0 HB1 ALA A 567 -12.040 11.741 9.795 1.00 0.00 H new ATOM 0 HB2 ALA A 567 -11.489 12.457 8.261 1.00 0.00 H new ATOM 0 HB3 ALA A 567 -13.157 11.856 8.415 1.00 0.00 H new ATOM 1279 N LEU A 568 -13.833 9.316 8.681 1.00 0.00 N ATOM 1280 CA LEU A 568 -14.751 8.343 9.262 1.00 0.00 C ATOM 1281 C LEU A 568 -14.195 6.930 9.118 1.00 0.00 C ATOM 1282 O LEU A 568 -14.418 6.075 9.975 1.00 0.00 O ATOM 1283 CB LEU A 568 -16.113 8.430 8.568 1.00 0.00 C ATOM 1284 CG LEU A 568 -16.661 9.854 8.688 1.00 0.00 C ATOM 1285 CD1 LEU A 568 -17.681 10.104 7.576 1.00 0.00 C ATOM 1286 CD2 LEU A 568 -17.341 10.028 10.049 1.00 0.00 C ATOM 0 H LEU A 568 -14.281 10.041 8.120 1.00 0.00 H new ATOM 0 HA LEU A 568 -14.868 8.570 10.322 1.00 0.00 H new ATOM 0 HB2 LEU A 568 -16.016 8.154 7.518 1.00 0.00 H new ATOM 0 HB3 LEU A 568 -16.808 7.723 9.020 1.00 0.00 H new ATOM 0 HG LEU A 568 -15.841 10.566 8.597 1.00 0.00 H new ATOM 0 HD11 LEU A 568 -18.071 11.118 7.662 1.00 0.00 H new ATOM 0 HD12 LEU A 568 -17.199 9.981 6.606 1.00 0.00 H new ATOM 0 HD13 LEU A 568 -18.500 9.391 7.667 1.00 0.00 H new ATOM 0 HD21 LEU A 568 -17.731 11.042 10.134 1.00 0.00 H new ATOM 0 HD22 LEU A 568 -18.161 9.315 10.140 1.00 0.00 H new ATOM 0 HD23 LEU A 568 -16.616 9.850 10.843 1.00 0.00 H new ATOM 1298 N ALA A 569 -13.470 6.693 8.030 1.00 0.00 N ATOM 1299 CA ALA A 569 -12.887 5.379 7.785 1.00 0.00 C ATOM 1300 C ALA A 569 -11.886 5.024 8.879 1.00 0.00 C ATOM 1301 O ALA A 569 -12.050 4.030 9.586 1.00 0.00 O ATOM 1302 CB ALA A 569 -12.186 5.363 6.425 1.00 0.00 C ATOM 0 H ALA A 569 -13.273 7.387 7.309 1.00 0.00 H new ATOM 0 HA ALA A 569 -13.689 4.641 7.789 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -11.753 4.378 6.250 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -12.909 5.586 5.640 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -11.396 6.113 6.414 1.00 0.00 H new ATOM 1308 N LEU A 570 -10.848 5.844 9.013 1.00 0.00 N ATOM 1309 CA LEU A 570 -9.825 5.605 10.026 1.00 0.00 C ATOM 1310 C LEU A 570 -10.458 5.494 11.410 1.00 0.00 C ATOM 1311 O LEU A 570 -9.807 5.076 12.368 1.00 0.00 O ATOM 1312 CB LEU A 570 -8.806 6.747 10.020 1.00 0.00 C ATOM 1313 CG LEU A 570 -8.320 6.991 8.590 1.00 0.00 C ATOM 1314 CD1 LEU A 570 -7.265 8.099 8.592 1.00 0.00 C ATOM 1315 CD2 LEU A 570 -7.706 5.705 8.032 1.00 0.00 C ATOM 0 H LEU A 570 -10.693 6.673 8.439 1.00 0.00 H new ATOM 0 HA LEU A 570 -9.321 4.667 9.792 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -9.258 7.654 10.421 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -7.963 6.499 10.665 1.00 0.00 H new ATOM 0 HG LEU A 570 -9.163 7.291 7.967 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -6.918 8.273 7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -7.701 9.016 8.989 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -6.423 7.798 9.215 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -7.360 5.879 7.013 1.00 0.00 H new ATOM 0 HD22 LEU A 570 -6.864 5.404 8.655 1.00 0.00 H new ATOM 0 HD23 LEU A 570 -8.457 4.915 8.030 1.00 0.00 H new ATOM 1327 N GLY A 571 -11.729 5.869 11.507 1.00 0.00 N ATOM 1328 CA GLY A 571 -12.439 5.806 12.780 1.00 0.00 C ATOM 1329 C GLY A 571 -13.207 4.495 12.911 1.00 0.00 C ATOM 1330 O GLY A 571 -12.768 3.574 13.600 1.00 0.00 O ATOM 0 H GLY A 571 -12.285 6.217 10.726 1.00 0.00 H new ATOM 0 HA2 GLY A 571 -11.729 5.900 13.602 1.00 0.00 H new ATOM 0 HA3 GLY A 571 -13.129 6.646 12.858 1.00 0.00 H new ATOM 1334 N ILE A 572 -14.355 4.419 12.246 1.00 0.00 N ATOM 1335 CA ILE A 572 -15.177 3.214 12.296 1.00 0.00 C ATOM 1336 C ILE A 572 -14.306 1.967 12.187 1.00 0.00 C ATOM 1337 O ILE A 572 -14.621 0.925 12.763 1.00 0.00 O ATOM 1338 CB ILE A 572 -16.195 3.231 11.154 1.00 0.00 C ATOM 1339 CG1 ILE A 572 -17.229 2.122 11.373 1.00 0.00 C ATOM 1340 CG2 ILE A 572 -15.474 2.999 9.824 1.00 0.00 C ATOM 1341 CD1 ILE A 572 -18.354 2.639 12.272 1.00 0.00 C ATOM 0 H ILE A 572 -14.735 5.170 11.671 1.00 0.00 H new ATOM 0 HA ILE A 572 -15.702 3.193 13.251 1.00 0.00 H new ATOM 0 HB ILE A 572 -16.698 4.198 11.132 1.00 0.00 H new ATOM 0 HG12 ILE A 572 -17.636 1.796 10.416 1.00 0.00 H new ATOM 0 HG13 ILE A 572 -16.755 1.254 11.830 1.00 0.00 H new ATOM 0 HG21 ILE A 572 -16.199 3.011 9.010 1.00 0.00 H new ATOM 0 HG22 ILE A 572 -14.738 3.788 9.666 1.00 0.00 H new ATOM 0 HG23 ILE A 572 -14.970 2.033 9.847 1.00 0.00 H new ATOM 0 HD11 ILE A 572 -19.089 1.849 12.427 1.00 0.00 H new ATOM 0 HD12 ILE A 572 -17.941 2.943 13.234 1.00 0.00 H new ATOM 0 HD13 ILE A 572 -18.835 3.494 11.797 1.00 0.00 H new ATOM 1353 N LEU A 573 -13.209 2.081 11.446 1.00 0.00 N ATOM 1354 CA LEU A 573 -12.298 0.955 11.268 1.00 0.00 C ATOM 1355 C LEU A 573 -12.042 0.257 12.600 1.00 0.00 C ATOM 1356 O LEU A 573 -12.382 -0.913 12.773 1.00 0.00 O ATOM 1357 CB LEU A 573 -10.972 1.446 10.681 1.00 0.00 C ATOM 1358 CG LEU A 573 -9.949 0.308 10.691 1.00 0.00 C ATOM 1359 CD1 LEU A 573 -10.552 -0.933 10.030 1.00 0.00 C ATOM 1360 CD2 LEU A 573 -8.701 0.740 9.917 1.00 0.00 C ATOM 0 H LEU A 573 -12.930 2.934 10.962 1.00 0.00 H new ATOM 0 HA LEU A 573 -12.757 0.243 10.582 1.00 0.00 H new ATOM 0 HB2 LEU A 573 -11.124 1.802 9.662 1.00 0.00 H new ATOM 0 HB3 LEU A 573 -10.597 2.290 11.261 1.00 0.00 H new ATOM 0 HG LEU A 573 -9.679 0.074 11.721 1.00 0.00 H new ATOM 0 HD11 LEU A 573 -9.821 -1.741 10.039 1.00 0.00 H new ATOM 0 HD12 LEU A 573 -11.441 -1.242 10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 573 -10.824 -0.701 9.000 1.00 0.00 H new ATOM 0 HD21 LEU A 573 -7.971 -0.069 9.923 1.00 0.00 H new ATOM 0 HD22 LEU A 573 -8.974 0.975 8.888 1.00 0.00 H new ATOM 0 HD23 LEU A 573 -8.268 1.623 10.388 1.00 0.00 H new ATOM 1372 N TYR A 574 -11.441 0.983 13.537 1.00 0.00 N ATOM 1373 CA TYR A 574 -11.145 0.422 14.851 1.00 0.00 C ATOM 1374 C TYR A 574 -12.367 0.509 15.759 1.00 0.00 C ATOM 1375 O TYR A 574 -13.437 0.946 15.336 1.00 0.00 O ATOM 1376 CB TYR A 574 -9.977 1.176 15.489 1.00 0.00 C ATOM 1377 CG TYR A 574 -8.743 1.009 14.636 1.00 0.00 C ATOM 1378 CD1 TYR A 574 -7.884 -0.076 14.852 1.00 0.00 C ATOM 1379 CD2 TYR A 574 -8.456 1.939 13.630 1.00 0.00 C ATOM 1380 CE1 TYR A 574 -6.740 -0.231 14.061 1.00 0.00 C ATOM 1381 CE2 TYR A 574 -7.312 1.784 12.838 1.00 0.00 C ATOM 1382 CZ TYR A 574 -6.453 0.699 13.054 1.00 0.00 C ATOM 1383 OH TYR A 574 -5.325 0.546 12.274 1.00 0.00 O ATOM 0 H TYR A 574 -11.151 1.953 13.413 1.00 0.00 H new ATOM 0 HA TYR A 574 -10.875 -0.627 14.725 1.00 0.00 H new ATOM 0 HB2 TYR A 574 -10.223 2.233 15.588 1.00 0.00 H new ATOM 0 HB3 TYR A 574 -9.791 0.797 16.494 1.00 0.00 H new ATOM 0 HD1 TYR A 574 -8.105 -0.793 15.629 1.00 0.00 H new ATOM 0 HD2 TYR A 574 -9.117 2.777 13.465 1.00 0.00 H new ATOM 0 HE1 TYR A 574 -6.078 -1.068 14.227 1.00 0.00 H new ATOM 0 HE2 TYR A 574 -7.092 2.501 12.061 1.00 0.00 H new ATOM 0 HH TYR A 574 -5.111 -0.407 12.191 1.00 0.00 H new ATOM 1393 N MET A 575 -12.199 0.090 17.009 1.00 0.00 N ATOM 1394 CA MET A 575 -13.296 0.125 17.970 1.00 0.00 C ATOM 1395 C MET A 575 -12.826 -0.365 19.337 1.00 0.00 C ATOM 1396 O MET A 575 -13.638 -0.632 20.223 1.00 0.00 O ATOM 1397 CB MET A 575 -14.449 -0.752 17.479 1.00 0.00 C ATOM 1398 CG MET A 575 -13.897 -2.092 16.987 1.00 0.00 C ATOM 1399 SD MET A 575 -15.269 -3.232 16.677 1.00 0.00 S ATOM 1400 CE MET A 575 -14.419 -4.290 15.480 1.00 0.00 C ATOM 0 H MET A 575 -11.321 -0.275 17.378 1.00 0.00 H new ATOM 0 HA MET A 575 -13.639 1.155 18.064 1.00 0.00 H new ATOM 0 HB2 MET A 575 -15.165 -0.915 18.285 1.00 0.00 H new ATOM 0 HB3 MET A 575 -14.985 -0.250 16.674 1.00 0.00 H new ATOM 0 HG2 MET A 575 -13.318 -1.946 16.075 1.00 0.00 H new ATOM 0 HG3 MET A 575 -13.220 -2.514 17.730 1.00 0.00 H new ATOM 0 HE1 MET A 575 -15.094 -5.079 15.148 1.00 0.00 H new ATOM 0 HE2 MET A 575 -14.109 -3.693 14.622 1.00 0.00 H new ATOM 0 HE3 MET A 575 -13.541 -4.736 15.948 1.00 0.00 H new ATOM 1441 N GLU A 579 -4.726 -0.816 22.314 1.00 0.00 N ATOM 1442 CA GLU A 579 -4.084 0.465 22.033 1.00 0.00 C ATOM 1443 C GLU A 579 -3.796 0.611 20.541 1.00 0.00 C ATOM 1444 O GLU A 579 -2.767 1.161 20.148 1.00 0.00 O ATOM 1445 CB GLU A 579 -2.776 0.575 22.819 1.00 0.00 C ATOM 1446 CG GLU A 579 -3.084 0.631 24.316 1.00 0.00 C ATOM 1447 CD GLU A 579 -1.806 0.907 25.101 1.00 0.00 C ATOM 1448 OE1 GLU A 579 -1.223 1.959 24.896 1.00 0.00 O ATOM 1449 OE2 GLU A 579 -1.428 0.062 25.896 1.00 0.00 O1- ATOM 0 HA GLU A 579 -4.762 1.262 22.338 1.00 0.00 H new ATOM 0 HB2 GLU A 579 -2.135 -0.279 22.600 1.00 0.00 H new ATOM 0 HB3 GLU A 579 -2.231 1.469 22.515 1.00 0.00 H new ATOM 0 HG2 GLU A 579 -3.819 1.411 24.516 1.00 0.00 H new ATOM 0 HG3 GLU A 579 -3.524 -0.312 24.641 1.00 0.00 H new ATOM 1456 N GLN A 580 -4.713 0.117 19.716 1.00 0.00 N ATOM 1457 CA GLN A 580 -4.549 0.199 18.269 1.00 0.00 C ATOM 1458 C GLN A 580 -4.578 1.653 17.809 1.00 0.00 C ATOM 1459 O GLN A 580 -3.603 2.157 17.253 1.00 0.00 O ATOM 1460 CB GLN A 580 -5.664 -0.581 17.571 1.00 0.00 C ATOM 1461 CG GLN A 580 -5.573 -2.060 17.954 1.00 0.00 C ATOM 1462 CD GLN A 580 -4.280 -2.660 17.414 1.00 0.00 C ATOM 1463 OE1 GLN A 580 -3.540 -3.310 18.153 1.00 0.00 O ATOM 1464 NE2 GLN A 580 -3.961 -2.479 16.162 1.00 0.00 N ATOM 0 H GLN A 580 -5.572 -0.341 20.021 1.00 0.00 H new ATOM 0 HA GLN A 580 -3.584 -0.235 18.007 1.00 0.00 H new ATOM 0 HB2 GLN A 580 -6.636 -0.180 17.857 1.00 0.00 H new ATOM 0 HB3 GLN A 580 -5.578 -0.469 16.490 1.00 0.00 H new ATOM 0 HG2 GLN A 580 -5.608 -2.166 19.038 1.00 0.00 H new ATOM 0 HG3 GLN A 580 -6.430 -2.601 17.553 1.00 0.00 H new ATOM 0 HE21 GLN A 580 -4.576 -1.940 15.552 1.00 0.00 H new ATOM 0 HE22 GLN A 580 -3.097 -2.876 15.793 1.00 0.00 H new ATOM 1473 N VAL A 581 -5.703 2.320 18.046 1.00 0.00 N ATOM 1474 CA VAL A 581 -5.849 3.716 17.651 1.00 0.00 C ATOM 1475 C VAL A 581 -4.752 4.568 18.280 1.00 0.00 C ATOM 1476 O VAL A 581 -4.203 5.464 17.639 1.00 0.00 O ATOM 1477 CB VAL A 581 -7.218 4.242 18.084 1.00 0.00 C ATOM 1478 CG1 VAL A 581 -7.404 5.669 17.567 1.00 0.00 C ATOM 1479 CG2 VAL A 581 -8.313 3.344 17.504 1.00 0.00 C ATOM 0 H VAL A 581 -6.521 1.920 18.506 1.00 0.00 H new ATOM 0 HA VAL A 581 -5.764 3.777 16.566 1.00 0.00 H new ATOM 0 HB VAL A 581 -7.281 4.239 19.172 1.00 0.00 H new ATOM 0 HG11 VAL A 581 -8.380 6.044 17.876 1.00 0.00 H new ATOM 0 HG12 VAL A 581 -6.623 6.309 17.977 1.00 0.00 H new ATOM 0 HG13 VAL A 581 -7.342 5.673 16.479 1.00 0.00 H new ATOM 0 HG21 VAL A 581 -9.290 3.717 17.811 1.00 0.00 H new ATOM 0 HG22 VAL A 581 -8.249 3.348 16.416 1.00 0.00 H new ATOM 0 HG23 VAL A 581 -8.181 2.326 17.871 1.00 0.00 H new ATOM 1489 N ASP A 582 -4.437 4.282 19.539 1.00 0.00 N ATOM 1490 CA ASP A 582 -3.403 5.029 20.246 1.00 0.00 C ATOM 1491 C ASP A 582 -2.134 5.114 19.403 1.00 0.00 C ATOM 1492 O ASP A 582 -1.498 6.164 19.327 1.00 0.00 O ATOM 1493 CB ASP A 582 -3.088 4.350 21.580 1.00 0.00 C ATOM 1494 CG ASP A 582 -2.292 5.297 22.472 1.00 0.00 C ATOM 1495 OD1 ASP A 582 -2.506 6.494 22.372 1.00 0.00 O ATOM 1496 OD2 ASP A 582 -1.481 4.811 23.243 1.00 0.00 O1- ATOM 0 H ASP A 582 -4.879 3.544 20.087 1.00 0.00 H new ATOM 0 HA ASP A 582 -3.771 6.038 20.431 1.00 0.00 H new ATOM 0 HB2 ASP A 582 -4.014 4.060 22.078 1.00 0.00 H new ATOM 0 HB3 ASP A 582 -2.520 3.436 21.407 1.00 0.00 H new ATOM 1501 N ASP A 583 -1.773 4.001 18.773 1.00 0.00 N ATOM 1502 CA ASP A 583 -0.578 3.962 17.938 1.00 0.00 C ATOM 1503 C ASP A 583 -0.770 4.813 16.687 1.00 0.00 C ATOM 1504 O ASP A 583 0.156 5.485 16.233 1.00 0.00 O ATOM 1505 CB ASP A 583 -0.268 2.520 17.534 1.00 0.00 C ATOM 1506 CG ASP A 583 1.147 2.428 16.972 1.00 0.00 C ATOM 1507 OD1 ASP A 583 1.308 2.660 15.785 1.00 0.00 O ATOM 1508 OD2 ASP A 583 2.049 2.128 17.737 1.00 0.00 O1- ATOM 0 H ASP A 583 -2.286 3.121 18.824 1.00 0.00 H new ATOM 0 HA ASP A 583 0.256 4.364 18.513 1.00 0.00 H new ATOM 0 HB2 ASP A 583 -0.369 1.862 18.397 1.00 0.00 H new ATOM 0 HB3 ASP A 583 -0.987 2.180 16.789 1.00 0.00 H new ATOM 1513 N VAL A 584 -1.978 4.779 16.133 1.00 0.00 N ATOM 1514 CA VAL A 584 -2.278 5.553 14.934 1.00 0.00 C ATOM 1515 C VAL A 584 -2.028 7.037 15.179 1.00 0.00 C ATOM 1516 O VAL A 584 -1.270 7.678 14.452 1.00 0.00 O ATOM 1517 CB VAL A 584 -3.736 5.338 14.524 1.00 0.00 C ATOM 1518 CG1 VAL A 584 -4.012 6.077 13.213 1.00 0.00 C ATOM 1519 CG2 VAL A 584 -3.994 3.843 14.329 1.00 0.00 C ATOM 0 H VAL A 584 -2.759 4.229 16.491 1.00 0.00 H new ATOM 0 HA VAL A 584 -1.623 5.214 14.131 1.00 0.00 H new ATOM 0 HB VAL A 584 -4.393 5.723 15.304 1.00 0.00 H new ATOM 0 HG11 VAL A 584 -5.051 5.924 12.921 1.00 0.00 H new ATOM 0 HG12 VAL A 584 -3.827 7.142 13.350 1.00 0.00 H new ATOM 0 HG13 VAL A 584 -3.355 5.692 12.433 1.00 0.00 H new ATOM 0 HG21 VAL A 584 -5.033 3.688 14.037 1.00 0.00 H new ATOM 0 HG22 VAL A 584 -3.336 3.459 13.549 1.00 0.00 H new ATOM 0 HG23 VAL A 584 -3.797 3.315 15.262 1.00 0.00 H new ATOM 1529 N LEU A 585 -2.671 7.578 16.210 1.00 0.00 N ATOM 1530 CA LEU A 585 -2.509 8.989 16.542 1.00 0.00 C ATOM 1531 C LEU A 585 -1.036 9.321 16.756 1.00 0.00 C ATOM 1532 O LEU A 585 -0.591 10.432 16.468 1.00 0.00 O ATOM 1533 CB LEU A 585 -3.298 9.322 17.809 1.00 0.00 C ATOM 1534 CG LEU A 585 -4.738 8.827 17.661 1.00 0.00 C ATOM 1535 CD1 LEU A 585 -5.519 9.137 18.939 1.00 0.00 C ATOM 1536 CD2 LEU A 585 -5.401 9.534 16.476 1.00 0.00 C ATOM 0 H LEU A 585 -3.304 7.066 16.825 1.00 0.00 H new ATOM 0 HA LEU A 585 -2.889 9.585 15.712 1.00 0.00 H new ATOM 0 HB2 LEU A 585 -2.829 8.855 18.675 1.00 0.00 H new ATOM 0 HB3 LEU A 585 -3.289 10.398 17.983 1.00 0.00 H new ATOM 0 HG LEU A 585 -4.735 7.751 17.489 1.00 0.00 H new ATOM 0 HD11 LEU A 585 -6.545 8.784 18.833 1.00 0.00 H new ATOM 0 HD12 LEU A 585 -5.048 8.635 19.784 1.00 0.00 H new ATOM 0 HD13 LEU A 585 -5.521 10.213 19.112 1.00 0.00 H new ATOM 0 HD21 LEU A 585 -6.427 9.182 16.370 1.00 0.00 H new ATOM 0 HD22 LEU A 585 -5.403 10.610 16.649 1.00 0.00 H new ATOM 0 HD23 LEU A 585 -4.846 9.314 15.564 1.00 0.00 H new ATOM 1548 N GLU A 586 -0.283 8.349 17.263 1.00 0.00 N ATOM 1549 CA GLU A 586 1.140 8.549 17.511 1.00 0.00 C ATOM 1550 C GLU A 586 1.890 8.741 16.198 1.00 0.00 C ATOM 1551 O GLU A 586 2.835 9.526 16.121 1.00 0.00 O ATOM 1552 CB GLU A 586 1.713 7.342 18.257 1.00 0.00 C ATOM 1553 CG GLU A 586 3.130 7.663 18.736 1.00 0.00 C ATOM 1554 CD GLU A 586 3.660 6.521 19.597 1.00 0.00 C ATOM 1555 OE1 GLU A 586 3.044 5.468 19.594 1.00 0.00 O ATOM 1556 OE2 GLU A 586 4.675 6.716 20.245 1.00 0.00 O1- ATOM 0 H GLU A 586 -0.631 7.422 17.508 1.00 0.00 H new ATOM 0 HA GLU A 586 1.262 9.445 18.120 1.00 0.00 H new ATOM 0 HB2 GLU A 586 1.078 7.092 19.107 1.00 0.00 H new ATOM 0 HB3 GLU A 586 1.728 6.470 17.603 1.00 0.00 H new ATOM 0 HG2 GLU A 586 3.786 7.818 17.879 1.00 0.00 H new ATOM 0 HG3 GLU A 586 3.128 8.591 19.308 1.00 0.00 H new ATOM 1563 N THR A 587 1.462 8.020 15.167 1.00 0.00 N ATOM 1564 CA THR A 587 2.101 8.120 13.860 1.00 0.00 C ATOM 1565 C THR A 587 1.824 9.482 13.232 1.00 0.00 C ATOM 1566 O THR A 587 2.748 10.197 12.843 1.00 0.00 O ATOM 1567 CB THR A 587 1.580 7.015 12.938 1.00 0.00 C ATOM 1568 OG1 THR A 587 1.730 5.756 13.580 1.00 0.00 O ATOM 1569 CG2 THR A 587 2.374 7.021 11.631 1.00 0.00 C ATOM 0 H THR A 587 0.681 7.365 15.210 1.00 0.00 H new ATOM 0 HA THR A 587 3.177 8.005 13.992 1.00 0.00 H new ATOM 0 HB THR A 587 0.526 7.190 12.720 1.00 0.00 H new ATOM 0 HG1 THR A 587 1.088 5.686 14.318 1.00 0.00 H new ATOM 0 HG21 THR A 587 2.002 6.234 10.976 1.00 0.00 H new ATOM 0 HG22 THR A 587 2.258 7.987 11.140 1.00 0.00 H new ATOM 0 HG23 THR A 587 3.428 6.847 11.845 1.00 0.00 H new ATOM 1577 N ILE A 588 0.546 9.835 13.138 1.00 0.00 N ATOM 1578 CA ILE A 588 0.159 11.115 12.557 1.00 0.00 C ATOM 1579 C ILE A 588 1.015 12.242 13.125 1.00 0.00 C ATOM 1580 O ILE A 588 1.417 13.154 12.403 1.00 0.00 O ATOM 1581 CB ILE A 588 -1.317 11.395 12.848 1.00 0.00 C ATOM 1582 CG1 ILE A 588 -2.185 10.399 12.075 1.00 0.00 C ATOM 1583 CG2 ILE A 588 -1.664 12.819 12.410 1.00 0.00 C ATOM 1584 CD1 ILE A 588 -3.621 10.459 12.598 1.00 0.00 C ATOM 0 H ILE A 588 -0.233 9.258 13.454 1.00 0.00 H new ATOM 0 HA ILE A 588 0.314 11.066 11.479 1.00 0.00 H new ATOM 0 HB ILE A 588 -1.503 11.289 13.917 1.00 0.00 H new ATOM 0 HG12 ILE A 588 -2.165 10.632 11.010 1.00 0.00 H new ATOM 0 HG13 ILE A 588 -1.788 9.390 12.188 1.00 0.00 H new ATOM 0 HG21 ILE A 588 -2.715 13.017 12.618 1.00 0.00 H new ATOM 0 HG22 ILE A 588 -1.045 13.529 12.959 1.00 0.00 H new ATOM 0 HG23 ILE A 588 -1.479 12.926 11.341 1.00 0.00 H new ATOM 0 HD11 ILE A 588 -4.239 9.750 12.047 1.00 0.00 H new ATOM 0 HD12 ILE A 588 -3.633 10.204 13.658 1.00 0.00 H new ATOM 0 HD13 ILE A 588 -4.016 11.466 12.462 1.00 0.00 H new ATOM 1596 N SER A 589 1.290 12.172 14.423 1.00 0.00 N ATOM 1597 CA SER A 589 2.100 13.192 15.079 1.00 0.00 C ATOM 1598 C SER A 589 3.572 13.020 14.720 1.00 0.00 C ATOM 1599 O SER A 589 4.338 13.984 14.718 1.00 0.00 O ATOM 1600 CB SER A 589 1.929 13.100 16.595 1.00 0.00 C ATOM 1601 OG SER A 589 2.714 12.025 17.091 1.00 0.00 O ATOM 0 H SER A 589 0.967 11.425 15.038 1.00 0.00 H new ATOM 0 HA SER A 589 1.766 14.171 14.735 1.00 0.00 H new ATOM 0 HB2 SER A 589 2.234 14.035 17.064 1.00 0.00 H new ATOM 0 HB3 SER A 589 0.880 12.945 16.846 1.00 0.00 H new ATOM 0 HG SER A 589 2.609 11.246 16.506 1.00 0.00 H new ATOM 1607 N ALA A 590 3.961 11.786 14.416 1.00 0.00 N ATOM 1608 CA ALA A 590 5.345 11.498 14.057 1.00 0.00 C ATOM 1609 C ALA A 590 5.776 12.345 12.864 1.00 0.00 C ATOM 1610 O ALA A 590 6.917 12.801 12.794 1.00 0.00 O ATOM 1611 CB ALA A 590 5.499 10.015 13.715 1.00 0.00 C ATOM 0 H ALA A 590 3.343 10.975 14.411 1.00 0.00 H new ATOM 0 HA ALA A 590 5.980 11.741 14.909 1.00 0.00 H new ATOM 0 HB1 ALA A 590 6.536 9.809 13.448 1.00 0.00 H new ATOM 0 HB2 ALA A 590 5.220 9.412 14.579 1.00 0.00 H new ATOM 0 HB3 ALA A 590 4.852 9.766 12.874 1.00 0.00 H new ATOM 1617 N ILE A 591 4.855 12.551 11.928 1.00 0.00 N ATOM 1618 CA ILE A 591 5.150 13.345 10.740 1.00 0.00 C ATOM 1619 C ILE A 591 4.542 14.738 10.864 1.00 0.00 C ATOM 1620 O ILE A 591 3.611 15.086 10.137 1.00 0.00 O ATOM 1621 CB ILE A 591 4.594 12.651 9.496 1.00 0.00 C ATOM 1622 CG1 ILE A 591 3.178 12.146 9.784 1.00 0.00 C ATOM 1623 CG2 ILE A 591 5.489 11.467 9.126 1.00 0.00 C ATOM 1624 CD1 ILE A 591 2.573 11.564 8.505 1.00 0.00 C ATOM 0 H ILE A 591 3.905 12.182 11.968 1.00 0.00 H new ATOM 0 HA ILE A 591 6.232 13.440 10.648 1.00 0.00 H new ATOM 0 HB ILE A 591 4.568 13.359 8.668 1.00 0.00 H new ATOM 0 HG12 ILE A 591 3.203 11.386 10.565 1.00 0.00 H new ATOM 0 HG13 ILE A 591 2.558 12.962 10.153 1.00 0.00 H new ATOM 0 HG21 ILE A 591 5.091 10.973 8.239 1.00 0.00 H new ATOM 0 HG22 ILE A 591 6.498 11.824 8.921 1.00 0.00 H new ATOM 0 HG23 ILE A 591 5.516 10.759 9.954 1.00 0.00 H new ATOM 0 HD11 ILE A 591 1.565 11.204 8.710 1.00 0.00 H new ATOM 0 HD12 ILE A 591 2.533 12.336 7.737 1.00 0.00 H new ATOM 0 HD13 ILE A 591 3.189 10.736 8.155 1.00 0.00 H new ATOM 1636 N GLU A 592 5.075 15.531 11.787 1.00 0.00 N ATOM 1637 CA GLU A 592 4.578 16.886 11.998 1.00 0.00 C ATOM 1638 C GLU A 592 3.109 16.861 12.408 1.00 0.00 C ATOM 1639 O GLU A 592 2.563 15.806 12.732 1.00 0.00 O ATOM 1640 CB GLU A 592 4.738 17.706 10.716 1.00 0.00 C ATOM 1641 CG GLU A 592 6.137 17.484 10.139 1.00 0.00 C ATOM 1642 CD GLU A 592 6.414 18.498 9.035 1.00 0.00 C ATOM 1643 OE1 GLU A 592 6.515 19.673 9.348 1.00 0.00 O ATOM 1644 OE2 GLU A 592 6.520 18.086 7.892 1.00 0.00 O1- ATOM 0 H GLU A 592 5.846 15.262 12.398 1.00 0.00 H new ATOM 0 HA GLU A 592 5.159 17.345 12.798 1.00 0.00 H new ATOM 0 HB2 GLU A 592 3.982 17.413 9.988 1.00 0.00 H new ATOM 0 HB3 GLU A 592 4.584 18.764 10.927 1.00 0.00 H new ATOM 0 HG2 GLU A 592 6.884 17.580 10.927 1.00 0.00 H new ATOM 0 HG3 GLU A 592 6.219 16.472 9.743 1.00 0.00 H new ATOM 1651 N HIS A 593 2.475 18.030 12.392 1.00 0.00 N ATOM 1652 CA HIS A 593 1.069 18.132 12.765 1.00 0.00 C ATOM 1653 C HIS A 593 0.329 19.068 11.815 1.00 0.00 C ATOM 1654 O HIS A 593 0.052 20.219 12.152 1.00 0.00 O ATOM 1655 CB HIS A 593 0.945 18.655 14.198 1.00 0.00 C ATOM 1656 CG HIS A 593 1.586 20.012 14.294 1.00 0.00 C ATOM 1657 ND1 HIS A 593 2.784 20.310 13.663 1.00 0.00 N ATOM 1658 CD2 HIS A 593 1.209 21.161 14.943 1.00 0.00 C ATOM 1659 CE1 HIS A 593 3.082 21.592 13.943 1.00 0.00 C ATOM 1660 NE2 HIS A 593 2.154 22.157 14.720 1.00 0.00 N ATOM 0 H HIS A 593 2.909 18.914 12.127 1.00 0.00 H new ATOM 0 HA HIS A 593 0.623 17.140 12.700 1.00 0.00 H new ATOM 0 HB2 HIS A 593 -0.105 18.716 14.485 1.00 0.00 H new ATOM 0 HB3 HIS A 593 1.425 17.964 14.891 1.00 0.00 H new ATOM 0 HD2 HIS A 593 0.314 21.275 15.537 1.00 0.00 H new ATOM 0 HE1 HIS A 593 3.964 22.102 13.583 1.00 0.00 H new ATOM 0 HE2 HIS A 593 2.141 23.114 15.074 1.00 0.00 H new ATOM 1668 N PRO A 594 0.009 18.594 10.641 1.00 0.00 N ATOM 1669 CA PRO A 594 -0.713 19.393 9.615 1.00 0.00 C ATOM 1670 C PRO A 594 -2.195 19.549 9.951 1.00 0.00 C ATOM 1671 O PRO A 594 -2.596 19.415 11.107 1.00 0.00 O ATOM 1672 CB PRO A 594 -0.527 18.601 8.309 1.00 0.00 C ATOM 1673 CG PRO A 594 0.294 17.390 8.644 1.00 0.00 C ATOM 1674 CD PRO A 594 0.300 17.242 10.164 1.00 0.00 C ATOM 0 HA PRO A 594 -0.324 20.409 9.550 1.00 0.00 H new ATOM 0 HB2 PRO A 594 -1.492 18.310 7.894 1.00 0.00 H new ATOM 0 HB3 PRO A 594 -0.027 19.210 7.556 1.00 0.00 H new ATOM 0 HG2 PRO A 594 -0.126 16.501 8.174 1.00 0.00 H new ATOM 0 HG3 PRO A 594 1.310 17.500 8.266 1.00 0.00 H new ATOM 0 HD2 PRO A 594 -0.451 16.528 10.500 1.00 0.00 H new ATOM 0 HD3 PRO A 594 1.264 16.887 10.529 1.00 0.00 H new ATOM 1682 N MET A 595 -3.000 19.833 8.932 1.00 0.00 N ATOM 1683 CA MET A 595 -4.435 20.005 9.131 1.00 0.00 C ATOM 1684 C MET A 595 -5.073 18.700 9.599 1.00 0.00 C ATOM 1685 O MET A 595 -6.292 18.612 9.746 1.00 0.00 O ATOM 1686 CB MET A 595 -5.093 20.458 7.826 1.00 0.00 C ATOM 1687 CG MET A 595 -4.501 21.801 7.396 1.00 0.00 C ATOM 1688 SD MET A 595 -5.157 22.256 5.771 1.00 0.00 S ATOM 1689 CE MET A 595 -4.563 23.966 5.758 1.00 0.00 C ATOM 0 H MET A 595 -2.687 19.948 7.968 1.00 0.00 H new ATOM 0 HA MET A 595 -4.587 20.765 9.897 1.00 0.00 H new ATOM 0 HB2 MET A 595 -4.933 19.712 7.048 1.00 0.00 H new ATOM 0 HB3 MET A 595 -6.170 20.550 7.962 1.00 0.00 H new ATOM 0 HG2 MET A 595 -4.747 22.570 8.128 1.00 0.00 H new ATOM 0 HG3 MET A 595 -3.414 21.735 7.356 1.00 0.00 H new ATOM 0 HE1 MET A 595 -4.861 24.448 4.827 1.00 0.00 H new ATOM 0 HE2 MET A 595 -4.993 24.507 6.601 1.00 0.00 H new ATOM 0 HE3 MET A 595 -3.476 23.974 5.839 1.00 0.00 H new ATOM 1699 N THR A 596 -4.241 17.690 9.830 1.00 0.00 N ATOM 1700 CA THR A 596 -4.736 16.394 10.281 1.00 0.00 C ATOM 1701 C THR A 596 -5.467 16.533 11.612 1.00 0.00 C ATOM 1702 O THR A 596 -6.028 15.566 12.127 1.00 0.00 O ATOM 1703 CB THR A 596 -3.570 15.415 10.437 1.00 0.00 C ATOM 1704 OG1 THR A 596 -2.750 15.826 11.522 1.00 0.00 O ATOM 1705 CG2 THR A 596 -2.744 15.393 9.150 1.00 0.00 C ATOM 0 H THR A 596 -3.229 17.742 9.714 1.00 0.00 H new ATOM 0 HA THR A 596 -5.433 16.013 9.535 1.00 0.00 H new ATOM 0 HB THR A 596 -3.958 14.416 10.633 1.00 0.00 H new ATOM 0 HG1 THR A 596 -2.965 15.292 12.315 1.00 0.00 H new ATOM 0 HG21 THR A 596 -1.914 14.696 9.262 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.374 15.077 8.319 1.00 0.00 H new ATOM 0 HG23 THR A 596 -2.355 16.391 8.951 1.00 0.00 H new ATOM 1713 N SER A 597 -5.457 17.742 12.163 1.00 0.00 N ATOM 1714 CA SER A 597 -6.123 17.996 13.436 1.00 0.00 C ATOM 1715 C SER A 597 -7.514 17.371 13.446 1.00 0.00 C ATOM 1716 O SER A 597 -7.899 16.706 14.408 1.00 0.00 O ATOM 1717 CB SER A 597 -6.236 19.502 13.674 1.00 0.00 C ATOM 1718 OG SER A 597 -7.331 20.014 12.925 1.00 0.00 O ATOM 0 H SER A 597 -4.999 18.556 11.752 1.00 0.00 H new ATOM 0 HA SER A 597 -5.529 17.546 14.232 1.00 0.00 H new ATOM 0 HB2 SER A 597 -6.380 19.705 14.735 1.00 0.00 H new ATOM 0 HB3 SER A 597 -5.313 19.999 13.377 1.00 0.00 H new ATOM 0 HG SER A 597 -7.408 20.979 13.076 1.00 0.00 H new ATOM 1724 N ALA A 598 -8.263 17.588 12.370 1.00 0.00 N ATOM 1725 CA ALA A 598 -9.611 17.041 12.267 1.00 0.00 C ATOM 1726 C ALA A 598 -9.620 15.564 12.651 1.00 0.00 C ATOM 1727 O ALA A 598 -10.486 15.114 13.401 1.00 0.00 O ATOM 1728 CB ALA A 598 -10.131 17.202 10.838 1.00 0.00 C ATOM 0 H ALA A 598 -7.963 18.134 11.563 1.00 0.00 H new ATOM 0 HA ALA A 598 -10.259 17.587 12.953 1.00 0.00 H new ATOM 0 HB1 ALA A 598 -11.138 16.791 10.769 1.00 0.00 H new ATOM 0 HB2 ALA A 598 -10.152 18.260 10.575 1.00 0.00 H new ATOM 0 HB3 ALA A 598 -9.474 16.670 10.150 1.00 0.00 H new ATOM 1734 N ILE A 599 -8.652 14.817 12.131 1.00 0.00 N ATOM 1735 CA ILE A 599 -8.558 13.392 12.427 1.00 0.00 C ATOM 1736 C ILE A 599 -8.148 13.172 13.879 1.00 0.00 C ATOM 1737 O ILE A 599 -8.744 12.359 14.587 1.00 0.00 O ATOM 1738 CB ILE A 599 -7.535 12.733 11.501 1.00 0.00 C ATOM 1739 CG1 ILE A 599 -7.759 13.216 10.065 1.00 0.00 C ATOM 1740 CG2 ILE A 599 -7.697 11.213 11.557 1.00 0.00 C ATOM 1741 CD1 ILE A 599 -9.232 13.042 9.689 1.00 0.00 C ATOM 0 H ILE A 599 -7.927 15.171 11.507 1.00 0.00 H new ATOM 0 HA ILE A 599 -9.537 12.941 12.266 1.00 0.00 H new ATOM 0 HB ILE A 599 -6.529 13.003 11.824 1.00 0.00 H new ATOM 0 HG12 ILE A 599 -7.471 14.263 9.974 1.00 0.00 H new ATOM 0 HG13 ILE A 599 -7.129 12.651 9.378 1.00 0.00 H new ATOM 0 HG21 ILE A 599 -6.967 10.745 10.896 1.00 0.00 H new ATOM 0 HG22 ILE A 599 -7.536 10.867 12.578 1.00 0.00 H new ATOM 0 HG23 ILE A 599 -8.703 10.942 11.236 1.00 0.00 H new ATOM 0 HD11 ILE A 599 -9.390 13.386 8.667 1.00 0.00 H new ATOM 0 HD12 ILE A 599 -9.505 11.989 9.764 1.00 0.00 H new ATOM 0 HD13 ILE A 599 -9.852 13.626 10.368 1.00 0.00 H new ATOM 1753 N GLU A 600 -7.127 13.901 14.317 1.00 0.00 N ATOM 1754 CA GLU A 600 -6.645 13.778 15.688 1.00 0.00 C ATOM 1755 C GLU A 600 -7.804 13.873 16.675 1.00 0.00 C ATOM 1756 O GLU A 600 -8.053 12.947 17.447 1.00 0.00 O ATOM 1757 CB GLU A 600 -5.627 14.881 15.985 1.00 0.00 C ATOM 1758 CG GLU A 600 -4.901 14.567 17.295 1.00 0.00 C ATOM 1759 CD GLU A 600 -3.948 13.394 17.094 1.00 0.00 C ATOM 1760 OE1 GLU A 600 -3.692 13.054 15.950 1.00 0.00 O ATOM 1761 OE2 GLU A 600 -3.487 12.854 18.086 1.00 0.00 O1- ATOM 0 H GLU A 600 -6.620 14.579 13.747 1.00 0.00 H new ATOM 0 HA GLU A 600 -6.168 12.804 15.799 1.00 0.00 H new ATOM 0 HB2 GLU A 600 -4.909 14.957 15.168 1.00 0.00 H new ATOM 0 HB3 GLU A 600 -6.130 15.845 16.058 1.00 0.00 H new ATOM 0 HG2 GLU A 600 -4.347 15.443 17.632 1.00 0.00 H new ATOM 0 HG3 GLU A 600 -5.625 14.329 18.074 1.00 0.00 H new ATOM 1768 N VAL A 601 -8.510 14.998 16.644 1.00 0.00 N ATOM 1769 CA VAL A 601 -9.642 15.204 17.541 1.00 0.00 C ATOM 1770 C VAL A 601 -10.671 14.091 17.370 1.00 0.00 C ATOM 1771 O VAL A 601 -10.895 13.294 18.281 1.00 0.00 O ATOM 1772 CB VAL A 601 -10.297 16.556 17.254 1.00 0.00 C ATOM 1773 CG1 VAL A 601 -11.529 16.726 18.144 1.00 0.00 C ATOM 1774 CG2 VAL A 601 -9.298 17.677 17.548 1.00 0.00 C ATOM 0 H VAL A 601 -8.321 15.776 16.012 1.00 0.00 H new ATOM 0 HA VAL A 601 -9.275 15.189 18.567 1.00 0.00 H new ATOM 0 HB VAL A 601 -10.597 16.600 16.207 1.00 0.00 H new ATOM 0 HG11 VAL A 601 -11.996 17.690 17.939 1.00 0.00 H new ATOM 0 HG12 VAL A 601 -12.241 15.927 17.937 1.00 0.00 H new ATOM 0 HG13 VAL A 601 -11.230 16.683 19.191 1.00 0.00 H new ATOM 0 HG21 VAL A 601 -9.763 18.642 17.344 1.00 0.00 H new ATOM 0 HG22 VAL A 601 -8.999 17.633 18.595 1.00 0.00 H new ATOM 0 HG23 VAL A 601 -8.419 17.557 16.914 1.00 0.00 H new ATOM 1784 N LEU A 602 -11.295 14.044 16.197 1.00 0.00 N ATOM 1785 CA LEU A 602 -12.300 13.025 15.918 1.00 0.00 C ATOM 1786 C LEU A 602 -11.825 11.658 16.401 1.00 0.00 C ATOM 1787 O LEU A 602 -12.306 11.145 17.412 1.00 0.00 O ATOM 1788 CB LEU A 602 -12.582 12.969 14.415 1.00 0.00 C ATOM 1789 CG LEU A 602 -13.606 11.869 14.123 1.00 0.00 C ATOM 1790 CD1 LEU A 602 -14.892 12.143 14.906 1.00 0.00 C ATOM 1791 CD2 LEU A 602 -13.917 11.851 12.624 1.00 0.00 C ATOM 0 H LEU A 602 -11.124 14.694 15.430 1.00 0.00 H new ATOM 0 HA LEU A 602 -13.215 13.287 16.450 1.00 0.00 H new ATOM 0 HB2 LEU A 602 -12.959 13.932 14.070 1.00 0.00 H new ATOM 0 HB3 LEU A 602 -11.659 12.774 13.869 1.00 0.00 H new ATOM 0 HG LEU A 602 -13.198 10.904 14.424 1.00 0.00 H new ATOM 0 HD11 LEU A 602 -15.620 11.359 14.697 1.00 0.00 H new ATOM 0 HD12 LEU A 602 -14.672 12.158 15.973 1.00 0.00 H new ATOM 0 HD13 LEU A 602 -15.302 13.108 14.606 1.00 0.00 H new ATOM 0 HD21 LEU A 602 -14.646 11.069 12.413 1.00 0.00 H new ATOM 0 HD22 LEU A 602 -14.325 12.817 12.325 1.00 0.00 H new ATOM 0 HD23 LEU A 602 -13.002 11.655 12.065 1.00 0.00 H new ATOM 1803 N VAL A 603 -10.879 11.074 15.673 1.00 0.00 N ATOM 1804 CA VAL A 603 -10.347 9.767 16.038 1.00 0.00 C ATOM 1805 C VAL A 603 -9.903 9.758 17.498 1.00 0.00 C ATOM 1806 O VAL A 603 -9.914 8.716 18.154 1.00 0.00 O ATOM 1807 CB VAL A 603 -9.160 9.416 15.140 1.00 0.00 C ATOM 1808 CG1 VAL A 603 -8.678 8.000 15.458 1.00 0.00 C ATOM 1809 CG2 VAL A 603 -9.593 9.489 13.674 1.00 0.00 C ATOM 0 H VAL A 603 -10.468 11.482 14.833 1.00 0.00 H new ATOM 0 HA VAL A 603 -11.135 9.025 15.904 1.00 0.00 H new ATOM 0 HB VAL A 603 -8.349 10.123 15.317 1.00 0.00 H new ATOM 0 HG11 VAL A 603 -7.832 7.751 14.817 1.00 0.00 H new ATOM 0 HG12 VAL A 603 -8.370 7.946 16.502 1.00 0.00 H new ATOM 0 HG13 VAL A 603 -9.488 7.292 15.281 1.00 0.00 H new ATOM 0 HG21 VAL A 603 -8.748 9.239 13.032 1.00 0.00 H new ATOM 0 HG22 VAL A 603 -10.404 8.782 13.498 1.00 0.00 H new ATOM 0 HG23 VAL A 603 -9.936 10.498 13.446 1.00 0.00 H new ATOM 1819 N GLY A 604 -9.513 10.925 17.999 1.00 0.00 N ATOM 1820 CA GLY A 604 -9.067 11.039 19.383 1.00 0.00 C ATOM 1821 C GLY A 604 -10.211 10.749 20.349 1.00 0.00 C ATOM 1822 O GLY A 604 -10.020 10.095 21.374 1.00 0.00 O ATOM 0 H GLY A 604 -9.496 11.799 17.473 1.00 0.00 H new ATOM 0 HA2 GLY A 604 -8.248 10.343 19.564 1.00 0.00 H new ATOM 0 HA3 GLY A 604 -8.679 12.042 19.563 1.00 0.00 H new ATOM 1826 N SER A 605 -11.399 11.241 20.014 1.00 0.00 N ATOM 1827 CA SER A 605 -12.568 11.028 20.860 1.00 0.00 C ATOM 1828 C SER A 605 -12.927 9.547 20.914 1.00 0.00 C ATOM 1829 O SER A 605 -13.074 8.973 21.993 1.00 0.00 O ATOM 1830 CB SER A 605 -13.756 11.824 20.319 1.00 0.00 C ATOM 1831 OG SER A 605 -14.770 11.887 21.312 1.00 0.00 O ATOM 0 H SER A 605 -11.577 11.785 19.170 1.00 0.00 H new ATOM 0 HA SER A 605 -12.331 11.370 21.868 1.00 0.00 H new ATOM 0 HB2 SER A 605 -13.439 12.829 20.042 1.00 0.00 H new ATOM 0 HB3 SER A 605 -14.144 11.352 19.416 1.00 0.00 H new ATOM 0 HG SER A 605 -15.532 12.398 20.969 1.00 0.00 H new ATOM 1837 N CYS A 606 -13.066 8.934 19.743 1.00 0.00 N ATOM 1838 CA CYS A 606 -13.408 7.518 19.669 1.00 0.00 C ATOM 1839 C CYS A 606 -12.165 6.656 19.867 1.00 0.00 C ATOM 1840 O CYS A 606 -11.151 6.849 19.197 1.00 0.00 O ATOM 1841 CB CYS A 606 -14.039 7.203 18.312 1.00 0.00 C ATOM 1842 SG CYS A 606 -14.499 5.454 18.252 1.00 0.00 S ATOM 0 H CYS A 606 -12.948 9.391 18.839 1.00 0.00 H new ATOM 0 HA CYS A 606 -14.122 7.294 20.462 1.00 0.00 H new ATOM 0 HB2 CYS A 606 -14.919 7.827 18.154 1.00 0.00 H new ATOM 0 HB3 CYS A 606 -13.337 7.433 17.510 1.00 0.00 H new ATOM 0 HG CYS A 606 -15.038 5.186 17.099 1.00 0.00 H new ATOM 1848 N ALA A 607 -12.252 5.704 20.790 1.00 0.00 N ATOM 1849 CA ALA A 607 -11.127 4.817 21.067 1.00 0.00 C ATOM 1850 C ALA A 607 -11.547 3.701 22.018 1.00 0.00 C ATOM 1851 O ALA A 607 -11.948 2.621 21.584 1.00 0.00 O ATOM 1852 CB ALA A 607 -9.976 5.612 21.686 1.00 0.00 C ATOM 0 H ALA A 607 -13.083 5.527 21.355 1.00 0.00 H new ATOM 0 HA ALA A 607 -10.798 4.373 20.127 1.00 0.00 H new ATOM 0 HB1 ALA A 607 -9.140 4.943 21.890 1.00 0.00 H new ATOM 0 HB2 ALA A 607 -9.657 6.390 20.993 1.00 0.00 H new ATOM 0 HB3 ALA A 607 -10.310 6.070 22.617 1.00 0.00 H new ATOM 1923 N MET B 1 4.396 -21.019 -22.240 1.00 0.00 N ATOM 1924 CA MET B 1 3.394 -21.198 -21.152 1.00 0.00 C ATOM 1925 C MET B 1 2.226 -20.244 -21.376 1.00 0.00 C ATOM 1926 O MET B 1 2.350 -19.254 -22.097 1.00 0.00 O ATOM 1927 CB MET B 1 4.052 -20.912 -19.799 1.00 0.00 C ATOM 1928 CG MET B 1 5.035 -19.748 -19.937 1.00 0.00 C ATOM 1929 SD MET B 1 6.246 -19.821 -18.593 1.00 0.00 S ATOM 1930 CE MET B 1 6.249 -18.057 -18.190 1.00 0.00 C ATOM 0 H1 MET B 1 5.336 -21.299 -21.895 1.00 0.00 H new ATOM 0 H2 MET B 1 4.135 -21.612 -23.054 1.00 0.00 H new ATOM 0 H3 MET B 1 4.417 -20.021 -22.531 1.00 0.00 H new ATOM 0 HA MET B 1 3.024 -22.223 -21.159 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.290 -20.671 -19.058 1.00 0.00 H new ATOM 0 HB3 MET B 1 4.574 -21.800 -19.443 1.00 0.00 H new ATOM 0 HG2 MET B 1 5.542 -19.798 -20.901 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.499 -18.799 -19.907 1.00 0.00 H new ATOM 0 HE1 MET B 1 7.095 -17.834 -17.540 1.00 0.00 H new ATOM 0 HE2 MET B 1 6.332 -17.474 -19.107 1.00 0.00 H new ATOM 0 HE3 MET B 1 5.321 -17.799 -17.679 1.00 0.00 H new ATOM 1942 N GLN B 2 1.093 -20.549 -20.752 1.00 0.00 N ATOM 1943 CA GLN B 2 -0.094 -19.712 -20.889 1.00 0.00 C ATOM 1944 C GLN B 2 -0.321 -18.894 -19.621 1.00 0.00 C ATOM 1945 O GLN B 2 -0.723 -19.431 -18.589 1.00 0.00 O ATOM 1946 CB GLN B 2 -1.320 -20.586 -21.160 1.00 0.00 C ATOM 1947 CG GLN B 2 -2.503 -19.701 -21.557 1.00 0.00 C ATOM 1948 CD GLN B 2 -3.732 -20.563 -21.826 1.00 0.00 C ATOM 1949 OE1 GLN B 2 -4.153 -21.331 -20.962 1.00 0.00 O ATOM 1950 NE2 GLN B 2 -4.335 -20.481 -22.980 1.00 0.00 N ATOM 0 H GLN B 2 0.971 -21.364 -20.150 1.00 0.00 H new ATOM 0 HA GLN B 2 0.059 -19.030 -21.726 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -1.103 -21.298 -21.956 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -1.569 -21.166 -20.272 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -2.717 -18.987 -20.762 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -2.253 -19.122 -22.446 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -3.984 -19.843 -23.695 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -5.157 -21.054 -23.168 1.00 0.00 H new ATOM 1959 N ILE B 3 -0.061 -17.593 -19.707 1.00 0.00 N ATOM 1960 CA ILE B 3 -0.241 -16.712 -18.558 1.00 0.00 C ATOM 1961 C ILE B 3 -1.509 -15.879 -18.713 1.00 0.00 C ATOM 1962 O ILE B 3 -1.978 -15.643 -19.828 1.00 0.00 O ATOM 1963 CB ILE B 3 0.967 -15.789 -18.411 1.00 0.00 C ATOM 1964 CG1 ILE B 3 1.107 -14.920 -19.663 1.00 0.00 C ATOM 1965 CG2 ILE B 3 2.233 -16.629 -18.232 1.00 0.00 C ATOM 1966 CD1 ILE B 3 1.894 -13.657 -19.313 1.00 0.00 C ATOM 0 H ILE B 3 0.272 -17.129 -20.552 1.00 0.00 H new ATOM 0 HA ILE B 3 -0.334 -17.328 -17.664 1.00 0.00 H new ATOM 0 HB ILE B 3 0.827 -15.149 -17.540 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.618 -15.475 -20.450 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.122 -14.654 -20.048 1.00 0.00 H new ATOM 0 HG21 ILE B 3 3.095 -15.970 -18.127 1.00 0.00 H new ATOM 0 HG22 ILE B 3 2.137 -17.246 -17.339 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.370 -17.270 -19.103 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.997 -13.034 -20.202 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.364 -13.101 -18.539 1.00 0.00 H new ATOM 0 HD13 ILE B 3 2.883 -13.934 -18.948 1.00 0.00 H new ATOM 1978 N PHE B 4 -2.059 -15.436 -17.587 1.00 0.00 N ATOM 1979 CA PHE B 4 -3.274 -14.630 -17.604 1.00 0.00 C ATOM 1980 C PHE B 4 -3.001 -13.235 -17.054 1.00 0.00 C ATOM 1981 O PHE B 4 -2.092 -13.041 -16.248 1.00 0.00 O ATOM 1982 CB PHE B 4 -4.360 -15.307 -16.765 1.00 0.00 C ATOM 1983 CG PHE B 4 -4.757 -16.612 -17.414 1.00 0.00 C ATOM 1984 CD1 PHE B 4 -3.892 -17.711 -17.361 1.00 0.00 C ATOM 1985 CD2 PHE B 4 -5.991 -16.723 -18.066 1.00 0.00 C ATOM 1986 CE1 PHE B 4 -4.260 -18.921 -17.962 1.00 0.00 C ATOM 1987 CE2 PHE B 4 -6.359 -17.933 -18.667 1.00 0.00 C ATOM 1988 CZ PHE B 4 -5.493 -19.032 -18.615 1.00 0.00 C ATOM 0 H PHE B 4 -1.685 -15.620 -16.656 1.00 0.00 H new ATOM 0 HA PHE B 4 -3.613 -14.540 -18.636 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -3.994 -15.488 -15.754 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -5.228 -14.653 -16.678 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -2.941 -17.626 -16.857 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -6.659 -15.875 -18.105 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -3.592 -19.769 -17.922 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -7.311 -18.019 -19.171 1.00 0.00 H new ATOM 0 HZ PHE B 4 -5.776 -19.965 -19.079 1.00 0.00 H new ATOM 1998 N VAL B 5 -3.798 -12.266 -17.495 1.00 0.00 N ATOM 1999 CA VAL B 5 -3.638 -10.889 -17.040 1.00 0.00 C ATOM 2000 C VAL B 5 -4.975 -10.326 -16.573 1.00 0.00 C ATOM 2001 O VAL B 5 -5.849 -10.019 -17.385 1.00 0.00 O ATOM 2002 CB VAL B 5 -3.084 -10.025 -18.174 1.00 0.00 C ATOM 2003 CG1 VAL B 5 -2.955 -8.577 -17.698 1.00 0.00 C ATOM 2004 CG2 VAL B 5 -1.706 -10.549 -18.586 1.00 0.00 C ATOM 0 H VAL B 5 -4.556 -12.407 -18.162 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.939 -10.878 -16.204 1.00 0.00 H new ATOM 0 HB VAL B 5 -3.761 -10.068 -19.027 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -2.560 -7.962 -18.507 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -3.935 -8.202 -17.403 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -2.278 -8.533 -16.845 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -1.310 -9.934 -19.394 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -1.030 -10.506 -17.732 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -1.796 -11.581 -18.926 1.00 0.00 H new ATOM 2014 N LYS B 6 -5.130 -10.196 -15.260 1.00 0.00 N ATOM 2015 CA LYS B 6 -6.368 -9.673 -14.694 1.00 0.00 C ATOM 2016 C LYS B 6 -6.390 -8.149 -14.764 1.00 0.00 C ATOM 2017 O LYS B 6 -5.472 -7.482 -14.287 1.00 0.00 O ATOM 2018 CB LYS B 6 -6.506 -10.120 -13.237 1.00 0.00 C ATOM 2019 CG LYS B 6 -7.881 -9.709 -12.705 1.00 0.00 C ATOM 2020 CD LYS B 6 -8.015 -10.140 -11.242 1.00 0.00 C ATOM 2021 CE LYS B 6 -8.585 -11.558 -11.176 1.00 0.00 C ATOM 2022 NZ LYS B 6 -10.036 -11.527 -11.517 1.00 0.00 N1+ ATOM 0 H LYS B 6 -4.419 -10.444 -14.572 1.00 0.00 H new ATOM 0 HA LYS B 6 -7.203 -10.064 -15.275 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -6.384 -11.201 -13.164 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -5.720 -9.669 -12.631 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -8.007 -8.630 -12.790 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -8.667 -10.170 -13.304 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -7.042 -10.105 -10.751 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -8.667 -9.450 -10.707 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -8.051 -12.208 -11.869 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -8.444 -11.972 -10.178 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -10.506 -12.362 -11.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -10.466 -10.664 -11.126 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -10.150 -11.533 -12.551 1.00 0.00 H new ATOM 2036 N THR B 7 -7.448 -7.606 -15.358 1.00 0.00 N ATOM 2037 CA THR B 7 -7.583 -6.159 -15.482 1.00 0.00 C ATOM 2038 C THR B 7 -8.317 -5.588 -14.273 1.00 0.00 C ATOM 2039 O THR B 7 -9.070 -6.294 -13.603 1.00 0.00 O ATOM 2040 CB THR B 7 -8.352 -5.814 -16.759 1.00 0.00 C ATOM 2041 OG1 THR B 7 -9.705 -6.223 -16.620 1.00 0.00 O ATOM 2042 CG2 THR B 7 -7.718 -6.534 -17.950 1.00 0.00 C ATOM 0 H THR B 7 -8.219 -8.141 -15.758 1.00 0.00 H new ATOM 0 HA THR B 7 -6.586 -5.720 -15.530 1.00 0.00 H new ATOM 0 HB THR B 7 -8.313 -4.738 -16.927 1.00 0.00 H new ATOM 0 HG1 THR B 7 -9.759 -7.200 -16.675 1.00 0.00 H new ATOM 0 HG21 THR B 7 -8.267 -6.287 -18.859 1.00 0.00 H new ATOM 0 HG22 THR B 7 -6.680 -6.218 -18.056 1.00 0.00 H new ATOM 0 HG23 THR B 7 -7.754 -7.611 -17.785 1.00 0.00 H new ATOM 2050 N LEU B 8 -8.091 -4.308 -13.999 1.00 0.00 N ATOM 2051 CA LEU B 8 -8.736 -3.655 -12.867 1.00 0.00 C ATOM 2052 C LEU B 8 -10.216 -3.422 -13.156 1.00 0.00 C ATOM 2053 O LEU B 8 -10.750 -2.346 -12.885 1.00 0.00 O ATOM 2054 CB LEU B 8 -8.049 -2.319 -12.573 1.00 0.00 C ATOM 2055 CG LEU B 8 -7.867 -2.154 -11.062 1.00 0.00 C ATOM 2056 CD1 LEU B 8 -6.630 -2.932 -10.606 1.00 0.00 C ATOM 2057 CD2 LEU B 8 -7.686 -0.672 -10.729 1.00 0.00 C ATOM 0 H LEU B 8 -7.471 -3.706 -14.541 1.00 0.00 H new ATOM 0 HA LEU B 8 -8.648 -4.305 -11.996 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -7.081 -2.279 -13.072 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -8.646 -1.497 -12.969 1.00 0.00 H new ATOM 0 HG LEU B 8 -8.748 -2.539 -10.548 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -6.502 -2.813 -9.530 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -6.757 -3.988 -10.842 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -5.749 -2.549 -11.121 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -7.556 -0.554 -9.653 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -6.806 -0.288 -11.245 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -8.567 -0.116 -11.051 1.00 0.00 H new ATOM 2069 N THR B 9 -10.873 -4.437 -13.706 1.00 0.00 N ATOM 2070 CA THR B 9 -12.292 -4.333 -14.027 1.00 0.00 C ATOM 2071 C THR B 9 -12.997 -5.663 -13.780 1.00 0.00 C ATOM 2072 O THR B 9 -14.088 -5.702 -13.212 1.00 0.00 O ATOM 2073 CB THR B 9 -12.468 -3.925 -15.492 1.00 0.00 C ATOM 2074 OG1 THR B 9 -12.120 -5.017 -16.331 1.00 0.00 O ATOM 2075 CG2 THR B 9 -11.563 -2.731 -15.802 1.00 0.00 C ATOM 0 H THR B 9 -10.450 -5.336 -13.938 1.00 0.00 H new ATOM 0 HA THR B 9 -12.736 -3.574 -13.382 1.00 0.00 H new ATOM 0 HB THR B 9 -13.507 -3.647 -15.671 1.00 0.00 H new ATOM 0 HG1 THR B 9 -11.170 -5.227 -16.217 1.00 0.00 H new ATOM 0 HG21 THR B 9 -11.688 -2.441 -16.845 1.00 0.00 H new ATOM 0 HG22 THR B 9 -11.831 -1.894 -15.157 1.00 0.00 H new ATOM 0 HG23 THR B 9 -10.523 -3.007 -15.625 1.00 0.00 H new ATOM 2083 N GLY B 10 -12.365 -6.751 -14.211 1.00 0.00 N ATOM 2084 CA GLY B 10 -12.941 -8.079 -14.030 1.00 0.00 C ATOM 2085 C GLY B 10 -12.596 -8.987 -15.205 1.00 0.00 C ATOM 2086 O GLY B 10 -12.738 -10.207 -15.121 1.00 0.00 O ATOM 0 H GLY B 10 -11.461 -6.740 -14.684 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -12.569 -8.518 -13.104 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -14.024 -8.000 -13.932 1.00 0.00 H new ATOM 2090 N LYS B 11 -12.141 -8.385 -16.299 1.00 0.00 N ATOM 2091 CA LYS B 11 -11.779 -9.151 -17.486 1.00 0.00 C ATOM 2092 C LYS B 11 -10.363 -9.704 -17.356 1.00 0.00 C ATOM 2093 O LYS B 11 -9.462 -9.020 -16.871 1.00 0.00 O ATOM 2094 CB LYS B 11 -11.870 -8.264 -18.729 1.00 0.00 C ATOM 2095 CG LYS B 11 -11.460 -9.069 -19.963 1.00 0.00 C ATOM 2096 CD LYS B 11 -11.783 -8.269 -21.227 1.00 0.00 C ATOM 2097 CE LYS B 11 -11.125 -8.936 -22.436 1.00 0.00 C ATOM 2098 NZ LYS B 11 -11.735 -10.278 -22.656 1.00 0.00 N1+ ATOM 0 H LYS B 11 -12.015 -7.377 -16.388 1.00 0.00 H new ATOM 0 HA LYS B 11 -12.475 -9.984 -17.583 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -12.887 -7.890 -18.848 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -11.221 -7.395 -18.617 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -10.394 -9.294 -19.925 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -11.987 -10.023 -19.979 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -12.862 -8.216 -21.370 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -11.424 -7.245 -21.123 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -11.255 -8.316 -23.323 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -10.052 -9.035 -22.271 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -11.414 -10.660 -23.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -11.446 -10.920 -21.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -12.771 -10.191 -22.663 1.00 0.00 H new ATOM 2112 N THR B 12 -10.175 -10.945 -17.793 1.00 0.00 N ATOM 2113 CA THR B 12 -8.865 -11.582 -17.723 1.00 0.00 C ATOM 2114 C THR B 12 -8.367 -11.934 -19.122 1.00 0.00 C ATOM 2115 O THR B 12 -9.016 -12.685 -19.850 1.00 0.00 O ATOM 2116 CB THR B 12 -8.946 -12.853 -16.873 1.00 0.00 C ATOM 2117 OG1 THR B 12 -9.530 -12.542 -15.616 1.00 0.00 O ATOM 2118 CG2 THR B 12 -7.541 -13.418 -16.660 1.00 0.00 C ATOM 0 H THR B 12 -10.909 -11.527 -18.197 1.00 0.00 H new ATOM 0 HA THR B 12 -8.165 -10.883 -17.264 1.00 0.00 H new ATOM 0 HB THR B 12 -9.558 -13.595 -17.385 1.00 0.00 H new ATOM 0 HG1 THR B 12 -9.585 -13.354 -15.071 1.00 0.00 H new ATOM 0 HG21 THR B 12 -7.600 -14.323 -16.055 1.00 0.00 H new ATOM 0 HG22 THR B 12 -7.094 -13.656 -17.625 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.925 -12.679 -16.148 1.00 0.00 H new ATOM 2126 N ILE B 13 -7.213 -11.387 -19.491 1.00 0.00 N ATOM 2127 CA ILE B 13 -6.641 -11.650 -20.807 1.00 0.00 C ATOM 2128 C ILE B 13 -5.624 -12.785 -20.735 1.00 0.00 C ATOM 2129 O ILE B 13 -4.722 -12.771 -19.898 1.00 0.00 O ATOM 2130 CB ILE B 13 -5.963 -10.388 -21.345 1.00 0.00 C ATOM 2131 CG1 ILE B 13 -6.737 -9.155 -20.873 1.00 0.00 C ATOM 2132 CG2 ILE B 13 -5.949 -10.427 -22.874 1.00 0.00 C ATOM 2133 CD1 ILE B 13 -6.234 -7.918 -21.620 1.00 0.00 C ATOM 0 H ILE B 13 -6.659 -10.764 -18.903 1.00 0.00 H new ATOM 0 HA ILE B 13 -7.448 -11.943 -21.479 1.00 0.00 H new ATOM 0 HB ILE B 13 -4.939 -10.339 -20.975 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -7.803 -9.292 -21.052 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -6.608 -9.021 -19.799 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.466 -9.528 -23.256 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.399 -11.306 -23.211 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -6.972 -10.475 -23.246 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -6.786 -7.040 -21.283 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -5.172 -7.778 -21.419 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -6.386 -8.053 -22.691 1.00 0.00 H new ATOM 2145 N THR B 14 -5.776 -13.766 -21.620 1.00 0.00 N ATOM 2146 CA THR B 14 -4.865 -14.905 -21.652 1.00 0.00 C ATOM 2147 C THR B 14 -3.891 -14.775 -22.819 1.00 0.00 C ATOM 2148 O THR B 14 -4.304 -14.630 -23.969 1.00 0.00 O ATOM 2149 CB THR B 14 -5.659 -16.205 -21.789 1.00 0.00 C ATOM 2150 OG1 THR B 14 -6.756 -16.185 -20.886 1.00 0.00 O ATOM 2151 CG2 THR B 14 -4.754 -17.395 -21.468 1.00 0.00 C ATOM 0 H THR B 14 -6.517 -13.795 -22.320 1.00 0.00 H new ATOM 0 HA THR B 14 -4.300 -14.923 -20.720 1.00 0.00 H new ATOM 0 HB THR B 14 -6.029 -16.299 -22.810 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.427 -16.290 -19.969 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.321 -18.320 -21.566 1.00 0.00 H new ATOM 0 HG22 THR B 14 -3.913 -17.410 -22.161 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.382 -17.304 -20.448 1.00 0.00 H new ATOM 2159 N LEU B 15 -2.597 -14.824 -22.515 1.00 0.00 N ATOM 2160 CA LEU B 15 -1.576 -14.706 -23.551 1.00 0.00 C ATOM 2161 C LEU B 15 -0.531 -15.808 -23.408 1.00 0.00 C ATOM 2162 O LEU B 15 -0.145 -16.170 -22.297 1.00 0.00 O ATOM 2163 CB LEU B 15 -0.892 -13.340 -23.458 1.00 0.00 C ATOM 2164 CG LEU B 15 -1.942 -12.232 -23.560 1.00 0.00 C ATOM 2165 CD1 LEU B 15 -1.318 -10.898 -23.147 1.00 0.00 C ATOM 2166 CD2 LEU B 15 -2.443 -12.132 -25.004 1.00 0.00 C ATOM 0 H LEU B 15 -2.233 -14.943 -21.570 1.00 0.00 H new ATOM 0 HA LEU B 15 -2.062 -14.806 -24.522 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -0.351 -13.256 -22.515 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -0.158 -13.234 -24.257 1.00 0.00 H new ATOM 0 HG LEU B 15 -2.778 -12.464 -22.900 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -2.066 -10.108 -23.220 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.961 -10.966 -22.119 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.482 -10.668 -23.807 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -3.191 -11.342 -25.076 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -1.607 -11.901 -25.664 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -2.888 -13.082 -25.301 1.00 0.00 H new ATOM 2178 N GLU B 16 -0.075 -16.333 -24.541 1.00 0.00 N ATOM 2179 CA GLU B 16 0.930 -17.390 -24.533 1.00 0.00 C ATOM 2180 C GLU B 16 2.330 -16.791 -24.611 1.00 0.00 C ATOM 2181 O GLU B 16 2.723 -16.240 -25.640 1.00 0.00 O ATOM 2182 CB GLU B 16 0.708 -18.331 -25.719 1.00 0.00 C ATOM 2183 CG GLU B 16 -0.670 -18.987 -25.599 1.00 0.00 C ATOM 2184 CD GLU B 16 -1.031 -19.681 -26.907 1.00 0.00 C ATOM 2185 OE1 GLU B 16 -0.252 -20.508 -27.352 1.00 0.00 O ATOM 2186 OE2 GLU B 16 -2.083 -19.377 -27.446 1.00 0.00 O1- ATOM 0 H GLU B 16 -0.383 -16.046 -25.470 1.00 0.00 H new ATOM 0 HA GLU B 16 0.836 -17.952 -23.604 1.00 0.00 H new ATOM 0 HB2 GLU B 16 0.778 -17.777 -26.655 1.00 0.00 H new ATOM 0 HB3 GLU B 16 1.485 -19.095 -25.742 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -0.668 -19.709 -24.783 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -1.421 -18.234 -25.357 1.00 0.00 H new ATOM 2193 N VAL B 17 3.077 -16.898 -23.517 1.00 0.00 N ATOM 2194 CA VAL B 17 4.432 -16.358 -23.472 1.00 0.00 C ATOM 2195 C VAL B 17 5.426 -17.429 -23.037 1.00 0.00 C ATOM 2196 O VAL B 17 5.069 -18.597 -22.882 1.00 0.00 O ATOM 2197 CB VAL B 17 4.489 -15.184 -22.494 1.00 0.00 C ATOM 2198 CG1 VAL B 17 3.385 -14.181 -22.836 1.00 0.00 C ATOM 2199 CG2 VAL B 17 4.285 -15.700 -21.067 1.00 0.00 C ATOM 0 H VAL B 17 2.771 -17.350 -22.656 1.00 0.00 H new ATOM 0 HA VAL B 17 4.700 -16.017 -24.472 1.00 0.00 H new ATOM 0 HB VAL B 17 5.460 -14.695 -22.569 1.00 0.00 H new ATOM 0 HG11 VAL B 17 3.425 -13.344 -22.139 1.00 0.00 H new ATOM 0 HG12 VAL B 17 3.529 -13.814 -23.852 1.00 0.00 H new ATOM 0 HG13 VAL B 17 2.414 -14.669 -22.761 1.00 0.00 H new ATOM 0 HG21 VAL B 17 4.325 -14.864 -20.369 1.00 0.00 H new ATOM 0 HG22 VAL B 17 3.314 -16.189 -20.992 1.00 0.00 H new ATOM 0 HG23 VAL B 17 5.071 -16.415 -20.823 1.00 0.00 H new ATOM 2209 N GLU B 18 6.676 -17.020 -22.840 1.00 0.00 N ATOM 2210 CA GLU B 18 7.720 -17.948 -22.421 1.00 0.00 C ATOM 2211 C GLU B 18 8.415 -17.427 -21.164 1.00 0.00 C ATOM 2212 O GLU B 18 8.162 -16.305 -20.726 1.00 0.00 O ATOM 2213 CB GLU B 18 8.744 -18.122 -23.546 1.00 0.00 C ATOM 2214 CG GLU B 18 8.047 -17.968 -24.899 1.00 0.00 C ATOM 2215 CD GLU B 18 9.021 -18.288 -26.028 1.00 0.00 C ATOM 2216 OE1 GLU B 18 10.174 -17.904 -25.914 1.00 0.00 O ATOM 2217 OE2 GLU B 18 8.601 -18.911 -26.988 1.00 0.00 O1- ATOM 0 H GLU B 18 6.989 -16.057 -22.963 1.00 0.00 H new ATOM 0 HA GLU B 18 7.264 -18.913 -22.198 1.00 0.00 H new ATOM 0 HB2 GLU B 18 9.538 -17.381 -23.447 1.00 0.00 H new ATOM 0 HB3 GLU B 18 9.213 -19.103 -23.476 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.186 -18.634 -24.951 1.00 0.00 H new ATOM 0 HG3 GLU B 18 7.671 -16.951 -25.010 1.00 0.00 H new ATOM 2224 N PRO B 19 9.277 -18.217 -20.581 1.00 0.00 N ATOM 2225 CA PRO B 19 10.020 -17.833 -19.349 1.00 0.00 C ATOM 2226 C PRO B 19 11.149 -16.846 -19.641 1.00 0.00 C ATOM 2227 O PRO B 19 11.652 -16.181 -18.736 1.00 0.00 O ATOM 2228 CB PRO B 19 10.578 -19.160 -18.807 1.00 0.00 C ATOM 2229 CG PRO B 19 10.126 -20.240 -19.747 1.00 0.00 C ATOM 2230 CD PRO B 19 9.642 -19.561 -21.026 1.00 0.00 C ATOM 0 HA PRO B 19 9.373 -17.324 -18.634 1.00 0.00 H new ATOM 0 HB2 PRO B 19 11.666 -19.127 -18.751 1.00 0.00 H new ATOM 0 HB3 PRO B 19 10.213 -19.349 -17.798 1.00 0.00 H new ATOM 0 HG2 PRO B 19 10.944 -20.927 -19.963 1.00 0.00 H new ATOM 0 HG3 PRO B 19 9.326 -20.828 -19.299 1.00 0.00 H new ATOM 0 HD2 PRO B 19 10.423 -19.534 -21.786 1.00 0.00 H new ATOM 0 HD3 PRO B 19 8.791 -20.085 -21.461 1.00 0.00 H new ATOM 2238 N SER B 20 11.542 -16.757 -20.907 1.00 0.00 N ATOM 2239 CA SER B 20 12.612 -15.847 -21.301 1.00 0.00 C ATOM 2240 C SER B 20 12.036 -14.547 -21.854 1.00 0.00 C ATOM 2241 O SER B 20 12.758 -13.568 -22.040 1.00 0.00 O ATOM 2242 CB SER B 20 13.496 -16.505 -22.360 1.00 0.00 C ATOM 2243 OG SER B 20 14.717 -15.785 -22.465 1.00 0.00 O ATOM 0 H SER B 20 11.140 -17.299 -21.672 1.00 0.00 H new ATOM 0 HA SER B 20 13.210 -15.620 -20.419 1.00 0.00 H new ATOM 0 HB2 SER B 20 13.694 -17.543 -22.091 1.00 0.00 H new ATOM 0 HB3 SER B 20 12.984 -16.517 -23.322 1.00 0.00 H new ATOM 0 HG SER B 20 14.535 -14.823 -22.418 1.00 0.00 H new ATOM 2249 N ASP B 21 10.733 -14.543 -22.115 1.00 0.00 N ATOM 2250 CA ASP B 21 10.076 -13.355 -22.646 1.00 0.00 C ATOM 2251 C ASP B 21 10.321 -12.157 -21.736 1.00 0.00 C ATOM 2252 O ASP B 21 10.251 -12.270 -20.511 1.00 0.00 O ATOM 2253 CB ASP B 21 8.571 -13.599 -22.776 1.00 0.00 C ATOM 2254 CG ASP B 21 8.305 -14.658 -23.840 1.00 0.00 C ATOM 2255 OD1 ASP B 21 9.264 -15.224 -24.338 1.00 0.00 O ATOM 2256 OD2 ASP B 21 7.145 -14.887 -24.142 1.00 0.00 O1- ATOM 0 H ASP B 21 10.116 -15.342 -21.969 1.00 0.00 H new ATOM 0 HA ASP B 21 10.494 -13.143 -23.630 1.00 0.00 H new ATOM 0 HB2 ASP B 21 8.163 -13.923 -21.819 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.065 -12.670 -23.041 1.00 0.00 H new ATOM 2261 N THR B 22 10.612 -11.011 -22.342 1.00 0.00 N ATOM 2262 CA THR B 22 10.869 -9.796 -21.578 1.00 0.00 C ATOM 2263 C THR B 22 9.567 -9.063 -21.275 1.00 0.00 C ATOM 2264 O THR B 22 8.680 -8.971 -22.126 1.00 0.00 O ATOM 2265 CB THR B 22 11.805 -8.873 -22.362 1.00 0.00 C ATOM 2266 OG1 THR B 22 11.061 -8.183 -23.357 1.00 0.00 O ATOM 2267 CG2 THR B 22 12.905 -9.702 -23.027 1.00 0.00 C ATOM 0 H THR B 22 10.676 -10.898 -23.354 1.00 0.00 H new ATOM 0 HA THR B 22 11.340 -10.078 -20.636 1.00 0.00 H new ATOM 0 HB THR B 22 12.259 -8.153 -21.682 1.00 0.00 H new ATOM 0 HG1 THR B 22 11.658 -7.590 -23.859 1.00 0.00 H new ATOM 0 HG21 THR B 22 13.570 -9.043 -23.585 1.00 0.00 H new ATOM 0 HG22 THR B 22 13.475 -10.231 -22.263 1.00 0.00 H new ATOM 0 HG23 THR B 22 12.455 -10.424 -23.708 1.00 0.00 H new ATOM 2275 N ILE B 23 9.460 -8.539 -20.058 1.00 0.00 N ATOM 2276 CA ILE B 23 8.263 -7.811 -19.654 1.00 0.00 C ATOM 2277 C ILE B 23 7.846 -6.833 -20.748 1.00 0.00 C ATOM 2278 O ILE B 23 6.687 -6.811 -21.166 1.00 0.00 O ATOM 2279 CB ILE B 23 8.532 -7.046 -18.357 1.00 0.00 C ATOM 2280 CG1 ILE B 23 9.089 -8.007 -17.301 1.00 0.00 C ATOM 2281 CG2 ILE B 23 7.230 -6.425 -17.845 1.00 0.00 C ATOM 2282 CD1 ILE B 23 8.169 -9.223 -17.171 1.00 0.00 C ATOM 0 H ILE B 23 10.181 -8.604 -19.340 1.00 0.00 H new ATOM 0 HA ILE B 23 7.457 -8.526 -19.491 1.00 0.00 H new ATOM 0 HB ILE B 23 9.258 -6.256 -18.549 1.00 0.00 H new ATOM 0 HG12 ILE B 23 10.093 -8.327 -17.580 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.172 -7.498 -16.341 1.00 0.00 H new ATOM 0 HG21 ILE B 23 7.425 -5.881 -16.921 1.00 0.00 H new ATOM 0 HG22 ILE B 23 6.835 -5.739 -18.594 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.501 -7.213 -17.655 1.00 0.00 H new ATOM 0 HD11 ILE B 23 8.569 -9.903 -16.419 1.00 0.00 H new ATOM 0 HD12 ILE B 23 7.174 -8.896 -16.871 1.00 0.00 H new ATOM 0 HD13 ILE B 23 8.108 -9.737 -18.130 1.00 0.00 H new ATOM 2294 N GLU B 24 8.798 -6.030 -21.211 1.00 0.00 N ATOM 2295 CA GLU B 24 8.517 -5.058 -22.261 1.00 0.00 C ATOM 2296 C GLU B 24 7.769 -5.726 -23.409 1.00 0.00 C ATOM 2297 O GLU B 24 6.833 -5.156 -23.969 1.00 0.00 O ATOM 2298 CB GLU B 24 9.824 -4.455 -22.779 1.00 0.00 C ATOM 2299 CG GLU B 24 9.530 -3.550 -23.978 1.00 0.00 C ATOM 2300 CD GLU B 24 10.760 -2.715 -24.316 1.00 0.00 C ATOM 2301 OE1 GLU B 24 11.370 -2.196 -23.396 1.00 0.00 O ATOM 2302 OE2 GLU B 24 11.073 -2.605 -25.490 1.00 0.00 O1- ATOM 0 H GLU B 24 9.763 -6.032 -20.879 1.00 0.00 H new ATOM 0 HA GLU B 24 7.896 -4.264 -21.846 1.00 0.00 H new ATOM 0 HB2 GLU B 24 10.311 -3.883 -21.989 1.00 0.00 H new ATOM 0 HB3 GLU B 24 10.513 -5.248 -23.069 1.00 0.00 H new ATOM 0 HG2 GLU B 24 9.243 -4.154 -24.838 1.00 0.00 H new ATOM 0 HG3 GLU B 24 8.687 -2.896 -23.753 1.00 0.00 H new ATOM 2309 N ASN B 25 8.186 -6.942 -23.750 1.00 0.00 N ATOM 2310 CA ASN B 25 7.545 -7.684 -24.828 1.00 0.00 C ATOM 2311 C ASN B 25 6.086 -7.956 -24.485 1.00 0.00 C ATOM 2312 O ASN B 25 5.197 -7.770 -25.316 1.00 0.00 O ATOM 2313 CB ASN B 25 8.275 -9.009 -25.059 1.00 0.00 C ATOM 2314 CG ASN B 25 7.872 -9.598 -26.407 1.00 0.00 C ATOM 2315 OD1 ASN B 25 6.661 -9.412 -26.854 1.00 0.00 O flip ATOM 2316 ND2 ASN B 25 8.683 -10.245 -27.069 1.00 0.00 N flip ATOM 0 H ASN B 25 8.959 -7.431 -23.299 1.00 0.00 H new ATOM 0 HA ASN B 25 7.591 -7.086 -25.738 1.00 0.00 H new ATOM 0 HB2 ASN B 25 9.353 -8.850 -25.030 1.00 0.00 H new ATOM 0 HB3 ASN B 25 8.035 -9.710 -24.260 1.00 0.00 H new ATOM 0 HD21 ASN B 25 9.629 -10.389 -26.717 1.00 0.00 H new ATOM 0 HD22 ASN B 25 8.409 -10.637 -27.970 1.00 0.00 H new ATOM 2323 N VAL B 26 5.846 -8.394 -23.253 1.00 0.00 N ATOM 2324 CA VAL B 26 4.488 -8.684 -22.809 1.00 0.00 C ATOM 2325 C VAL B 26 3.607 -7.448 -22.964 1.00 0.00 C ATOM 2326 O VAL B 26 2.540 -7.505 -23.578 1.00 0.00 O ATOM 2327 CB VAL B 26 4.499 -9.127 -21.345 1.00 0.00 C ATOM 2328 CG1 VAL B 26 3.061 -9.324 -20.860 1.00 0.00 C ATOM 2329 CG2 VAL B 26 5.263 -10.447 -21.220 1.00 0.00 C ATOM 0 H VAL B 26 6.567 -8.555 -22.550 1.00 0.00 H new ATOM 0 HA VAL B 26 4.084 -9.488 -23.425 1.00 0.00 H new ATOM 0 HB VAL B 26 4.986 -8.364 -20.738 1.00 0.00 H new ATOM 0 HG11 VAL B 26 3.069 -9.640 -19.817 1.00 0.00 H new ATOM 0 HG12 VAL B 26 2.515 -8.385 -20.951 1.00 0.00 H new ATOM 0 HG13 VAL B 26 2.574 -10.088 -21.466 1.00 0.00 H new ATOM 0 HG21 VAL B 26 5.272 -10.765 -20.177 1.00 0.00 H new ATOM 0 HG22 VAL B 26 4.775 -11.209 -21.827 1.00 0.00 H new ATOM 0 HG23 VAL B 26 6.287 -10.309 -21.566 1.00 0.00 H new ATOM 2339 N LYS B 27 4.063 -6.330 -22.407 1.00 0.00 N ATOM 2340 CA LYS B 27 3.310 -5.085 -22.495 1.00 0.00 C ATOM 2341 C LYS B 27 2.938 -4.797 -23.945 1.00 0.00 C ATOM 2342 O LYS B 27 1.839 -4.323 -24.233 1.00 0.00 O ATOM 2343 CB LYS B 27 4.143 -3.929 -21.939 1.00 0.00 C ATOM 2344 CG LYS B 27 4.428 -4.170 -20.455 1.00 0.00 C ATOM 2345 CD LYS B 27 5.092 -2.930 -19.854 1.00 0.00 C ATOM 2346 CE LYS B 27 5.742 -3.295 -18.517 1.00 0.00 C ATOM 2347 NZ LYS B 27 5.891 -2.067 -17.686 1.00 0.00 N1+ ATOM 0 H LYS B 27 4.942 -6.261 -21.895 1.00 0.00 H new ATOM 0 HA LYS B 27 2.398 -5.186 -21.907 1.00 0.00 H new ATOM 0 HB2 LYS B 27 5.079 -3.844 -22.490 1.00 0.00 H new ATOM 0 HB3 LYS B 27 3.610 -2.987 -22.069 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.500 -4.391 -19.927 1.00 0.00 H new ATOM 0 HG3 LYS B 27 5.077 -5.037 -20.335 1.00 0.00 H new ATOM 0 HD2 LYS B 27 5.843 -2.538 -20.540 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.352 -2.143 -19.708 1.00 0.00 H new ATOM 0 HE2 LYS B 27 5.132 -4.030 -17.992 1.00 0.00 H new ATOM 0 HE3 LYS B 27 6.717 -3.753 -18.687 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 6.333 -2.314 -16.777 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 6.490 -1.380 -18.186 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.955 -1.649 -17.513 1.00 0.00 H new ATOM 2361 N ALA B 28 3.862 -5.091 -24.854 1.00 0.00 N ATOM 2362 CA ALA B 28 3.622 -4.865 -26.274 1.00 0.00 C ATOM 2363 C ALA B 28 2.434 -5.696 -26.748 1.00 0.00 C ATOM 2364 O ALA B 28 1.578 -5.210 -27.488 1.00 0.00 O ATOM 2365 CB ALA B 28 4.867 -5.240 -27.081 1.00 0.00 C ATOM 0 H ALA B 28 4.778 -5.484 -24.635 1.00 0.00 H new ATOM 0 HA ALA B 28 3.399 -3.809 -26.426 1.00 0.00 H new ATOM 0 HB1 ALA B 28 4.679 -5.068 -28.141 1.00 0.00 H new ATOM 0 HB2 ALA B 28 5.708 -4.627 -26.758 1.00 0.00 H new ATOM 0 HB3 ALA B 28 5.102 -6.292 -26.920 1.00 0.00 H new ATOM 2371 N LYS B 29 2.388 -6.951 -26.313 1.00 0.00 N ATOM 2372 CA LYS B 29 1.300 -7.842 -26.695 1.00 0.00 C ATOM 2373 C LYS B 29 -0.033 -7.301 -26.191 1.00 0.00 C ATOM 2374 O LYS B 29 -1.053 -7.402 -26.873 1.00 0.00 O ATOM 2375 CB LYS B 29 1.539 -9.238 -26.116 1.00 0.00 C ATOM 2376 CG LYS B 29 2.746 -9.877 -26.804 1.00 0.00 C ATOM 2377 CD LYS B 29 2.898 -11.324 -26.331 1.00 0.00 C ATOM 2378 CE LYS B 29 4.168 -11.928 -26.932 1.00 0.00 C ATOM 2379 NZ LYS B 29 5.356 -11.436 -26.179 1.00 0.00 N1+ ATOM 0 H LYS B 29 3.087 -7.371 -25.700 1.00 0.00 H new ATOM 0 HA LYS B 29 1.268 -7.902 -27.783 1.00 0.00 H new ATOM 0 HB2 LYS B 29 1.712 -9.173 -25.042 1.00 0.00 H new ATOM 0 HB3 LYS B 29 0.655 -9.859 -26.259 1.00 0.00 H new ATOM 0 HG2 LYS B 29 2.618 -9.849 -27.886 1.00 0.00 H new ATOM 0 HG3 LYS B 29 3.649 -9.312 -26.575 1.00 0.00 H new ATOM 0 HD2 LYS B 29 2.946 -11.359 -25.243 1.00 0.00 H new ATOM 0 HD3 LYS B 29 2.028 -11.909 -26.630 1.00 0.00 H new ATOM 0 HE2 LYS B 29 4.122 -13.016 -26.889 1.00 0.00 H new ATOM 0 HE3 LYS B 29 4.251 -11.654 -27.984 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 6.140 -12.111 -26.288 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 5.644 -10.509 -26.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 5.115 -11.345 -25.171 1.00 0.00 H new ATOM 2393 N ILE B 30 -0.017 -6.724 -24.993 1.00 0.00 N ATOM 2394 CA ILE B 30 -1.233 -6.168 -24.410 1.00 0.00 C ATOM 2395 C ILE B 30 -1.709 -4.963 -25.216 1.00 0.00 C ATOM 2396 O ILE B 30 -2.910 -4.753 -25.386 1.00 0.00 O ATOM 2397 CB ILE B 30 -0.975 -5.750 -22.961 1.00 0.00 C ATOM 2398 CG1 ILE B 30 -0.559 -6.979 -22.147 1.00 0.00 C ATOM 2399 CG2 ILE B 30 -2.251 -5.150 -22.365 1.00 0.00 C ATOM 2400 CD1 ILE B 30 -0.676 -6.671 -20.653 1.00 0.00 C ATOM 0 H ILE B 30 0.816 -6.630 -24.412 1.00 0.00 H new ATOM 0 HA ILE B 30 -2.008 -6.934 -24.432 1.00 0.00 H new ATOM 0 HB ILE B 30 -0.179 -5.006 -22.932 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -1.192 -7.829 -22.404 1.00 0.00 H new ATOM 0 HG13 ILE B 30 0.466 -7.259 -22.391 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.066 -4.853 -21.333 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.549 -4.277 -22.946 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.049 -5.892 -22.391 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -0.379 -7.547 -20.077 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -0.025 -5.834 -20.402 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -1.708 -6.412 -20.415 1.00 0.00 H new ATOM 2412 N GLN B 31 -0.759 -4.176 -25.711 1.00 0.00 N ATOM 2413 CA GLN B 31 -1.094 -2.995 -26.499 1.00 0.00 C ATOM 2414 C GLN B 31 -1.737 -3.401 -27.821 1.00 0.00 C ATOM 2415 O GLN B 31 -2.621 -2.712 -28.330 1.00 0.00 O ATOM 2416 CB GLN B 31 0.168 -2.172 -26.771 1.00 0.00 C ATOM 2417 CG GLN B 31 -0.138 -1.093 -27.813 1.00 0.00 C ATOM 2418 CD GLN B 31 1.040 -0.132 -27.930 1.00 0.00 C ATOM 2419 OE1 GLN B 31 2.191 -0.539 -27.780 1.00 0.00 O ATOM 2420 NE2 GLN B 31 0.819 1.127 -28.193 1.00 0.00 N ATOM 0 H GLN B 31 0.241 -4.332 -25.582 1.00 0.00 H new ATOM 0 HA GLN B 31 -1.803 -2.391 -25.933 1.00 0.00 H new ATOM 0 HB2 GLN B 31 0.520 -1.711 -25.848 1.00 0.00 H new ATOM 0 HB3 GLN B 31 0.968 -2.821 -27.128 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -0.338 -1.556 -28.780 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -1.037 -0.546 -27.529 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -0.136 1.462 -28.317 1.00 0.00 H new ATOM 0 HE22 GLN B 31 1.602 1.776 -28.275 1.00 0.00 H new ATOM 2429 N ASP B 32 -1.286 -4.522 -28.373 1.00 0.00 N ATOM 2430 CA ASP B 32 -1.825 -5.010 -29.638 1.00 0.00 C ATOM 2431 C ASP B 32 -3.230 -5.570 -29.442 1.00 0.00 C ATOM 2432 O ASP B 32 -4.037 -5.587 -30.371 1.00 0.00 O ATOM 2433 CB ASP B 32 -0.915 -6.099 -30.208 1.00 0.00 C ATOM 2434 CG ASP B 32 -1.358 -6.461 -31.622 1.00 0.00 C ATOM 2435 OD1 ASP B 32 -2.503 -6.849 -31.781 1.00 0.00 O ATOM 2436 OD2 ASP B 32 -0.545 -6.345 -32.524 1.00 0.00 O1- ATOM 0 H ASP B 32 -0.554 -5.106 -27.969 1.00 0.00 H new ATOM 0 HA ASP B 32 -1.873 -4.175 -30.337 1.00 0.00 H new ATOM 0 HB2 ASP B 32 0.118 -5.752 -30.219 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -0.948 -6.982 -29.570 1.00 0.00 H new ATOM 2441 N LYS B 33 -3.516 -6.027 -28.227 1.00 0.00 N ATOM 2442 CA LYS B 33 -4.827 -6.586 -27.920 1.00 0.00 C ATOM 2443 C LYS B 33 -5.815 -5.477 -27.571 1.00 0.00 C ATOM 2444 O LYS B 33 -6.799 -5.264 -28.279 1.00 0.00 O ATOM 2445 CB LYS B 33 -4.717 -7.563 -26.747 1.00 0.00 C ATOM 2446 CG LYS B 33 -4.153 -8.898 -27.242 1.00 0.00 C ATOM 2447 CD LYS B 33 -5.302 -9.803 -27.694 1.00 0.00 C ATOM 2448 CE LYS B 33 -4.742 -11.155 -28.140 1.00 0.00 C ATOM 2449 NZ LYS B 33 -5.860 -12.030 -28.595 1.00 0.00 N1+ ATOM 0 H LYS B 33 -2.862 -6.021 -27.444 1.00 0.00 H new ATOM 0 HA LYS B 33 -5.190 -7.116 -28.801 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -4.070 -7.148 -25.974 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -5.697 -7.716 -26.295 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -3.463 -8.729 -28.068 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.586 -9.382 -26.447 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.011 -9.943 -26.878 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -5.847 -9.335 -28.514 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -4.024 -11.015 -28.948 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.207 -11.629 -27.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -5.480 -12.949 -28.898 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.529 -12.173 -27.812 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -6.352 -11.579 -29.392 1.00 0.00 H new ATOM 2463 N GLU B 34 -5.545 -4.775 -26.475 1.00 0.00 N ATOM 2464 CA GLU B 34 -6.418 -3.690 -26.041 1.00 0.00 C ATOM 2465 C GLU B 34 -6.108 -2.412 -26.813 1.00 0.00 C ATOM 2466 O GLU B 34 -6.409 -2.304 -28.002 1.00 0.00 O ATOM 2467 CB GLU B 34 -6.236 -3.441 -24.543 1.00 0.00 C ATOM 2468 CG GLU B 34 -6.636 -4.696 -23.764 1.00 0.00 C ATOM 2469 CD GLU B 34 -8.155 -4.814 -23.710 1.00 0.00 C ATOM 2470 OE1 GLU B 34 -8.752 -4.154 -22.876 1.00 0.00 O ATOM 2471 OE2 GLU B 34 -8.700 -5.564 -24.504 1.00 0.00 O1- ATOM 0 H GLU B 34 -4.736 -4.936 -25.875 1.00 0.00 H new ATOM 0 HA GLU B 34 -7.451 -3.978 -26.238 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.199 -3.183 -24.330 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -6.846 -2.595 -24.228 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -6.211 -5.580 -24.239 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -6.230 -4.651 -22.753 1.00 0.00 H new ATOM 2478 N GLY B 35 -5.504 -1.446 -26.128 1.00 0.00 N ATOM 2479 CA GLY B 35 -5.157 -0.178 -26.759 1.00 0.00 C ATOM 2480 C GLY B 35 -4.336 0.692 -25.813 1.00 0.00 C ATOM 2481 O GLY B 35 -4.136 1.881 -26.064 1.00 0.00 O ATOM 0 H GLY B 35 -5.246 -1.516 -25.144 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -4.591 -0.364 -27.672 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -6.066 0.350 -27.049 1.00 0.00 H new ATOM 2485 N ILE B 36 -3.864 0.092 -24.726 1.00 0.00 N ATOM 2486 CA ILE B 36 -3.066 0.821 -23.747 1.00 0.00 C ATOM 2487 C ILE B 36 -1.588 0.790 -24.131 1.00 0.00 C ATOM 2488 O ILE B 36 -1.016 -0.280 -24.339 1.00 0.00 O ATOM 2489 CB ILE B 36 -3.245 0.198 -22.362 1.00 0.00 C ATOM 2490 CG1 ILE B 36 -4.724 0.241 -21.972 1.00 0.00 C ATOM 2491 CG2 ILE B 36 -2.426 0.985 -21.338 1.00 0.00 C ATOM 2492 CD1 ILE B 36 -4.947 -0.609 -20.719 1.00 0.00 C ATOM 0 H ILE B 36 -4.019 -0.891 -24.501 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.405 1.857 -23.728 1.00 0.00 H new ATOM 0 HB ILE B 36 -2.903 -0.837 -22.382 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -5.032 1.270 -21.786 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -5.338 -0.132 -22.792 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.554 0.541 -20.351 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.372 0.956 -21.615 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.767 2.020 -21.317 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -6.001 -0.578 -20.441 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -4.655 -1.639 -20.922 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -4.344 -0.215 -19.900 1.00 0.00 H new ATOM 2504 N PRO B 37 -0.966 1.936 -24.224 1.00 0.00 N ATOM 2505 CA PRO B 37 0.473 2.039 -24.588 1.00 0.00 C ATOM 2506 C PRO B 37 1.385 1.587 -23.447 1.00 0.00 C ATOM 2507 O PRO B 37 1.067 1.776 -22.273 1.00 0.00 O ATOM 2508 CB PRO B 37 0.692 3.527 -24.905 1.00 0.00 C ATOM 2509 CG PRO B 37 -0.628 4.217 -24.720 1.00 0.00 C ATOM 2510 CD PRO B 37 -1.564 3.252 -23.994 1.00 0.00 C ATOM 0 HA PRO B 37 0.718 1.392 -25.430 1.00 0.00 H new ATOM 0 HB2 PRO B 37 1.446 3.955 -24.244 1.00 0.00 H new ATOM 0 HB3 PRO B 37 1.053 3.654 -25.925 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -0.502 5.133 -24.143 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -1.048 4.503 -25.684 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -1.626 3.481 -22.930 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -2.578 3.305 -24.391 1.00 0.00 H new ATOM 2518 N PRO B 38 2.503 0.995 -23.775 1.00 0.00 N ATOM 2519 CA PRO B 38 3.481 0.503 -22.767 1.00 0.00 C ATOM 2520 C PRO B 38 3.745 1.535 -21.673 1.00 0.00 C ATOM 2521 O PRO B 38 3.682 1.223 -20.484 1.00 0.00 O ATOM 2522 CB PRO B 38 4.761 0.223 -23.572 1.00 0.00 C ATOM 2523 CG PRO B 38 4.468 0.570 -25.002 1.00 0.00 C ATOM 2524 CD PRO B 38 2.955 0.730 -25.141 1.00 0.00 C ATOM 0 HA PRO B 38 3.108 -0.380 -22.248 1.00 0.00 H new ATOM 0 HB2 PRO B 38 5.592 0.819 -23.194 1.00 0.00 H new ATOM 0 HB3 PRO B 38 5.052 -0.824 -23.481 1.00 0.00 H new ATOM 0 HG2 PRO B 38 4.977 1.491 -25.284 1.00 0.00 H new ATOM 0 HG3 PRO B 38 4.833 -0.212 -25.668 1.00 0.00 H new ATOM 0 HD2 PRO B 38 2.700 1.550 -25.813 1.00 0.00 H new ATOM 0 HD3 PRO B 38 2.494 -0.170 -25.547 1.00 0.00 H new ATOM 2532 N ASP B 39 4.042 2.764 -22.084 1.00 0.00 N ATOM 2533 CA ASP B 39 4.314 3.833 -21.130 1.00 0.00 C ATOM 2534 C ASP B 39 3.077 4.133 -20.289 1.00 0.00 C ATOM 2535 O ASP B 39 2.945 5.221 -19.729 1.00 0.00 O ATOM 2536 CB ASP B 39 4.746 5.098 -21.874 1.00 0.00 C ATOM 2537 CG ASP B 39 5.750 4.744 -22.965 1.00 0.00 C ATOM 2538 OD1 ASP B 39 6.902 4.519 -22.633 1.00 0.00 O ATOM 2539 OD2 ASP B 39 5.352 4.703 -24.118 1.00 0.00 O1- ATOM 0 H ASP B 39 4.100 3.043 -23.063 1.00 0.00 H new ATOM 0 HA ASP B 39 5.117 3.507 -20.469 1.00 0.00 H new ATOM 0 HB2 ASP B 39 3.876 5.586 -22.313 1.00 0.00 H new ATOM 0 HB3 ASP B 39 5.190 5.807 -21.175 1.00 0.00 H new ATOM 2544 N GLN B 40 2.173 3.162 -20.207 1.00 0.00 N ATOM 2545 CA GLN B 40 0.950 3.334 -19.432 1.00 0.00 C ATOM 2546 C GLN B 40 0.451 1.987 -18.916 1.00 0.00 C ATOM 2547 O GLN B 40 -0.726 1.655 -19.056 1.00 0.00 O ATOM 2548 CB GLN B 40 -0.131 3.982 -20.301 1.00 0.00 C ATOM 2549 CG GLN B 40 0.122 5.487 -20.399 1.00 0.00 C ATOM 2550 CD GLN B 40 -1.051 6.168 -21.096 1.00 0.00 C ATOM 2551 OE1 GLN B 40 -2.265 5.749 -20.869 1.00 0.00 O flip ATOM 2552 NE2 GLN B 40 -0.856 7.107 -21.868 1.00 0.00 N flip ATOM 0 H GLN B 40 2.263 2.255 -20.664 1.00 0.00 H new ATOM 0 HA GLN B 40 1.167 3.979 -18.581 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.127 3.537 -21.296 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -1.116 3.796 -19.873 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.257 5.907 -19.402 1.00 0.00 H new ATOM 0 HG3 GLN B 40 1.043 5.674 -20.952 1.00 0.00 H new ATOM 0 HE21 GLN B 40 0.094 7.433 -22.044 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -1.645 7.559 -22.331 1.00 0.00 H new ATOM 2561 N GLN B 41 1.355 1.217 -18.318 1.00 0.00 N ATOM 2562 CA GLN B 41 0.996 -0.093 -17.784 1.00 0.00 C ATOM 2563 C GLN B 41 1.833 -0.416 -16.551 1.00 0.00 C ATOM 2564 O GLN B 41 2.988 -0.002 -16.447 1.00 0.00 O ATOM 2565 CB GLN B 41 1.215 -1.169 -18.849 1.00 0.00 C ATOM 2566 CG GLN B 41 0.421 -0.812 -20.107 1.00 0.00 C ATOM 2567 CD GLN B 41 0.393 -2.001 -21.061 1.00 0.00 C ATOM 2568 OE1 GLN B 41 0.416 -3.151 -20.622 1.00 0.00 O ATOM 2569 NE2 GLN B 41 0.343 -1.793 -22.348 1.00 0.00 N ATOM 0 H GLN B 41 2.334 1.474 -18.191 1.00 0.00 H new ATOM 0 HA GLN B 41 -0.056 -0.073 -17.500 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.276 -1.250 -19.087 1.00 0.00 H new ATOM 0 HB3 GLN B 41 0.898 -2.141 -18.470 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -0.596 -0.528 -19.837 1.00 0.00 H new ATOM 0 HG3 GLN B 41 0.872 0.049 -20.600 1.00 0.00 H new ATOM 0 HE21 GLN B 41 0.324 -0.840 -22.710 1.00 0.00 H new ATOM 0 HE22 GLN B 41 0.323 -2.584 -22.992 1.00 0.00 H new ATOM 2578 N ARG B 42 1.244 -1.160 -15.621 1.00 0.00 N ATOM 2579 CA ARG B 42 1.946 -1.534 -14.397 1.00 0.00 C ATOM 2580 C ARG B 42 1.589 -2.960 -13.991 1.00 0.00 C ATOM 2581 O ARG B 42 0.571 -3.194 -13.339 1.00 0.00 O ATOM 2582 CB ARG B 42 1.574 -0.571 -13.268 1.00 0.00 C ATOM 2583 CG ARG B 42 2.632 -0.643 -12.165 1.00 0.00 C ATOM 2584 CD ARG B 42 2.284 0.354 -11.058 1.00 0.00 C ATOM 2585 NE ARG B 42 3.080 0.083 -9.866 1.00 0.00 N ATOM 2586 CZ ARG B 42 2.895 0.773 -8.745 1.00 0.00 C ATOM 2587 NH1 ARG B 42 1.975 0.404 -7.896 1.00 0.00 N1+ ATOM 2588 NH2 ARG B 42 3.633 1.819 -8.493 1.00 0.00 N ATOM 0 H ARG B 42 0.290 -1.514 -15.689 1.00 0.00 H new ATOM 0 HA ARG B 42 3.019 -1.479 -14.583 1.00 0.00 H new ATOM 0 HB2 ARG B 42 1.503 0.446 -13.652 1.00 0.00 H new ATOM 0 HB3 ARG B 42 0.595 -0.828 -12.864 1.00 0.00 H new ATOM 0 HG2 ARG B 42 2.680 -1.653 -11.758 1.00 0.00 H new ATOM 0 HG3 ARG B 42 3.616 -0.418 -12.575 1.00 0.00 H new ATOM 0 HD2 ARG B 42 2.469 1.371 -11.404 1.00 0.00 H new ATOM 0 HD3 ARG B 42 1.223 0.286 -10.818 1.00 0.00 H new ATOM 0 HE ARG B 42 3.791 -0.648 -9.893 1.00 0.00 H new ATOM 0 HH11 ARG B 42 1.398 -0.414 -8.093 1.00 0.00 H new ATOM 0 HH12 ARG B 42 1.833 0.933 -7.036 1.00 0.00 H new ATOM 0 HH21 ARG B 42 4.352 2.108 -9.156 1.00 0.00 H new ATOM 0 HH22 ARG B 42 3.491 2.348 -7.633 1.00 0.00 H new ATOM 2602 N LEU B 43 2.434 -3.910 -14.379 1.00 0.00 N ATOM 2603 CA LEU B 43 2.197 -5.310 -14.048 1.00 0.00 C ATOM 2604 C LEU B 43 2.727 -5.628 -12.653 1.00 0.00 C ATOM 2605 O LEU B 43 3.886 -5.354 -12.342 1.00 0.00 O ATOM 2606 CB LEU B 43 2.883 -6.214 -15.075 1.00 0.00 C ATOM 2607 CG LEU B 43 2.805 -5.566 -16.459 1.00 0.00 C ATOM 2608 CD1 LEU B 43 3.327 -6.547 -17.511 1.00 0.00 C ATOM 2609 CD2 LEU B 43 1.351 -5.209 -16.774 1.00 0.00 C ATOM 0 H LEU B 43 3.282 -3.738 -14.919 1.00 0.00 H new ATOM 0 HA LEU B 43 1.122 -5.491 -14.066 1.00 0.00 H new ATOM 0 HB2 LEU B 43 3.924 -6.375 -14.795 1.00 0.00 H new ATOM 0 HB3 LEU B 43 2.403 -7.192 -15.092 1.00 0.00 H new ATOM 0 HG LEU B 43 3.413 -4.661 -16.471 1.00 0.00 H new ATOM 0 HD11 LEU B 43 3.272 -6.086 -18.497 1.00 0.00 H new ATOM 0 HD12 LEU B 43 4.363 -6.803 -17.288 1.00 0.00 H new ATOM 0 HD13 LEU B 43 2.719 -7.451 -17.499 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.295 -4.747 -17.760 1.00 0.00 H new ATOM 0 HD22 LEU B 43 0.743 -6.114 -16.762 1.00 0.00 H new ATOM 0 HD23 LEU B 43 0.977 -4.511 -16.025 1.00 0.00 H new ATOM 2621 N ILE B 44 1.869 -6.207 -11.818 1.00 0.00 N ATOM 2622 CA ILE B 44 2.261 -6.558 -10.457 1.00 0.00 C ATOM 2623 C ILE B 44 1.936 -8.020 -10.166 1.00 0.00 C ATOM 2624 O ILE B 44 0.943 -8.554 -10.658 1.00 0.00 O ATOM 2625 CB ILE B 44 1.531 -5.662 -9.456 1.00 0.00 C ATOM 2626 CG1 ILE B 44 1.617 -4.206 -9.920 1.00 0.00 C ATOM 2627 CG2 ILE B 44 2.183 -5.797 -8.079 1.00 0.00 C ATOM 2628 CD1 ILE B 44 1.027 -3.291 -8.844 1.00 0.00 C ATOM 0 H ILE B 44 0.906 -6.441 -12.057 1.00 0.00 H new ATOM 0 HA ILE B 44 3.337 -6.410 -10.359 1.00 0.00 H new ATOM 0 HB ILE B 44 0.485 -5.964 -9.393 1.00 0.00 H new ATOM 0 HG12 ILE B 44 2.655 -3.936 -10.113 1.00 0.00 H new ATOM 0 HG13 ILE B 44 1.075 -4.079 -10.857 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.662 -5.158 -7.366 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.123 -6.834 -7.748 1.00 0.00 H new ATOM 0 HG23 ILE B 44 3.229 -5.495 -8.140 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.088 -2.254 -9.175 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.016 -3.556 -8.673 1.00 0.00 H new ATOM 0 HD13 ILE B 44 1.588 -3.410 -7.917 1.00 0.00 H new ATOM 2640 N PHE B 45 2.781 -8.660 -9.364 1.00 0.00 N ATOM 2641 CA PHE B 45 2.574 -10.061 -9.014 1.00 0.00 C ATOM 2642 C PHE B 45 3.034 -10.329 -7.585 1.00 0.00 C ATOM 2643 O PHE B 45 4.097 -9.870 -7.168 1.00 0.00 O ATOM 2644 CB PHE B 45 3.348 -10.960 -9.979 1.00 0.00 C ATOM 2645 CG PHE B 45 3.009 -12.405 -9.703 1.00 0.00 C ATOM 2646 CD1 PHE B 45 1.782 -12.930 -10.127 1.00 0.00 C ATOM 2647 CD2 PHE B 45 3.921 -13.221 -9.023 1.00 0.00 C ATOM 2648 CE1 PHE B 45 1.468 -14.270 -9.871 1.00 0.00 C ATOM 2649 CE2 PHE B 45 3.607 -14.561 -8.767 1.00 0.00 C ATOM 2650 CZ PHE B 45 2.380 -15.085 -9.191 1.00 0.00 C ATOM 0 H PHE B 45 3.609 -8.235 -8.947 1.00 0.00 H new ATOM 0 HA PHE B 45 1.509 -10.282 -9.088 1.00 0.00 H new ATOM 0 HB2 PHE B 45 3.097 -10.707 -11.009 1.00 0.00 H new ATOM 0 HB3 PHE B 45 4.420 -10.798 -9.863 1.00 0.00 H new ATOM 0 HD1 PHE B 45 1.078 -12.301 -10.652 1.00 0.00 H new ATOM 0 HD2 PHE B 45 4.867 -12.816 -8.696 1.00 0.00 H new ATOM 0 HE1 PHE B 45 0.522 -14.675 -10.198 1.00 0.00 H new ATOM 0 HE2 PHE B 45 4.311 -15.190 -8.243 1.00 0.00 H new ATOM 0 HZ PHE B 45 2.137 -16.119 -8.993 1.00 0.00 H new ATOM 2660 N ALA B 46 2.226 -11.076 -6.839 1.00 0.00 N ATOM 2661 CA ALA B 46 2.561 -11.399 -5.457 1.00 0.00 C ATOM 2662 C ALA B 46 2.964 -10.140 -4.695 1.00 0.00 C ATOM 2663 O ALA B 46 3.734 -10.203 -3.737 1.00 0.00 O ATOM 2664 CB ALA B 46 3.708 -12.410 -5.420 1.00 0.00 C ATOM 0 H ALA B 46 1.342 -11.466 -7.165 1.00 0.00 H new ATOM 0 HA ALA B 46 1.681 -11.832 -4.981 1.00 0.00 H new ATOM 0 HB1 ALA B 46 3.952 -12.646 -4.384 1.00 0.00 H new ATOM 0 HB2 ALA B 46 3.407 -13.321 -5.938 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.583 -11.985 -5.911 1.00 0.00 H new ATOM 2670 N GLY B 47 2.440 -8.999 -5.129 1.00 0.00 N ATOM 2671 CA GLY B 47 2.752 -7.730 -4.481 1.00 0.00 C ATOM 2672 C GLY B 47 4.139 -7.241 -4.883 1.00 0.00 C ATOM 2673 O GLY B 47 4.877 -6.696 -4.062 1.00 0.00 O ATOM 0 H GLY B 47 1.802 -8.926 -5.921 1.00 0.00 H new ATOM 0 HA2 GLY B 47 2.006 -6.984 -4.754 1.00 0.00 H new ATOM 0 HA3 GLY B 47 2.703 -7.848 -3.399 1.00 0.00 H new ATOM 2677 N LYS B 48 4.488 -7.440 -6.150 1.00 0.00 N ATOM 2678 CA LYS B 48 5.790 -7.015 -6.651 1.00 0.00 C ATOM 2679 C LYS B 48 5.668 -6.476 -8.073 1.00 0.00 C ATOM 2680 O LYS B 48 5.268 -7.196 -8.988 1.00 0.00 O ATOM 2681 CB LYS B 48 6.766 -8.193 -6.632 1.00 0.00 C ATOM 2682 CG LYS B 48 7.085 -8.570 -5.183 1.00 0.00 C ATOM 2683 CD LYS B 48 8.052 -9.755 -5.165 1.00 0.00 C ATOM 2684 CE LYS B 48 8.668 -9.890 -3.771 1.00 0.00 C ATOM 2685 NZ LYS B 48 7.618 -10.000 -2.764 1.00 0.00 N1+ ATOM 0 H LYS B 48 3.892 -7.890 -6.845 1.00 0.00 H new ATOM 0 HA LYS B 48 6.165 -6.221 -6.005 1.00 0.00 H new ATOM 0 HB2 LYS B 48 6.333 -9.046 -7.154 1.00 0.00 H new ATOM 0 HB3 LYS B 48 7.682 -7.928 -7.160 1.00 0.00 H new ATOM 0 HG2 LYS B 48 7.526 -7.719 -4.663 1.00 0.00 H new ATOM 0 HG3 LYS B 48 6.168 -8.827 -4.653 1.00 0.00 H new ATOM 0 HD2 LYS B 48 7.526 -10.671 -5.432 1.00 0.00 H new ATOM 0 HD3 LYS B 48 8.836 -9.610 -5.908 1.00 0.00 H new ATOM 0 HE2 LYS B 48 9.311 -10.769 -3.733 1.00 0.00 H new ATOM 0 HE3 LYS B 48 9.297 -9.025 -3.558 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 7.372 -9.052 -2.414 1.00 0.00 H new ATOM 2697 N GLN B 49 6.015 -5.206 -8.251 1.00 0.00 N ATOM 2698 CA GLN B 49 5.941 -4.580 -9.566 1.00 0.00 C ATOM 2699 C GLN B 49 7.053 -5.102 -10.471 1.00 0.00 C ATOM 2700 O GLN B 49 8.202 -5.229 -10.047 1.00 0.00 O ATOM 2701 CB GLN B 49 6.061 -3.061 -9.430 1.00 0.00 C ATOM 2702 CG GLN B 49 5.678 -2.397 -10.754 1.00 0.00 C ATOM 2703 CD GLN B 49 5.842 -0.885 -10.645 1.00 0.00 C ATOM 2704 OE1 GLN B 49 5.891 -0.191 -11.660 1.00 0.00 O ATOM 2705 NE2 GLN B 49 5.929 -0.331 -9.467 1.00 0.00 N ATOM 0 H GLN B 49 6.348 -4.593 -7.507 1.00 0.00 H new ATOM 0 HA GLN B 49 4.978 -4.829 -10.012 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.411 -2.705 -8.631 1.00 0.00 H new ATOM 0 HB3 GLN B 49 7.081 -2.789 -9.157 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.305 -2.782 -11.558 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.647 -2.642 -11.008 1.00 0.00 H new ATOM 0 HE21 GLN B 49 5.888 -0.909 -8.627 1.00 0.00 H new ATOM 0 HE22 GLN B 49 6.038 0.680 -9.386 1.00 0.00 H new ATOM 2714 N LEU B 50 6.705 -5.402 -11.718 1.00 0.00 N ATOM 2715 CA LEU B 50 7.683 -5.910 -12.673 1.00 0.00 C ATOM 2716 C LEU B 50 8.298 -4.764 -13.471 1.00 0.00 C ATOM 2717 O LEU B 50 7.596 -3.852 -13.908 1.00 0.00 O ATOM 2718 CB LEU B 50 7.016 -6.900 -13.629 1.00 0.00 C ATOM 2719 CG LEU B 50 6.084 -7.823 -12.842 1.00 0.00 C ATOM 2720 CD1 LEU B 50 5.556 -8.923 -13.764 1.00 0.00 C ATOM 2721 CD2 LEU B 50 6.855 -8.458 -11.682 1.00 0.00 C ATOM 0 H LEU B 50 5.760 -5.303 -12.089 1.00 0.00 H new ATOM 0 HA LEU B 50 8.473 -6.417 -12.119 1.00 0.00 H new ATOM 0 HB2 LEU B 50 6.453 -6.362 -14.392 1.00 0.00 H new ATOM 0 HB3 LEU B 50 7.774 -7.487 -14.147 1.00 0.00 H new ATOM 0 HG LEU B 50 5.247 -7.245 -12.450 1.00 0.00 H new ATOM 0 HD11 LEU B 50 4.892 -9.580 -13.203 1.00 0.00 H new ATOM 0 HD12 LEU B 50 5.007 -8.472 -14.591 1.00 0.00 H new ATOM 0 HD13 LEU B 50 6.392 -9.501 -14.157 1.00 0.00 H new ATOM 0 HD21 LEU B 50 6.191 -9.116 -11.121 1.00 0.00 H new ATOM 0 HD22 LEU B 50 7.692 -9.036 -12.074 1.00 0.00 H new ATOM 0 HD23 LEU B 50 7.232 -7.675 -11.024 1.00 0.00 H new ATOM 2733 N GLU B 51 9.613 -4.820 -13.659 1.00 0.00 N ATOM 2734 CA GLU B 51 10.314 -3.782 -14.408 1.00 0.00 C ATOM 2735 C GLU B 51 10.641 -4.268 -15.816 1.00 0.00 C ATOM 2736 O GLU B 51 10.861 -5.459 -16.036 1.00 0.00 O ATOM 2737 CB GLU B 51 11.608 -3.400 -13.685 1.00 0.00 C ATOM 2738 CG GLU B 51 11.270 -2.749 -12.343 1.00 0.00 C ATOM 2739 CD GLU B 51 12.552 -2.349 -11.620 1.00 0.00 C ATOM 2740 OE1 GLU B 51 13.299 -3.238 -11.246 1.00 0.00 O ATOM 2741 OE2 GLU B 51 12.767 -1.160 -11.451 1.00 0.00 O1- ATOM 0 H GLU B 51 10.211 -5.567 -13.306 1.00 0.00 H new ATOM 0 HA GLU B 51 9.666 -2.909 -14.478 1.00 0.00 H new ATOM 0 HB2 GLU B 51 12.224 -4.285 -13.527 1.00 0.00 H new ATOM 0 HB3 GLU B 51 12.190 -2.712 -14.298 1.00 0.00 H new ATOM 0 HG2 GLU B 51 10.644 -1.871 -12.503 1.00 0.00 H new ATOM 0 HG3 GLU B 51 10.697 -3.442 -11.727 1.00 0.00 H new ATOM 2748 N ASP B 52 10.671 -3.339 -16.766 1.00 0.00 N ATOM 2749 CA ASP B 52 10.972 -3.687 -18.150 1.00 0.00 C ATOM 2750 C ASP B 52 12.297 -4.438 -18.237 1.00 0.00 C ATOM 2751 O ASP B 52 12.970 -4.647 -17.228 1.00 0.00 O ATOM 2752 CB ASP B 52 11.041 -2.420 -19.006 1.00 0.00 C ATOM 2753 CG ASP B 52 10.151 -1.336 -18.408 1.00 0.00 C ATOM 2754 OD1 ASP B 52 10.604 -0.659 -17.500 1.00 0.00 O ATOM 2755 OD2 ASP B 52 9.029 -1.199 -18.866 1.00 0.00 O1- ATOM 0 H ASP B 52 10.492 -2.348 -16.605 1.00 0.00 H new ATOM 0 HA ASP B 52 10.177 -4.332 -18.524 1.00 0.00 H new ATOM 0 HB2 ASP B 52 12.070 -2.066 -19.063 1.00 0.00 H new ATOM 0 HB3 ASP B 52 10.723 -2.642 -20.025 1.00 0.00 H new ATOM 2760 N GLY B 53 12.666 -4.840 -19.449 1.00 0.00 N ATOM 2761 CA GLY B 53 13.914 -5.567 -19.655 1.00 0.00 C ATOM 2762 C GLY B 53 13.839 -6.963 -19.046 1.00 0.00 C ATOM 2763 O GLY B 53 13.911 -7.965 -19.757 1.00 0.00 O ATOM 0 H GLY B 53 12.124 -4.677 -20.297 1.00 0.00 H new ATOM 0 HA2 GLY B 53 14.123 -5.642 -20.722 1.00 0.00 H new ATOM 0 HA3 GLY B 53 14.739 -5.014 -19.206 1.00 0.00 H new ATOM 2767 N ARG B 54 13.694 -7.021 -17.726 1.00 0.00 N ATOM 2768 CA ARG B 54 13.610 -8.300 -17.031 1.00 0.00 C ATOM 2769 C ARG B 54 12.735 -9.278 -17.810 1.00 0.00 C ATOM 2770 O ARG B 54 12.013 -8.884 -18.726 1.00 0.00 O ATOM 2771 CB ARG B 54 13.028 -8.095 -15.630 1.00 0.00 C ATOM 2772 CG ARG B 54 14.166 -7.914 -14.622 1.00 0.00 C ATOM 2773 CD ARG B 54 15.096 -6.794 -15.095 1.00 0.00 C ATOM 2774 NE ARG B 54 15.752 -6.168 -13.952 1.00 0.00 N ATOM 2775 CZ ARG B 54 16.160 -4.904 -14.002 1.00 0.00 C ATOM 2776 NH1 ARG B 54 15.449 -4.013 -14.638 1.00 0.00 N1+ ATOM 2777 NH2 ARG B 54 17.272 -4.554 -13.415 1.00 0.00 N ATOM 0 H ARG B 54 13.633 -6.203 -17.120 1.00 0.00 H new ATOM 0 HA ARG B 54 14.615 -8.715 -16.950 1.00 0.00 H new ATOM 0 HB2 ARG B 54 12.377 -7.221 -15.620 1.00 0.00 H new ATOM 0 HB3 ARG B 54 12.415 -8.952 -15.351 1.00 0.00 H new ATOM 0 HG2 ARG B 54 13.760 -7.673 -13.639 1.00 0.00 H new ATOM 0 HG3 ARG B 54 14.724 -8.844 -14.517 1.00 0.00 H new ATOM 0 HD2 ARG B 54 15.844 -7.197 -15.778 1.00 0.00 H new ATOM 0 HD3 ARG B 54 14.527 -6.049 -15.650 1.00 0.00 H new ATOM 0 HE ARG B 54 15.900 -6.709 -13.100 1.00 0.00 H new ATOM 0 HH11 ARG B 54 14.580 -4.287 -15.097 1.00 0.00 H new ATOM 0 HH12 ARG B 54 15.762 -3.043 -14.676 1.00 0.00 H new ATOM 0 HH21 ARG B 54 17.828 -5.250 -12.918 1.00 0.00 H new ATOM 0 HH22 ARG B 54 17.585 -3.584 -13.453 1.00 0.00 H new ATOM 2791 N THR B 55 12.804 -10.553 -17.440 1.00 0.00 N ATOM 2792 CA THR B 55 12.012 -11.578 -18.111 1.00 0.00 C ATOM 2793 C THR B 55 11.045 -12.235 -17.131 1.00 0.00 C ATOM 2794 O THR B 55 11.174 -12.077 -15.917 1.00 0.00 O ATOM 2795 CB THR B 55 12.933 -12.643 -18.712 1.00 0.00 C ATOM 2796 OG1 THR B 55 13.628 -13.310 -17.668 1.00 0.00 O ATOM 2797 CG2 THR B 55 13.938 -11.982 -19.656 1.00 0.00 C ATOM 0 H THR B 55 13.396 -10.899 -16.685 1.00 0.00 H new ATOM 0 HA THR B 55 11.439 -11.103 -18.907 1.00 0.00 H new ATOM 0 HB THR B 55 12.336 -13.364 -19.271 1.00 0.00 H new ATOM 0 HG1 THR B 55 13.362 -14.253 -17.648 1.00 0.00 H new ATOM 0 HG21 THR B 55 14.592 -12.743 -20.082 1.00 0.00 H new ATOM 0 HG22 THR B 55 13.403 -11.473 -20.458 1.00 0.00 H new ATOM 0 HG23 THR B 55 14.536 -11.258 -19.102 1.00 0.00 H new ATOM 2805 N LEU B 56 10.078 -12.972 -17.667 1.00 0.00 N ATOM 2806 CA LEU B 56 9.094 -13.648 -16.829 1.00 0.00 C ATOM 2807 C LEU B 56 9.767 -14.698 -15.951 1.00 0.00 C ATOM 2808 O LEU B 56 9.117 -15.340 -15.126 1.00 0.00 O ATOM 2809 CB LEU B 56 8.032 -14.317 -17.703 1.00 0.00 C ATOM 2810 CG LEU B 56 7.140 -13.247 -18.337 1.00 0.00 C ATOM 2811 CD1 LEU B 56 6.220 -13.898 -19.371 1.00 0.00 C ATOM 2812 CD2 LEU B 56 6.291 -12.576 -17.253 1.00 0.00 C ATOM 0 H LEU B 56 9.955 -13.116 -18.669 1.00 0.00 H new ATOM 0 HA LEU B 56 8.621 -12.904 -16.188 1.00 0.00 H new ATOM 0 HB2 LEU B 56 8.509 -14.914 -18.480 1.00 0.00 H new ATOM 0 HB3 LEU B 56 7.429 -14.998 -17.103 1.00 0.00 H new ATOM 0 HG LEU B 56 7.765 -12.498 -18.823 1.00 0.00 H new ATOM 0 HD11 LEU B 56 5.584 -13.137 -19.823 1.00 0.00 H new ATOM 0 HD12 LEU B 56 6.822 -14.374 -20.145 1.00 0.00 H new ATOM 0 HD13 LEU B 56 5.597 -14.648 -18.883 1.00 0.00 H new ATOM 0 HD21 LEU B 56 5.657 -11.815 -17.707 1.00 0.00 H new ATOM 0 HD22 LEU B 56 5.667 -13.324 -16.765 1.00 0.00 H new ATOM 0 HD23 LEU B 56 6.945 -12.111 -16.515 1.00 0.00 H new ATOM 2824 N SER B 57 11.073 -14.868 -16.133 1.00 0.00 N ATOM 2825 CA SER B 57 11.822 -15.844 -15.350 1.00 0.00 C ATOM 2826 C SER B 57 12.502 -15.169 -14.162 1.00 0.00 C ATOM 2827 O SER B 57 12.846 -15.824 -13.178 1.00 0.00 O ATOM 2828 CB SER B 57 12.876 -16.519 -16.229 1.00 0.00 C ATOM 2829 OG SER B 57 13.398 -15.571 -17.150 1.00 0.00 O ATOM 0 H SER B 57 11.631 -14.347 -16.810 1.00 0.00 H new ATOM 0 HA SER B 57 11.126 -16.595 -14.977 1.00 0.00 H new ATOM 0 HB2 SER B 57 13.678 -16.922 -15.610 1.00 0.00 H new ATOM 0 HB3 SER B 57 12.435 -17.359 -16.765 1.00 0.00 H new ATOM 0 HG SER B 57 13.101 -15.797 -18.056 1.00 0.00 H new ATOM 2835 N ASP B 58 12.690 -13.857 -14.261 1.00 0.00 N ATOM 2836 CA ASP B 58 13.329 -13.104 -13.188 1.00 0.00 C ATOM 2837 C ASP B 58 12.313 -12.749 -12.107 1.00 0.00 C ATOM 2838 O ASP B 58 12.607 -11.976 -11.195 1.00 0.00 O ATOM 2839 CB ASP B 58 13.951 -11.823 -13.749 1.00 0.00 C ATOM 2840 CG ASP B 58 15.288 -12.140 -14.410 1.00 0.00 C ATOM 2841 OD1 ASP B 58 15.474 -13.277 -14.811 1.00 0.00 O ATOM 2842 OD2 ASP B 58 16.107 -11.240 -14.507 1.00 0.00 O1- ATOM 0 H ASP B 58 12.411 -13.297 -15.067 1.00 0.00 H new ATOM 0 HA ASP B 58 14.110 -13.723 -12.747 1.00 0.00 H new ATOM 0 HB2 ASP B 58 13.276 -11.368 -14.474 1.00 0.00 H new ATOM 0 HB3 ASP B 58 14.095 -11.097 -12.948 1.00 0.00 H new ATOM 2847 N TYR B 59 11.117 -13.319 -12.215 1.00 0.00 N ATOM 2848 CA TYR B 59 10.064 -13.057 -11.241 1.00 0.00 C ATOM 2849 C TYR B 59 9.363 -14.354 -10.848 1.00 0.00 C ATOM 2850 O TYR B 59 8.319 -14.335 -10.197 1.00 0.00 O ATOM 2851 CB TYR B 59 9.042 -12.079 -11.826 1.00 0.00 C ATOM 2852 CG TYR B 59 9.611 -10.680 -11.797 1.00 0.00 C ATOM 2853 CD1 TYR B 59 9.799 -10.026 -10.574 1.00 0.00 C ATOM 2854 CD2 TYR B 59 9.950 -10.037 -12.994 1.00 0.00 C ATOM 2855 CE1 TYR B 59 10.326 -8.730 -10.547 1.00 0.00 C ATOM 2856 CE2 TYR B 59 10.477 -8.740 -12.967 1.00 0.00 C ATOM 2857 CZ TYR B 59 10.664 -8.087 -11.743 1.00 0.00 C ATOM 2858 OH TYR B 59 11.184 -6.808 -11.717 1.00 0.00 O ATOM 0 H TYR B 59 10.854 -13.961 -12.962 1.00 0.00 H new ATOM 0 HA TYR B 59 10.518 -12.619 -10.352 1.00 0.00 H new ATOM 0 HB2 TYR B 59 8.796 -12.362 -12.849 1.00 0.00 H new ATOM 0 HB3 TYR B 59 8.116 -12.118 -11.253 1.00 0.00 H new ATOM 0 HD1 TYR B 59 9.537 -10.522 -9.651 1.00 0.00 H new ATOM 0 HD2 TYR B 59 9.805 -10.541 -13.938 1.00 0.00 H new ATOM 0 HE1 TYR B 59 10.472 -8.226 -9.603 1.00 0.00 H new ATOM 0 HE2 TYR B 59 10.739 -8.244 -13.890 1.00 0.00 H new ATOM 0 HH TYR B 59 11.784 -6.683 -12.482 1.00 0.00 H new ATOM 2868 N ASN B 60 9.947 -15.479 -11.248 1.00 0.00 N ATOM 2869 CA ASN B 60 9.372 -16.782 -10.932 1.00 0.00 C ATOM 2870 C ASN B 60 7.927 -16.865 -11.413 1.00 0.00 C ATOM 2871 O ASN B 60 7.097 -17.536 -10.800 1.00 0.00 O ATOM 2872 CB ASN B 60 9.424 -17.023 -9.422 1.00 0.00 C ATOM 2873 CG ASN B 60 10.869 -17.220 -8.975 1.00 0.00 C ATOM 2874 OD1 ASN B 60 11.781 -17.222 -9.802 1.00 0.00 O ATOM 2875 ND2 ASN B 60 11.133 -17.386 -7.708 1.00 0.00 N ATOM 0 H ASN B 60 10.812 -15.515 -11.788 1.00 0.00 H new ATOM 0 HA ASN B 60 9.956 -17.548 -11.443 1.00 0.00 H new ATOM 0 HB2 ASN B 60 8.984 -16.177 -8.895 1.00 0.00 H new ATOM 0 HB3 ASN B 60 8.832 -17.901 -9.165 1.00 0.00 H new ATOM 0 HD21 ASN B 60 12.097 -17.518 -7.401 1.00 0.00 H new ATOM 0 HD22 ASN B 60 10.376 -17.384 -7.025 1.00 0.00 H new ATOM 2882 N ILE B 61 7.634 -16.183 -12.515 1.00 0.00 N ATOM 2883 CA ILE B 61 6.284 -16.191 -13.070 1.00 0.00 C ATOM 2884 C ILE B 61 6.066 -17.438 -13.921 1.00 0.00 C ATOM 2885 O ILE B 61 6.403 -17.461 -15.104 1.00 0.00 O ATOM 2886 CB ILE B 61 6.062 -14.940 -13.923 1.00 0.00 C ATOM 2887 CG1 ILE B 61 6.047 -13.706 -13.018 1.00 0.00 C ATOM 2888 CG2 ILE B 61 4.724 -15.050 -14.656 1.00 0.00 C ATOM 2889 CD1 ILE B 61 6.167 -12.443 -13.873 1.00 0.00 C ATOM 0 H ILE B 61 8.306 -15.622 -13.038 1.00 0.00 H new ATOM 0 HA ILE B 61 5.570 -16.197 -12.246 1.00 0.00 H new ATOM 0 HB ILE B 61 6.867 -14.850 -14.652 1.00 0.00 H new ATOM 0 HG12 ILE B 61 5.125 -13.679 -12.438 1.00 0.00 H new ATOM 0 HG13 ILE B 61 6.870 -13.755 -12.305 1.00 0.00 H new ATOM 0 HG21 ILE B 61 4.567 -14.158 -15.263 1.00 0.00 H new ATOM 0 HG22 ILE B 61 4.733 -15.930 -15.299 1.00 0.00 H new ATOM 0 HG23 ILE B 61 3.917 -15.140 -13.929 1.00 0.00 H new ATOM 0 HD11 ILE B 61 6.156 -11.565 -13.228 1.00 0.00 H new ATOM 0 HD12 ILE B 61 7.102 -12.470 -14.433 1.00 0.00 H new ATOM 0 HD13 ILE B 61 5.329 -12.393 -14.568 1.00 0.00 H new ATOM 2901 N GLN B 62 5.502 -18.474 -13.308 1.00 0.00 N ATOM 2902 CA GLN B 62 5.246 -19.722 -14.016 1.00 0.00 C ATOM 2903 C GLN B 62 4.011 -19.598 -14.903 1.00 0.00 C ATOM 2904 O GLN B 62 3.588 -18.493 -15.244 1.00 0.00 O ATOM 2905 CB GLN B 62 5.044 -20.859 -13.013 1.00 0.00 C ATOM 2906 CG GLN B 62 6.059 -20.724 -11.876 1.00 0.00 C ATOM 2907 CD GLN B 62 6.111 -22.015 -11.067 1.00 0.00 C ATOM 2908 OE1 GLN B 62 5.208 -22.936 -11.266 1.00 0.00 O flip ATOM 2909 NE2 GLN B 62 6.997 -22.190 -10.231 1.00 0.00 N flip ATOM 0 H GLN B 62 5.215 -18.474 -12.329 1.00 0.00 H new ATOM 0 HA GLN B 62 6.108 -19.941 -14.646 1.00 0.00 H new ATOM 0 HB2 GLN B 62 4.030 -20.831 -12.614 1.00 0.00 H new ATOM 0 HB3 GLN B 62 5.164 -21.822 -13.510 1.00 0.00 H new ATOM 0 HG2 GLN B 62 7.045 -20.500 -12.283 1.00 0.00 H new ATOM 0 HG3 GLN B 62 5.784 -19.891 -11.229 1.00 0.00 H new ATOM 0 HE21 GLN B 62 7.702 -21.469 -10.077 1.00 0.00 H new ATOM 0 HE22 GLN B 62 7.026 -23.056 -9.693 1.00 0.00 H new ATOM 2918 N LYS B 63 3.440 -20.739 -15.273 1.00 0.00 N ATOM 2919 CA LYS B 63 2.254 -20.751 -16.123 1.00 0.00 C ATOM 2920 C LYS B 63 0.991 -20.575 -15.289 1.00 0.00 C ATOM 2921 O LYS B 63 0.995 -20.805 -14.079 1.00 0.00 O ATOM 2922 CB LYS B 63 2.179 -22.069 -16.896 1.00 0.00 C ATOM 2923 CG LYS B 63 2.048 -23.235 -15.914 1.00 0.00 C ATOM 2924 CD LYS B 63 1.830 -24.535 -16.691 1.00 0.00 C ATOM 2925 CE LYS B 63 1.920 -25.724 -15.733 1.00 0.00 C ATOM 2926 NZ LYS B 63 1.824 -26.994 -16.508 1.00 0.00 N1+ ATOM 0 H LYS B 63 3.776 -21.663 -15.000 1.00 0.00 H new ATOM 0 HA LYS B 63 2.327 -19.921 -16.826 1.00 0.00 H new ATOM 0 HB2 LYS B 63 1.327 -22.055 -17.575 1.00 0.00 H new ATOM 0 HB3 LYS B 63 3.072 -22.195 -17.508 1.00 0.00 H new ATOM 0 HG2 LYS B 63 2.947 -23.311 -15.302 1.00 0.00 H new ATOM 0 HG3 LYS B 63 1.213 -23.060 -15.235 1.00 0.00 H new ATOM 0 HD2 LYS B 63 0.855 -24.520 -17.179 1.00 0.00 H new ATOM 0 HD3 LYS B 63 2.579 -24.631 -17.478 1.00 0.00 H new ATOM 0 HE2 LYS B 63 2.860 -25.691 -15.183 1.00 0.00 H new ATOM 0 HE3 LYS B 63 1.118 -25.673 -14.997 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 1.885 -27.803 -15.857 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 0.916 -27.024 -17.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 2.604 -27.042 -17.194 1.00 0.00 H new ATOM 2940 N GLU B 64 -0.088 -20.168 -15.947 1.00 0.00 N ATOM 2941 CA GLU B 64 -1.360 -19.963 -15.265 1.00 0.00 C ATOM 2942 C GLU B 64 -1.227 -18.902 -14.178 1.00 0.00 C ATOM 2943 O GLU B 64 -1.922 -18.949 -13.163 1.00 0.00 O ATOM 2944 CB GLU B 64 -1.839 -21.277 -14.645 1.00 0.00 C ATOM 2945 CG GLU B 64 -1.949 -22.346 -15.734 1.00 0.00 C ATOM 2946 CD GLU B 64 -2.541 -23.625 -15.151 1.00 0.00 C ATOM 2947 OE1 GLU B 64 -3.563 -23.534 -14.491 1.00 0.00 O ATOM 2948 OE2 GLU B 64 -1.964 -24.676 -15.374 1.00 0.00 O1- ATOM 0 H GLU B 64 -0.108 -19.974 -16.948 1.00 0.00 H new ATOM 0 HA GLU B 64 -2.090 -19.620 -15.999 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -1.143 -21.601 -13.871 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -2.806 -21.133 -14.163 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -2.576 -21.984 -16.549 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.965 -22.550 -16.156 1.00 0.00 H new ATOM 2955 N SER B 65 -0.333 -17.943 -14.397 1.00 0.00 N ATOM 2956 CA SER B 65 -0.121 -16.873 -13.428 1.00 0.00 C ATOM 2957 C SER B 65 -1.035 -15.690 -13.732 1.00 0.00 C ATOM 2958 O SER B 65 -1.083 -15.205 -14.863 1.00 0.00 O ATOM 2959 CB SER B 65 1.337 -16.417 -13.465 1.00 0.00 C ATOM 2960 OG SER B 65 2.180 -17.510 -13.127 1.00 0.00 O ATOM 0 H SER B 65 0.252 -17.884 -15.230 1.00 0.00 H new ATOM 0 HA SER B 65 -0.356 -17.254 -12.434 1.00 0.00 H new ATOM 0 HB2 SER B 65 1.588 -16.043 -14.458 1.00 0.00 H new ATOM 0 HB3 SER B 65 1.491 -15.595 -12.766 1.00 0.00 H new ATOM 0 HG SER B 65 2.759 -17.724 -13.888 1.00 0.00 H new ATOM 2966 N THR B 66 -1.759 -15.230 -12.716 1.00 0.00 N ATOM 2967 CA THR B 66 -2.669 -14.102 -12.888 1.00 0.00 C ATOM 2968 C THR B 66 -1.957 -12.789 -12.582 1.00 0.00 C ATOM 2969 O THR B 66 -1.915 -12.347 -11.434 1.00 0.00 O ATOM 2970 CB THR B 66 -3.876 -14.259 -11.961 1.00 0.00 C ATOM 2971 OG1 THR B 66 -4.453 -15.543 -12.152 1.00 0.00 O ATOM 2972 CG2 THR B 66 -4.911 -13.180 -12.281 1.00 0.00 C ATOM 0 H THR B 66 -1.734 -15.617 -11.773 1.00 0.00 H new ATOM 0 HA THR B 66 -3.007 -14.086 -13.924 1.00 0.00 H new ATOM 0 HB THR B 66 -3.555 -14.155 -10.925 1.00 0.00 H new ATOM 0 HG1 THR B 66 -5.225 -15.646 -11.558 1.00 0.00 H new ATOM 0 HG21 THR B 66 -5.770 -13.293 -11.620 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.467 -12.195 -12.134 1.00 0.00 H new ATOM 0 HG23 THR B 66 -5.234 -13.282 -13.317 1.00 0.00 H new ATOM 2980 N LEU B 67 -1.398 -12.170 -13.616 1.00 0.00 N ATOM 2981 CA LEU B 67 -0.689 -10.908 -13.447 1.00 0.00 C ATOM 2982 C LEU B 67 -1.674 -9.766 -13.217 1.00 0.00 C ATOM 2983 O LEU B 67 -2.598 -9.562 -14.004 1.00 0.00 O ATOM 2984 CB LEU B 67 0.156 -10.612 -14.688 1.00 0.00 C ATOM 2985 CG LEU B 67 1.431 -11.459 -14.654 1.00 0.00 C ATOM 2986 CD1 LEU B 67 1.916 -11.711 -16.083 1.00 0.00 C ATOM 2987 CD2 LEU B 67 2.518 -10.715 -13.873 1.00 0.00 C ATOM 0 H LEU B 67 -1.422 -12.519 -14.574 1.00 0.00 H new ATOM 0 HA LEU B 67 -0.039 -10.993 -12.577 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -0.415 -10.832 -15.590 1.00 0.00 H new ATOM 0 HB3 LEU B 67 0.411 -9.553 -14.722 1.00 0.00 H new ATOM 0 HG LEU B 67 1.220 -12.411 -14.168 1.00 0.00 H new ATOM 0 HD11 LEU B 67 2.824 -12.314 -16.058 1.00 0.00 H new ATOM 0 HD12 LEU B 67 1.144 -12.240 -16.641 1.00 0.00 H new ATOM 0 HD13 LEU B 67 2.126 -10.758 -16.569 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.426 -11.318 -13.849 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.728 -9.762 -14.359 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.175 -10.534 -12.854 1.00 0.00 H new ATOM 2999 N HIS B 68 -1.468 -9.024 -12.134 1.00 0.00 N ATOM 3000 CA HIS B 68 -2.342 -7.903 -11.811 1.00 0.00 C ATOM 3001 C HIS B 68 -1.987 -6.688 -12.662 1.00 0.00 C ATOM 3002 O HIS B 68 -0.949 -6.057 -12.457 1.00 0.00 O ATOM 3003 CB HIS B 68 -2.211 -7.547 -10.328 1.00 0.00 C ATOM 3004 CG HIS B 68 -2.900 -8.595 -9.498 1.00 0.00 C ATOM 3005 ND1 HIS B 68 -3.563 -9.671 -10.067 1.00 0.00 N ATOM 3006 CD2 HIS B 68 -3.037 -8.745 -8.140 1.00 0.00 C ATOM 3007 CE1 HIS B 68 -4.065 -10.414 -9.063 1.00 0.00 C ATOM 3008 NE2 HIS B 68 -3.773 -9.895 -7.868 1.00 0.00 N ATOM 0 H HIS B 68 -0.709 -9.177 -11.470 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.371 -8.195 -12.023 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -1.159 -7.482 -10.050 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.652 -6.569 -10.137 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -2.635 -8.073 -7.396 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -4.635 -11.320 -9.207 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -4.033 -10.262 -6.953 1.00 0.00 H new ATOM 3016 N LEU B 69 -2.854 -6.368 -13.617 1.00 0.00 N ATOM 3017 CA LEU B 69 -2.622 -5.228 -14.496 1.00 0.00 C ATOM 3018 C LEU B 69 -3.187 -3.952 -13.880 1.00 0.00 C ATOM 3019 O LEU B 69 -4.392 -3.708 -13.931 1.00 0.00 O ATOM 3020 CB LEU B 69 -3.278 -5.477 -15.857 1.00 0.00 C ATOM 3021 CG LEU B 69 -3.266 -4.187 -16.681 1.00 0.00 C ATOM 3022 CD1 LEU B 69 -1.847 -3.618 -16.723 1.00 0.00 C ATOM 3023 CD2 LEU B 69 -3.734 -4.491 -18.106 1.00 0.00 C ATOM 0 H LEU B 69 -3.718 -6.878 -13.801 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.547 -5.107 -14.628 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -2.745 -6.265 -16.389 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -4.303 -5.822 -15.720 1.00 0.00 H new ATOM 0 HG LEU B 69 -3.935 -3.458 -16.223 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -1.840 -2.700 -17.310 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -1.511 -3.403 -15.709 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -1.177 -4.346 -17.180 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -3.726 -3.574 -18.695 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -3.064 -5.220 -18.561 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -4.746 -4.896 -18.078 1.00 0.00 H new ATOM 3035 N VAL B 70 -2.308 -3.142 -13.298 1.00 0.00 N ATOM 3036 CA VAL B 70 -2.730 -1.892 -12.675 1.00 0.00 C ATOM 3037 C VAL B 70 -2.303 -0.701 -13.526 1.00 0.00 C ATOM 3038 O VAL B 70 -1.281 -0.750 -14.211 1.00 0.00 O ATOM 3039 CB VAL B 70 -2.116 -1.772 -11.279 1.00 0.00 C ATOM 3040 CG1 VAL B 70 -2.947 -0.803 -10.435 1.00 0.00 C ATOM 3041 CG2 VAL B 70 -2.105 -3.148 -10.609 1.00 0.00 C ATOM 0 H VAL B 70 -1.306 -3.327 -13.245 1.00 0.00 H new ATOM 0 HA VAL B 70 -3.817 -1.895 -12.594 1.00 0.00 H new ATOM 0 HB VAL B 70 -1.096 -1.397 -11.363 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -2.509 -0.718 -9.441 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -2.958 0.177 -10.911 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -3.967 -1.177 -10.351 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.668 -3.065 -9.614 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -3.126 -3.521 -10.527 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -1.513 -3.840 -11.208 1.00 0.00 H new ATOM 3051 N LEU B 71 -3.092 0.367 -13.479 1.00 0.00 N ATOM 3052 CA LEU B 71 -2.786 1.566 -14.252 1.00 0.00 C ATOM 3053 C LEU B 71 -1.935 2.530 -13.432 1.00 0.00 C ATOM 3054 O LEU B 71 -2.360 3.006 -12.379 1.00 0.00 O ATOM 3055 CB LEU B 71 -4.083 2.260 -14.676 1.00 0.00 C ATOM 3056 CG LEU B 71 -4.701 1.520 -15.865 1.00 0.00 C ATOM 3057 CD1 LEU B 71 -3.829 1.719 -17.108 1.00 0.00 C ATOM 3058 CD2 LEU B 71 -4.795 0.026 -15.542 1.00 0.00 C ATOM 0 H LEU B 71 -3.942 0.428 -12.918 1.00 0.00 H new ATOM 0 HA LEU B 71 -2.226 1.270 -15.139 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -4.785 2.279 -13.843 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -3.880 3.296 -14.946 1.00 0.00 H new ATOM 0 HG LEU B 71 -5.698 1.916 -16.057 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -4.272 1.191 -17.952 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -3.763 2.782 -17.340 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -2.830 1.326 -16.918 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -5.235 -0.502 -16.388 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -3.797 -0.368 -15.348 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -5.420 -0.117 -14.660 1.00 0.00 H new ATOM 3070 N ARG B 72 -0.733 2.815 -13.922 1.00 0.00 N ATOM 3071 CA ARG B 72 0.168 3.726 -13.225 1.00 0.00 C ATOM 3072 C ARG B 72 -0.377 5.150 -13.264 1.00 0.00 C ATOM 3073 O ARG B 72 -0.072 5.917 -14.178 1.00 0.00 O ATOM 3074 CB ARG B 72 1.553 3.691 -13.875 1.00 0.00 C ATOM 3075 CG ARG B 72 2.564 4.388 -12.963 1.00 0.00 C ATOM 3076 CD ARG B 72 3.954 4.326 -13.598 1.00 0.00 C ATOM 3077 NE ARG B 72 4.309 2.945 -13.902 1.00 0.00 N ATOM 3078 CZ ARG B 72 5.539 2.620 -14.287 1.00 0.00 C ATOM 3079 NH1 ARG B 72 6.295 3.507 -14.872 1.00 0.00 N1+ ATOM 3080 NH2 ARG B 72 5.990 1.412 -14.080 1.00 0.00 N ATOM 0 H ARG B 72 -0.362 2.432 -14.792 1.00 0.00 H new ATOM 0 HA ARG B 72 0.246 3.406 -12.186 1.00 0.00 H new ATOM 0 HB2 ARG B 72 1.857 2.659 -14.051 1.00 0.00 H new ATOM 0 HB3 ARG B 72 1.523 4.185 -14.846 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.271 5.426 -12.805 1.00 0.00 H new ATOM 0 HG3 ARG B 72 2.578 3.908 -11.985 1.00 0.00 H new ATOM 0 HD2 ARG B 72 3.972 4.923 -14.510 1.00 0.00 H new ATOM 0 HD3 ARG B 72 4.691 4.758 -12.920 1.00 0.00 H new ATOM 0 HE ARG B 72 3.601 2.215 -13.818 1.00 0.00 H new ATOM 0 HH11 ARG B 72 5.942 4.450 -15.034 1.00 0.00 H new ATOM 0 HH12 ARG B 72 7.239 3.257 -15.167 1.00 0.00 H new ATOM 0 HH21 ARG B 72 5.398 0.718 -13.623 1.00 0.00 H new ATOM 0 HH22 ARG B 72 6.934 1.162 -14.375 1.00 0.00 H new ATOM 3153 N MET C 1 23.974 -0.447 20.557 1.00 0.00 N ATOM 3154 CA MET C 1 22.806 -0.148 21.432 1.00 0.00 C ATOM 3155 C MET C 1 21.605 -0.965 20.970 1.00 0.00 C ATOM 3156 O MET C 1 21.243 -0.944 19.793 1.00 0.00 O ATOM 3157 CB MET C 1 22.481 1.347 21.360 1.00 0.00 C ATOM 3158 CG MET C 1 22.725 1.863 19.940 1.00 0.00 C ATOM 3159 SD MET C 1 22.790 3.672 19.961 1.00 0.00 S ATOM 3160 CE MET C 1 21.601 3.960 18.627 1.00 0.00 C ATOM 0 H1 MET C 1 24.693 0.295 20.673 1.00 0.00 H new ATOM 0 H2 MET C 1 24.380 -1.367 20.822 1.00 0.00 H new ATOM 0 H3 MET C 1 23.665 -0.478 19.564 1.00 0.00 H new ATOM 0 HA MET C 1 23.044 -0.411 22.463 1.00 0.00 H new ATOM 0 HB2 MET C 1 21.443 1.517 21.645 1.00 0.00 H new ATOM 0 HB3 MET C 1 23.100 1.898 22.068 1.00 0.00 H new ATOM 0 HG2 MET C 1 23.659 1.459 19.550 1.00 0.00 H new ATOM 0 HG3 MET C 1 21.929 1.524 19.276 1.00 0.00 H new ATOM 0 HE1 MET C 1 21.763 4.951 18.203 1.00 0.00 H new ATOM 0 HE2 MET C 1 21.735 3.207 17.851 1.00 0.00 H new ATOM 0 HE3 MET C 1 20.587 3.896 19.023 1.00 0.00 H new ATOM 3172 N GLN C 2 20.990 -1.683 21.904 1.00 0.00 N ATOM 3173 CA GLN C 2 19.829 -2.503 21.583 1.00 0.00 C ATOM 3174 C GLN C 2 18.602 -1.625 21.355 1.00 0.00 C ATOM 3175 O GLN C 2 17.963 -1.178 22.307 1.00 0.00 O ATOM 3176 CB GLN C 2 19.553 -3.484 22.724 1.00 0.00 C ATOM 3177 CG GLN C 2 18.546 -4.538 22.261 1.00 0.00 C ATOM 3178 CD GLN C 2 18.437 -5.648 23.300 1.00 0.00 C ATOM 3179 OE1 GLN C 2 18.305 -5.373 24.493 1.00 0.00 O ATOM 3180 NE2 GLN C 2 18.484 -6.895 22.917 1.00 0.00 N ATOM 0 H GLN C 2 21.274 -1.714 22.883 1.00 0.00 H new ATOM 0 HA GLN C 2 20.039 -3.059 20.669 1.00 0.00 H new ATOM 0 HB2 GLN C 2 20.480 -3.965 23.036 1.00 0.00 H new ATOM 0 HB3 GLN C 2 19.163 -2.950 23.590 1.00 0.00 H new ATOM 0 HG2 GLN C 2 17.571 -4.077 22.106 1.00 0.00 H new ATOM 0 HG3 GLN C 2 18.858 -4.955 21.303 1.00 0.00 H new ATOM 0 HE21 GLN C 2 18.593 -7.121 21.928 1.00 0.00 H new ATOM 0 HE22 GLN C 2 18.411 -7.643 23.606 1.00 0.00 H new ATOM 3189 N ILE C 3 18.281 -1.380 20.089 1.00 0.00 N ATOM 3190 CA ILE C 3 17.130 -0.551 19.750 1.00 0.00 C ATOM 3191 C ILE C 3 15.934 -1.414 19.363 1.00 0.00 C ATOM 3192 O ILE C 3 16.089 -2.577 18.987 1.00 0.00 O ATOM 3193 CB ILE C 3 17.483 0.387 18.595 1.00 0.00 C ATOM 3194 CG1 ILE C 3 17.812 -0.436 17.347 1.00 0.00 C ATOM 3195 CG2 ILE C 3 18.697 1.235 18.979 1.00 0.00 C ATOM 3196 CD1 ILE C 3 17.519 0.400 16.101 1.00 0.00 C ATOM 0 H ILE C 3 18.797 -1.740 19.286 1.00 0.00 H new ATOM 0 HA ILE C 3 16.864 0.038 20.628 1.00 0.00 H new ATOM 0 HB ILE C 3 16.634 1.038 18.387 1.00 0.00 H new ATOM 0 HG12 ILE C 3 18.860 -0.735 17.360 1.00 0.00 H new ATOM 0 HG13 ILE C 3 17.219 -1.351 17.333 1.00 0.00 H new ATOM 0 HG21 ILE C 3 18.949 1.904 18.156 1.00 0.00 H new ATOM 0 HG22 ILE C 3 18.464 1.824 19.866 1.00 0.00 H new ATOM 0 HG23 ILE C 3 19.545 0.583 19.189 1.00 0.00 H new ATOM 0 HD11 ILE C 3 17.752 -0.182 15.209 1.00 0.00 H new ATOM 0 HD12 ILE C 3 16.465 0.677 16.088 1.00 0.00 H new ATOM 0 HD13 ILE C 3 18.131 1.302 16.116 1.00 0.00 H new ATOM 3208 N PHE C 4 14.740 -0.835 19.458 1.00 0.00 N ATOM 3209 CA PHE C 4 13.519 -1.555 19.117 1.00 0.00 C ATOM 3210 C PHE C 4 12.847 -0.927 17.899 1.00 0.00 C ATOM 3211 O PHE C 4 12.892 0.288 17.712 1.00 0.00 O ATOM 3212 CB PHE C 4 12.551 -1.529 20.302 1.00 0.00 C ATOM 3213 CG PHE C 4 13.161 -2.268 21.469 1.00 0.00 C ATOM 3214 CD1 PHE C 4 13.335 -3.655 21.405 1.00 0.00 C ATOM 3215 CD2 PHE C 4 13.552 -1.565 22.615 1.00 0.00 C ATOM 3216 CE1 PHE C 4 13.900 -4.341 22.488 1.00 0.00 C ATOM 3217 CE2 PHE C 4 14.117 -2.251 23.698 1.00 0.00 C ATOM 3218 CZ PHE C 4 14.291 -3.638 23.634 1.00 0.00 C ATOM 0 H PHE C 4 14.593 0.126 19.767 1.00 0.00 H new ATOM 0 HA PHE C 4 13.782 -2.586 18.882 1.00 0.00 H new ATOM 0 HB2 PHE C 4 12.333 -0.499 20.584 1.00 0.00 H new ATOM 0 HB3 PHE C 4 11.604 -1.990 20.021 1.00 0.00 H new ATOM 0 HD1 PHE C 4 13.034 -4.197 20.521 1.00 0.00 H new ATOM 0 HD2 PHE C 4 13.418 -0.494 22.664 1.00 0.00 H new ATOM 0 HE1 PHE C 4 14.034 -5.412 22.439 1.00 0.00 H new ATOM 0 HE2 PHE C 4 14.418 -1.709 24.582 1.00 0.00 H new ATOM 0 HZ PHE C 4 14.727 -4.166 24.469 1.00 0.00 H new ATOM 3228 N VAL C 5 12.223 -1.764 17.076 1.00 0.00 N ATOM 3229 CA VAL C 5 11.542 -1.281 15.880 1.00 0.00 C ATOM 3230 C VAL C 5 10.091 -1.753 15.864 1.00 0.00 C ATOM 3231 O VAL C 5 9.812 -2.925 15.614 1.00 0.00 O ATOM 3232 CB VAL C 5 12.260 -1.786 14.628 1.00 0.00 C ATOM 3233 CG1 VAL C 5 11.509 -1.313 13.382 1.00 0.00 C ATOM 3234 CG2 VAL C 5 13.687 -1.234 14.603 1.00 0.00 C ATOM 0 H VAL C 5 12.175 -2.773 17.214 1.00 0.00 H new ATOM 0 HA VAL C 5 11.558 -0.191 15.890 1.00 0.00 H new ATOM 0 HB VAL C 5 12.290 -2.875 14.641 1.00 0.00 H new ATOM 0 HG11 VAL C 5 12.021 -1.673 12.490 1.00 0.00 H new ATOM 0 HG12 VAL C 5 10.492 -1.705 13.400 1.00 0.00 H new ATOM 0 HG13 VAL C 5 11.478 -0.224 13.368 1.00 0.00 H new ATOM 0 HG21 VAL C 5 14.200 -1.593 13.711 1.00 0.00 H new ATOM 0 HG22 VAL C 5 13.656 -0.145 14.590 1.00 0.00 H new ATOM 0 HG23 VAL C 5 14.223 -1.571 15.490 1.00 0.00 H new ATOM 3244 N LYS C 6 9.173 -0.831 16.136 1.00 0.00 N ATOM 3245 CA LYS C 6 7.752 -1.162 16.154 1.00 0.00 C ATOM 3246 C LYS C 6 7.144 -0.995 14.765 1.00 0.00 C ATOM 3247 O LYS C 6 7.330 0.033 14.115 1.00 0.00 O ATOM 3248 CB LYS C 6 7.019 -0.257 17.146 1.00 0.00 C ATOM 3249 CG LYS C 6 5.570 -0.725 17.293 1.00 0.00 C ATOM 3250 CD LYS C 6 4.952 -0.094 18.542 1.00 0.00 C ATOM 3251 CE LYS C 6 4.868 1.423 18.361 1.00 0.00 C ATOM 3252 NZ LYS C 6 3.934 1.992 19.373 1.00 0.00 N1+ ATOM 0 H LYS C 6 9.385 0.144 16.346 1.00 0.00 H new ATOM 0 HA LYS C 6 7.644 -2.202 16.462 1.00 0.00 H new ATOM 0 HB2 LYS C 6 7.520 -0.281 18.114 1.00 0.00 H new ATOM 0 HB3 LYS C 6 7.045 0.776 16.799 1.00 0.00 H new ATOM 0 HG2 LYS C 6 4.996 -0.446 16.410 1.00 0.00 H new ATOM 0 HG3 LYS C 6 5.534 -1.812 17.366 1.00 0.00 H new ATOM 0 HD2 LYS C 6 3.958 -0.505 18.716 1.00 0.00 H new ATOM 0 HD3 LYS C 6 5.554 -0.333 19.419 1.00 0.00 H new ATOM 0 HE2 LYS C 6 5.857 1.869 18.471 1.00 0.00 H new ATOM 0 HE3 LYS C 6 4.521 1.662 17.356 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 4.293 2.912 19.699 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 2.994 2.119 18.946 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 3.861 1.343 20.182 1.00 0.00 H new ATOM 3266 N THR C 7 6.415 -2.013 14.319 1.00 0.00 N ATOM 3267 CA THR C 7 5.781 -1.969 13.006 1.00 0.00 C ATOM 3268 C THR C 7 4.326 -1.529 13.131 1.00 0.00 C ATOM 3269 O THR C 7 3.633 -1.906 14.075 1.00 0.00 O ATOM 3270 CB THR C 7 5.844 -3.349 12.348 1.00 0.00 C ATOM 3271 OG1 THR C 7 5.140 -4.286 13.151 1.00 0.00 O ATOM 3272 CG2 THR C 7 7.303 -3.785 12.211 1.00 0.00 C ATOM 0 H THR C 7 6.249 -2.872 14.843 1.00 0.00 H new ATOM 0 HA THR C 7 6.316 -1.248 12.388 1.00 0.00 H new ATOM 0 HB THR C 7 5.388 -3.302 11.359 1.00 0.00 H new ATOM 0 HG1 THR C 7 4.425 -4.698 12.622 1.00 0.00 H new ATOM 0 HG21 THR C 7 7.346 -4.768 11.742 1.00 0.00 H new ATOM 0 HG22 THR C 7 7.842 -3.065 11.595 1.00 0.00 H new ATOM 0 HG23 THR C 7 7.763 -3.833 13.198 1.00 0.00 H new ATOM 3280 N LEU C 8 3.870 -0.729 12.173 1.00 0.00 N ATOM 3281 CA LEU C 8 2.495 -0.244 12.188 1.00 0.00 C ATOM 3282 C LEU C 8 1.525 -1.396 12.429 1.00 0.00 C ATOM 3283 O LEU C 8 0.630 -1.302 13.269 1.00 0.00 O ATOM 3284 CB LEU C 8 2.164 0.438 10.858 1.00 0.00 C ATOM 3285 CG LEU C 8 1.210 1.608 11.105 1.00 0.00 C ATOM 3286 CD1 LEU C 8 0.864 2.275 9.772 1.00 0.00 C ATOM 3287 CD2 LEU C 8 -0.071 1.091 11.764 1.00 0.00 C ATOM 0 H LEU C 8 4.427 -0.405 11.383 1.00 0.00 H new ATOM 0 HA LEU C 8 2.393 0.478 12.998 1.00 0.00 H new ATOM 0 HB2 LEU C 8 3.078 0.795 10.383 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.708 -0.278 10.174 1.00 0.00 H new ATOM 0 HG LEU C 8 1.689 2.335 11.761 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.184 3.109 9.948 1.00 0.00 H new ATOM 0 HD12 LEU C 8 1.776 2.643 9.302 1.00 0.00 H new ATOM 0 HD13 LEU C 8 0.385 1.549 9.115 1.00 0.00 H new ATOM 0 HD21 LEU C 8 -0.751 1.924 11.940 1.00 0.00 H new ATOM 0 HD22 LEU C 8 -0.550 0.364 11.108 1.00 0.00 H new ATOM 0 HD23 LEU C 8 0.175 0.616 12.714 1.00 0.00 H new ATOM 3299 N THR C 9 1.709 -2.483 11.687 1.00 0.00 N ATOM 3300 CA THR C 9 0.844 -3.648 11.829 1.00 0.00 C ATOM 3301 C THR C 9 0.694 -4.027 13.299 1.00 0.00 C ATOM 3302 O THR C 9 -0.399 -3.950 13.861 1.00 0.00 O ATOM 3303 CB THR C 9 1.428 -4.831 11.052 1.00 0.00 C ATOM 3304 OG1 THR C 9 2.762 -5.064 11.481 1.00 0.00 O ATOM 3305 CG2 THR C 9 1.418 -4.516 9.556 1.00 0.00 C ATOM 0 H THR C 9 2.444 -2.581 10.986 1.00 0.00 H new ATOM 0 HA THR C 9 -0.138 -3.399 11.427 1.00 0.00 H new ATOM 0 HB THR C 9 0.826 -5.721 11.237 1.00 0.00 H new ATOM 0 HG1 THR C 9 3.137 -5.822 10.986 1.00 0.00 H new ATOM 0 HG21 THR C 9 1.834 -5.359 9.004 1.00 0.00 H new ATOM 0 HG22 THR C 9 0.394 -4.338 9.229 1.00 0.00 H new ATOM 0 HG23 THR C 9 2.019 -3.627 9.367 1.00 0.00 H new ATOM 3313 N GLY C 10 1.798 -4.436 13.915 1.00 0.00 N ATOM 3314 CA GLY C 10 1.777 -4.825 15.321 1.00 0.00 C ATOM 3315 C GLY C 10 2.860 -5.856 15.616 1.00 0.00 C ATOM 3316 O GLY C 10 2.571 -7.039 15.797 1.00 0.00 O ATOM 0 H GLY C 10 2.712 -4.507 13.468 1.00 0.00 H new ATOM 0 HA2 GLY C 10 1.926 -3.946 15.948 1.00 0.00 H new ATOM 0 HA3 GLY C 10 0.800 -5.236 15.574 1.00 0.00 H new ATOM 3320 N LYS C 11 4.108 -5.401 15.664 1.00 0.00 N ATOM 3321 CA LYS C 11 5.226 -6.296 15.939 1.00 0.00 C ATOM 3322 C LYS C 11 6.491 -5.498 16.241 1.00 0.00 C ATOM 3323 O LYS C 11 6.885 -4.625 15.468 1.00 0.00 O ATOM 3324 CB LYS C 11 5.472 -7.209 14.737 1.00 0.00 C ATOM 3325 CG LYS C 11 6.528 -8.256 15.098 1.00 0.00 C ATOM 3326 CD LYS C 11 6.711 -9.222 13.925 1.00 0.00 C ATOM 3327 CE LYS C 11 7.844 -10.200 14.242 1.00 0.00 C ATOM 3328 NZ LYS C 11 7.925 -11.231 13.169 1.00 0.00 N1+ ATOM 0 H LYS C 11 4.369 -4.426 15.517 1.00 0.00 H new ATOM 0 HA LYS C 11 4.976 -6.901 16.810 1.00 0.00 H new ATOM 0 HB2 LYS C 11 4.544 -7.700 14.444 1.00 0.00 H new ATOM 0 HB3 LYS C 11 5.806 -6.621 13.882 1.00 0.00 H new ATOM 0 HG2 LYS C 11 7.474 -7.768 15.332 1.00 0.00 H new ATOM 0 HG3 LYS C 11 6.223 -8.804 15.990 1.00 0.00 H new ATOM 0 HD2 LYS C 11 5.786 -9.768 13.742 1.00 0.00 H new ATOM 0 HD3 LYS C 11 6.939 -8.667 13.015 1.00 0.00 H new ATOM 0 HE2 LYS C 11 8.790 -9.664 14.319 1.00 0.00 H new ATOM 0 HE3 LYS C 11 7.668 -10.676 15.206 1.00 0.00 H new ATOM 0 HZ1 LYS C 11 7.980 -12.176 13.599 1.00 0.00 H new ATOM 0 HZ2 LYS C 11 7.079 -11.173 12.567 1.00 0.00 H new ATOM 0 HZ3 LYS C 11 8.773 -11.064 12.591 1.00 0.00 H new ATOM 3342 N THR C 12 7.123 -5.807 17.369 1.00 0.00 N ATOM 3343 CA THR C 12 8.345 -5.114 17.765 1.00 0.00 C ATOM 3344 C THR C 12 9.566 -5.983 17.483 1.00 0.00 C ATOM 3345 O THR C 12 9.610 -7.152 17.868 1.00 0.00 O ATOM 3346 CB THR C 12 8.292 -4.771 19.255 1.00 0.00 C ATOM 3347 OG1 THR C 12 7.100 -4.050 19.532 1.00 0.00 O ATOM 3348 CG2 THR C 12 9.505 -3.918 19.628 1.00 0.00 C ATOM 0 H THR C 12 6.812 -6.527 18.021 1.00 0.00 H new ATOM 0 HA THR C 12 8.425 -4.195 17.185 1.00 0.00 H new ATOM 0 HB THR C 12 8.304 -5.691 19.840 1.00 0.00 H new ATOM 0 HG1 THR C 12 7.064 -3.831 20.487 1.00 0.00 H new ATOM 0 HG21 THR C 12 9.466 -3.674 20.690 1.00 0.00 H new ATOM 0 HG22 THR C 12 10.419 -4.473 19.416 1.00 0.00 H new ATOM 0 HG23 THR C 12 9.496 -2.998 19.044 1.00 0.00 H new ATOM 3356 N ILE C 13 10.556 -5.405 16.809 1.00 0.00 N ATOM 3357 CA ILE C 13 11.774 -6.138 16.480 1.00 0.00 C ATOM 3358 C ILE C 13 12.981 -5.512 17.172 1.00 0.00 C ATOM 3359 O ILE C 13 13.197 -4.302 17.091 1.00 0.00 O ATOM 3360 CB ILE C 13 11.993 -6.134 14.966 1.00 0.00 C ATOM 3361 CG1 ILE C 13 10.646 -6.298 14.257 1.00 0.00 C ATOM 3362 CG2 ILE C 13 12.915 -7.292 14.580 1.00 0.00 C ATOM 3363 CD1 ILE C 13 10.870 -6.367 12.745 1.00 0.00 C ATOM 0 H ILE C 13 10.540 -4.439 16.482 1.00 0.00 H new ATOM 0 HA ILE C 13 11.662 -7.165 16.828 1.00 0.00 H new ATOM 0 HB ILE C 13 12.450 -5.191 14.668 1.00 0.00 H new ATOM 0 HG12 ILE C 13 10.149 -7.204 14.603 1.00 0.00 H new ATOM 0 HG13 ILE C 13 9.991 -5.462 14.500 1.00 0.00 H new ATOM 0 HG21 ILE C 13 13.071 -7.289 13.501 1.00 0.00 H new ATOM 0 HG22 ILE C 13 13.874 -7.178 15.086 1.00 0.00 H new ATOM 0 HG23 ILE C 13 12.458 -8.236 14.878 1.00 0.00 H new ATOM 0 HD11 ILE C 13 9.911 -6.484 12.240 1.00 0.00 H new ATOM 0 HD12 ILE C 13 11.349 -5.449 12.406 1.00 0.00 H new ATOM 0 HD13 ILE C 13 11.510 -7.218 12.510 1.00 0.00 H new ATOM 3375 N THR C 14 13.764 -6.344 17.849 1.00 0.00 N ATOM 3376 CA THR C 14 14.950 -5.865 18.550 1.00 0.00 C ATOM 3377 C THR C 14 16.182 -5.993 17.660 1.00 0.00 C ATOM 3378 O THR C 14 16.499 -7.081 17.179 1.00 0.00 O ATOM 3379 CB THR C 14 15.159 -6.671 19.833 1.00 0.00 C ATOM 3380 OG1 THR C 14 13.925 -6.774 20.531 1.00 0.00 O ATOM 3381 CG2 THR C 14 16.190 -5.969 20.716 1.00 0.00 C ATOM 0 H THR C 14 13.601 -7.348 17.927 1.00 0.00 H new ATOM 0 HA THR C 14 14.803 -4.815 18.802 1.00 0.00 H new ATOM 0 HB THR C 14 15.519 -7.669 19.582 1.00 0.00 H new ATOM 0 HG1 THR C 14 13.611 -5.878 20.774 1.00 0.00 H new ATOM 0 HG21 THR C 14 16.338 -6.544 21.630 1.00 0.00 H new ATOM 0 HG22 THR C 14 17.135 -5.891 20.179 1.00 0.00 H new ATOM 0 HG23 THR C 14 15.833 -4.971 20.969 1.00 0.00 H new ATOM 3389 N LEU C 15 16.871 -4.877 17.441 1.00 0.00 N ATOM 3390 CA LEU C 15 18.065 -4.882 16.601 1.00 0.00 C ATOM 3391 C LEU C 15 19.217 -4.159 17.292 1.00 0.00 C ATOM 3392 O LEU C 15 19.061 -3.034 17.767 1.00 0.00 O ATOM 3393 CB LEU C 15 17.766 -4.202 15.264 1.00 0.00 C ATOM 3394 CG LEU C 15 16.542 -4.854 14.617 1.00 0.00 C ATOM 3395 CD1 LEU C 15 16.043 -3.976 13.469 1.00 0.00 C ATOM 3396 CD2 LEU C 15 16.925 -6.233 14.073 1.00 0.00 C ATOM 0 H LEU C 15 16.627 -3.966 17.829 1.00 0.00 H new ATOM 0 HA LEU C 15 18.355 -5.918 16.428 1.00 0.00 H new ATOM 0 HB2 LEU C 15 17.585 -3.138 15.418 1.00 0.00 H new ATOM 0 HB3 LEU C 15 18.628 -4.286 14.602 1.00 0.00 H new ATOM 0 HG LEU C 15 15.753 -4.963 15.362 1.00 0.00 H new ATOM 0 HD11 LEU C 15 15.171 -4.440 13.008 1.00 0.00 H new ATOM 0 HD12 LEU C 15 15.770 -2.994 13.854 1.00 0.00 H new ATOM 0 HD13 LEU C 15 16.832 -3.867 12.725 1.00 0.00 H new ATOM 0 HD21 LEU C 15 16.053 -6.697 13.612 1.00 0.00 H new ATOM 0 HD22 LEU C 15 17.714 -6.124 13.329 1.00 0.00 H new ATOM 0 HD23 LEU C 15 17.281 -6.860 14.890 1.00 0.00 H new ATOM 3408 N GLU C 16 20.375 -4.811 17.339 1.00 0.00 N ATOM 3409 CA GLU C 16 21.551 -4.220 17.968 1.00 0.00 C ATOM 3410 C GLU C 16 22.333 -3.390 16.954 1.00 0.00 C ATOM 3411 O GLU C 16 23.028 -3.936 16.097 1.00 0.00 O ATOM 3412 CB GLU C 16 22.451 -5.319 18.535 1.00 0.00 C ATOM 3413 CG GLU C 16 21.620 -6.260 19.410 1.00 0.00 C ATOM 3414 CD GLU C 16 20.760 -7.164 18.534 1.00 0.00 C ATOM 3415 OE1 GLU C 16 21.067 -7.286 17.360 1.00 0.00 O ATOM 3416 OE2 GLU C 16 19.806 -7.723 19.051 1.00 0.00 O1- ATOM 0 H GLU C 16 20.524 -5.743 16.952 1.00 0.00 H new ATOM 0 HA GLU C 16 21.221 -3.571 18.779 1.00 0.00 H new ATOM 0 HB2 GLU C 16 22.917 -5.877 17.723 1.00 0.00 H new ATOM 0 HB3 GLU C 16 23.257 -4.877 19.121 1.00 0.00 H new ATOM 0 HG2 GLU C 16 22.278 -6.864 20.035 1.00 0.00 H new ATOM 0 HG3 GLU C 16 20.986 -5.681 20.081 1.00 0.00 H new ATOM 3423 N VAL C 17 22.209 -2.071 17.055 1.00 0.00 N ATOM 3424 CA VAL C 17 22.905 -1.175 16.136 1.00 0.00 C ATOM 3425 C VAL C 17 23.770 -0.179 16.901 1.00 0.00 C ATOM 3426 O VAL C 17 23.856 -0.228 18.128 1.00 0.00 O ATOM 3427 CB VAL C 17 21.887 -0.415 15.285 1.00 0.00 C ATOM 3428 CG1 VAL C 17 20.906 -1.406 14.655 1.00 0.00 C ATOM 3429 CG2 VAL C 17 21.118 0.569 16.172 1.00 0.00 C ATOM 0 H VAL C 17 21.638 -1.601 17.757 1.00 0.00 H new ATOM 0 HA VAL C 17 23.549 -1.775 15.493 1.00 0.00 H new ATOM 0 HB VAL C 17 22.406 0.131 14.498 1.00 0.00 H new ATOM 0 HG11 VAL C 17 20.180 -0.864 14.048 1.00 0.00 H new ATOM 0 HG12 VAL C 17 21.452 -2.109 14.026 1.00 0.00 H new ATOM 0 HG13 VAL C 17 20.385 -1.952 15.441 1.00 0.00 H new ATOM 0 HG21 VAL C 17 20.391 1.112 15.568 1.00 0.00 H new ATOM 0 HG22 VAL C 17 20.599 0.021 16.958 1.00 0.00 H new ATOM 0 HG23 VAL C 17 21.816 1.275 16.622 1.00 0.00 H new ATOM 3439 N GLU C 18 24.406 0.727 16.165 1.00 0.00 N ATOM 3440 CA GLU C 18 25.261 1.739 16.776 1.00 0.00 C ATOM 3441 C GLU C 18 24.807 3.136 16.357 1.00 0.00 C ATOM 3442 O GLU C 18 23.900 3.282 15.538 1.00 0.00 O ATOM 3443 CB GLU C 18 26.716 1.516 16.352 1.00 0.00 C ATOM 3444 CG GLU C 18 26.939 0.032 16.052 1.00 0.00 C ATOM 3445 CD GLU C 18 28.423 -0.239 15.832 1.00 0.00 C ATOM 3446 OE1 GLU C 18 29.150 0.712 15.597 1.00 0.00 O ATOM 3447 OE2 GLU C 18 28.812 -1.393 15.903 1.00 0.00 O1- ATOM 0 H GLU C 18 24.346 0.781 15.148 1.00 0.00 H new ATOM 0 HA GLU C 18 25.187 1.655 17.860 1.00 0.00 H new ATOM 0 HB2 GLU C 18 26.945 2.114 15.470 1.00 0.00 H new ATOM 0 HB3 GLU C 18 27.391 1.843 17.143 1.00 0.00 H new ATOM 0 HG2 GLU C 18 26.569 -0.574 16.879 1.00 0.00 H new ATOM 0 HG3 GLU C 18 26.373 -0.257 15.167 1.00 0.00 H new ATOM 3454 N PRO C 19 25.414 4.157 16.903 1.00 0.00 N ATOM 3455 CA PRO C 19 25.065 5.568 16.583 1.00 0.00 C ATOM 3456 C PRO C 19 25.592 5.996 15.215 1.00 0.00 C ATOM 3457 O PRO C 19 25.084 6.942 14.614 1.00 0.00 O ATOM 3458 CB PRO C 19 25.721 6.390 17.705 1.00 0.00 C ATOM 3459 CG PRO C 19 26.409 5.417 18.618 1.00 0.00 C ATOM 3460 CD PRO C 19 26.498 4.082 17.882 1.00 0.00 C ATOM 0 HA PRO C 19 23.986 5.711 16.531 1.00 0.00 H new ATOM 0 HB2 PRO C 19 26.435 7.103 17.293 1.00 0.00 H new ATOM 0 HB3 PRO C 19 24.972 6.966 18.249 1.00 0.00 H new ATOM 0 HG2 PRO C 19 27.404 5.776 18.882 1.00 0.00 H new ATOM 0 HG3 PRO C 19 25.853 5.305 19.549 1.00 0.00 H new ATOM 0 HD2 PRO C 19 27.467 3.954 17.399 1.00 0.00 H new ATOM 0 HD3 PRO C 19 26.367 3.240 18.562 1.00 0.00 H new ATOM 3468 N SER C 20 26.611 5.295 14.729 1.00 0.00 N ATOM 3469 CA SER C 20 27.193 5.616 13.431 1.00 0.00 C ATOM 3470 C SER C 20 26.556 4.771 12.333 1.00 0.00 C ATOM 3471 O SER C 20 26.828 4.970 11.148 1.00 0.00 O ATOM 3472 CB SER C 20 28.701 5.366 13.458 1.00 0.00 C ATOM 3473 OG SER C 20 29.308 6.036 12.361 1.00 0.00 O ATOM 0 H SER C 20 27.048 4.508 15.209 1.00 0.00 H new ATOM 0 HA SER C 20 27.003 6.668 13.220 1.00 0.00 H new ATOM 0 HB2 SER C 20 29.124 5.724 14.397 1.00 0.00 H new ATOM 0 HB3 SER C 20 28.905 4.297 13.404 1.00 0.00 H new ATOM 0 HG SER C 20 28.792 5.863 11.546 1.00 0.00 H new ATOM 3479 N ASP C 21 25.708 3.829 12.732 1.00 0.00 N ATOM 3480 CA ASP C 21 25.040 2.961 11.769 1.00 0.00 C ATOM 3481 C ASP C 21 24.159 3.780 10.832 1.00 0.00 C ATOM 3482 O ASP C 21 23.463 4.700 11.263 1.00 0.00 O ATOM 3483 CB ASP C 21 24.185 1.926 12.501 1.00 0.00 C ATOM 3484 CG ASP C 21 25.081 0.961 13.270 1.00 0.00 C ATOM 3485 OD1 ASP C 21 26.259 1.251 13.394 1.00 0.00 O ATOM 3486 OD2 ASP C 21 24.575 -0.052 13.723 1.00 0.00 O1- ATOM 0 H ASP C 21 25.468 3.648 13.707 1.00 0.00 H new ATOM 0 HA ASP C 21 25.802 2.450 11.180 1.00 0.00 H new ATOM 0 HB2 ASP C 21 23.502 2.426 13.187 1.00 0.00 H new ATOM 0 HB3 ASP C 21 23.573 1.376 11.786 1.00 0.00 H new ATOM 3491 N THR C 22 24.197 3.438 9.548 1.00 0.00 N ATOM 3492 CA THR C 22 23.401 4.146 8.554 1.00 0.00 C ATOM 3493 C THR C 22 22.013 3.526 8.432 1.00 0.00 C ATOM 3494 O THR C 22 21.862 2.304 8.466 1.00 0.00 O ATOM 3495 CB THR C 22 24.103 4.099 7.194 1.00 0.00 C ATOM 3496 OG1 THR C 22 23.817 2.861 6.559 1.00 0.00 O ATOM 3497 CG2 THR C 22 25.613 4.237 7.392 1.00 0.00 C ATOM 0 H THR C 22 24.767 2.679 9.174 1.00 0.00 H new ATOM 0 HA THR C 22 23.295 5.182 8.875 1.00 0.00 H new ATOM 0 HB THR C 22 23.745 4.919 6.571 1.00 0.00 H new ATOM 0 HG1 THR C 22 24.264 2.829 5.687 1.00 0.00 H new ATOM 0 HG21 THR C 22 26.112 4.203 6.423 1.00 0.00 H new ATOM 0 HG22 THR C 22 25.831 5.187 7.879 1.00 0.00 H new ATOM 0 HG23 THR C 22 25.975 3.419 8.015 1.00 0.00 H new ATOM 3505 N ILE C 23 21.002 4.377 8.287 1.00 0.00 N ATOM 3506 CA ILE C 23 19.630 3.902 8.156 1.00 0.00 C ATOM 3507 C ILE C 23 19.561 2.754 7.156 1.00 0.00 C ATOM 3508 O ILE C 23 18.956 1.716 7.427 1.00 0.00 O ATOM 3509 CB ILE C 23 18.725 5.044 7.692 1.00 0.00 C ATOM 3510 CG1 ILE C 23 18.844 6.222 8.664 1.00 0.00 C ATOM 3511 CG2 ILE C 23 17.274 4.563 7.648 1.00 0.00 C ATOM 3512 CD1 ILE C 23 18.561 5.746 10.091 1.00 0.00 C ATOM 0 H ILE C 23 21.106 5.391 8.257 1.00 0.00 H new ATOM 0 HA ILE C 23 19.290 3.545 9.128 1.00 0.00 H new ATOM 0 HB ILE C 23 19.031 5.364 6.696 1.00 0.00 H new ATOM 0 HG12 ILE C 23 19.843 6.654 8.606 1.00 0.00 H new ATOM 0 HG13 ILE C 23 18.141 7.007 8.386 1.00 0.00 H new ATOM 0 HG21 ILE C 23 16.630 5.378 7.317 1.00 0.00 H new ATOM 0 HG22 ILE C 23 17.188 3.728 6.953 1.00 0.00 H new ATOM 0 HG23 ILE C 23 16.968 4.240 8.643 1.00 0.00 H new ATOM 0 HD11 ILE C 23 18.647 6.587 10.779 1.00 0.00 H new ATOM 0 HD12 ILE C 23 17.553 5.335 10.144 1.00 0.00 H new ATOM 0 HD13 ILE C 23 19.282 4.976 10.367 1.00 0.00 H new ATOM 3524 N GLU C 24 20.187 2.945 5.999 1.00 0.00 N ATOM 3525 CA GLU C 24 20.193 1.916 4.968 1.00 0.00 C ATOM 3526 C GLU C 24 20.655 0.586 5.552 1.00 0.00 C ATOM 3527 O GLU C 24 20.108 -0.469 5.231 1.00 0.00 O ATOM 3528 CB GLU C 24 21.120 2.327 3.822 1.00 0.00 C ATOM 3529 CG GLU C 24 21.187 1.200 2.790 1.00 0.00 C ATOM 3530 CD GLU C 24 21.758 1.727 1.478 1.00 0.00 C ATOM 3531 OE1 GLU C 24 22.962 1.909 1.409 1.00 0.00 O ATOM 3532 OE2 GLU C 24 20.982 1.942 0.561 1.00 0.00 O1- ATOM 0 H GLU C 24 20.693 3.796 5.754 1.00 0.00 H new ATOM 0 HA GLU C 24 19.179 1.801 4.585 1.00 0.00 H new ATOM 0 HB2 GLU C 24 20.754 3.241 3.354 1.00 0.00 H new ATOM 0 HB3 GLU C 24 22.117 2.542 4.206 1.00 0.00 H new ATOM 0 HG2 GLU C 24 21.809 0.388 3.166 1.00 0.00 H new ATOM 0 HG3 GLU C 24 20.191 0.789 2.624 1.00 0.00 H new ATOM 3539 N ASN C 25 21.662 0.645 6.418 1.00 0.00 N ATOM 3540 CA ASN C 25 22.184 -0.561 7.047 1.00 0.00 C ATOM 3541 C ASN C 25 21.102 -1.222 7.892 1.00 0.00 C ATOM 3542 O ASN C 25 20.931 -2.441 7.860 1.00 0.00 O ATOM 3543 CB ASN C 25 23.386 -0.215 7.929 1.00 0.00 C ATOM 3544 CG ASN C 25 24.173 -1.479 8.258 1.00 0.00 C ATOM 3545 OD1 ASN C 25 23.552 -2.511 8.759 1.00 0.00 O flip ATOM 3546 ND2 ASN C 25 25.386 -1.527 8.054 1.00 0.00 N flip ATOM 0 H ASN C 25 22.129 1.508 6.698 1.00 0.00 H new ATOM 0 HA ASN C 25 22.500 -1.253 6.267 1.00 0.00 H new ATOM 0 HB2 ASN C 25 24.029 0.501 7.417 1.00 0.00 H new ATOM 0 HB3 ASN C 25 23.047 0.262 8.849 1.00 0.00 H new ATOM 0 HD21 ASN C 25 25.870 -0.719 7.662 1.00 0.00 H new ATOM 0 HD22 ASN C 25 25.907 -2.375 8.277 1.00 0.00 H new ATOM 3553 N VAL C 26 20.369 -0.407 8.644 1.00 0.00 N ATOM 3554 CA VAL C 26 19.299 -0.923 9.488 1.00 0.00 C ATOM 3555 C VAL C 26 18.260 -1.646 8.638 1.00 0.00 C ATOM 3556 O VAL C 26 17.849 -2.763 8.955 1.00 0.00 O ATOM 3557 CB VAL C 26 18.632 0.224 10.249 1.00 0.00 C ATOM 3558 CG1 VAL C 26 17.530 -0.334 11.152 1.00 0.00 C ATOM 3559 CG2 VAL C 26 19.677 0.941 11.107 1.00 0.00 C ATOM 0 H VAL C 26 20.495 0.604 8.686 1.00 0.00 H new ATOM 0 HA VAL C 26 19.727 -1.627 10.202 1.00 0.00 H new ATOM 0 HB VAL C 26 18.198 0.927 9.538 1.00 0.00 H new ATOM 0 HG11 VAL C 26 17.055 0.484 11.694 1.00 0.00 H new ATOM 0 HG12 VAL C 26 16.785 -0.847 10.543 1.00 0.00 H new ATOM 0 HG13 VAL C 26 17.964 -1.037 11.863 1.00 0.00 H new ATOM 0 HG21 VAL C 26 19.203 1.759 11.650 1.00 0.00 H new ATOM 0 HG22 VAL C 26 20.110 0.237 11.817 1.00 0.00 H new ATOM 0 HG23 VAL C 26 20.463 1.339 10.466 1.00 0.00 H new ATOM 3569 N LYS C 27 17.842 -1.001 7.552 1.00 0.00 N ATOM 3570 CA LYS C 27 16.855 -1.594 6.659 1.00 0.00 C ATOM 3571 C LYS C 27 17.311 -2.977 6.208 1.00 0.00 C ATOM 3572 O LYS C 27 16.518 -3.916 6.155 1.00 0.00 O ATOM 3573 CB LYS C 27 16.652 -0.698 5.434 1.00 0.00 C ATOM 3574 CG LYS C 27 15.943 0.592 5.853 1.00 0.00 C ATOM 3575 CD LYS C 27 15.354 1.275 4.617 1.00 0.00 C ATOM 3576 CE LYS C 27 15.082 2.749 4.926 1.00 0.00 C ATOM 3577 NZ LYS C 27 14.074 3.280 3.966 1.00 0.00 N1+ ATOM 0 H LYS C 27 18.169 -0.076 7.272 1.00 0.00 H new ATOM 0 HA LYS C 27 15.913 -1.689 7.198 1.00 0.00 H new ATOM 0 HB2 LYS C 27 17.614 -0.464 4.978 1.00 0.00 H new ATOM 0 HB3 LYS C 27 16.062 -1.221 4.682 1.00 0.00 H new ATOM 0 HG2 LYS C 27 15.153 0.369 6.570 1.00 0.00 H new ATOM 0 HG3 LYS C 27 16.645 1.260 6.351 1.00 0.00 H new ATOM 0 HD2 LYS C 27 16.045 1.190 3.778 1.00 0.00 H new ATOM 0 HD3 LYS C 27 14.430 0.779 4.320 1.00 0.00 H new ATOM 0 HE2 LYS C 27 14.718 2.856 5.948 1.00 0.00 H new ATOM 0 HE3 LYS C 27 16.006 3.323 4.854 1.00 0.00 H new ATOM 0 HZ1 LYS C 27 14.144 4.317 3.928 1.00 0.00 H new ATOM 0 HZ2 LYS C 27 14.254 2.886 3.021 1.00 0.00 H new ATOM 0 HZ3 LYS C 27 13.120 3.009 4.279 1.00 0.00 H new ATOM 3591 N ALA C 28 18.596 -3.093 5.889 1.00 0.00 N ATOM 3592 CA ALA C 28 19.150 -4.367 5.448 1.00 0.00 C ATOM 3593 C ALA C 28 18.968 -5.427 6.529 1.00 0.00 C ATOM 3594 O ALA C 28 18.571 -6.557 6.244 1.00 0.00 O ATOM 3595 CB ALA C 28 20.638 -4.208 5.127 1.00 0.00 C ATOM 0 H ALA C 28 19.268 -2.327 5.927 1.00 0.00 H new ATOM 0 HA ALA C 28 18.620 -4.684 4.550 1.00 0.00 H new ATOM 0 HB1 ALA C 28 21.044 -5.165 4.798 1.00 0.00 H new ATOM 0 HB2 ALA C 28 20.762 -3.470 4.335 1.00 0.00 H new ATOM 0 HB3 ALA C 28 21.169 -3.876 6.019 1.00 0.00 H new ATOM 3601 N LYS C 29 19.258 -5.053 7.771 1.00 0.00 N ATOM 3602 CA LYS C 29 19.118 -5.980 8.888 1.00 0.00 C ATOM 3603 C LYS C 29 17.678 -6.470 8.994 1.00 0.00 C ATOM 3604 O LYS C 29 17.429 -7.652 9.235 1.00 0.00 O ATOM 3605 CB LYS C 29 19.523 -5.293 10.194 1.00 0.00 C ATOM 3606 CG LYS C 29 21.049 -5.228 10.287 1.00 0.00 C ATOM 3607 CD LYS C 29 21.456 -4.701 11.665 1.00 0.00 C ATOM 3608 CE LYS C 29 22.976 -4.776 11.813 1.00 0.00 C ATOM 3609 NZ LYS C 29 23.607 -3.689 11.012 1.00 0.00 N1+ ATOM 0 H LYS C 29 19.589 -4.123 8.028 1.00 0.00 H new ATOM 0 HA LYS C 29 19.771 -6.834 8.712 1.00 0.00 H new ATOM 0 HB2 LYS C 29 19.103 -4.288 10.234 1.00 0.00 H new ATOM 0 HB3 LYS C 29 19.120 -5.841 11.045 1.00 0.00 H new ATOM 0 HG2 LYS C 29 21.476 -6.218 10.124 1.00 0.00 H new ATOM 0 HG3 LYS C 29 21.444 -4.578 9.506 1.00 0.00 H new ATOM 0 HD2 LYS C 29 21.119 -3.672 11.786 1.00 0.00 H new ATOM 0 HD3 LYS C 29 20.975 -5.288 12.447 1.00 0.00 H new ATOM 0 HE2 LYS C 29 23.255 -4.678 12.862 1.00 0.00 H new ATOM 0 HE3 LYS C 29 23.337 -5.748 11.476 1.00 0.00 H new ATOM 0 HZ1 LYS C 29 24.642 -3.770 11.071 1.00 0.00 H new ATOM 0 HZ2 LYS C 29 23.309 -3.772 10.019 1.00 0.00 H new ATOM 0 HZ3 LYS C 29 23.310 -2.765 11.386 1.00 0.00 H new ATOM 3623 N ILE C 30 16.732 -5.555 8.808 1.00 0.00 N ATOM 3624 CA ILE C 30 15.318 -5.905 8.882 1.00 0.00 C ATOM 3625 C ILE C 30 14.964 -6.917 7.798 1.00 0.00 C ATOM 3626 O ILE C 30 14.272 -7.902 8.056 1.00 0.00 O ATOM 3627 CB ILE C 30 14.459 -4.650 8.718 1.00 0.00 C ATOM 3628 CG1 ILE C 30 14.744 -3.689 9.877 1.00 0.00 C ATOM 3629 CG2 ILE C 30 12.978 -5.036 8.726 1.00 0.00 C ATOM 3630 CD1 ILE C 30 13.643 -2.628 9.949 1.00 0.00 C ATOM 0 H ILE C 30 16.917 -4.572 8.606 1.00 0.00 H new ATOM 0 HA ILE C 30 15.121 -6.350 9.857 1.00 0.00 H new ATOM 0 HB ILE C 30 14.699 -4.165 7.772 1.00 0.00 H new ATOM 0 HG12 ILE C 30 14.793 -4.241 10.816 1.00 0.00 H new ATOM 0 HG13 ILE C 30 15.714 -3.212 9.737 1.00 0.00 H new ATOM 0 HG21 ILE C 30 12.368 -4.140 8.609 1.00 0.00 H new ATOM 0 HG22 ILE C 30 12.776 -5.722 7.904 1.00 0.00 H new ATOM 0 HG23 ILE C 30 12.733 -5.521 9.671 1.00 0.00 H new ATOM 0 HD11 ILE C 30 13.848 -1.946 10.774 1.00 0.00 H new ATOM 0 HD12 ILE C 30 13.615 -2.068 9.014 1.00 0.00 H new ATOM 0 HD13 ILE C 30 12.680 -3.113 10.110 1.00 0.00 H new ATOM 3642 N GLN C 31 15.443 -6.668 6.583 1.00 0.00 N ATOM 3643 CA GLN C 31 15.172 -7.566 5.468 1.00 0.00 C ATOM 3644 C GLN C 31 15.658 -8.975 5.790 1.00 0.00 C ATOM 3645 O GLN C 31 15.015 -9.962 5.432 1.00 0.00 O ATOM 3646 CB GLN C 31 15.870 -7.059 4.205 1.00 0.00 C ATOM 3647 CG GLN C 31 15.388 -7.864 2.996 1.00 0.00 C ATOM 3648 CD GLN C 31 16.175 -7.462 1.754 1.00 0.00 C ATOM 3649 OE1 GLN C 31 17.182 -6.760 1.856 1.00 0.00 O ATOM 3650 NE2 GLN C 31 15.775 -7.867 0.580 1.00 0.00 N ATOM 0 H GLN C 31 16.016 -5.858 6.347 1.00 0.00 H new ATOM 0 HA GLN C 31 14.095 -7.593 5.299 1.00 0.00 H new ATOM 0 HB2 GLN C 31 15.656 -6.000 4.059 1.00 0.00 H new ATOM 0 HB3 GLN C 31 16.951 -7.154 4.311 1.00 0.00 H new ATOM 0 HG2 GLN C 31 15.512 -8.930 3.186 1.00 0.00 H new ATOM 0 HG3 GLN C 31 14.324 -7.691 2.834 1.00 0.00 H new ATOM 0 HE21 GLN C 31 14.941 -8.448 0.498 1.00 0.00 H new ATOM 0 HE22 GLN C 31 16.296 -7.602 -0.256 1.00 0.00 H new ATOM 3659 N ASP C 32 16.797 -9.061 6.469 1.00 0.00 N ATOM 3660 CA ASP C 32 17.361 -10.354 6.837 1.00 0.00 C ATOM 3661 C ASP C 32 16.493 -11.035 7.889 1.00 0.00 C ATOM 3662 O ASP C 32 16.497 -12.259 8.014 1.00 0.00 O ATOM 3663 CB ASP C 32 18.778 -10.170 7.383 1.00 0.00 C ATOM 3664 CG ASP C 32 19.349 -11.516 7.816 1.00 0.00 C ATOM 3665 OD1 ASP C 32 18.975 -12.514 7.223 1.00 0.00 O ATOM 3666 OD2 ASP C 32 20.152 -11.529 8.735 1.00 0.00 O1- ATOM 0 H ASP C 32 17.345 -8.256 6.774 1.00 0.00 H new ATOM 0 HA ASP C 32 17.395 -10.982 5.947 1.00 0.00 H new ATOM 0 HB2 ASP C 32 19.416 -9.724 6.620 1.00 0.00 H new ATOM 0 HB3 ASP C 32 18.764 -9.482 8.229 1.00 0.00 H new ATOM 3671 N LYS C 33 15.749 -10.232 8.644 1.00 0.00 N ATOM 3672 CA LYS C 33 14.878 -10.766 9.684 1.00 0.00 C ATOM 3673 C LYS C 33 13.555 -11.235 9.085 1.00 0.00 C ATOM 3674 O LYS C 33 13.234 -12.423 9.118 1.00 0.00 O ATOM 3675 CB LYS C 33 14.611 -9.694 10.743 1.00 0.00 C ATOM 3676 CG LYS C 33 15.818 -9.582 11.678 1.00 0.00 C ATOM 3677 CD LYS C 33 15.663 -10.568 12.838 1.00 0.00 C ATOM 3678 CE LYS C 33 16.861 -10.441 13.780 1.00 0.00 C ATOM 3679 NZ LYS C 33 16.820 -11.539 14.787 1.00 0.00 N1+ ATOM 0 H LYS C 33 15.732 -9.216 8.556 1.00 0.00 H new ATOM 0 HA LYS C 33 15.376 -11.618 10.148 1.00 0.00 H new ATOM 0 HB2 LYS C 33 14.420 -8.734 10.263 1.00 0.00 H new ATOM 0 HB3 LYS C 33 13.718 -9.948 11.314 1.00 0.00 H new ATOM 0 HG2 LYS C 33 16.736 -9.792 11.129 1.00 0.00 H new ATOM 0 HG3 LYS C 33 15.901 -8.565 12.061 1.00 0.00 H new ATOM 0 HD2 LYS C 33 14.739 -10.367 13.379 1.00 0.00 H new ATOM 0 HD3 LYS C 33 15.593 -11.587 12.456 1.00 0.00 H new ATOM 0 HE2 LYS C 33 17.790 -10.488 13.212 1.00 0.00 H new ATOM 0 HE3 LYS C 33 16.842 -9.473 14.281 1.00 0.00 H new ATOM 0 HZ1 LYS C 33 17.635 -11.453 15.428 1.00 0.00 H new ATOM 0 HZ2 LYS C 33 15.939 -11.474 15.336 1.00 0.00 H new ATOM 0 HZ3 LYS C 33 16.858 -12.458 14.301 1.00 0.00 H new ATOM 3693 N GLU C 34 12.791 -10.294 8.540 1.00 0.00 N ATOM 3694 CA GLU C 34 11.504 -10.622 7.937 1.00 0.00 C ATOM 3695 C GLU C 34 11.677 -10.977 6.464 1.00 0.00 C ATOM 3696 O GLU C 34 12.088 -12.088 6.127 1.00 0.00 O ATOM 3697 CB GLU C 34 10.548 -9.435 8.068 1.00 0.00 C ATOM 3698 CG GLU C 34 10.197 -9.221 9.541 1.00 0.00 C ATOM 3699 CD GLU C 34 9.323 -10.366 10.041 1.00 0.00 C ATOM 3700 OE1 GLU C 34 8.368 -10.698 9.358 1.00 0.00 O ATOM 3701 OE2 GLU C 34 9.622 -10.895 11.099 1.00 0.00 O1- ATOM 0 H GLU C 34 13.038 -9.305 8.503 1.00 0.00 H new ATOM 0 HA GLU C 34 11.088 -11.483 8.460 1.00 0.00 H new ATOM 0 HB2 GLU C 34 11.010 -8.536 7.659 1.00 0.00 H new ATOM 0 HB3 GLU C 34 9.642 -9.619 7.491 1.00 0.00 H new ATOM 0 HG2 GLU C 34 11.109 -9.162 10.136 1.00 0.00 H new ATOM 0 HG3 GLU C 34 9.674 -8.273 9.665 1.00 0.00 H new ATOM 3708 N GLY C 35 11.361 -10.026 5.591 1.00 0.00 N ATOM 3709 CA GLY C 35 11.485 -10.247 4.156 1.00 0.00 C ATOM 3710 C GLY C 35 10.956 -9.049 3.375 1.00 0.00 C ATOM 3711 O GLY C 35 10.642 -9.157 2.190 1.00 0.00 O ATOM 0 H GLY C 35 11.019 -9.101 5.850 1.00 0.00 H new ATOM 0 HA2 GLY C 35 12.530 -10.421 3.899 1.00 0.00 H new ATOM 0 HA3 GLY C 35 10.934 -11.144 3.873 1.00 0.00 H new ATOM 3715 N ILE C 36 10.860 -7.908 4.050 1.00 0.00 N ATOM 3716 CA ILE C 36 10.367 -6.692 3.413 1.00 0.00 C ATOM 3717 C ILE C 36 11.511 -5.941 2.736 1.00 0.00 C ATOM 3718 O ILE C 36 12.366 -5.363 3.407 1.00 0.00 O ATOM 3719 CB ILE C 36 9.710 -5.789 4.458 1.00 0.00 C ATOM 3720 CG1 ILE C 36 8.552 -6.538 5.123 1.00 0.00 C ATOM 3721 CG2 ILE C 36 9.176 -4.526 3.780 1.00 0.00 C ATOM 3722 CD1 ILE C 36 8.116 -5.790 6.384 1.00 0.00 C ATOM 0 H ILE C 36 11.115 -7.800 5.032 1.00 0.00 H new ATOM 0 HA ILE C 36 9.632 -6.970 2.657 1.00 0.00 H new ATOM 0 HB ILE C 36 10.447 -5.512 5.212 1.00 0.00 H new ATOM 0 HG12 ILE C 36 7.715 -6.623 4.430 1.00 0.00 H new ATOM 0 HG13 ILE C 36 8.860 -7.552 5.377 1.00 0.00 H new ATOM 0 HG21 ILE C 36 8.708 -3.883 4.525 1.00 0.00 H new ATOM 0 HG22 ILE C 36 9.999 -3.992 3.306 1.00 0.00 H new ATOM 0 HG23 ILE C 36 8.440 -4.802 3.025 1.00 0.00 H new ATOM 0 HD11 ILE C 36 7.292 -6.324 6.857 1.00 0.00 H new ATOM 0 HD12 ILE C 36 8.954 -5.728 7.078 1.00 0.00 H new ATOM 0 HD13 ILE C 36 7.791 -4.784 6.117 1.00 0.00 H new ATOM 3734 N PRO C 37 11.543 -5.941 1.428 1.00 0.00 N ATOM 3735 CA PRO C 37 12.606 -5.248 0.651 1.00 0.00 C ATOM 3736 C PRO C 37 12.876 -3.841 1.183 1.00 0.00 C ATOM 3737 O PRO C 37 11.947 -3.106 1.520 1.00 0.00 O ATOM 3738 CB PRO C 37 12.063 -5.193 -0.786 1.00 0.00 C ATOM 3739 CG PRO C 37 10.714 -5.849 -0.773 1.00 0.00 C ATOM 3740 CD PRO C 37 10.575 -6.600 0.550 1.00 0.00 C ATOM 0 HA PRO C 37 13.559 -5.773 0.720 1.00 0.00 H new ATOM 0 HB2 PRO C 37 11.986 -4.161 -1.130 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.735 -5.708 -1.472 1.00 0.00 H new ATOM 0 HG2 PRO C 37 9.925 -5.103 -0.874 1.00 0.00 H new ATOM 0 HG3 PRO C 37 10.614 -6.535 -1.614 1.00 0.00 H new ATOM 0 HD2 PRO C 37 9.562 -6.529 0.946 1.00 0.00 H new ATOM 0 HD3 PRO C 37 10.798 -7.661 0.433 1.00 0.00 H new ATOM 3748 N PRO C 38 14.124 -3.459 1.265 1.00 0.00 N ATOM 3749 CA PRO C 38 14.524 -2.117 1.767 1.00 0.00 C ATOM 3750 C PRO C 38 13.693 -0.999 1.142 1.00 0.00 C ATOM 3751 O PRO C 38 13.240 -0.087 1.834 1.00 0.00 O ATOM 3752 CB PRO C 38 16.003 -1.978 1.372 1.00 0.00 C ATOM 3753 CG PRO C 38 16.390 -3.238 0.654 1.00 0.00 C ATOM 3754 CD PRO C 38 15.285 -4.267 0.889 1.00 0.00 C ATOM 0 HA PRO C 38 14.364 -2.032 2.842 1.00 0.00 H new ATOM 0 HB2 PRO C 38 16.150 -1.109 0.731 1.00 0.00 H new ATOM 0 HB3 PRO C 38 16.625 -1.832 2.255 1.00 0.00 H new ATOM 0 HG2 PRO C 38 16.514 -3.048 -0.412 1.00 0.00 H new ATOM 0 HG3 PRO C 38 17.345 -3.611 1.025 1.00 0.00 H new ATOM 0 HD2 PRO C 38 15.089 -4.854 -0.008 1.00 0.00 H new ATOM 0 HD3 PRO C 38 15.555 -4.970 1.677 1.00 0.00 H new ATOM 3762 N ASP C 39 13.501 -1.075 -0.171 1.00 0.00 N ATOM 3763 CA ASP C 39 12.727 -0.062 -0.881 1.00 0.00 C ATOM 3764 C ASP C 39 11.247 -0.160 -0.521 1.00 0.00 C ATOM 3765 O ASP C 39 10.381 0.197 -1.319 1.00 0.00 O ATOM 3766 CB ASP C 39 12.899 -0.238 -2.391 1.00 0.00 C ATOM 3767 CG ASP C 39 12.335 0.974 -3.125 1.00 0.00 C ATOM 3768 OD1 ASP C 39 11.732 1.810 -2.473 1.00 0.00 O ATOM 3769 OD2 ASP C 39 12.515 1.048 -4.330 1.00 0.00 O1- ATOM 0 H ASP C 39 13.867 -1.821 -0.762 1.00 0.00 H new ATOM 0 HA ASP C 39 13.094 0.920 -0.584 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.955 -0.361 -2.633 1.00 0.00 H new ATOM 0 HB3 ASP C 39 12.389 -1.143 -2.720 1.00 0.00 H new ATOM 3774 N GLN C 40 10.965 -0.643 0.684 1.00 0.00 N ATOM 3775 CA GLN C 40 9.585 -0.781 1.137 1.00 0.00 C ATOM 3776 C GLN C 40 9.516 -0.749 2.660 1.00 0.00 C ATOM 3777 O GLN C 40 8.862 -1.589 3.279 1.00 0.00 O ATOM 3778 CB GLN C 40 8.994 -2.096 0.624 1.00 0.00 C ATOM 3779 CG GLN C 40 8.872 -2.043 -0.901 1.00 0.00 C ATOM 3780 CD GLN C 40 7.956 -3.160 -1.390 1.00 0.00 C ATOM 3781 OE1 GLN C 40 7.396 -3.960 -0.524 1.00 0.00 O flip ATOM 3782 NE2 GLN C 40 7.744 -3.307 -2.594 1.00 0.00 N flip ATOM 0 H GLN C 40 11.667 -0.943 1.360 1.00 0.00 H new ATOM 0 HA GLN C 40 9.007 0.054 0.741 1.00 0.00 H new ATOM 0 HB2 GLN C 40 9.629 -2.931 0.919 1.00 0.00 H new ATOM 0 HB3 GLN C 40 8.015 -2.266 1.072 1.00 0.00 H new ATOM 0 HG2 GLN C 40 8.476 -1.075 -1.209 1.00 0.00 H new ATOM 0 HG3 GLN C 40 9.857 -2.144 -1.357 1.00 0.00 H new ATOM 0 HE21 GLN C 40 8.183 -2.681 -3.269 1.00 0.00 H new ATOM 0 HE22 GLN C 40 7.130 -4.055 -2.916 1.00 0.00 H new ATOM 3791 N GLN C 41 10.196 0.224 3.258 1.00 0.00 N ATOM 3792 CA GLN C 41 10.205 0.354 4.711 1.00 0.00 C ATOM 3793 C GLN C 41 10.385 1.813 5.119 1.00 0.00 C ATOM 3794 O GLN C 41 11.504 2.325 5.150 1.00 0.00 O ATOM 3795 CB GLN C 41 11.339 -0.483 5.304 1.00 0.00 C ATOM 3796 CG GLN C 41 11.119 -1.958 4.964 1.00 0.00 C ATOM 3797 CD GLN C 41 12.071 -2.828 5.779 1.00 0.00 C ATOM 3798 OE1 GLN C 41 12.625 -2.373 6.779 1.00 0.00 O ATOM 3799 NE2 GLN C 41 12.295 -4.058 5.408 1.00 0.00 N ATOM 0 H GLN C 41 10.744 0.929 2.764 1.00 0.00 H new ATOM 0 HA GLN C 41 9.249 -0.004 5.093 1.00 0.00 H new ATOM 0 HB2 GLN C 41 12.298 -0.147 4.909 1.00 0.00 H new ATOM 0 HB3 GLN C 41 11.376 -0.350 6.385 1.00 0.00 H new ATOM 0 HG2 GLN C 41 10.087 -2.238 5.174 1.00 0.00 H new ATOM 0 HG3 GLN C 41 11.284 -2.123 3.899 1.00 0.00 H new ATOM 0 HE21 GLN C 41 11.834 -4.432 4.579 1.00 0.00 H new ATOM 0 HE22 GLN C 41 12.931 -4.646 5.947 1.00 0.00 H new ATOM 3808 N ARG C 42 9.277 2.477 5.433 1.00 0.00 N ATOM 3809 CA ARG C 42 9.327 3.876 5.840 1.00 0.00 C ATOM 3810 C ARG C 42 9.532 3.984 7.348 1.00 0.00 C ATOM 3811 O ARG C 42 8.606 3.758 8.128 1.00 0.00 O ATOM 3812 CB ARG C 42 8.028 4.583 5.445 1.00 0.00 C ATOM 3813 CG ARG C 42 8.141 5.094 4.007 1.00 0.00 C ATOM 3814 CD ARG C 42 6.794 5.666 3.562 1.00 0.00 C ATOM 3815 NE ARG C 42 6.817 5.960 2.133 1.00 0.00 N ATOM 3816 CZ ARG C 42 5.694 6.199 1.463 1.00 0.00 C ATOM 3817 NH1 ARG C 42 4.555 5.751 1.917 1.00 0.00 N1+ ATOM 3818 NH2 ARG C 42 5.731 6.881 0.351 1.00 0.00 N ATOM 0 H ARG C 42 8.341 2.072 5.414 1.00 0.00 H new ATOM 0 HA ARG C 42 10.166 4.354 5.334 1.00 0.00 H new ATOM 0 HB2 ARG C 42 7.186 3.896 5.533 1.00 0.00 H new ATOM 0 HB3 ARG C 42 7.833 5.414 6.123 1.00 0.00 H new ATOM 0 HG2 ARG C 42 8.913 5.861 3.942 1.00 0.00 H new ATOM 0 HG3 ARG C 42 8.441 4.283 3.344 1.00 0.00 H new ATOM 0 HD2 ARG C 42 5.998 4.954 3.781 1.00 0.00 H new ATOM 0 HD3 ARG C 42 6.573 6.574 4.124 1.00 0.00 H new ATOM 0 HE ARG C 42 7.710 5.983 1.640 1.00 0.00 H new ATOM 0 HH11 ARG C 42 4.527 5.218 2.786 1.00 0.00 H new ATOM 0 HH12 ARG C 42 3.693 5.934 1.403 1.00 0.00 H new ATOM 0 HH21 ARG C 42 6.621 7.230 -0.004 1.00 0.00 H new ATOM 0 HH22 ARG C 42 4.870 7.065 -0.164 1.00 0.00 H new ATOM 3832 N LEU C 43 10.752 4.326 7.751 1.00 0.00 N ATOM 3833 CA LEU C 43 11.069 4.457 9.169 1.00 0.00 C ATOM 3834 C LEU C 43 10.770 5.870 9.660 1.00 0.00 C ATOM 3835 O LEU C 43 11.082 6.852 8.986 1.00 0.00 O ATOM 3836 CB LEU C 43 12.547 4.136 9.405 1.00 0.00 C ATOM 3837 CG LEU C 43 12.804 2.656 9.110 1.00 0.00 C ATOM 3838 CD1 LEU C 43 14.309 2.416 8.976 1.00 0.00 C ATOM 3839 CD2 LEU C 43 12.252 1.801 10.255 1.00 0.00 C ATOM 0 H LEU C 43 11.532 4.516 7.121 1.00 0.00 H new ATOM 0 HA LEU C 43 10.449 3.754 9.725 1.00 0.00 H new ATOM 0 HB2 LEU C 43 13.172 4.759 8.765 1.00 0.00 H new ATOM 0 HB3 LEU C 43 12.819 4.365 10.435 1.00 0.00 H new ATOM 0 HG LEU C 43 12.307 2.381 8.180 1.00 0.00 H new ATOM 0 HD11 LEU C 43 14.492 1.362 8.766 1.00 0.00 H new ATOM 0 HD12 LEU C 43 14.703 3.022 8.160 1.00 0.00 H new ATOM 0 HD13 LEU C 43 14.806 2.692 9.906 1.00 0.00 H new ATOM 0 HD21 LEU C 43 12.436 0.748 10.044 1.00 0.00 H new ATOM 0 HD22 LEU C 43 12.748 2.076 11.186 1.00 0.00 H new ATOM 0 HD23 LEU C 43 11.180 1.970 10.351 1.00 0.00 H new ATOM 3851 N ILE C 44 10.165 5.964 10.840 1.00 0.00 N ATOM 3852 CA ILE C 44 9.828 7.261 11.417 1.00 0.00 C ATOM 3853 C ILE C 44 10.072 7.257 12.922 1.00 0.00 C ATOM 3854 O ILE C 44 9.795 6.269 13.602 1.00 0.00 O ATOM 3855 CB ILE C 44 8.361 7.593 11.137 1.00 0.00 C ATOM 3856 CG1 ILE C 44 8.048 7.314 9.665 1.00 0.00 C ATOM 3857 CG2 ILE C 44 8.103 9.070 11.441 1.00 0.00 C ATOM 3858 CD1 ILE C 44 6.685 7.912 9.309 1.00 0.00 C ATOM 0 H ILE C 44 9.899 5.163 11.413 1.00 0.00 H new ATOM 0 HA ILE C 44 10.465 8.018 10.959 1.00 0.00 H new ATOM 0 HB ILE C 44 7.723 6.976 11.769 1.00 0.00 H new ATOM 0 HG12 ILE C 44 8.822 7.744 9.030 1.00 0.00 H new ATOM 0 HG13 ILE C 44 8.045 6.240 9.480 1.00 0.00 H new ATOM 0 HG21 ILE C 44 7.058 9.305 11.241 1.00 0.00 H new ATOM 0 HG22 ILE C 44 8.326 9.270 12.489 1.00 0.00 H new ATOM 0 HG23 ILE C 44 8.741 9.688 10.810 1.00 0.00 H new ATOM 0 HD11 ILE C 44 6.463 7.713 8.261 1.00 0.00 H new ATOM 0 HD12 ILE C 44 5.915 7.461 9.935 1.00 0.00 H new ATOM 0 HD13 ILE C 44 6.705 8.989 9.477 1.00 0.00 H new ATOM 3870 N PHE C 45 10.593 8.367 13.436 1.00 0.00 N ATOM 3871 CA PHE C 45 10.871 8.479 14.864 1.00 0.00 C ATOM 3872 C PHE C 45 10.205 9.723 15.444 1.00 0.00 C ATOM 3873 O PHE C 45 9.524 10.462 14.733 1.00 0.00 O ATOM 3874 CB PHE C 45 12.382 8.550 15.098 1.00 0.00 C ATOM 3875 CG PHE C 45 12.668 8.470 16.578 1.00 0.00 C ATOM 3876 CD1 PHE C 45 12.381 7.296 17.285 1.00 0.00 C ATOM 3877 CD2 PHE C 45 13.222 9.570 17.245 1.00 0.00 C ATOM 3878 CE1 PHE C 45 12.646 7.222 18.657 1.00 0.00 C ATOM 3879 CE2 PHE C 45 13.487 9.496 18.617 1.00 0.00 C ATOM 3880 CZ PHE C 45 13.199 8.322 19.323 1.00 0.00 C ATOM 0 H PHE C 45 10.830 9.196 12.890 1.00 0.00 H new ATOM 0 HA PHE C 45 10.467 7.599 15.364 1.00 0.00 H new ATOM 0 HB2 PHE C 45 12.880 7.733 14.576 1.00 0.00 H new ATOM 0 HB3 PHE C 45 12.780 9.479 14.690 1.00 0.00 H new ATOM 0 HD1 PHE C 45 11.955 6.447 16.771 1.00 0.00 H new ATOM 0 HD2 PHE C 45 13.445 10.476 16.700 1.00 0.00 H new ATOM 0 HE1 PHE C 45 12.424 6.316 19.202 1.00 0.00 H new ATOM 0 HE2 PHE C 45 13.914 10.345 19.131 1.00 0.00 H new ATOM 0 HZ PHE C 45 13.404 8.265 20.382 1.00 0.00 H new ATOM 3890 N ALA C 46 10.406 9.947 16.738 1.00 0.00 N ATOM 3891 CA ALA C 46 9.819 11.105 17.405 1.00 0.00 C ATOM 3892 C ALA C 46 9.855 12.326 16.491 1.00 0.00 C ATOM 3893 O ALA C 46 8.899 13.099 16.435 1.00 0.00 O ATOM 3894 CB ALA C 46 10.584 11.408 18.694 1.00 0.00 C ATOM 0 H ALA C 46 10.967 9.347 17.343 1.00 0.00 H new ATOM 0 HA ALA C 46 8.781 10.875 17.644 1.00 0.00 H new ATOM 0 HB1 ALA C 46 10.140 12.273 19.186 1.00 0.00 H new ATOM 0 HB2 ALA C 46 10.532 10.546 19.359 1.00 0.00 H new ATOM 0 HB3 ALA C 46 11.626 11.621 18.457 1.00 0.00 H new ATOM 3900 N GLY C 47 10.963 12.492 15.776 1.00 0.00 N ATOM 3901 CA GLY C 47 11.111 13.623 14.868 1.00 0.00 C ATOM 3902 C GLY C 47 10.212 13.462 13.647 1.00 0.00 C ATOM 3903 O GLY C 47 9.046 13.857 13.666 1.00 0.00 O ATOM 0 H GLY C 47 11.765 11.863 15.807 1.00 0.00 H new ATOM 0 HA2 GLY C 47 10.862 14.548 15.389 1.00 0.00 H new ATOM 0 HA3 GLY C 47 12.150 13.706 14.551 1.00 0.00 H new ATOM 3907 N LYS C 48 10.761 12.879 12.586 1.00 0.00 N ATOM 3908 CA LYS C 48 9.999 12.669 11.360 1.00 0.00 C ATOM 3909 C LYS C 48 10.434 11.379 10.673 1.00 0.00 C ATOM 3910 O LYS C 48 10.734 10.383 11.333 1.00 0.00 O ATOM 3911 CB LYS C 48 10.205 13.850 10.409 1.00 0.00 C ATOM 3912 CG LYS C 48 10.005 15.161 11.171 1.00 0.00 C ATOM 3913 CD LYS C 48 10.006 16.331 10.185 1.00 0.00 C ATOM 3914 CE LYS C 48 10.173 17.645 10.950 1.00 0.00 C ATOM 3915 NZ LYS C 48 10.044 18.790 10.005 1.00 0.00 N1+ ATOM 0 H LYS C 48 11.724 12.546 12.550 1.00 0.00 H new ATOM 0 HA LYS C 48 8.943 12.591 11.619 1.00 0.00 H new ATOM 0 HB2 LYS C 48 11.207 13.815 9.981 1.00 0.00 H new ATOM 0 HB3 LYS C 48 9.501 13.789 9.579 1.00 0.00 H new ATOM 0 HG2 LYS C 48 9.063 15.135 11.719 1.00 0.00 H new ATOM 0 HG3 LYS C 48 10.799 15.291 11.907 1.00 0.00 H new ATOM 0 HD2 LYS C 48 10.815 16.212 9.465 1.00 0.00 H new ATOM 0 HD3 LYS C 48 9.075 16.344 9.619 1.00 0.00 H new ATOM 0 HE2 LYS C 48 9.419 17.720 11.734 1.00 0.00 H new ATOM 0 HE3 LYS C 48 11.146 17.672 11.440 1.00 0.00 H new ATOM 0 HZ1 LYS C 48 10.157 19.684 10.525 1.00 0.00 H new ATOM 0 HZ2 LYS C 48 10.779 18.720 9.272 1.00 0.00 H new ATOM 0 HZ3 LYS C 48 9.106 18.767 9.557 1.00 0.00 H new ATOM 3929 N GLN C 49 10.466 11.404 9.344 1.00 0.00 N ATOM 3930 CA GLN C 49 10.865 10.230 8.576 1.00 0.00 C ATOM 3931 C GLN C 49 12.381 10.191 8.407 1.00 0.00 C ATOM 3932 O GLN C 49 13.012 11.217 8.152 1.00 0.00 O ATOM 3933 CB GLN C 49 10.196 10.254 7.200 1.00 0.00 C ATOM 3934 CG GLN C 49 10.537 8.968 6.444 1.00 0.00 C ATOM 3935 CD GLN C 49 9.701 8.876 5.172 1.00 0.00 C ATOM 3936 OE1 GLN C 49 10.140 9.311 4.107 1.00 0.00 O ATOM 3937 NE2 GLN C 49 8.517 8.331 5.218 1.00 0.00 N ATOM 0 H GLN C 49 10.222 12.218 8.780 1.00 0.00 H new ATOM 0 HA GLN C 49 10.548 9.339 9.118 1.00 0.00 H new ATOM 0 HB2 GLN C 49 9.116 10.348 7.311 1.00 0.00 H new ATOM 0 HB3 GLN C 49 10.535 11.122 6.634 1.00 0.00 H new ATOM 0 HG2 GLN C 49 11.598 8.953 6.194 1.00 0.00 H new ATOM 0 HG3 GLN C 49 10.347 8.102 7.078 1.00 0.00 H new ATOM 0 HE21 GLN C 49 8.155 7.971 6.101 1.00 0.00 H new ATOM 0 HE22 GLN C 49 7.953 8.265 4.371 1.00 0.00 H new ATOM 3946 N LEU C 50 12.958 9.003 8.552 1.00 0.00 N ATOM 3947 CA LEU C 50 14.402 8.845 8.413 1.00 0.00 C ATOM 3948 C LEU C 50 14.768 8.493 6.974 1.00 0.00 C ATOM 3949 O LEU C 50 14.163 7.609 6.368 1.00 0.00 O ATOM 3950 CB LEU C 50 14.900 7.744 9.352 1.00 0.00 C ATOM 3951 CG LEU C 50 14.200 7.871 10.705 1.00 0.00 C ATOM 3952 CD1 LEU C 50 14.842 6.907 11.704 1.00 0.00 C ATOM 3953 CD2 LEU C 50 14.341 9.305 11.220 1.00 0.00 C ATOM 0 H LEU C 50 12.454 8.142 8.764 1.00 0.00 H new ATOM 0 HA LEU C 50 14.878 9.790 8.676 1.00 0.00 H new ATOM 0 HB2 LEU C 50 14.701 6.764 8.918 1.00 0.00 H new ATOM 0 HB3 LEU C 50 15.980 7.822 9.481 1.00 0.00 H new ATOM 0 HG LEU C 50 13.144 7.627 10.591 1.00 0.00 H new ATOM 0 HD11 LEU C 50 14.343 6.997 12.669 1.00 0.00 H new ATOM 0 HD12 LEU C 50 14.743 5.885 11.339 1.00 0.00 H new ATOM 0 HD13 LEU C 50 15.898 7.151 11.818 1.00 0.00 H new ATOM 0 HD21 LEU C 50 13.842 9.396 12.185 1.00 0.00 H new ATOM 0 HD22 LEU C 50 15.397 9.549 11.334 1.00 0.00 H new ATOM 0 HD23 LEU C 50 13.884 9.993 10.509 1.00 0.00 H new ATOM 3965 N GLU C 51 15.761 9.192 6.434 1.00 0.00 N ATOM 3966 CA GLU C 51 16.201 8.946 5.065 1.00 0.00 C ATOM 3967 C GLU C 51 17.441 8.059 5.051 1.00 0.00 C ATOM 3968 O GLU C 51 18.151 7.951 6.051 1.00 0.00 O ATOM 3969 CB GLU C 51 16.513 10.273 4.371 1.00 0.00 C ATOM 3970 CG GLU C 51 15.256 11.146 4.347 1.00 0.00 C ATOM 3971 CD GLU C 51 14.189 10.499 3.471 1.00 0.00 C ATOM 3972 OE1 GLU C 51 14.558 9.783 2.554 1.00 0.00 O ATOM 3973 OE2 GLU C 51 13.019 10.731 3.728 1.00 0.00 O1- ATOM 0 H GLU C 51 16.273 9.928 6.919 1.00 0.00 H new ATOM 0 HA GLU C 51 15.398 8.436 4.532 1.00 0.00 H new ATOM 0 HB2 GLU C 51 17.317 10.789 4.895 1.00 0.00 H new ATOM 0 HB3 GLU C 51 16.861 10.091 3.354 1.00 0.00 H new ATOM 0 HG2 GLU C 51 14.876 11.278 5.360 1.00 0.00 H new ATOM 0 HG3 GLU C 51 15.499 12.138 3.966 1.00 0.00 H new ATOM 3980 N ASP C 52 17.696 7.426 3.911 1.00 0.00 N ATOM 3981 CA ASP C 52 18.854 6.550 3.777 1.00 0.00 C ATOM 3982 C ASP C 52 20.148 7.349 3.902 1.00 0.00 C ATOM 3983 O ASP C 52 20.139 8.578 3.826 1.00 0.00 O ATOM 3984 CB ASP C 52 18.819 5.840 2.421 1.00 0.00 C ATOM 3985 CG ASP C 52 17.374 5.623 1.984 1.00 0.00 C ATOM 3986 OD1 ASP C 52 16.528 5.485 2.852 1.00 0.00 O ATOM 3987 OD2 ASP C 52 17.135 5.599 0.788 1.00 0.00 O1- ATOM 0 H ASP C 52 17.121 7.502 3.072 1.00 0.00 H new ATOM 0 HA ASP C 52 18.819 5.809 4.576 1.00 0.00 H new ATOM 0 HB2 ASP C 52 19.348 6.435 1.676 1.00 0.00 H new ATOM 0 HB3 ASP C 52 19.335 4.882 2.489 1.00 0.00 H new ATOM 3992 N GLY C 53 21.258 6.644 4.094 1.00 0.00 N ATOM 3993 CA GLY C 53 22.554 7.299 4.227 1.00 0.00 C ATOM 3994 C GLY C 53 22.775 7.786 5.655 1.00 0.00 C ATOM 3995 O GLY C 53 23.624 7.260 6.376 1.00 0.00 O ATOM 0 H GLY C 53 21.287 5.627 4.161 1.00 0.00 H new ATOM 0 HA2 GLY C 53 23.347 6.605 3.949 1.00 0.00 H new ATOM 0 HA3 GLY C 53 22.612 8.142 3.538 1.00 0.00 H new ATOM 3999 N ARG C 54 22.006 8.793 6.057 1.00 0.00 N ATOM 4000 CA ARG C 54 22.126 9.344 7.403 1.00 0.00 C ATOM 4001 C ARG C 54 22.347 8.228 8.420 1.00 0.00 C ATOM 4002 O ARG C 54 22.078 7.060 8.141 1.00 0.00 O ATOM 4003 CB ARG C 54 20.859 10.122 7.765 1.00 0.00 C ATOM 4004 CG ARG C 54 20.302 10.808 6.515 1.00 0.00 C ATOM 4005 CD ARG C 54 21.386 11.684 5.886 1.00 0.00 C ATOM 4006 NE ARG C 54 20.780 12.706 5.040 1.00 0.00 N ATOM 4007 CZ ARG C 54 21.525 13.606 4.408 1.00 0.00 C ATOM 4008 NH1 ARG C 54 22.134 14.541 5.085 1.00 0.00 N1+ ATOM 4009 NH2 ARG C 54 21.649 13.555 3.109 1.00 0.00 N ATOM 0 H ARG C 54 21.298 9.241 5.475 1.00 0.00 H new ATOM 0 HA ARG C 54 22.983 10.017 7.425 1.00 0.00 H new ATOM 0 HB2 ARG C 54 20.113 9.447 8.184 1.00 0.00 H new ATOM 0 HB3 ARG C 54 21.083 10.865 8.531 1.00 0.00 H new ATOM 0 HG2 ARG C 54 19.963 10.060 5.798 1.00 0.00 H new ATOM 0 HG3 ARG C 54 19.435 11.415 6.776 1.00 0.00 H new ATOM 0 HD2 ARG C 54 21.982 12.155 6.668 1.00 0.00 H new ATOM 0 HD3 ARG C 54 22.064 11.068 5.296 1.00 0.00 H new ATOM 0 HE ARG C 54 19.766 12.730 4.932 1.00 0.00 H new ATOM 0 HH11 ARG C 54 22.038 14.581 6.100 1.00 0.00 H new ATOM 0 HH12 ARG C 54 22.706 15.232 4.599 1.00 0.00 H new ATOM 0 HH21 ARG C 54 21.174 12.824 2.580 1.00 0.00 H new ATOM 0 HH22 ARG C 54 22.221 14.246 2.624 1.00 0.00 H new ATOM 4023 N THR C 55 22.835 8.596 9.601 1.00 0.00 N ATOM 4024 CA THR C 55 23.084 7.615 10.652 1.00 0.00 C ATOM 4025 C THR C 55 22.142 7.841 11.830 1.00 0.00 C ATOM 4026 O THR C 55 21.536 8.905 11.957 1.00 0.00 O ATOM 4027 CB THR C 55 24.534 7.713 11.132 1.00 0.00 C ATOM 4028 OG1 THR C 55 24.726 8.948 11.808 1.00 0.00 O ATOM 4029 CG2 THR C 55 25.481 7.632 9.934 1.00 0.00 C ATOM 0 H THR C 55 23.064 9.557 9.853 1.00 0.00 H new ATOM 0 HA THR C 55 22.905 6.621 10.241 1.00 0.00 H new ATOM 0 HB THR C 55 24.746 6.889 11.813 1.00 0.00 H new ATOM 0 HG1 THR C 55 24.395 9.682 11.249 1.00 0.00 H new ATOM 0 HG21 THR C 55 26.512 7.702 10.280 1.00 0.00 H new ATOM 0 HG22 THR C 55 25.335 6.683 9.418 1.00 0.00 H new ATOM 0 HG23 THR C 55 25.272 8.453 9.249 1.00 0.00 H new ATOM 4037 N LEU C 56 22.025 6.833 12.688 1.00 0.00 N ATOM 4038 CA LEU C 56 21.152 6.934 13.852 1.00 0.00 C ATOM 4039 C LEU C 56 21.646 8.021 14.802 1.00 0.00 C ATOM 4040 O LEU C 56 21.079 8.225 15.875 1.00 0.00 O ATOM 4041 CB LEU C 56 21.107 5.594 14.589 1.00 0.00 C ATOM 4042 CG LEU C 56 20.525 4.521 13.667 1.00 0.00 C ATOM 4043 CD1 LEU C 56 20.748 3.141 14.288 1.00 0.00 C ATOM 4044 CD2 LEU C 56 19.024 4.759 13.486 1.00 0.00 C ATOM 0 H LEU C 56 22.519 5.945 12.601 1.00 0.00 H new ATOM 0 HA LEU C 56 20.151 7.195 13.509 1.00 0.00 H new ATOM 0 HB2 LEU C 56 22.110 5.309 14.908 1.00 0.00 H new ATOM 0 HB3 LEU C 56 20.499 5.683 15.489 1.00 0.00 H new ATOM 0 HG LEU C 56 21.020 4.570 12.697 1.00 0.00 H new ATOM 0 HD11 LEU C 56 20.334 2.376 13.632 1.00 0.00 H new ATOM 0 HD12 LEU C 56 21.816 2.969 14.417 1.00 0.00 H new ATOM 0 HD13 LEU C 56 20.253 3.094 15.258 1.00 0.00 H new ATOM 0 HD21 LEU C 56 18.611 3.994 12.829 1.00 0.00 H new ATOM 0 HD22 LEU C 56 18.528 4.711 14.456 1.00 0.00 H new ATOM 0 HD23 LEU C 56 18.862 5.742 13.044 1.00 0.00 H new ATOM 4056 N SER C 57 22.705 8.715 14.400 1.00 0.00 N ATOM 4057 CA SER C 57 23.268 9.779 15.225 1.00 0.00 C ATOM 4058 C SER C 57 22.717 11.137 14.801 1.00 0.00 C ATOM 4059 O SER C 57 22.660 12.071 15.601 1.00 0.00 O ATOM 4060 CB SER C 57 24.792 9.785 15.101 1.00 0.00 C ATOM 4061 OG SER C 57 25.287 11.069 15.455 1.00 0.00 O ATOM 0 H SER C 57 23.188 8.562 13.515 1.00 0.00 H new ATOM 0 HA SER C 57 22.988 9.594 16.262 1.00 0.00 H new ATOM 0 HB2 SER C 57 25.224 9.024 15.751 1.00 0.00 H new ATOM 0 HB3 SER C 57 25.086 9.538 14.081 1.00 0.00 H new ATOM 0 HG SER C 57 26.264 11.076 15.378 1.00 0.00 H new ATOM 4067 N ASP C 58 22.312 11.239 13.540 1.00 0.00 N ATOM 4068 CA ASP C 58 21.767 12.489 13.021 1.00 0.00 C ATOM 4069 C ASP C 58 20.314 12.660 13.452 1.00 0.00 C ATOM 4070 O ASP C 58 19.570 13.442 12.861 1.00 0.00 O ATOM 4071 CB ASP C 58 21.853 12.503 11.495 1.00 0.00 C ATOM 4072 CG ASP C 58 23.306 12.362 11.053 1.00 0.00 C ATOM 4073 OD1 ASP C 58 23.938 11.401 11.461 1.00 0.00 O ATOM 4074 OD2 ASP C 58 23.765 13.216 10.313 1.00 0.00 O1- ATOM 0 H ASP C 58 22.350 10.478 12.862 1.00 0.00 H new ATOM 0 HA ASP C 58 22.354 13.314 13.425 1.00 0.00 H new ATOM 0 HB2 ASP C 58 21.258 11.689 11.082 1.00 0.00 H new ATOM 0 HB3 ASP C 58 21.435 13.432 11.107 1.00 0.00 H new ATOM 4079 N TYR C 59 19.918 11.924 14.485 1.00 0.00 N ATOM 4080 CA TYR C 59 18.550 12.003 14.988 1.00 0.00 C ATOM 4081 C TYR C 59 18.534 11.923 16.511 1.00 0.00 C ATOM 4082 O TYR C 59 17.503 12.151 17.143 1.00 0.00 O ATOM 4083 CB TYR C 59 17.713 10.864 14.404 1.00 0.00 C ATOM 4084 CG TYR C 59 17.486 11.109 12.932 1.00 0.00 C ATOM 4085 CD1 TYR C 59 16.403 11.890 12.512 1.00 0.00 C ATOM 4086 CD2 TYR C 59 18.358 10.556 11.988 1.00 0.00 C ATOM 4087 CE1 TYR C 59 16.192 12.118 11.147 1.00 0.00 C ATOM 4088 CE2 TYR C 59 18.147 10.783 10.623 1.00 0.00 C ATOM 4089 CZ TYR C 59 17.064 11.564 10.202 1.00 0.00 C ATOM 4090 OH TYR C 59 16.856 11.789 8.857 1.00 0.00 O ATOM 0 H TYR C 59 20.519 11.271 14.987 1.00 0.00 H new ATOM 0 HA TYR C 59 18.124 12.959 14.683 1.00 0.00 H new ATOM 0 HB2 TYR C 59 18.223 9.912 14.551 1.00 0.00 H new ATOM 0 HB3 TYR C 59 16.757 10.797 14.924 1.00 0.00 H new ATOM 0 HD1 TYR C 59 15.730 12.317 13.241 1.00 0.00 H new ATOM 0 HD2 TYR C 59 19.194 9.954 12.312 1.00 0.00 H new ATOM 0 HE1 TYR C 59 15.357 12.721 10.823 1.00 0.00 H new ATOM 0 HE2 TYR C 59 18.820 10.356 9.894 1.00 0.00 H new ATOM 0 HH TYR C 59 17.552 11.334 8.338 1.00 0.00 H new ATOM 4100 N ASN C 60 19.685 11.599 17.092 1.00 0.00 N ATOM 4101 CA ASN C 60 19.794 11.492 18.543 1.00 0.00 C ATOM 4102 C ASN C 60 19.164 10.193 19.037 1.00 0.00 C ATOM 4103 O ASN C 60 18.977 10.001 20.239 1.00 0.00 O ATOM 4104 CB ASN C 60 19.102 12.684 19.208 1.00 0.00 C ATOM 4105 CG ASN C 60 19.767 12.995 20.545 1.00 0.00 C ATOM 4106 OD1 ASN C 60 20.347 12.108 21.172 1.00 0.00 O ATOM 4107 ND2 ASN C 60 19.717 14.209 21.022 1.00 0.00 N ATOM 0 H ASN C 60 20.549 11.407 16.585 1.00 0.00 H new ATOM 0 HA ASN C 60 20.851 11.491 18.809 1.00 0.00 H new ATOM 0 HB2 ASN C 60 19.154 13.555 18.555 1.00 0.00 H new ATOM 0 HB3 ASN C 60 18.046 12.463 19.361 1.00 0.00 H new ATOM 0 HD21 ASN C 60 20.159 14.424 21.916 1.00 0.00 H new ATOM 0 HD22 ASN C 60 19.236 14.942 20.501 1.00 0.00 H new ATOM 4114 N ILE C 61 18.841 9.303 18.104 1.00 0.00 N ATOM 4115 CA ILE C 61 18.234 8.026 18.460 1.00 0.00 C ATOM 4116 C ILE C 61 19.145 7.246 19.403 1.00 0.00 C ATOM 4117 O ILE C 61 20.178 6.719 18.990 1.00 0.00 O ATOM 4118 CB ILE C 61 17.975 7.200 17.199 1.00 0.00 C ATOM 4119 CG1 ILE C 61 16.891 7.881 16.360 1.00 0.00 C ATOM 4120 CG2 ILE C 61 17.506 5.798 17.594 1.00 0.00 C ATOM 4121 CD1 ILE C 61 16.886 7.287 14.950 1.00 0.00 C ATOM 0 H ILE C 61 18.988 9.441 17.104 1.00 0.00 H new ATOM 0 HA ILE C 61 17.288 8.223 18.965 1.00 0.00 H new ATOM 0 HB ILE C 61 18.894 7.125 16.618 1.00 0.00 H new ATOM 0 HG12 ILE C 61 15.916 7.744 16.827 1.00 0.00 H new ATOM 0 HG13 ILE C 61 17.074 8.955 16.313 1.00 0.00 H new ATOM 0 HG21 ILE C 61 17.321 5.209 16.695 1.00 0.00 H new ATOM 0 HG22 ILE C 61 18.276 5.312 18.194 1.00 0.00 H new ATOM 0 HG23 ILE C 61 16.586 5.872 18.174 1.00 0.00 H new ATOM 0 HD11 ILE C 61 16.114 7.773 14.353 1.00 0.00 H new ATOM 0 HD12 ILE C 61 17.858 7.447 14.484 1.00 0.00 H new ATOM 0 HD13 ILE C 61 16.682 6.218 15.006 1.00 0.00 H new ATOM 4133 N GLN C 62 18.756 7.179 20.672 1.00 0.00 N ATOM 4134 CA GLN C 62 19.547 6.462 21.666 1.00 0.00 C ATOM 4135 C GLN C 62 19.208 4.975 21.653 1.00 0.00 C ATOM 4136 O GLN C 62 18.706 4.452 20.659 1.00 0.00 O ATOM 4137 CB GLN C 62 19.280 7.036 23.059 1.00 0.00 C ATOM 4138 CG GLN C 62 19.383 8.562 23.011 1.00 0.00 C ATOM 4139 CD GLN C 62 19.142 9.145 24.399 1.00 0.00 C ATOM 4140 OE1 GLN C 62 19.591 8.581 25.397 1.00 0.00 O ATOM 4141 NE2 GLN C 62 18.453 10.246 24.524 1.00 0.00 N ATOM 0 H GLN C 62 17.905 7.609 21.035 1.00 0.00 H new ATOM 0 HA GLN C 62 20.602 6.584 21.418 1.00 0.00 H new ATOM 0 HB2 GLN C 62 18.289 6.738 23.403 1.00 0.00 H new ATOM 0 HB3 GLN C 62 19.999 6.635 23.773 1.00 0.00 H new ATOM 0 HG2 GLN C 62 20.368 8.857 22.650 1.00 0.00 H new ATOM 0 HG3 GLN C 62 18.653 8.962 22.308 1.00 0.00 H new ATOM 0 HE21 GLN C 62 18.082 10.712 23.696 1.00 0.00 H new ATOM 0 HE22 GLN C 62 18.286 10.641 25.450 1.00 0.00 H new ATOM 4150 N LYS C 63 19.487 4.301 22.764 1.00 0.00 N ATOM 4151 CA LYS C 63 19.210 2.873 22.872 1.00 0.00 C ATOM 4152 C LYS C 63 17.781 2.635 23.345 1.00 0.00 C ATOM 4153 O LYS C 63 17.146 3.524 23.913 1.00 0.00 O ATOM 4154 CB LYS C 63 20.189 2.225 23.854 1.00 0.00 C ATOM 4155 CG LYS C 63 19.917 2.746 25.266 1.00 0.00 C ATOM 4156 CD LYS C 63 21.014 2.254 26.213 1.00 0.00 C ATOM 4157 CE LYS C 63 20.910 2.997 27.546 1.00 0.00 C ATOM 4158 NZ LYS C 63 19.478 3.280 27.846 1.00 0.00 N1+ ATOM 0 H LYS C 63 19.902 4.717 23.598 1.00 0.00 H new ATOM 0 HA LYS C 63 19.331 2.424 21.886 1.00 0.00 H new ATOM 0 HB2 LYS C 63 20.082 1.141 23.828 1.00 0.00 H new ATOM 0 HB3 LYS C 63 21.215 2.451 23.563 1.00 0.00 H new ATOM 0 HG2 LYS C 63 19.886 3.836 25.263 1.00 0.00 H new ATOM 0 HG3 LYS C 63 18.942 2.401 25.611 1.00 0.00 H new ATOM 0 HD2 LYS C 63 20.915 1.181 26.374 1.00 0.00 H new ATOM 0 HD3 LYS C 63 21.995 2.420 25.768 1.00 0.00 H new ATOM 0 HE2 LYS C 63 21.348 2.398 28.344 1.00 0.00 H new ATOM 0 HE3 LYS C 63 21.474 3.929 27.500 1.00 0.00 H new ATOM 0 HZ1 LYS C 63 19.379 3.549 28.846 1.00 0.00 H new ATOM 0 HZ2 LYS C 63 19.145 4.059 27.244 1.00 0.00 H new ATOM 0 HZ3 LYS C 63 18.909 2.430 27.658 1.00 0.00 H new ATOM 4172 N GLU C 64 17.284 1.427 23.106 1.00 0.00 N ATOM 4173 CA GLU C 64 15.930 1.072 23.510 1.00 0.00 C ATOM 4174 C GLU C 64 14.914 2.036 22.904 1.00 0.00 C ATOM 4175 O GLU C 64 13.840 2.253 23.464 1.00 0.00 O ATOM 4176 CB GLU C 64 15.815 1.097 25.035 1.00 0.00 C ATOM 4177 CG GLU C 64 16.741 0.037 25.635 1.00 0.00 C ATOM 4178 CD GLU C 64 16.394 -0.189 27.102 1.00 0.00 C ATOM 4179 OE1 GLU C 64 15.274 -0.589 27.371 1.00 0.00 O ATOM 4180 OE2 GLU C 64 17.255 0.042 27.936 1.00 0.00 O1- ATOM 0 H GLU C 64 17.796 0.680 22.637 1.00 0.00 H new ATOM 0 HA GLU C 64 15.718 0.067 23.146 1.00 0.00 H new ATOM 0 HB2 GLU C 64 16.081 2.084 25.414 1.00 0.00 H new ATOM 0 HB3 GLU C 64 14.785 0.907 25.336 1.00 0.00 H new ATOM 0 HG2 GLU C 64 16.644 -0.897 25.082 1.00 0.00 H new ATOM 0 HG3 GLU C 64 17.779 0.356 25.543 1.00 0.00 H new ATOM 4187 N SER C 65 15.260 2.611 21.757 1.00 0.00 N ATOM 4188 CA SER C 65 14.368 3.548 21.084 1.00 0.00 C ATOM 4189 C SER C 65 13.414 2.806 20.153 1.00 0.00 C ATOM 4190 O SER C 65 13.828 1.924 19.400 1.00 0.00 O ATOM 4191 CB SER C 65 15.185 4.560 20.280 1.00 0.00 C ATOM 4192 OG SER C 65 16.001 5.315 21.166 1.00 0.00 O ATOM 0 H SER C 65 16.145 2.446 21.277 1.00 0.00 H new ATOM 0 HA SER C 65 13.784 4.072 21.841 1.00 0.00 H new ATOM 0 HB2 SER C 65 15.805 4.044 19.547 1.00 0.00 H new ATOM 0 HB3 SER C 65 14.521 5.223 19.725 1.00 0.00 H new ATOM 0 HG SER C 65 16.405 6.064 20.680 1.00 0.00 H new ATOM 4198 N THR C 66 12.137 3.169 20.210 1.00 0.00 N ATOM 4199 CA THR C 66 11.132 2.531 19.366 1.00 0.00 C ATOM 4200 C THR C 66 10.998 3.273 18.040 1.00 0.00 C ATOM 4201 O THR C 66 10.527 4.410 17.998 1.00 0.00 O ATOM 4202 CB THR C 66 9.780 2.515 20.083 1.00 0.00 C ATOM 4203 OG1 THR C 66 9.965 2.090 21.427 1.00 0.00 O ATOM 4204 CG2 THR C 66 8.832 1.552 19.367 1.00 0.00 C ATOM 0 H THR C 66 11.775 3.896 20.827 1.00 0.00 H new ATOM 0 HA THR C 66 11.449 1.507 19.167 1.00 0.00 H new ATOM 0 HB THR C 66 9.351 3.517 20.074 1.00 0.00 H new ATOM 0 HG1 THR C 66 9.101 2.081 21.889 1.00 0.00 H new ATOM 0 HG21 THR C 66 7.870 1.541 19.878 1.00 0.00 H new ATOM 0 HG22 THR C 66 8.692 1.878 18.337 1.00 0.00 H new ATOM 0 HG23 THR C 66 9.258 0.549 19.375 1.00 0.00 H new ATOM 4212 N LEU C 67 11.417 2.623 16.959 1.00 0.00 N ATOM 4213 CA LEU C 67 11.342 3.231 15.635 1.00 0.00 C ATOM 4214 C LEU C 67 10.150 2.683 14.856 1.00 0.00 C ATOM 4215 O LEU C 67 10.042 1.477 14.635 1.00 0.00 O ATOM 4216 CB LEU C 67 12.630 2.946 14.858 1.00 0.00 C ATOM 4217 CG LEU C 67 13.736 3.892 15.332 1.00 0.00 C ATOM 4218 CD1 LEU C 67 15.091 3.191 15.222 1.00 0.00 C ATOM 4219 CD2 LEU C 67 13.741 5.148 14.457 1.00 0.00 C ATOM 0 H LEU C 67 11.809 1.682 16.973 1.00 0.00 H new ATOM 0 HA LEU C 67 11.217 4.307 15.759 1.00 0.00 H new ATOM 0 HB2 LEU C 67 12.935 1.910 15.007 1.00 0.00 H new ATOM 0 HB3 LEU C 67 12.459 3.077 13.790 1.00 0.00 H new ATOM 0 HG LEU C 67 13.555 4.171 16.370 1.00 0.00 H new ATOM 0 HD11 LEU C 67 15.878 3.865 15.560 1.00 0.00 H new ATOM 0 HD12 LEU C 67 15.089 2.296 15.844 1.00 0.00 H new ATOM 0 HD13 LEU C 67 15.273 2.912 14.184 1.00 0.00 H new ATOM 0 HD21 LEU C 67 14.528 5.823 14.793 1.00 0.00 H new ATOM 0 HD22 LEU C 67 13.922 4.868 13.419 1.00 0.00 H new ATOM 0 HD23 LEU C 67 12.776 5.649 14.534 1.00 0.00 H new ATOM 4231 N HIS C 68 9.260 3.578 14.437 1.00 0.00 N ATOM 4232 CA HIS C 68 8.084 3.170 13.678 1.00 0.00 C ATOM 4233 C HIS C 68 8.489 2.730 12.275 1.00 0.00 C ATOM 4234 O HIS C 68 9.387 3.314 11.668 1.00 0.00 O ATOM 4235 CB HIS C 68 7.090 4.332 13.586 1.00 0.00 C ATOM 4236 CG HIS C 68 6.166 4.298 14.773 1.00 0.00 C ATOM 4237 ND1 HIS C 68 6.631 4.405 16.074 1.00 0.00 N ATOM 4238 CD2 HIS C 68 4.803 4.170 14.871 1.00 0.00 C ATOM 4239 CE1 HIS C 68 5.564 4.340 16.892 1.00 0.00 C ATOM 4240 NE2 HIS C 68 4.425 4.197 16.210 1.00 0.00 N ATOM 0 H HIS C 68 9.330 4.581 14.608 1.00 0.00 H new ATOM 0 HA HIS C 68 7.611 2.333 14.191 1.00 0.00 H new ATOM 0 HB2 HIS C 68 7.626 5.281 13.556 1.00 0.00 H new ATOM 0 HB3 HIS C 68 6.515 4.261 12.662 1.00 0.00 H new ATOM 0 HD2 HIS C 68 4.127 4.064 14.036 1.00 0.00 H new ATOM 0 HE1 HIS C 68 5.622 4.397 17.969 1.00 0.00 H new ATOM 0 HE2 HIS C 68 3.481 4.123 16.589 1.00 0.00 H new ATOM 4248 N LEU C 69 7.826 1.697 11.765 1.00 0.00 N ATOM 4249 CA LEU C 69 8.134 1.188 10.432 1.00 0.00 C ATOM 4250 C LEU C 69 6.852 0.934 9.645 1.00 0.00 C ATOM 4251 O LEU C 69 6.000 0.150 10.062 1.00 0.00 O ATOM 4252 CB LEU C 69 8.936 -0.113 10.547 1.00 0.00 C ATOM 4253 CG LEU C 69 9.474 -0.525 9.172 1.00 0.00 C ATOM 4254 CD1 LEU C 69 10.511 -1.637 9.346 1.00 0.00 C ATOM 4255 CD2 LEU C 69 8.323 -1.038 8.299 1.00 0.00 C ATOM 0 H LEU C 69 7.079 1.199 12.249 1.00 0.00 H new ATOM 0 HA LEU C 69 8.726 1.935 9.903 1.00 0.00 H new ATOM 0 HB2 LEU C 69 9.763 0.021 11.244 1.00 0.00 H new ATOM 0 HB3 LEU C 69 8.304 -0.904 10.951 1.00 0.00 H new ATOM 0 HG LEU C 69 9.936 0.338 8.692 1.00 0.00 H new ATOM 0 HD11 LEU C 69 10.895 -1.932 8.370 1.00 0.00 H new ATOM 0 HD12 LEU C 69 11.332 -1.275 9.965 1.00 0.00 H new ATOM 0 HD13 LEU C 69 10.045 -2.497 9.827 1.00 0.00 H new ATOM 0 HD21 LEU C 69 8.709 -1.330 7.322 1.00 0.00 H new ATOM 0 HD22 LEU C 69 7.859 -1.900 8.778 1.00 0.00 H new ATOM 0 HD23 LEU C 69 7.581 -0.249 8.175 1.00 0.00 H new ATOM 4267 N VAL C 70 6.726 1.601 8.501 1.00 0.00 N ATOM 4268 CA VAL C 70 5.547 1.439 7.657 1.00 0.00 C ATOM 4269 C VAL C 70 5.944 0.906 6.284 1.00 0.00 C ATOM 4270 O VAL C 70 6.474 1.642 5.451 1.00 0.00 O ATOM 4271 CB VAL C 70 4.828 2.780 7.498 1.00 0.00 C ATOM 4272 CG1 VAL C 70 3.474 2.558 6.823 1.00 0.00 C ATOM 4273 CG2 VAL C 70 4.612 3.408 8.877 1.00 0.00 C ATOM 0 H VAL C 70 7.421 2.254 8.139 1.00 0.00 H new ATOM 0 HA VAL C 70 4.877 0.724 8.134 1.00 0.00 H new ATOM 0 HB VAL C 70 5.434 3.446 6.884 1.00 0.00 H new ATOM 0 HG11 VAL C 70 2.963 3.514 6.710 1.00 0.00 H new ATOM 0 HG12 VAL C 70 3.626 2.110 5.841 1.00 0.00 H new ATOM 0 HG13 VAL C 70 2.867 1.892 7.436 1.00 0.00 H new ATOM 0 HG21 VAL C 70 4.100 4.364 8.765 1.00 0.00 H new ATOM 0 HG22 VAL C 70 4.006 2.741 9.490 1.00 0.00 H new ATOM 0 HG23 VAL C 70 5.576 3.567 9.359 1.00 0.00 H new ATOM 4283 N LEU C 71 5.688 -0.378 6.057 1.00 0.00 N ATOM 4284 CA LEU C 71 6.025 -1.000 4.781 1.00 0.00 C ATOM 4285 C LEU C 71 5.005 -0.623 3.712 1.00 0.00 C ATOM 4286 O LEU C 71 3.824 -0.438 4.004 1.00 0.00 O ATOM 4287 CB LEU C 71 6.071 -2.523 4.937 1.00 0.00 C ATOM 4288 CG LEU C 71 4.650 -3.073 5.084 1.00 0.00 C ATOM 4289 CD1 LEU C 71 4.704 -4.597 5.197 1.00 0.00 C ATOM 4290 CD2 LEU C 71 4.005 -2.493 6.345 1.00 0.00 C ATOM 0 H LEU C 71 5.252 -1.004 6.734 1.00 0.00 H new ATOM 0 HA LEU C 71 7.005 -0.638 4.471 1.00 0.00 H new ATOM 0 HB2 LEU C 71 6.557 -2.972 4.070 1.00 0.00 H new ATOM 0 HB3 LEU C 71 6.666 -2.790 5.810 1.00 0.00 H new ATOM 0 HG LEU C 71 4.060 -2.792 4.212 1.00 0.00 H new ATOM 0 HD11 LEU C 71 3.693 -4.990 5.302 1.00 0.00 H new ATOM 0 HD12 LEU C 71 5.164 -5.012 4.300 1.00 0.00 H new ATOM 0 HD13 LEU C 71 5.294 -4.876 6.070 1.00 0.00 H new ATOM 0 HD21 LEU C 71 2.993 -2.885 6.449 1.00 0.00 H new ATOM 0 HD22 LEU C 71 4.595 -2.774 7.218 1.00 0.00 H new ATOM 0 HD23 LEU C 71 3.967 -1.406 6.267 1.00 0.00 H new ATOM 4302 N ARG C 72 5.470 -0.513 2.471 1.00 0.00 N ATOM 4303 CA ARG C 72 4.589 -0.159 1.364 1.00 0.00 C ATOM 4304 C ARG C 72 3.882 -1.398 0.824 1.00 0.00 C ATOM 4305 O ARG C 72 4.397 -2.083 -0.059 1.00 0.00 O ATOM 4306 CB ARG C 72 5.398 0.498 0.243 1.00 0.00 C ATOM 4307 CG ARG C 72 4.450 1.209 -0.724 1.00 0.00 C ATOM 4308 CD ARG C 72 5.212 2.297 -1.481 1.00 0.00 C ATOM 4309 NE ARG C 72 4.312 3.383 -1.847 1.00 0.00 N ATOM 4310 CZ ARG C 72 4.703 4.352 -2.668 1.00 0.00 C ATOM 4311 NH1 ARG C 72 5.460 4.074 -3.694 1.00 0.00 N1+ ATOM 4312 NH2 ARG C 72 4.328 5.584 -2.449 1.00 0.00 N ATOM 0 H ARG C 72 6.444 -0.663 2.208 1.00 0.00 H new ATOM 0 HA ARG C 72 3.839 0.542 1.731 1.00 0.00 H new ATOM 0 HB2 ARG C 72 6.108 1.211 0.663 1.00 0.00 H new ATOM 0 HB3 ARG C 72 5.979 -0.255 -0.289 1.00 0.00 H new ATOM 0 HG2 ARG C 72 4.026 0.492 -1.427 1.00 0.00 H new ATOM 0 HG3 ARG C 72 3.617 1.649 -0.175 1.00 0.00 H new ATOM 0 HD2 ARG C 72 6.023 2.681 -0.862 1.00 0.00 H new ATOM 0 HD3 ARG C 72 5.667 1.875 -2.377 1.00 0.00 H new ATOM 0 HE ARG C 72 3.366 3.400 -1.467 1.00 0.00 H new ATOM 0 HH11 ARG C 72 5.752 3.112 -3.866 1.00 0.00 H new ATOM 0 HH12 ARG C 72 5.759 4.819 -4.323 1.00 0.00 H new ATOM 0 HH21 ARG C 72 3.735 5.802 -1.648 1.00 0.00 H new ATOM 0 HH22 ARG C 72 4.628 6.328 -3.079 1.00 0.00 H new ATOM 4326 N LEU C 73 2.700 -1.680 1.362 1.00 0.00 N ATOM 4327 CA LEU C 73 1.930 -2.839 0.927 1.00 0.00 C ATOM 4328 C LEU C 73 2.711 -4.126 1.175 1.00 0.00 C ATOM 4329 O LEU C 73 3.919 -4.094 1.414 1.00 0.00 O ATOM 4330 CB LEU C 73 1.600 -2.718 -0.562 1.00 0.00 C ATOM 4331 CG LEU C 73 1.087 -1.308 -0.859 1.00 0.00 C ATOM 4332 CD1 LEU C 73 0.787 -1.176 -2.353 1.00 0.00 C ATOM 4333 CD2 LEU C 73 -0.192 -1.052 -0.059 1.00 0.00 C ATOM 0 H LEU C 73 2.257 -1.126 2.095 1.00 0.00 H new ATOM 0 HA LEU C 73 1.005 -2.873 1.502 1.00 0.00 H new ATOM 0 HB2 LEU C 73 2.487 -2.927 -1.160 1.00 0.00 H new ATOM 0 HB3 LEU C 73 0.847 -3.456 -0.840 1.00 0.00 H new ATOM 0 HG LEU C 73 1.847 -0.579 -0.576 1.00 0.00 H new ATOM 0 HD11 LEU C 73 0.422 -0.171 -2.563 1.00 0.00 H new ATOM 0 HD12 LEU C 73 1.697 -1.358 -2.924 1.00 0.00 H new ATOM 0 HD13 LEU C 73 0.028 -1.905 -2.638 1.00 0.00 H new ATOM 0 HD21 LEU C 73 -0.558 -0.047 -0.270 1.00 0.00 H new ATOM 0 HD22 LEU C 73 -0.951 -1.782 -0.342 1.00 0.00 H new ATOM 0 HD23 LEU C 73 0.020 -1.144 1.006 1.00 0.00 H new ATOM 4345 N ARG C 74 2.014 -5.256 1.117 1.00 0.00 N ATOM 4346 CA ARG C 74 2.653 -6.548 1.338 1.00 0.00 C ATOM 4347 C ARG C 74 3.957 -6.645 0.552 1.00 0.00 C ATOM 4348 O ARG C 74 3.979 -6.434 -0.660 1.00 0.00 O ATOM 4349 CB ARG C 74 1.712 -7.676 0.910 1.00 0.00 C ATOM 4350 CG ARG C 74 0.452 -7.646 1.777 1.00 0.00 C ATOM 4351 CD ARG C 74 -0.489 -8.774 1.350 1.00 0.00 C ATOM 4352 NE ARG C 74 -1.798 -8.600 1.969 1.00 0.00 N ATOM 4353 CZ ARG C 74 -2.744 -9.525 1.847 1.00 0.00 C ATOM 4354 NH1 ARG C 74 -3.460 -9.586 0.757 1.00 0.00 N1+ ATOM 4355 NH2 ARG C 74 -2.958 -10.371 2.817 1.00 0.00 N ATOM 0 H ARG C 74 1.014 -5.304 0.920 1.00 0.00 H new ATOM 0 HA ARG C 74 2.876 -6.644 2.401 1.00 0.00 H new ATOM 0 HB2 ARG C 74 1.446 -7.563 -0.141 1.00 0.00 H new ATOM 0 HB3 ARG C 74 2.212 -8.639 1.010 1.00 0.00 H new ATOM 0 HG2 ARG C 74 0.718 -7.759 2.828 1.00 0.00 H new ATOM 0 HG3 ARG C 74 -0.049 -6.683 1.676 1.00 0.00 H new ATOM 0 HD2 ARG C 74 -0.590 -8.782 0.265 1.00 0.00 H new ATOM 0 HD3 ARG C 74 -0.068 -9.737 1.638 1.00 0.00 H new ATOM 0 HE ARG C 74 -1.991 -7.754 2.505 1.00 0.00 H new ATOM 0 HH11 ARG C 74 -3.293 -8.924 -0.001 1.00 0.00 H new ATOM 0 HH12 ARG C 74 -4.186 -10.296 0.663 1.00 0.00 H new ATOM 0 HH21 ARG C 74 -2.399 -10.322 3.669 1.00 0.00 H new ATOM 0 HH22 ARG C 74 -3.684 -11.081 2.723 1.00 0.00 H new ATOM 4369 N GLY C 75 5.041 -6.965 1.251 1.00 0.00 N ATOM 4370 CA GLY C 75 6.344 -7.087 0.609 1.00 0.00 C ATOM 4371 C GLY C 75 6.369 -8.269 -0.354 1.00 0.00 C ATOM 4372 O GLY C 75 6.170 -8.106 -1.558 1.00 0.00 O ATOM 0 H GLY C 75 5.043 -7.143 2.255 1.00 0.00 H new ATOM 0 HA2 GLY C 75 6.575 -6.169 0.069 1.00 0.00 H new ATOM 0 HA3 GLY C 75 7.117 -7.214 1.367 1.00 0.00 H new ATOM 4376 N GLY C 76 6.614 -9.459 0.185 1.00 0.00 N ATOM 4377 CA GLY C 76 6.662 -10.663 -0.636 1.00 0.00 C ATOM 4378 C GLY C 76 7.838 -10.614 -1.606 1.00 0.00 C ATOM 4379 O GLY C 76 8.920 -11.121 -1.310 1.00 0.00 O ATOM 0 H GLY C 76 6.781 -9.615 1.179 1.00 0.00 H new ATOM 0 HA2 GLY C 76 6.750 -11.541 0.004 1.00 0.00 H new ATOM 0 HA3 GLY C 76 5.730 -10.766 -1.193 1.00 0.00 H new