USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 MET CE :methyl 154:sc= -4.82! (180deg=-6.58!) USER MOD Set 1.2: A 53 ASN :FLIP amide:sc= -4.59! C(o=-30!,f=-18!) USER MOD Set 1.3: B 49 MET CE :methyl 153:sc= -4.9! (180deg=-6.55!) USER MOD Set 1.4: B 53 ASN :FLIP amide:sc= -4.05! C(o=-30!,f=-18!) USER MOD Set 2.1: B 44 LYS NZ :NH3+ 174:sc= -3.35! (180deg=-2.81) USER MOD Set 2.2: B 47 SER OG : rot 63:sc= -1.18! USER MOD Set 3.1: A 44 LYS NZ :NH3+ -156:sc= -0.951 (180deg=-1.45!) USER MOD Set 3.2: A 47 SER OG : rot 80:sc= 0.358 USER MOD Single : A 23 HIS :FLIP no HD1:sc= -1.21 F(o=-1.7,f=-1.2) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0818 USER MOD Single : A 26 SER OG : rot 145:sc= 0.105 USER MOD Single : A 28 GLN :FLIP amide:sc= -7.41! C(o=-12!,f=-7.4!) USER MOD Single : A 29 ASN : amide:sc= -0.797 X(o=-0.8,f=-0.42) USER MOD Single : A 30 MET CE :methyl -132:sc= -1.13 (180deg=-6.31!) USER MOD Single : A 31 SER OG : rot 180:sc= 0.0372 USER MOD Single : A 32 LYS NZ :NH3+ -173:sc= 0.828! (180deg=0.688) USER MOD Single : A 33 GLN : amide:sc= -0.063 X(o=-0.063,f=0) USER MOD Single : A 37 LYS NZ :NH3+ -119:sc= 0.305 (180deg=-2.57!) USER MOD Single : A 39 TYR OH : rot 142:sc= -3.23! USER MOD Single : A 45 CYS SG : rot 82:sc= 0.043 USER MOD Single : A 54 ASN : amide:sc=-0.00884 K(o=-0.0088,f=-1.5) USER MOD Single : A 60 SER OG : rot -93:sc= 0.722 USER MOD Single : A 61 LYS NZ :NH3+ -164:sc= -0.261 (180deg=-1.72!) USER MOD Single : B 23 HIS : no HD1:sc= -2.1 X(o=-2.1,f=-1.6) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.0651 USER MOD Single : B 26 SER OG : rot 180:sc= 0.133 USER MOD Single : B 28 GLN :FLIP amide:sc= -7.54! C(o=-11!,f=-7.5!) USER MOD Single : B 29 ASN :FLIP amide:sc= -0.589 F(o=-1.6!,f=-0.59) USER MOD Single : B 30 MET CE :methyl -134:sc= -1.04 (180deg=-6.52!) USER MOD Single : B 31 SER OG : rot 180:sc= 0.00205 USER MOD Single : B 32 LYS NZ :NH3+ -176:sc= 0.973 (180deg=0.745) USER MOD Single : B 33 GLN : amide:sc= -0.0595 X(o=-0.06,f=0) USER MOD Single : B 37 LYS NZ :NH3+ -119:sc= -0.371! (180deg=-3.11!) USER MOD Single : B 39 TYR OH : rot 134:sc= -2.79! USER MOD Single : B 45 CYS SG : rot 82:sc= 0.148 USER MOD Single : B 54 ASN : amide:sc= -0.0815 K(o=-0.082,f=-2.4!) USER MOD Single : B 60 SER OG : rot -68:sc= 0.604 USER MOD Single : B 61 LYS NZ :NH3+ -160:sc= -0.357 (180deg=-2.14!) USER MOD Single : B 84 ASN : amide:sc= 0.847 K(o=0.85,f=-0.47) USER MOD Single : B 86 GLN :FLIP amide:sc= -0.894 F(o=-2.1!,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 151.647 -10.555 -5.072 1.00 0.00 N ATOM 333 CA HIS A 23 151.116 -9.939 -3.809 1.00 0.00 C ATOM 334 C HIS A 23 149.956 -8.965 -4.088 1.00 0.00 C ATOM 335 O HIS A 23 149.366 -8.439 -3.159 1.00 0.00 O ATOM 336 CB HIS A 23 152.250 -9.192 -3.079 1.00 0.00 C ATOM 337 CG HIS A 23 152.058 -9.298 -1.590 1.00 0.00 C ATOM 338 ND1 HIS A 23 152.140 -8.366 -0.582 1.00 0.00 N flip ATOM 339 CD2 HIS A 23 151.742 -10.497 -0.973 1.00 0.00 C flip ATOM 340 CE1 HIS A 23 151.878 -8.974 0.640 1.00 0.00 C flip ATOM 341 NE2 HIS A 23 151.644 -10.258 0.347 1.00 0.00 N flip ATOM 0 HA HIS A 23 150.733 -10.745 -3.183 1.00 0.00 H new ATOM 0 HB2 HIS A 23 153.215 -9.613 -3.361 1.00 0.00 H new ATOM 0 HB3 HIS A 23 152.259 -8.144 -3.380 1.00 0.00 H new ATOM 0 HD2 HIS A 23 151.600 -11.449 -1.462 1.00 0.00 H new ATOM 0 HE1 HIS A 23 151.866 -8.510 1.615 1.00 0.00 H new ATOM 0 HE2 HIS A 23 151.418 -10.970 1.041 1.00 0.00 H new ATOM 350 N THR A 24 149.627 -8.687 -5.331 1.00 0.00 N ATOM 351 CA THR A 24 148.525 -7.689 -5.584 1.00 0.00 C ATOM 352 C THR A 24 147.286 -8.029 -4.734 1.00 0.00 C ATOM 353 O THR A 24 146.902 -7.252 -3.875 1.00 0.00 O ATOM 354 CB THR A 24 148.163 -7.585 -7.085 1.00 0.00 C ATOM 355 OG1 THR A 24 149.249 -8.025 -7.877 1.00 0.00 O ATOM 356 CG2 THR A 24 147.881 -6.125 -7.441 1.00 0.00 C ATOM 0 H THR A 24 150.058 -9.093 -6.162 1.00 0.00 H new ATOM 0 HA THR A 24 148.895 -6.709 -5.283 1.00 0.00 H new ATOM 0 HB THR A 24 147.286 -8.204 -7.275 1.00 0.00 H new ATOM 0 HG1 THR A 24 149.011 -7.958 -8.825 1.00 0.00 H new ATOM 0 HG21 THR A 24 147.626 -6.051 -8.498 1.00 0.00 H new ATOM 0 HG22 THR A 24 147.049 -5.758 -6.840 1.00 0.00 H new ATOM 0 HG23 THR A 24 148.767 -5.523 -7.239 1.00 0.00 H new ATOM 364 N GLU A 25 146.685 -9.185 -4.923 1.00 0.00 N ATOM 365 CA GLU A 25 145.512 -9.578 -4.082 1.00 0.00 C ATOM 366 C GLU A 25 145.816 -9.274 -2.624 1.00 0.00 C ATOM 367 O GLU A 25 145.199 -8.410 -2.015 1.00 0.00 O ATOM 368 CB GLU A 25 145.281 -11.092 -4.243 1.00 0.00 C ATOM 369 CG GLU A 25 144.461 -11.352 -5.518 1.00 0.00 C ATOM 370 CD GLU A 25 143.039 -10.846 -5.337 1.00 0.00 C ATOM 371 OE1 GLU A 25 142.505 -10.979 -4.261 1.00 0.00 O ATOM 372 OE2 GLU A 25 142.490 -10.350 -6.283 1.00 0.00 O ATOM 0 H GLU A 25 146.960 -9.871 -5.626 1.00 0.00 H new ATOM 0 HA GLU A 25 144.626 -9.025 -4.393 1.00 0.00 H new ATOM 0 HB2 GLU A 25 146.237 -11.613 -4.300 1.00 0.00 H new ATOM 0 HB3 GLU A 25 144.755 -11.485 -3.373 1.00 0.00 H new ATOM 0 HG2 GLU A 25 144.927 -10.853 -6.368 1.00 0.00 H new ATOM 0 HG3 GLU A 25 144.450 -12.419 -5.741 1.00 0.00 H new ATOM 379 N SER A 26 146.714 -10.006 -2.042 1.00 0.00 N ATOM 380 CA SER A 26 147.057 -9.796 -0.618 1.00 0.00 C ATOM 381 C SER A 26 147.192 -8.301 -0.336 1.00 0.00 C ATOM 382 O SER A 26 146.633 -7.792 0.617 1.00 0.00 O ATOM 383 CB SER A 26 148.379 -10.505 -0.325 1.00 0.00 C ATOM 384 OG SER A 26 148.462 -11.699 -1.130 1.00 0.00 O ATOM 0 H SER A 26 147.234 -10.754 -2.501 1.00 0.00 H new ATOM 0 HA SER A 26 146.272 -10.202 0.020 1.00 0.00 H new ATOM 0 HB2 SER A 26 149.217 -9.844 -0.545 1.00 0.00 H new ATOM 0 HB3 SER A 26 148.443 -10.759 0.733 1.00 0.00 H new ATOM 0 HG SER A 26 149.391 -11.843 -1.407 1.00 0.00 H new ATOM 390 N LEU A 27 147.830 -7.578 -1.211 1.00 0.00 N ATOM 391 CA LEU A 27 147.954 -6.120 -1.015 1.00 0.00 C ATOM 392 C LEU A 27 146.564 -5.480 -0.968 1.00 0.00 C ATOM 393 O LEU A 27 146.277 -4.685 -0.090 1.00 0.00 O ATOM 394 CB LEU A 27 148.779 -5.512 -2.146 1.00 0.00 C ATOM 395 CG LEU A 27 150.268 -5.812 -1.941 1.00 0.00 C ATOM 396 CD1 LEU A 27 151.050 -5.418 -3.200 1.00 0.00 C ATOM 397 CD2 LEU A 27 150.814 -5.023 -0.738 1.00 0.00 C ATOM 0 H LEU A 27 148.271 -7.942 -2.056 1.00 0.00 H new ATOM 0 HA LEU A 27 148.460 -5.928 -0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 27 148.449 -5.915 -3.103 1.00 0.00 H new ATOM 0 HB3 LEU A 27 148.620 -4.434 -2.182 1.00 0.00 H new ATOM 0 HG LEU A 27 150.386 -6.879 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 27 152.109 -5.632 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 27 150.680 -5.988 -4.052 1.00 0.00 H new ATOM 0 HD13 LEU A 27 150.918 -4.353 -3.392 1.00 0.00 H new ATOM 0 HD21 LEU A 27 151.872 -5.247 -0.606 1.00 0.00 H new ATOM 0 HD22 LEU A 27 150.689 -3.955 -0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 27 150.268 -5.307 0.162 1.00 0.00 H new ATOM 409 N GLN A 28 145.682 -5.823 -1.872 1.00 0.00 N ATOM 410 CA GLN A 28 144.318 -5.203 -1.803 1.00 0.00 C ATOM 411 C GLN A 28 143.523 -5.831 -0.679 1.00 0.00 C ATOM 412 O GLN A 28 142.662 -5.188 -0.090 1.00 0.00 O ATOM 413 CB GLN A 28 143.483 -5.287 -3.121 1.00 0.00 C ATOM 414 CG GLN A 28 144.216 -6.008 -4.247 1.00 0.00 C ATOM 415 CD GLN A 28 145.104 -5.010 -4.971 1.00 0.00 C ATOM 416 OE1 GLN A 28 146.364 -5.016 -4.764 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 144.629 -4.204 -5.732 1.00 0.00 N flip ATOM 0 H GLN A 28 145.836 -6.484 -2.634 1.00 0.00 H new ATOM 0 HA GLN A 28 144.499 -4.143 -1.627 1.00 0.00 H new ATOM 0 HB2 GLN A 28 142.544 -5.803 -2.918 1.00 0.00 H new ATOM 0 HB3 GLN A 28 143.228 -4.279 -3.448 1.00 0.00 H new ATOM 0 HG2 GLN A 28 144.816 -6.824 -3.845 1.00 0.00 H new ATOM 0 HG3 GLN A 28 143.501 -6.450 -4.941 1.00 0.00 H new ATOM 0 HE21 GLN A 28 143.623 -4.194 -5.902 1.00 0.00 H new ATOM 0 HE22 GLN A 28 145.233 -3.532 -6.206 1.00 0.00 H new ATOM 426 N ASN A 29 143.768 -7.077 -0.392 1.00 0.00 N ATOM 427 CA ASN A 29 142.974 -7.774 0.639 1.00 0.00 C ATOM 428 C ASN A 29 143.468 -7.389 2.034 1.00 0.00 C ATOM 429 O ASN A 29 142.842 -7.712 3.033 1.00 0.00 O ATOM 430 CB ASN A 29 143.057 -9.279 0.428 1.00 0.00 C ATOM 431 CG ASN A 29 142.393 -9.654 -0.900 1.00 0.00 C ATOM 432 OD1 ASN A 29 141.223 -9.390 -1.106 1.00 0.00 O ATOM 433 ND2 ASN A 29 143.082 -10.253 -1.811 1.00 0.00 N ATOM 0 H ASN A 29 144.492 -7.642 -0.835 1.00 0.00 H new ATOM 0 HA ASN A 29 141.930 -7.472 0.553 1.00 0.00 H new ATOM 0 HB2 ASN A 29 144.099 -9.598 0.427 1.00 0.00 H new ATOM 0 HB3 ASN A 29 142.565 -9.798 1.250 1.00 0.00 H new ATOM 0 HD21 ASN A 29 142.646 -10.503 -2.699 1.00 0.00 H new ATOM 0 HD22 ASN A 29 144.063 -10.477 -1.644 1.00 0.00 H new ATOM 440 N MET A 30 144.534 -6.650 2.118 1.00 0.00 N ATOM 441 CA MET A 30 145.025 -6.185 3.424 1.00 0.00 C ATOM 442 C MET A 30 144.278 -4.918 3.791 1.00 0.00 C ATOM 443 O MET A 30 143.612 -4.311 2.951 1.00 0.00 O ATOM 444 CB MET A 30 146.513 -5.847 3.319 1.00 0.00 C ATOM 445 CG MET A 30 147.344 -7.130 3.300 1.00 0.00 C ATOM 446 SD MET A 30 148.578 -7.046 4.612 1.00 0.00 S ATOM 447 CE MET A 30 149.444 -5.578 4.007 1.00 0.00 C ATOM 0 H MET A 30 145.090 -6.347 1.318 1.00 0.00 H new ATOM 0 HA MET A 30 144.872 -6.962 4.173 1.00 0.00 H new ATOM 0 HB2 MET A 30 146.700 -5.270 2.413 1.00 0.00 H new ATOM 0 HB3 MET A 30 146.812 -5.223 4.161 1.00 0.00 H new ATOM 0 HG2 MET A 30 146.700 -7.998 3.443 1.00 0.00 H new ATOM 0 HG3 MET A 30 147.831 -7.250 2.332 1.00 0.00 H new ATOM 0 HE1 MET A 30 150.518 -5.763 4.007 1.00 0.00 H new ATOM 0 HE2 MET A 30 149.115 -5.354 2.992 1.00 0.00 H new ATOM 0 HE3 MET A 30 149.222 -4.731 4.656 1.00 0.00 H new ATOM 457 N SER A 31 144.361 -4.510 5.005 1.00 0.00 N ATOM 458 CA SER A 31 143.637 -3.289 5.411 1.00 0.00 C ATOM 459 C SER A 31 144.555 -2.108 5.138 1.00 0.00 C ATOM 460 O SER A 31 145.753 -2.166 5.390 1.00 0.00 O ATOM 461 CB SER A 31 143.309 -3.355 6.914 1.00 0.00 C ATOM 462 OG SER A 31 143.511 -4.700 7.409 1.00 0.00 O ATOM 0 H SER A 31 144.899 -4.966 5.742 1.00 0.00 H new ATOM 0 HA SER A 31 142.703 -3.190 4.858 1.00 0.00 H new ATOM 0 HB2 SER A 31 143.942 -2.658 7.463 1.00 0.00 H new ATOM 0 HB3 SER A 31 142.277 -3.048 7.083 1.00 0.00 H new ATOM 0 HG SER A 31 143.302 -4.731 8.366 1.00 0.00 H new ATOM 468 N LYS A 32 144.025 -1.073 4.548 1.00 0.00 N ATOM 469 CA LYS A 32 144.841 0.124 4.176 1.00 0.00 C ATOM 470 C LYS A 32 145.768 0.486 5.339 1.00 0.00 C ATOM 471 O LYS A 32 146.925 0.785 5.141 1.00 0.00 O ATOM 472 CB LYS A 32 143.902 1.307 3.861 1.00 0.00 C ATOM 473 CG LYS A 32 144.445 2.155 2.690 1.00 0.00 C ATOM 474 CD LYS A 32 144.254 3.655 2.998 1.00 0.00 C ATOM 475 CE LYS A 32 144.309 4.475 1.693 1.00 0.00 C ATOM 476 NZ LYS A 32 143.107 5.314 1.554 1.00 0.00 N ATOM 0 H LYS A 32 143.038 -1.002 4.301 1.00 0.00 H new ATOM 0 HA LYS A 32 145.442 -0.098 3.294 1.00 0.00 H new ATOM 0 HB2 LYS A 32 142.910 0.931 3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 32 143.792 1.933 4.746 1.00 0.00 H new ATOM 0 HG2 LYS A 32 145.501 1.939 2.532 1.00 0.00 H new ATOM 0 HG3 LYS A 32 143.925 1.894 1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 32 143.297 3.813 3.496 1.00 0.00 H new ATOM 0 HD3 LYS A 32 145.030 3.995 3.683 1.00 0.00 H new ATOM 0 HE2 LYS A 32 145.200 5.104 1.690 1.00 0.00 H new ATOM 0 HE3 LYS A 32 144.390 3.803 0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 143.106 5.767 0.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 142.257 4.723 1.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 143.108 6.046 2.292 1.00 0.00 H new ATOM 490 N GLN A 33 145.273 0.445 6.534 1.00 0.00 N ATOM 491 CA GLN A 33 146.117 0.791 7.716 1.00 0.00 C ATOM 492 C GLN A 33 147.402 -0.022 7.695 1.00 0.00 C ATOM 493 O GLN A 33 148.478 0.507 7.847 1.00 0.00 O ATOM 494 CB GLN A 33 145.367 0.453 8.998 1.00 0.00 C ATOM 495 CG GLN A 33 144.437 1.590 9.388 1.00 0.00 C ATOM 496 CD GLN A 33 144.145 1.471 10.865 1.00 0.00 C ATOM 497 OE1 GLN A 33 144.191 2.438 11.573 1.00 0.00 O ATOM 498 NE2 GLN A 33 143.845 0.319 11.363 1.00 0.00 N ATOM 0 H GLN A 33 144.311 0.185 6.753 1.00 0.00 H new ATOM 0 HA GLN A 33 146.346 1.856 7.677 1.00 0.00 H new ATOM 0 HB2 GLN A 33 144.792 -0.463 8.859 1.00 0.00 H new ATOM 0 HB3 GLN A 33 146.078 0.265 9.803 1.00 0.00 H new ATOM 0 HG2 GLN A 33 144.899 2.552 9.168 1.00 0.00 H new ATOM 0 HG3 GLN A 33 143.513 1.541 8.812 1.00 0.00 H new ATOM 0 HE21 GLN A 33 143.806 -0.503 10.760 1.00 0.00 H new ATOM 0 HE22 GLN A 33 143.647 0.230 12.360 1.00 0.00 H new ATOM 507 N GLU A 34 147.283 -1.304 7.568 1.00 0.00 N ATOM 508 CA GLU A 34 148.471 -2.188 7.614 1.00 0.00 C ATOM 509 C GLU A 34 149.420 -1.780 6.526 1.00 0.00 C ATOM 510 O GLU A 34 150.549 -1.418 6.784 1.00 0.00 O ATOM 511 CB GLU A 34 148.022 -3.649 7.430 1.00 0.00 C ATOM 512 CG GLU A 34 146.802 -3.935 8.337 1.00 0.00 C ATOM 513 CD GLU A 34 147.104 -3.469 9.743 1.00 0.00 C ATOM 514 OE1 GLU A 34 147.740 -4.190 10.450 1.00 0.00 O ATOM 515 OE2 GLU A 34 146.717 -2.376 10.090 1.00 0.00 O ATOM 0 H GLU A 34 146.396 -1.788 7.431 1.00 0.00 H new ATOM 0 HA GLU A 34 148.977 -2.100 8.575 1.00 0.00 H new ATOM 0 HB2 GLU A 34 147.763 -3.832 6.387 1.00 0.00 H new ATOM 0 HB3 GLU A 34 148.840 -4.325 7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 34 145.921 -3.421 7.953 1.00 0.00 H new ATOM 0 HG3 GLU A 34 146.576 -5.001 8.336 1.00 0.00 H new ATOM 522 N LEU A 35 148.935 -1.750 5.323 1.00 0.00 N ATOM 523 CA LEU A 35 149.761 -1.306 4.163 1.00 0.00 C ATOM 524 C LEU A 35 150.460 -0.002 4.529 1.00 0.00 C ATOM 525 O LEU A 35 151.592 0.247 4.133 1.00 0.00 O ATOM 526 CB LEU A 35 148.839 -1.048 2.973 1.00 0.00 C ATOM 527 CG LEU A 35 148.171 -2.355 2.520 1.00 0.00 C ATOM 528 CD1 LEU A 35 146.827 -2.046 1.864 1.00 0.00 C ATOM 529 CD2 LEU A 35 149.071 -3.073 1.513 1.00 0.00 C ATOM 0 H LEU A 35 147.981 -2.019 5.085 1.00 0.00 H new ATOM 0 HA LEU A 35 150.496 -2.071 3.912 1.00 0.00 H new ATOM 0 HB2 LEU A 35 148.077 -0.318 3.247 1.00 0.00 H new ATOM 0 HB3 LEU A 35 149.409 -0.619 2.149 1.00 0.00 H new ATOM 0 HG LEU A 35 148.014 -2.994 3.389 1.00 0.00 H new ATOM 0 HD11 LEU A 35 146.356 -2.975 1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 35 146.180 -1.540 2.581 1.00 0.00 H new ATOM 0 HD13 LEU A 35 146.984 -1.402 0.999 1.00 0.00 H new ATOM 0 HD21 LEU A 35 148.594 -4.000 1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 35 149.232 -2.431 0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 35 150.030 -3.301 1.979 1.00 0.00 H new ATOM 541 N ILE A 36 149.794 0.843 5.248 1.00 0.00 N ATOM 542 CA ILE A 36 150.416 2.119 5.639 1.00 0.00 C ATOM 543 C ILE A 36 151.462 1.832 6.708 1.00 0.00 C ATOM 544 O ILE A 36 152.590 2.289 6.614 1.00 0.00 O ATOM 545 CB ILE A 36 149.343 3.072 6.179 1.00 0.00 C ATOM 546 CG1 ILE A 36 148.332 3.385 5.064 1.00 0.00 C ATOM 547 CG2 ILE A 36 149.990 4.378 6.674 1.00 0.00 C ATOM 548 CD1 ILE A 36 147.043 3.935 5.671 1.00 0.00 C ATOM 0 H ILE A 36 148.841 0.702 5.582 1.00 0.00 H new ATOM 0 HA ILE A 36 150.891 2.592 4.779 1.00 0.00 H new ATOM 0 HB ILE A 36 148.831 2.596 7.015 1.00 0.00 H new ATOM 0 HG12 ILE A 36 148.756 4.111 4.370 1.00 0.00 H new ATOM 0 HG13 ILE A 36 148.118 2.483 4.491 1.00 0.00 H new ATOM 0 HG21 ILE A 36 149.217 5.046 7.055 1.00 0.00 H new ATOM 0 HG22 ILE A 36 150.700 4.153 7.470 1.00 0.00 H new ATOM 0 HG23 ILE A 36 150.512 4.861 5.848 1.00 0.00 H new ATOM 0 HD11 ILE A 36 146.331 4.155 4.875 1.00 0.00 H new ATOM 0 HD12 ILE A 36 146.615 3.195 6.347 1.00 0.00 H new ATOM 0 HD13 ILE A 36 147.262 4.848 6.224 1.00 0.00 H new ATOM 560 N LYS A 37 151.116 1.059 7.704 1.00 0.00 N ATOM 561 CA LYS A 37 152.081 0.721 8.762 1.00 0.00 C ATOM 562 C LYS A 37 153.335 0.163 8.115 1.00 0.00 C ATOM 563 O LYS A 37 154.449 0.622 8.396 1.00 0.00 O ATOM 564 CB LYS A 37 151.472 -0.320 9.689 1.00 0.00 C ATOM 565 CG LYS A 37 150.077 0.136 10.188 1.00 0.00 C ATOM 566 CD LYS A 37 150.002 0.048 11.721 1.00 0.00 C ATOM 567 CE LYS A 37 148.560 -0.288 12.156 1.00 0.00 C ATOM 568 NZ LYS A 37 148.265 -1.709 11.859 1.00 0.00 N ATOM 0 H LYS A 37 150.190 0.648 7.820 1.00 0.00 H new ATOM 0 HA LYS A 37 152.329 1.610 9.342 1.00 0.00 H new ATOM 0 HB2 LYS A 37 151.383 -1.272 9.165 1.00 0.00 H new ATOM 0 HB3 LYS A 37 152.132 -0.485 10.541 1.00 0.00 H new ATOM 0 HG2 LYS A 37 149.885 1.160 9.866 1.00 0.00 H new ATOM 0 HG3 LYS A 37 149.302 -0.489 9.743 1.00 0.00 H new ATOM 0 HD2 LYS A 37 150.689 -0.717 12.084 1.00 0.00 H new ATOM 0 HD3 LYS A 37 150.314 0.994 12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 37 148.438 -0.097 13.222 1.00 0.00 H new ATOM 0 HE3 LYS A 37 147.853 0.357 11.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 147.472 -1.766 11.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 149.105 -2.158 11.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 148.011 -2.202 12.739 1.00 0.00 H new ATOM 582 N GLU A 38 153.188 -0.792 7.228 1.00 0.00 N ATOM 583 CA GLU A 38 154.380 -1.314 6.565 1.00 0.00 C ATOM 584 C GLU A 38 155.035 -0.226 5.729 1.00 0.00 C ATOM 585 O GLU A 38 156.230 -0.187 5.630 1.00 0.00 O ATOM 586 CB GLU A 38 154.117 -2.604 5.763 1.00 0.00 C ATOM 587 CG GLU A 38 152.802 -2.598 4.990 1.00 0.00 C ATOM 588 CD GLU A 38 152.223 -3.982 5.082 1.00 0.00 C ATOM 589 OE1 GLU A 38 152.727 -4.851 4.404 1.00 0.00 O ATOM 590 OE2 GLU A 38 151.337 -4.180 5.858 1.00 0.00 O ATOM 0 H GLU A 38 152.302 -1.214 6.951 1.00 0.00 H new ATOM 0 HA GLU A 38 155.082 -1.612 7.343 1.00 0.00 H new ATOM 0 HB2 GLU A 38 154.938 -2.757 5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 38 154.120 -3.452 6.448 1.00 0.00 H new ATOM 0 HG2 GLU A 38 152.113 -1.865 5.409 1.00 0.00 H new ATOM 0 HG3 GLU A 38 152.969 -2.320 3.949 1.00 0.00 H new ATOM 597 N TYR A 39 154.292 0.722 5.205 1.00 0.00 N ATOM 598 CA TYR A 39 154.962 1.840 4.485 1.00 0.00 C ATOM 599 C TYR A 39 155.845 2.627 5.389 1.00 0.00 C ATOM 600 O TYR A 39 156.942 2.939 5.033 1.00 0.00 O ATOM 601 CB TYR A 39 153.984 2.791 3.773 1.00 0.00 C ATOM 602 CG TYR A 39 153.784 2.371 2.342 1.00 0.00 C ATOM 603 CD1 TYR A 39 154.912 2.191 1.526 1.00 0.00 C ATOM 604 CD2 TYR A 39 152.508 2.198 1.813 1.00 0.00 C ATOM 605 CE1 TYR A 39 154.765 1.837 0.204 1.00 0.00 C ATOM 606 CE2 TYR A 39 152.366 1.836 0.469 1.00 0.00 C ATOM 607 CZ TYR A 39 153.505 1.656 -0.328 1.00 0.00 C ATOM 608 OH TYR A 39 153.391 1.306 -1.629 1.00 0.00 O ATOM 0 H TYR A 39 153.274 0.766 5.245 1.00 0.00 H new ATOM 0 HA TYR A 39 155.564 1.356 3.717 1.00 0.00 H new ATOM 0 HB2 TYR A 39 153.027 2.794 4.294 1.00 0.00 H new ATOM 0 HB3 TYR A 39 154.369 3.810 3.808 1.00 0.00 H new ATOM 0 HD1 TYR A 39 155.901 2.331 1.938 1.00 0.00 H new ATOM 0 HD2 TYR A 39 151.636 2.342 2.434 1.00 0.00 H new ATOM 0 HE1 TYR A 39 155.637 1.701 -0.418 1.00 0.00 H new ATOM 0 HE2 TYR A 39 151.382 1.696 0.047 1.00 0.00 H new ATOM 0 HH TYR A 39 152.655 0.668 -1.733 1.00 0.00 H new ATOM 618 N LEU A 40 155.408 2.963 6.541 1.00 0.00 N ATOM 619 CA LEU A 40 156.299 3.782 7.418 1.00 0.00 C ATOM 620 C LEU A 40 157.575 2.985 7.686 1.00 0.00 C ATOM 621 O LEU A 40 158.665 3.534 7.768 1.00 0.00 O ATOM 622 CB LEU A 40 155.596 4.148 8.743 1.00 0.00 C ATOM 623 CG LEU A 40 154.060 4.262 8.544 1.00 0.00 C ATOM 624 CD1 LEU A 40 153.399 4.675 9.842 1.00 0.00 C ATOM 625 CD2 LEU A 40 153.725 5.298 7.465 1.00 0.00 C ATOM 0 H LEU A 40 154.495 2.723 6.927 1.00 0.00 H new ATOM 0 HA LEU A 40 156.542 4.718 6.916 1.00 0.00 H new ATOM 0 HB2 LEU A 40 155.814 3.390 9.496 1.00 0.00 H new ATOM 0 HB3 LEU A 40 155.989 5.093 9.119 1.00 0.00 H new ATOM 0 HG LEU A 40 153.688 3.287 8.230 1.00 0.00 H new ATOM 0 HD11 LEU A 40 152.322 4.753 9.693 1.00 0.00 H new ATOM 0 HD12 LEU A 40 153.607 3.929 10.609 1.00 0.00 H new ATOM 0 HD13 LEU A 40 153.792 5.641 10.159 1.00 0.00 H new ATOM 0 HD21 LEU A 40 152.644 5.360 7.343 1.00 0.00 H new ATOM 0 HD22 LEU A 40 154.113 6.272 7.763 1.00 0.00 H new ATOM 0 HD23 LEU A 40 154.180 5.000 6.520 1.00 0.00 H new ATOM 637 N GLU A 41 157.455 1.697 7.791 1.00 0.00 N ATOM 638 CA GLU A 41 158.656 0.849 8.026 1.00 0.00 C ATOM 639 C GLU A 41 159.435 0.687 6.712 1.00 0.00 C ATOM 640 O GLU A 41 160.574 1.094 6.597 1.00 0.00 O ATOM 641 CB GLU A 41 158.203 -0.528 8.519 1.00 0.00 C ATOM 642 CG GLU A 41 157.257 -0.375 9.737 1.00 0.00 C ATOM 643 CD GLU A 41 157.721 -1.257 10.875 1.00 0.00 C ATOM 644 OE1 GLU A 41 158.909 -1.342 11.091 1.00 0.00 O ATOM 645 OE2 GLU A 41 156.893 -1.840 11.513 1.00 0.00 O ATOM 0 H GLU A 41 156.573 1.189 7.724 1.00 0.00 H new ATOM 0 HA GLU A 41 159.298 1.318 8.771 1.00 0.00 H new ATOM 0 HB2 GLU A 41 157.692 -1.060 7.717 1.00 0.00 H new ATOM 0 HB3 GLU A 41 159.071 -1.127 8.796 1.00 0.00 H new ATOM 0 HG2 GLU A 41 157.234 0.666 10.060 1.00 0.00 H new ATOM 0 HG3 GLU A 41 156.240 -0.642 9.452 1.00 0.00 H new ATOM 652 N LEU A 42 158.835 0.053 5.751 1.00 0.00 N ATOM 653 CA LEU A 42 159.498 -0.216 4.441 1.00 0.00 C ATOM 654 C LEU A 42 159.980 1.088 3.824 1.00 0.00 C ATOM 655 O LEU A 42 161.063 1.160 3.270 1.00 0.00 O ATOM 656 CB LEU A 42 158.493 -0.888 3.482 1.00 0.00 C ATOM 657 CG LEU A 42 159.252 -1.768 2.474 1.00 0.00 C ATOM 658 CD1 LEU A 42 159.401 -3.180 3.027 1.00 0.00 C ATOM 659 CD2 LEU A 42 158.493 -1.835 1.147 1.00 0.00 C ATOM 0 H LEU A 42 157.882 -0.303 5.817 1.00 0.00 H new ATOM 0 HA LEU A 42 160.350 -0.875 4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 42 157.784 -1.493 4.047 1.00 0.00 H new ATOM 0 HB3 LEU A 42 157.915 -0.129 2.955 1.00 0.00 H new ATOM 0 HG LEU A 42 160.235 -1.329 2.307 1.00 0.00 H new ATOM 0 HD11 LEU A 42 159.939 -3.797 2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 42 159.956 -3.147 3.964 1.00 0.00 H new ATOM 0 HD13 LEU A 42 158.414 -3.607 3.205 1.00 0.00 H new ATOM 0 HD21 LEU A 42 159.043 -2.461 0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 42 157.504 -2.260 1.315 1.00 0.00 H new ATOM 0 HD23 LEU A 42 158.391 -0.831 0.735 1.00 0.00 H new ATOM 671 N GLU A 43 159.185 2.112 3.898 1.00 0.00 N ATOM 672 CA GLU A 43 159.589 3.407 3.308 1.00 0.00 C ATOM 673 C GLU A 43 160.805 3.906 4.056 1.00 0.00 C ATOM 674 O GLU A 43 161.835 4.179 3.465 1.00 0.00 O ATOM 675 CB GLU A 43 158.429 4.428 3.411 1.00 0.00 C ATOM 676 CG GLU A 43 158.732 5.660 2.533 1.00 0.00 C ATOM 677 CD GLU A 43 159.215 6.821 3.380 1.00 0.00 C ATOM 678 OE1 GLU A 43 159.721 6.597 4.454 1.00 0.00 O ATOM 679 OE2 GLU A 43 159.076 7.925 2.947 1.00 0.00 O ATOM 0 H GLU A 43 158.268 2.106 4.345 1.00 0.00 H new ATOM 0 HA GLU A 43 159.829 3.282 2.252 1.00 0.00 H new ATOM 0 HB2 GLU A 43 157.496 3.964 3.092 1.00 0.00 H new ATOM 0 HB3 GLU A 43 158.294 4.734 4.448 1.00 0.00 H new ATOM 0 HG2 GLU A 43 159.489 5.406 1.791 1.00 0.00 H new ATOM 0 HG3 GLU A 43 157.835 5.952 1.986 1.00 0.00 H new ATOM 686 N LYS A 44 160.716 4.038 5.345 1.00 0.00 N ATOM 687 CA LYS A 44 161.884 4.527 6.096 1.00 0.00 C ATOM 688 C LYS A 44 163.058 3.594 5.844 1.00 0.00 C ATOM 689 O LYS A 44 164.168 4.038 5.634 1.00 0.00 O ATOM 690 CB LYS A 44 161.549 4.607 7.578 1.00 0.00 C ATOM 691 CG LYS A 44 160.854 5.955 7.864 1.00 0.00 C ATOM 692 CD LYS A 44 161.873 7.119 7.759 1.00 0.00 C ATOM 693 CE LYS A 44 161.331 8.230 6.830 1.00 0.00 C ATOM 694 NZ LYS A 44 161.526 7.860 5.399 1.00 0.00 N ATOM 0 H LYS A 44 159.888 3.829 5.903 1.00 0.00 H new ATOM 0 HA LYS A 44 162.155 5.528 5.762 1.00 0.00 H new ATOM 0 HB2 LYS A 44 160.898 3.780 7.862 1.00 0.00 H new ATOM 0 HB3 LYS A 44 162.457 4.517 8.175 1.00 0.00 H new ATOM 0 HG2 LYS A 44 160.040 6.110 7.155 1.00 0.00 H new ATOM 0 HG3 LYS A 44 160.411 5.939 8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 44 162.070 7.529 8.750 1.00 0.00 H new ATOM 0 HD3 LYS A 44 162.822 6.746 7.374 1.00 0.00 H new ATOM 0 HE2 LYS A 44 160.271 8.392 7.028 1.00 0.00 H new ATOM 0 HE3 LYS A 44 161.842 9.169 7.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 161.549 8.722 4.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 162.424 7.346 5.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 160.741 7.253 5.087 1.00 0.00 H new ATOM 708 N CYS A 45 162.803 2.319 5.762 1.00 0.00 N ATOM 709 CA CYS A 45 163.876 1.353 5.441 1.00 0.00 C ATOM 710 C CYS A 45 164.491 1.746 4.110 1.00 0.00 C ATOM 711 O CYS A 45 165.648 2.064 4.027 1.00 0.00 O ATOM 712 CB CYS A 45 163.282 -0.057 5.333 1.00 0.00 C ATOM 713 SG CYS A 45 163.142 -0.789 6.982 1.00 0.00 S ATOM 0 H CYS A 45 161.882 1.905 5.907 1.00 0.00 H new ATOM 0 HA CYS A 45 164.635 1.361 6.224 1.00 0.00 H new ATOM 0 HB2 CYS A 45 162.301 -0.013 4.860 1.00 0.00 H new ATOM 0 HB3 CYS A 45 163.914 -0.681 4.700 1.00 0.00 H new ATOM 0 HG CYS A 45 162.058 -0.360 7.557 1.00 0.00 H new ATOM 719 N LEU A 46 163.717 1.740 3.066 1.00 0.00 N ATOM 720 CA LEU A 46 164.259 2.116 1.725 1.00 0.00 C ATOM 721 C LEU A 46 164.904 3.497 1.806 1.00 0.00 C ATOM 722 O LEU A 46 165.947 3.714 1.273 1.00 0.00 O ATOM 723 CB LEU A 46 163.121 2.129 0.681 1.00 0.00 C ATOM 724 CG LEU A 46 163.684 2.379 -0.750 1.00 0.00 C ATOM 725 CD1 LEU A 46 164.943 1.551 -0.994 1.00 0.00 C ATOM 726 CD2 LEU A 46 162.643 1.987 -1.794 1.00 0.00 C ATOM 0 H LEU A 46 162.728 1.491 3.078 1.00 0.00 H new ATOM 0 HA LEU A 46 165.008 1.384 1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 46 162.588 1.178 0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 46 162.399 2.906 0.933 1.00 0.00 H new ATOM 0 HG LEU A 46 163.926 3.439 -0.832 1.00 0.00 H new ATOM 0 HD11 LEU A 46 165.316 1.744 -2.000 1.00 0.00 H new ATOM 0 HD12 LEU A 46 165.706 1.825 -0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 46 164.707 0.492 -0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 46 163.044 2.165 -2.792 1.00 0.00 H new ATOM 0 HD22 LEU A 46 162.397 0.931 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 46 161.743 2.585 -1.653 1.00 0.00 H new ATOM 738 N SER A 47 164.317 4.398 2.520 1.00 0.00 N ATOM 739 CA SER A 47 164.906 5.752 2.669 1.00 0.00 C ATOM 740 C SER A 47 166.301 5.624 3.294 1.00 0.00 C ATOM 741 O SER A 47 167.285 6.179 2.811 1.00 0.00 O ATOM 742 CB SER A 47 164.019 6.596 3.583 1.00 0.00 C ATOM 743 OG SER A 47 162.631 6.421 3.238 1.00 0.00 O ATOM 0 H SER A 47 163.438 4.256 3.018 1.00 0.00 H new ATOM 0 HA SER A 47 164.979 6.230 1.692 1.00 0.00 H new ATOM 0 HB2 SER A 47 164.181 6.310 4.622 1.00 0.00 H new ATOM 0 HB3 SER A 47 164.292 7.648 3.495 1.00 0.00 H new ATOM 0 HG SER A 47 162.300 5.586 3.629 1.00 0.00 H new ATOM 749 N ARG A 48 166.392 4.889 4.354 1.00 0.00 N ATOM 750 CA ARG A 48 167.690 4.688 5.038 1.00 0.00 C ATOM 751 C ARG A 48 168.616 3.924 4.109 1.00 0.00 C ATOM 752 O ARG A 48 169.816 4.191 4.040 1.00 0.00 O ATOM 753 CB ARG A 48 167.439 3.884 6.316 1.00 0.00 C ATOM 754 CG ARG A 48 166.709 4.781 7.344 1.00 0.00 C ATOM 755 CD ARG A 48 167.144 4.433 8.769 1.00 0.00 C ATOM 756 NE ARG A 48 168.629 4.257 8.825 1.00 0.00 N ATOM 757 CZ ARG A 48 169.214 3.931 9.946 1.00 0.00 C ATOM 758 NH1 ARG A 48 168.503 3.803 11.040 1.00 0.00 N ATOM 759 NH2 ARG A 48 170.496 3.743 9.964 1.00 0.00 N ATOM 0 H ARG A 48 165.604 4.407 4.787 1.00 0.00 H new ATOM 0 HA ARG A 48 168.150 5.643 5.293 1.00 0.00 H new ATOM 0 HB2 ARG A 48 166.839 3.002 6.093 1.00 0.00 H new ATOM 0 HB3 ARG A 48 168.384 3.531 6.729 1.00 0.00 H new ATOM 0 HG2 ARG A 48 166.925 5.829 7.138 1.00 0.00 H new ATOM 0 HG3 ARG A 48 165.631 4.653 7.246 1.00 0.00 H new ATOM 0 HD2 ARG A 48 166.838 5.223 9.454 1.00 0.00 H new ATOM 0 HD3 ARG A 48 166.649 3.518 9.095 1.00 0.00 H new ATOM 0 HE ARG A 48 169.188 4.393 7.982 1.00 0.00 H new ATOM 0 HH11 ARG A 48 167.495 3.958 11.014 1.00 0.00 H new ATOM 0 HH12 ARG A 48 168.958 3.548 11.917 1.00 0.00 H new ATOM 0 HH21 ARG A 48 171.039 3.850 9.107 1.00 0.00 H new ATOM 0 HH22 ARG A 48 170.962 3.488 10.835 1.00 0.00 H new ATOM 773 N MET A 49 168.079 2.983 3.396 1.00 0.00 N ATOM 774 CA MET A 49 168.884 2.199 2.460 1.00 0.00 C ATOM 775 C MET A 49 169.223 3.064 1.258 1.00 0.00 C ATOM 776 O MET A 49 170.146 2.804 0.585 1.00 0.00 O ATOM 777 CB MET A 49 168.099 0.961 1.980 1.00 0.00 C ATOM 778 CG MET A 49 167.580 0.142 3.180 1.00 0.00 C ATOM 779 SD MET A 49 168.541 -1.387 3.348 1.00 0.00 S ATOM 780 CE MET A 49 167.943 -2.236 1.864 1.00 0.00 C ATOM 0 H MET A 49 167.092 2.726 3.431 1.00 0.00 H new ATOM 0 HA MET A 49 169.793 1.870 2.963 1.00 0.00 H new ATOM 0 HB2 MET A 49 167.260 1.275 1.358 1.00 0.00 H new ATOM 0 HB3 MET A 49 168.741 0.337 1.358 1.00 0.00 H new ATOM 0 HG2 MET A 49 167.656 0.732 4.094 1.00 0.00 H new ATOM 0 HG3 MET A 49 166.525 -0.095 3.040 1.00 0.00 H new ATOM 0 HE1 MET A 49 168.696 -2.946 1.523 1.00 0.00 H new ATOM 0 HE2 MET A 49 167.021 -2.768 2.096 1.00 0.00 H new ATOM 0 HE3 MET A 49 167.752 -1.505 1.079 1.00 0.00 H new ATOM 790 N GLU A 50 168.529 4.132 1.039 1.00 0.00 N ATOM 791 CA GLU A 50 168.877 5.011 -0.093 1.00 0.00 C ATOM 792 C GLU A 50 170.121 5.782 0.283 1.00 0.00 C ATOM 793 O GLU A 50 171.106 5.812 -0.451 1.00 0.00 O ATOM 794 CB GLU A 50 167.724 5.953 -0.374 1.00 0.00 C ATOM 795 CG GLU A 50 166.648 5.235 -1.221 1.00 0.00 C ATOM 796 CD GLU A 50 166.135 6.150 -2.294 1.00 0.00 C ATOM 797 OE1 GLU A 50 166.933 6.707 -3.001 1.00 0.00 O ATOM 798 OE2 GLU A 50 164.945 6.278 -2.409 1.00 0.00 O ATOM 0 H GLU A 50 167.732 4.436 1.598 1.00 0.00 H new ATOM 0 HA GLU A 50 169.066 4.429 -0.995 1.00 0.00 H new ATOM 0 HB2 GLU A 50 167.289 6.299 0.564 1.00 0.00 H new ATOM 0 HB3 GLU A 50 168.085 6.835 -0.902 1.00 0.00 H new ATOM 0 HG2 GLU A 50 167.069 4.336 -1.671 1.00 0.00 H new ATOM 0 HG3 GLU A 50 165.825 4.916 -0.582 1.00 0.00 H new ATOM 805 N ASP A 51 170.121 6.327 1.468 1.00 0.00 N ATOM 806 CA ASP A 51 171.307 7.044 1.980 1.00 0.00 C ATOM 807 C ASP A 51 172.501 6.114 1.861 1.00 0.00 C ATOM 808 O ASP A 51 173.523 6.449 1.269 1.00 0.00 O ATOM 809 CB ASP A 51 171.094 7.366 3.463 1.00 0.00 C ATOM 810 CG ASP A 51 170.377 8.677 3.621 1.00 0.00 C ATOM 811 OD1 ASP A 51 171.000 9.697 3.481 1.00 0.00 O ATOM 812 OD2 ASP A 51 169.214 8.654 3.903 1.00 0.00 O ATOM 0 H ASP A 51 169.329 6.301 2.111 1.00 0.00 H new ATOM 0 HA ASP A 51 171.468 7.964 1.418 1.00 0.00 H new ATOM 0 HB2 ASP A 51 170.517 6.570 3.934 1.00 0.00 H new ATOM 0 HB3 ASP A 51 172.056 7.407 3.974 1.00 0.00 H new ATOM 817 N GLU A 52 172.386 4.957 2.446 1.00 0.00 N ATOM 818 CA GLU A 52 173.495 3.983 2.419 1.00 0.00 C ATOM 819 C GLU A 52 173.754 3.531 0.996 1.00 0.00 C ATOM 820 O GLU A 52 174.855 3.450 0.582 1.00 0.00 O ATOM 821 CB GLU A 52 173.149 2.757 3.286 1.00 0.00 C ATOM 822 CG GLU A 52 173.483 3.061 4.746 1.00 0.00 C ATOM 823 CD GLU A 52 173.185 1.861 5.620 1.00 0.00 C ATOM 824 OE1 GLU A 52 173.555 0.768 5.254 1.00 0.00 O ATOM 825 OE2 GLU A 52 172.612 2.056 6.655 1.00 0.00 O ATOM 0 H GLU A 52 171.555 4.645 2.948 1.00 0.00 H new ATOM 0 HA GLU A 52 174.388 4.465 2.816 1.00 0.00 H new ATOM 0 HB2 GLU A 52 172.091 2.513 3.186 1.00 0.00 H new ATOM 0 HB3 GLU A 52 173.710 1.887 2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 52 174.535 3.331 4.836 1.00 0.00 H new ATOM 0 HG3 GLU A 52 172.903 3.919 5.087 1.00 0.00 H new ATOM 832 N ASN A 53 172.741 3.156 0.288 1.00 0.00 N ATOM 833 CA ASN A 53 172.928 2.600 -1.080 1.00 0.00 C ATOM 834 C ASN A 53 173.658 3.582 -1.928 1.00 0.00 C ATOM 835 O ASN A 53 174.622 3.246 -2.591 1.00 0.00 O ATOM 836 CB ASN A 53 171.558 2.297 -1.686 1.00 0.00 C ATOM 837 CG ASN A 53 171.077 0.984 -1.093 1.00 0.00 C ATOM 838 OD1 ASN A 53 171.336 0.726 0.149 1.00 0.00 O flip ATOM 839 ND2 ASN A 53 170.471 0.178 -1.758 1.00 0.00 N flip ATOM 0 H ASN A 53 171.771 3.209 0.599 1.00 0.00 H new ATOM 0 HA ASN A 53 173.513 1.682 -1.028 1.00 0.00 H new ATOM 0 HB2 ASN A 53 170.854 3.099 -1.463 1.00 0.00 H new ATOM 0 HB3 ASN A 53 171.626 2.225 -2.771 1.00 0.00 H new ATOM 0 HD21 ASN A 53 170.264 0.377 -2.737 1.00 0.00 H new ATOM 0 HD22 ASN A 53 170.166 -0.701 -1.341 1.00 0.00 H new ATOM 846 N ASN A 54 173.246 4.817 -1.860 1.00 0.00 N ATOM 847 CA ASN A 54 173.924 5.899 -2.609 1.00 0.00 C ATOM 848 C ASN A 54 175.402 5.824 -2.306 1.00 0.00 C ATOM 849 O ASN A 54 176.216 5.606 -3.175 1.00 0.00 O ATOM 850 CB ASN A 54 173.406 7.257 -2.109 1.00 0.00 C ATOM 851 CG ASN A 54 172.112 7.656 -2.817 1.00 0.00 C ATOM 852 OD1 ASN A 54 171.580 6.920 -3.637 1.00 0.00 O ATOM 853 ND2 ASN A 54 171.570 8.789 -2.536 1.00 0.00 N ATOM 0 H ASN A 54 172.449 5.123 -1.302 1.00 0.00 H new ATOM 0 HA ASN A 54 173.734 5.792 -3.677 1.00 0.00 H new ATOM 0 HB2 ASN A 54 173.234 7.209 -1.034 1.00 0.00 H new ATOM 0 HB3 ASN A 54 174.165 8.021 -2.277 1.00 0.00 H new ATOM 0 HD21 ASN A 54 170.703 9.068 -2.996 1.00 0.00 H new ATOM 0 HD22 ASN A 54 172.007 9.408 -1.854 1.00 0.00 H new ATOM 860 N ARG A 55 175.750 5.982 -1.062 1.00 0.00 N ATOM 861 CA ARG A 55 177.171 5.926 -0.656 1.00 0.00 C ATOM 862 C ARG A 55 177.745 4.573 -1.022 1.00 0.00 C ATOM 863 O ARG A 55 178.593 4.471 -1.851 1.00 0.00 O ATOM 864 CB ARG A 55 177.255 6.130 0.853 1.00 0.00 C ATOM 865 CG ARG A 55 177.041 7.607 1.180 1.00 0.00 C ATOM 866 CD ARG A 55 178.391 8.342 1.181 1.00 0.00 C ATOM 867 NE ARG A 55 178.551 9.044 2.492 1.00 0.00 N ATOM 868 CZ ARG A 55 179.053 8.422 3.547 1.00 0.00 C ATOM 869 NH1 ARG A 55 179.620 7.247 3.421 1.00 0.00 N ATOM 870 NH2 ARG A 55 179.023 9.005 4.714 1.00 0.00 N ATOM 0 H ARG A 55 175.095 6.150 -0.299 1.00 0.00 H new ATOM 0 HA ARG A 55 177.739 6.704 -1.166 1.00 0.00 H new ATOM 0 HB2 ARG A 55 176.502 5.523 1.355 1.00 0.00 H new ATOM 0 HB3 ARG A 55 178.227 5.802 1.222 1.00 0.00 H new ATOM 0 HG2 ARG A 55 176.372 8.058 0.447 1.00 0.00 H new ATOM 0 HG3 ARG A 55 176.561 7.707 2.154 1.00 0.00 H new ATOM 0 HD2 ARG A 55 179.207 7.635 1.028 1.00 0.00 H new ATOM 0 HD3 ARG A 55 178.432 9.059 0.361 1.00 0.00 H new ATOM 0 HE ARG A 55 178.268 10.020 2.575 1.00 0.00 H new ATOM 0 HH11 ARG A 55 179.677 6.804 2.504 1.00 0.00 H new ATOM 0 HH12 ARG A 55 180.004 6.776 4.240 1.00 0.00 H new ATOM 0 HH21 ARG A 55 178.614 9.935 4.809 1.00 0.00 H new ATOM 0 HH22 ARG A 55 179.408 8.531 5.531 1.00 0.00 H new ATOM 884 N LEU A 56 177.263 3.549 -0.404 1.00 0.00 N ATOM 885 CA LEU A 56 177.718 2.164 -0.662 1.00 0.00 C ATOM 886 C LEU A 56 178.074 1.959 -2.104 1.00 0.00 C ATOM 887 O LEU A 56 179.173 1.541 -2.429 1.00 0.00 O ATOM 888 CB LEU A 56 176.532 1.221 -0.359 1.00 0.00 C ATOM 889 CG LEU A 56 176.536 0.860 1.141 1.00 0.00 C ATOM 890 CD1 LEU A 56 175.290 0.042 1.482 1.00 0.00 C ATOM 891 CD2 LEU A 56 177.798 0.035 1.471 1.00 0.00 C ATOM 0 H LEU A 56 176.534 3.617 0.307 1.00 0.00 H new ATOM 0 HA LEU A 56 178.594 1.967 -0.044 1.00 0.00 H new ATOM 0 HB2 LEU A 56 175.592 1.704 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 56 176.609 0.317 -0.962 1.00 0.00 H new ATOM 0 HG LEU A 56 176.536 1.778 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 56 175.299 -0.210 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 56 174.398 0.626 1.255 1.00 0.00 H new ATOM 0 HD13 LEU A 56 175.284 -0.874 0.892 1.00 0.00 H new ATOM 0 HD21 LEU A 56 177.800 -0.219 2.531 1.00 0.00 H new ATOM 0 HD22 LEU A 56 177.800 -0.880 0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 56 178.687 0.621 1.237 1.00 0.00 H new ATOM 903 N ARG A 57 177.136 2.185 -2.982 1.00 0.00 N ATOM 904 CA ARG A 57 177.387 1.959 -4.415 1.00 0.00 C ATOM 905 C ARG A 57 178.517 2.860 -4.883 1.00 0.00 C ATOM 906 O ARG A 57 179.320 2.458 -5.707 1.00 0.00 O ATOM 907 CB ARG A 57 176.125 2.235 -5.239 1.00 0.00 C ATOM 908 CG ARG A 57 174.968 1.303 -4.785 1.00 0.00 C ATOM 909 CD ARG A 57 174.637 0.235 -5.863 1.00 0.00 C ATOM 910 NE ARG A 57 174.680 0.842 -7.237 1.00 0.00 N ATOM 911 CZ ARG A 57 173.977 0.335 -8.236 1.00 0.00 C ATOM 912 NH1 ARG A 57 173.242 -0.729 -8.064 1.00 0.00 N ATOM 913 NH2 ARG A 57 174.047 0.889 -9.407 1.00 0.00 N ATOM 0 H ARG A 57 176.200 2.520 -2.756 1.00 0.00 H new ATOM 0 HA ARG A 57 177.669 0.916 -4.558 1.00 0.00 H new ATOM 0 HB2 ARG A 57 175.828 3.277 -5.123 1.00 0.00 H new ATOM 0 HB3 ARG A 57 176.333 2.079 -6.298 1.00 0.00 H new ATOM 0 HG2 ARG A 57 175.243 0.808 -3.854 1.00 0.00 H new ATOM 0 HG3 ARG A 57 174.079 1.899 -4.578 1.00 0.00 H new ATOM 0 HD2 ARG A 57 175.350 -0.587 -5.800 1.00 0.00 H new ATOM 0 HD3 ARG A 57 173.649 -0.185 -5.676 1.00 0.00 H new ATOM 0 HE ARG A 57 175.263 1.662 -7.403 1.00 0.00 H new ATOM 0 HH11 ARG A 57 173.204 -1.181 -7.150 1.00 0.00 H new ATOM 0 HH12 ARG A 57 172.705 -1.109 -8.843 1.00 0.00 H new ATOM 0 HH21 ARG A 57 174.640 1.707 -9.550 1.00 0.00 H new ATOM 0 HH22 ARG A 57 173.509 0.507 -10.185 1.00 0.00 H new ATOM 927 N LEU A 58 178.584 4.066 -4.407 1.00 0.00 N ATOM 928 CA LEU A 58 179.653 4.982 -4.848 1.00 0.00 C ATOM 929 C LEU A 58 180.981 4.527 -4.238 1.00 0.00 C ATOM 930 O LEU A 58 182.005 4.490 -4.919 1.00 0.00 O ATOM 931 CB LEU A 58 179.324 6.397 -4.433 1.00 0.00 C ATOM 932 CG LEU A 58 178.031 6.855 -5.115 1.00 0.00 C ATOM 933 CD1 LEU A 58 177.428 8.056 -4.374 1.00 0.00 C ATOM 934 CD2 LEU A 58 178.340 7.235 -6.549 1.00 0.00 C ATOM 0 H LEU A 58 177.935 4.457 -3.724 1.00 0.00 H new ATOM 0 HA LEU A 58 179.737 4.961 -5.935 1.00 0.00 H new ATOM 0 HB2 LEU A 58 179.213 6.451 -3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 58 180.143 7.064 -4.703 1.00 0.00 H new ATOM 0 HG LEU A 58 177.306 6.042 -5.095 1.00 0.00 H new ATOM 0 HD11 LEU A 58 176.510 8.368 -4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 58 177.204 7.774 -3.345 1.00 0.00 H new ATOM 0 HD13 LEU A 58 178.141 8.881 -4.377 1.00 0.00 H new ATOM 0 HD21 LEU A 58 177.426 7.563 -7.044 1.00 0.00 H new ATOM 0 HD22 LEU A 58 179.070 8.045 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 58 178.747 6.371 -7.075 1.00 0.00 H new ATOM 946 N GLU A 59 180.971 4.206 -2.995 1.00 0.00 N ATOM 947 CA GLU A 59 182.191 3.766 -2.286 1.00 0.00 C ATOM 948 C GLU A 59 182.641 2.420 -2.824 1.00 0.00 C ATOM 949 O GLU A 59 183.719 2.291 -3.341 1.00 0.00 O ATOM 950 CB GLU A 59 181.878 3.647 -0.776 1.00 0.00 C ATOM 951 CG GLU A 59 181.614 5.054 -0.202 1.00 0.00 C ATOM 952 CD GLU A 59 181.325 4.976 1.278 1.00 0.00 C ATOM 953 OE1 GLU A 59 181.965 4.221 1.954 1.00 0.00 O ATOM 954 OE2 GLU A 59 180.464 5.677 1.725 1.00 0.00 O ATOM 0 H GLU A 59 180.135 4.230 -2.412 1.00 0.00 H new ATOM 0 HA GLU A 59 182.989 4.493 -2.441 1.00 0.00 H new ATOM 0 HB2 GLU A 59 181.008 3.009 -0.622 1.00 0.00 H new ATOM 0 HB3 GLU A 59 182.713 3.179 -0.255 1.00 0.00 H new ATOM 0 HG2 GLU A 59 182.480 5.693 -0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 59 180.771 5.512 -0.719 1.00 0.00 H new ATOM 961 N SER A 60 181.823 1.418 -2.674 1.00 0.00 N ATOM 962 CA SER A 60 182.192 0.035 -3.120 1.00 0.00 C ATOM 963 C SER A 60 182.957 0.085 -4.446 1.00 0.00 C ATOM 964 O SER A 60 184.104 -0.313 -4.536 1.00 0.00 O ATOM 965 CB SER A 60 180.912 -0.780 -3.312 1.00 0.00 C ATOM 966 OG SER A 60 179.956 0.005 -4.034 1.00 0.00 O ATOM 0 H SER A 60 180.896 1.494 -2.254 1.00 0.00 H new ATOM 0 HA SER A 60 182.828 -0.425 -2.364 1.00 0.00 H new ATOM 0 HB2 SER A 60 181.130 -1.699 -3.856 1.00 0.00 H new ATOM 0 HB3 SER A 60 180.504 -1.072 -2.344 1.00 0.00 H new ATOM 0 HG SER A 60 179.373 0.473 -3.401 1.00 0.00 H new ATOM 972 N LYS A 61 182.322 0.570 -5.478 1.00 0.00 N ATOM 973 CA LYS A 61 182.991 0.643 -6.820 1.00 0.00 C ATOM 974 C LYS A 61 184.342 1.366 -6.670 1.00 0.00 C ATOM 975 O LYS A 61 185.331 1.012 -7.297 1.00 0.00 O ATOM 976 CB LYS A 61 182.092 1.425 -7.808 1.00 0.00 C ATOM 977 CG LYS A 61 181.850 2.843 -7.254 1.00 0.00 C ATOM 978 CD LYS A 61 180.842 3.638 -8.127 1.00 0.00 C ATOM 979 CE LYS A 61 181.278 5.123 -8.234 1.00 0.00 C ATOM 980 NZ LYS A 61 182.287 5.453 -7.186 1.00 0.00 N ATOM 0 H LYS A 61 181.365 0.922 -5.455 1.00 0.00 H new ATOM 0 HA LYS A 61 183.153 -0.364 -7.204 1.00 0.00 H new ATOM 0 HB2 LYS A 61 182.568 1.480 -8.787 1.00 0.00 H new ATOM 0 HB3 LYS A 61 181.143 0.907 -7.944 1.00 0.00 H new ATOM 0 HG2 LYS A 61 181.473 2.775 -6.234 1.00 0.00 H new ATOM 0 HG3 LYS A 61 182.796 3.382 -7.209 1.00 0.00 H new ATOM 0 HD2 LYS A 61 180.784 3.196 -9.122 1.00 0.00 H new ATOM 0 HD3 LYS A 61 179.845 3.575 -7.692 1.00 0.00 H new ATOM 0 HE2 LYS A 61 181.697 5.314 -9.222 1.00 0.00 H new ATOM 0 HE3 LYS A 61 180.408 5.771 -8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 182.365 6.486 -7.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 181.990 5.045 -6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 183.211 5.059 -7.457 1.00 0.00 H new ATOM 994 N ARG A 62 184.388 2.373 -5.842 1.00 0.00 N ATOM 995 CA ARG A 62 185.637 3.136 -5.642 1.00 0.00 C ATOM 996 C ARG A 62 186.442 2.503 -4.520 1.00 0.00 C ATOM 997 O ARG A 62 187.351 3.128 -3.983 1.00 0.00 O ATOM 998 CB ARG A 62 185.322 4.618 -5.300 1.00 0.00 C ATOM 999 CG ARG A 62 185.767 5.548 -6.463 1.00 0.00 C ATOM 1000 CD ARG A 62 187.280 5.909 -6.359 1.00 0.00 C ATOM 1001 NE ARG A 62 187.983 4.972 -5.420 1.00 0.00 N ATOM 1002 CZ ARG A 62 189.285 4.989 -5.265 1.00 0.00 C ATOM 1003 NH1 ARG A 62 190.029 5.806 -5.966 1.00 0.00 N ATOM 1004 NH2 ARG A 62 189.822 4.181 -4.406 1.00 0.00 N ATOM 0 H ARG A 62 183.595 2.699 -5.289 1.00 0.00 H new ATOM 0 HA ARG A 62 186.218 3.113 -6.564 1.00 0.00 H new ATOM 0 HB2 ARG A 62 184.254 4.737 -5.119 1.00 0.00 H new ATOM 0 HB3 ARG A 62 185.835 4.903 -4.381 1.00 0.00 H new ATOM 0 HG2 ARG A 62 185.574 5.057 -7.417 1.00 0.00 H new ATOM 0 HG3 ARG A 62 185.172 6.461 -6.448 1.00 0.00 H new ATOM 0 HD2 ARG A 62 187.740 5.857 -7.346 1.00 0.00 H new ATOM 0 HD3 ARG A 62 187.391 6.935 -6.009 1.00 0.00 H new ATOM 0 HE ARG A 62 187.431 4.301 -4.886 1.00 0.00 H new ATOM 0 HH11 ARG A 62 189.597 6.437 -6.641 1.00 0.00 H new ATOM 0 HH12 ARG A 62 191.041 5.811 -5.838 1.00 0.00 H new ATOM 0 HH21 ARG A 62 189.234 3.547 -3.865 1.00 0.00 H new ATOM 0 HH22 ARG A 62 190.833 4.179 -4.271 1.00 0.00 H new ATOM 1018 N LEU A 63 186.141 1.302 -4.156 1.00 0.00 N ATOM 1019 CA LEU A 63 186.884 0.635 -3.097 1.00 0.00 C ATOM 1020 C LEU A 63 187.632 -0.553 -3.693 1.00 0.00 C ATOM 1021 O LEU A 63 187.296 -1.049 -4.764 1.00 0.00 O ATOM 1022 CB LEU A 63 185.927 0.126 -2.022 1.00 0.00 C ATOM 1023 CG LEU A 63 185.579 1.228 -0.999 1.00 0.00 C ATOM 1024 CD1 LEU A 63 184.338 0.811 -0.221 1.00 0.00 C ATOM 1025 CD2 LEU A 63 186.726 1.395 0.002 1.00 0.00 C ATOM 0 H LEU A 63 185.389 0.748 -4.565 1.00 0.00 H new ATOM 0 HA LEU A 63 187.583 1.342 -2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 63 185.012 -0.237 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 63 186.378 -0.721 -1.505 1.00 0.00 H new ATOM 0 HG LEU A 63 185.409 2.163 -1.533 1.00 0.00 H new ATOM 0 HD11 LEU A 63 184.086 1.585 0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 63 183.505 0.675 -0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 63 184.534 -0.126 0.301 1.00 0.00 H new ATOM 0 HD21 LEU A 63 186.472 2.175 0.720 1.00 0.00 H new ATOM 0 HD22 LEU A 63 186.888 0.455 0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 63 187.635 1.674 -0.530 1.00 0.00 H new ATOM 2083 N HIS B 23 153.490 11.454 6.797 1.00 0.00 N ATOM 2084 CA HIS B 23 152.774 10.917 5.592 1.00 0.00 C ATOM 2085 C HIS B 23 151.564 10.059 5.995 1.00 0.00 C ATOM 2086 O HIS B 23 150.815 9.618 5.140 1.00 0.00 O ATOM 2087 CB HIS B 23 153.746 10.079 4.743 1.00 0.00 C ATOM 2088 CG HIS B 23 153.396 10.196 3.282 1.00 0.00 C ATOM 2089 ND1 HIS B 23 153.127 11.418 2.668 1.00 0.00 N ATOM 2090 CD2 HIS B 23 153.272 9.248 2.295 1.00 0.00 C ATOM 2091 CE1 HIS B 23 152.858 11.159 1.372 1.00 0.00 C ATOM 2092 NE2 HIS B 23 152.931 9.859 1.097 1.00 0.00 N ATOM 0 HA HIS B 23 152.409 11.763 5.009 1.00 0.00 H new ATOM 0 HB2 HIS B 23 154.769 10.418 4.908 1.00 0.00 H new ATOM 0 HB3 HIS B 23 153.703 9.035 5.052 1.00 0.00 H new ATOM 0 HD2 HIS B 23 153.418 8.187 2.431 1.00 0.00 H new ATOM 0 HE1 HIS B 23 152.612 11.917 0.643 1.00 0.00 H new ATOM 0 HE2 HIS B 23 152.770 9.408 0.197 1.00 0.00 H new ATOM 2101 N THR B 24 151.356 9.797 7.268 1.00 0.00 N ATOM 2102 CA THR B 24 150.190 8.922 7.649 1.00 0.00 C ATOM 2103 C THR B 24 148.903 9.420 6.973 1.00 0.00 C ATOM 2104 O THR B 24 148.331 8.715 6.155 1.00 0.00 O ATOM 2105 CB THR B 24 150.015 8.817 9.180 1.00 0.00 C ATOM 2106 OG1 THR B 24 151.237 9.120 9.820 1.00 0.00 O ATOM 2107 CG2 THR B 24 149.631 7.382 9.546 1.00 0.00 C ATOM 0 H THR B 24 151.925 10.139 8.042 1.00 0.00 H new ATOM 0 HA THR B 24 150.403 7.915 7.290 1.00 0.00 H new ATOM 0 HB THR B 24 149.240 9.515 9.498 1.00 0.00 H new ATOM 0 HG1 THR B 24 151.123 9.054 10.791 1.00 0.00 H new ATOM 0 HG21 THR B 24 149.506 7.303 10.626 1.00 0.00 H new ATOM 0 HG22 THR B 24 148.696 7.119 9.052 1.00 0.00 H new ATOM 0 HG23 THR B 24 150.417 6.701 9.221 1.00 0.00 H new ATOM 2115 N GLU B 25 148.463 10.630 7.255 1.00 0.00 N ATOM 2116 CA GLU B 25 147.249 11.165 6.569 1.00 0.00 C ATOM 2117 C GLU B 25 147.355 10.888 5.076 1.00 0.00 C ATOM 2118 O GLU B 25 146.571 10.124 4.519 1.00 0.00 O ATOM 2119 CB GLU B 25 147.186 12.686 6.792 1.00 0.00 C ATOM 2120 CG GLU B 25 146.727 12.981 8.234 1.00 0.00 C ATOM 2121 CD GLU B 25 145.223 12.861 8.321 1.00 0.00 C ATOM 2122 OE1 GLU B 25 144.755 11.785 8.508 1.00 0.00 O ATOM 2123 OE2 GLU B 25 144.554 13.855 8.192 1.00 0.00 O ATOM 0 H GLU B 25 148.894 11.263 7.929 1.00 0.00 H new ATOM 0 HA GLU B 25 146.354 10.688 6.969 1.00 0.00 H new ATOM 0 HB2 GLU B 25 148.165 13.130 6.614 1.00 0.00 H new ATOM 0 HB3 GLU B 25 146.496 13.139 6.080 1.00 0.00 H new ATOM 0 HG2 GLU B 25 147.198 12.284 8.926 1.00 0.00 H new ATOM 0 HG3 GLU B 25 147.040 13.983 8.528 1.00 0.00 H new ATOM 2130 N SER B 26 148.247 11.546 4.408 1.00 0.00 N ATOM 2131 CA SER B 26 148.395 11.357 2.946 1.00 0.00 C ATOM 2132 C SER B 26 148.352 9.861 2.604 1.00 0.00 C ATOM 2133 O SER B 26 147.658 9.445 1.692 1.00 0.00 O ATOM 2134 CB SER B 26 149.733 11.958 2.529 1.00 0.00 C ATOM 2135 OG SER B 26 149.975 13.131 3.330 1.00 0.00 O ATOM 0 H SER B 26 148.893 12.220 4.819 1.00 0.00 H new ATOM 0 HA SER B 26 147.581 11.849 2.413 1.00 0.00 H new ATOM 0 HB2 SER B 26 150.534 11.232 2.668 1.00 0.00 H new ATOM 0 HB3 SER B 26 149.718 12.218 1.471 1.00 0.00 H new ATOM 0 HG SER B 26 150.833 13.529 3.076 1.00 0.00 H new ATOM 2141 N LEU B 27 148.994 9.042 3.390 1.00 0.00 N ATOM 2142 CA LEU B 27 148.948 7.582 3.144 1.00 0.00 C ATOM 2143 C LEU B 27 147.506 7.085 3.231 1.00 0.00 C ATOM 2144 O LEU B 27 147.051 6.339 2.378 1.00 0.00 O ATOM 2145 CB LEU B 27 149.814 6.856 4.169 1.00 0.00 C ATOM 2146 CG LEU B 27 151.292 6.964 3.784 1.00 0.00 C ATOM 2147 CD1 LEU B 27 152.164 6.483 4.944 1.00 0.00 C ATOM 2148 CD2 LEU B 27 151.590 6.112 2.539 1.00 0.00 C ATOM 0 H LEU B 27 149.551 9.327 4.196 1.00 0.00 H new ATOM 0 HA LEU B 27 149.333 7.376 2.145 1.00 0.00 H new ATOM 0 HB2 LEU B 27 149.656 7.285 5.158 1.00 0.00 H new ATOM 0 HB3 LEU B 27 149.521 5.808 4.226 1.00 0.00 H new ATOM 0 HG LEU B 27 151.515 8.007 3.561 1.00 0.00 H new ATOM 0 HD11 LEU B 27 153.215 6.561 4.666 1.00 0.00 H new ATOM 0 HD12 LEU B 27 151.974 7.100 5.822 1.00 0.00 H new ATOM 0 HD13 LEU B 27 151.926 5.444 5.172 1.00 0.00 H new ATOM 0 HD21 LEU B 27 152.645 6.202 2.281 1.00 0.00 H new ATOM 0 HD22 LEU B 27 151.355 5.068 2.748 1.00 0.00 H new ATOM 0 HD23 LEU B 27 150.981 6.461 1.705 1.00 0.00 H new ATOM 2160 N GLN B 28 146.762 7.495 4.228 1.00 0.00 N ATOM 2161 CA GLN B 28 145.339 7.028 4.293 1.00 0.00 C ATOM 2162 C GLN B 28 144.517 7.761 3.258 1.00 0.00 C ATOM 2163 O GLN B 28 143.484 7.276 2.831 1.00 0.00 O ATOM 2164 CB GLN B 28 144.648 7.193 5.684 1.00 0.00 C ATOM 2165 CG GLN B 28 145.577 7.764 6.750 1.00 0.00 C ATOM 2166 CD GLN B 28 146.394 6.629 7.341 1.00 0.00 C ATOM 2167 OE1 GLN B 28 147.634 6.519 7.046 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 145.872 5.811 8.071 1.00 0.00 N flip ATOM 0 H GLN B 28 147.064 8.114 4.980 1.00 0.00 H new ATOM 0 HA GLN B 28 145.383 5.956 4.100 1.00 0.00 H new ATOM 0 HB2 GLN B 28 143.782 7.846 5.578 1.00 0.00 H new ATOM 0 HB3 GLN B 28 144.277 6.223 6.016 1.00 0.00 H new ATOM 0 HG2 GLN B 28 146.235 8.516 6.315 1.00 0.00 H new ATOM 0 HG3 GLN B 28 144.998 8.259 7.530 1.00 0.00 H new ATOM 0 HE21 GLN B 28 144.884 5.896 8.308 1.00 0.00 H new ATOM 0 HE22 GLN B 28 146.422 5.039 8.447 1.00 0.00 H new ATOM 2177 N ASN B 29 144.906 8.949 2.901 1.00 0.00 N ATOM 2178 CA ASN B 29 144.076 9.741 1.964 1.00 0.00 C ATOM 2179 C ASN B 29 144.350 9.320 0.525 1.00 0.00 C ATOM 2180 O ASN B 29 143.649 9.728 -0.392 1.00 0.00 O ATOM 2181 CB ASN B 29 144.349 11.217 2.151 1.00 0.00 C ATOM 2182 CG ASN B 29 143.757 11.676 3.472 1.00 0.00 C ATOM 2183 OD1 ASN B 29 144.441 11.554 4.549 1.00 0.00 O flip ATOM 2184 ND2 ASN B 29 142.636 12.138 3.523 1.00 0.00 N flip ATOM 0 H ASN B 29 145.762 9.404 3.218 1.00 0.00 H new ATOM 0 HA ASN B 29 143.024 9.553 2.179 1.00 0.00 H new ATOM 0 HB2 ASN B 29 145.423 11.404 2.136 1.00 0.00 H new ATOM 0 HB3 ASN B 29 143.915 11.785 1.328 1.00 0.00 H new ATOM 0 HD21 ASN B 29 142.086 12.238 2.670 1.00 0.00 H new ATOM 0 HD22 ASN B 29 142.244 12.426 4.419 1.00 0.00 H new ATOM 2191 N MET B 30 145.308 8.470 0.317 1.00 0.00 N ATOM 2192 CA MET B 30 145.586 7.972 -1.038 1.00 0.00 C ATOM 2193 C MET B 30 144.681 6.788 -1.303 1.00 0.00 C ATOM 2194 O MET B 30 144.085 6.241 -0.386 1.00 0.00 O ATOM 2195 CB MET B 30 147.033 7.488 -1.115 1.00 0.00 C ATOM 2196 CG MET B 30 147.989 8.680 -1.180 1.00 0.00 C ATOM 2197 SD MET B 30 149.188 8.392 -2.498 1.00 0.00 S ATOM 2198 CE MET B 30 149.894 6.861 -1.832 1.00 0.00 C ATOM 0 H MET B 30 145.917 8.097 1.045 1.00 0.00 H new ATOM 0 HA MET B 30 145.419 8.766 -1.765 1.00 0.00 H new ATOM 0 HB2 MET B 30 147.265 6.874 -0.245 1.00 0.00 H new ATOM 0 HB3 MET B 30 147.166 6.858 -1.994 1.00 0.00 H new ATOM 0 HG2 MET B 30 147.434 9.599 -1.369 1.00 0.00 H new ATOM 0 HG3 MET B 30 148.500 8.806 -0.226 1.00 0.00 H new ATOM 0 HE1 MET B 30 150.982 6.909 -1.885 1.00 0.00 H new ATOM 0 HE2 MET B 30 149.586 6.740 -0.793 1.00 0.00 H new ATOM 0 HE3 MET B 30 149.539 6.012 -2.417 1.00 0.00 H new ATOM 2208 N SER B 31 144.569 6.376 -2.512 1.00 0.00 N ATOM 2209 CA SER B 31 143.698 5.223 -2.812 1.00 0.00 C ATOM 2210 C SER B 31 144.536 3.958 -2.664 1.00 0.00 C ATOM 2211 O SER B 31 145.707 3.916 -3.036 1.00 0.00 O ATOM 2212 CB SER B 31 143.154 5.338 -4.250 1.00 0.00 C ATOM 2213 OG SER B 31 143.111 6.728 -4.647 1.00 0.00 O ATOM 0 H SER B 31 145.044 6.786 -3.316 1.00 0.00 H new ATOM 0 HA SER B 31 142.849 5.195 -2.129 1.00 0.00 H new ATOM 0 HB2 SER B 31 143.788 4.774 -4.935 1.00 0.00 H new ATOM 0 HB3 SER B 31 142.156 4.903 -4.307 1.00 0.00 H new ATOM 0 HG SER B 31 142.766 6.796 -5.562 1.00 0.00 H new ATOM 2219 N LYS B 32 143.970 2.959 -2.058 1.00 0.00 N ATOM 2220 CA LYS B 32 144.691 1.683 -1.792 1.00 0.00 C ATOM 2221 C LYS B 32 145.404 1.238 -3.062 1.00 0.00 C ATOM 2222 O LYS B 32 146.557 0.859 -3.028 1.00 0.00 O ATOM 2223 CB LYS B 32 143.675 0.608 -1.357 1.00 0.00 C ATOM 2224 CG LYS B 32 144.259 -0.304 -0.256 1.00 0.00 C ATOM 2225 CD LYS B 32 143.778 -1.754 -0.472 1.00 0.00 C ATOM 2226 CE LYS B 32 143.839 -2.541 0.856 1.00 0.00 C ATOM 2227 NZ LYS B 32 142.515 -3.111 1.188 1.00 0.00 N ATOM 0 H LYS B 32 143.006 2.972 -1.724 1.00 0.00 H new ATOM 0 HA LYS B 32 145.424 1.827 -0.998 1.00 0.00 H new ATOM 0 HB2 LYS B 32 142.768 1.089 -0.990 1.00 0.00 H new ATOM 0 HB3 LYS B 32 143.390 0.004 -2.219 1.00 0.00 H new ATOM 0 HG2 LYS B 32 145.348 -0.265 -0.278 1.00 0.00 H new ATOM 0 HG3 LYS B 32 143.947 0.050 0.726 1.00 0.00 H new ATOM 0 HD2 LYS B 32 142.758 -1.753 -0.856 1.00 0.00 H new ATOM 0 HD3 LYS B 32 144.400 -2.243 -1.222 1.00 0.00 H new ATOM 0 HE2 LYS B 32 144.575 -3.341 0.777 1.00 0.00 H new ATOM 0 HE3 LYS B 32 144.169 -1.883 1.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 142.561 -3.578 2.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 141.807 -2.350 1.218 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 142.245 -3.807 0.464 1.00 0.00 H new ATOM 2241 N GLN B 33 144.744 1.323 -4.178 1.00 0.00 N ATOM 2242 CA GLN B 33 145.380 0.914 -5.465 1.00 0.00 C ATOM 2243 C GLN B 33 146.731 1.588 -5.593 1.00 0.00 C ATOM 2244 O GLN B 33 147.719 0.959 -5.870 1.00 0.00 O ATOM 2245 CB GLN B 33 144.516 1.357 -6.645 1.00 0.00 C ATOM 2246 CG GLN B 33 143.397 0.351 -6.905 1.00 0.00 C ATOM 2247 CD GLN B 33 142.925 0.512 -8.343 1.00 0.00 C ATOM 2248 OE1 GLN B 33 142.757 -0.449 -9.045 1.00 0.00 O ATOM 2249 NE2 GLN B 33 142.703 1.689 -8.813 1.00 0.00 N ATOM 0 H GLN B 33 143.785 1.660 -4.259 1.00 0.00 H new ATOM 0 HA GLN B 33 145.487 -0.171 -5.471 1.00 0.00 H new ATOM 0 HB2 GLN B 33 144.088 2.339 -6.440 1.00 0.00 H new ATOM 0 HB3 GLN B 33 145.135 1.458 -7.537 1.00 0.00 H new ATOM 0 HG2 GLN B 33 143.754 -0.665 -6.735 1.00 0.00 H new ATOM 0 HG3 GLN B 33 142.570 0.518 -6.214 1.00 0.00 H new ATOM 0 HE21 GLN B 33 142.844 2.509 -8.223 1.00 0.00 H new ATOM 0 HE22 GLN B 33 142.386 1.802 -9.776 1.00 0.00 H new ATOM 2258 N GLU B 34 146.761 2.867 -5.426 1.00 0.00 N ATOM 2259 CA GLU B 34 148.016 3.627 -5.595 1.00 0.00 C ATOM 2260 C GLU B 34 149.026 3.127 -4.600 1.00 0.00 C ATOM 2261 O GLU B 34 150.104 2.688 -4.967 1.00 0.00 O ATOM 2262 CB GLU B 34 147.727 5.123 -5.388 1.00 0.00 C ATOM 2263 CG GLU B 34 146.433 5.509 -6.151 1.00 0.00 C ATOM 2264 CD GLU B 34 146.513 5.015 -7.583 1.00 0.00 C ATOM 2265 OE1 GLU B 34 147.033 5.714 -8.393 1.00 0.00 O ATOM 2266 OE2 GLU B 34 146.052 3.923 -7.855 1.00 0.00 O ATOM 0 H GLU B 34 145.951 3.433 -5.174 1.00 0.00 H new ATOM 0 HA GLU B 34 148.419 3.489 -6.598 1.00 0.00 H new ATOM 0 HB2 GLU B 34 147.614 5.339 -4.326 1.00 0.00 H new ATOM 0 HB3 GLU B 34 148.566 5.720 -5.747 1.00 0.00 H new ATOM 0 HG2 GLU B 34 145.565 5.075 -5.655 1.00 0.00 H new ATOM 0 HG3 GLU B 34 146.301 6.591 -6.137 1.00 0.00 H new ATOM 2273 N LEU B 35 148.668 3.126 -3.354 1.00 0.00 N ATOM 2274 CA LEU B 35 149.577 2.601 -2.294 1.00 0.00 C ATOM 2275 C LEU B 35 150.079 1.230 -2.722 1.00 0.00 C ATOM 2276 O LEU B 35 151.213 0.865 -2.469 1.00 0.00 O ATOM 2277 CB LEU B 35 148.784 2.440 -0.997 1.00 0.00 C ATOM 2278 CG LEU B 35 148.339 3.806 -0.465 1.00 0.00 C ATOM 2279 CD1 LEU B 35 147.040 3.656 0.325 1.00 0.00 C ATOM 2280 CD2 LEU B 35 149.417 4.376 0.450 1.00 0.00 C ATOM 0 H LEU B 35 147.770 3.471 -3.014 1.00 0.00 H new ATOM 0 HA LEU B 35 150.412 3.286 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU B 35 147.912 1.810 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU B 35 149.396 1.935 -0.250 1.00 0.00 H new ATOM 0 HG LEU B 35 148.178 4.479 -1.307 1.00 0.00 H new ATOM 0 HD11 LEU B 35 146.728 4.630 0.701 1.00 0.00 H new ATOM 0 HD12 LEU B 35 146.264 3.252 -0.325 1.00 0.00 H new ATOM 0 HD13 LEU B 35 147.200 2.978 1.163 1.00 0.00 H new ATOM 0 HD21 LEU B 35 149.098 5.348 0.827 1.00 0.00 H new ATOM 0 HD22 LEU B 35 149.580 3.697 1.287 1.00 0.00 H new ATOM 0 HD23 LEU B 35 150.345 4.491 -0.109 1.00 0.00 H new ATOM 2292 N ILE B 36 149.243 0.457 -3.332 1.00 0.00 N ATOM 2293 CA ILE B 36 149.683 -0.881 -3.768 1.00 0.00 C ATOM 2294 C ILE B 36 150.637 -0.706 -4.943 1.00 0.00 C ATOM 2295 O ILE B 36 151.726 -1.256 -4.953 1.00 0.00 O ATOM 2296 CB ILE B 36 148.467 -1.716 -4.188 1.00 0.00 C ATOM 2297 CG1 ILE B 36 147.544 -1.920 -2.975 1.00 0.00 C ATOM 2298 CG2 ILE B 36 148.924 -3.084 -4.724 1.00 0.00 C ATOM 2299 CD1 ILE B 36 146.150 -2.329 -3.445 1.00 0.00 C ATOM 0 H ILE B 36 148.274 0.693 -3.548 1.00 0.00 H new ATOM 0 HA ILE B 36 150.188 -1.400 -2.954 1.00 0.00 H new ATOM 0 HB ILE B 36 147.927 -1.190 -4.975 1.00 0.00 H new ATOM 0 HG12 ILE B 36 147.956 -2.687 -2.319 1.00 0.00 H new ATOM 0 HG13 ILE B 36 147.486 -1.000 -2.393 1.00 0.00 H new ATOM 0 HG21 ILE B 36 148.053 -3.669 -5.019 1.00 0.00 H new ATOM 0 HG22 ILE B 36 149.573 -2.938 -5.588 1.00 0.00 H new ATOM 0 HG23 ILE B 36 149.471 -3.616 -3.945 1.00 0.00 H new ATOM 0 HD11 ILE B 36 145.502 -2.472 -2.580 1.00 0.00 H new ATOM 0 HD12 ILE B 36 145.737 -1.547 -4.083 1.00 0.00 H new ATOM 0 HD13 ILE B 36 146.214 -3.260 -4.008 1.00 0.00 H new ATOM 2311 N LYS B 37 150.260 0.089 -5.910 1.00 0.00 N ATOM 2312 CA LYS B 37 151.126 0.334 -7.074 1.00 0.00 C ATOM 2313 C LYS B 37 152.498 0.750 -6.590 1.00 0.00 C ATOM 2314 O LYS B 37 153.515 0.213 -7.041 1.00 0.00 O ATOM 2315 CB LYS B 37 150.529 1.448 -7.924 1.00 0.00 C ATOM 2316 CG LYS B 37 149.069 1.118 -8.312 1.00 0.00 C ATOM 2317 CD LYS B 37 148.886 1.198 -9.837 1.00 0.00 C ATOM 2318 CE LYS B 37 147.511 1.808 -10.163 1.00 0.00 C ATOM 2319 NZ LYS B 37 147.481 3.221 -9.707 1.00 0.00 N ATOM 0 H LYS B 37 149.368 0.583 -5.931 1.00 0.00 H new ATOM 0 HA LYS B 37 151.206 -0.574 -7.672 1.00 0.00 H new ATOM 0 HB2 LYS B 37 150.560 2.388 -7.374 1.00 0.00 H new ATOM 0 HB3 LYS B 37 151.128 1.585 -8.825 1.00 0.00 H new ATOM 0 HG2 LYS B 37 148.810 0.119 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS B 37 148.390 1.815 -7.821 1.00 0.00 H new ATOM 0 HD2 LYS B 37 149.677 1.805 -10.277 1.00 0.00 H new ATOM 0 HD3 LYS B 37 148.967 0.203 -10.275 1.00 0.00 H new ATOM 0 HE2 LYS B 37 147.322 1.756 -11.235 1.00 0.00 H new ATOM 0 HE3 LYS B 37 146.722 1.238 -9.672 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 146.734 3.340 -8.993 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 148.401 3.471 -9.291 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 147.287 3.843 -10.517 1.00 0.00 H new ATOM 2333 N GLU B 38 152.565 1.680 -5.668 1.00 0.00 N ATOM 2334 CA GLU B 38 153.884 2.068 -5.186 1.00 0.00 C ATOM 2335 C GLU B 38 154.507 0.946 -4.376 1.00 0.00 C ATOM 2336 O GLU B 38 155.696 0.788 -4.396 1.00 0.00 O ATOM 2337 CB GLU B 38 153.908 3.441 -4.488 1.00 0.00 C ATOM 2338 CG GLU B 38 152.833 3.637 -3.436 1.00 0.00 C ATOM 2339 CD GLU B 38 152.677 5.127 -3.261 1.00 0.00 C ATOM 2340 OE1 GLU B 38 153.540 5.725 -2.659 1.00 0.00 O ATOM 2341 OE2 GLU B 38 151.756 5.663 -3.778 1.00 0.00 O ATOM 0 H GLU B 38 151.772 2.165 -5.249 1.00 0.00 H new ATOM 0 HA GLU B 38 154.521 2.220 -6.058 1.00 0.00 H new ATOM 0 HB2 GLU B 38 154.883 3.579 -4.021 1.00 0.00 H new ATOM 0 HB3 GLU B 38 153.804 4.219 -5.244 1.00 0.00 H new ATOM 0 HG2 GLU B 38 151.894 3.182 -3.751 1.00 0.00 H new ATOM 0 HG3 GLU B 38 153.118 3.163 -2.497 1.00 0.00 H new ATOM 2348 N TYR B 39 153.725 0.067 -3.780 1.00 0.00 N ATOM 2349 CA TYR B 39 154.352 -1.122 -3.145 1.00 0.00 C ATOM 2350 C TYR B 39 155.015 -1.977 -4.157 1.00 0.00 C ATOM 2351 O TYR B 39 156.095 -2.429 -3.946 1.00 0.00 O ATOM 2352 CB TYR B 39 153.372 -1.980 -2.322 1.00 0.00 C ATOM 2353 CG TYR B 39 153.394 -1.567 -0.879 1.00 0.00 C ATOM 2354 CD1 TYR B 39 154.626 -1.522 -0.211 1.00 0.00 C ATOM 2355 CD2 TYR B 39 152.220 -1.272 -0.196 1.00 0.00 C ATOM 2356 CE1 TYR B 39 154.687 -1.180 1.120 1.00 0.00 C ATOM 2357 CE2 TYR B 39 152.286 -0.923 1.159 1.00 0.00 C ATOM 2358 CZ TYR B 39 153.530 -0.880 1.809 1.00 0.00 C ATOM 2359 OH TYR B 39 153.619 -0.542 3.119 1.00 0.00 O ATOM 0 H TYR B 39 152.709 0.126 -3.711 1.00 0.00 H new ATOM 0 HA TYR B 39 155.088 -0.719 -2.450 1.00 0.00 H new ATOM 0 HB2 TYR B 39 152.363 -1.874 -2.721 1.00 0.00 H new ATOM 0 HB3 TYR B 39 153.640 -3.033 -2.409 1.00 0.00 H new ATOM 0 HD1 TYR B 39 155.534 -1.758 -0.746 1.00 0.00 H new ATOM 0 HD2 TYR B 39 151.268 -1.311 -0.704 1.00 0.00 H new ATOM 0 HE1 TYR B 39 155.641 -1.146 1.626 1.00 0.00 H new ATOM 0 HE2 TYR B 39 151.383 -0.688 1.702 1.00 0.00 H new ATOM 0 HH TYR B 39 153.070 0.251 3.290 1.00 0.00 H new ATOM 2369 N LEU B 40 154.401 -2.224 -5.248 1.00 0.00 N ATOM 2370 CA LEU B 40 155.064 -3.119 -6.240 1.00 0.00 C ATOM 2371 C LEU B 40 156.391 -2.488 -6.648 1.00 0.00 C ATOM 2372 O LEU B 40 157.377 -3.174 -6.876 1.00 0.00 O ATOM 2373 CB LEU B 40 154.161 -3.340 -7.471 1.00 0.00 C ATOM 2374 CG LEU B 40 152.666 -3.337 -7.057 1.00 0.00 C ATOM 2375 CD1 LEU B 40 151.800 -3.649 -8.250 1.00 0.00 C ATOM 2376 CD2 LEU B 40 152.394 -4.375 -5.959 1.00 0.00 C ATOM 0 H LEU B 40 153.485 -1.862 -5.512 1.00 0.00 H new ATOM 0 HA LEU B 40 155.243 -4.096 -5.791 1.00 0.00 H new ATOM 0 HB2 LEU B 40 154.342 -2.557 -8.207 1.00 0.00 H new ATOM 0 HB3 LEU B 40 154.411 -4.288 -7.947 1.00 0.00 H new ATOM 0 HG LEU B 40 152.429 -2.345 -6.672 1.00 0.00 H new ATOM 0 HD11 LEU B 40 150.752 -3.645 -7.950 1.00 0.00 H new ATOM 0 HD12 LEU B 40 151.959 -2.896 -9.022 1.00 0.00 H new ATOM 0 HD13 LEU B 40 152.061 -4.632 -8.642 1.00 0.00 H new ATOM 0 HD21 LEU B 40 151.338 -4.351 -5.689 1.00 0.00 H new ATOM 0 HD22 LEU B 40 152.652 -5.369 -6.326 1.00 0.00 H new ATOM 0 HD23 LEU B 40 152.999 -4.144 -5.082 1.00 0.00 H new ATOM 2388 N GLU B 41 156.433 -1.193 -6.725 1.00 0.00 N ATOM 2389 CA GLU B 41 157.701 -0.504 -7.102 1.00 0.00 C ATOM 2390 C GLU B 41 158.629 -0.438 -5.887 1.00 0.00 C ATOM 2391 O GLU B 41 159.712 -0.983 -5.892 1.00 0.00 O ATOM 2392 CB GLU B 41 157.383 0.917 -7.608 1.00 0.00 C ATOM 2393 CG GLU B 41 156.135 0.876 -8.522 1.00 0.00 C ATOM 2394 CD GLU B 41 156.450 1.454 -9.873 1.00 0.00 C ATOM 2395 OE1 GLU B 41 157.386 1.010 -10.484 1.00 0.00 O ATOM 2396 OE2 GLU B 41 155.746 2.323 -10.287 1.00 0.00 O ATOM 0 H GLU B 41 155.642 -0.575 -6.543 1.00 0.00 H new ATOM 0 HA GLU B 41 158.199 -1.060 -7.896 1.00 0.00 H new ATOM 0 HB2 GLU B 41 157.206 1.583 -6.764 1.00 0.00 H new ATOM 0 HB3 GLU B 41 158.235 1.318 -8.157 1.00 0.00 H new ATOM 0 HG2 GLU B 41 155.791 -0.153 -8.632 1.00 0.00 H new ATOM 0 HG3 GLU B 41 155.322 1.436 -8.061 1.00 0.00 H new ATOM 2403 N LEU B 42 158.217 0.243 -4.866 1.00 0.00 N ATOM 2404 CA LEU B 42 159.047 0.404 -3.640 1.00 0.00 C ATOM 2405 C LEU B 42 159.437 -0.967 -3.091 1.00 0.00 C ATOM 2406 O LEU B 42 160.565 -1.178 -2.674 1.00 0.00 O ATOM 2407 CB LEU B 42 158.247 1.173 -2.570 1.00 0.00 C ATOM 2408 CG LEU B 42 159.212 1.979 -1.685 1.00 0.00 C ATOM 2409 CD1 LEU B 42 159.411 3.378 -2.266 1.00 0.00 C ATOM 2410 CD2 LEU B 42 158.653 2.105 -0.268 1.00 0.00 C ATOM 0 H LEU B 42 157.312 0.711 -4.824 1.00 0.00 H new ATOM 0 HA LEU B 42 159.949 0.961 -3.893 1.00 0.00 H new ATOM 0 HB2 LEU B 42 157.531 1.842 -3.048 1.00 0.00 H new ATOM 0 HB3 LEU B 42 157.674 0.476 -1.959 1.00 0.00 H new ATOM 0 HG LEU B 42 160.167 1.455 -1.653 1.00 0.00 H new ATOM 0 HD11 LEU B 42 160.096 3.941 -1.632 1.00 0.00 H new ATOM 0 HD12 LEU B 42 159.828 3.299 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU B 42 158.452 3.893 -2.311 1.00 0.00 H new ATOM 0 HD21 LEU B 42 159.347 2.678 0.347 1.00 0.00 H new ATOM 0 HD22 LEU B 42 157.690 2.615 -0.301 1.00 0.00 H new ATOM 0 HD23 LEU B 42 158.523 1.112 0.161 1.00 0.00 H new ATOM 2422 N GLU B 43 158.520 -1.886 -3.062 1.00 0.00 N ATOM 2423 CA GLU B 43 158.826 -3.234 -2.523 1.00 0.00 C ATOM 2424 C GLU B 43 159.882 -3.874 -3.404 1.00 0.00 C ATOM 2425 O GLU B 43 160.903 -4.343 -2.919 1.00 0.00 O ATOM 2426 CB GLU B 43 157.546 -4.096 -2.491 1.00 0.00 C ATOM 2427 CG GLU B 43 157.825 -5.437 -1.784 1.00 0.00 C ATOM 2428 CD GLU B 43 158.129 -6.525 -2.796 1.00 0.00 C ATOM 2429 OE1 GLU B 43 158.106 -6.268 -3.982 1.00 0.00 O ATOM 2430 OE2 GLU B 43 158.370 -7.612 -2.380 1.00 0.00 O ATOM 0 H GLU B 43 157.563 -1.760 -3.392 1.00 0.00 H new ATOM 0 HA GLU B 43 159.201 -3.155 -1.503 1.00 0.00 H new ATOM 0 HB2 GLU B 43 156.751 -3.561 -1.971 1.00 0.00 H new ATOM 0 HB3 GLU B 43 157.196 -4.278 -3.507 1.00 0.00 H new ATOM 0 HG2 GLU B 43 158.666 -5.325 -1.100 1.00 0.00 H new ATOM 0 HG3 GLU B 43 156.962 -5.723 -1.183 1.00 0.00 H new ATOM 2437 N LYS B 44 159.648 -3.956 -4.683 1.00 0.00 N ATOM 2438 CA LYS B 44 160.653 -4.591 -5.551 1.00 0.00 C ATOM 2439 C LYS B 44 161.949 -3.797 -5.465 1.00 0.00 C ATOM 2440 O LYS B 44 163.026 -4.363 -5.386 1.00 0.00 O ATOM 2441 CB LYS B 44 160.141 -4.667 -6.981 1.00 0.00 C ATOM 2442 CG LYS B 44 159.363 -5.989 -7.166 1.00 0.00 C ATOM 2443 CD LYS B 44 160.346 -7.193 -7.130 1.00 0.00 C ATOM 2444 CE LYS B 44 159.890 -8.255 -6.098 1.00 0.00 C ATOM 2445 NZ LYS B 44 159.886 -7.693 -4.713 1.00 0.00 N ATOM 0 H LYS B 44 158.811 -3.612 -5.153 1.00 0.00 H new ATOM 0 HA LYS B 44 160.843 -5.612 -5.219 1.00 0.00 H new ATOM 0 HB2 LYS B 44 159.494 -3.816 -7.195 1.00 0.00 H new ATOM 0 HB3 LYS B 44 160.974 -4.619 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS B 44 158.616 -6.095 -6.379 1.00 0.00 H new ATOM 0 HG3 LYS B 44 158.826 -5.975 -8.115 1.00 0.00 H new ATOM 0 HD2 LYS B 44 160.407 -7.646 -8.120 1.00 0.00 H new ATOM 0 HD3 LYS B 44 161.347 -6.842 -6.877 1.00 0.00 H new ATOM 0 HE2 LYS B 44 158.891 -8.609 -6.353 1.00 0.00 H new ATOM 0 HE3 LYS B 44 160.555 -9.118 -6.142 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 159.481 -8.391 -4.056 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 160.861 -7.472 -4.425 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 159.313 -6.825 -4.692 1.00 0.00 H new ATOM 2459 N CYS B 45 161.851 -2.501 -5.370 1.00 0.00 N ATOM 2460 CA CYS B 45 163.058 -1.666 -5.194 1.00 0.00 C ATOM 2461 C CYS B 45 163.776 -2.142 -3.947 1.00 0.00 C ATOM 2462 O CYS B 45 164.902 -2.561 -4.003 1.00 0.00 O ATOM 2463 CB CYS B 45 162.644 -0.201 -5.027 1.00 0.00 C ATOM 2464 SG CYS B 45 162.264 0.512 -6.646 1.00 0.00 S ATOM 0 H CYS B 45 160.973 -1.984 -5.408 1.00 0.00 H new ATOM 0 HA CYS B 45 163.713 -1.749 -6.062 1.00 0.00 H new ATOM 0 HB2 CYS B 45 161.774 -0.131 -4.374 1.00 0.00 H new ATOM 0 HB3 CYS B 45 163.446 0.362 -4.550 1.00 0.00 H new ATOM 0 HG CYS B 45 161.048 0.199 -6.983 1.00 0.00 H new ATOM 2470 N LEU B 46 163.123 -2.099 -2.823 1.00 0.00 N ATOM 2471 CA LEU B 46 163.769 -2.572 -1.562 1.00 0.00 C ATOM 2472 C LEU B 46 164.213 -4.026 -1.745 1.00 0.00 C ATOM 2473 O LEU B 46 165.249 -4.404 -1.290 1.00 0.00 O ATOM 2474 CB LEU B 46 162.782 -2.454 -0.377 1.00 0.00 C ATOM 2475 CG LEU B 46 163.507 -2.715 0.976 1.00 0.00 C ATOM 2476 CD1 LEU B 46 164.846 -1.987 1.033 1.00 0.00 C ATOM 2477 CD2 LEU B 46 162.644 -2.216 2.133 1.00 0.00 C ATOM 0 H LEU B 46 162.168 -1.757 -2.719 1.00 0.00 H new ATOM 0 HA LEU B 46 164.638 -1.952 -1.342 1.00 0.00 H new ATOM 0 HB2 LEU B 46 162.334 -1.460 -0.369 1.00 0.00 H new ATOM 0 HB3 LEU B 46 161.969 -3.169 -0.503 1.00 0.00 H new ATOM 0 HG LEU B 46 163.676 -3.789 1.058 1.00 0.00 H new ATOM 0 HD11 LEU B 46 165.329 -2.188 1.989 1.00 0.00 H new ATOM 0 HD12 LEU B 46 165.485 -2.337 0.223 1.00 0.00 H new ATOM 0 HD13 LEU B 46 164.682 -0.915 0.928 1.00 0.00 H new ATOM 0 HD21 LEU B 46 163.157 -2.402 3.076 1.00 0.00 H new ATOM 0 HD22 LEU B 46 162.468 -1.146 2.020 1.00 0.00 H new ATOM 0 HD23 LEU B 46 161.690 -2.743 2.129 1.00 0.00 H new ATOM 2489 N SER B 47 163.462 -4.821 -2.457 1.00 0.00 N ATOM 2490 CA SER B 47 163.884 -6.235 -2.697 1.00 0.00 C ATOM 2491 C SER B 47 165.252 -6.211 -3.372 1.00 0.00 C ATOM 2492 O SER B 47 166.225 -6.789 -2.895 1.00 0.00 O ATOM 2493 CB SER B 47 162.890 -6.950 -3.637 1.00 0.00 C ATOM 2494 OG SER B 47 161.520 -6.661 -3.266 1.00 0.00 O ATOM 0 H SER B 47 162.575 -4.555 -2.884 1.00 0.00 H new ATOM 0 HA SER B 47 163.916 -6.767 -1.746 1.00 0.00 H new ATOM 0 HB2 SER B 47 163.066 -6.634 -4.665 1.00 0.00 H new ATOM 0 HB3 SER B 47 163.060 -8.026 -3.601 1.00 0.00 H new ATOM 0 HG SER B 47 161.352 -5.700 -3.358 1.00 0.00 H new ATOM 2500 N ARG B 48 165.329 -5.530 -4.469 1.00 0.00 N ATOM 2501 CA ARG B 48 166.598 -5.420 -5.222 1.00 0.00 C ATOM 2502 C ARG B 48 167.649 -4.781 -4.324 1.00 0.00 C ATOM 2503 O ARG B 48 168.792 -5.223 -4.261 1.00 0.00 O ATOM 2504 CB ARG B 48 166.354 -4.529 -6.449 1.00 0.00 C ATOM 2505 CG ARG B 48 165.423 -5.254 -7.450 1.00 0.00 C ATOM 2506 CD ARG B 48 165.787 -4.865 -8.893 1.00 0.00 C ATOM 2507 NE ARG B 48 167.262 -5.039 -9.108 1.00 0.00 N ATOM 2508 CZ ARG B 48 167.804 -4.817 -10.288 1.00 0.00 C ATOM 2509 NH1 ARG B 48 167.044 -4.500 -11.301 1.00 0.00 N ATOM 2510 NH2 ARG B 48 169.092 -4.949 -10.447 1.00 0.00 N ATOM 0 H ARG B 48 164.544 -5.031 -4.888 1.00 0.00 H new ATOM 0 HA ARG B 48 166.945 -6.403 -5.540 1.00 0.00 H new ATOM 0 HB2 ARG B 48 165.905 -3.585 -6.140 1.00 0.00 H new ATOM 0 HB3 ARG B 48 167.303 -4.289 -6.929 1.00 0.00 H new ATOM 0 HG2 ARG B 48 165.511 -6.333 -7.323 1.00 0.00 H new ATOM 0 HG3 ARG B 48 164.385 -4.993 -7.246 1.00 0.00 H new ATOM 0 HD2 ARG B 48 165.232 -5.484 -9.598 1.00 0.00 H new ATOM 0 HD3 ARG B 48 165.502 -3.830 -9.084 1.00 0.00 H new ATOM 0 HE ARG B 48 167.853 -5.333 -8.330 1.00 0.00 H new ATOM 0 HH11 ARG B 48 166.034 -4.425 -11.177 1.00 0.00 H new ATOM 0 HH12 ARG B 48 167.460 -4.327 -12.216 1.00 0.00 H new ATOM 0 HH21 ARG B 48 169.678 -5.224 -9.658 1.00 0.00 H new ATOM 0 HH22 ARG B 48 169.513 -4.778 -11.360 1.00 0.00 H new ATOM 2524 N MET B 49 167.285 -3.738 -3.651 1.00 0.00 N ATOM 2525 CA MET B 49 168.235 -3.039 -2.777 1.00 0.00 C ATOM 2526 C MET B 49 168.611 -3.941 -1.619 1.00 0.00 C ATOM 2527 O MET B 49 169.647 -3.806 -1.083 1.00 0.00 O ATOM 2528 CB MET B 49 167.607 -1.749 -2.225 1.00 0.00 C ATOM 2529 CG MET B 49 167.085 -0.868 -3.377 1.00 0.00 C ATOM 2530 SD MET B 49 168.239 0.489 -3.683 1.00 0.00 S ATOM 2531 CE MET B 49 167.902 1.449 -2.184 1.00 0.00 C ATOM 0 H MET B 49 166.348 -3.336 -3.674 1.00 0.00 H new ATOM 0 HA MET B 49 169.122 -2.784 -3.357 1.00 0.00 H new ATOM 0 HB2 MET B 49 166.789 -1.996 -1.549 1.00 0.00 H new ATOM 0 HB3 MET B 49 168.346 -1.198 -1.643 1.00 0.00 H new ATOM 0 HG2 MET B 49 166.966 -1.467 -4.280 1.00 0.00 H new ATOM 0 HG3 MET B 49 166.101 -0.471 -3.126 1.00 0.00 H new ATOM 0 HE1 MET B 49 168.783 2.034 -1.921 1.00 0.00 H new ATOM 0 HE2 MET B 49 167.062 2.120 -2.363 1.00 0.00 H new ATOM 0 HE3 MET B 49 167.658 0.772 -1.365 1.00 0.00 H new ATOM 2541 N GLU B 50 167.820 -4.905 -1.293 1.00 0.00 N ATOM 2542 CA GLU B 50 168.201 -5.824 -0.198 1.00 0.00 C ATOM 2543 C GLU B 50 169.311 -6.721 -0.697 1.00 0.00 C ATOM 2544 O GLU B 50 170.357 -6.866 -0.066 1.00 0.00 O ATOM 2545 CB GLU B 50 167.001 -6.654 0.222 1.00 0.00 C ATOM 2546 CG GLU B 50 166.221 -5.949 1.339 1.00 0.00 C ATOM 2547 CD GLU B 50 165.518 -6.987 2.178 1.00 0.00 C ATOM 2548 OE1 GLU B 50 166.167 -7.604 2.977 1.00 0.00 O ATOM 2549 OE2 GLU B 50 164.333 -7.146 2.018 1.00 0.00 O ATOM 0 H GLU B 50 166.922 -5.101 -1.736 1.00 0.00 H new ATOM 0 HA GLU B 50 168.543 -5.258 0.668 1.00 0.00 H new ATOM 0 HB2 GLU B 50 166.349 -6.820 -0.635 1.00 0.00 H new ATOM 0 HB3 GLU B 50 167.332 -7.634 0.565 1.00 0.00 H new ATOM 0 HG2 GLU B 50 166.899 -5.361 1.958 1.00 0.00 H new ATOM 0 HG3 GLU B 50 165.496 -5.256 0.912 1.00 0.00 H new ATOM 2556 N ASP B 51 169.121 -7.274 -1.862 1.00 0.00 N ATOM 2557 CA ASP B 51 170.151 -8.146 -2.464 1.00 0.00 C ATOM 2558 C ASP B 51 171.453 -7.385 -2.517 1.00 0.00 C ATOM 2559 O ASP B 51 172.492 -7.868 -2.078 1.00 0.00 O ATOM 2560 CB ASP B 51 169.731 -8.523 -3.885 1.00 0.00 C ATOM 2561 CG ASP B 51 168.886 -9.765 -3.854 1.00 0.00 C ATOM 2562 OD1 ASP B 51 169.415 -10.819 -3.622 1.00 0.00 O ATOM 2563 OD2 ASP B 51 167.714 -9.651 -4.068 1.00 0.00 O ATOM 0 H ASP B 51 168.280 -7.153 -2.426 1.00 0.00 H new ATOM 0 HA ASP B 51 170.267 -9.052 -1.869 1.00 0.00 H new ATOM 0 HB2 ASP B 51 169.173 -7.704 -4.338 1.00 0.00 H new ATOM 0 HB3 ASP B 51 170.614 -8.688 -4.503 1.00 0.00 H new ATOM 2568 N GLU B 52 171.410 -6.210 -3.066 1.00 0.00 N ATOM 2569 CA GLU B 52 172.627 -5.390 -3.182 1.00 0.00 C ATOM 2570 C GLU B 52 173.087 -4.951 -1.799 1.00 0.00 C ATOM 2571 O GLU B 52 174.216 -5.086 -1.471 1.00 0.00 O ATOM 2572 CB GLU B 52 172.351 -4.159 -4.057 1.00 0.00 C ATOM 2573 CG GLU B 52 172.517 -4.539 -5.530 1.00 0.00 C ATOM 2574 CD GLU B 52 172.233 -3.344 -6.394 1.00 0.00 C ATOM 2575 OE1 GLU B 52 172.980 -2.403 -6.326 1.00 0.00 O ATOM 2576 OE2 GLU B 52 171.272 -3.384 -7.124 1.00 0.00 O ATOM 0 H GLU B 52 170.566 -5.780 -3.444 1.00 0.00 H new ATOM 0 HA GLU B 52 173.413 -5.985 -3.648 1.00 0.00 H new ATOM 0 HB2 GLU B 52 171.342 -3.789 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU B 52 173.037 -3.353 -3.798 1.00 0.00 H new ATOM 0 HG2 GLU B 52 173.530 -4.899 -5.711 1.00 0.00 H new ATOM 0 HG3 GLU B 52 171.839 -5.354 -5.784 1.00 0.00 H new ATOM 2583 N ASN B 53 172.215 -4.398 -1.007 1.00 0.00 N ATOM 2584 CA ASN B 53 172.606 -3.896 0.351 1.00 0.00 C ATOM 2585 C ASN B 53 173.352 -4.969 1.073 1.00 0.00 C ATOM 2586 O ASN B 53 174.408 -4.742 1.626 1.00 0.00 O ATOM 2587 CB ASN B 53 171.344 -3.540 1.157 1.00 0.00 C ATOM 2588 CG ASN B 53 170.992 -2.097 0.882 1.00 0.00 C ATOM 2589 OD1 ASN B 53 170.489 -1.795 -0.256 1.00 0.00 O flip ATOM 2590 ND2 ASN B 53 171.188 -1.222 1.716 1.00 0.00 N flip ATOM 0 H ASN B 53 171.231 -4.268 -1.241 1.00 0.00 H new ATOM 0 HA ASN B 53 173.232 -3.010 0.241 1.00 0.00 H new ATOM 0 HB2 ASN B 53 170.518 -4.192 0.875 1.00 0.00 H new ATOM 0 HB3 ASN B 53 171.520 -3.691 2.222 1.00 0.00 H new ATOM 0 HD21 ASN B 53 171.589 -1.462 2.623 1.00 0.00 H new ATOM 0 HD22 ASN B 53 170.951 -0.253 1.504 1.00 0.00 H new ATOM 2597 N ASN B 54 172.824 -6.155 1.029 1.00 0.00 N ATOM 2598 CA ASN B 54 173.476 -7.308 1.679 1.00 0.00 C ATOM 2599 C ASN B 54 174.900 -7.404 1.190 1.00 0.00 C ATOM 2600 O ASN B 54 175.838 -7.281 1.949 1.00 0.00 O ATOM 2601 CB ASN B 54 172.737 -8.590 1.289 1.00 0.00 C ATOM 2602 CG ASN B 54 171.561 -8.833 2.223 1.00 0.00 C ATOM 2603 OD1 ASN B 54 171.374 -8.118 3.197 1.00 0.00 O ATOM 2604 ND2 ASN B 54 170.771 -9.819 1.995 1.00 0.00 N ATOM 0 H ASN B 54 171.947 -6.374 0.557 1.00 0.00 H new ATOM 0 HA ASN B 54 173.456 -7.181 2.761 1.00 0.00 H new ATOM 0 HB2 ASN B 54 172.383 -8.514 0.261 1.00 0.00 H new ATOM 0 HB3 ASN B 54 173.421 -9.437 1.328 1.00 0.00 H new ATOM 0 HD21 ASN B 54 169.991 -10.004 2.625 1.00 0.00 H new ATOM 0 HD22 ASN B 54 170.924 -10.418 1.183 1.00 0.00 H new ATOM 2611 N ARG B 55 175.076 -7.608 -0.080 1.00 0.00 N ATOM 2612 CA ARG B 55 176.439 -7.714 -0.633 1.00 0.00 C ATOM 2613 C ARG B 55 177.183 -6.429 -0.345 1.00 0.00 C ATOM 2614 O ARG B 55 178.127 -6.424 0.364 1.00 0.00 O ATOM 2615 CB ARG B 55 176.353 -7.943 -2.137 1.00 0.00 C ATOM 2616 CG ARG B 55 176.004 -9.404 -2.405 1.00 0.00 C ATOM 2617 CD ARG B 55 177.291 -10.237 -2.555 1.00 0.00 C ATOM 2618 NE ARG B 55 177.211 -11.001 -3.834 1.00 0.00 N ATOM 2619 CZ ARG B 55 177.663 -10.507 -4.973 1.00 0.00 C ATOM 2620 NH1 ARG B 55 178.359 -9.396 -4.998 1.00 0.00 N ATOM 2621 NH2 ARG B 55 177.437 -11.150 -6.076 1.00 0.00 N ATOM 0 H ARG B 55 174.324 -7.706 -0.762 1.00 0.00 H new ATOM 0 HA ARG B 55 176.969 -8.550 -0.176 1.00 0.00 H new ATOM 0 HB2 ARG B 55 175.597 -7.290 -2.573 1.00 0.00 H new ATOM 0 HB3 ARG B 55 177.302 -7.691 -2.610 1.00 0.00 H new ATOM 0 HG2 ARG B 55 175.400 -9.798 -1.587 1.00 0.00 H new ATOM 0 HG3 ARG B 55 175.403 -9.482 -3.311 1.00 0.00 H new ATOM 0 HD2 ARG B 55 178.166 -9.587 -2.556 1.00 0.00 H new ATOM 0 HD3 ARG B 55 177.402 -10.919 -1.712 1.00 0.00 H new ATOM 0 HE ARG B 55 176.795 -11.932 -3.829 1.00 0.00 H new ATOM 0 HH11 ARG B 55 178.559 -8.900 -4.130 1.00 0.00 H new ATOM 0 HH12 ARG B 55 178.701 -9.028 -5.886 1.00 0.00 H new ATOM 0 HH21 ARG B 55 176.916 -12.026 -6.058 1.00 0.00 H new ATOM 0 HH22 ARG B 55 177.781 -10.779 -6.962 1.00 0.00 H new ATOM 2635 N LEU B 56 176.730 -5.356 -0.892 1.00 0.00 N ATOM 2636 CA LEU B 56 177.347 -4.025 -0.692 1.00 0.00 C ATOM 2637 C LEU B 56 177.903 -3.870 0.693 1.00 0.00 C ATOM 2638 O LEU B 56 179.071 -3.570 0.873 1.00 0.00 O ATOM 2639 CB LEU B 56 176.236 -2.967 -0.850 1.00 0.00 C ATOM 2640 CG LEU B 56 176.091 -2.601 -2.338 1.00 0.00 C ATOM 2641 CD1 LEU B 56 174.919 -1.636 -2.524 1.00 0.00 C ATOM 2642 CD2 LEU B 56 177.393 -1.939 -2.839 1.00 0.00 C ATOM 0 H LEU B 56 175.913 -5.342 -1.503 1.00 0.00 H new ATOM 0 HA LEU B 56 178.155 -3.909 -1.415 1.00 0.00 H new ATOM 0 HB2 LEU B 56 175.292 -3.353 -0.465 1.00 0.00 H new ATOM 0 HB3 LEU B 56 176.478 -2.079 -0.267 1.00 0.00 H new ATOM 0 HG LEU B 56 175.902 -3.508 -2.913 1.00 0.00 H new ATOM 0 HD11 LEU B 56 174.822 -1.381 -3.579 1.00 0.00 H new ATOM 0 HD12 LEU B 56 174.000 -2.109 -2.179 1.00 0.00 H new ATOM 0 HD13 LEU B 56 175.099 -0.729 -1.947 1.00 0.00 H new ATOM 0 HD21 LEU B 56 177.288 -1.681 -3.893 1.00 0.00 H new ATOM 0 HD22 LEU B 56 177.587 -1.035 -2.262 1.00 0.00 H new ATOM 0 HD23 LEU B 56 178.224 -2.633 -2.717 1.00 0.00 H new ATOM 2654 N ARG B 57 177.073 -4.015 1.683 1.00 0.00 N ATOM 2655 CA ARG B 57 177.532 -3.837 3.068 1.00 0.00 C ATOM 2656 C ARG B 57 178.598 -4.864 3.376 1.00 0.00 C ATOM 2657 O ARG B 57 179.583 -4.559 4.005 1.00 0.00 O ATOM 2658 CB ARG B 57 176.368 -4.003 4.046 1.00 0.00 C ATOM 2659 CG ARG B 57 175.231 -3.003 3.715 1.00 0.00 C ATOM 2660 CD ARG B 57 175.112 -1.916 4.802 1.00 0.00 C ATOM 2661 NE ARG B 57 175.253 -2.530 6.162 1.00 0.00 N ATOM 2662 CZ ARG B 57 174.713 -1.974 7.216 1.00 0.00 C ATOM 2663 NH1 ARG B 57 174.040 -0.851 7.109 1.00 0.00 N ATOM 2664 NH2 ARG B 57 174.875 -2.531 8.377 1.00 0.00 N ATOM 0 H ARG B 57 176.086 -4.252 1.582 1.00 0.00 H new ATOM 0 HA ARG B 57 177.939 -2.832 3.178 1.00 0.00 H new ATOM 0 HB2 ARG B 57 175.988 -5.023 3.997 1.00 0.00 H new ATOM 0 HB3 ARG B 57 176.717 -3.841 5.066 1.00 0.00 H new ATOM 0 HG2 ARG B 57 175.423 -2.536 2.749 1.00 0.00 H new ATOM 0 HG3 ARG B 57 174.286 -3.539 3.627 1.00 0.00 H new ATOM 0 HD2 ARG B 57 175.881 -1.158 4.655 1.00 0.00 H new ATOM 0 HD3 ARG B 57 174.149 -1.412 4.720 1.00 0.00 H new ATOM 0 HE ARG B 57 175.780 -3.397 6.268 1.00 0.00 H new ATOM 0 HH11 ARG B 57 173.935 -0.404 6.198 1.00 0.00 H new ATOM 0 HH12 ARG B 57 173.623 -0.426 7.937 1.00 0.00 H new ATOM 0 HH21 ARG B 57 175.418 -3.391 8.459 1.00 0.00 H new ATOM 0 HH22 ARG B 57 174.460 -2.109 9.208 1.00 0.00 H new ATOM 2678 N LEU B 58 178.412 -6.076 2.960 1.00 0.00 N ATOM 2679 CA LEU B 58 179.403 -7.121 3.264 1.00 0.00 C ATOM 2680 C LEU B 58 180.700 -6.821 2.497 1.00 0.00 C ATOM 2681 O LEU B 58 181.794 -6.924 3.039 1.00 0.00 O ATOM 2682 CB LEU B 58 178.849 -8.474 2.897 1.00 0.00 C ATOM 2683 CG LEU B 58 177.595 -8.790 3.724 1.00 0.00 C ATOM 2684 CD1 LEU B 58 176.802 -9.919 3.057 1.00 0.00 C ATOM 2685 CD2 LEU B 58 178.004 -9.213 5.130 1.00 0.00 C ATOM 0 H LEU B 58 177.607 -6.387 2.417 1.00 0.00 H new ATOM 0 HA LEU B 58 179.624 -7.130 4.331 1.00 0.00 H new ATOM 0 HB2 LEU B 58 178.605 -8.497 1.835 1.00 0.00 H new ATOM 0 HB3 LEU B 58 179.605 -9.240 3.067 1.00 0.00 H new ATOM 0 HG LEU B 58 176.969 -7.899 3.781 1.00 0.00 H new ATOM 0 HD11 LEU B 58 175.913 -10.138 3.649 1.00 0.00 H new ATOM 0 HD12 LEU B 58 176.504 -9.611 2.055 1.00 0.00 H new ATOM 0 HD13 LEU B 58 177.424 -10.812 2.992 1.00 0.00 H new ATOM 0 HD21 LEU B 58 177.113 -9.437 5.716 1.00 0.00 H new ATOM 0 HD22 LEU B 58 178.634 -10.101 5.074 1.00 0.00 H new ATOM 0 HD23 LEU B 58 178.558 -8.404 5.607 1.00 0.00 H new ATOM 2697 N GLU B 59 180.583 -6.466 1.274 1.00 0.00 N ATOM 2698 CA GLU B 59 181.750 -6.157 0.422 1.00 0.00 C ATOM 2699 C GLU B 59 182.418 -4.880 0.905 1.00 0.00 C ATOM 2700 O GLU B 59 183.561 -4.888 1.282 1.00 0.00 O ATOM 2701 CB GLU B 59 181.270 -5.987 -1.043 1.00 0.00 C ATOM 2702 CG GLU B 59 180.826 -7.358 -1.609 1.00 0.00 C ATOM 2703 CD GLU B 59 180.444 -7.223 -3.069 1.00 0.00 C ATOM 2704 OE1 GLU B 59 181.139 -6.548 -3.782 1.00 0.00 O ATOM 2705 OE2 GLU B 59 179.465 -7.800 -3.457 1.00 0.00 O ATOM 0 H GLU B 59 179.685 -6.370 0.799 1.00 0.00 H new ATOM 0 HA GLU B 59 182.474 -6.970 0.477 1.00 0.00 H new ATOM 0 HB2 GLU B 59 180.441 -5.280 -1.085 1.00 0.00 H new ATOM 0 HB3 GLU B 59 182.073 -5.574 -1.653 1.00 0.00 H new ATOM 0 HG2 GLU B 59 181.634 -8.082 -1.502 1.00 0.00 H new ATOM 0 HG3 GLU B 59 179.979 -7.738 -1.038 1.00 0.00 H new ATOM 2712 N SER B 60 181.715 -3.786 0.855 1.00 0.00 N ATOM 2713 CA SER B 60 182.293 -2.467 1.251 1.00 0.00 C ATOM 2714 C SER B 60 183.173 -2.627 2.488 1.00 0.00 C ATOM 2715 O SER B 60 184.360 -2.366 2.463 1.00 0.00 O ATOM 2716 CB SER B 60 181.149 -1.505 1.580 1.00 0.00 C ATOM 2717 OG SER B 60 180.209 -2.159 2.433 1.00 0.00 O ATOM 0 H SER B 60 180.742 -3.746 0.550 1.00 0.00 H new ATOM 0 HA SER B 60 182.896 -2.079 0.430 1.00 0.00 H new ATOM 0 HB2 SER B 60 181.539 -0.612 2.068 1.00 0.00 H new ATOM 0 HB3 SER B 60 180.659 -1.179 0.663 1.00 0.00 H new ATOM 0 HG SER B 60 179.754 -2.869 1.934 1.00 0.00 H new ATOM 2723 N LYS B 61 182.588 -3.040 3.580 1.00 0.00 N ATOM 2724 CA LYS B 61 183.370 -3.203 4.848 1.00 0.00 C ATOM 2725 C LYS B 61 184.618 -4.044 4.554 1.00 0.00 C ATOM 2726 O LYS B 61 185.704 -3.761 5.029 1.00 0.00 O ATOM 2727 CB LYS B 61 182.500 -3.922 5.901 1.00 0.00 C ATOM 2728 CG LYS B 61 182.087 -5.305 5.352 1.00 0.00 C ATOM 2729 CD LYS B 61 181.071 -6.011 6.282 1.00 0.00 C ATOM 2730 CE LYS B 61 181.336 -7.546 6.321 1.00 0.00 C ATOM 2731 NZ LYS B 61 182.222 -7.959 5.193 1.00 0.00 N ATOM 0 H LYS B 61 181.598 -3.274 3.652 1.00 0.00 H new ATOM 0 HA LYS B 61 183.663 -2.226 5.232 1.00 0.00 H new ATOM 0 HB2 LYS B 61 183.054 -4.037 6.832 1.00 0.00 H new ATOM 0 HB3 LYS B 61 181.615 -3.327 6.128 1.00 0.00 H new ATOM 0 HG2 LYS B 61 181.651 -5.187 4.360 1.00 0.00 H new ATOM 0 HG3 LYS B 61 182.972 -5.931 5.239 1.00 0.00 H new ATOM 0 HD2 LYS B 61 181.144 -5.599 7.288 1.00 0.00 H new ATOM 0 HD3 LYS B 61 180.056 -5.821 5.932 1.00 0.00 H new ATOM 0 HE2 LYS B 61 181.798 -7.816 7.270 1.00 0.00 H new ATOM 0 HE3 LYS B 61 180.390 -8.085 6.263 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 182.119 -8.980 5.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 181.954 -7.439 4.333 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 183.211 -7.746 5.433 1.00 0.00 H new ATOM 2745 N ARG B 62 184.455 -5.077 3.771 1.00 0.00 N ATOM 2746 CA ARG B 62 185.578 -5.972 3.437 1.00 0.00 C ATOM 2747 C ARG B 62 186.340 -5.414 2.242 1.00 0.00 C ATOM 2748 O ARG B 62 187.130 -6.124 1.630 1.00 0.00 O ATOM 2749 CB ARG B 62 185.059 -7.404 3.119 1.00 0.00 C ATOM 2750 CG ARG B 62 185.504 -8.403 4.224 1.00 0.00 C ATOM 2751 CD ARG B 62 186.941 -8.945 3.948 1.00 0.00 C ATOM 2752 NE ARG B 62 187.635 -8.090 2.925 1.00 0.00 N ATOM 2753 CZ ARG B 62 188.884 -8.280 2.596 1.00 0.00 C ATOM 2754 NH1 ARG B 62 189.589 -9.214 3.175 1.00 0.00 N ATOM 2755 NH2 ARG B 62 189.415 -7.516 1.693 1.00 0.00 N ATOM 0 H ARG B 62 183.566 -5.336 3.344 1.00 0.00 H new ATOM 0 HA ARG B 62 186.248 -6.032 4.295 1.00 0.00 H new ATOM 0 HB2 ARG B 62 183.972 -7.395 3.045 1.00 0.00 H new ATOM 0 HB3 ARG B 62 185.441 -7.729 2.151 1.00 0.00 H new ATOM 0 HG2 ARG B 62 185.479 -7.910 5.196 1.00 0.00 H new ATOM 0 HG3 ARG B 62 184.801 -9.235 4.271 1.00 0.00 H new ATOM 0 HD2 ARG B 62 187.517 -8.956 4.874 1.00 0.00 H new ATOM 0 HD3 ARG B 62 186.887 -9.975 3.595 1.00 0.00 H new ATOM 0 HE ARG B 62 187.114 -7.338 2.474 1.00 0.00 H new ATOM 0 HH11 ARG B 62 189.165 -9.803 3.891 1.00 0.00 H new ATOM 0 HH12 ARG B 62 190.564 -9.355 2.911 1.00 0.00 H new ATOM 0 HH21 ARG B 62 188.858 -6.783 1.254 1.00 0.00 H new ATOM 0 HH22 ARG B 62 190.389 -7.648 1.422 1.00 0.00 H new ATOM 2769 N LEU B 63 186.137 -4.184 1.905 1.00 0.00 N ATOM 2770 CA LEU B 63 186.850 -3.594 0.782 1.00 0.00 C ATOM 2771 C LEU B 63 187.806 -2.518 1.292 1.00 0.00 C ATOM 2772 O LEU B 63 187.683 -2.017 2.403 1.00 0.00 O ATOM 2773 CB LEU B 63 185.868 -2.969 -0.207 1.00 0.00 C ATOM 2774 CG LEU B 63 185.281 -4.021 -1.177 1.00 0.00 C ATOM 2775 CD1 LEU B 63 184.000 -3.475 -1.789 1.00 0.00 C ATOM 2776 CD2 LEU B 63 186.263 -4.291 -2.321 1.00 0.00 C ATOM 0 H LEU B 63 185.488 -3.556 2.379 1.00 0.00 H new ATOM 0 HA LEU B 63 187.411 -4.379 0.275 1.00 0.00 H new ATOM 0 HB2 LEU B 63 185.058 -2.488 0.341 1.00 0.00 H new ATOM 0 HB3 LEU B 63 186.374 -2.190 -0.778 1.00 0.00 H new ATOM 0 HG LEU B 63 185.091 -4.939 -0.621 1.00 0.00 H new ATOM 0 HD11 LEU B 63 183.581 -4.212 -2.474 1.00 0.00 H new ATOM 0 HD12 LEU B 63 183.280 -3.264 -0.998 1.00 0.00 H new ATOM 0 HD13 LEU B 63 184.220 -2.557 -2.334 1.00 0.00 H new ATOM 0 HD21 LEU B 63 185.839 -5.033 -2.997 1.00 0.00 H new ATOM 0 HD22 LEU B 63 186.448 -3.366 -2.867 1.00 0.00 H new ATOM 0 HD23 LEU B 63 187.202 -4.666 -1.914 1.00 0.00 H new ATOM 2788 N GLY B 64 188.720 -2.143 0.475 1.00 0.00 N ATOM 2789 CA GLY B 64 189.700 -1.075 0.812 1.00 0.00 C ATOM 2790 C GLY B 64 189.976 -0.297 -0.454 1.00 0.00 C ATOM 2791 O GLY B 64 189.091 0.317 -1.004 1.00 0.00 O ATOM 0 H GLY B 64 188.844 -2.542 -0.455 1.00 0.00 H new ATOM 0 HA2 GLY B 64 189.301 -0.419 1.586 1.00 0.00 H new ATOM 0 HA3 GLY B 64 190.620 -1.508 1.204 1.00 0.00 H new ATOM 2795 N GLY B 65 191.152 -0.364 -0.980 1.00 0.00 N ATOM 2796 CA GLY B 65 191.444 0.357 -2.262 1.00 0.00 C ATOM 2797 C GLY B 65 192.857 0.814 -2.181 1.00 0.00 C ATOM 2798 O GLY B 65 193.141 1.911 -1.701 1.00 0.00 O ATOM 0 H GLY B 65 191.936 -0.885 -0.587 1.00 0.00 H new ATOM 0 HA2 GLY B 65 191.298 -0.301 -3.118 1.00 0.00 H new ATOM 0 HA3 GLY B 65 190.770 1.204 -2.392 1.00 0.00 H new ATOM 2802 N ASP B 66 193.762 -0.025 -2.538 1.00 0.00 N ATOM 2803 CA ASP B 66 195.190 0.293 -2.366 1.00 0.00 C ATOM 2804 C ASP B 66 195.994 -0.361 -3.494 1.00 0.00 C ATOM 2805 O ASP B 66 197.198 -0.187 -3.593 1.00 0.00 O ATOM 2806 CB ASP B 66 195.643 -0.277 -1.000 1.00 0.00 C ATOM 2807 CG ASP B 66 194.492 -0.234 0.002 1.00 0.00 C ATOM 2808 OD1 ASP B 66 193.693 -1.161 0.046 1.00 0.00 O ATOM 2809 OD2 ASP B 66 194.403 0.733 0.700 1.00 0.00 O ATOM 0 H ASP B 66 193.572 -0.938 -2.951 1.00 0.00 H new ATOM 0 HA ASP B 66 195.352 1.370 -2.397 1.00 0.00 H new ATOM 0 HB2 ASP B 66 195.988 -1.304 -1.123 1.00 0.00 H new ATOM 0 HB3 ASP B 66 196.486 0.299 -0.620 1.00 0.00 H new ATOM 2814 N ASP B 67 195.350 -1.175 -4.297 1.00 0.00 N ATOM 2815 CA ASP B 67 196.051 -1.940 -5.394 1.00 0.00 C ATOM 2816 C ASP B 67 196.982 -1.034 -6.190 1.00 0.00 C ATOM 2817 O ASP B 67 197.985 -1.471 -6.716 1.00 0.00 O ATOM 2818 CB ASP B 67 195.026 -2.580 -6.357 1.00 0.00 C ATOM 2819 CG ASP B 67 194.638 -1.596 -7.445 1.00 0.00 C ATOM 2820 OD1 ASP B 67 194.010 -0.617 -7.137 1.00 0.00 O ATOM 2821 OD2 ASP B 67 194.965 -1.839 -8.576 1.00 0.00 O ATOM 0 H ASP B 67 194.346 -1.349 -4.241 1.00 0.00 H new ATOM 0 HA ASP B 67 196.640 -2.723 -4.916 1.00 0.00 H new ATOM 0 HB2 ASP B 67 195.450 -3.479 -6.805 1.00 0.00 H new ATOM 0 HB3 ASP B 67 194.139 -2.888 -5.803 1.00 0.00 H new ATOM 2826 N ALA B 68 196.656 0.208 -6.308 1.00 0.00 N ATOM 2827 CA ALA B 68 197.543 1.125 -7.078 1.00 0.00 C ATOM 2828 C ALA B 68 198.730 1.470 -6.187 1.00 0.00 C ATOM 2829 O ALA B 68 199.871 1.421 -6.625 1.00 0.00 O ATOM 2830 CB ALA B 68 196.795 2.366 -7.532 1.00 0.00 C ATOM 0 H ALA B 68 195.820 0.636 -5.910 1.00 0.00 H new ATOM 0 HA ALA B 68 197.893 0.639 -7.989 1.00 0.00 H new ATOM 0 HB1 ALA B 68 197.470 3.014 -8.091 1.00 0.00 H new ATOM 0 HB2 ALA B 68 195.961 2.075 -8.170 1.00 0.00 H new ATOM 0 HB3 ALA B 68 196.416 2.901 -6.661 1.00 0.00 H new ATOM 2836 N ARG B 69 198.498 1.676 -4.924 1.00 0.00 N ATOM 2837 CA ARG B 69 199.630 1.864 -3.998 1.00 0.00 C ATOM 2838 C ARG B 69 200.453 0.580 -4.085 1.00 0.00 C ATOM 2839 O ARG B 69 201.654 0.603 -4.296 1.00 0.00 O ATOM 2840 CB ARG B 69 199.101 2.073 -2.563 1.00 0.00 C ATOM 2841 CG ARG B 69 200.265 2.275 -1.581 1.00 0.00 C ATOM 2842 CD ARG B 69 200.557 3.759 -1.354 1.00 0.00 C ATOM 2843 NE ARG B 69 200.850 3.985 0.103 1.00 0.00 N ATOM 2844 CZ ARG B 69 201.920 3.461 0.683 1.00 0.00 C ATOM 2845 NH1 ARG B 69 202.829 2.858 -0.036 1.00 0.00 N ATOM 2846 NH2 ARG B 69 202.087 3.582 1.962 1.00 0.00 N ATOM 0 H ARG B 69 197.572 1.721 -4.498 1.00 0.00 H new ATOM 0 HA ARG B 69 200.230 2.737 -4.255 1.00 0.00 H new ATOM 0 HB2 ARG B 69 198.441 2.940 -2.536 1.00 0.00 H new ATOM 0 HB3 ARG B 69 198.508 1.211 -2.259 1.00 0.00 H new ATOM 0 HG2 ARG B 69 200.026 1.801 -0.629 1.00 0.00 H new ATOM 0 HG3 ARG B 69 201.158 1.783 -1.967 1.00 0.00 H new ATOM 0 HD2 ARG B 69 201.406 4.072 -1.961 1.00 0.00 H new ATOM 0 HD3 ARG B 69 199.703 4.362 -1.664 1.00 0.00 H new ATOM 0 HE ARG B 69 200.211 4.554 0.658 1.00 0.00 H new ATOM 0 HH11 ARG B 69 202.716 2.789 -1.047 1.00 0.00 H new ATOM 0 HH12 ARG B 69 203.651 2.456 0.414 1.00 0.00 H new ATOM 0 HH21 ARG B 69 201.395 4.080 2.522 1.00 0.00 H new ATOM 0 HH22 ARG B 69 202.910 3.179 2.409 1.00 0.00 H new ATOM 2860 N VAL B 70 199.783 -0.541 -3.992 1.00 0.00 N ATOM 2861 CA VAL B 70 200.461 -1.866 -4.134 1.00 0.00 C ATOM 2862 C VAL B 70 201.305 -1.824 -5.384 1.00 0.00 C ATOM 2863 O VAL B 70 202.473 -2.119 -5.372 1.00 0.00 O ATOM 2864 CB VAL B 70 199.387 -2.973 -4.320 1.00 0.00 C ATOM 2865 CG1 VAL B 70 200.022 -4.330 -4.619 1.00 0.00 C ATOM 2866 CG2 VAL B 70 198.537 -3.091 -3.080 1.00 0.00 C ATOM 0 H VAL B 70 198.779 -0.595 -3.821 1.00 0.00 H new ATOM 0 HA VAL B 70 201.066 -2.074 -3.252 1.00 0.00 H new ATOM 0 HB VAL B 70 198.768 -2.684 -5.170 1.00 0.00 H new ATOM 0 HG11 VAL B 70 199.239 -5.079 -4.743 1.00 0.00 H new ATOM 0 HG12 VAL B 70 200.608 -4.263 -5.535 1.00 0.00 H new ATOM 0 HG13 VAL B 70 200.672 -4.618 -3.793 1.00 0.00 H new ATOM 0 HG21 VAL B 70 197.789 -3.870 -3.225 1.00 0.00 H new ATOM 0 HG22 VAL B 70 199.168 -3.347 -2.229 1.00 0.00 H new ATOM 0 HG23 VAL B 70 198.039 -2.141 -2.889 1.00 0.00 H new ATOM 2876 N ARG B 71 200.691 -1.505 -6.461 1.00 0.00 N ATOM 2877 CA ARG B 71 201.389 -1.504 -7.769 1.00 0.00 C ATOM 2878 C ARG B 71 202.592 -0.598 -7.704 1.00 0.00 C ATOM 2879 O ARG B 71 203.691 -0.987 -8.082 1.00 0.00 O ATOM 2880 CB ARG B 71 200.429 -1.028 -8.860 1.00 0.00 C ATOM 2881 CG ARG B 71 200.864 -1.563 -10.229 1.00 0.00 C ATOM 2882 CD ARG B 71 199.628 -1.816 -11.095 1.00 0.00 C ATOM 2883 NE ARG B 71 198.730 -2.812 -10.414 1.00 0.00 N ATOM 2884 CZ ARG B 71 197.591 -2.449 -9.842 1.00 0.00 C ATOM 2885 NH1 ARG B 71 197.229 -1.201 -9.806 1.00 0.00 N ATOM 2886 NH2 ARG B 71 196.829 -3.338 -9.298 1.00 0.00 N ATOM 0 H ARG B 71 199.708 -1.236 -6.503 1.00 0.00 H new ATOM 0 HA ARG B 71 201.722 -2.515 -8.004 1.00 0.00 H new ATOM 0 HB2 ARG B 71 199.417 -1.366 -8.635 1.00 0.00 H new ATOM 0 HB3 ARG B 71 200.404 0.062 -8.880 1.00 0.00 H new ATOM 0 HG2 ARG B 71 201.523 -0.846 -10.718 1.00 0.00 H new ATOM 0 HG3 ARG B 71 201.431 -2.486 -10.107 1.00 0.00 H new ATOM 0 HD2 ARG B 71 199.091 -0.882 -11.262 1.00 0.00 H new ATOM 0 HD3 ARG B 71 199.928 -2.191 -12.074 1.00 0.00 H new ATOM 0 HE ARG B 71 199.005 -3.794 -10.392 1.00 0.00 H new ATOM 0 HH11 ARG B 71 197.825 -0.485 -10.222 1.00 0.00 H new ATOM 0 HH12 ARG B 71 196.349 -0.938 -9.362 1.00 0.00 H new ATOM 0 HH21 ARG B 71 197.104 -4.320 -9.308 1.00 0.00 H new ATOM 0 HH22 ARG B 71 195.952 -3.058 -8.858 1.00 0.00 H new ATOM 2900 N GLU B 72 202.427 0.580 -7.201 1.00 0.00 N ATOM 2901 CA GLU B 72 203.586 1.487 -7.099 1.00 0.00 C ATOM 2902 C GLU B 72 204.646 0.813 -6.252 1.00 0.00 C ATOM 2903 O GLU B 72 205.836 0.899 -6.541 1.00 0.00 O ATOM 2904 CB GLU B 72 203.159 2.824 -6.485 1.00 0.00 C ATOM 2905 CG GLU B 72 202.273 3.576 -7.493 1.00 0.00 C ATOM 2906 CD GLU B 72 202.226 5.044 -7.130 1.00 0.00 C ATOM 2907 OE1 GLU B 72 203.212 5.703 -7.292 1.00 0.00 O ATOM 2908 OE2 GLU B 72 201.210 5.487 -6.678 1.00 0.00 O ATOM 0 H GLU B 72 201.543 0.954 -6.857 1.00 0.00 H new ATOM 0 HA GLU B 72 203.991 1.695 -8.089 1.00 0.00 H new ATOM 0 HB2 GLU B 72 202.614 2.655 -5.557 1.00 0.00 H new ATOM 0 HB3 GLU B 72 204.036 3.421 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU B 72 202.667 3.453 -8.502 1.00 0.00 H new ATOM 0 HG3 GLU B 72 201.266 3.158 -7.491 1.00 0.00 H new ATOM 2915 N LEU B 73 204.242 0.135 -5.227 1.00 0.00 N ATOM 2916 CA LEU B 73 205.214 -0.559 -4.376 1.00 0.00 C ATOM 2917 C LEU B 73 205.822 -1.734 -5.123 1.00 0.00 C ATOM 2918 O LEU B 73 206.997 -1.965 -5.029 1.00 0.00 O ATOM 2919 CB LEU B 73 204.564 -1.019 -3.095 1.00 0.00 C ATOM 2920 CG LEU B 73 204.025 0.197 -2.336 1.00 0.00 C ATOM 2921 CD1 LEU B 73 203.102 -0.276 -1.249 1.00 0.00 C ATOM 2922 CD2 LEU B 73 205.177 0.980 -1.705 1.00 0.00 C ATOM 0 H LEU B 73 203.267 0.034 -4.944 1.00 0.00 H new ATOM 0 HA LEU B 73 206.012 0.138 -4.120 1.00 0.00 H new ATOM 0 HB2 LEU B 73 203.753 -1.714 -3.314 1.00 0.00 H new ATOM 0 HB3 LEU B 73 205.286 -1.556 -2.480 1.00 0.00 H new ATOM 0 HG LEU B 73 203.492 0.845 -3.032 1.00 0.00 H new ATOM 0 HD11 LEU B 73 202.713 0.583 -0.703 1.00 0.00 H new ATOM 0 HD12 LEU B 73 202.274 -0.831 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU B 73 203.649 -0.924 -0.564 1.00 0.00 H new ATOM 0 HD21 LEU B 73 204.780 1.842 -1.168 1.00 0.00 H new ATOM 0 HD22 LEU B 73 205.716 0.337 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU B 73 205.857 1.320 -2.486 1.00 0.00 H new ATOM 2934 N GLU B 74 205.056 -2.463 -5.892 1.00 0.00 N ATOM 2935 CA GLU B 74 205.647 -3.579 -6.666 1.00 0.00 C ATOM 2936 C GLU B 74 206.640 -2.979 -7.654 1.00 0.00 C ATOM 2937 O GLU B 74 207.762 -3.445 -7.797 1.00 0.00 O ATOM 2938 CB GLU B 74 204.537 -4.316 -7.428 1.00 0.00 C ATOM 2939 CG GLU B 74 203.443 -4.771 -6.450 1.00 0.00 C ATOM 2940 CD GLU B 74 203.229 -6.256 -6.575 1.00 0.00 C ATOM 2941 OE1 GLU B 74 202.459 -6.656 -7.393 1.00 0.00 O ATOM 2942 OE2 GLU B 74 203.832 -6.984 -5.841 1.00 0.00 O ATOM 0 H GLU B 74 204.052 -2.330 -6.013 1.00 0.00 H new ATOM 0 HA GLU B 74 206.147 -4.287 -6.005 1.00 0.00 H new ATOM 0 HB2 GLU B 74 204.109 -3.661 -8.187 1.00 0.00 H new ATOM 0 HB3 GLU B 74 204.953 -5.179 -7.949 1.00 0.00 H new ATOM 0 HG2 GLU B 74 203.729 -4.521 -5.428 1.00 0.00 H new ATOM 0 HG3 GLU B 74 202.513 -4.242 -6.659 1.00 0.00 H new ATOM 2949 N LEU B 75 206.242 -1.936 -8.328 1.00 0.00 N ATOM 2950 CA LEU B 75 207.143 -1.262 -9.289 1.00 0.00 C ATOM 2951 C LEU B 75 208.369 -0.778 -8.512 1.00 0.00 C ATOM 2952 O LEU B 75 209.506 -0.960 -8.937 1.00 0.00 O ATOM 2953 CB LEU B 75 206.407 -0.074 -9.923 1.00 0.00 C ATOM 2954 CG LEU B 75 205.160 -0.566 -10.700 1.00 0.00 C ATOM 2955 CD1 LEU B 75 204.103 0.547 -10.792 1.00 0.00 C ATOM 2956 CD2 LEU B 75 205.567 -0.967 -12.112 1.00 0.00 C ATOM 0 H LEU B 75 205.314 -1.520 -8.248 1.00 0.00 H new ATOM 0 HA LEU B 75 207.450 -1.941 -10.085 1.00 0.00 H new ATOM 0 HB2 LEU B 75 206.106 0.631 -9.148 1.00 0.00 H new ATOM 0 HB3 LEU B 75 207.077 0.460 -10.597 1.00 0.00 H new ATOM 0 HG LEU B 75 204.738 -1.419 -10.168 1.00 0.00 H new ATOM 0 HD11 LEU B 75 203.236 0.181 -11.341 1.00 0.00 H new ATOM 0 HD12 LEU B 75 203.798 0.843 -9.788 1.00 0.00 H new ATOM 0 HD13 LEU B 75 204.525 1.407 -11.312 1.00 0.00 H new ATOM 0 HD21 LEU B 75 204.690 -1.313 -12.659 1.00 0.00 H new ATOM 0 HD22 LEU B 75 205.998 -0.107 -12.624 1.00 0.00 H new ATOM 0 HD23 LEU B 75 206.305 -1.768 -12.064 1.00 0.00 H new ATOM 2968 N GLU B 76 208.150 -0.231 -7.353 1.00 0.00 N ATOM 2969 CA GLU B 76 209.263 0.213 -6.489 1.00 0.00 C ATOM 2970 C GLU B 76 210.150 -0.996 -6.157 1.00 0.00 C ATOM 2971 O GLU B 76 211.358 -0.939 -6.264 1.00 0.00 O ATOM 2972 CB GLU B 76 208.673 0.796 -5.189 1.00 0.00 C ATOM 2973 CG GLU B 76 209.682 1.718 -4.497 1.00 0.00 C ATOM 2974 CD GLU B 76 209.125 3.112 -4.429 1.00 0.00 C ATOM 2975 OE1 GLU B 76 209.118 3.779 -5.440 1.00 0.00 O ATOM 2976 OE2 GLU B 76 208.706 3.503 -3.379 1.00 0.00 O ATOM 0 H GLU B 76 207.221 -0.071 -6.963 1.00 0.00 H new ATOM 0 HA GLU B 76 209.860 0.971 -6.996 1.00 0.00 H new ATOM 0 HB2 GLU B 76 207.762 1.351 -5.415 1.00 0.00 H new ATOM 0 HB3 GLU B 76 208.394 -0.015 -4.516 1.00 0.00 H new ATOM 0 HG2 GLU B 76 209.896 1.351 -3.493 1.00 0.00 H new ATOM 0 HG3 GLU B 76 210.625 1.718 -5.044 1.00 0.00 H new ATOM 2983 N LEU B 77 209.559 -2.073 -5.735 1.00 0.00 N ATOM 2984 CA LEU B 77 210.347 -3.280 -5.364 1.00 0.00 C ATOM 2985 C LEU B 77 211.146 -3.723 -6.553 1.00 0.00 C ATOM 2986 O LEU B 77 212.335 -3.928 -6.458 1.00 0.00 O ATOM 2987 CB LEU B 77 209.417 -4.410 -4.922 1.00 0.00 C ATOM 2988 CG LEU B 77 208.977 -4.174 -3.472 1.00 0.00 C ATOM 2989 CD1 LEU B 77 207.746 -5.008 -3.166 1.00 0.00 C ATOM 2990 CD2 LEU B 77 210.102 -4.564 -2.511 1.00 0.00 C ATOM 0 H LEU B 77 208.549 -2.172 -5.629 1.00 0.00 H new ATOM 0 HA LEU B 77 211.012 -3.034 -4.536 1.00 0.00 H new ATOM 0 HB2 LEU B 77 208.545 -4.454 -5.575 1.00 0.00 H new ATOM 0 HB3 LEU B 77 209.927 -5.369 -5.007 1.00 0.00 H new ATOM 0 HG LEU B 77 208.744 -3.117 -3.344 1.00 0.00 H new ATOM 0 HD11 LEU B 77 207.438 -4.837 -2.135 1.00 0.00 H new ATOM 0 HD12 LEU B 77 206.937 -4.723 -3.839 1.00 0.00 H new ATOM 0 HD13 LEU B 77 207.978 -6.064 -3.305 1.00 0.00 H new ATOM 0 HD21 LEU B 77 209.779 -4.392 -1.484 1.00 0.00 H new ATOM 0 HD22 LEU B 77 210.345 -5.618 -2.644 1.00 0.00 H new ATOM 0 HD23 LEU B 77 210.985 -3.959 -2.720 1.00 0.00 H new ATOM 3002 N ASP B 78 210.518 -3.851 -7.687 1.00 0.00 N ATOM 3003 CA ASP B 78 211.264 -4.247 -8.900 1.00 0.00 C ATOM 3004 C ASP B 78 212.407 -3.262 -9.094 1.00 0.00 C ATOM 3005 O ASP B 78 213.507 -3.625 -9.478 1.00 0.00 O ATOM 3006 CB ASP B 78 210.325 -4.211 -10.117 1.00 0.00 C ATOM 3007 CG ASP B 78 209.676 -5.564 -10.295 1.00 0.00 C ATOM 3008 OD1 ASP B 78 210.301 -6.424 -10.857 1.00 0.00 O ATOM 3009 OD2 ASP B 78 208.571 -5.740 -9.851 1.00 0.00 O ATOM 0 H ASP B 78 209.519 -3.697 -7.821 1.00 0.00 H new ATOM 0 HA ASP B 78 211.656 -5.258 -8.794 1.00 0.00 H new ATOM 0 HB2 ASP B 78 209.562 -3.445 -9.978 1.00 0.00 H new ATOM 0 HB3 ASP B 78 210.885 -3.944 -11.013 1.00 0.00 H new ATOM 3014 N ARG B 79 212.157 -2.023 -8.808 1.00 0.00 N ATOM 3015 CA ARG B 79 213.184 -0.986 -8.948 1.00 0.00 C ATOM 3016 C ARG B 79 214.307 -1.285 -7.947 1.00 0.00 C ATOM 3017 O ARG B 79 215.456 -1.425 -8.311 1.00 0.00 O ATOM 3018 CB ARG B 79 212.545 0.364 -8.634 1.00 0.00 C ATOM 3019 CG ARG B 79 213.202 1.490 -9.442 1.00 0.00 C ATOM 3020 CD ARG B 79 214.390 2.102 -8.677 1.00 0.00 C ATOM 3021 NE ARG B 79 215.689 1.619 -9.256 1.00 0.00 N ATOM 3022 CZ ARG B 79 216.008 1.820 -10.518 1.00 0.00 C ATOM 3023 NH1 ARG B 79 215.194 2.464 -11.303 1.00 0.00 N ATOM 3024 NH2 ARG B 79 217.133 1.390 -10.964 1.00 0.00 N ATOM 0 H ARG B 79 211.255 -1.684 -8.474 1.00 0.00 H new ATOM 0 HA ARG B 79 213.594 -0.967 -9.958 1.00 0.00 H new ATOM 0 HB2 ARG B 79 211.479 0.326 -8.859 1.00 0.00 H new ATOM 0 HB3 ARG B 79 212.639 0.575 -7.569 1.00 0.00 H new ATOM 0 HG2 ARG B 79 213.545 1.101 -10.401 1.00 0.00 H new ATOM 0 HG3 ARG B 79 212.466 2.265 -9.657 1.00 0.00 H new ATOM 0 HD2 ARG B 79 214.343 3.190 -8.729 1.00 0.00 H new ATOM 0 HD3 ARG B 79 214.331 1.831 -7.623 1.00 0.00 H new ATOM 0 HE ARG B 79 216.344 1.120 -8.654 1.00 0.00 H new ATOM 0 HH11 ARG B 79 214.307 2.814 -10.941 1.00 0.00 H new ATOM 0 HH12 ARG B 79 215.443 2.619 -12.280 1.00 0.00 H new ATOM 0 HH21 ARG B 79 217.773 0.896 -10.342 1.00 0.00 H new ATOM 0 HH22 ARG B 79 217.386 1.542 -11.940 1.00 0.00 H new ATOM 3038 N LEU B 80 213.977 -1.433 -6.693 1.00 0.00 N ATOM 3039 CA LEU B 80 215.018 -1.749 -5.675 1.00 0.00 C ATOM 3040 C LEU B 80 215.726 -3.037 -6.072 1.00 0.00 C ATOM 3041 O LEU B 80 216.919 -3.194 -5.857 1.00 0.00 O ATOM 3042 CB LEU B 80 214.379 -1.913 -4.298 1.00 0.00 C ATOM 3043 CG LEU B 80 214.261 -0.554 -3.581 1.00 0.00 C ATOM 3044 CD1 LEU B 80 213.824 -0.775 -2.136 1.00 0.00 C ATOM 3045 CD2 LEU B 80 215.613 0.187 -3.585 1.00 0.00 C ATOM 0 H LEU B 80 213.028 -1.348 -6.329 1.00 0.00 H new ATOM 0 HA LEU B 80 215.737 -0.931 -5.628 1.00 0.00 H new ATOM 0 HB2 LEU B 80 213.391 -2.361 -4.402 1.00 0.00 H new ATOM 0 HB3 LEU B 80 214.976 -2.596 -3.695 1.00 0.00 H new ATOM 0 HG LEU B 80 213.524 0.049 -4.111 1.00 0.00 H new ATOM 0 HD11 LEU B 80 213.741 0.187 -1.630 1.00 0.00 H new ATOM 0 HD12 LEU B 80 212.857 -1.278 -2.121 1.00 0.00 H new ATOM 0 HD13 LEU B 80 214.562 -1.392 -1.623 1.00 0.00 H new ATOM 0 HD21 LEU B 80 215.505 1.143 -3.073 1.00 0.00 H new ATOM 0 HD22 LEU B 80 216.361 -0.417 -3.071 1.00 0.00 H new ATOM 0 HD23 LEU B 80 215.930 0.359 -4.613 1.00 0.00 H new ATOM 3057 N ARG B 81 215.007 -3.980 -6.585 1.00 0.00 N ATOM 3058 CA ARG B 81 215.639 -5.258 -7.005 1.00 0.00 C ATOM 3059 C ARG B 81 216.614 -4.932 -8.112 1.00 0.00 C ATOM 3060 O ARG B 81 217.680 -5.526 -8.212 1.00 0.00 O ATOM 3061 CB ARG B 81 214.570 -6.235 -7.501 1.00 0.00 C ATOM 3062 CG ARG B 81 213.736 -6.702 -6.303 1.00 0.00 C ATOM 3063 CD ARG B 81 212.483 -7.437 -6.783 1.00 0.00 C ATOM 3064 NE ARG B 81 212.020 -8.379 -5.715 1.00 0.00 N ATOM 3065 CZ ARG B 81 212.211 -9.685 -5.804 1.00 0.00 C ATOM 3066 NH1 ARG B 81 212.854 -10.197 -6.827 1.00 0.00 N ATOM 3067 NH2 ARG B 81 211.773 -10.459 -4.852 1.00 0.00 N ATOM 0 H ARG B 81 214.000 -3.926 -6.735 1.00 0.00 H new ATOM 0 HA ARG B 81 216.155 -5.730 -6.169 1.00 0.00 H new ATOM 0 HB2 ARG B 81 213.931 -5.752 -8.241 1.00 0.00 H new ATOM 0 HB3 ARG B 81 215.037 -7.089 -7.992 1.00 0.00 H new ATOM 0 HG2 ARG B 81 214.332 -7.360 -5.671 1.00 0.00 H new ATOM 0 HG3 ARG B 81 213.452 -5.845 -5.693 1.00 0.00 H new ATOM 0 HD2 ARG B 81 211.696 -6.721 -7.018 1.00 0.00 H new ATOM 0 HD3 ARG B 81 212.699 -7.986 -7.699 1.00 0.00 H new ATOM 0 HE ARG B 81 211.544 -8.003 -4.895 1.00 0.00 H new ATOM 0 HH11 ARG B 81 213.211 -9.587 -7.562 1.00 0.00 H new ATOM 0 HH12 ARG B 81 212.996 -11.205 -6.887 1.00 0.00 H new ATOM 0 HH21 ARG B 81 211.289 -10.056 -4.050 1.00 0.00 H new ATOM 0 HH22 ARG B 81 211.914 -11.468 -4.909 1.00 0.00 H new ATOM 3081 N ALA B 82 216.296 -3.951 -8.904 1.00 0.00 N ATOM 3082 CA ALA B 82 217.230 -3.514 -9.960 1.00 0.00 C ATOM 3083 C ALA B 82 218.543 -3.162 -9.282 1.00 0.00 C ATOM 3084 O ALA B 82 219.613 -3.590 -9.700 1.00 0.00 O ATOM 3085 CB ALA B 82 216.669 -2.272 -10.678 1.00 0.00 C ATOM 0 H ALA B 82 215.419 -3.431 -8.861 1.00 0.00 H new ATOM 0 HA ALA B 82 217.371 -4.302 -10.699 1.00 0.00 H new ATOM 0 HB1 ALA B 82 217.364 -1.956 -11.456 1.00 0.00 H new ATOM 0 HB2 ALA B 82 215.707 -2.516 -11.129 1.00 0.00 H new ATOM 0 HB3 ALA B 82 216.538 -1.464 -9.958 1.00 0.00 H new ATOM 3091 N GLU B 83 218.480 -2.378 -8.245 1.00 0.00 N ATOM 3092 CA GLU B 83 219.721 -1.987 -7.536 1.00 0.00 C ATOM 3093 C GLU B 83 220.303 -3.193 -6.838 1.00 0.00 C ATOM 3094 O GLU B 83 221.458 -3.469 -6.953 1.00 0.00 O ATOM 3095 CB GLU B 83 219.425 -0.887 -6.522 1.00 0.00 C ATOM 3096 CG GLU B 83 219.613 0.462 -7.201 1.00 0.00 C ATOM 3097 CD GLU B 83 218.462 0.692 -8.127 1.00 0.00 C ATOM 3098 OE1 GLU B 83 217.434 1.077 -7.659 1.00 0.00 O ATOM 3099 OE2 GLU B 83 218.622 0.466 -9.306 1.00 0.00 O ATOM 0 H GLU B 83 217.619 -1.991 -7.859 1.00 0.00 H new ATOM 0 HA GLU B 83 220.442 -1.606 -8.260 1.00 0.00 H new ATOM 0 HB2 GLU B 83 218.406 -0.983 -6.146 1.00 0.00 H new ATOM 0 HB3 GLU B 83 220.091 -0.975 -5.663 1.00 0.00 H new ATOM 0 HG2 GLU B 83 219.665 1.257 -6.457 1.00 0.00 H new ATOM 0 HG3 GLU B 83 220.553 0.480 -7.753 1.00 0.00 H new ATOM 3106 N ASN B 84 219.500 -3.933 -6.129 1.00 0.00 N ATOM 3107 CA ASN B 84 220.009 -5.147 -5.434 1.00 0.00 C ATOM 3108 C ASN B 84 220.807 -5.948 -6.432 1.00 0.00 C ATOM 3109 O ASN B 84 221.900 -6.371 -6.158 1.00 0.00 O ATOM 3110 CB ASN B 84 218.842 -5.997 -4.950 1.00 0.00 C ATOM 3111 CG ASN B 84 218.287 -5.451 -3.643 1.00 0.00 C ATOM 3112 OD1 ASN B 84 218.581 -5.962 -2.577 1.00 0.00 O ATOM 3113 ND2 ASN B 84 217.496 -4.430 -3.664 1.00 0.00 N ATOM 0 H ASN B 84 218.505 -3.748 -6.000 1.00 0.00 H new ATOM 0 HA ASN B 84 220.620 -4.858 -4.579 1.00 0.00 H new ATOM 0 HB2 ASN B 84 218.057 -6.011 -5.707 1.00 0.00 H new ATOM 0 HB3 ASN B 84 219.169 -7.027 -4.810 1.00 0.00 H new ATOM 0 HD21 ASN B 84 217.122 -4.057 -2.792 1.00 0.00 H new ATOM 0 HD22 ASN B 84 217.246 -3.997 -4.553 1.00 0.00 H new ATOM 3120 N LEU B 85 220.273 -6.137 -7.600 1.00 0.00 N ATOM 3121 CA LEU B 85 221.013 -6.897 -8.638 1.00 0.00 C ATOM 3122 C LEU B 85 222.329 -6.171 -8.908 1.00 0.00 C ATOM 3123 O LEU B 85 223.401 -6.728 -8.770 1.00 0.00 O ATOM 3124 CB LEU B 85 220.144 -6.995 -9.927 1.00 0.00 C ATOM 3125 CG LEU B 85 221.007 -7.020 -11.211 1.00 0.00 C ATOM 3126 CD1 LEU B 85 221.910 -8.259 -11.231 1.00 0.00 C ATOM 3127 CD2 LEU B 85 220.088 -7.045 -12.437 1.00 0.00 C ATOM 0 H LEU B 85 219.354 -5.797 -7.882 1.00 0.00 H new ATOM 0 HA LEU B 85 221.227 -7.912 -8.303 1.00 0.00 H new ATOM 0 HB2 LEU B 85 219.533 -7.897 -9.884 1.00 0.00 H new ATOM 0 HB3 LEU B 85 219.459 -6.148 -9.967 1.00 0.00 H new ATOM 0 HG LEU B 85 221.634 -6.129 -11.229 1.00 0.00 H new ATOM 0 HD11 LEU B 85 222.509 -8.258 -12.142 1.00 0.00 H new ATOM 0 HD12 LEU B 85 222.569 -8.243 -10.363 1.00 0.00 H new ATOM 0 HD13 LEU B 85 221.295 -9.158 -11.202 1.00 0.00 H new ATOM 0 HD21 LEU B 85 220.692 -7.063 -13.344 1.00 0.00 H new ATOM 0 HD22 LEU B 85 219.459 -7.935 -12.402 1.00 0.00 H new ATOM 0 HD23 LEU B 85 219.458 -6.155 -12.438 1.00 0.00 H new ATOM 3139 N GLN B 86 222.245 -4.934 -9.289 1.00 0.00 N ATOM 3140 CA GLN B 86 223.472 -4.135 -9.608 1.00 0.00 C ATOM 3141 C GLN B 86 224.491 -4.229 -8.458 1.00 0.00 C ATOM 3142 O GLN B 86 225.682 -4.373 -8.666 1.00 0.00 O ATOM 3143 CB GLN B 86 223.074 -2.662 -9.792 1.00 0.00 C ATOM 3144 CG GLN B 86 222.403 -2.438 -11.160 1.00 0.00 C ATOM 3145 CD GLN B 86 221.531 -1.188 -11.073 1.00 0.00 C ATOM 3146 OE1 GLN B 86 220.320 -1.301 -10.674 1.00 0.00 O flip ATOM 3147 NE2 GLN B 86 221.983 -0.084 -11.355 1.00 0.00 N flip ATOM 0 H GLN B 86 221.367 -4.426 -9.397 1.00 0.00 H new ATOM 0 HA GLN B 86 223.923 -4.530 -10.519 1.00 0.00 H new ATOM 0 HB2 GLN B 86 222.392 -2.364 -8.995 1.00 0.00 H new ATOM 0 HB3 GLN B 86 223.958 -2.030 -9.709 1.00 0.00 H new ATOM 0 HG2 GLN B 86 223.158 -2.320 -11.937 1.00 0.00 H new ATOM 0 HG3 GLN B 86 221.799 -3.303 -11.432 1.00 0.00 H new ATOM 0 HE21 GLN B 86 222.948 0.006 -11.673 1.00 0.00 H new ATOM 0 HE22 GLN B 86 221.394 0.745 -11.272 1.00 0.00 H new ATOM 3156 N LEU B 87 224.044 -4.055 -7.270 1.00 0.00 N ATOM 3157 CA LEU B 87 224.967 -4.017 -6.112 1.00 0.00 C ATOM 3158 C LEU B 87 225.426 -5.416 -5.755 1.00 0.00 C ATOM 3159 O LEU B 87 226.606 -5.659 -5.590 1.00 0.00 O ATOM 3160 CB LEU B 87 224.269 -3.372 -4.917 1.00 0.00 C ATOM 3161 CG LEU B 87 223.609 -2.050 -5.350 1.00 0.00 C ATOM 3162 CD1 LEU B 87 222.444 -1.718 -4.420 1.00 0.00 C ATOM 3163 CD2 LEU B 87 224.646 -0.925 -5.298 1.00 0.00 C ATOM 0 H LEU B 87 223.058 -3.934 -7.037 1.00 0.00 H new ATOM 0 HA LEU B 87 225.842 -3.424 -6.378 1.00 0.00 H new ATOM 0 HB2 LEU B 87 223.517 -4.050 -4.514 1.00 0.00 H new ATOM 0 HB3 LEU B 87 224.989 -3.186 -4.120 1.00 0.00 H new ATOM 0 HG LEU B 87 223.231 -2.153 -6.367 1.00 0.00 H new ATOM 0 HD11 LEU B 87 221.983 -0.781 -4.734 1.00 0.00 H new ATOM 0 HD12 LEU B 87 221.705 -2.518 -4.463 1.00 0.00 H new ATOM 0 HD13 LEU B 87 222.811 -1.617 -3.399 1.00 0.00 H new ATOM 0 HD21 LEU B 87 224.182 0.012 -5.604 1.00 0.00 H new ATOM 0 HD22 LEU B 87 225.026 -0.827 -4.281 1.00 0.00 H new ATOM 0 HD23 LEU B 87 225.470 -1.159 -5.972 1.00 0.00 H new