USER MOD reduce.3.24.130724 H: found=0, std=0, add=1134, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1136 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 21 SER OG : rot -12:sc= 1.19 USER MOD Set 1.2: B 80 TYR OH : rot 46:sc= 2.34 USER MOD Set 2.1: B 23 THR OG1 : rot -161:sc= 1.33 USER MOD Set 2.2: B 67 HIS : no HE2:sc= 2.08 K(o=3.4,f=-9.6!) USER MOD Set 3.1: B 40 ASN :FLIP amide:sc= 0 X(o=-0.62,f=-0.19) USER MOD Set 3.2: B 41 GLN :FLIP amide:sc= -0.193 F(o=-0.79,f=-0.19) USER MOD Set 4.1: A 83 ASN : amide:sc= -1.02 K(o=0.0091,f=-5.6!) USER MOD Set 4.2: B 83 ASN : amide:sc= 1.02 K(o=0.0091,f=-0.86) USER MOD Set 5.1: A 80 TYR OH : rot 35:sc= -0.413! USER MOD Set 5.2: A 84 HIS : no HD1:sc= 1.09 K(o=1.6,f=-5!) USER MOD Set 5.3: B 21 SER OG : rot -18:sc= 0.942 USER MOD Single : A 23 THR OG1 : rot 69:sc= 0.739 USER MOD Single : A 26 THR OG1 : rot 71:sc= 0.903 USER MOD Single : A 28 TYR OH : rot 130:sc= -0.285 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.137 K(o=-0.14,f=-2.6!) USER MOD Single : A 40 ASN : amide:sc= -0.0553 X(o=-0.055,f=0) USER MOD Single : A 41 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.13) USER MOD Single : A 45 TYR OH : rot 38:sc= -0.211! USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 62 ASN : amide:sc=-0.00145 X(o=-0.0015,f=0) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 MET CE :methyl 143:sc= -1.53 (180deg=-2.56!) USER MOD Single : A 77 THR OG1 : rot 84:sc= 0.108 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : B 26 THR OG1 : rot 73:sc= 1.21 USER MOD Single : B 28 TYR OH : rot 150:sc= -0.0356 USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 45 TYR OH : rot 51:sc= 1.73 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 GLN : amide:sc= -0.0684 K(o=-0.068,f=-0.6) USER MOD Single : B 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 73 MET CE :methyl 162:sc= -1.11 (180deg=-1.52) USER MOD Single : B 77 THR OG1 : rot 120:sc= 0.234 USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 TYR OH : rot 180:sc= 0 USER MOD Single : B 84 HIS : +bothHN:sc= 1.58 K(o=1.6,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 300 N ALA A 19 14.068 0.476 6.239 1.00 21.12 N ATOM 301 CA ALA A 19 13.369 0.501 7.495 1.00 4.22 C ATOM 302 C ALA A 19 11.889 0.304 7.322 1.00 2.23 C ATOM 303 O ALA A 19 11.255 -0.288 8.168 1.00 63.30 O ATOM 304 CB ALA A 19 13.596 1.815 8.152 1.00 2.50 C ATOM 0 HA ALA A 19 13.754 -0.317 8.103 1.00 4.22 H new ATOM 0 HB1 ALA A 19 13.069 1.841 9.106 1.00 2.50 H new ATOM 0 HB2 ALA A 19 14.663 1.956 8.324 1.00 2.50 H new ATOM 0 HB3 ALA A 19 13.223 2.612 7.509 1.00 2.50 H new ATOM 310 N ILE A 20 11.337 0.800 6.215 1.00 10.04 N ATOM 311 CA ILE A 20 9.896 0.708 5.968 1.00 35.20 C ATOM 312 C ILE A 20 9.504 -0.759 5.878 1.00 30.32 C ATOM 313 O ILE A 20 8.416 -1.162 6.308 1.00 61.53 O ATOM 314 CB ILE A 20 9.452 1.480 4.681 1.00 10.05 C ATOM 315 CG1 ILE A 20 9.861 2.963 4.784 1.00 61.23 C ATOM 316 CG2 ILE A 20 7.940 1.359 4.468 1.00 34.21 C ATOM 317 CD1 ILE A 20 9.489 3.796 3.568 1.00 14.33 C ATOM 0 H ILE A 20 11.862 1.268 5.477 1.00 10.04 H new ATOM 0 HA ILE A 20 9.379 1.185 6.801 1.00 35.20 H new ATOM 0 HB ILE A 20 9.954 1.034 3.822 1.00 10.05 H new ATOM 0 HG12 ILE A 20 9.391 3.398 5.666 1.00 61.23 H new ATOM 0 HG13 ILE A 20 10.939 3.022 4.935 1.00 61.23 H new ATOM 0 HG21 ILE A 20 7.655 1.903 3.568 1.00 34.21 H new ATOM 0 HG22 ILE A 20 7.671 0.309 4.357 1.00 34.21 H new ATOM 0 HG23 ILE A 20 7.417 1.779 5.327 1.00 34.21 H new ATOM 0 HD11 ILE A 20 9.811 4.826 3.720 1.00 14.33 H new ATOM 0 HD12 ILE A 20 9.980 3.389 2.684 1.00 14.33 H new ATOM 0 HD13 ILE A 20 8.409 3.771 3.427 1.00 14.33 H new ATOM 329 N SER A 21 10.432 -1.552 5.377 1.00 45.24 N ATOM 330 CA SER A 21 10.235 -2.983 5.254 1.00 12.42 C ATOM 331 C SER A 21 10.084 -3.602 6.648 1.00 52.34 C ATOM 332 O SER A 21 9.252 -4.483 6.873 1.00 40.21 O ATOM 333 CB SER A 21 11.426 -3.611 4.516 1.00 51.21 C ATOM 334 OG SER A 21 11.595 -3.021 3.227 1.00 72.44 O ATOM 0 H SER A 21 11.339 -1.224 5.045 1.00 45.24 H new ATOM 0 HA SER A 21 9.328 -3.177 4.681 1.00 12.42 H new ATOM 0 HB2 SER A 21 12.334 -3.477 5.103 1.00 51.21 H new ATOM 0 HB3 SER A 21 11.269 -4.685 4.411 1.00 51.21 H new ATOM 0 HG SER A 21 10.804 -2.487 3.005 1.00 72.44 H new ATOM 340 N GLU A 22 10.873 -3.094 7.575 1.00 11.24 N ATOM 341 CA GLU A 22 10.877 -3.547 8.950 1.00 42.10 C ATOM 342 C GLU A 22 9.643 -2.999 9.675 1.00 41.41 C ATOM 343 O GLU A 22 8.980 -3.707 10.445 1.00 55.53 O ATOM 344 CB GLU A 22 12.132 -3.036 9.636 1.00 33.13 C ATOM 345 CG GLU A 22 13.423 -3.346 8.891 1.00 21.55 C ATOM 346 CD GLU A 22 13.657 -4.818 8.679 1.00 43.41 C ATOM 347 OE1 GLU A 22 14.217 -5.470 9.580 1.00 52.41 O ATOM 348 OE2 GLU A 22 13.324 -5.333 7.602 1.00 62.24 O ATOM 0 H GLU A 22 11.539 -2.344 7.390 1.00 11.24 H new ATOM 0 HA GLU A 22 10.857 -4.636 8.977 1.00 42.10 H new ATOM 0 HB2 GLU A 22 12.049 -1.956 9.762 1.00 33.13 H new ATOM 0 HB3 GLU A 22 12.189 -3.470 10.634 1.00 33.13 H new ATOM 0 HG2 GLU A 22 13.403 -2.846 7.922 1.00 21.55 H new ATOM 0 HG3 GLU A 22 14.263 -2.929 9.447 1.00 21.55 H new ATOM 355 N THR A 23 9.348 -1.725 9.413 1.00 52.32 N ATOM 356 CA THR A 23 8.202 -1.040 9.976 1.00 12.33 C ATOM 357 C THR A 23 6.917 -1.804 9.651 1.00 75.31 C ATOM 358 O THR A 23 6.145 -2.157 10.551 1.00 11.51 O ATOM 359 CB THR A 23 8.108 0.408 9.406 1.00 34.31 C ATOM 360 OG1 THR A 23 9.301 1.144 9.737 1.00 23.03 O ATOM 361 CG2 THR A 23 6.889 1.151 9.950 1.00 43.11 C ATOM 0 H THR A 23 9.910 -1.140 8.795 1.00 52.32 H new ATOM 0 HA THR A 23 8.324 -0.992 11.058 1.00 12.33 H new ATOM 0 HB THR A 23 8.005 0.330 8.324 1.00 34.31 H new ATOM 0 HG1 THR A 23 10.061 0.777 9.239 1.00 23.03 H new ATOM 0 HG21 THR A 23 6.858 2.156 9.530 1.00 43.11 H new ATOM 0 HG22 THR A 23 5.982 0.614 9.673 1.00 43.11 H new ATOM 0 HG23 THR A 23 6.956 1.214 11.036 1.00 43.11 H new ATOM 369 N LEU A 24 6.719 -2.102 8.381 1.00 40.53 N ATOM 370 CA LEU A 24 5.532 -2.800 7.951 1.00 0.53 C ATOM 371 C LEU A 24 5.533 -4.252 8.412 1.00 24.53 C ATOM 372 O LEU A 24 4.477 -4.806 8.679 1.00 44.24 O ATOM 373 CB LEU A 24 5.332 -2.685 6.446 1.00 63.44 C ATOM 374 CG LEU A 24 5.137 -1.264 5.899 1.00 34.30 C ATOM 375 CD1 LEU A 24 4.962 -1.298 4.398 1.00 34.43 C ATOM 376 CD2 LEU A 24 3.940 -0.581 6.559 1.00 3.43 C ATOM 0 H LEU A 24 7.369 -1.869 7.631 1.00 40.53 H new ATOM 0 HA LEU A 24 4.680 -2.315 8.428 1.00 0.53 H new ATOM 0 HB2 LEU A 24 6.195 -3.128 5.950 1.00 63.44 H new ATOM 0 HB3 LEU A 24 4.463 -3.282 6.168 1.00 63.44 H new ATOM 0 HG LEU A 24 6.029 -0.685 6.136 1.00 34.30 H new ATOM 0 HD11 LEU A 24 4.825 -0.283 4.025 1.00 34.43 H new ATOM 0 HD12 LEU A 24 5.847 -1.737 3.938 1.00 34.43 H new ATOM 0 HD13 LEU A 24 4.087 -1.898 4.147 1.00 34.43 H new ATOM 0 HD21 LEU A 24 3.825 0.424 6.153 1.00 3.43 H new ATOM 0 HD22 LEU A 24 3.037 -1.158 6.361 1.00 3.43 H new ATOM 0 HD23 LEU A 24 4.103 -0.521 7.635 1.00 3.43 H new ATOM 388 N GLU A 25 6.718 -4.862 8.524 1.00 12.45 N ATOM 389 CA GLU A 25 6.821 -6.226 9.041 1.00 31.23 C ATOM 390 C GLU A 25 6.326 -6.273 10.487 1.00 2.34 C ATOM 391 O GLU A 25 5.581 -7.185 10.882 1.00 70.45 O ATOM 392 CB GLU A 25 8.258 -6.751 8.953 1.00 3.43 C ATOM 393 CG GLU A 25 8.423 -8.134 9.551 1.00 43.01 C ATOM 394 CD GLU A 25 9.803 -8.690 9.390 1.00 4.10 C ATOM 395 OE1 GLU A 25 10.722 -8.278 10.148 1.00 60.43 O ATOM 396 OE2 GLU A 25 9.995 -9.560 8.529 1.00 72.32 O ATOM 0 H GLU A 25 7.608 -4.437 8.266 1.00 12.45 H new ATOM 0 HA GLU A 25 6.194 -6.871 8.425 1.00 31.23 H new ATOM 0 HB2 GLU A 25 8.567 -6.774 7.908 1.00 3.43 H new ATOM 0 HB3 GLU A 25 8.924 -6.058 9.467 1.00 3.43 H new ATOM 0 HG2 GLU A 25 8.177 -8.095 10.612 1.00 43.01 H new ATOM 0 HG3 GLU A 25 7.709 -8.812 9.083 1.00 43.01 H new ATOM 403 N THR A 26 6.728 -5.271 11.260 1.00 60.04 N ATOM 404 CA THR A 26 6.312 -5.128 12.632 1.00 23.04 C ATOM 405 C THR A 26 4.785 -5.006 12.707 1.00 12.54 C ATOM 406 O THR A 26 4.131 -5.692 13.497 1.00 63.24 O ATOM 407 CB THR A 26 6.974 -3.877 13.257 1.00 23.15 C ATOM 408 OG1 THR A 26 8.409 -4.015 13.216 1.00 5.41 O ATOM 409 CG2 THR A 26 6.521 -3.679 14.692 1.00 75.13 C ATOM 0 H THR A 26 7.357 -4.534 10.941 1.00 60.04 H new ATOM 0 HA THR A 26 6.624 -6.010 13.191 1.00 23.04 H new ATOM 0 HB THR A 26 6.671 -3.004 12.678 1.00 23.15 H new ATOM 0 HG1 THR A 26 8.720 -3.926 12.291 1.00 5.41 H new ATOM 0 HG21 THR A 26 7.002 -2.793 15.106 1.00 75.13 H new ATOM 0 HG22 THR A 26 5.439 -3.550 14.717 1.00 75.13 H new ATOM 0 HG23 THR A 26 6.796 -4.552 15.284 1.00 75.13 H new ATOM 417 N VAL A 27 4.236 -4.145 11.861 1.00 62.40 N ATOM 418 CA VAL A 27 2.798 -3.936 11.792 1.00 11.44 C ATOM 419 C VAL A 27 2.083 -5.222 11.399 1.00 52.51 C ATOM 420 O VAL A 27 1.134 -5.634 12.061 1.00 22.13 O ATOM 421 CB VAL A 27 2.434 -2.801 10.789 1.00 30.44 C ATOM 422 CG1 VAL A 27 0.931 -2.604 10.709 1.00 52.51 C ATOM 423 CG2 VAL A 27 3.108 -1.497 11.182 1.00 41.45 C ATOM 0 H VAL A 27 4.772 -3.575 11.207 1.00 62.40 H new ATOM 0 HA VAL A 27 2.466 -3.634 12.785 1.00 11.44 H new ATOM 0 HB VAL A 27 2.796 -3.101 9.806 1.00 30.44 H new ATOM 0 HG11 VAL A 27 0.706 -1.806 10.002 1.00 52.51 H new ATOM 0 HG12 VAL A 27 0.460 -3.529 10.375 1.00 52.51 H new ATOM 0 HG13 VAL A 27 0.546 -2.336 11.693 1.00 52.51 H new ATOM 0 HG21 VAL A 27 2.839 -0.719 10.467 1.00 41.45 H new ATOM 0 HG22 VAL A 27 2.779 -1.203 12.179 1.00 41.45 H new ATOM 0 HG23 VAL A 27 4.190 -1.632 11.182 1.00 41.45 H new ATOM 433 N TYR A 28 2.582 -5.864 10.361 1.00 12.24 N ATOM 434 CA TYR A 28 1.980 -7.074 9.816 1.00 11.32 C ATOM 435 C TYR A 28 1.800 -8.148 10.883 1.00 3.32 C ATOM 436 O TYR A 28 0.694 -8.658 11.096 1.00 22.12 O ATOM 437 CB TYR A 28 2.829 -7.622 8.646 1.00 74.31 C ATOM 438 CG TYR A 28 2.270 -8.890 8.032 1.00 74.34 C ATOM 439 CD1 TYR A 28 2.729 -10.139 8.426 1.00 40.04 C ATOM 440 CD2 TYR A 28 1.269 -8.835 7.079 1.00 61.42 C ATOM 441 CE1 TYR A 28 2.203 -11.290 7.889 1.00 3.12 C ATOM 442 CE2 TYR A 28 0.740 -9.985 6.535 1.00 3.13 C ATOM 443 CZ TYR A 28 1.211 -11.210 6.946 1.00 11.24 C ATOM 444 OH TYR A 28 0.677 -12.362 6.416 1.00 23.24 O ATOM 0 H TYR A 28 3.421 -5.562 9.866 1.00 12.24 H new ATOM 0 HA TYR A 28 0.991 -6.806 9.445 1.00 11.32 H new ATOM 0 HB2 TYR A 28 2.904 -6.857 7.873 1.00 74.31 H new ATOM 0 HB3 TYR A 28 3.841 -7.816 9.002 1.00 74.31 H new ATOM 0 HD1 TYR A 28 3.512 -10.208 9.167 1.00 40.04 H new ATOM 0 HD2 TYR A 28 0.896 -7.874 6.756 1.00 61.42 H new ATOM 0 HE1 TYR A 28 2.570 -12.254 8.209 1.00 3.12 H new ATOM 0 HE2 TYR A 28 -0.040 -9.925 5.790 1.00 3.13 H new ATOM 0 HH TYR A 28 -0.301 -12.321 6.464 1.00 23.24 H new ATOM 454 N ARG A 29 2.873 -8.455 11.565 1.00 33.25 N ATOM 455 CA ARG A 29 2.877 -9.517 12.550 1.00 12.31 C ATOM 456 C ARG A 29 2.032 -9.178 13.773 1.00 54.52 C ATOM 457 O ARG A 29 1.444 -10.071 14.396 1.00 73.41 O ATOM 458 CB ARG A 29 4.305 -9.910 12.912 1.00 23.03 C ATOM 459 CG ARG A 29 5.096 -10.389 11.696 1.00 54.54 C ATOM 460 CD ARG A 29 6.488 -10.884 12.047 1.00 10.55 C ATOM 461 NE ARG A 29 7.345 -9.864 12.666 1.00 33.14 N ATOM 462 CZ ARG A 29 8.682 -9.956 12.733 1.00 43.24 C ATOM 463 NH1 ARG A 29 9.310 -10.967 12.135 1.00 55.45 N ATOM 464 NH2 ARG A 29 9.387 -9.033 13.374 1.00 33.33 N ATOM 0 H ARG A 29 3.769 -7.980 11.457 1.00 33.25 H new ATOM 0 HA ARG A 29 2.402 -10.389 12.101 1.00 12.31 H new ATOM 0 HB2 ARG A 29 4.813 -9.056 13.361 1.00 23.03 H new ATOM 0 HB3 ARG A 29 4.284 -10.699 13.664 1.00 23.03 H new ATOM 0 HG2 ARG A 29 4.545 -11.191 11.205 1.00 54.54 H new ATOM 0 HG3 ARG A 29 5.178 -9.572 10.979 1.00 54.54 H new ATOM 0 HD2 ARG A 29 6.401 -11.732 12.726 1.00 10.55 H new ATOM 0 HD3 ARG A 29 6.972 -11.250 11.141 1.00 10.55 H new ATOM 0 HE ARG A 29 6.899 -9.039 13.067 1.00 33.14 H new ATOM 0 HH11 ARG A 29 8.775 -11.671 11.626 1.00 55.45 H new ATOM 0 HH12 ARG A 29 10.326 -11.037 12.186 1.00 55.45 H new ATOM 0 HH21 ARG A 29 8.913 -8.247 13.820 1.00 33.33 H new ATOM 0 HH22 ARG A 29 10.403 -9.109 13.421 1.00 33.33 H new ATOM 478 N ALA A 30 1.944 -7.895 14.095 1.00 31.40 N ATOM 479 CA ALA A 30 1.137 -7.447 15.217 1.00 32.10 C ATOM 480 C ALA A 30 -0.344 -7.783 15.000 1.00 4.33 C ATOM 481 O ALA A 30 -1.039 -8.203 15.934 1.00 61.52 O ATOM 482 CB ALA A 30 1.321 -5.958 15.461 1.00 3.31 C ATOM 0 H ALA A 30 2.423 -7.147 13.594 1.00 31.40 H new ATOM 0 HA ALA A 30 1.478 -7.980 16.105 1.00 32.10 H new ATOM 0 HB1 ALA A 30 0.706 -5.649 16.306 1.00 3.31 H new ATOM 0 HB2 ALA A 30 2.369 -5.752 15.680 1.00 3.31 H new ATOM 0 HB3 ALA A 30 1.021 -5.404 14.572 1.00 3.31 H new ATOM 488 N LEU A 31 -0.833 -7.614 13.766 1.00 22.40 N ATOM 489 CA LEU A 31 -2.223 -7.942 13.483 1.00 0.23 C ATOM 490 C LEU A 31 -2.485 -9.424 13.439 1.00 3.23 C ATOM 491 O LEU A 31 -3.610 -9.857 13.737 1.00 12.00 O ATOM 492 CB LEU A 31 -2.842 -7.249 12.266 1.00 43.50 C ATOM 493 CG LEU A 31 -3.023 -5.742 12.349 1.00 23.33 C ATOM 494 CD1 LEU A 31 -1.812 -4.983 11.897 1.00 24.12 C ATOM 495 CD2 LEU A 31 -4.239 -5.306 11.616 1.00 54.11 C ATOM 0 H LEU A 31 -0.299 -7.262 12.971 1.00 22.40 H new ATOM 0 HA LEU A 31 -2.739 -7.522 14.346 1.00 0.23 H new ATOM 0 HB2 LEU A 31 -2.220 -7.468 11.398 1.00 43.50 H new ATOM 0 HB3 LEU A 31 -3.818 -7.698 12.080 1.00 43.50 H new ATOM 0 HG LEU A 31 -3.157 -5.504 13.404 1.00 23.33 H new ATOM 0 HD11 LEU A 31 -2.002 -3.913 11.979 1.00 24.12 H new ATOM 0 HD12 LEU A 31 -0.961 -5.250 12.523 1.00 24.12 H new ATOM 0 HD13 LEU A 31 -1.592 -5.234 10.859 1.00 24.12 H new ATOM 0 HD21 LEU A 31 -4.342 -4.224 11.693 1.00 54.11 H new ATOM 0 HD22 LEU A 31 -4.152 -5.588 10.567 1.00 54.11 H new ATOM 0 HD23 LEU A 31 -5.117 -5.786 12.049 1.00 54.11 H new ATOM 507 N GLU A 32 -1.475 -10.216 13.064 1.00 63.33 N ATOM 508 CA GLU A 32 -1.634 -11.671 13.047 1.00 72.33 C ATOM 509 C GLU A 32 -1.962 -12.158 14.451 1.00 14.24 C ATOM 510 O GLU A 32 -2.774 -13.060 14.637 1.00 51.12 O ATOM 511 CB GLU A 32 -0.381 -12.396 12.529 1.00 0.44 C ATOM 512 CG GLU A 32 0.039 -12.012 11.123 1.00 53.52 C ATOM 513 CD GLU A 32 1.165 -12.880 10.602 1.00 70.54 C ATOM 514 OE1 GLU A 32 0.896 -13.766 9.766 1.00 64.14 O ATOM 515 OE2 GLU A 32 2.323 -12.704 11.029 1.00 4.51 O ATOM 0 H GLU A 32 -0.556 -9.881 12.774 1.00 63.33 H new ATOM 0 HA GLU A 32 -2.448 -11.904 12.360 1.00 72.33 H new ATOM 0 HB2 GLU A 32 0.446 -12.193 13.209 1.00 0.44 H new ATOM 0 HB3 GLU A 32 -0.561 -13.471 12.559 1.00 0.44 H new ATOM 0 HG2 GLU A 32 -0.818 -12.094 10.455 1.00 53.52 H new ATOM 0 HG3 GLU A 32 0.353 -10.968 11.112 1.00 53.52 H new ATOM 522 N GLU A 33 -1.339 -11.528 15.432 1.00 44.23 N ATOM 523 CA GLU A 33 -1.580 -11.830 16.842 1.00 53.25 C ATOM 524 C GLU A 33 -2.987 -11.418 17.292 1.00 41.31 C ATOM 525 O GLU A 33 -3.531 -11.979 18.236 1.00 23.14 O ATOM 526 CB GLU A 33 -0.559 -11.110 17.722 1.00 53.40 C ATOM 527 CG GLU A 33 0.864 -11.593 17.569 1.00 25.34 C ATOM 528 CD GLU A 33 1.008 -13.037 17.955 1.00 61.20 C ATOM 529 OE1 GLU A 33 0.688 -13.381 19.107 1.00 71.55 O ATOM 530 OE2 GLU A 33 1.478 -13.848 17.128 1.00 72.44 O ATOM 0 H GLU A 33 -0.650 -10.791 15.279 1.00 44.23 H new ATOM 0 HA GLU A 33 -1.484 -12.910 16.951 1.00 53.25 H new ATOM 0 HB2 GLU A 33 -0.592 -10.044 17.495 1.00 53.40 H new ATOM 0 HB3 GLU A 33 -0.856 -11.223 18.765 1.00 53.40 H new ATOM 0 HG2 GLU A 33 1.184 -11.460 16.536 1.00 25.34 H new ATOM 0 HG3 GLU A 33 1.523 -10.984 18.188 1.00 25.34 H new ATOM 537 N LYS A 34 -3.556 -10.438 16.632 1.00 24.04 N ATOM 538 CA LYS A 34 -4.849 -9.895 17.041 1.00 24.00 C ATOM 539 C LYS A 34 -6.019 -10.496 16.274 1.00 2.20 C ATOM 540 O LYS A 34 -7.180 -10.273 16.624 1.00 73.22 O ATOM 541 CB LYS A 34 -4.841 -8.377 16.911 1.00 43.23 C ATOM 542 CG LYS A 34 -3.848 -7.683 17.826 1.00 63.32 C ATOM 543 CD LYS A 34 -4.207 -7.860 19.302 1.00 2.52 C ATOM 544 CE LYS A 34 -5.479 -7.124 19.668 1.00 11.22 C ATOM 545 NZ LYS A 34 -5.810 -7.264 21.105 1.00 42.43 N ATOM 0 H LYS A 34 -3.152 -9.994 15.808 1.00 24.04 H new ATOM 0 HA LYS A 34 -4.996 -10.171 18.085 1.00 24.00 H new ATOM 0 HB2 LYS A 34 -4.614 -8.112 15.878 1.00 43.23 H new ATOM 0 HB3 LYS A 34 -5.841 -7.999 17.124 1.00 43.23 H new ATOM 0 HG2 LYS A 34 -2.850 -8.081 17.646 1.00 63.32 H new ATOM 0 HG3 LYS A 34 -3.815 -6.620 17.586 1.00 63.32 H new ATOM 0 HD2 LYS A 34 -4.326 -8.921 19.522 1.00 2.52 H new ATOM 0 HD3 LYS A 34 -3.387 -7.496 19.921 1.00 2.52 H new ATOM 0 HE2 LYS A 34 -5.369 -6.068 19.423 1.00 11.22 H new ATOM 0 HE3 LYS A 34 -6.304 -7.507 19.067 1.00 11.22 H new ATOM 0 HZ1 LYS A 34 -6.687 -6.745 21.311 1.00 42.43 H new ATOM 0 HZ2 LYS A 34 -5.941 -8.270 21.335 1.00 42.43 H new ATOM 0 HZ3 LYS A 34 -5.035 -6.876 21.679 1.00 42.43 H new ATOM 559 N GLY A 35 -5.724 -11.245 15.246 1.00 32.12 N ATOM 560 CA GLY A 35 -6.773 -11.871 14.473 1.00 53.03 C ATOM 561 C GLY A 35 -7.444 -10.917 13.494 1.00 32.44 C ATOM 562 O GLY A 35 -8.658 -10.998 13.255 1.00 30.44 O ATOM 0 H GLY A 35 -4.776 -11.438 14.923 1.00 32.12 H new ATOM 0 HA2 GLY A 35 -6.356 -12.714 13.922 1.00 53.03 H new ATOM 0 HA3 GLY A 35 -7.525 -12.274 15.151 1.00 53.03 H new ATOM 566 N TYR A 36 -6.678 -10.005 12.952 1.00 12.02 N ATOM 567 CA TYR A 36 -7.175 -9.114 11.922 1.00 31.50 C ATOM 568 C TYR A 36 -6.467 -9.441 10.641 1.00 25.32 C ATOM 569 O TYR A 36 -5.615 -10.338 10.618 1.00 23.01 O ATOM 570 CB TYR A 36 -6.922 -7.637 12.255 1.00 33.43 C ATOM 571 CG TYR A 36 -7.624 -7.095 13.473 1.00 22.11 C ATOM 572 CD1 TYR A 36 -6.938 -6.903 14.653 1.00 72.24 C ATOM 573 CD2 TYR A 36 -8.971 -6.759 13.435 1.00 3.34 C ATOM 574 CE1 TYR A 36 -7.562 -6.390 15.768 1.00 21.52 C ATOM 575 CE2 TYR A 36 -9.609 -6.247 14.546 1.00 35.40 C ATOM 576 CZ TYR A 36 -8.894 -6.063 15.712 1.00 51.43 C ATOM 577 OH TYR A 36 -9.516 -5.547 16.824 1.00 33.12 O ATOM 0 H TYR A 36 -5.701 -9.856 13.205 1.00 12.02 H new ATOM 0 HA TYR A 36 -8.253 -9.256 11.841 1.00 31.50 H new ATOM 0 HB2 TYR A 36 -5.849 -7.496 12.388 1.00 33.43 H new ATOM 0 HB3 TYR A 36 -7.219 -7.037 11.395 1.00 33.43 H new ATOM 0 HD1 TYR A 36 -5.890 -7.160 14.704 1.00 72.24 H new ATOM 0 HD2 TYR A 36 -9.528 -6.901 12.521 1.00 3.34 H new ATOM 0 HE1 TYR A 36 -7.006 -6.246 16.683 1.00 21.52 H new ATOM 0 HE2 TYR A 36 -10.658 -5.993 14.504 1.00 35.40 H new ATOM 0 HH TYR A 36 -10.457 -5.368 16.619 1.00 33.12 H new ATOM 587 N ASN A 37 -6.797 -8.740 9.589 1.00 41.12 N ATOM 588 CA ASN A 37 -6.119 -8.915 8.325 1.00 32.35 C ATOM 589 C ASN A 37 -5.152 -7.761 8.155 1.00 42.12 C ATOM 590 O ASN A 37 -5.565 -6.645 7.802 1.00 10.23 O ATOM 591 CB ASN A 37 -7.103 -8.965 7.135 1.00 20.35 C ATOM 592 CG ASN A 37 -8.123 -10.095 7.211 1.00 35.50 C ATOM 593 OD1 ASN A 37 -8.562 -10.509 8.287 1.00 1.13 O ATOM 594 ND2 ASN A 37 -8.502 -10.604 6.084 1.00 61.13 N ATOM 0 H ASN A 37 -7.536 -8.037 9.579 1.00 41.12 H new ATOM 0 HA ASN A 37 -5.594 -9.870 8.334 1.00 32.35 H new ATOM 0 HB2 ASN A 37 -7.634 -8.015 7.078 1.00 20.35 H new ATOM 0 HB3 ASN A 37 -6.533 -9.067 6.212 1.00 20.35 H new ATOM 0 HD21 ASN A 37 -9.180 -11.366 6.071 1.00 61.13 H new ATOM 0 HD22 ASN A 37 -8.123 -10.243 5.208 1.00 61.13 H new ATOM 601 N PRO A 38 -3.855 -7.995 8.453 1.00 65.14 N ATOM 602 CA PRO A 38 -2.831 -6.952 8.438 1.00 15.15 C ATOM 603 C PRO A 38 -2.789 -6.129 7.159 1.00 22.33 C ATOM 604 O PRO A 38 -2.697 -4.912 7.222 1.00 23.35 O ATOM 605 CB PRO A 38 -1.524 -7.707 8.595 1.00 65.23 C ATOM 606 CG PRO A 38 -1.871 -9.039 9.165 1.00 4.12 C ATOM 607 CD PRO A 38 -3.304 -9.307 8.853 1.00 70.23 C ATOM 0 HA PRO A 38 -3.035 -6.226 9.225 1.00 15.15 H new ATOM 0 HB2 PRO A 38 -1.021 -7.815 7.634 1.00 65.23 H new ATOM 0 HB3 PRO A 38 -0.842 -7.169 9.253 1.00 65.23 H new ATOM 0 HG2 PRO A 38 -1.235 -9.815 8.738 1.00 4.12 H new ATOM 0 HG3 PRO A 38 -1.706 -9.049 10.242 1.00 4.12 H new ATOM 0 HD2 PRO A 38 -3.404 -10.039 8.052 1.00 70.23 H new ATOM 0 HD3 PRO A 38 -3.829 -9.709 9.719 1.00 70.23 H new ATOM 615 N ILE A 39 -2.919 -6.774 6.015 1.00 33.31 N ATOM 616 CA ILE A 39 -2.833 -6.063 4.745 1.00 45.14 C ATOM 617 C ILE A 39 -4.009 -5.125 4.569 1.00 40.44 C ATOM 618 O ILE A 39 -3.832 -3.963 4.201 1.00 65.24 O ATOM 619 CB ILE A 39 -2.708 -7.029 3.538 1.00 32.41 C ATOM 620 CG1 ILE A 39 -1.414 -7.846 3.648 1.00 41.12 C ATOM 621 CG2 ILE A 39 -2.755 -6.272 2.209 1.00 34.44 C ATOM 622 CD1 ILE A 39 -0.148 -7.007 3.695 1.00 52.34 C ATOM 0 H ILE A 39 -3.083 -7.778 5.934 1.00 33.31 H new ATOM 0 HA ILE A 39 -1.920 -5.469 4.773 1.00 45.14 H new ATOM 0 HB ILE A 39 -3.559 -7.709 3.560 1.00 32.41 H new ATOM 0 HG12 ILE A 39 -1.462 -8.461 4.546 1.00 41.12 H new ATOM 0 HG13 ILE A 39 -1.354 -8.526 2.798 1.00 41.12 H new ATOM 0 HG21 ILE A 39 -2.665 -6.979 1.384 1.00 34.44 H new ATOM 0 HG22 ILE A 39 -3.702 -5.738 2.128 1.00 34.44 H new ATOM 0 HG23 ILE A 39 -1.932 -5.559 2.167 1.00 34.44 H new ATOM 0 HD11 ILE A 39 0.720 -7.662 3.773 1.00 52.34 H new ATOM 0 HD12 ILE A 39 -0.073 -6.411 2.786 1.00 52.34 H new ATOM 0 HD13 ILE A 39 -0.182 -6.345 4.561 1.00 52.34 H new ATOM 634 N ASN A 40 -5.188 -5.613 4.899 1.00 61.31 N ATOM 635 CA ASN A 40 -6.391 -4.876 4.787 1.00 74.20 C ATOM 636 C ASN A 40 -6.386 -3.658 5.714 1.00 14.13 C ATOM 637 O ASN A 40 -6.896 -2.590 5.366 1.00 1.33 O ATOM 638 CB ASN A 40 -7.549 -5.819 5.085 1.00 34.22 C ATOM 639 CG ASN A 40 -8.835 -5.120 5.318 1.00 1.33 C ATOM 640 OD1 ASN A 40 -9.600 -4.843 4.394 1.00 4.34 O ATOM 641 ND2 ASN A 40 -9.111 -4.877 6.557 1.00 33.24 N ATOM 0 H ASN A 40 -5.319 -6.558 5.259 1.00 61.31 H new ATOM 0 HA ASN A 40 -6.498 -4.481 3.777 1.00 74.20 H new ATOM 0 HB2 ASN A 40 -7.667 -6.512 4.252 1.00 34.22 H new ATOM 0 HB3 ASN A 40 -7.304 -6.416 5.964 1.00 34.22 H new ATOM 0 HD21 ASN A 40 -9.997 -4.436 6.805 1.00 33.24 H new ATOM 0 HD22 ASN A 40 -8.443 -5.126 7.287 1.00 33.24 H new ATOM 648 N GLN A 41 -5.810 -3.808 6.887 1.00 50.23 N ATOM 649 CA GLN A 41 -5.744 -2.705 7.809 1.00 51.23 C ATOM 650 C GLN A 41 -4.694 -1.675 7.377 1.00 54.30 C ATOM 651 O GLN A 41 -4.885 -0.475 7.569 1.00 60.52 O ATOM 652 CB GLN A 41 -5.525 -3.199 9.219 1.00 54.30 C ATOM 653 CG GLN A 41 -6.639 -4.135 9.697 1.00 60.32 C ATOM 654 CD GLN A 41 -8.013 -3.490 9.766 1.00 43.04 C ATOM 655 OE1 GLN A 41 -9.021 -4.154 9.551 1.00 41.34 O ATOM 656 NE2 GLN A 41 -8.073 -2.237 10.117 1.00 13.44 N ATOM 0 H GLN A 41 -5.386 -4.674 7.219 1.00 50.23 H new ATOM 0 HA GLN A 41 -6.704 -2.189 7.795 1.00 51.23 H new ATOM 0 HB2 GLN A 41 -4.570 -3.721 9.272 1.00 54.30 H new ATOM 0 HB3 GLN A 41 -5.460 -2.345 9.893 1.00 54.30 H new ATOM 0 HG2 GLN A 41 -6.687 -4.994 9.028 1.00 60.32 H new ATOM 0 HG3 GLN A 41 -6.379 -4.515 10.685 1.00 60.32 H new ATOM 0 HE21 GLN A 41 -7.214 -1.714 10.288 1.00 13.44 H new ATOM 0 HE22 GLN A 41 -8.979 -1.779 10.221 1.00 13.44 H new ATOM 665 N ILE A 42 -3.599 -2.147 6.773 1.00 14.44 N ATOM 666 CA ILE A 42 -2.558 -1.250 6.270 1.00 71.12 C ATOM 667 C ILE A 42 -3.092 -0.423 5.096 1.00 14.45 C ATOM 668 O ILE A 42 -2.970 0.803 5.095 1.00 43.44 O ATOM 669 CB ILE A 42 -1.248 -2.001 5.862 1.00 44.41 C ATOM 670 CG1 ILE A 42 -0.627 -2.693 7.089 1.00 53.50 C ATOM 671 CG2 ILE A 42 -0.239 -1.032 5.235 1.00 1.13 C ATOM 672 CD1 ILE A 42 0.629 -3.497 6.788 1.00 75.50 C ATOM 0 H ILE A 42 -3.412 -3.138 6.622 1.00 14.44 H new ATOM 0 HA ILE A 42 -2.291 -0.585 7.091 1.00 71.12 H new ATOM 0 HB ILE A 42 -1.504 -2.758 5.121 1.00 44.41 H new ATOM 0 HG12 ILE A 42 -0.389 -1.936 7.836 1.00 53.50 H new ATOM 0 HG13 ILE A 42 -1.370 -3.356 7.532 1.00 53.50 H new ATOM 0 HG21 ILE A 42 0.664 -1.576 4.959 1.00 1.13 H new ATOM 0 HG22 ILE A 42 -0.675 -0.578 4.345 1.00 1.13 H new ATOM 0 HG23 ILE A 42 0.012 -0.253 5.954 1.00 1.13 H new ATOM 0 HD11 ILE A 42 1.000 -3.950 7.707 1.00 75.50 H new ATOM 0 HD12 ILE A 42 0.396 -4.280 6.066 1.00 75.50 H new ATOM 0 HD13 ILE A 42 1.393 -2.838 6.375 1.00 75.50 H new ATOM 684 N VAL A 43 -3.715 -1.087 4.115 1.00 0.22 N ATOM 685 CA VAL A 43 -4.306 -0.371 2.977 1.00 13.02 C ATOM 686 C VAL A 43 -5.356 0.643 3.468 1.00 51.23 C ATOM 687 O VAL A 43 -5.436 1.777 2.961 1.00 30.04 O ATOM 688 CB VAL A 43 -4.879 -1.334 1.856 1.00 75.04 C ATOM 689 CG1 VAL A 43 -5.841 -2.343 2.419 1.00 63.02 C ATOM 690 CG2 VAL A 43 -5.580 -0.543 0.767 1.00 11.42 C ATOM 0 H VAL A 43 -3.822 -2.101 4.084 1.00 0.22 H new ATOM 0 HA VAL A 43 -3.500 0.178 2.491 1.00 13.02 H new ATOM 0 HB VAL A 43 -4.024 -1.863 1.435 1.00 75.04 H new ATOM 0 HG11 VAL A 43 -6.209 -2.982 1.616 1.00 63.02 H new ATOM 0 HG12 VAL A 43 -5.332 -2.954 3.165 1.00 63.02 H new ATOM 0 HG13 VAL A 43 -6.680 -1.826 2.884 1.00 63.02 H new ATOM 0 HG21 VAL A 43 -5.964 -1.227 0.010 1.00 11.42 H new ATOM 0 HG22 VAL A 43 -6.407 0.019 1.201 1.00 11.42 H new ATOM 0 HG23 VAL A 43 -4.873 0.148 0.307 1.00 11.42 H new ATOM 700 N GLY A 44 -6.111 0.249 4.493 1.00 52.15 N ATOM 701 CA GLY A 44 -7.070 1.140 5.098 1.00 60.13 C ATOM 702 C GLY A 44 -6.383 2.342 5.729 1.00 71.12 C ATOM 703 O GLY A 44 -6.841 3.476 5.579 1.00 31.24 O ATOM 0 H GLY A 44 -6.069 -0.680 4.912 1.00 52.15 H new ATOM 0 HA2 GLY A 44 -7.781 1.478 4.345 1.00 60.13 H new ATOM 0 HA3 GLY A 44 -7.640 0.604 5.857 1.00 60.13 H new ATOM 707 N TYR A 45 -5.270 2.096 6.415 1.00 34.11 N ATOM 708 CA TYR A 45 -4.498 3.153 7.048 1.00 22.40 C ATOM 709 C TYR A 45 -3.999 4.186 6.052 1.00 71.41 C ATOM 710 O TYR A 45 -4.234 5.368 6.236 1.00 33.52 O ATOM 711 CB TYR A 45 -3.319 2.603 7.882 1.00 53.15 C ATOM 712 CG TYR A 45 -2.375 3.700 8.376 1.00 43.24 C ATOM 713 CD1 TYR A 45 -1.136 3.892 7.780 1.00 4.21 C ATOM 714 CD2 TYR A 45 -2.738 4.554 9.398 1.00 41.02 C ATOM 715 CE1 TYR A 45 -0.291 4.892 8.189 1.00 70.13 C ATOM 716 CE2 TYR A 45 -1.894 5.560 9.821 1.00 21.21 C ATOM 717 CZ TYR A 45 -0.667 5.723 9.206 1.00 62.44 C ATOM 718 OH TYR A 45 0.182 6.728 9.604 1.00 4.00 O ATOM 0 H TYR A 45 -4.882 1.162 6.545 1.00 34.11 H new ATOM 0 HA TYR A 45 -5.190 3.650 7.728 1.00 22.40 H new ATOM 0 HB2 TYR A 45 -3.711 2.056 8.739 1.00 53.15 H new ATOM 0 HB3 TYR A 45 -2.756 1.891 7.279 1.00 53.15 H new ATOM 0 HD1 TYR A 45 -0.830 3.239 6.976 1.00 4.21 H new ATOM 0 HD2 TYR A 45 -3.699 4.432 9.875 1.00 41.02 H new ATOM 0 HE1 TYR A 45 0.668 5.022 7.709 1.00 70.13 H new ATOM 0 HE2 TYR A 45 -2.190 6.215 10.627 1.00 21.21 H new ATOM 0 HH TYR A 45 0.631 7.107 8.820 1.00 4.00 H new ATOM 728 N LEU A 46 -3.326 3.756 5.002 1.00 52.42 N ATOM 729 CA LEU A 46 -2.766 4.719 4.058 1.00 54.12 C ATOM 730 C LEU A 46 -3.826 5.474 3.275 1.00 71.54 C ATOM 731 O LEU A 46 -3.657 6.657 2.987 1.00 63.13 O ATOM 732 CB LEU A 46 -1.674 4.146 3.121 1.00 21.11 C ATOM 733 CG LEU A 46 -0.338 3.703 3.767 1.00 43.44 C ATOM 734 CD1 LEU A 46 -0.472 2.431 4.554 1.00 10.42 C ATOM 735 CD2 LEU A 46 0.749 3.573 2.728 1.00 64.12 C ATOM 0 H LEU A 46 -3.154 2.776 4.780 1.00 52.42 H new ATOM 0 HA LEU A 46 -2.257 5.439 4.699 1.00 54.12 H new ATOM 0 HB2 LEU A 46 -2.096 3.287 2.598 1.00 21.11 H new ATOM 0 HB3 LEU A 46 -1.449 4.900 2.366 1.00 21.11 H new ATOM 0 HG LEU A 46 -0.057 4.486 4.471 1.00 43.44 H new ATOM 0 HD11 LEU A 46 0.494 2.166 4.985 1.00 10.42 H new ATOM 0 HD12 LEU A 46 -1.200 2.573 5.353 1.00 10.42 H new ATOM 0 HD13 LEU A 46 -0.807 1.630 3.896 1.00 10.42 H new ATOM 0 HD21 LEU A 46 1.676 3.261 3.209 1.00 64.12 H new ATOM 0 HD22 LEU A 46 0.456 2.830 1.986 1.00 64.12 H new ATOM 0 HD23 LEU A 46 0.900 4.535 2.238 1.00 64.12 H new ATOM 747 N LEU A 47 -4.915 4.818 2.941 1.00 2.32 N ATOM 748 CA LEU A 47 -5.959 5.481 2.179 1.00 32.24 C ATOM 749 C LEU A 47 -6.818 6.402 3.045 1.00 53.30 C ATOM 750 O LEU A 47 -7.305 7.418 2.565 1.00 31.45 O ATOM 751 CB LEU A 47 -6.832 4.478 1.416 1.00 71.43 C ATOM 752 CG LEU A 47 -6.123 3.615 0.364 1.00 51.40 C ATOM 753 CD1 LEU A 47 -7.114 2.700 -0.327 1.00 31.43 C ATOM 754 CD2 LEU A 47 -5.398 4.482 -0.663 1.00 53.23 C ATOM 0 H LEU A 47 -5.103 3.844 3.178 1.00 2.32 H new ATOM 0 HA LEU A 47 -5.450 6.108 1.447 1.00 32.24 H new ATOM 0 HB2 LEU A 47 -7.302 3.814 2.141 1.00 71.43 H new ATOM 0 HB3 LEU A 47 -7.633 5.029 0.922 1.00 71.43 H new ATOM 0 HG LEU A 47 -5.380 3.005 0.877 1.00 51.40 H new ATOM 0 HD11 LEU A 47 -6.594 2.095 -1.070 1.00 31.43 H new ATOM 0 HD12 LEU A 47 -7.581 2.047 0.410 1.00 31.43 H new ATOM 0 HD13 LEU A 47 -7.880 3.299 -0.819 1.00 31.43 H new ATOM 0 HD21 LEU A 47 -4.905 3.843 -1.396 1.00 53.23 H new ATOM 0 HD22 LEU A 47 -6.118 5.126 -1.169 1.00 53.23 H new ATOM 0 HD23 LEU A 47 -4.653 5.097 -0.159 1.00 53.23 H new ATOM 766 N SER A 48 -6.993 6.062 4.307 1.00 22.11 N ATOM 767 CA SER A 48 -7.837 6.867 5.171 1.00 62.41 C ATOM 768 C SER A 48 -7.020 7.856 6.028 1.00 5.03 C ATOM 769 O SER A 48 -7.542 8.883 6.452 1.00 25.33 O ATOM 770 CB SER A 48 -8.710 5.960 6.050 1.00 31.10 C ATOM 771 OG SER A 48 -9.628 6.700 6.846 1.00 74.22 O ATOM 0 H SER A 48 -6.570 5.248 4.752 1.00 22.11 H new ATOM 0 HA SER A 48 -8.485 7.469 4.535 1.00 62.41 H new ATOM 0 HB2 SER A 48 -9.261 5.265 5.416 1.00 31.10 H new ATOM 0 HB3 SER A 48 -8.070 5.362 6.699 1.00 31.10 H new ATOM 0 HG SER A 48 -10.163 6.083 7.387 1.00 74.22 H new ATOM 777 N GLY A 49 -5.750 7.550 6.275 1.00 31.11 N ATOM 778 CA GLY A 49 -4.919 8.429 7.080 1.00 44.44 C ATOM 779 C GLY A 49 -5.322 8.416 8.545 1.00 14.12 C ATOM 780 O GLY A 49 -5.292 9.453 9.219 1.00 12.02 O ATOM 0 H GLY A 49 -5.282 6.711 5.933 1.00 31.11 H new ATOM 0 HA2 GLY A 49 -3.876 8.125 6.989 1.00 44.44 H new ATOM 0 HA3 GLY A 49 -4.989 9.446 6.695 1.00 44.44 H new ATOM 784 N ASP A 50 -5.697 7.254 9.040 1.00 24.35 N ATOM 785 CA ASP A 50 -6.132 7.123 10.424 1.00 3.55 C ATOM 786 C ASP A 50 -5.412 5.967 11.109 1.00 43.52 C ATOM 787 O ASP A 50 -5.481 4.828 10.646 1.00 50.53 O ATOM 788 CB ASP A 50 -7.644 6.933 10.512 1.00 50.42 C ATOM 789 CG ASP A 50 -8.114 6.810 11.942 1.00 32.03 C ATOM 790 OD1 ASP A 50 -8.228 5.676 12.446 1.00 13.43 O ATOM 791 OD2 ASP A 50 -8.361 7.852 12.587 1.00 31.05 O ATOM 0 H ASP A 50 -5.711 6.384 8.508 1.00 24.35 H new ATOM 0 HA ASP A 50 -5.876 8.048 10.941 1.00 3.55 H new ATOM 0 HB2 ASP A 50 -8.144 7.777 10.037 1.00 50.42 H new ATOM 0 HB3 ASP A 50 -7.930 6.039 9.958 1.00 50.42 H new ATOM 796 N PRO A 51 -4.715 6.248 12.223 1.00 34.12 N ATOM 797 CA PRO A 51 -3.907 5.255 12.951 1.00 74.24 C ATOM 798 C PRO A 51 -4.708 4.105 13.579 1.00 20.15 C ATOM 799 O PRO A 51 -4.160 3.027 13.808 1.00 10.02 O ATOM 800 CB PRO A 51 -3.196 6.072 14.031 1.00 44.34 C ATOM 801 CG PRO A 51 -4.039 7.286 14.212 1.00 60.01 C ATOM 802 CD PRO A 51 -4.654 7.576 12.872 1.00 62.01 C ATOM 0 HA PRO A 51 -3.235 4.745 12.262 1.00 74.24 H new ATOM 0 HB2 PRO A 51 -3.111 5.509 14.960 1.00 44.34 H new ATOM 0 HB3 PRO A 51 -2.184 6.336 13.724 1.00 44.34 H new ATOM 0 HG2 PRO A 51 -4.809 7.116 14.965 1.00 60.01 H new ATOM 0 HG3 PRO A 51 -3.439 8.129 14.555 1.00 60.01 H new ATOM 0 HD2 PRO A 51 -5.645 8.019 12.973 1.00 62.01 H new ATOM 0 HD3 PRO A 51 -4.049 8.276 12.296 1.00 62.01 H new ATOM 810 N ALA A 52 -5.997 4.328 13.854 1.00 14.20 N ATOM 811 CA ALA A 52 -6.832 3.318 14.539 1.00 54.15 C ATOM 812 C ALA A 52 -7.054 2.067 13.695 1.00 62.21 C ATOM 813 O ALA A 52 -7.542 1.046 14.198 1.00 1.33 O ATOM 814 CB ALA A 52 -8.143 3.891 15.036 1.00 65.53 C ATOM 0 H ALA A 52 -6.488 5.190 13.618 1.00 14.20 H new ATOM 0 HA ALA A 52 -6.263 3.011 15.416 1.00 54.15 H new ATOM 0 HB1 ALA A 52 -8.718 3.108 15.531 1.00 65.53 H new ATOM 0 HB2 ALA A 52 -7.943 4.697 15.743 1.00 65.53 H new ATOM 0 HB3 ALA A 52 -8.713 4.281 14.193 1.00 65.53 H new ATOM 820 N TYR A 53 -6.697 2.141 12.413 1.00 11.42 N ATOM 821 CA TYR A 53 -6.737 0.978 11.546 1.00 21.40 C ATOM 822 C TYR A 53 -5.732 -0.067 11.985 1.00 2.03 C ATOM 823 O TYR A 53 -5.856 -1.238 11.644 1.00 23.00 O ATOM 824 CB TYR A 53 -6.493 1.359 10.093 1.00 15.31 C ATOM 825 CG TYR A 53 -7.728 1.868 9.443 1.00 33.33 C ATOM 826 CD1 TYR A 53 -8.595 0.977 8.860 1.00 4.43 C ATOM 827 CD2 TYR A 53 -8.051 3.209 9.431 1.00 25.12 C ATOM 828 CE1 TYR A 53 -9.751 1.388 8.281 1.00 53.33 C ATOM 829 CE2 TYR A 53 -9.219 3.643 8.841 1.00 1.44 C ATOM 830 CZ TYR A 53 -10.070 2.721 8.264 1.00 73.24 C ATOM 831 OH TYR A 53 -11.255 3.129 7.689 1.00 42.14 O ATOM 0 H TYR A 53 -6.378 2.996 11.958 1.00 11.42 H new ATOM 0 HA TYR A 53 -7.737 0.553 11.625 1.00 21.40 H new ATOM 0 HB2 TYR A 53 -5.715 2.121 10.042 1.00 15.31 H new ATOM 0 HB3 TYR A 53 -6.125 0.491 9.546 1.00 15.31 H new ATOM 0 HD1 TYR A 53 -8.351 -0.075 8.862 1.00 4.43 H new ATOM 0 HD2 TYR A 53 -7.383 3.925 9.888 1.00 25.12 H new ATOM 0 HE1 TYR A 53 -10.419 0.666 7.834 1.00 53.33 H new ATOM 0 HE2 TYR A 53 -9.466 4.694 8.830 1.00 1.44 H new ATOM 0 HH TYR A 53 -11.334 4.103 7.759 1.00 42.14 H new ATOM 841 N ILE A 54 -4.748 0.360 12.745 1.00 73.11 N ATOM 842 CA ILE A 54 -3.765 -0.536 13.282 1.00 0.54 C ATOM 843 C ILE A 54 -4.003 -0.669 14.793 1.00 1.52 C ATOM 844 O ILE A 54 -3.919 0.326 15.530 1.00 63.23 O ATOM 845 CB ILE A 54 -2.319 -0.020 13.026 1.00 31.12 C ATOM 846 CG1 ILE A 54 -2.085 0.224 11.520 1.00 61.10 C ATOM 847 CG2 ILE A 54 -1.276 -0.990 13.588 1.00 55.12 C ATOM 848 CD1 ILE A 54 -2.321 -0.988 10.632 1.00 32.30 C ATOM 0 H ILE A 54 -4.612 1.337 13.004 1.00 73.11 H new ATOM 0 HA ILE A 54 -3.864 -1.502 12.787 1.00 0.54 H new ATOM 0 HB ILE A 54 -2.206 0.930 13.549 1.00 31.12 H new ATOM 0 HG12 ILE A 54 -2.740 1.031 11.191 1.00 61.10 H new ATOM 0 HG13 ILE A 54 -1.060 0.567 11.377 1.00 61.10 H new ATOM 0 HG21 ILE A 54 -0.276 -0.602 13.394 1.00 55.12 H new ATOM 0 HG22 ILE A 54 -1.421 -1.097 14.663 1.00 55.12 H new ATOM 0 HG23 ILE A 54 -1.387 -1.962 13.108 1.00 55.12 H new ATOM 0 HD11 ILE A 54 -2.132 -0.720 9.593 1.00 32.30 H new ATOM 0 HD12 ILE A 54 -1.647 -1.792 10.928 1.00 32.30 H new ATOM 0 HD13 ILE A 54 -3.353 -1.322 10.739 1.00 32.30 H new ATOM 860 N PRO A 55 -4.345 -1.880 15.273 1.00 13.52 N ATOM 861 CA PRO A 55 -4.597 -2.125 16.698 1.00 3.24 C ATOM 862 C PRO A 55 -3.338 -1.917 17.539 1.00 24.44 C ATOM 863 O PRO A 55 -2.234 -2.352 17.157 1.00 74.33 O ATOM 864 CB PRO A 55 -5.008 -3.608 16.740 1.00 14.14 C ATOM 865 CG PRO A 55 -4.457 -4.190 15.491 1.00 33.51 C ATOM 866 CD PRO A 55 -4.519 -3.095 14.470 1.00 43.31 C ATOM 0 HA PRO A 55 -5.347 -1.445 17.103 1.00 3.24 H new ATOM 0 HB2 PRO A 55 -4.603 -4.106 17.621 1.00 14.14 H new ATOM 0 HB3 PRO A 55 -6.092 -3.717 16.783 1.00 14.14 H new ATOM 0 HG2 PRO A 55 -3.432 -4.531 15.637 1.00 33.51 H new ATOM 0 HG3 PRO A 55 -5.039 -5.055 15.173 1.00 33.51 H new ATOM 0 HD2 PRO A 55 -3.735 -3.198 13.720 1.00 43.31 H new ATOM 0 HD3 PRO A 55 -5.470 -3.094 13.938 1.00 43.31 H new ATOM 874 N ARG A 56 -3.483 -1.283 18.687 1.00 52.02 N ATOM 875 CA ARG A 56 -2.339 -1.062 19.533 1.00 63.53 C ATOM 876 C ARG A 56 -2.060 -2.237 20.461 1.00 31.12 C ATOM 877 O ARG A 56 -2.320 -2.200 21.659 1.00 2.50 O ATOM 878 CB ARG A 56 -2.333 0.312 20.252 1.00 43.02 C ATOM 879 CG ARG A 56 -3.545 0.611 21.130 1.00 63.44 C ATOM 880 CD ARG A 56 -3.407 1.971 21.813 1.00 11.41 C ATOM 881 NE ARG A 56 -2.217 2.028 22.675 1.00 13.42 N ATOM 882 CZ ARG A 56 -1.811 3.096 23.383 1.00 22.33 C ATOM 883 NH1 ARG A 56 -2.472 4.257 23.314 1.00 21.15 N ATOM 884 NH2 ARG A 56 -0.729 2.994 24.152 1.00 33.45 N ATOM 0 H ARG A 56 -4.366 -0.920 19.045 1.00 52.02 H new ATOM 0 HA ARG A 56 -1.489 -1.007 18.853 1.00 63.53 H new ATOM 0 HB2 ARG A 56 -1.437 0.373 20.870 1.00 43.02 H new ATOM 0 HB3 ARG A 56 -2.253 1.095 19.498 1.00 43.02 H new ATOM 0 HG2 ARG A 56 -4.450 0.595 20.523 1.00 63.44 H new ATOM 0 HG3 ARG A 56 -3.653 -0.169 21.884 1.00 63.44 H new ATOM 0 HD2 ARG A 56 -3.346 2.754 21.057 1.00 11.41 H new ATOM 0 HD3 ARG A 56 -4.298 2.171 22.408 1.00 11.41 H new ATOM 0 HE ARG A 56 -1.650 1.183 22.741 1.00 13.42 H new ATOM 0 HH11 ARG A 56 -3.296 4.340 22.718 1.00 21.15 H new ATOM 0 HH12 ARG A 56 -2.152 5.059 23.857 1.00 21.15 H new ATOM 0 HH21 ARG A 56 -0.218 2.112 24.199 1.00 33.45 H new ATOM 0 HH22 ARG A 56 -0.411 3.797 24.694 1.00 33.45 H new ATOM 898 N TYR A 57 -1.622 -3.306 19.850 1.00 12.05 N ATOM 899 CA TYR A 57 -1.196 -4.494 20.549 1.00 63.01 C ATOM 900 C TYR A 57 0.250 -4.352 20.945 1.00 43.41 C ATOM 901 O TYR A 57 0.650 -4.677 22.068 1.00 20.43 O ATOM 902 CB TYR A 57 -1.354 -5.712 19.627 1.00 74.34 C ATOM 903 CG TYR A 57 -0.697 -6.978 20.151 1.00 32.15 C ATOM 904 CD1 TYR A 57 -1.281 -7.737 21.147 1.00 12.02 C ATOM 905 CD2 TYR A 57 0.525 -7.398 19.640 1.00 11.22 C ATOM 906 CE1 TYR A 57 -0.667 -8.875 21.625 1.00 74.41 C ATOM 907 CE2 TYR A 57 1.145 -8.530 20.105 1.00 4.25 C ATOM 908 CZ TYR A 57 0.550 -9.268 21.099 1.00 3.10 C ATOM 909 OH TYR A 57 1.180 -10.398 21.579 1.00 42.13 O ATOM 0 H TYR A 57 -1.549 -3.379 18.835 1.00 12.05 H new ATOM 0 HA TYR A 57 -1.807 -4.629 21.442 1.00 63.01 H new ATOM 0 HB2 TYR A 57 -2.416 -5.903 19.475 1.00 74.34 H new ATOM 0 HB3 TYR A 57 -0.930 -5.473 18.652 1.00 74.34 H new ATOM 0 HD1 TYR A 57 -2.233 -7.434 21.557 1.00 12.02 H new ATOM 0 HD2 TYR A 57 0.997 -6.820 18.859 1.00 11.22 H new ATOM 0 HE1 TYR A 57 -1.134 -9.456 22.406 1.00 74.41 H new ATOM 0 HE2 TYR A 57 2.094 -8.839 19.692 1.00 4.25 H new ATOM 0 HH TYR A 57 2.024 -10.531 21.099 1.00 42.13 H new ATOM 919 N GLN A 58 1.007 -3.843 20.028 1.00 23.35 N ATOM 920 CA GLN A 58 2.420 -3.718 20.148 1.00 24.32 C ATOM 921 C GLN A 58 2.766 -2.310 19.686 1.00 73.35 C ATOM 922 O GLN A 58 1.866 -1.569 19.258 1.00 75.41 O ATOM 923 CB GLN A 58 3.061 -4.779 19.207 1.00 44.33 C ATOM 924 CG GLN A 58 4.567 -4.968 19.307 1.00 70.04 C ATOM 925 CD GLN A 58 5.072 -6.023 18.341 1.00 24.12 C ATOM 926 OE1 GLN A 58 5.418 -5.722 17.204 1.00 75.55 O ATOM 927 NE2 GLN A 58 5.117 -7.254 18.784 1.00 51.23 N ATOM 0 H GLN A 58 0.643 -3.490 19.143 1.00 23.35 H new ATOM 0 HA GLN A 58 2.782 -3.877 21.164 1.00 24.32 H new ATOM 0 HB2 GLN A 58 2.585 -5.739 19.405 1.00 44.33 H new ATOM 0 HB3 GLN A 58 2.821 -4.510 18.179 1.00 44.33 H new ATOM 0 HG2 GLN A 58 5.066 -4.021 19.103 1.00 70.04 H new ATOM 0 HG3 GLN A 58 4.830 -5.253 20.326 1.00 70.04 H new ATOM 0 HE21 GLN A 58 4.820 -7.464 19.737 1.00 51.23 H new ATOM 0 HE22 GLN A 58 5.449 -8.003 18.176 1.00 51.23 H new ATOM 936 N ASP A 59 4.031 -1.954 19.746 1.00 24.53 N ATOM 937 CA ASP A 59 4.547 -0.657 19.266 1.00 22.03 C ATOM 938 C ASP A 59 4.220 -0.374 17.802 1.00 0.44 C ATOM 939 O ASP A 59 4.442 0.716 17.341 1.00 24.55 O ATOM 940 CB ASP A 59 6.056 -0.497 19.492 1.00 51.53 C ATOM 941 CG ASP A 59 6.457 -0.304 20.934 1.00 71.13 C ATOM 942 OD1 ASP A 59 6.623 0.860 21.354 1.00 74.20 O ATOM 943 OD2 ASP A 59 6.631 -1.301 21.666 1.00 53.31 O ATOM 0 H ASP A 59 4.756 -2.558 20.134 1.00 24.53 H new ATOM 0 HA ASP A 59 4.022 0.079 19.874 1.00 22.03 H new ATOM 0 HB2 ASP A 59 6.564 -1.379 19.102 1.00 51.53 H new ATOM 0 HB3 ASP A 59 6.409 0.356 18.913 1.00 51.53 H new ATOM 948 N ALA A 60 3.722 -1.373 17.076 1.00 22.21 N ATOM 949 CA ALA A 60 3.434 -1.268 15.637 1.00 42.13 C ATOM 950 C ALA A 60 2.646 0.004 15.273 1.00 12.21 C ATOM 951 O ALA A 60 2.977 0.664 14.288 1.00 35.04 O ATOM 952 CB ALA A 60 2.663 -2.483 15.186 1.00 11.53 C ATOM 0 H ALA A 60 3.503 -2.289 17.469 1.00 22.21 H new ATOM 0 HA ALA A 60 4.394 -1.209 15.124 1.00 42.13 H new ATOM 0 HB1 ALA A 60 2.450 -2.404 14.120 1.00 11.53 H new ATOM 0 HB2 ALA A 60 3.255 -3.379 15.372 1.00 11.53 H new ATOM 0 HB3 ALA A 60 1.726 -2.545 15.739 1.00 11.53 H new ATOM 958 N ARG A 61 1.633 0.358 16.075 1.00 53.20 N ATOM 959 CA ARG A 61 0.859 1.586 15.832 1.00 3.34 C ATOM 960 C ARG A 61 1.774 2.815 15.934 1.00 40.34 C ATOM 961 O ARG A 61 1.619 3.790 15.204 1.00 62.34 O ATOM 962 CB ARG A 61 -0.356 1.700 16.788 1.00 72.33 C ATOM 963 CG ARG A 61 -1.195 2.973 16.586 1.00 40.32 C ATOM 964 CD ARG A 61 -2.422 2.998 17.491 1.00 55.20 C ATOM 965 NE ARG A 61 -3.176 4.266 17.383 1.00 72.12 N ATOM 966 CZ ARG A 61 -4.384 4.500 17.930 1.00 74.25 C ATOM 967 NH1 ARG A 61 -5.045 3.524 18.535 1.00 41.14 N ATOM 968 NH2 ARG A 61 -4.929 5.710 17.855 1.00 0.22 N ATOM 0 H ARG A 61 1.332 -0.179 16.888 1.00 53.20 H new ATOM 0 HA ARG A 61 0.456 1.539 14.820 1.00 3.34 H new ATOM 0 HB2 ARG A 61 -0.997 0.829 16.649 1.00 72.33 H new ATOM 0 HB3 ARG A 61 0.001 1.672 17.817 1.00 72.33 H new ATOM 0 HG2 ARG A 61 -0.578 3.849 16.787 1.00 40.32 H new ATOM 0 HG3 ARG A 61 -1.511 3.037 15.545 1.00 40.32 H new ATOM 0 HD2 ARG A 61 -3.077 2.166 17.234 1.00 55.20 H new ATOM 0 HD3 ARG A 61 -2.111 2.850 18.525 1.00 55.20 H new ATOM 0 HE ARG A 61 -2.747 5.024 16.852 1.00 72.12 H new ATOM 0 HH11 ARG A 61 -4.639 2.590 18.588 1.00 41.14 H new ATOM 0 HH12 ARG A 61 -5.960 3.707 18.948 1.00 41.14 H new ATOM 0 HH21 ARG A 61 -4.432 6.465 17.382 1.00 0.22 H new ATOM 0 HH22 ARG A 61 -5.844 5.884 18.270 1.00 0.22 H new ATOM 982 N ASN A 62 2.749 2.734 16.818 1.00 22.04 N ATOM 983 CA ASN A 62 3.716 3.799 16.996 1.00 71.12 C ATOM 984 C ASN A 62 4.662 3.837 15.804 1.00 2.11 C ATOM 985 O ASN A 62 4.886 4.896 15.238 1.00 64.12 O ATOM 986 CB ASN A 62 4.515 3.628 18.307 1.00 54.31 C ATOM 987 CG ASN A 62 5.519 4.756 18.534 1.00 12.32 C ATOM 988 OD1 ASN A 62 5.183 5.801 19.089 1.00 50.44 O ATOM 989 ND2 ASN A 62 6.757 4.539 18.156 1.00 14.52 N ATOM 0 H ASN A 62 2.893 1.931 17.431 1.00 22.04 H new ATOM 0 HA ASN A 62 3.174 4.742 17.062 1.00 71.12 H new ATOM 0 HB2 ASN A 62 3.822 3.588 19.148 1.00 54.31 H new ATOM 0 HB3 ASN A 62 5.044 2.675 18.284 1.00 54.31 H new ATOM 0 HD21 ASN A 62 7.472 5.248 18.320 1.00 14.52 H new ATOM 0 HD22 ASN A 62 7.004 3.662 17.698 1.00 14.52 H new ATOM 996 N LEU A 63 5.197 2.655 15.409 1.00 12.45 N ATOM 997 CA LEU A 63 6.117 2.558 14.251 1.00 44.33 C ATOM 998 C LEU A 63 5.495 3.082 12.975 1.00 31.13 C ATOM 999 O LEU A 63 6.127 3.847 12.234 1.00 54.11 O ATOM 1000 CB LEU A 63 6.653 1.119 13.979 1.00 75.02 C ATOM 1001 CG LEU A 63 7.732 0.529 14.908 1.00 21.42 C ATOM 1002 CD1 LEU A 63 8.914 1.463 15.069 1.00 34.23 C ATOM 1003 CD2 LEU A 63 7.186 0.082 16.229 1.00 51.11 C ATOM 0 H LEU A 63 5.009 1.765 15.871 1.00 12.45 H new ATOM 0 HA LEU A 63 6.961 3.184 14.541 1.00 44.33 H new ATOM 0 HB2 LEU A 63 5.799 0.442 13.997 1.00 75.02 H new ATOM 0 HB3 LEU A 63 7.050 1.104 12.964 1.00 75.02 H new ATOM 0 HG LEU A 63 8.097 -0.371 14.413 1.00 21.42 H new ATOM 0 HD11 LEU A 63 9.650 1.008 15.731 1.00 34.23 H new ATOM 0 HD12 LEU A 63 9.367 1.647 14.095 1.00 34.23 H new ATOM 0 HD13 LEU A 63 8.576 2.407 15.496 1.00 34.23 H new ATOM 0 HD21 LEU A 63 7.994 -0.324 16.838 1.00 51.11 H new ATOM 0 HD22 LEU A 63 6.736 0.931 16.743 1.00 51.11 H new ATOM 0 HD23 LEU A 63 6.431 -0.687 16.069 1.00 51.11 H new ATOM 1015 N ILE A 64 4.260 2.696 12.717 1.00 63.32 N ATOM 1016 CA ILE A 64 3.610 3.090 11.488 1.00 63.32 C ATOM 1017 C ILE A 64 3.308 4.604 11.506 1.00 2.02 C ATOM 1018 O ILE A 64 3.333 5.259 10.477 1.00 73.50 O ATOM 1019 CB ILE A 64 2.338 2.230 11.198 1.00 31.40 C ATOM 1020 CG1 ILE A 64 1.848 2.444 9.763 1.00 11.24 C ATOM 1021 CG2 ILE A 64 1.222 2.539 12.194 1.00 5.22 C ATOM 1022 CD1 ILE A 64 0.707 1.527 9.365 1.00 54.20 C ATOM 0 H ILE A 64 3.694 2.116 13.336 1.00 63.32 H new ATOM 0 HA ILE A 64 4.294 2.897 10.661 1.00 63.32 H new ATOM 0 HB ILE A 64 2.616 1.182 11.315 1.00 31.40 H new ATOM 0 HG12 ILE A 64 1.527 3.479 9.649 1.00 11.24 H new ATOM 0 HG13 ILE A 64 2.681 2.291 9.077 1.00 11.24 H new ATOM 0 HG21 ILE A 64 0.351 1.925 11.966 1.00 5.22 H new ATOM 0 HG22 ILE A 64 1.566 2.320 13.205 1.00 5.22 H new ATOM 0 HG23 ILE A 64 0.952 3.593 12.123 1.00 5.22 H new ATOM 0 HD11 ILE A 64 0.414 1.737 8.336 1.00 54.20 H new ATOM 0 HD12 ILE A 64 1.029 0.489 9.446 1.00 54.20 H new ATOM 0 HD13 ILE A 64 -0.143 1.696 10.026 1.00 54.20 H new ATOM 1034 N ARG A 65 3.097 5.150 12.710 1.00 32.35 N ATOM 1035 CA ARG A 65 2.868 6.578 12.882 1.00 41.44 C ATOM 1036 C ARG A 65 4.165 7.362 13.024 1.00 54.45 C ATOM 1037 O ARG A 65 4.152 8.557 13.329 1.00 74.05 O ATOM 1038 CB ARG A 65 1.921 6.869 14.043 1.00 43.02 C ATOM 1039 CG ARG A 65 0.474 6.521 13.742 1.00 23.22 C ATOM 1040 CD ARG A 65 -0.037 7.334 12.548 1.00 23.42 C ATOM 1041 NE ARG A 65 0.016 8.784 12.786 1.00 14.31 N ATOM 1042 CZ ARG A 65 0.618 9.683 11.973 1.00 3.51 C ATOM 1043 NH1 ARG A 65 1.265 9.291 10.884 1.00 54.35 N ATOM 1044 NH2 ARG A 65 0.555 10.974 12.255 1.00 73.45 N ATOM 0 H ARG A 65 3.081 4.616 13.579 1.00 32.35 H new ATOM 0 HA ARG A 65 2.384 6.920 11.967 1.00 41.44 H new ATOM 0 HB2 ARG A 65 2.248 6.307 14.918 1.00 43.02 H new ATOM 0 HB3 ARG A 65 1.987 7.926 14.300 1.00 43.02 H new ATOM 0 HG2 ARG A 65 0.387 5.456 13.528 1.00 23.22 H new ATOM 0 HG3 ARG A 65 -0.144 6.722 14.617 1.00 23.22 H new ATOM 0 HD2 ARG A 65 0.558 7.092 11.667 1.00 23.42 H new ATOM 0 HD3 ARG A 65 -1.064 7.043 12.328 1.00 23.42 H new ATOM 0 HE ARG A 65 -0.436 9.140 13.629 1.00 14.31 H new ATOM 0 HH11 ARG A 65 1.314 8.300 10.649 1.00 54.35 H new ATOM 0 HH12 ARG A 65 1.714 9.981 10.281 1.00 54.35 H new ATOM 0 HH21 ARG A 65 0.053 11.291 13.084 1.00 73.45 H new ATOM 0 HH22 ARG A 65 1.008 11.652 11.643 1.00 73.45 H new ATOM 1058 N ARG A 66 5.298 6.691 12.805 1.00 22.35 N ATOM 1059 CA ARG A 66 6.589 7.382 12.774 1.00 23.11 C ATOM 1060 C ARG A 66 6.828 7.873 11.370 1.00 23.45 C ATOM 1061 O ARG A 66 7.821 8.542 11.063 1.00 14.53 O ATOM 1062 CB ARG A 66 7.753 6.484 13.209 1.00 72.11 C ATOM 1063 CG ARG A 66 7.652 5.967 14.624 1.00 54.25 C ATOM 1064 CD ARG A 66 8.913 5.237 15.037 1.00 33.10 C ATOM 1065 NE ARG A 66 10.047 6.158 15.179 1.00 1.31 N ATOM 1066 CZ ARG A 66 11.335 5.808 15.229 1.00 63.34 C ATOM 1067 NH1 ARG A 66 11.717 4.559 14.977 1.00 71.52 N ATOM 1068 NH2 ARG A 66 12.238 6.737 15.502 1.00 43.52 N ATOM 0 H ARG A 66 5.349 5.684 12.649 1.00 22.35 H new ATOM 0 HA ARG A 66 6.548 8.209 13.483 1.00 23.11 H new ATOM 0 HB2 ARG A 66 7.813 5.634 12.529 1.00 72.11 H new ATOM 0 HB3 ARG A 66 8.684 7.042 13.105 1.00 72.11 H new ATOM 0 HG2 ARG A 66 7.472 6.799 15.305 1.00 54.25 H new ATOM 0 HG3 ARG A 66 6.797 5.296 14.708 1.00 54.25 H new ATOM 0 HD2 ARG A 66 8.742 4.720 15.981 1.00 33.10 H new ATOM 0 HD3 ARG A 66 9.153 4.475 14.295 1.00 33.10 H new ATOM 0 HE ARG A 66 9.833 7.153 15.245 1.00 1.31 H new ATOM 0 HH11 ARG A 66 11.022 3.851 14.741 1.00 71.52 H new ATOM 0 HH12 ARG A 66 12.705 4.309 15.020 1.00 71.52 H new ATOM 0 HH21 ARG A 66 11.945 7.700 15.670 1.00 43.52 H new ATOM 0 HH22 ARG A 66 13.227 6.490 15.545 1.00 43.52 H new ATOM 1082 N HIS A 67 5.909 7.509 10.524 1.00 42.22 N ATOM 1083 CA HIS A 67 5.883 7.877 9.153 1.00 64.55 C ATOM 1084 C HIS A 67 4.469 8.318 8.890 1.00 2.23 C ATOM 1085 O HIS A 67 3.593 8.062 9.716 1.00 64.12 O ATOM 1086 CB HIS A 67 6.222 6.674 8.253 1.00 12.22 C ATOM 1087 CG HIS A 67 7.584 6.057 8.469 1.00 23.51 C ATOM 1088 ND1 HIS A 67 8.698 6.405 7.740 1.00 64.12 N ATOM 1089 CD2 HIS A 67 7.992 5.085 9.326 1.00 1.23 C ATOM 1090 CE1 HIS A 67 9.726 5.678 8.134 1.00 64.41 C ATOM 1091 NE2 HIS A 67 9.322 4.873 9.092 1.00 34.54 N ATOM 0 H HIS A 67 5.122 6.918 10.793 1.00 42.22 H new ATOM 0 HA HIS A 67 6.614 8.656 8.938 1.00 64.55 H new ATOM 0 HB2 HIS A 67 5.466 5.904 8.407 1.00 12.22 H new ATOM 0 HB3 HIS A 67 6.147 6.990 7.212 1.00 12.22 H new ATOM 0 HD2 HIS A 67 7.380 4.575 10.056 1.00 1.23 H new ATOM 0 HE1 HIS A 67 10.729 5.734 7.737 1.00 64.41 H new ATOM 0 HE2 HIS A 67 9.908 4.198 9.583 1.00 34.54 H new ATOM 1100 N GLU A 68 4.224 8.965 7.796 1.00 1.45 N ATOM 1101 CA GLU A 68 2.880 9.408 7.521 1.00 1.43 C ATOM 1102 C GLU A 68 2.100 8.363 6.754 1.00 35.32 C ATOM 1103 O GLU A 68 1.306 7.636 7.341 1.00 14.33 O ATOM 1104 CB GLU A 68 2.875 10.755 6.816 1.00 45.41 C ATOM 1105 CG GLU A 68 3.467 11.864 7.659 1.00 54.02 C ATOM 1106 CD GLU A 68 2.642 12.166 8.886 1.00 72.54 C ATOM 1107 OE1 GLU A 68 2.675 11.391 9.857 1.00 23.34 O ATOM 1108 OE2 GLU A 68 1.962 13.209 8.896 1.00 5.45 O ATOM 0 H GLU A 68 4.917 9.199 7.085 1.00 1.45 H new ATOM 0 HA GLU A 68 2.374 9.545 8.476 1.00 1.43 H new ATOM 0 HB2 GLU A 68 3.436 10.674 5.885 1.00 45.41 H new ATOM 0 HB3 GLU A 68 1.851 11.016 6.549 1.00 45.41 H new ATOM 0 HG2 GLU A 68 4.475 11.584 7.964 1.00 54.02 H new ATOM 0 HG3 GLU A 68 3.556 12.767 7.054 1.00 54.02 H new ATOM 1115 N ARG A 69 2.361 8.266 5.457 1.00 1.34 N ATOM 1116 CA ARG A 69 1.671 7.321 4.570 1.00 33.21 C ATOM 1117 C ARG A 69 2.125 7.518 3.138 1.00 52.24 C ATOM 1118 O ARG A 69 2.230 6.569 2.372 1.00 53.13 O ATOM 1119 CB ARG A 69 0.110 7.446 4.665 1.00 51.11 C ATOM 1120 CG ARG A 69 -0.465 8.836 4.374 1.00 4.12 C ATOM 1121 CD ARG A 69 -1.985 8.814 4.460 1.00 32.11 C ATOM 1122 NE ARG A 69 -2.592 10.133 4.239 1.00 71.15 N ATOM 1123 CZ ARG A 69 -3.731 10.352 3.548 1.00 14.43 C ATOM 1124 NH1 ARG A 69 -4.374 9.335 2.965 1.00 22.12 N ATOM 1125 NH2 ARG A 69 -4.217 11.587 3.444 1.00 62.40 N ATOM 0 H ARG A 69 3.059 8.840 4.983 1.00 1.34 H new ATOM 0 HA ARG A 69 1.936 6.317 4.900 1.00 33.21 H new ATOM 0 HB2 ARG A 69 -0.336 6.736 3.969 1.00 51.11 H new ATOM 0 HB3 ARG A 69 -0.200 7.148 5.667 1.00 51.11 H new ATOM 0 HG2 ARG A 69 -0.065 9.558 5.086 1.00 4.12 H new ATOM 0 HG3 ARG A 69 -0.156 9.163 3.381 1.00 4.12 H new ATOM 0 HD2 ARG A 69 -2.375 8.113 3.722 1.00 32.11 H new ATOM 0 HD3 ARG A 69 -2.282 8.443 5.441 1.00 32.11 H new ATOM 0 HE ARG A 69 -2.118 10.944 4.637 1.00 71.15 H new ATOM 0 HH11 ARG A 69 -4.004 8.387 3.041 1.00 22.12 H new ATOM 0 HH12 ARG A 69 -5.234 9.507 2.444 1.00 22.12 H new ATOM 0 HH21 ARG A 69 -3.729 12.366 3.886 1.00 62.40 H new ATOM 0 HH22 ARG A 69 -5.077 11.754 2.922 1.00 62.40 H new ATOM 1139 N ASP A 70 2.435 8.755 2.810 1.00 34.34 N ATOM 1140 CA ASP A 70 2.817 9.156 1.458 1.00 1.10 C ATOM 1141 C ASP A 70 4.092 8.451 0.945 1.00 62.10 C ATOM 1142 O ASP A 70 4.034 7.744 -0.059 1.00 73.24 O ATOM 1143 CB ASP A 70 2.928 10.690 1.366 1.00 63.24 C ATOM 1144 CG ASP A 70 3.943 11.270 2.326 1.00 22.43 C ATOM 1145 OD1 ASP A 70 3.652 11.335 3.553 1.00 24.14 O ATOM 1146 OD2 ASP A 70 5.037 11.645 1.890 1.00 22.44 O ATOM 0 H ASP A 70 2.431 9.525 3.478 1.00 34.34 H new ATOM 0 HA ASP A 70 2.021 8.825 0.791 1.00 1.10 H new ATOM 0 HB2 ASP A 70 3.199 10.968 0.348 1.00 63.24 H new ATOM 0 HB3 ASP A 70 1.952 11.132 1.568 1.00 63.24 H new ATOM 1151 N GLU A 71 5.217 8.607 1.658 1.00 14.25 N ATOM 1152 CA GLU A 71 6.504 8.014 1.238 1.00 15.42 C ATOM 1153 C GLU A 71 6.402 6.487 1.250 1.00 43.21 C ATOM 1154 O GLU A 71 6.989 5.796 0.413 1.00 61.43 O ATOM 1155 CB GLU A 71 7.621 8.455 2.190 1.00 52.24 C ATOM 1156 CG GLU A 71 9.044 8.038 1.779 1.00 71.43 C ATOM 1157 CD GLU A 71 9.561 8.780 0.558 1.00 53.41 C ATOM 1158 OE1 GLU A 71 9.823 10.007 0.682 1.00 12.32 O ATOM 1159 OE2 GLU A 71 9.783 8.160 -0.512 1.00 5.32 O ATOM 0 H GLU A 71 5.266 9.137 2.528 1.00 14.25 H new ATOM 0 HA GLU A 71 6.734 8.355 0.229 1.00 15.42 H new ATOM 0 HB2 GLU A 71 7.591 9.541 2.279 1.00 52.24 H new ATOM 0 HB3 GLU A 71 7.413 8.048 3.180 1.00 52.24 H new ATOM 0 HG2 GLU A 71 9.721 8.212 2.615 1.00 71.43 H new ATOM 0 HG3 GLU A 71 9.057 6.967 1.577 1.00 71.43 H new ATOM 1166 N ILE A 72 5.637 5.971 2.212 1.00 51.33 N ATOM 1167 CA ILE A 72 5.431 4.540 2.337 1.00 34.23 C ATOM 1168 C ILE A 72 4.727 4.020 1.101 1.00 74.43 C ATOM 1169 O ILE A 72 5.160 3.048 0.503 1.00 42.03 O ATOM 1170 CB ILE A 72 4.581 4.178 3.588 1.00 73.02 C ATOM 1171 CG1 ILE A 72 5.255 4.675 4.870 1.00 31.13 C ATOM 1172 CG2 ILE A 72 4.345 2.663 3.663 1.00 5.43 C ATOM 1173 CD1 ILE A 72 4.464 4.367 6.129 1.00 42.13 C ATOM 0 H ILE A 72 5.152 6.529 2.914 1.00 51.33 H new ATOM 0 HA ILE A 72 6.412 4.077 2.447 1.00 34.23 H new ATOM 0 HB ILE A 72 3.616 4.676 3.493 1.00 73.02 H new ATOM 0 HG12 ILE A 72 6.243 4.221 4.951 1.00 31.13 H new ATOM 0 HG13 ILE A 72 5.404 5.752 4.799 1.00 31.13 H new ATOM 0 HG21 ILE A 72 3.748 2.431 4.545 1.00 5.43 H new ATOM 0 HG22 ILE A 72 3.815 2.333 2.770 1.00 5.43 H new ATOM 0 HG23 ILE A 72 5.304 2.148 3.728 1.00 5.43 H new ATOM 0 HD11 ILE A 72 5.001 4.748 6.998 1.00 42.13 H new ATOM 0 HD12 ILE A 72 3.485 4.843 6.070 1.00 42.13 H new ATOM 0 HD13 ILE A 72 4.337 3.289 6.224 1.00 42.13 H new ATOM 1185 N MET A 73 3.656 4.706 0.707 1.00 31.11 N ATOM 1186 CA MET A 73 2.854 4.296 -0.433 1.00 23.31 C ATOM 1187 C MET A 73 3.714 4.369 -1.693 1.00 50.11 C ATOM 1188 O MET A 73 3.647 3.475 -2.561 1.00 63.22 O ATOM 1189 CB MET A 73 1.603 5.192 -0.553 1.00 73.34 C ATOM 1190 CG MET A 73 0.478 4.633 -1.436 1.00 61.44 C ATOM 1191 SD MET A 73 0.909 4.417 -3.166 1.00 24.41 S ATOM 1192 CE MET A 73 -0.589 3.706 -3.776 1.00 53.22 C ATOM 0 H MET A 73 3.326 5.554 1.168 1.00 31.11 H new ATOM 0 HA MET A 73 2.511 3.270 -0.300 1.00 23.31 H new ATOM 0 HB2 MET A 73 1.205 5.368 0.446 1.00 73.34 H new ATOM 0 HB3 MET A 73 1.907 6.161 -0.950 1.00 73.34 H new ATOM 0 HG2 MET A 73 0.164 3.671 -1.032 1.00 61.44 H new ATOM 0 HG3 MET A 73 -0.381 5.301 -1.371 1.00 61.44 H new ATOM 0 HE1 MET A 73 -0.789 4.084 -4.778 1.00 53.22 H new ATOM 0 HE2 MET A 73 -0.489 2.621 -3.811 1.00 53.22 H new ATOM 0 HE3 MET A 73 -1.414 3.974 -3.116 1.00 53.22 H new ATOM 1202 N GLU A 74 4.556 5.409 -1.773 1.00 53.33 N ATOM 1203 CA GLU A 74 5.474 5.547 -2.887 1.00 73.12 C ATOM 1204 C GLU A 74 6.345 4.340 -2.980 1.00 12.21 C ATOM 1205 O GLU A 74 6.405 3.717 -4.019 1.00 11.15 O ATOM 1206 CB GLU A 74 6.379 6.753 -2.743 1.00 32.01 C ATOM 1207 CG GLU A 74 5.685 8.091 -2.784 1.00 71.32 C ATOM 1208 CD GLU A 74 6.660 9.220 -2.612 1.00 12.24 C ATOM 1209 OE1 GLU A 74 7.393 9.526 -3.577 1.00 43.44 O ATOM 1210 OE2 GLU A 74 6.706 9.814 -1.525 1.00 2.11 O ATOM 0 H GLU A 74 4.612 6.156 -1.080 1.00 53.33 H new ATOM 0 HA GLU A 74 4.862 5.668 -3.781 1.00 73.12 H new ATOM 0 HB2 GLU A 74 6.918 6.671 -1.799 1.00 32.01 H new ATOM 0 HB3 GLU A 74 7.124 6.724 -3.539 1.00 32.01 H new ATOM 0 HG2 GLU A 74 5.162 8.202 -3.734 1.00 71.32 H new ATOM 0 HG3 GLU A 74 4.932 8.136 -1.998 1.00 71.32 H new ATOM 1217 N GLU A 75 6.980 3.975 -1.868 1.00 1.24 N ATOM 1218 CA GLU A 75 7.878 2.843 -1.864 1.00 40.44 C ATOM 1219 C GLU A 75 7.128 1.553 -2.146 1.00 44.22 C ATOM 1220 O GLU A 75 7.645 0.681 -2.817 1.00 1.32 O ATOM 1221 CB GLU A 75 8.690 2.737 -0.574 1.00 23.45 C ATOM 1222 CG GLU A 75 9.742 1.630 -0.640 1.00 1.51 C ATOM 1223 CD GLU A 75 10.610 1.529 0.579 1.00 41.34 C ATOM 1224 OE1 GLU A 75 10.324 0.699 1.457 1.00 42.52 O ATOM 1225 OE2 GLU A 75 11.627 2.244 0.653 1.00 45.51 O ATOM 0 H GLU A 75 6.885 4.448 -0.969 1.00 1.24 H new ATOM 0 HA GLU A 75 8.594 3.009 -2.669 1.00 40.44 H new ATOM 0 HB2 GLU A 75 9.181 3.690 -0.377 1.00 23.45 H new ATOM 0 HB3 GLU A 75 8.017 2.546 0.262 1.00 23.45 H new ATOM 0 HG2 GLU A 75 9.239 0.675 -0.793 1.00 1.51 H new ATOM 0 HG3 GLU A 75 10.376 1.799 -1.510 1.00 1.51 H new ATOM 1232 N LEU A 76 5.903 1.448 -1.657 1.00 34.33 N ATOM 1233 CA LEU A 76 5.080 0.274 -1.929 1.00 62.41 C ATOM 1234 C LEU A 76 4.899 0.081 -3.422 1.00 51.22 C ATOM 1235 O LEU A 76 4.990 -1.020 -3.913 1.00 23.10 O ATOM 1236 CB LEU A 76 3.715 0.359 -1.237 1.00 74.52 C ATOM 1237 CG LEU A 76 3.730 0.390 0.290 1.00 3.21 C ATOM 1238 CD1 LEU A 76 2.322 0.482 0.839 1.00 75.22 C ATOM 1239 CD2 LEU A 76 4.438 -0.831 0.845 1.00 54.15 C ATOM 0 H LEU A 76 5.456 2.155 -1.073 1.00 34.33 H new ATOM 0 HA LEU A 76 5.605 -0.589 -1.520 1.00 62.41 H new ATOM 0 HB2 LEU A 76 3.207 1.255 -1.592 1.00 74.52 H new ATOM 0 HB3 LEU A 76 3.116 -0.494 -1.556 1.00 74.52 H new ATOM 0 HG LEU A 76 4.279 1.277 0.605 1.00 3.21 H new ATOM 0 HD11 LEU A 76 2.357 0.503 1.928 1.00 75.22 H new ATOM 0 HD12 LEU A 76 1.848 1.393 0.474 1.00 75.22 H new ATOM 0 HD13 LEU A 76 1.746 -0.383 0.511 1.00 75.22 H new ATOM 0 HD21 LEU A 76 4.437 -0.788 1.934 1.00 54.15 H new ATOM 0 HD22 LEU A 76 3.920 -1.732 0.517 1.00 54.15 H new ATOM 0 HD23 LEU A 76 5.466 -0.851 0.484 1.00 54.15 H new ATOM 1251 N THR A 77 4.679 1.165 -4.137 1.00 31.45 N ATOM 1252 CA THR A 77 4.514 1.100 -5.573 1.00 0.14 C ATOM 1253 C THR A 77 5.891 0.952 -6.282 1.00 54.45 C ATOM 1254 O THR A 77 6.098 0.067 -7.123 1.00 12.34 O ATOM 1255 CB THR A 77 3.804 2.377 -6.073 1.00 55.30 C ATOM 1256 OG1 THR A 77 2.562 2.545 -5.364 1.00 1.23 O ATOM 1257 CG2 THR A 77 3.520 2.291 -7.565 1.00 12.55 C ATOM 0 H THR A 77 4.610 2.104 -3.745 1.00 31.45 H new ATOM 0 HA THR A 77 3.908 0.227 -5.813 1.00 0.14 H new ATOM 0 HB THR A 77 4.459 3.229 -5.890 1.00 55.30 H new ATOM 0 HG1 THR A 77 2.732 2.989 -4.507 1.00 1.23 H new ATOM 0 HG21 THR A 77 3.020 3.202 -7.893 1.00 12.55 H new ATOM 0 HG22 THR A 77 4.458 2.176 -8.108 1.00 12.55 H new ATOM 0 HG23 THR A 77 2.878 1.433 -7.764 1.00 12.55 H new ATOM 1265 N LYS A 78 6.808 1.799 -5.890 1.00 74.31 N ATOM 1266 CA LYS A 78 8.120 1.934 -6.443 1.00 63.21 C ATOM 1267 C LYS A 78 8.981 0.662 -6.257 1.00 23.31 C ATOM 1268 O LYS A 78 9.664 0.231 -7.180 1.00 63.32 O ATOM 1269 CB LYS A 78 8.674 3.182 -5.769 1.00 21.20 C ATOM 1270 CG LYS A 78 10.075 3.578 -5.980 1.00 32.43 C ATOM 1271 CD LYS A 78 10.273 4.934 -5.321 1.00 31.23 C ATOM 1272 CE LYS A 78 11.700 5.366 -5.332 1.00 52.45 C ATOM 1273 NZ LYS A 78 11.886 6.675 -4.660 1.00 11.14 N ATOM 0 H LYS A 78 6.641 2.453 -5.125 1.00 74.31 H new ATOM 0 HA LYS A 78 8.117 2.045 -7.527 1.00 63.21 H new ATOM 0 HB2 LYS A 78 8.051 4.021 -6.080 1.00 21.20 H new ATOM 0 HB3 LYS A 78 8.531 3.060 -4.695 1.00 21.20 H new ATOM 0 HG2 LYS A 78 10.751 2.840 -5.548 1.00 32.43 H new ATOM 0 HG3 LYS A 78 10.301 3.633 -7.045 1.00 32.43 H new ATOM 0 HD2 LYS A 78 9.667 5.678 -5.837 1.00 31.23 H new ATOM 0 HD3 LYS A 78 9.917 4.891 -4.292 1.00 31.23 H new ATOM 0 HE2 LYS A 78 12.311 4.613 -4.835 1.00 52.45 H new ATOM 0 HE3 LYS A 78 12.051 5.433 -6.362 1.00 52.45 H new ATOM 0 HZ1 LYS A 78 12.891 6.940 -4.689 1.00 11.14 H new ATOM 0 HZ2 LYS A 78 11.323 7.400 -5.149 1.00 11.14 H new ATOM 0 HZ3 LYS A 78 11.575 6.604 -3.670 1.00 11.14 H new ATOM 1287 N TYR A 79 8.928 0.064 -5.089 1.00 44.21 N ATOM 1288 CA TYR A 79 9.673 -1.160 -4.819 1.00 13.05 C ATOM 1289 C TYR A 79 8.988 -2.330 -5.534 1.00 61.22 C ATOM 1290 O TYR A 79 9.648 -3.204 -6.093 1.00 3.42 O ATOM 1291 CB TYR A 79 9.735 -1.405 -3.308 1.00 52.42 C ATOM 1292 CG TYR A 79 10.670 -2.505 -2.841 1.00 0.33 C ATOM 1293 CD1 TYR A 79 11.935 -2.191 -2.373 1.00 43.03 C ATOM 1294 CD2 TYR A 79 10.276 -3.839 -2.825 1.00 13.02 C ATOM 1295 CE1 TYR A 79 12.789 -3.166 -1.907 1.00 43.32 C ATOM 1296 CE2 TYR A 79 11.124 -4.826 -2.353 1.00 12.35 C ATOM 1297 CZ TYR A 79 12.384 -4.479 -1.895 1.00 72.33 C ATOM 1298 OH TYR A 79 13.240 -5.452 -1.414 1.00 41.33 O ATOM 0 H TYR A 79 8.375 0.402 -4.301 1.00 44.21 H new ATOM 0 HA TYR A 79 10.693 -1.067 -5.191 1.00 13.05 H new ATOM 0 HB2 TYR A 79 10.032 -0.475 -2.823 1.00 52.42 H new ATOM 0 HB3 TYR A 79 8.730 -1.640 -2.958 1.00 52.42 H new ATOM 0 HD1 TYR A 79 12.258 -1.161 -2.373 1.00 43.03 H new ATOM 0 HD2 TYR A 79 9.294 -4.108 -3.186 1.00 13.02 H new ATOM 0 HE1 TYR A 79 13.774 -2.899 -1.552 1.00 43.32 H new ATOM 0 HE2 TYR A 79 10.806 -5.858 -2.342 1.00 12.35 H new ATOM 0 HH TYR A 79 12.805 -6.328 -1.472 1.00 41.33 H new ATOM 1308 N TYR A 80 7.650 -2.324 -5.514 1.00 14.44 N ATOM 1309 CA TYR A 80 6.839 -3.347 -6.182 1.00 31.43 C ATOM 1310 C TYR A 80 7.150 -3.420 -7.673 1.00 44.45 C ATOM 1311 O TYR A 80 7.331 -4.507 -8.231 1.00 4.42 O ATOM 1312 CB TYR A 80 5.333 -3.072 -5.972 1.00 60.52 C ATOM 1313 CG TYR A 80 4.441 -3.910 -6.842 1.00 13.43 C ATOM 1314 CD1 TYR A 80 4.014 -5.159 -6.448 1.00 34.12 C ATOM 1315 CD2 TYR A 80 4.061 -3.451 -8.092 1.00 33.40 C ATOM 1316 CE1 TYR A 80 3.240 -5.929 -7.285 1.00 42.35 C ATOM 1317 CE2 TYR A 80 3.292 -4.197 -8.915 1.00 24.10 C ATOM 1318 CZ TYR A 80 2.885 -5.434 -8.520 1.00 64.45 C ATOM 1319 OH TYR A 80 2.158 -6.187 -9.385 1.00 34.43 O ATOM 0 H TYR A 80 7.100 -1.611 -5.035 1.00 14.44 H new ATOM 0 HA TYR A 80 7.092 -4.308 -5.733 1.00 31.43 H new ATOM 0 HB2 TYR A 80 5.082 -3.253 -4.927 1.00 60.52 H new ATOM 0 HB3 TYR A 80 5.134 -2.019 -6.170 1.00 60.52 H new ATOM 0 HD1 TYR A 80 4.289 -5.537 -5.474 1.00 34.12 H new ATOM 0 HD2 TYR A 80 4.387 -2.474 -8.417 1.00 33.40 H new ATOM 0 HE1 TYR A 80 2.914 -6.911 -6.977 1.00 42.35 H new ATOM 0 HE2 TYR A 80 3.002 -3.813 -9.882 1.00 24.10 H new ATOM 0 HH TYR A 80 1.523 -6.739 -8.884 1.00 34.43 H new ATOM 1329 N LEU A 81 7.194 -2.276 -8.321 1.00 33.12 N ATOM 1330 CA LEU A 81 7.470 -2.231 -9.740 1.00 21.41 C ATOM 1331 C LEU A 81 8.864 -2.731 -10.051 1.00 23.42 C ATOM 1332 O LEU A 81 9.095 -3.322 -11.113 1.00 11.14 O ATOM 1333 CB LEU A 81 7.220 -0.841 -10.309 1.00 30.40 C ATOM 1334 CG LEU A 81 5.765 -0.365 -10.284 1.00 3.12 C ATOM 1335 CD1 LEU A 81 5.661 1.047 -10.801 1.00 54.11 C ATOM 1336 CD2 LEU A 81 4.881 -1.287 -11.110 1.00 34.24 C ATOM 0 H LEU A 81 7.042 -1.365 -7.888 1.00 33.12 H new ATOM 0 HA LEU A 81 6.774 -2.909 -10.234 1.00 21.41 H new ATOM 0 HB2 LEU A 81 7.826 -0.126 -9.753 1.00 30.40 H new ATOM 0 HB3 LEU A 81 7.571 -0.822 -11.341 1.00 30.40 H new ATOM 0 HG LEU A 81 5.421 -0.388 -9.250 1.00 3.12 H new ATOM 0 HD11 LEU A 81 4.620 1.368 -10.776 1.00 54.11 H new ATOM 0 HD12 LEU A 81 6.260 1.709 -10.175 1.00 54.11 H new ATOM 0 HD13 LEU A 81 6.028 1.087 -11.827 1.00 54.11 H new ATOM 0 HD21 LEU A 81 3.852 -0.929 -11.078 1.00 34.24 H new ATOM 0 HD22 LEU A 81 5.230 -1.296 -12.143 1.00 34.24 H new ATOM 0 HD23 LEU A 81 4.927 -2.297 -10.702 1.00 34.24 H new ATOM 1348 N ALA A 82 9.773 -2.571 -9.097 1.00 43.30 N ATOM 1349 CA ALA A 82 11.136 -3.042 -9.250 1.00 54.22 C ATOM 1350 C ALA A 82 11.152 -4.571 -9.314 1.00 51.00 C ATOM 1351 O ALA A 82 12.017 -5.174 -9.945 1.00 24.31 O ATOM 1352 CB ALA A 82 11.999 -2.538 -8.104 1.00 41.35 C ATOM 0 H ALA A 82 9.585 -2.115 -8.204 1.00 43.30 H new ATOM 0 HA ALA A 82 11.548 -2.652 -10.181 1.00 54.22 H new ATOM 0 HB1 ALA A 82 13.020 -2.899 -8.231 1.00 41.35 H new ATOM 0 HB2 ALA A 82 11.997 -1.448 -8.099 1.00 41.35 H new ATOM 0 HB3 ALA A 82 11.599 -2.905 -7.159 1.00 41.35 H new ATOM 1358 N ASN A 83 10.142 -5.186 -8.695 1.00 70.51 N ATOM 1359 CA ASN A 83 9.996 -6.654 -8.659 1.00 20.42 C ATOM 1360 C ASN A 83 9.644 -7.225 -10.017 1.00 34.12 C ATOM 1361 O ASN A 83 9.757 -8.420 -10.237 1.00 50.34 O ATOM 1362 CB ASN A 83 8.942 -7.098 -7.642 1.00 20.31 C ATOM 1363 CG ASN A 83 9.353 -6.958 -6.186 1.00 65.43 C ATOM 1364 OD1 ASN A 83 8.878 -7.690 -5.351 1.00 42.21 O ATOM 1365 ND2 ASN A 83 10.228 -6.041 -5.874 1.00 20.11 N ATOM 0 H ASN A 83 9.400 -4.687 -8.204 1.00 70.51 H new ATOM 0 HA ASN A 83 10.969 -7.042 -8.356 1.00 20.42 H new ATOM 0 HB2 ASN A 83 8.035 -6.517 -7.805 1.00 20.31 H new ATOM 0 HB3 ASN A 83 8.691 -8.141 -7.834 1.00 20.31 H new ATOM 0 HD21 ASN A 83 10.526 -5.929 -4.905 1.00 20.11 H new ATOM 0 HD22 ASN A 83 10.613 -5.436 -6.599 1.00 20.11 H new ATOM 1372 N HIS A 84 9.220 -6.370 -10.934 1.00 31.34 N ATOM 1373 CA HIS A 84 8.888 -6.815 -12.291 1.00 72.13 C ATOM 1374 C HIS A 84 10.135 -6.821 -13.178 1.00 24.14 C ATOM 1375 O HIS A 84 10.042 -6.962 -14.392 1.00 73.11 O ATOM 1376 CB HIS A 84 7.772 -5.946 -12.934 1.00 64.41 C ATOM 1377 CG HIS A 84 6.384 -6.134 -12.356 1.00 73.03 C ATOM 1378 ND1 HIS A 84 5.464 -7.004 -12.890 1.00 21.55 N ATOM 1379 CD2 HIS A 84 5.755 -5.543 -11.307 1.00 64.34 C ATOM 1380 CE1 HIS A 84 4.342 -6.948 -12.213 1.00 74.11 C ATOM 1381 NE2 HIS A 84 4.482 -6.076 -11.249 1.00 60.25 N ATOM 0 H HIS A 84 9.096 -5.371 -10.772 1.00 31.34 H new ATOM 0 HA HIS A 84 8.505 -7.832 -12.211 1.00 72.13 H new ATOM 0 HB2 HIS A 84 8.049 -4.897 -12.833 1.00 64.41 H new ATOM 0 HB3 HIS A 84 7.735 -6.165 -14.001 1.00 64.41 H new ATOM 0 HD2 HIS A 84 6.171 -4.798 -10.645 1.00 64.34 H new ATOM 0 HE1 HIS A 84 3.452 -7.525 -12.417 1.00 74.11 H new ATOM 0 HE2 HIS A 84 3.767 -5.829 -10.565 1.00 60.25 H new ATOM 1390 N GLY A 85 11.301 -6.683 -12.553 1.00 34.24 N ATOM 1391 CA GLY A 85 12.555 -6.654 -13.289 1.00 15.13 C ATOM 1392 C GLY A 85 12.833 -5.281 -13.831 1.00 71.20 C ATOM 1393 O GLY A 85 13.661 -5.096 -14.727 1.00 32.44 O ATOM 0 H GLY A 85 11.401 -6.590 -11.542 1.00 34.24 H new ATOM 0 HA2 GLY A 85 13.371 -6.962 -12.635 1.00 15.13 H new ATOM 0 HA3 GLY A 85 12.515 -7.371 -14.109 1.00 15.13 H new ATOM 1397 N ILE A 86 12.142 -4.321 -13.284 1.00 11.14 N ATOM 1398 CA ILE A 86 12.242 -2.962 -13.709 1.00 31.32 C ATOM 1399 C ILE A 86 13.136 -2.181 -12.761 1.00 54.24 C ATOM 1400 O ILE A 86 13.046 -2.333 -11.541 1.00 5.41 O ATOM 1401 CB ILE A 86 10.844 -2.302 -13.759 1.00 53.43 C ATOM 1402 CG1 ILE A 86 9.924 -3.072 -14.719 1.00 51.41 C ATOM 1403 CG2 ILE A 86 10.955 -0.847 -14.176 1.00 63.23 C ATOM 1404 CD1 ILE A 86 8.522 -2.512 -14.813 1.00 13.02 C ATOM 0 H ILE A 86 11.484 -4.468 -12.518 1.00 11.14 H new ATOM 0 HA ILE A 86 12.675 -2.949 -14.709 1.00 31.32 H new ATOM 0 HB ILE A 86 10.409 -2.338 -12.760 1.00 53.43 H new ATOM 0 HG12 ILE A 86 10.371 -3.071 -15.713 1.00 51.41 H new ATOM 0 HG13 ILE A 86 9.868 -4.111 -14.396 1.00 51.41 H new ATOM 0 HG21 ILE A 86 9.961 -0.400 -14.205 1.00 63.23 H new ATOM 0 HG22 ILE A 86 11.574 -0.309 -13.458 1.00 63.23 H new ATOM 0 HG23 ILE A 86 11.410 -0.786 -15.165 1.00 63.23 H new ATOM 0 HD11 ILE A 86 7.937 -3.111 -15.510 1.00 13.02 H new ATOM 0 HD12 ILE A 86 8.053 -2.538 -13.829 1.00 13.02 H new ATOM 0 HD13 ILE A 86 8.565 -1.482 -15.167 1.00 13.02 H new ATOM 1416 N ASP A 87 14.007 -1.395 -13.314 1.00 14.30 N ATOM 1417 CA ASP A 87 14.859 -0.526 -12.539 1.00 42.41 C ATOM 1418 C ASP A 87 14.316 0.880 -12.619 1.00 55.52 C ATOM 1419 O ASP A 87 14.178 1.434 -13.711 1.00 4.44 O ATOM 1420 CB ASP A 87 16.296 -0.571 -13.037 1.00 61.22 C ATOM 1421 CG ASP A 87 17.206 0.344 -12.254 1.00 44.30 C ATOM 1422 OD1 ASP A 87 17.580 1.405 -12.761 1.00 32.53 O ATOM 1423 OD2 ASP A 87 17.562 0.007 -11.112 1.00 72.14 O ATOM 0 H ASP A 87 14.153 -1.333 -14.322 1.00 14.30 H new ATOM 0 HA ASP A 87 14.866 -0.864 -11.503 1.00 42.41 H new ATOM 0 HB2 ASP A 87 16.669 -1.593 -12.971 1.00 61.22 H new ATOM 0 HB3 ASP A 87 16.322 -0.290 -14.090 1.00 61.22 H new ATOM 1428 N ILE A 88 13.987 1.441 -11.489 1.00 32.13 N ATOM 1429 CA ILE A 88 13.387 2.765 -11.438 1.00 1.31 C ATOM 1430 C ILE A 88 14.368 3.731 -10.796 1.00 31.13 C ATOM 1431 O ILE A 88 15.100 3.346 -9.874 1.00 60.34 O ATOM 1432 CB ILE A 88 12.078 2.730 -10.597 1.00 45.34 C ATOM 1433 CG1 ILE A 88 11.142 1.646 -11.132 1.00 4.12 C ATOM 1434 CG2 ILE A 88 11.377 4.095 -10.610 1.00 32.52 C ATOM 1435 CD1 ILE A 88 9.866 1.497 -10.346 1.00 4.22 C ATOM 0 H ILE A 88 14.122 1.005 -10.577 1.00 32.13 H new ATOM 0 HA ILE A 88 13.150 3.089 -12.451 1.00 1.31 H new ATOM 0 HB ILE A 88 12.340 2.497 -9.565 1.00 45.34 H new ATOM 0 HG12 ILE A 88 10.894 1.874 -12.169 1.00 4.12 H new ATOM 0 HG13 ILE A 88 11.670 0.692 -11.133 1.00 4.12 H new ATOM 0 HG21 ILE A 88 10.465 4.042 -10.015 1.00 32.52 H new ATOM 0 HG22 ILE A 88 12.042 4.849 -10.189 1.00 32.52 H new ATOM 0 HG23 ILE A 88 11.125 4.365 -11.636 1.00 32.52 H new ATOM 0 HD11 ILE A 88 9.256 0.709 -10.788 1.00 4.22 H new ATOM 0 HD12 ILE A 88 10.102 1.237 -9.314 1.00 4.22 H new ATOM 0 HD13 ILE A 88 9.314 2.437 -10.366 1.00 4.22 H new ATOM 1767 N ALA B 19 -3.979 -9.819 -12.200 1.00 14.22 N ATOM 1768 CA ALA B 19 -4.323 -8.830 -13.192 1.00 73.20 C ATOM 1769 C ALA B 19 -3.723 -7.501 -12.806 1.00 13.44 C ATOM 1770 O ALA B 19 -3.254 -6.749 -13.649 1.00 22.15 O ATOM 1771 CB ALA B 19 -5.813 -8.691 -13.256 1.00 21.14 C ATOM 0 HA ALA B 19 -3.937 -9.141 -14.163 1.00 73.20 H new ATOM 0 HB1 ALA B 19 -6.077 -7.944 -14.005 1.00 21.14 H new ATOM 0 HB2 ALA B 19 -6.256 -9.649 -13.527 1.00 21.14 H new ATOM 0 HB3 ALA B 19 -6.191 -8.378 -12.283 1.00 21.14 H new ATOM 1777 N ILE B 20 -3.723 -7.236 -11.502 1.00 63.11 N ATOM 1778 CA ILE B 20 -3.177 -6.009 -10.938 1.00 74.14 C ATOM 1779 C ILE B 20 -1.714 -5.890 -11.336 1.00 12.40 C ATOM 1780 O ILE B 20 -1.221 -4.801 -11.680 1.00 54.22 O ATOM 1781 CB ILE B 20 -3.264 -6.044 -9.397 1.00 14.32 C ATOM 1782 CG1 ILE B 20 -4.709 -6.291 -8.948 1.00 3.51 C ATOM 1783 CG2 ILE B 20 -2.729 -4.749 -8.802 1.00 12.12 C ATOM 1784 CD1 ILE B 20 -4.876 -6.430 -7.455 1.00 4.55 C ATOM 0 H ILE B 20 -4.105 -7.873 -10.803 1.00 63.11 H new ATOM 0 HA ILE B 20 -3.749 -5.161 -11.314 1.00 74.14 H new ATOM 0 HB ILE B 20 -2.647 -6.866 -9.034 1.00 14.32 H new ATOM 0 HG12 ILE B 20 -5.332 -5.468 -9.297 1.00 3.51 H new ATOM 0 HG13 ILE B 20 -5.078 -7.197 -9.430 1.00 3.51 H new ATOM 0 HG21 ILE B 20 -2.798 -4.792 -7.715 1.00 12.12 H new ATOM 0 HG22 ILE B 20 -1.687 -4.617 -9.094 1.00 12.12 H new ATOM 0 HG23 ILE B 20 -3.318 -3.909 -9.170 1.00 12.12 H new ATOM 0 HD11 ILE B 20 -5.926 -6.602 -7.221 1.00 4.55 H new ATOM 0 HD12 ILE B 20 -4.282 -7.272 -7.099 1.00 4.55 H new ATOM 0 HD13 ILE B 20 -4.540 -5.516 -6.965 1.00 4.55 H new ATOM 1796 N SER B 21 -1.059 -7.027 -11.347 1.00 62.20 N ATOM 1797 CA SER B 21 0.339 -7.113 -11.675 1.00 70.42 C ATOM 1798 C SER B 21 0.568 -6.691 -13.128 1.00 34.33 C ATOM 1799 O SER B 21 1.496 -5.927 -13.427 1.00 45.41 O ATOM 1800 CB SER B 21 0.831 -8.542 -11.438 1.00 32.45 C ATOM 1801 OG SER B 21 0.565 -8.967 -10.102 1.00 33.34 O ATOM 0 H SER B 21 -1.488 -7.925 -11.126 1.00 62.20 H new ATOM 0 HA SER B 21 0.905 -6.436 -11.035 1.00 70.42 H new ATOM 0 HB2 SER B 21 0.344 -9.218 -12.141 1.00 32.45 H new ATOM 0 HB3 SER B 21 1.902 -8.597 -11.633 1.00 32.45 H new ATOM 0 HG SER B 21 0.387 -8.185 -9.539 1.00 33.34 H new ATOM 1807 N GLU B 22 -0.307 -7.160 -14.014 1.00 1.11 N ATOM 1808 CA GLU B 22 -0.231 -6.833 -15.430 1.00 73.44 C ATOM 1809 C GLU B 22 -0.553 -5.362 -15.632 1.00 74.21 C ATOM 1810 O GLU B 22 0.102 -4.666 -16.425 1.00 15.31 O ATOM 1811 CB GLU B 22 -1.216 -7.683 -16.235 1.00 4.24 C ATOM 1812 CG GLU B 22 -1.007 -9.177 -16.108 1.00 42.41 C ATOM 1813 CD GLU B 22 0.374 -9.606 -16.521 1.00 70.33 C ATOM 1814 OE1 GLU B 22 0.644 -9.706 -17.735 1.00 64.30 O ATOM 1815 OE2 GLU B 22 1.211 -9.870 -15.642 1.00 24.50 O ATOM 0 H GLU B 22 -1.084 -7.774 -13.770 1.00 1.11 H new ATOM 0 HA GLU B 22 0.780 -7.042 -15.780 1.00 73.44 H new ATOM 0 HB2 GLU B 22 -2.230 -7.442 -15.915 1.00 4.24 H new ATOM 0 HB3 GLU B 22 -1.140 -7.406 -17.287 1.00 4.24 H new ATOM 0 HG2 GLU B 22 -1.183 -9.478 -15.075 1.00 42.41 H new ATOM 0 HG3 GLU B 22 -1.743 -9.696 -16.721 1.00 42.41 H new ATOM 1822 N THR B 23 -1.557 -4.899 -14.899 1.00 1.53 N ATOM 1823 CA THR B 23 -1.997 -3.527 -14.940 1.00 42.23 C ATOM 1824 C THR B 23 -0.835 -2.567 -14.625 1.00 11.34 C ATOM 1825 O THR B 23 -0.514 -1.683 -15.419 1.00 50.43 O ATOM 1826 CB THR B 23 -3.133 -3.307 -13.893 1.00 64.41 C ATOM 1827 OG1 THR B 23 -4.270 -4.146 -14.191 1.00 52.32 O ATOM 1828 CG2 THR B 23 -3.571 -1.857 -13.842 1.00 13.11 C ATOM 0 H THR B 23 -2.090 -5.481 -14.253 1.00 1.53 H new ATOM 0 HA THR B 23 -2.366 -3.319 -15.944 1.00 42.23 H new ATOM 0 HB THR B 23 -2.730 -3.579 -12.917 1.00 64.41 H new ATOM 0 HG1 THR B 23 -5.064 -3.794 -13.738 1.00 52.32 H new ATOM 0 HG21 THR B 23 -4.363 -1.742 -13.102 1.00 13.11 H new ATOM 0 HG22 THR B 23 -2.723 -1.230 -13.566 1.00 13.11 H new ATOM 0 HG23 THR B 23 -3.942 -1.554 -14.821 1.00 13.11 H new ATOM 1836 N LEU B 24 -0.177 -2.797 -13.509 1.00 32.31 N ATOM 1837 CA LEU B 24 0.879 -1.915 -13.042 1.00 13.55 C ATOM 1838 C LEU B 24 2.136 -2.020 -13.894 1.00 24.02 C ATOM 1839 O LEU B 24 2.832 -1.020 -14.109 1.00 4.12 O ATOM 1840 CB LEU B 24 1.171 -2.185 -11.581 1.00 31.12 C ATOM 1841 CG LEU B 24 -0.005 -1.957 -10.629 1.00 4.32 C ATOM 1842 CD1 LEU B 24 0.380 -2.330 -9.226 1.00 53.23 C ATOM 1843 CD2 LEU B 24 -0.479 -0.508 -10.684 1.00 41.21 C ATOM 0 H LEU B 24 -0.355 -3.596 -12.900 1.00 32.31 H new ATOM 0 HA LEU B 24 0.528 -0.888 -13.143 1.00 13.55 H new ATOM 0 HB2 LEU B 24 1.506 -3.217 -11.479 1.00 31.12 H new ATOM 0 HB3 LEU B 24 1.999 -1.549 -11.269 1.00 31.12 H new ATOM 0 HG LEU B 24 -0.830 -2.595 -10.948 1.00 4.32 H new ATOM 0 HD11 LEU B 24 -0.466 -2.163 -8.560 1.00 53.23 H new ATOM 0 HD12 LEU B 24 0.664 -3.382 -9.194 1.00 53.23 H new ATOM 0 HD13 LEU B 24 1.222 -1.717 -8.904 1.00 53.23 H new ATOM 0 HD21 LEU B 24 -1.315 -0.373 -9.998 1.00 41.21 H new ATOM 0 HD22 LEU B 24 0.338 0.153 -10.395 1.00 41.21 H new ATOM 0 HD23 LEU B 24 -0.799 -0.268 -11.698 1.00 41.21 H new ATOM 1855 N GLU B 25 2.410 -3.222 -14.390 1.00 14.53 N ATOM 1856 CA GLU B 25 3.540 -3.463 -15.278 1.00 31.12 C ATOM 1857 C GLU B 25 3.368 -2.603 -16.544 1.00 64.32 C ATOM 1858 O GLU B 25 4.319 -2.029 -17.070 1.00 61.41 O ATOM 1859 CB GLU B 25 3.574 -4.960 -15.644 1.00 4.54 C ATOM 1860 CG GLU B 25 4.707 -5.388 -16.558 1.00 10.02 C ATOM 1861 CD GLU B 25 4.651 -6.870 -16.873 1.00 70.31 C ATOM 1862 OE1 GLU B 25 3.906 -7.269 -17.794 1.00 1.12 O ATOM 1863 OE2 GLU B 25 5.339 -7.665 -16.199 1.00 64.30 O ATOM 0 H GLU B 25 1.856 -4.054 -14.188 1.00 14.53 H new ATOM 0 HA GLU B 25 4.477 -3.195 -14.790 1.00 31.12 H new ATOM 0 HB2 GLU B 25 3.636 -5.539 -14.723 1.00 4.54 H new ATOM 0 HB3 GLU B 25 2.629 -5.220 -16.121 1.00 4.54 H new ATOM 0 HG2 GLU B 25 4.660 -4.818 -17.486 1.00 10.02 H new ATOM 0 HG3 GLU B 25 5.662 -5.153 -16.087 1.00 10.02 H new ATOM 1870 N THR B 26 2.127 -2.503 -16.979 1.00 41.32 N ATOM 1871 CA THR B 26 1.757 -1.736 -18.143 1.00 74.25 C ATOM 1872 C THR B 26 1.825 -0.215 -17.857 1.00 61.13 C ATOM 1873 O THR B 26 2.471 0.541 -18.597 1.00 24.24 O ATOM 1874 CB THR B 26 0.331 -2.126 -18.594 1.00 32.05 C ATOM 1875 OG1 THR B 26 0.286 -3.535 -18.876 1.00 23.11 O ATOM 1876 CG2 THR B 26 -0.094 -1.351 -19.823 1.00 35.22 C ATOM 0 H THR B 26 1.338 -2.961 -16.523 1.00 41.32 H new ATOM 0 HA THR B 26 2.466 -1.961 -18.940 1.00 74.25 H new ATOM 0 HB THR B 26 -0.358 -1.882 -17.785 1.00 32.05 H new ATOM 0 HG1 THR B 26 0.316 -4.038 -18.035 1.00 23.11 H new ATOM 0 HG21 THR B 26 -1.101 -1.651 -20.112 1.00 35.22 H new ATOM 0 HG22 THR B 26 -0.082 -0.284 -19.602 1.00 35.22 H new ATOM 0 HG23 THR B 26 0.595 -1.560 -20.641 1.00 35.22 H new ATOM 1884 N VAL B 27 1.166 0.210 -16.771 1.00 30.12 N ATOM 1885 CA VAL B 27 1.094 1.632 -16.386 1.00 62.20 C ATOM 1886 C VAL B 27 2.474 2.289 -16.277 1.00 0.32 C ATOM 1887 O VAL B 27 2.679 3.382 -16.808 1.00 44.50 O ATOM 1888 CB VAL B 27 0.292 1.848 -15.060 1.00 60.34 C ATOM 1889 CG1 VAL B 27 0.263 3.320 -14.670 1.00 14.14 C ATOM 1890 CG2 VAL B 27 -1.130 1.333 -15.204 1.00 12.32 C ATOM 0 H VAL B 27 0.670 -0.415 -16.136 1.00 30.12 H new ATOM 0 HA VAL B 27 0.555 2.122 -17.197 1.00 62.20 H new ATOM 0 HB VAL B 27 0.799 1.288 -14.274 1.00 60.34 H new ATOM 0 HG11 VAL B 27 -0.301 3.440 -13.745 1.00 14.14 H new ATOM 0 HG12 VAL B 27 1.282 3.678 -14.523 1.00 14.14 H new ATOM 0 HG13 VAL B 27 -0.213 3.897 -15.463 1.00 14.14 H new ATOM 0 HG21 VAL B 27 -1.671 1.492 -14.271 1.00 12.32 H new ATOM 0 HG22 VAL B 27 -1.631 1.869 -16.010 1.00 12.32 H new ATOM 0 HG23 VAL B 27 -1.110 0.268 -15.434 1.00 12.32 H new ATOM 1900 N TYR B 28 3.416 1.615 -15.631 1.00 41.32 N ATOM 1901 CA TYR B 28 4.759 2.181 -15.438 1.00 51.14 C ATOM 1902 C TYR B 28 5.416 2.549 -16.774 1.00 21.52 C ATOM 1903 O TYR B 28 5.906 3.674 -16.954 1.00 33.43 O ATOM 1904 CB TYR B 28 5.672 1.223 -14.639 1.00 32.21 C ATOM 1905 CG TYR B 28 7.098 1.741 -14.496 1.00 1.30 C ATOM 1906 CD1 TYR B 28 8.090 1.331 -15.370 1.00 20.03 C ATOM 1907 CD2 TYR B 28 7.439 2.663 -13.517 1.00 1.33 C ATOM 1908 CE1 TYR B 28 9.368 1.822 -15.280 1.00 3.31 C ATOM 1909 CE2 TYR B 28 8.731 3.155 -13.418 1.00 11.51 C ATOM 1910 CZ TYR B 28 9.688 2.727 -14.307 1.00 40.52 C ATOM 1911 OH TYR B 28 10.971 3.229 -14.242 1.00 50.34 O ATOM 0 H TYR B 28 3.285 0.685 -15.233 1.00 41.32 H new ATOM 0 HA TYR B 28 4.633 3.095 -14.858 1.00 51.14 H new ATOM 0 HB2 TYR B 28 5.247 1.067 -13.648 1.00 32.21 H new ATOM 0 HB3 TYR B 28 5.692 0.252 -15.134 1.00 32.21 H new ATOM 0 HD1 TYR B 28 7.853 0.610 -16.138 1.00 20.03 H new ATOM 0 HD2 TYR B 28 6.686 3.003 -12.821 1.00 1.33 H new ATOM 0 HE1 TYR B 28 10.122 1.493 -15.979 1.00 3.31 H new ATOM 0 HE2 TYR B 28 8.984 3.869 -12.648 1.00 11.51 H new ATOM 0 HH TYR B 28 10.949 4.138 -13.876 1.00 50.34 H new ATOM 1921 N ARG B 29 5.380 1.620 -17.700 1.00 20.32 N ATOM 1922 CA ARG B 29 6.021 1.775 -18.998 1.00 21.24 C ATOM 1923 C ARG B 29 5.352 2.858 -19.831 1.00 3.31 C ATOM 1924 O ARG B 29 6.001 3.517 -20.659 1.00 51.14 O ATOM 1925 CB ARG B 29 6.049 0.439 -19.739 1.00 62.34 C ATOM 1926 CG ARG B 29 6.794 -0.649 -18.976 1.00 44.52 C ATOM 1927 CD ARG B 29 6.801 -1.969 -19.721 1.00 32.44 C ATOM 1928 NE ARG B 29 5.449 -2.494 -19.958 1.00 10.14 N ATOM 1929 CZ ARG B 29 5.157 -3.771 -20.230 1.00 33.15 C ATOM 1930 NH1 ARG B 29 6.126 -4.682 -20.304 1.00 50.03 N ATOM 1931 NH2 ARG B 29 3.895 -4.128 -20.442 1.00 2.42 N ATOM 0 H ARG B 29 4.903 0.726 -17.579 1.00 20.32 H new ATOM 0 HA ARG B 29 7.049 2.096 -18.830 1.00 21.24 H new ATOM 0 HB2 ARG B 29 5.026 0.110 -19.923 1.00 62.34 H new ATOM 0 HB3 ARG B 29 6.519 0.579 -20.712 1.00 62.34 H new ATOM 0 HG2 ARG B 29 7.821 -0.328 -18.799 1.00 44.52 H new ATOM 0 HG3 ARG B 29 6.331 -0.788 -17.999 1.00 44.52 H new ATOM 0 HD2 ARG B 29 7.309 -1.839 -20.677 1.00 32.44 H new ATOM 0 HD3 ARG B 29 7.375 -2.700 -19.152 1.00 32.44 H new ATOM 0 HE ARG B 29 4.673 -1.834 -19.912 1.00 10.14 H new ATOM 0 HH11 ARG B 29 7.097 -4.407 -20.153 1.00 50.03 H new ATOM 0 HH12 ARG B 29 5.897 -5.654 -20.512 1.00 50.03 H new ATOM 0 HH21 ARG B 29 3.153 -3.430 -20.397 1.00 2.42 H new ATOM 0 HH22 ARG B 29 3.668 -5.101 -20.650 1.00 2.42 H new ATOM 1945 N ALA B 30 4.061 3.046 -19.618 1.00 2.30 N ATOM 1946 CA ALA B 30 3.310 4.059 -20.331 1.00 50.01 C ATOM 1947 C ALA B 30 3.823 5.461 -20.005 1.00 74.40 C ATOM 1948 O ALA B 30 3.980 6.298 -20.901 1.00 42.24 O ATOM 1949 CB ALA B 30 1.828 3.946 -20.029 1.00 71.22 C ATOM 0 H ALA B 30 3.510 2.505 -18.952 1.00 2.30 H new ATOM 0 HA ALA B 30 3.455 3.890 -21.398 1.00 50.01 H new ATOM 0 HB1 ALA B 30 1.285 4.717 -20.576 1.00 71.22 H new ATOM 0 HB2 ALA B 30 1.468 2.963 -20.334 1.00 71.22 H new ATOM 0 HB3 ALA B 30 1.664 4.076 -18.959 1.00 71.22 H new ATOM 1955 N LEU B 31 4.102 5.721 -18.728 1.00 70.14 N ATOM 1956 CA LEU B 31 4.588 7.038 -18.346 1.00 34.34 C ATOM 1957 C LEU B 31 6.010 7.304 -18.753 1.00 11.41 C ATOM 1958 O LEU B 31 6.371 8.463 -18.973 1.00 44.32 O ATOM 1959 CB LEU B 31 4.345 7.443 -16.894 1.00 23.35 C ATOM 1960 CG LEU B 31 2.900 7.647 -16.483 1.00 23.24 C ATOM 1961 CD1 LEU B 31 2.237 6.379 -16.020 1.00 55.33 C ATOM 1962 CD2 LEU B 31 2.775 8.734 -15.474 1.00 13.25 C ATOM 0 H LEU B 31 4.002 5.055 -17.962 1.00 70.14 H new ATOM 0 HA LEU B 31 3.947 7.693 -18.937 1.00 34.34 H new ATOM 0 HB2 LEU B 31 4.779 6.679 -16.249 1.00 23.35 H new ATOM 0 HB3 LEU B 31 4.889 8.368 -16.702 1.00 23.35 H new ATOM 0 HG LEU B 31 2.363 7.957 -17.379 1.00 23.24 H new ATOM 0 HD11 LEU B 31 1.205 6.590 -15.739 1.00 55.33 H new ATOM 0 HD12 LEU B 31 2.252 5.646 -16.826 1.00 55.33 H new ATOM 0 HD13 LEU B 31 2.773 5.982 -15.158 1.00 55.33 H new ATOM 0 HD21 LEU B 31 1.727 8.857 -15.199 1.00 13.25 H new ATOM 0 HD22 LEU B 31 3.355 8.476 -14.588 1.00 13.25 H new ATOM 0 HD23 LEU B 31 3.151 9.666 -15.895 1.00 13.25 H new ATOM 1974 N GLU B 32 6.828 6.255 -18.840 1.00 22.13 N ATOM 1975 CA GLU B 32 8.218 6.416 -19.278 1.00 45.01 C ATOM 1976 C GLU B 32 8.254 7.039 -20.658 1.00 54.41 C ATOM 1977 O GLU B 32 8.945 8.028 -20.895 1.00 34.12 O ATOM 1978 CB GLU B 32 8.948 5.089 -19.340 1.00 20.42 C ATOM 1979 CG GLU B 32 9.066 4.354 -18.037 1.00 2.41 C ATOM 1980 CD GLU B 32 9.900 3.113 -18.199 1.00 45.20 C ATOM 1981 OE1 GLU B 32 11.147 3.208 -18.054 1.00 52.40 O ATOM 1982 OE2 GLU B 32 9.346 2.051 -18.489 1.00 61.45 O ATOM 0 H GLU B 32 6.559 5.297 -18.617 1.00 22.13 H new ATOM 0 HA GLU B 32 8.712 7.057 -18.548 1.00 45.01 H new ATOM 0 HB2 GLU B 32 8.435 4.445 -20.055 1.00 20.42 H new ATOM 0 HB3 GLU B 32 9.951 5.264 -19.730 1.00 20.42 H new ATOM 0 HG2 GLU B 32 9.515 5.004 -17.287 1.00 2.41 H new ATOM 0 HG3 GLU B 32 8.074 4.086 -17.674 1.00 2.41 H new ATOM 1989 N GLU B 33 7.465 6.470 -21.553 1.00 2.23 N ATOM 1990 CA GLU B 33 7.386 6.934 -22.926 1.00 54.21 C ATOM 1991 C GLU B 33 6.805 8.345 -23.025 1.00 30.13 C ATOM 1992 O GLU B 33 7.061 9.064 -23.985 1.00 52.14 O ATOM 1993 CB GLU B 33 6.594 5.955 -23.783 1.00 72.20 C ATOM 1994 CG GLU B 33 7.240 4.583 -23.901 1.00 32.20 C ATOM 1995 CD GLU B 33 8.631 4.657 -24.490 1.00 23.40 C ATOM 1996 OE1 GLU B 33 9.619 4.442 -23.760 1.00 62.32 O ATOM 1997 OE2 GLU B 33 8.760 4.962 -25.687 1.00 13.30 O ATOM 0 H GLU B 33 6.862 5.674 -21.348 1.00 2.23 H new ATOM 0 HA GLU B 33 8.405 6.982 -23.310 1.00 54.21 H new ATOM 0 HB2 GLU B 33 5.596 5.841 -23.360 1.00 72.20 H new ATOM 0 HB3 GLU B 33 6.472 6.376 -24.781 1.00 72.20 H new ATOM 0 HG2 GLU B 33 7.288 4.120 -22.916 1.00 32.20 H new ATOM 0 HG3 GLU B 33 6.617 3.942 -24.524 1.00 32.20 H new ATOM 2004 N LYS B 34 6.024 8.733 -22.032 1.00 15.10 N ATOM 2005 CA LYS B 34 5.423 10.069 -21.997 1.00 11.33 C ATOM 2006 C LYS B 34 6.332 11.076 -21.287 1.00 31.20 C ATOM 2007 O LYS B 34 6.063 12.276 -21.290 1.00 13.10 O ATOM 2008 CB LYS B 34 4.055 10.032 -21.317 1.00 72.43 C ATOM 2009 CG LYS B 34 3.002 9.209 -22.043 1.00 34.44 C ATOM 2010 CD LYS B 34 2.629 9.794 -23.411 1.00 54.11 C ATOM 2011 CE LYS B 34 1.951 11.132 -23.289 1.00 73.05 C ATOM 2012 NZ LYS B 34 1.576 11.684 -24.606 1.00 75.45 N ATOM 0 H LYS B 34 5.786 8.145 -21.233 1.00 15.10 H new ATOM 0 HA LYS B 34 5.296 10.394 -23.030 1.00 11.33 H new ATOM 0 HB2 LYS B 34 4.177 9.633 -20.310 1.00 72.43 H new ATOM 0 HB3 LYS B 34 3.689 11.053 -21.213 1.00 72.43 H new ATOM 0 HG2 LYS B 34 3.371 8.192 -22.176 1.00 34.44 H new ATOM 0 HG3 LYS B 34 2.107 9.145 -21.424 1.00 34.44 H new ATOM 0 HD2 LYS B 34 3.529 9.898 -24.018 1.00 54.11 H new ATOM 0 HD3 LYS B 34 1.970 9.101 -23.934 1.00 54.11 H new ATOM 0 HE2 LYS B 34 1.059 11.031 -22.671 1.00 73.05 H new ATOM 0 HE3 LYS B 34 2.615 11.830 -22.779 1.00 73.05 H new ATOM 0 HZ1 LYS B 34 1.112 12.606 -24.477 1.00 75.45 H new ATOM 0 HZ2 LYS B 34 2.430 11.805 -25.188 1.00 75.45 H new ATOM 0 HZ3 LYS B 34 0.922 11.031 -25.083 1.00 75.45 H new ATOM 2026 N GLY B 35 7.384 10.579 -20.668 1.00 20.41 N ATOM 2027 CA GLY B 35 8.336 11.439 -20.003 1.00 50.51 C ATOM 2028 C GLY B 35 7.864 11.955 -18.657 1.00 14.21 C ATOM 2029 O GLY B 35 8.343 12.989 -18.186 1.00 54.12 O ATOM 0 H GLY B 35 7.599 9.584 -20.613 1.00 20.41 H new ATOM 0 HA2 GLY B 35 9.269 10.893 -19.865 1.00 50.51 H new ATOM 0 HA3 GLY B 35 8.557 12.288 -20.649 1.00 50.51 H new ATOM 2033 N TYR B 36 6.942 11.255 -18.035 1.00 63.23 N ATOM 2034 CA TYR B 36 6.441 11.667 -16.733 1.00 4.33 C ATOM 2035 C TYR B 36 7.059 10.823 -15.634 1.00 1.25 C ATOM 2036 O TYR B 36 7.929 9.975 -15.902 1.00 50.50 O ATOM 2037 CB TYR B 36 4.911 11.565 -16.649 1.00 61.21 C ATOM 2038 CG TYR B 36 4.148 12.477 -17.579 1.00 31.00 C ATOM 2039 CD1 TYR B 36 3.378 11.960 -18.600 1.00 4.43 C ATOM 2040 CD2 TYR B 36 4.191 13.857 -17.425 1.00 32.32 C ATOM 2041 CE1 TYR B 36 2.666 12.782 -19.445 1.00 5.34 C ATOM 2042 CE2 TYR B 36 3.483 14.691 -18.269 1.00 43.41 C ATOM 2043 CZ TYR B 36 2.720 14.145 -19.277 1.00 43.42 C ATOM 2044 OH TYR B 36 2.004 14.964 -20.121 1.00 74.53 O ATOM 0 H TYR B 36 6.522 10.401 -18.403 1.00 63.23 H new ATOM 0 HA TYR B 36 6.723 12.711 -16.599 1.00 4.33 H new ATOM 0 HB2 TYR B 36 4.621 10.535 -16.858 1.00 61.21 H new ATOM 0 HB3 TYR B 36 4.605 11.780 -15.625 1.00 61.21 H new ATOM 0 HD1 TYR B 36 3.333 10.890 -18.739 1.00 4.43 H new ATOM 0 HD2 TYR B 36 4.787 14.285 -16.633 1.00 32.32 H new ATOM 0 HE1 TYR B 36 2.067 12.357 -20.237 1.00 5.34 H new ATOM 0 HE2 TYR B 36 3.528 15.762 -18.139 1.00 43.41 H new ATOM 0 HH TYR B 36 2.148 15.900 -19.869 1.00 74.53 H new ATOM 2054 N ASN B 37 6.616 11.060 -14.409 1.00 63.12 N ATOM 2055 CA ASN B 37 7.065 10.306 -13.247 1.00 72.00 C ATOM 2056 C ASN B 37 5.993 9.279 -12.866 1.00 14.33 C ATOM 2057 O ASN B 37 4.998 9.626 -12.203 1.00 52.31 O ATOM 2058 CB ASN B 37 7.347 11.247 -12.050 1.00 30.24 C ATOM 2059 CG ASN B 37 8.474 12.238 -12.300 1.00 30.40 C ATOM 2060 OD1 ASN B 37 9.406 11.968 -13.059 1.00 5.13 O ATOM 2061 ND2 ASN B 37 8.401 13.388 -11.673 1.00 4.04 N ATOM 0 H ASN B 37 5.932 11.784 -14.191 1.00 63.12 H new ATOM 0 HA ASN B 37 7.994 9.794 -13.498 1.00 72.00 H new ATOM 0 HB2 ASN B 37 6.437 11.798 -11.811 1.00 30.24 H new ATOM 0 HB3 ASN B 37 7.593 10.644 -11.176 1.00 30.24 H new ATOM 0 HD21 ASN B 37 9.129 14.089 -11.807 1.00 4.04 H new ATOM 0 HD22 ASN B 37 7.616 13.581 -11.051 1.00 4.04 H new ATOM 2068 N PRO B 38 6.153 8.008 -13.319 1.00 41.41 N ATOM 2069 CA PRO B 38 5.163 6.944 -13.097 1.00 40.13 C ATOM 2070 C PRO B 38 4.763 6.739 -11.640 1.00 64.03 C ATOM 2071 O PRO B 38 3.582 6.587 -11.346 1.00 12.50 O ATOM 2072 CB PRO B 38 5.850 5.686 -13.614 1.00 71.34 C ATOM 2073 CG PRO B 38 6.914 6.154 -14.543 1.00 31.32 C ATOM 2074 CD PRO B 38 7.306 7.530 -14.106 1.00 24.22 C ATOM 0 HA PRO B 38 4.231 7.200 -13.600 1.00 40.13 H new ATOM 0 HB2 PRO B 38 6.275 5.108 -12.793 1.00 71.34 H new ATOM 0 HB3 PRO B 38 5.141 5.037 -14.128 1.00 71.34 H new ATOM 0 HG2 PRO B 38 7.772 5.482 -14.516 1.00 31.32 H new ATOM 0 HG3 PRO B 38 6.551 6.165 -15.571 1.00 31.32 H new ATOM 0 HD2 PRO B 38 8.216 7.512 -13.507 1.00 24.22 H new ATOM 0 HD3 PRO B 38 7.500 8.178 -14.961 1.00 24.22 H new ATOM 2082 N ILE B 39 5.726 6.783 -10.730 1.00 0.43 N ATOM 2083 CA ILE B 39 5.437 6.508 -9.324 1.00 2.14 C ATOM 2084 C ILE B 39 4.575 7.605 -8.751 1.00 3.41 C ATOM 2085 O ILE B 39 3.585 7.336 -8.079 1.00 11.33 O ATOM 2086 CB ILE B 39 6.732 6.338 -8.463 1.00 63.02 C ATOM 2087 CG1 ILE B 39 7.623 5.232 -9.044 1.00 63.43 C ATOM 2088 CG2 ILE B 39 6.383 6.036 -7.001 1.00 41.51 C ATOM 2089 CD1 ILE B 39 6.945 3.886 -9.148 1.00 31.32 C ATOM 0 H ILE B 39 6.701 7.003 -10.932 1.00 0.43 H new ATOM 0 HA ILE B 39 4.903 5.559 -9.287 1.00 2.14 H new ATOM 0 HB ILE B 39 7.283 7.278 -8.492 1.00 63.02 H new ATOM 0 HG12 ILE B 39 7.960 5.535 -10.035 1.00 63.43 H new ATOM 0 HG13 ILE B 39 8.512 5.132 -8.422 1.00 63.43 H new ATOM 0 HG21 ILE B 39 7.301 5.922 -6.424 1.00 41.51 H new ATOM 0 HG22 ILE B 39 5.795 6.857 -6.590 1.00 41.51 H new ATOM 0 HG23 ILE B 39 5.804 5.114 -6.948 1.00 41.51 H new ATOM 0 HD11 ILE B 39 7.641 3.160 -9.568 1.00 31.32 H new ATOM 0 HD12 ILE B 39 6.632 3.558 -8.156 1.00 31.32 H new ATOM 0 HD13 ILE B 39 6.072 3.968 -9.795 1.00 31.32 H new ATOM 2101 N ASN B 40 4.915 8.833 -9.095 1.00 5.23 N ATOM 2102 CA ASN B 40 4.240 9.987 -8.635 1.00 62.11 C ATOM 2103 C ASN B 40 2.787 10.012 -9.100 1.00 55.31 C ATOM 2104 O ASN B 40 1.885 10.402 -8.342 1.00 10.43 O ATOM 2105 CB ASN B 40 5.023 11.215 -9.096 1.00 10.35 C ATOM 2106 CG ASN B 40 4.254 12.483 -9.003 1.00 62.04 C ATOM 2107 OD1 ASN B 40 3.667 12.853 -10.088 1.00 13.04 O flip ATOM 2108 ND2 ASN B 40 4.224 13.149 -7.968 1.00 22.21 N flip ATOM 0 H ASN B 40 5.694 9.039 -9.721 1.00 5.23 H new ATOM 0 HA ASN B 40 4.196 9.982 -7.546 1.00 62.11 H new ATOM 0 HB2 ASN B 40 5.928 11.304 -8.495 1.00 10.35 H new ATOM 0 HB3 ASN B 40 5.339 11.067 -10.129 1.00 10.35 H new ATOM 0 HD21 ASN B 40 4.704 12.815 -7.133 1.00 22.21 H new ATOM 0 HD22 ASN B 40 3.719 14.035 -7.946 1.00 22.21 H new ATOM 2115 N GLN B 41 2.553 9.582 -10.324 1.00 33.21 N ATOM 2116 CA GLN B 41 1.217 9.564 -10.849 1.00 14.33 C ATOM 2117 C GLN B 41 0.394 8.423 -10.241 1.00 23.34 C ATOM 2118 O GLN B 41 -0.779 8.605 -9.928 1.00 50.02 O ATOM 2119 CB GLN B 41 1.242 9.511 -12.362 1.00 54.52 C ATOM 2120 CG GLN B 41 1.988 10.695 -12.990 1.00 32.33 C ATOM 2121 CD GLN B 41 1.376 12.048 -12.695 1.00 43.15 C ATOM 2122 OE1 GLN B 41 0.088 12.111 -12.604 1.00 54.31 O flip ATOM 2123 NE2 GLN B 41 2.079 13.042 -12.604 1.00 70.21 N flip ATOM 0 H GLN B 41 3.271 9.244 -10.965 1.00 33.21 H new ATOM 0 HA GLN B 41 0.721 10.491 -10.563 1.00 14.33 H new ATOM 0 HB2 GLN B 41 1.714 8.581 -12.680 1.00 54.52 H new ATOM 0 HB3 GLN B 41 0.219 9.493 -12.737 1.00 54.52 H new ATOM 0 HG2 GLN B 41 3.018 10.690 -12.633 1.00 32.33 H new ATOM 0 HG3 GLN B 41 2.024 10.554 -14.070 1.00 32.33 H new ATOM 0 HE21 GLN B 41 3.093 12.958 -12.680 1.00 70.21 H new ATOM 0 HE22 GLN B 41 1.653 13.956 -12.452 1.00 70.21 H new ATOM 2132 N ILE B 42 1.023 7.262 -10.049 1.00 31.33 N ATOM 2133 CA ILE B 42 0.331 6.110 -9.470 1.00 20.21 C ATOM 2134 C ILE B 42 -0.036 6.359 -8.003 1.00 63.31 C ATOM 2135 O ILE B 42 -1.192 6.187 -7.622 1.00 72.05 O ATOM 2136 CB ILE B 42 1.134 4.778 -9.610 1.00 51.31 C ATOM 2137 CG1 ILE B 42 1.371 4.451 -11.095 1.00 23.10 C ATOM 2138 CG2 ILE B 42 0.386 3.623 -8.928 1.00 21.31 C ATOM 2139 CD1 ILE B 42 2.204 3.200 -11.337 1.00 33.02 C ATOM 0 H ILE B 42 2.002 7.095 -10.284 1.00 31.33 H new ATOM 0 HA ILE B 42 -0.585 5.991 -10.048 1.00 20.21 H new ATOM 0 HB ILE B 42 2.099 4.905 -9.119 1.00 51.31 H new ATOM 0 HG12 ILE B 42 0.406 4.331 -11.587 1.00 23.10 H new ATOM 0 HG13 ILE B 42 1.866 5.300 -11.567 1.00 23.10 H new ATOM 0 HG21 ILE B 42 0.961 2.703 -9.036 1.00 21.31 H new ATOM 0 HG22 ILE B 42 0.257 3.848 -7.869 1.00 21.31 H new ATOM 0 HG23 ILE B 42 -0.591 3.497 -9.394 1.00 21.31 H new ATOM 0 HD11 ILE B 42 2.322 3.043 -12.409 1.00 33.02 H new ATOM 0 HD12 ILE B 42 3.185 3.322 -10.878 1.00 33.02 H new ATOM 0 HD13 ILE B 42 1.702 2.338 -10.898 1.00 33.02 H new ATOM 2151 N VAL B 43 0.934 6.801 -7.189 1.00 1.11 N ATOM 2152 CA VAL B 43 0.659 7.071 -5.769 1.00 35.40 C ATOM 2153 C VAL B 43 -0.460 8.120 -5.630 1.00 31.14 C ATOM 2154 O VAL B 43 -1.366 7.980 -4.794 1.00 1.53 O ATOM 2155 CB VAL B 43 1.949 7.483 -4.949 1.00 5.24 C ATOM 2156 CG1 VAL B 43 2.614 8.723 -5.516 1.00 55.42 C ATOM 2157 CG2 VAL B 43 1.616 7.707 -3.481 1.00 14.35 C ATOM 0 H VAL B 43 1.896 6.976 -7.480 1.00 1.11 H new ATOM 0 HA VAL B 43 0.319 6.134 -5.328 1.00 35.40 H new ATOM 0 HB VAL B 43 2.650 6.653 -5.035 1.00 5.24 H new ATOM 0 HG11 VAL B 43 3.494 8.968 -4.922 1.00 55.42 H new ATOM 0 HG12 VAL B 43 2.913 8.536 -6.547 1.00 55.42 H new ATOM 0 HG13 VAL B 43 1.913 9.557 -5.487 1.00 55.42 H new ATOM 0 HG21 VAL B 43 2.520 7.989 -2.942 1.00 14.35 H new ATOM 0 HG22 VAL B 43 0.878 8.504 -3.393 1.00 14.35 H new ATOM 0 HG23 VAL B 43 1.211 6.789 -3.056 1.00 14.35 H new ATOM 2167 N GLY B 44 -0.426 9.130 -6.501 1.00 2.20 N ATOM 2168 CA GLY B 44 -1.452 10.146 -6.505 1.00 61.31 C ATOM 2169 C GLY B 44 -2.801 9.572 -6.884 1.00 72.11 C ATOM 2170 O GLY B 44 -3.829 9.942 -6.305 1.00 54.03 O ATOM 0 H GLY B 44 0.301 9.257 -7.205 1.00 2.20 H new ATOM 0 HA2 GLY B 44 -1.515 10.605 -5.518 1.00 61.31 H new ATOM 0 HA3 GLY B 44 -1.181 10.935 -7.207 1.00 61.31 H new ATOM 2174 N TYR B 45 -2.795 8.654 -7.844 1.00 11.33 N ATOM 2175 CA TYR B 45 -4.004 8.000 -8.301 1.00 52.31 C ATOM 2176 C TYR B 45 -4.714 7.269 -7.180 1.00 61.32 C ATOM 2177 O TYR B 45 -5.889 7.491 -6.957 1.00 40.34 O ATOM 2178 CB TYR B 45 -3.736 7.039 -9.474 1.00 35.04 C ATOM 2179 CG TYR B 45 -4.947 6.199 -9.839 1.00 22.12 C ATOM 2180 CD1 TYR B 45 -5.046 4.878 -9.422 1.00 71.01 C ATOM 2181 CD2 TYR B 45 -6.000 6.727 -10.559 1.00 41.22 C ATOM 2182 CE1 TYR B 45 -6.143 4.116 -9.717 1.00 61.54 C ATOM 2183 CE2 TYR B 45 -7.107 5.965 -10.862 1.00 45.41 C ATOM 2184 CZ TYR B 45 -7.167 4.659 -10.435 1.00 32.41 C ATOM 2185 OH TYR B 45 -8.258 3.894 -10.726 1.00 64.43 O ATOM 0 H TYR B 45 -1.949 8.346 -8.324 1.00 11.33 H new ATOM 0 HA TYR B 45 -4.659 8.795 -8.657 1.00 52.31 H new ATOM 0 HB2 TYR B 45 -3.424 7.615 -10.345 1.00 35.04 H new ATOM 0 HB3 TYR B 45 -2.908 6.380 -9.215 1.00 35.04 H new ATOM 0 HD1 TYR B 45 -4.239 4.443 -8.852 1.00 71.01 H new ATOM 0 HD2 TYR B 45 -5.955 7.754 -10.890 1.00 41.22 H new ATOM 0 HE1 TYR B 45 -6.198 3.090 -9.383 1.00 61.54 H new ATOM 0 HE2 TYR B 45 -7.921 6.390 -11.430 1.00 45.41 H new ATOM 0 HH TYR B 45 -8.589 3.471 -9.906 1.00 64.43 H new ATOM 2195 N LEU B 46 -4.014 6.404 -6.479 1.00 34.11 N ATOM 2196 CA LEU B 46 -4.657 5.635 -5.428 1.00 15.22 C ATOM 2197 C LEU B 46 -5.079 6.492 -4.246 1.00 44.54 C ATOM 2198 O LEU B 46 -6.097 6.223 -3.615 1.00 41.24 O ATOM 2199 CB LEU B 46 -3.886 4.376 -4.984 1.00 25.52 C ATOM 2200 CG LEU B 46 -3.707 3.246 -6.030 1.00 42.14 C ATOM 2201 CD1 LEU B 46 -2.677 3.587 -7.075 1.00 52.53 C ATOM 2202 CD2 LEU B 46 -3.381 1.931 -5.361 1.00 32.41 C ATOM 0 H LEU B 46 -3.020 6.215 -6.610 1.00 34.11 H new ATOM 0 HA LEU B 46 -5.566 5.257 -5.896 1.00 15.22 H new ATOM 0 HB2 LEU B 46 -2.896 4.687 -4.651 1.00 25.52 H new ATOM 0 HB3 LEU B 46 -4.397 3.956 -4.118 1.00 25.52 H new ATOM 0 HG LEU B 46 -4.662 3.142 -6.546 1.00 42.14 H new ATOM 0 HD11 LEU B 46 -2.590 2.763 -7.783 1.00 52.53 H new ATOM 0 HD12 LEU B 46 -2.981 4.490 -7.605 1.00 52.53 H new ATOM 0 HD13 LEU B 46 -1.713 3.756 -6.595 1.00 52.53 H new ATOM 0 HD21 LEU B 46 -3.261 1.157 -6.119 1.00 32.41 H new ATOM 0 HD22 LEU B 46 -2.455 2.031 -4.794 1.00 32.41 H new ATOM 0 HD23 LEU B 46 -4.191 1.655 -4.686 1.00 32.41 H new ATOM 2214 N LEU B 47 -4.310 7.509 -3.932 1.00 51.31 N ATOM 2215 CA LEU B 47 -4.668 8.387 -2.832 1.00 24.50 C ATOM 2216 C LEU B 47 -5.905 9.238 -3.160 1.00 31.42 C ATOM 2217 O LEU B 47 -6.801 9.370 -2.334 1.00 75.14 O ATOM 2218 CB LEU B 47 -3.492 9.281 -2.410 1.00 63.34 C ATOM 2219 CG LEU B 47 -2.251 8.560 -1.859 1.00 64.50 C ATOM 2220 CD1 LEU B 47 -1.164 9.565 -1.509 1.00 64.01 C ATOM 2221 CD2 LEU B 47 -2.608 7.719 -0.637 1.00 75.10 C ATOM 0 H LEU B 47 -3.443 7.750 -4.413 1.00 51.31 H new ATOM 0 HA LEU B 47 -4.919 7.744 -1.989 1.00 24.50 H new ATOM 0 HB2 LEU B 47 -3.188 9.875 -3.272 1.00 63.34 H new ATOM 0 HB3 LEU B 47 -3.847 9.978 -1.651 1.00 63.34 H new ATOM 0 HG LEU B 47 -1.874 7.893 -2.635 1.00 64.50 H new ATOM 0 HD11 LEU B 47 -0.293 9.038 -1.120 1.00 64.01 H new ATOM 0 HD12 LEU B 47 -0.882 10.122 -2.402 1.00 64.01 H new ATOM 0 HD13 LEU B 47 -1.537 10.256 -0.753 1.00 64.01 H new ATOM 0 HD21 LEU B 47 -1.714 7.219 -0.266 1.00 75.10 H new ATOM 0 HD22 LEU B 47 -3.013 8.364 0.143 1.00 75.10 H new ATOM 0 HD23 LEU B 47 -3.353 6.973 -0.914 1.00 75.10 H new ATOM 2233 N SER B 48 -5.970 9.780 -4.365 1.00 13.25 N ATOM 2234 CA SER B 48 -7.058 10.678 -4.716 1.00 52.31 C ATOM 2235 C SER B 48 -8.239 9.969 -5.425 1.00 71.50 C ATOM 2236 O SER B 48 -9.374 10.439 -5.341 1.00 43.13 O ATOM 2237 CB SER B 48 -6.512 11.828 -5.582 1.00 45.35 C ATOM 2238 OG SER B 48 -7.520 12.770 -5.933 1.00 1.11 O ATOM 0 H SER B 48 -5.291 9.617 -5.109 1.00 13.25 H new ATOM 0 HA SER B 48 -7.466 11.071 -3.785 1.00 52.31 H new ATOM 0 HB2 SER B 48 -5.714 12.338 -5.042 1.00 45.35 H new ATOM 0 HB3 SER B 48 -6.071 11.417 -6.490 1.00 45.35 H new ATOM 0 HG SER B 48 -7.127 13.481 -6.480 1.00 1.11 H new ATOM 2244 N GLY B 49 -7.986 8.848 -6.088 1.00 61.42 N ATOM 2245 CA GLY B 49 -9.049 8.166 -6.817 1.00 5.30 C ATOM 2246 C GLY B 49 -9.431 8.930 -8.076 1.00 51.14 C ATOM 2247 O GLY B 49 -10.614 9.031 -8.428 1.00 61.25 O ATOM 0 H GLY B 49 -7.072 8.398 -6.137 1.00 61.42 H new ATOM 0 HA2 GLY B 49 -8.723 7.160 -7.083 1.00 5.30 H new ATOM 0 HA3 GLY B 49 -9.923 8.058 -6.175 1.00 5.30 H new ATOM 2251 N ASP B 50 -8.429 9.465 -8.748 1.00 11.34 N ATOM 2252 CA ASP B 50 -8.632 10.281 -9.938 1.00 64.22 C ATOM 2253 C ASP B 50 -7.905 9.688 -11.143 1.00 31.33 C ATOM 2254 O ASP B 50 -6.681 9.599 -11.146 1.00 35.43 O ATOM 2255 CB ASP B 50 -8.157 11.714 -9.681 1.00 71.43 C ATOM 2256 CG ASP B 50 -8.249 12.595 -10.906 1.00 70.40 C ATOM 2257 OD1 ASP B 50 -7.223 12.816 -11.555 1.00 22.25 O ATOM 2258 OD2 ASP B 50 -9.355 13.074 -11.236 1.00 23.12 O ATOM 0 H ASP B 50 -7.450 9.348 -8.487 1.00 11.34 H new ATOM 0 HA ASP B 50 -9.698 10.295 -10.163 1.00 64.22 H new ATOM 0 HB2 ASP B 50 -8.754 12.151 -8.880 1.00 71.43 H new ATOM 0 HB3 ASP B 50 -7.124 11.692 -9.333 1.00 71.43 H new ATOM 2263 N PRO B 51 -8.654 9.270 -12.189 1.00 12.33 N ATOM 2264 CA PRO B 51 -8.079 8.632 -13.385 1.00 60.52 C ATOM 2265 C PRO B 51 -7.157 9.553 -14.188 1.00 73.31 C ATOM 2266 O PRO B 51 -6.269 9.078 -14.900 1.00 24.12 O ATOM 2267 CB PRO B 51 -9.295 8.222 -14.230 1.00 73.11 C ATOM 2268 CG PRO B 51 -10.481 8.370 -13.334 1.00 62.14 C ATOM 2269 CD PRO B 51 -10.120 9.390 -12.293 1.00 12.04 C ATOM 0 HA PRO B 51 -7.446 7.793 -13.098 1.00 60.52 H new ATOM 0 HB2 PRO B 51 -9.390 8.855 -15.112 1.00 73.11 H new ATOM 0 HB3 PRO B 51 -9.198 7.196 -14.583 1.00 73.11 H new ATOM 0 HG2 PRO B 51 -11.355 8.690 -13.901 1.00 62.14 H new ATOM 0 HG3 PRO B 51 -10.734 7.417 -12.869 1.00 62.14 H new ATOM 0 HD2 PRO B 51 -10.420 10.394 -12.593 1.00 12.04 H new ATOM 0 HD3 PRO B 51 -10.608 9.182 -11.341 1.00 12.04 H new ATOM 2277 N ALA B 52 -7.359 10.868 -14.059 1.00 73.51 N ATOM 2278 CA ALA B 52 -6.591 11.867 -14.814 1.00 12.24 C ATOM 2279 C ALA B 52 -5.096 11.843 -14.468 1.00 55.31 C ATOM 2280 O ALA B 52 -4.281 12.475 -15.150 1.00 74.35 O ATOM 2281 CB ALA B 52 -7.174 13.260 -14.635 1.00 74.33 C ATOM 0 H ALA B 52 -8.056 11.270 -13.432 1.00 73.51 H new ATOM 0 HA ALA B 52 -6.674 11.596 -15.867 1.00 12.24 H new ATOM 0 HB1 ALA B 52 -6.584 13.977 -15.206 1.00 74.33 H new ATOM 0 HB2 ALA B 52 -8.204 13.272 -14.991 1.00 74.33 H new ATOM 0 HB3 ALA B 52 -7.152 13.531 -13.579 1.00 74.33 H new ATOM 2287 N TYR B 53 -4.739 11.145 -13.399 1.00 54.50 N ATOM 2288 CA TYR B 53 -3.345 10.969 -13.043 1.00 42.42 C ATOM 2289 C TYR B 53 -2.577 10.129 -14.059 1.00 33.15 C ATOM 2290 O TYR B 53 -1.361 10.237 -14.146 1.00 62.14 O ATOM 2291 CB TYR B 53 -3.182 10.378 -11.648 1.00 0.24 C ATOM 2292 CG TYR B 53 -3.357 11.384 -10.554 1.00 64.41 C ATOM 2293 CD1 TYR B 53 -2.375 12.325 -10.334 1.00 43.21 C ATOM 2294 CD2 TYR B 53 -4.473 11.397 -9.739 1.00 14.45 C ATOM 2295 CE1 TYR B 53 -2.482 13.249 -9.343 1.00 71.35 C ATOM 2296 CE2 TYR B 53 -4.595 12.335 -8.731 1.00 65.43 C ATOM 2297 CZ TYR B 53 -3.593 13.259 -8.536 1.00 70.23 C ATOM 2298 OH TYR B 53 -3.694 14.190 -7.515 1.00 5.41 O ATOM 0 H TYR B 53 -5.398 10.693 -12.765 1.00 54.50 H new ATOM 0 HA TYR B 53 -2.914 11.970 -13.048 1.00 42.42 H new ATOM 0 HB2 TYR B 53 -3.908 9.576 -11.514 1.00 0.24 H new ATOM 0 HB3 TYR B 53 -2.192 9.929 -11.565 1.00 0.24 H new ATOM 0 HD1 TYR B 53 -1.498 12.329 -10.965 1.00 43.21 H new ATOM 0 HD2 TYR B 53 -5.256 10.669 -9.891 1.00 14.45 H new ATOM 0 HE1 TYR B 53 -1.695 13.973 -9.191 1.00 71.35 H new ATOM 0 HE2 TYR B 53 -5.471 12.343 -8.100 1.00 65.43 H new ATOM 0 HH TYR B 53 -4.541 14.063 -7.039 1.00 5.41 H new ATOM 2308 N ILE B 54 -3.270 9.305 -14.824 1.00 52.35 N ATOM 2309 CA ILE B 54 -2.592 8.467 -15.802 1.00 64.21 C ATOM 2310 C ILE B 54 -2.911 8.942 -17.225 1.00 3.45 C ATOM 2311 O ILE B 54 -4.071 8.924 -17.647 1.00 61.11 O ATOM 2312 CB ILE B 54 -2.980 6.960 -15.655 1.00 3.13 C ATOM 2313 CG1 ILE B 54 -2.750 6.475 -14.206 1.00 11.32 C ATOM 2314 CG2 ILE B 54 -2.186 6.095 -16.642 1.00 13.34 C ATOM 2315 CD1 ILE B 54 -1.317 6.605 -13.707 1.00 22.15 C ATOM 0 H ILE B 54 -4.284 9.197 -14.791 1.00 52.35 H new ATOM 0 HA ILE B 54 -1.522 8.558 -15.614 1.00 64.21 H new ATOM 0 HB ILE B 54 -4.040 6.860 -15.887 1.00 3.13 H new ATOM 0 HG12 ILE B 54 -3.404 7.040 -13.541 1.00 11.32 H new ATOM 0 HG13 ILE B 54 -3.050 5.430 -14.136 1.00 11.32 H new ATOM 0 HG21 ILE B 54 -2.472 5.050 -16.522 1.00 13.34 H new ATOM 0 HG22 ILE B 54 -2.401 6.415 -17.661 1.00 13.34 H new ATOM 0 HG23 ILE B 54 -1.120 6.204 -16.445 1.00 13.34 H new ATOM 0 HD11 ILE B 54 -1.254 6.240 -12.682 1.00 22.15 H new ATOM 0 HD12 ILE B 54 -0.656 6.017 -14.343 1.00 22.15 H new ATOM 0 HD13 ILE B 54 -1.014 7.652 -13.739 1.00 22.15 H new ATOM 2327 N PRO B 55 -1.899 9.396 -17.973 1.00 30.43 N ATOM 2328 CA PRO B 55 -2.081 9.822 -19.358 1.00 41.43 C ATOM 2329 C PRO B 55 -2.229 8.611 -20.289 1.00 63.42 C ATOM 2330 O PRO B 55 -1.499 7.605 -20.150 1.00 53.44 O ATOM 2331 CB PRO B 55 -0.791 10.589 -19.668 1.00 13.11 C ATOM 2332 CG PRO B 55 0.235 9.986 -18.767 1.00 21.30 C ATOM 2333 CD PRO B 55 -0.496 9.538 -17.528 1.00 24.32 C ATOM 0 HA PRO B 55 -2.980 10.422 -19.502 1.00 41.43 H new ATOM 0 HB2 PRO B 55 -0.509 10.483 -20.716 1.00 13.11 H new ATOM 0 HB3 PRO B 55 -0.909 11.655 -19.476 1.00 13.11 H new ATOM 0 HG2 PRO B 55 0.730 9.144 -19.251 1.00 21.30 H new ATOM 0 HG3 PRO B 55 1.009 10.712 -18.520 1.00 21.30 H new ATOM 0 HD2 PRO B 55 -0.100 8.596 -17.149 1.00 24.32 H new ATOM 0 HD3 PRO B 55 -0.404 10.268 -16.724 1.00 24.32 H new ATOM 2341 N ARG B 56 -3.140 8.686 -21.240 1.00 70.14 N ATOM 2342 CA ARG B 56 -3.366 7.554 -22.102 1.00 72.15 C ATOM 2343 C ARG B 56 -2.394 7.500 -23.286 1.00 72.24 C ATOM 2344 O ARG B 56 -2.675 7.987 -24.385 1.00 52.44 O ATOM 2345 CB ARG B 56 -4.839 7.372 -22.536 1.00 1.04 C ATOM 2346 CG ARG B 56 -5.442 8.516 -23.345 1.00 64.04 C ATOM 2347 CD ARG B 56 -6.854 8.177 -23.819 1.00 10.54 C ATOM 2348 NE ARG B 56 -6.881 6.945 -24.638 1.00 43.05 N ATOM 2349 CZ ARG B 56 -7.699 6.708 -25.676 1.00 70.45 C ATOM 2350 NH1 ARG B 56 -8.566 7.635 -26.075 1.00 14.34 N ATOM 2351 NH2 ARG B 56 -7.640 5.539 -26.311 1.00 44.24 N ATOM 0 H ARG B 56 -3.722 9.502 -21.429 1.00 70.14 H new ATOM 0 HA ARG B 56 -3.145 6.687 -21.479 1.00 72.15 H new ATOM 0 HB2 ARG B 56 -4.914 6.458 -23.125 1.00 1.04 H new ATOM 0 HB3 ARG B 56 -5.445 7.226 -21.642 1.00 1.04 H new ATOM 0 HG2 ARG B 56 -5.468 9.420 -22.737 1.00 64.04 H new ATOM 0 HG3 ARG B 56 -4.808 8.729 -24.206 1.00 64.04 H new ATOM 0 HD2 ARG B 56 -7.507 8.053 -22.955 1.00 10.54 H new ATOM 0 HD3 ARG B 56 -7.251 9.009 -24.401 1.00 10.54 H new ATOM 0 HE ARG B 56 -6.219 6.210 -24.392 1.00 43.05 H new ATOM 0 HH11 ARG B 56 -8.612 8.532 -25.592 1.00 14.34 H new ATOM 0 HH12 ARG B 56 -9.185 7.449 -26.864 1.00 14.34 H new ATOM 0 HH21 ARG B 56 -6.975 4.827 -26.008 1.00 44.24 H new ATOM 0 HH22 ARG B 56 -8.260 5.355 -27.100 1.00 44.24 H new ATOM 2365 N TYR B 57 -1.218 6.983 -23.011 1.00 4.21 N ATOM 2366 CA TYR B 57 -0.241 6.703 -24.047 1.00 20.04 C ATOM 2367 C TYR B 57 -0.603 5.407 -24.717 1.00 73.22 C ATOM 2368 O TYR B 57 -0.533 5.256 -25.945 1.00 24.32 O ATOM 2369 CB TYR B 57 1.163 6.562 -23.440 1.00 1.43 C ATOM 2370 CG TYR B 57 2.199 6.121 -24.456 1.00 64.04 C ATOM 2371 CD1 TYR B 57 2.756 7.016 -25.347 1.00 60.55 C ATOM 2372 CD2 TYR B 57 2.589 4.793 -24.532 1.00 13.42 C ATOM 2373 CE1 TYR B 57 3.659 6.614 -26.284 1.00 30.41 C ATOM 2374 CE2 TYR B 57 3.501 4.374 -25.462 1.00 24.32 C ATOM 2375 CZ TYR B 57 4.034 5.286 -26.344 1.00 34.32 C ATOM 2376 OH TYR B 57 4.927 4.867 -27.292 1.00 52.41 O ATOM 0 H TYR B 57 -0.910 6.744 -22.068 1.00 4.21 H new ATOM 0 HA TYR B 57 -0.241 7.525 -24.763 1.00 20.04 H new ATOM 0 HB2 TYR B 57 1.466 7.517 -23.010 1.00 1.43 H new ATOM 0 HB3 TYR B 57 1.131 5.840 -22.624 1.00 1.43 H new ATOM 0 HD1 TYR B 57 2.470 8.056 -25.300 1.00 60.55 H new ATOM 0 HD2 TYR B 57 2.165 4.076 -23.845 1.00 13.42 H new ATOM 0 HE1 TYR B 57 4.079 7.329 -26.976 1.00 30.41 H new ATOM 0 HE2 TYR B 57 3.800 3.337 -25.503 1.00 24.32 H new ATOM 0 HH TYR B 57 5.082 3.904 -27.193 1.00 52.41 H new ATOM 2386 N GLN B 58 -0.990 4.492 -23.900 1.00 34.53 N ATOM 2387 CA GLN B 58 -1.302 3.169 -24.286 1.00 54.04 C ATOM 2388 C GLN B 58 -2.541 2.818 -23.485 1.00 41.21 C ATOM 2389 O GLN B 58 -3.019 3.660 -22.724 1.00 1.30 O ATOM 2390 CB GLN B 58 -0.109 2.264 -23.882 1.00 33.32 C ATOM 2391 CG GLN B 58 -0.113 0.851 -24.443 1.00 43.44 C ATOM 2392 CD GLN B 58 1.057 0.038 -23.940 1.00 61.12 C ATOM 2393 OE1 GLN B 58 0.965 -0.617 -22.910 1.00 73.35 O ATOM 2394 NE2 GLN B 58 2.153 0.062 -24.659 1.00 13.31 N ATOM 0 H GLN B 58 -1.101 4.657 -22.900 1.00 34.53 H new ATOM 0 HA GLN B 58 -1.476 3.047 -25.355 1.00 54.04 H new ATOM 0 HB2 GLN B 58 0.813 2.754 -24.196 1.00 33.32 H new ATOM 0 HB3 GLN B 58 -0.082 2.200 -22.794 1.00 33.32 H new ATOM 0 HG2 GLN B 58 -1.044 0.355 -24.168 1.00 43.44 H new ATOM 0 HG3 GLN B 58 -0.083 0.893 -25.532 1.00 43.44 H new ATOM 0 HE21 GLN B 58 2.191 0.620 -25.512 1.00 13.31 H new ATOM 0 HE22 GLN B 58 2.967 -0.478 -24.366 1.00 13.31 H new ATOM 2403 N ASP B 59 -3.013 1.607 -23.615 1.00 20.34 N ATOM 2404 CA ASP B 59 -4.202 1.075 -22.910 1.00 25.45 C ATOM 2405 C ASP B 59 -4.099 1.193 -21.382 1.00 23.45 C ATOM 2406 O ASP B 59 -5.062 0.948 -20.691 1.00 65.33 O ATOM 2407 CB ASP B 59 -4.409 -0.397 -23.260 1.00 13.03 C ATOM 2408 CG ASP B 59 -4.521 -0.646 -24.737 1.00 73.35 C ATOM 2409 OD1 ASP B 59 -5.644 -0.676 -25.274 1.00 2.31 O ATOM 2410 OD2 ASP B 59 -3.471 -0.811 -25.400 1.00 20.11 O ATOM 0 H ASP B 59 -2.581 0.920 -24.232 1.00 20.34 H new ATOM 0 HA ASP B 59 -5.045 1.681 -23.242 1.00 25.45 H new ATOM 0 HB2 ASP B 59 -3.577 -0.978 -22.863 1.00 13.03 H new ATOM 0 HB3 ASP B 59 -5.313 -0.757 -22.768 1.00 13.03 H new ATOM 2415 N ALA B 60 -2.918 1.535 -20.876 1.00 22.13 N ATOM 2416 CA ALA B 60 -2.610 1.566 -19.437 1.00 31.32 C ATOM 2417 C ALA B 60 -3.666 2.292 -18.591 1.00 1.34 C ATOM 2418 O ALA B 60 -4.021 1.806 -17.514 1.00 4.04 O ATOM 2419 CB ALA B 60 -1.267 2.219 -19.223 1.00 63.12 C ATOM 0 H ALA B 60 -2.127 1.805 -21.461 1.00 22.13 H new ATOM 0 HA ALA B 60 -2.602 0.528 -19.103 1.00 31.32 H new ATOM 0 HB1 ALA B 60 -1.039 2.242 -18.157 1.00 63.12 H new ATOM 0 HB2 ALA B 60 -0.498 1.650 -19.746 1.00 63.12 H new ATOM 0 HB3 ALA B 60 -1.292 3.237 -19.611 1.00 63.12 H new ATOM 2425 N ARG B 61 -4.178 3.425 -19.076 1.00 12.23 N ATOM 2426 CA ARG B 61 -5.209 4.159 -18.352 1.00 25.42 C ATOM 2427 C ARG B 61 -6.484 3.317 -18.260 1.00 51.25 C ATOM 2428 O ARG B 61 -7.186 3.338 -17.252 1.00 24.41 O ATOM 2429 CB ARG B 61 -5.478 5.528 -18.998 1.00 63.24 C ATOM 2430 CG ARG B 61 -6.566 6.353 -18.312 1.00 22.51 C ATOM 2431 CD ARG B 61 -6.698 7.721 -18.952 1.00 61.24 C ATOM 2432 NE ARG B 61 -7.770 8.528 -18.350 1.00 73.25 N ATOM 2433 CZ ARG B 61 -7.664 9.833 -18.033 1.00 23.20 C ATOM 2434 NH1 ARG B 61 -6.479 10.449 -18.083 1.00 30.24 N ATOM 2435 NH2 ARG B 61 -8.740 10.500 -17.613 1.00 4.14 N ATOM 0 H ARG B 61 -3.896 3.849 -19.960 1.00 12.23 H new ATOM 0 HA ARG B 61 -4.854 4.352 -17.340 1.00 25.42 H new ATOM 0 HB2 ARG B 61 -4.552 6.102 -19.000 1.00 63.24 H new ATOM 0 HB3 ARG B 61 -5.760 5.374 -20.040 1.00 63.24 H new ATOM 0 HG2 ARG B 61 -7.518 5.826 -18.372 1.00 22.51 H new ATOM 0 HG3 ARG B 61 -6.330 6.464 -17.254 1.00 22.51 H new ATOM 0 HD2 ARG B 61 -5.752 8.254 -18.859 1.00 61.24 H new ATOM 0 HD3 ARG B 61 -6.893 7.602 -20.018 1.00 61.24 H new ATOM 0 HE ARG B 61 -8.659 8.066 -18.158 1.00 73.25 H new ATOM 0 HH11 ARG B 61 -5.646 9.931 -18.363 1.00 30.24 H new ATOM 0 HH12 ARG B 61 -6.407 11.437 -17.841 1.00 30.24 H new ATOM 0 HH21 ARG B 61 -9.637 10.022 -17.533 1.00 4.14 H new ATOM 0 HH22 ARG B 61 -8.665 11.488 -17.372 1.00 4.14 H new ATOM 2449 N ASN B 62 -6.746 2.549 -19.298 1.00 53.25 N ATOM 2450 CA ASN B 62 -7.897 1.665 -19.324 1.00 21.13 C ATOM 2451 C ASN B 62 -7.677 0.508 -18.357 1.00 44.44 C ATOM 2452 O ASN B 62 -8.567 0.161 -17.596 1.00 35.22 O ATOM 2453 CB ASN B 62 -8.176 1.130 -20.739 1.00 60.22 C ATOM 2454 CG ASN B 62 -9.447 0.287 -20.793 1.00 22.21 C ATOM 2455 OD1 ASN B 62 -10.552 0.817 -20.940 1.00 33.21 O ATOM 2456 ND2 ASN B 62 -9.305 -1.019 -20.727 1.00 73.41 N ATOM 0 H ASN B 62 -6.173 2.518 -20.142 1.00 53.25 H new ATOM 0 HA ASN B 62 -8.770 2.240 -19.015 1.00 21.13 H new ATOM 0 HB2 ASN B 62 -8.267 1.967 -21.431 1.00 60.22 H new ATOM 0 HB3 ASN B 62 -7.329 0.530 -21.073 1.00 60.22 H new ATOM 0 HD21 ASN B 62 -10.122 -1.625 -20.798 1.00 73.41 H new ATOM 0 HD22 ASN B 62 -8.378 -1.426 -20.605 1.00 73.41 H new ATOM 2463 N LEU B 63 -6.467 -0.073 -18.383 1.00 33.13 N ATOM 2464 CA LEU B 63 -6.118 -1.171 -17.466 1.00 22.01 C ATOM 2465 C LEU B 63 -6.249 -0.759 -16.018 1.00 54.51 C ATOM 2466 O LEU B 63 -6.858 -1.475 -15.220 1.00 44.24 O ATOM 2467 CB LEU B 63 -4.698 -1.766 -17.699 1.00 24.40 C ATOM 2468 CG LEU B 63 -4.472 -2.690 -18.911 1.00 42.30 C ATOM 2469 CD1 LEU B 63 -5.458 -3.824 -18.927 1.00 73.02 C ATOM 2470 CD2 LEU B 63 -4.477 -1.955 -20.207 1.00 4.32 C ATOM 0 H LEU B 63 -5.719 0.196 -19.023 1.00 33.13 H new ATOM 0 HA LEU B 63 -6.842 -1.954 -17.695 1.00 22.01 H new ATOM 0 HB2 LEU B 63 -4.001 -0.933 -17.784 1.00 24.40 H new ATOM 0 HB3 LEU B 63 -4.422 -2.322 -16.803 1.00 24.40 H new ATOM 0 HG LEU B 63 -3.473 -3.110 -18.795 1.00 42.30 H new ATOM 0 HD11 LEU B 63 -5.271 -4.457 -19.795 1.00 73.02 H new ATOM 0 HD12 LEU B 63 -5.349 -4.414 -18.017 1.00 73.02 H new ATOM 0 HD13 LEU B 63 -6.471 -3.425 -18.981 1.00 73.02 H new ATOM 0 HD21 LEU B 63 -4.313 -2.657 -21.024 1.00 4.32 H new ATOM 0 HD22 LEU B 63 -5.439 -1.460 -20.341 1.00 4.32 H new ATOM 0 HD23 LEU B 63 -3.682 -1.209 -20.205 1.00 4.32 H new ATOM 2482 N ILE B 64 -5.701 0.390 -15.674 1.00 14.32 N ATOM 2483 CA ILE B 64 -5.722 0.830 -14.293 1.00 21.03 C ATOM 2484 C ILE B 64 -7.153 1.162 -13.857 1.00 0.13 C ATOM 2485 O ILE B 64 -7.544 0.882 -12.731 1.00 13.23 O ATOM 2486 CB ILE B 64 -4.729 2.011 -14.025 1.00 64.41 C ATOM 2487 CG1 ILE B 64 -4.594 2.278 -12.522 1.00 15.23 C ATOM 2488 CG2 ILE B 64 -5.161 3.281 -14.752 1.00 73.44 C ATOM 2489 CD1 ILE B 64 -3.565 3.341 -12.178 1.00 34.41 C ATOM 0 H ILE B 64 -5.241 1.029 -16.323 1.00 14.32 H new ATOM 0 HA ILE B 64 -5.368 0.003 -13.677 1.00 21.03 H new ATOM 0 HB ILE B 64 -3.756 1.715 -14.416 1.00 64.41 H new ATOM 0 HG12 ILE B 64 -5.563 2.583 -12.128 1.00 15.23 H new ATOM 0 HG13 ILE B 64 -4.324 1.349 -12.020 1.00 15.23 H new ATOM 0 HG21 ILE B 64 -4.449 4.080 -14.543 1.00 73.44 H new ATOM 0 HG22 ILE B 64 -5.192 3.093 -15.825 1.00 73.44 H new ATOM 0 HG23 ILE B 64 -6.151 3.579 -14.407 1.00 73.44 H new ATOM 0 HD11 ILE B 64 -3.527 3.474 -11.097 1.00 34.41 H new ATOM 0 HD12 ILE B 64 -2.585 3.030 -12.540 1.00 34.41 H new ATOM 0 HD13 ILE B 64 -3.844 4.283 -12.650 1.00 34.41 H new ATOM 2501 N ARG B 65 -7.949 1.674 -14.792 1.00 52.30 N ATOM 2502 CA ARG B 65 -9.330 2.014 -14.523 1.00 72.24 C ATOM 2503 C ARG B 65 -10.273 0.819 -14.556 1.00 12.32 C ATOM 2504 O ARG B 65 -11.483 0.969 -14.423 1.00 51.43 O ATOM 2505 CB ARG B 65 -9.816 3.155 -15.400 1.00 61.03 C ATOM 2506 CG ARG B 65 -9.230 4.500 -14.989 1.00 30.04 C ATOM 2507 CD ARG B 65 -9.575 4.794 -13.529 1.00 44.53 C ATOM 2508 NE ARG B 65 -11.024 4.727 -13.303 1.00 1.32 N ATOM 2509 CZ ARG B 65 -11.609 4.154 -12.245 1.00 51.12 C ATOM 2510 NH1 ARG B 65 -10.886 3.696 -11.246 1.00 32.35 N ATOM 2511 NH2 ARG B 65 -12.917 4.055 -12.183 1.00 60.03 N ATOM 0 H ARG B 65 -7.651 1.861 -15.749 1.00 52.30 H new ATOM 0 HA ARG B 65 -9.349 2.367 -13.492 1.00 72.24 H new ATOM 0 HB2 ARG B 65 -9.552 2.949 -16.437 1.00 61.03 H new ATOM 0 HB3 ARG B 65 -10.904 3.207 -15.353 1.00 61.03 H new ATOM 0 HG2 ARG B 65 -8.148 4.491 -15.121 1.00 30.04 H new ATOM 0 HG3 ARG B 65 -9.623 5.289 -15.630 1.00 30.04 H new ATOM 0 HD2 ARG B 65 -9.070 4.077 -12.882 1.00 44.53 H new ATOM 0 HD3 ARG B 65 -9.207 5.784 -13.258 1.00 44.53 H new ATOM 0 HE ARG B 65 -11.631 5.149 -14.006 1.00 1.32 H new ATOM 0 HH11 ARG B 65 -9.870 3.776 -11.273 1.00 32.35 H new ATOM 0 HH12 ARG B 65 -11.342 3.261 -10.444 1.00 32.35 H new ATOM 0 HH21 ARG B 65 -13.492 4.416 -12.944 1.00 60.03 H new ATOM 0 HH22 ARG B 65 -13.358 3.617 -11.374 1.00 60.03 H new ATOM 2525 N ARG B 66 -9.714 -0.374 -14.718 1.00 75.11 N ATOM 2526 CA ARG B 66 -10.495 -1.606 -14.602 1.00 3.42 C ATOM 2527 C ARG B 66 -10.623 -1.969 -13.125 1.00 65.54 C ATOM 2528 O ARG B 66 -11.342 -2.899 -12.745 1.00 71.51 O ATOM 2529 CB ARG B 66 -9.834 -2.771 -15.350 1.00 53.45 C ATOM 2530 CG ARG B 66 -9.772 -2.622 -16.861 1.00 71.05 C ATOM 2531 CD ARG B 66 -9.076 -3.820 -17.498 1.00 2.20 C ATOM 2532 NE ARG B 66 -9.737 -5.090 -17.147 1.00 21.43 N ATOM 2533 CZ ARG B 66 -9.200 -6.316 -17.303 1.00 23.43 C ATOM 2534 NH1 ARG B 66 -8.035 -6.464 -17.929 1.00 70.21 N ATOM 2535 NH2 ARG B 66 -9.857 -7.386 -16.865 1.00 50.54 N ATOM 0 H ARG B 66 -8.727 -0.518 -14.929 1.00 75.11 H new ATOM 0 HA ARG B 66 -11.475 -1.433 -15.048 1.00 3.42 H new ATOM 0 HB2 ARG B 66 -8.819 -2.895 -14.972 1.00 53.45 H new ATOM 0 HB3 ARG B 66 -10.376 -3.687 -15.114 1.00 53.45 H new ATOM 0 HG2 ARG B 66 -10.781 -2.527 -17.263 1.00 71.05 H new ATOM 0 HG3 ARG B 66 -9.238 -1.707 -17.119 1.00 71.05 H new ATOM 0 HD2 ARG B 66 -9.069 -3.702 -18.582 1.00 2.20 H new ATOM 0 HD3 ARG B 66 -8.036 -3.850 -17.174 1.00 2.20 H new ATOM 0 HE ARG B 66 -10.677 -5.036 -16.754 1.00 21.43 H new ATOM 0 HH11 ARG B 66 -7.544 -5.647 -18.293 1.00 70.21 H new ATOM 0 HH12 ARG B 66 -7.633 -7.394 -18.045 1.00 70.21 H new ATOM 0 HH21 ARG B 66 -10.765 -7.277 -16.413 1.00 50.54 H new ATOM 0 HH22 ARG B 66 -9.453 -8.315 -16.982 1.00 50.54 H new ATOM 2549 N HIS B 67 -9.914 -1.220 -12.304 1.00 63.25 N ATOM 2550 CA HIS B 67 -9.878 -1.424 -10.879 1.00 44.03 C ATOM 2551 C HIS B 67 -10.138 -0.062 -10.269 1.00 71.01 C ATOM 2552 O HIS B 67 -9.951 0.942 -10.950 1.00 4.21 O ATOM 2553 CB HIS B 67 -8.459 -1.862 -10.430 1.00 73.22 C ATOM 2554 CG HIS B 67 -7.790 -2.938 -11.261 1.00 43.14 C ATOM 2555 ND1 HIS B 67 -7.760 -4.269 -10.927 1.00 13.03 N ATOM 2556 CD2 HIS B 67 -7.079 -2.836 -12.411 1.00 22.40 C ATOM 2557 CE1 HIS B 67 -7.061 -4.936 -11.830 1.00 71.21 C ATOM 2558 NE2 HIS B 67 -6.639 -4.083 -12.740 1.00 45.41 N ATOM 0 H HIS B 67 -9.338 -0.440 -12.620 1.00 63.25 H new ATOM 0 HA HIS B 67 -10.599 -2.185 -10.580 1.00 44.03 H new ATOM 0 HB2 HIS B 67 -7.815 -0.983 -10.428 1.00 73.22 H new ATOM 0 HB3 HIS B 67 -8.520 -2.215 -9.400 1.00 73.22 H new ATOM 0 HD1 HIS B 67 -8.208 -4.680 -10.108 1.00 13.03 H new ATOM 0 HD2 HIS B 67 -6.894 -1.929 -12.967 1.00 22.40 H new ATOM 0 HE1 HIS B 67 -6.869 -5.999 -11.822 1.00 71.21 H new ATOM 2567 N GLU B 68 -10.573 0.002 -9.037 1.00 53.31 N ATOM 2568 CA GLU B 68 -10.701 1.288 -8.401 1.00 24.04 C ATOM 2569 C GLU B 68 -9.368 1.731 -7.809 1.00 10.14 C ATOM 2570 O GLU B 68 -8.663 2.528 -8.429 1.00 62.14 O ATOM 2571 CB GLU B 68 -11.846 1.351 -7.391 1.00 30.31 C ATOM 2572 CG GLU B 68 -13.233 1.305 -8.017 1.00 32.33 C ATOM 2573 CD GLU B 68 -13.487 2.479 -8.950 1.00 74.35 C ATOM 2574 OE1 GLU B 68 -13.567 2.277 -10.181 1.00 55.21 O ATOM 2575 OE2 GLU B 68 -13.590 3.627 -8.472 1.00 74.53 O ATOM 0 H GLU B 68 -10.839 -0.800 -8.465 1.00 53.31 H new ATOM 0 HA GLU B 68 -10.974 2.004 -9.176 1.00 24.04 H new ATOM 0 HB2 GLU B 68 -11.747 0.519 -6.694 1.00 30.31 H new ATOM 0 HB3 GLU B 68 -11.752 2.268 -6.809 1.00 30.31 H new ATOM 0 HG2 GLU B 68 -13.348 0.373 -8.570 1.00 32.33 H new ATOM 0 HG3 GLU B 68 -13.985 1.302 -7.228 1.00 32.33 H new ATOM 2582 N ARG B 69 -8.995 1.196 -6.646 1.00 41.02 N ATOM 2583 CA ARG B 69 -7.715 1.554 -6.033 1.00 73.24 C ATOM 2584 C ARG B 69 -7.281 0.635 -4.877 1.00 61.00 C ATOM 2585 O ARG B 69 -6.142 0.173 -4.866 1.00 1.12 O ATOM 2586 CB ARG B 69 -7.660 3.044 -5.624 1.00 41.12 C ATOM 2587 CG ARG B 69 -8.805 3.485 -4.751 1.00 1.33 C ATOM 2588 CD ARG B 69 -8.680 4.932 -4.371 1.00 42.02 C ATOM 2589 NE ARG B 69 -9.796 5.379 -3.550 1.00 71.30 N ATOM 2590 CZ ARG B 69 -9.709 6.278 -2.562 1.00 21.50 C ATOM 2591 NH1 ARG B 69 -8.525 6.810 -2.239 1.00 3.21 N ATOM 2592 NH2 ARG B 69 -10.804 6.639 -1.898 1.00 30.44 N ATOM 0 H ARG B 69 -9.550 0.524 -6.116 1.00 41.02 H new ATOM 0 HA ARG B 69 -6.979 1.393 -6.821 1.00 73.24 H new ATOM 0 HB2 ARG B 69 -6.724 3.231 -5.098 1.00 41.12 H new ATOM 0 HB3 ARG B 69 -7.648 3.657 -6.525 1.00 41.12 H new ATOM 0 HG2 ARG B 69 -9.747 3.325 -5.276 1.00 1.33 H new ATOM 0 HG3 ARG B 69 -8.834 2.872 -3.850 1.00 1.33 H new ATOM 0 HD2 ARG B 69 -7.747 5.085 -3.829 1.00 42.02 H new ATOM 0 HD3 ARG B 69 -8.628 5.541 -5.274 1.00 42.02 H new ATOM 0 HE ARG B 69 -10.713 4.977 -3.742 1.00 71.30 H new ATOM 0 HH11 ARG B 69 -7.685 6.531 -2.746 1.00 3.21 H new ATOM 0 HH12 ARG B 69 -8.462 7.495 -1.486 1.00 3.21 H new ATOM 0 HH21 ARG B 69 -11.706 6.231 -2.142 1.00 30.44 H new ATOM 0 HH22 ARG B 69 -10.741 7.324 -1.145 1.00 30.44 H new ATOM 2606 N ASP B 70 -8.172 0.346 -3.925 1.00 51.21 N ATOM 2607 CA ASP B 70 -7.779 -0.465 -2.741 1.00 34.12 C ATOM 2608 C ASP B 70 -7.396 -1.889 -3.106 1.00 60.02 C ATOM 2609 O ASP B 70 -6.469 -2.453 -2.518 1.00 42.01 O ATOM 2610 CB ASP B 70 -8.803 -0.426 -1.572 1.00 43.24 C ATOM 2611 CG ASP B 70 -10.185 -0.936 -1.917 1.00 22.24 C ATOM 2612 OD1 ASP B 70 -11.100 -0.107 -2.087 1.00 23.02 O ATOM 2613 OD2 ASP B 70 -10.374 -2.138 -2.029 1.00 31.23 O ATOM 0 H ASP B 70 -9.147 0.646 -3.936 1.00 51.21 H new ATOM 0 HA ASP B 70 -6.883 0.026 -2.361 1.00 34.12 H new ATOM 0 HB2 ASP B 70 -8.410 -1.017 -0.744 1.00 43.24 H new ATOM 0 HB3 ASP B 70 -8.889 0.601 -1.218 1.00 43.24 H new ATOM 2618 N GLU B 71 -8.075 -2.442 -4.103 1.00 31.10 N ATOM 2619 CA GLU B 71 -7.787 -3.779 -4.631 1.00 1.24 C ATOM 2620 C GLU B 71 -6.309 -3.847 -5.042 1.00 72.33 C ATOM 2621 O GLU B 71 -5.587 -4.788 -4.702 1.00 71.11 O ATOM 2622 CB GLU B 71 -8.671 -4.011 -5.864 1.00 3.53 C ATOM 2623 CG GLU B 71 -8.583 -5.380 -6.498 1.00 1.42 C ATOM 2624 CD GLU B 71 -9.370 -5.449 -7.790 1.00 15.00 C ATOM 2625 OE1 GLU B 71 -8.747 -5.541 -8.874 1.00 42.51 O ATOM 2626 OE2 GLU B 71 -10.608 -5.368 -7.764 1.00 60.21 O ATOM 0 H GLU B 71 -8.849 -1.975 -4.575 1.00 31.10 H new ATOM 0 HA GLU B 71 -7.989 -4.539 -3.877 1.00 1.24 H new ATOM 0 HB2 GLU B 71 -9.708 -3.830 -5.581 1.00 3.53 H new ATOM 0 HB3 GLU B 71 -8.411 -3.267 -6.617 1.00 3.53 H new ATOM 0 HG2 GLU B 71 -7.539 -5.624 -6.694 1.00 1.42 H new ATOM 0 HG3 GLU B 71 -8.960 -6.129 -5.801 1.00 1.42 H new ATOM 2633 N ILE B 72 -5.874 -2.802 -5.742 1.00 13.12 N ATOM 2634 CA ILE B 72 -4.506 -2.681 -6.228 1.00 25.42 C ATOM 2635 C ILE B 72 -3.549 -2.437 -5.069 1.00 34.11 C ATOM 2636 O ILE B 72 -2.465 -3.024 -5.002 1.00 73.34 O ATOM 2637 CB ILE B 72 -4.378 -1.492 -7.230 1.00 74.02 C ATOM 2638 CG1 ILE B 72 -5.273 -1.701 -8.459 1.00 73.21 C ATOM 2639 CG2 ILE B 72 -2.921 -1.265 -7.648 1.00 74.30 C ATOM 2640 CD1 ILE B 72 -5.200 -0.567 -9.470 1.00 31.04 C ATOM 0 H ILE B 72 -6.468 -2.010 -5.989 1.00 13.12 H new ATOM 0 HA ILE B 72 -4.252 -3.614 -6.731 1.00 25.42 H new ATOM 0 HB ILE B 72 -4.719 -0.595 -6.714 1.00 74.02 H new ATOM 0 HG12 ILE B 72 -4.989 -2.632 -8.950 1.00 73.21 H new ATOM 0 HG13 ILE B 72 -6.306 -1.816 -8.130 1.00 73.21 H new ATOM 0 HG21 ILE B 72 -2.869 -0.430 -8.346 1.00 74.30 H new ATOM 0 HG22 ILE B 72 -2.321 -1.040 -6.767 1.00 74.30 H new ATOM 0 HG23 ILE B 72 -2.536 -2.164 -8.129 1.00 74.30 H new ATOM 0 HD11 ILE B 72 -5.859 -0.786 -10.310 1.00 31.04 H new ATOM 0 HD12 ILE B 72 -5.513 0.364 -8.996 1.00 31.04 H new ATOM 0 HD13 ILE B 72 -4.176 -0.465 -9.829 1.00 31.04 H new ATOM 2652 N MET B 73 -3.976 -1.590 -4.151 1.00 72.22 N ATOM 2653 CA MET B 73 -3.140 -1.161 -3.045 1.00 30.32 C ATOM 2654 C MET B 73 -2.760 -2.354 -2.160 1.00 25.21 C ATOM 2655 O MET B 73 -1.618 -2.430 -1.674 1.00 15.20 O ATOM 2656 CB MET B 73 -3.836 -0.034 -2.258 1.00 12.01 C ATOM 2657 CG MET B 73 -2.939 0.790 -1.312 1.00 70.01 C ATOM 2658 SD MET B 73 -2.251 -0.126 0.071 1.00 65.32 S ATOM 2659 CE MET B 73 -1.295 1.145 0.864 1.00 0.14 C ATOM 0 H MET B 73 -4.910 -1.181 -4.151 1.00 72.22 H new ATOM 0 HA MET B 73 -2.208 -0.752 -3.435 1.00 30.32 H new ATOM 0 HB2 MET B 73 -4.298 0.648 -2.972 1.00 12.01 H new ATOM 0 HB3 MET B 73 -4.641 -0.474 -1.670 1.00 12.01 H new ATOM 0 HG2 MET B 73 -2.119 1.214 -1.891 1.00 70.01 H new ATOM 0 HG3 MET B 73 -3.520 1.626 -0.922 1.00 70.01 H new ATOM 0 HE1 MET B 73 -1.069 0.845 1.887 1.00 0.14 H new ATOM 0 HE2 MET B 73 -0.365 1.296 0.316 1.00 0.14 H new ATOM 0 HE3 MET B 73 -1.864 2.075 0.876 1.00 0.14 H new ATOM 2669 N GLU B 74 -3.692 -3.314 -1.976 1.00 51.30 N ATOM 2670 CA GLU B 74 -3.349 -4.515 -1.222 1.00 52.41 C ATOM 2671 C GLU B 74 -2.187 -5.219 -1.843 1.00 60.30 C ATOM 2672 O GLU B 74 -1.249 -5.536 -1.156 1.00 12.52 O ATOM 2673 CB GLU B 74 -4.461 -5.531 -1.093 1.00 55.21 C ATOM 2674 CG GLU B 74 -5.654 -5.131 -0.277 1.00 34.24 C ATOM 2675 CD GLU B 74 -6.515 -6.335 -0.028 1.00 53.31 C ATOM 2676 OE1 GLU B 74 -7.231 -6.764 -0.956 1.00 22.13 O ATOM 2677 OE2 GLU B 74 -6.441 -6.914 1.094 1.00 42.32 O ATOM 0 H GLU B 74 -4.649 -3.276 -2.328 1.00 51.30 H new ATOM 0 HA GLU B 74 -3.122 -4.138 -0.225 1.00 52.41 H new ATOM 0 HB2 GLU B 74 -4.806 -5.786 -2.095 1.00 55.21 H new ATOM 0 HB3 GLU B 74 -4.042 -6.439 -0.659 1.00 55.21 H new ATOM 0 HG2 GLU B 74 -5.332 -4.699 0.670 1.00 34.24 H new ATOM 0 HG3 GLU B 74 -6.225 -4.364 -0.800 1.00 34.24 H new ATOM 2684 N GLU B 75 -2.243 -5.444 -3.161 1.00 71.11 N ATOM 2685 CA GLU B 75 -1.175 -6.171 -3.839 1.00 14.03 C ATOM 2686 C GLU B 75 0.145 -5.449 -3.655 1.00 71.34 C ATOM 2687 O GLU B 75 1.151 -6.072 -3.393 1.00 54.32 O ATOM 2688 CB GLU B 75 -1.469 -6.396 -5.327 1.00 21.41 C ATOM 2689 CG GLU B 75 -0.438 -7.311 -6.010 1.00 2.31 C ATOM 2690 CD GLU B 75 -0.723 -7.589 -7.473 1.00 51.53 C ATOM 2691 OE1 GLU B 75 -0.049 -7.000 -8.344 1.00 43.34 O ATOM 2692 OE2 GLU B 75 -1.608 -8.411 -7.766 1.00 3.25 O ATOM 0 H GLU B 75 -3.004 -5.137 -3.767 1.00 71.11 H new ATOM 0 HA GLU B 75 -1.112 -7.158 -3.381 1.00 14.03 H new ATOM 0 HB2 GLU B 75 -2.462 -6.833 -5.434 1.00 21.41 H new ATOM 0 HB3 GLU B 75 -1.488 -5.433 -5.838 1.00 21.41 H new ATOM 0 HG2 GLU B 75 0.548 -6.855 -5.924 1.00 2.31 H new ATOM 0 HG3 GLU B 75 -0.399 -8.259 -5.473 1.00 2.31 H new ATOM 2699 N LEU B 76 0.117 -4.125 -3.743 1.00 30.41 N ATOM 2700 CA LEU B 76 1.317 -3.317 -3.529 1.00 61.12 C ATOM 2701 C LEU B 76 1.924 -3.606 -2.158 1.00 31.23 C ATOM 2702 O LEU B 76 3.104 -3.889 -2.048 1.00 1.34 O ATOM 2703 CB LEU B 76 0.996 -1.821 -3.631 1.00 31.30 C ATOM 2704 CG LEU B 76 0.487 -1.321 -4.975 1.00 12.22 C ATOM 2705 CD1 LEU B 76 0.163 0.158 -4.900 1.00 2.04 C ATOM 2706 CD2 LEU B 76 1.523 -1.569 -6.048 1.00 44.13 C ATOM 0 H LEU B 76 -0.721 -3.586 -3.961 1.00 30.41 H new ATOM 0 HA LEU B 76 2.034 -3.582 -4.306 1.00 61.12 H new ATOM 0 HB2 LEU B 76 0.250 -1.581 -2.874 1.00 31.30 H new ATOM 0 HB3 LEU B 76 1.897 -1.262 -3.379 1.00 31.30 H new ATOM 0 HG LEU B 76 -0.423 -1.866 -5.227 1.00 12.22 H new ATOM 0 HD11 LEU B 76 -0.200 0.501 -5.869 1.00 2.04 H new ATOM 0 HD12 LEU B 76 -0.606 0.324 -4.145 1.00 2.04 H new ATOM 0 HD13 LEU B 76 1.061 0.714 -4.632 1.00 2.04 H new ATOM 0 HD21 LEU B 76 1.149 -1.207 -7.006 1.00 44.13 H new ATOM 0 HD22 LEU B 76 2.442 -1.041 -5.795 1.00 44.13 H new ATOM 0 HD23 LEU B 76 1.726 -2.638 -6.118 1.00 44.13 H new ATOM 2718 N THR B 77 1.093 -3.574 -1.135 1.00 55.40 N ATOM 2719 CA THR B 77 1.549 -3.779 0.229 1.00 23.05 C ATOM 2720 C THR B 77 1.918 -5.264 0.497 1.00 3.22 C ATOM 2721 O THR B 77 2.986 -5.581 1.045 1.00 14.22 O ATOM 2722 CB THR B 77 0.442 -3.333 1.212 1.00 12.31 C ATOM 2723 OG1 THR B 77 0.090 -1.972 0.935 1.00 15.50 O ATOM 2724 CG2 THR B 77 0.906 -3.439 2.656 1.00 0.14 C ATOM 0 H THR B 77 0.091 -3.407 -1.222 1.00 55.40 H new ATOM 0 HA THR B 77 2.448 -3.181 0.377 1.00 23.05 H new ATOM 0 HB THR B 77 -0.418 -3.989 1.078 1.00 12.31 H new ATOM 0 HG1 THR B 77 -0.859 -1.922 0.695 1.00 15.50 H new ATOM 0 HG21 THR B 77 0.104 -3.118 3.320 1.00 0.14 H new ATOM 0 HG22 THR B 77 1.169 -4.473 2.879 1.00 0.14 H new ATOM 0 HG23 THR B 77 1.778 -2.802 2.806 1.00 0.14 H new ATOM 2732 N LYS B 78 1.045 -6.142 0.076 1.00 52.30 N ATOM 2733 CA LYS B 78 1.118 -7.533 0.315 1.00 61.15 C ATOM 2734 C LYS B 78 2.268 -8.190 -0.456 1.00 15.14 C ATOM 2735 O LYS B 78 2.997 -9.020 0.087 1.00 41.43 O ATOM 2736 CB LYS B 78 -0.240 -8.065 -0.081 1.00 43.25 C ATOM 2737 CG LYS B 78 -0.495 -9.490 0.119 1.00 61.02 C ATOM 2738 CD LYS B 78 -1.957 -9.769 -0.138 1.00 50.13 C ATOM 2739 CE LYS B 78 -2.285 -11.187 0.160 1.00 11.11 C ATOM 2740 NZ LYS B 78 -3.718 -11.493 -0.046 1.00 15.41 N ATOM 0 H LYS B 78 0.226 -5.876 -0.471 1.00 52.30 H new ATOM 0 HA LYS B 78 1.341 -7.760 1.357 1.00 61.15 H new ATOM 0 HB2 LYS B 78 -0.994 -7.508 0.475 1.00 43.25 H new ATOM 0 HB3 LYS B 78 -0.393 -7.842 -1.137 1.00 43.25 H new ATOM 0 HG2 LYS B 78 0.125 -10.082 -0.554 1.00 61.02 H new ATOM 0 HG3 LYS B 78 -0.229 -9.781 1.135 1.00 61.02 H new ATOM 0 HD2 LYS B 78 -2.571 -9.112 0.478 1.00 50.13 H new ATOM 0 HD3 LYS B 78 -2.197 -9.547 -1.178 1.00 50.13 H new ATOM 0 HE2 LYS B 78 -1.683 -11.837 -0.475 1.00 11.11 H new ATOM 0 HE3 LYS B 78 -2.014 -11.410 1.192 1.00 11.11 H new ATOM 0 HZ1 LYS B 78 -3.895 -12.494 0.175 1.00 15.41 H new ATOM 0 HZ2 LYS B 78 -4.294 -10.893 0.579 1.00 15.41 H new ATOM 0 HZ3 LYS B 78 -3.974 -11.307 -1.037 1.00 15.41 H new ATOM 2754 N TYR B 79 2.446 -7.804 -1.700 1.00 40.30 N ATOM 2755 CA TYR B 79 3.506 -8.366 -2.514 1.00 64.24 C ATOM 2756 C TYR B 79 4.854 -7.801 -2.044 1.00 60.35 C ATOM 2757 O TYR B 79 5.869 -8.488 -2.082 1.00 74.21 O ATOM 2758 CB TYR B 79 3.248 -8.057 -3.989 1.00 63.33 C ATOM 2759 CG TYR B 79 4.139 -8.762 -4.973 1.00 11.15 C ATOM 2760 CD1 TYR B 79 3.732 -9.947 -5.564 1.00 10.00 C ATOM 2761 CD2 TYR B 79 5.361 -8.237 -5.332 1.00 64.24 C ATOM 2762 CE1 TYR B 79 4.525 -10.592 -6.485 1.00 14.13 C ATOM 2763 CE2 TYR B 79 6.159 -8.869 -6.252 1.00 13.34 C ATOM 2764 CZ TYR B 79 5.740 -10.048 -6.827 1.00 61.24 C ATOM 2765 OH TYR B 79 6.541 -10.687 -7.751 1.00 13.21 O ATOM 0 H TYR B 79 1.873 -7.104 -2.171 1.00 40.30 H new ATOM 0 HA TYR B 79 3.531 -9.450 -2.404 1.00 64.24 H new ATOM 0 HB2 TYR B 79 2.213 -8.312 -4.218 1.00 63.33 H new ATOM 0 HB3 TYR B 79 3.352 -6.982 -4.139 1.00 63.33 H new ATOM 0 HD1 TYR B 79 2.776 -10.372 -5.297 1.00 10.00 H new ATOM 0 HD2 TYR B 79 5.696 -7.314 -4.882 1.00 64.24 H new ATOM 0 HE1 TYR B 79 4.196 -11.517 -6.935 1.00 14.13 H new ATOM 0 HE2 TYR B 79 7.113 -8.443 -6.524 1.00 13.34 H new ATOM 0 HH TYR B 79 7.364 -10.172 -7.882 1.00 13.21 H new ATOM 2775 N TYR B 80 4.836 -6.546 -1.586 1.00 41.21 N ATOM 2776 CA TYR B 80 6.017 -5.885 -1.022 1.00 60.44 C ATOM 2777 C TYR B 80 6.572 -6.703 0.141 1.00 23.11 C ATOM 2778 O TYR B 80 7.748 -7.089 0.142 1.00 14.53 O ATOM 2779 CB TYR B 80 5.629 -4.471 -0.546 1.00 60.23 C ATOM 2780 CG TYR B 80 6.690 -3.702 0.214 1.00 22.25 C ATOM 2781 CD1 TYR B 80 7.644 -2.944 -0.442 1.00 53.12 C ATOM 2782 CD2 TYR B 80 6.714 -3.723 1.604 1.00 40.20 C ATOM 2783 CE1 TYR B 80 8.595 -2.232 0.267 1.00 73.14 C ATOM 2784 CE2 TYR B 80 7.654 -3.022 2.314 1.00 74.31 C ATOM 2785 CZ TYR B 80 8.591 -2.277 1.645 1.00 51.22 C ATOM 2786 OH TYR B 80 9.532 -1.577 2.359 1.00 4.31 O ATOM 0 H TYR B 80 4.002 -5.959 -1.596 1.00 41.21 H new ATOM 0 HA TYR B 80 6.790 -5.808 -1.787 1.00 60.44 H new ATOM 0 HB2 TYR B 80 5.340 -3.884 -1.418 1.00 60.23 H new ATOM 0 HB3 TYR B 80 4.747 -4.554 0.089 1.00 60.23 H new ATOM 0 HD1 TYR B 80 7.646 -2.908 -1.521 1.00 53.12 H new ATOM 0 HD2 TYR B 80 5.976 -4.304 2.136 1.00 40.20 H new ATOM 0 HE1 TYR B 80 9.336 -1.645 -0.256 1.00 73.14 H new ATOM 0 HE2 TYR B 80 7.657 -3.056 3.393 1.00 74.31 H new ATOM 0 HH TYR B 80 9.607 -0.669 1.999 1.00 4.31 H new ATOM 2796 N LEU B 81 5.707 -6.995 1.099 1.00 23.55 N ATOM 2797 CA LEU B 81 6.081 -7.743 2.294 1.00 44.11 C ATOM 2798 C LEU B 81 6.486 -9.171 1.982 1.00 40.23 C ATOM 2799 O LEU B 81 7.265 -9.776 2.729 1.00 70.10 O ATOM 2800 CB LEU B 81 4.965 -7.712 3.337 1.00 24.41 C ATOM 2801 CG LEU B 81 4.650 -6.345 3.945 1.00 55.44 C ATOM 2802 CD1 LEU B 81 3.495 -6.453 4.921 1.00 3.25 C ATOM 2803 CD2 LEU B 81 5.878 -5.781 4.647 1.00 70.53 C ATOM 0 H LEU B 81 4.725 -6.721 1.072 1.00 23.55 H new ATOM 0 HA LEU B 81 6.957 -7.246 2.711 1.00 44.11 H new ATOM 0 HB2 LEU B 81 4.056 -8.101 2.878 1.00 24.41 H new ATOM 0 HB3 LEU B 81 5.231 -8.394 4.145 1.00 24.41 H new ATOM 0 HG LEU B 81 4.365 -5.668 3.140 1.00 55.44 H new ATOM 0 HD11 LEU B 81 3.284 -5.471 5.345 1.00 3.25 H new ATOM 0 HD12 LEU B 81 2.611 -6.821 4.400 1.00 3.25 H new ATOM 0 HD13 LEU B 81 3.758 -7.145 5.721 1.00 3.25 H new ATOM 0 HD21 LEU B 81 5.638 -4.808 5.075 1.00 70.53 H new ATOM 0 HD22 LEU B 81 6.187 -6.460 5.442 1.00 70.53 H new ATOM 0 HD23 LEU B 81 6.690 -5.671 3.928 1.00 70.53 H new ATOM 2815 N ALA B 82 5.997 -9.702 0.867 1.00 43.34 N ATOM 2816 CA ALA B 82 6.321 -11.057 0.456 1.00 10.40 C ATOM 2817 C ALA B 82 7.826 -11.211 0.241 1.00 34.24 C ATOM 2818 O ALA B 82 8.396 -12.274 0.484 1.00 53.03 O ATOM 2819 CB ALA B 82 5.560 -11.427 -0.803 1.00 12.21 C ATOM 0 H ALA B 82 5.371 -9.209 0.230 1.00 43.34 H new ATOM 0 HA ALA B 82 6.020 -11.738 1.252 1.00 10.40 H new ATOM 0 HB1 ALA B 82 5.815 -12.445 -1.096 1.00 12.21 H new ATOM 0 HB2 ALA B 82 4.489 -11.362 -0.613 1.00 12.21 H new ATOM 0 HB3 ALA B 82 5.829 -10.740 -1.606 1.00 12.21 H new ATOM 2825 N ASN B 83 8.470 -10.119 -0.157 1.00 4.01 N ATOM 2826 CA ASN B 83 9.919 -10.101 -0.407 1.00 51.32 C ATOM 2827 C ASN B 83 10.711 -10.207 0.864 1.00 61.42 C ATOM 2828 O ASN B 83 11.881 -10.557 0.843 1.00 75.04 O ATOM 2829 CB ASN B 83 10.360 -8.839 -1.138 1.00 55.24 C ATOM 2830 CG ASN B 83 9.792 -8.720 -2.512 1.00 42.11 C ATOM 2831 OD1 ASN B 83 10.366 -9.225 -3.469 1.00 1.22 O ATOM 2832 ND2 ASN B 83 8.689 -8.033 -2.639 1.00 44.13 N ATOM 0 H ASN B 83 8.011 -9.222 -0.317 1.00 4.01 H new ATOM 0 HA ASN B 83 10.116 -10.971 -1.034 1.00 51.32 H new ATOM 0 HB2 ASN B 83 10.064 -7.968 -0.554 1.00 55.24 H new ATOM 0 HB3 ASN B 83 11.448 -8.826 -1.201 1.00 55.24 H new ATOM 0 HD21 ASN B 83 8.274 -7.901 -3.561 1.00 44.13 H new ATOM 0 HD22 ASN B 83 8.242 -7.629 -1.816 1.00 44.13 H new ATOM 2839 N HIS B 84 10.075 -9.928 1.983 1.00 31.23 N ATOM 2840 CA HIS B 84 10.770 -9.956 3.258 1.00 41.42 C ATOM 2841 C HIS B 84 10.783 -11.408 3.772 1.00 2.32 C ATOM 2842 O HIS B 84 11.324 -11.710 4.835 1.00 75.34 O ATOM 2843 CB HIS B 84 10.057 -9.030 4.271 1.00 72.20 C ATOM 2844 CG HIS B 84 10.903 -8.571 5.443 1.00 31.52 C ATOM 2845 ND1 HIS B 84 11.914 -9.314 6.007 1.00 52.22 N ATOM 2846 CD2 HIS B 84 10.907 -7.390 6.102 1.00 23.41 C ATOM 2847 CE1 HIS B 84 12.500 -8.611 6.949 1.00 64.23 C ATOM 2848 NE2 HIS B 84 11.910 -7.441 7.024 1.00 52.34 N ATOM 0 H HIS B 84 9.087 -9.681 2.039 1.00 31.23 H new ATOM 0 HA HIS B 84 11.793 -9.599 3.136 1.00 41.42 H new ATOM 0 HB2 HIS B 84 9.695 -8.150 3.740 1.00 72.20 H new ATOM 0 HB3 HIS B 84 9.182 -9.551 4.659 1.00 72.20 H new ATOM 0 HD1 HIS B 84 12.169 -10.264 5.736 1.00 52.22 H new ATOM 0 HD2 HIS B 84 10.239 -6.559 5.930 1.00 23.41 H new ATOM 0 HE1 HIS B 84 13.328 -8.940 7.559 1.00 64.23 H new ATOM 0 HE2 HIS B 84 12.161 -6.691 7.668 1.00 52.34 H new ATOM 2857 N GLY B 85 10.194 -12.298 2.986 1.00 52.42 N ATOM 2858 CA GLY B 85 10.104 -13.686 3.364 1.00 3.14 C ATOM 2859 C GLY B 85 8.818 -13.952 4.092 1.00 25.20 C ATOM 2860 O GLY B 85 8.694 -14.914 4.854 1.00 45.23 O ATOM 0 H GLY B 85 9.774 -12.076 2.084 1.00 52.42 H new ATOM 0 HA2 GLY B 85 10.162 -14.315 2.476 1.00 3.14 H new ATOM 0 HA3 GLY B 85 10.949 -13.951 3.999 1.00 3.14 H new ATOM 2864 N ILE B 86 7.863 -13.094 3.872 1.00 4.15 N ATOM 2865 CA ILE B 86 6.595 -13.190 4.524 1.00 51.13 C ATOM 2866 C ILE B 86 5.556 -13.809 3.603 1.00 14.12 C ATOM 2867 O ILE B 86 5.393 -13.390 2.455 1.00 50.15 O ATOM 2868 CB ILE B 86 6.112 -11.799 5.002 1.00 61.41 C ATOM 2869 CG1 ILE B 86 7.131 -11.199 5.975 1.00 3.23 C ATOM 2870 CG2 ILE B 86 4.741 -11.894 5.660 1.00 23.13 C ATOM 2871 CD1 ILE B 86 6.757 -9.827 6.477 1.00 11.14 C ATOM 0 H ILE B 86 7.946 -12.305 3.231 1.00 4.15 H new ATOM 0 HA ILE B 86 6.720 -13.835 5.394 1.00 51.13 H new ATOM 0 HB ILE B 86 6.023 -11.147 4.133 1.00 61.41 H new ATOM 0 HG12 ILE B 86 7.244 -11.869 6.827 1.00 3.23 H new ATOM 0 HG13 ILE B 86 8.101 -11.143 5.482 1.00 3.23 H new ATOM 0 HG21 ILE B 86 4.425 -10.903 5.987 1.00 23.13 H new ATOM 0 HG22 ILE B 86 4.020 -12.287 4.943 1.00 23.13 H new ATOM 0 HG23 ILE B 86 4.796 -12.560 6.521 1.00 23.13 H new ATOM 0 HD11 ILE B 86 7.526 -9.468 7.161 1.00 11.14 H new ATOM 0 HD12 ILE B 86 6.672 -9.142 5.634 1.00 11.14 H new ATOM 0 HD13 ILE B 86 5.802 -9.879 7.000 1.00 11.14 H new ATOM 2883 N ASP B 87 4.889 -14.802 4.106 1.00 40.43 N ATOM 2884 CA ASP B 87 3.801 -15.463 3.400 1.00 53.15 C ATOM 2885 C ASP B 87 2.501 -14.902 3.887 1.00 75.01 C ATOM 2886 O ASP B 87 2.191 -14.972 5.093 1.00 75.41 O ATOM 2887 CB ASP B 87 3.845 -16.970 3.611 1.00 2.32 C ATOM 2888 CG ASP B 87 2.615 -17.698 3.078 1.00 71.40 C ATOM 2889 OD1 ASP B 87 2.491 -17.886 1.854 1.00 52.10 O ATOM 2890 OD2 ASP B 87 1.780 -18.127 3.893 1.00 21.34 O ATOM 0 H ASP B 87 5.077 -15.192 5.030 1.00 40.43 H new ATOM 0 HA ASP B 87 3.905 -15.281 2.330 1.00 53.15 H new ATOM 0 HB2 ASP B 87 4.734 -17.371 3.123 1.00 2.32 H new ATOM 0 HB3 ASP B 87 3.946 -17.176 4.677 1.00 2.32 H new ATOM 2895 N ILE B 88 1.761 -14.334 2.980 1.00 40.31 N ATOM 2896 CA ILE B 88 0.529 -13.673 3.294 1.00 33.54 C ATOM 2897 C ILE B 88 -0.599 -14.392 2.565 1.00 1.22 C ATOM 2898 O ILE B 88 -0.380 -14.948 1.479 1.00 3.44 O ATOM 2899 CB ILE B 88 0.589 -12.187 2.838 1.00 51.04 C ATOM 2900 CG1 ILE B 88 1.871 -11.536 3.384 1.00 15.24 C ATOM 2901 CG2 ILE B 88 -0.629 -11.434 3.353 1.00 53.11 C ATOM 2902 CD1 ILE B 88 2.063 -10.097 2.985 1.00 63.02 C ATOM 0 H ILE B 88 2.000 -14.317 1.988 1.00 40.31 H new ATOM 0 HA ILE B 88 0.358 -13.697 4.370 1.00 33.54 H new ATOM 0 HB ILE B 88 0.595 -12.146 1.749 1.00 51.04 H new ATOM 0 HG12 ILE B 88 1.860 -11.599 4.472 1.00 15.24 H new ATOM 0 HG13 ILE B 88 2.730 -12.112 3.040 1.00 15.24 H new ATOM 0 HG21 ILE B 88 -0.578 -10.395 3.029 1.00 53.11 H new ATOM 0 HG22 ILE B 88 -1.535 -11.894 2.958 1.00 53.11 H new ATOM 0 HG23 ILE B 88 -0.648 -11.474 4.442 1.00 53.11 H new ATOM 0 HD11 ILE B 88 2.991 -9.721 3.415 1.00 63.02 H new ATOM 0 HD12 ILE B 88 2.110 -10.024 1.898 1.00 63.02 H new ATOM 0 HD13 ILE B 88 1.226 -9.503 3.353 1.00 63.02 H new