USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 975 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 66 TYR OH : rot -60:sc= -0.721 USER MOD Set 1.2: A 139 SER OG : rot 121:sc= -1.18 USER MOD Set 2.1: A 69 THR OG1 : rot 90:sc= 1.38 USER MOD Set 2.2: A 137 THR OG1 : rot 180:sc= -0.656 USER MOD Set 2.3: A 138 ASN :FLIP amide:sc= -1.98 F(o=-7.4!,f=-1.2) USER MOD Set 3.1: A 72 TYR OH : rot 30:sc= 0.872 USER MOD Set 3.2: A 94 LYS NZ :NH3+ 143:sc= 1.22 (180deg=-0.56) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 63:sc= 0.0698 USER MOD Single : A 36 SER OG : rot -170:sc= -2.96 USER MOD Single : A 44 GLN : amide:sc= 0.99 K(o=0.99,f=-0.51) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 60 ASN :FLIP amide:sc= -2.25! C(o=-2.9!,f=-2.3!) USER MOD Single : A 71 ASN : amide:sc= -1.76 K(o=-1.8,f=-2.3!) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 TYR OH : rot 162:sc= -4.36! USER MOD Single : A 84 SER OG : rot 147:sc= 0.87 USER MOD Single : A 91 ASN :FLIP amide:sc= -0.468 F(o=-1.7,f=-0.47) USER MOD Single : A 93 LYS NZ :NH3+ -160:sc= -0.029 (180deg=-0.189) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 175:sc= -0.0192 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -139:sc= -1.27 (180deg=-3.81!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00392) USER MOD Single : A 132 SER OG : rot 31:sc= -5.93! USER MOD Single : A 133 ASN : amide:sc= -3.16! C(o=-3.2!,f=-6.6!) USER MOD Single : A 135 SER OG : rot 31:sc= 0.0342 USER MOD Single : A 140 SER OG : rot 170:sc= -1.29 USER MOD Single : A 149 HIS : no HD1:sc= -1.94 K(o=-1.9,f=-2.6) USER MOD Single : A 154 THR OG1 : rot 180:sc= -1.09 USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 THR OG1 : rot 46:sc= 0.0187 USER MOD Single : A 159 ASN :FLIP amide:sc= -0.505 F(o=-1,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 431 N GLU A 30 -18.673 -9.678 18.754 1.00 0.00 N ATOM 432 CA GLU A 30 -18.748 -8.882 17.535 1.00 0.00 C ATOM 433 C GLU A 30 -17.717 -7.758 17.556 1.00 0.00 C ATOM 434 O GLU A 30 -17.816 -6.826 18.354 1.00 0.00 O ATOM 435 CB GLU A 30 -20.152 -8.299 17.368 1.00 0.00 C ATOM 436 CG GLU A 30 -21.248 -9.350 17.328 1.00 0.00 C ATOM 437 CD GLU A 30 -22.327 -9.033 16.311 1.00 0.00 C ATOM 438 OE1 GLU A 30 -22.945 -7.954 16.420 1.00 0.00 O ATOM 439 OE2 GLU A 30 -22.551 -9.863 15.405 1.00 0.00 O ATOM 0 HA GLU A 30 -18.530 -9.535 16.690 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -20.350 -7.611 18.190 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -20.187 -7.715 16.448 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -20.808 -10.319 17.094 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -21.700 -9.435 18.316 1.00 0.00 H new ATOM 446 N VAL A 31 -16.728 -7.853 16.674 1.00 0.00 N ATOM 447 CA VAL A 31 -15.678 -6.846 16.590 1.00 0.00 C ATOM 448 C VAL A 31 -16.267 -5.479 16.255 1.00 0.00 C ATOM 449 O VAL A 31 -17.263 -5.381 15.537 1.00 0.00 O ATOM 450 CB VAL A 31 -14.614 -7.241 15.534 1.00 0.00 C ATOM 451 CG1 VAL A 31 -13.784 -6.045 15.094 1.00 0.00 C ATOM 452 CG2 VAL A 31 -13.708 -8.329 16.082 1.00 0.00 C ATOM 0 H VAL A 31 -16.632 -8.618 16.007 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.192 -6.788 17.564 1.00 0.00 H new ATOM 0 HB VAL A 31 -15.144 -7.618 14.659 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.050 -6.364 14.354 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.437 -5.290 14.656 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.269 -5.622 15.957 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.966 -8.597 15.330 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -13.203 -7.966 16.977 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -14.304 -9.207 16.332 1.00 0.00 H new ATOM 462 N THR A 32 -15.638 -4.425 16.768 1.00 0.00 N ATOM 463 CA THR A 32 -16.098 -3.069 16.509 1.00 0.00 C ATOM 464 C THR A 32 -15.812 -2.714 15.061 1.00 0.00 C ATOM 465 O THR A 32 -16.665 -2.178 14.351 1.00 0.00 O ATOM 466 CB THR A 32 -15.407 -2.079 17.452 1.00 0.00 C ATOM 467 OG1 THR A 32 -15.998 -0.795 17.352 1.00 0.00 O ATOM 468 CG2 THR A 32 -13.924 -1.925 17.184 1.00 0.00 C ATOM 0 H THR A 32 -14.812 -4.486 17.363 1.00 0.00 H new ATOM 0 HA THR A 32 -17.171 -3.011 16.689 1.00 0.00 H new ATOM 0 HB THR A 32 -15.535 -2.497 18.450 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.544 -0.177 17.963 1.00 0.00 H new ATOM 0 HG21 THR A 32 -13.499 -1.209 17.888 1.00 0.00 H new ATOM 0 HG22 THR A 32 -13.430 -2.889 17.305 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.774 -1.565 16.166 1.00 0.00 H new ATOM 476 N GLY A 33 -14.601 -3.040 14.631 1.00 0.00 N ATOM 477 CA GLY A 33 -14.196 -2.785 13.275 1.00 0.00 C ATOM 478 C GLY A 33 -13.936 -1.325 13.014 1.00 0.00 C ATOM 479 O GLY A 33 -14.866 -0.524 12.972 1.00 0.00 O ATOM 0 H GLY A 33 -13.888 -3.482 15.211 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.294 -3.356 13.056 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.971 -3.140 12.595 1.00 0.00 H new ATOM 483 N SER A 34 -12.673 -0.974 12.831 1.00 0.00 N ATOM 484 CA SER A 34 -12.318 0.409 12.557 1.00 0.00 C ATOM 485 C SER A 34 -10.957 0.520 11.904 1.00 0.00 C ATOM 486 O SER A 34 -10.008 -0.172 12.270 1.00 0.00 O ATOM 487 CB SER A 34 -12.373 1.249 13.832 1.00 0.00 C ATOM 488 OG SER A 34 -13.030 0.551 14.878 1.00 0.00 O ATOM 0 H SER A 34 -11.884 -1.620 12.867 1.00 0.00 H new ATOM 0 HA SER A 34 -13.054 0.799 11.854 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.361 1.508 14.144 1.00 0.00 H new ATOM 0 HB3 SER A 34 -12.895 2.185 13.632 1.00 0.00 H new ATOM 0 HG SER A 34 -12.520 -0.255 15.104 1.00 0.00 H new ATOM 494 N VAL A 35 -10.886 1.407 10.920 1.00 0.00 N ATOM 495 CA VAL A 35 -9.663 1.638 10.185 1.00 0.00 C ATOM 496 C VAL A 35 -8.929 2.854 10.711 1.00 0.00 C ATOM 497 O VAL A 35 -9.536 3.863 11.067 1.00 0.00 O ATOM 498 CB VAL A 35 -9.944 1.842 8.694 1.00 0.00 C ATOM 499 CG1 VAL A 35 -10.455 0.559 8.078 1.00 0.00 C ATOM 500 CG2 VAL A 35 -10.933 2.976 8.488 1.00 0.00 C ATOM 0 H VAL A 35 -11.673 1.980 10.615 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.041 0.753 10.320 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.013 2.114 8.196 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -10.651 0.717 7.018 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -9.706 -0.224 8.196 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -11.377 0.258 8.576 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.120 3.106 7.422 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -11.869 2.739 8.995 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -10.521 3.897 8.899 1.00 0.00 H new ATOM 510 N SER A 36 -7.618 2.739 10.748 1.00 0.00 N ATOM 511 CA SER A 36 -6.764 3.825 11.224 1.00 0.00 C ATOM 512 C SER A 36 -6.152 4.590 10.057 1.00 0.00 C ATOM 513 O SER A 36 -5.305 4.065 9.338 1.00 0.00 O ATOM 514 CB SER A 36 -5.656 3.280 12.125 1.00 0.00 C ATOM 515 OG SER A 36 -4.979 2.199 11.507 1.00 0.00 O ATOM 0 H SER A 36 -7.112 1.904 10.454 1.00 0.00 H new ATOM 0 HA SER A 36 -7.386 4.510 11.800 1.00 0.00 H new ATOM 0 HB2 SER A 36 -4.946 4.075 12.354 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.083 2.951 13.073 1.00 0.00 H new ATOM 0 HG SER A 36 -4.387 1.768 12.159 1.00 0.00 H new ATOM 521 N LEU A 37 -6.587 5.832 9.875 1.00 0.00 N ATOM 522 CA LEU A 37 -6.081 6.668 8.793 1.00 0.00 C ATOM 523 C LEU A 37 -4.975 7.597 9.288 1.00 0.00 C ATOM 524 O LEU A 37 -5.157 8.339 10.252 1.00 0.00 O ATOM 525 CB LEU A 37 -7.219 7.490 8.179 1.00 0.00 C ATOM 526 CG LEU A 37 -7.645 7.061 6.772 1.00 0.00 C ATOM 527 CD1 LEU A 37 -8.645 8.052 6.194 1.00 0.00 C ATOM 528 CD2 LEU A 37 -6.434 6.933 5.859 1.00 0.00 C ATOM 0 H LEU A 37 -7.289 6.282 10.463 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.662 6.013 8.030 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.085 7.431 8.838 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.914 8.536 8.146 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.125 6.085 6.842 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.937 7.732 5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.527 8.094 6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.188 9.040 6.140 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.759 6.627 4.864 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.924 7.894 5.795 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.751 6.186 6.263 1.00 0.00 H new ATOM 540 N GLU A 38 -3.831 7.553 8.614 1.00 0.00 N ATOM 541 CA GLU A 38 -2.694 8.392 8.974 1.00 0.00 C ATOM 542 C GLU A 38 -2.004 8.920 7.720 1.00 0.00 C ATOM 543 O GLU A 38 -1.249 8.199 7.066 1.00 0.00 O ATOM 544 CB GLU A 38 -1.697 7.604 9.827 1.00 0.00 C ATOM 545 CG GLU A 38 -0.905 8.468 10.793 1.00 0.00 C ATOM 546 CD GLU A 38 -1.456 8.421 12.204 1.00 0.00 C ATOM 547 OE1 GLU A 38 -2.681 8.603 12.370 1.00 0.00 O ATOM 548 OE2 GLU A 38 -0.664 8.201 13.145 1.00 0.00 O ATOM 0 H GLU A 38 -3.666 6.943 7.813 1.00 0.00 H new ATOM 0 HA GLU A 38 -3.062 9.237 9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.237 6.844 10.392 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.003 7.080 9.169 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.134 8.138 10.802 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.909 9.499 10.440 1.00 0.00 H new ATOM 555 N ALA A 39 -2.275 10.177 7.384 1.00 0.00 N ATOM 556 CA ALA A 39 -1.685 10.791 6.200 1.00 0.00 C ATOM 557 C ALA A 39 -1.459 12.285 6.398 1.00 0.00 C ATOM 558 O ALA A 39 -2.184 12.940 7.144 1.00 0.00 O ATOM 559 CB ALA A 39 -2.580 10.556 4.994 1.00 0.00 C ATOM 0 H ALA A 39 -2.897 10.788 7.913 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.714 10.326 6.029 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.133 11.017 4.114 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.690 9.485 4.826 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.560 10.997 5.177 1.00 0.00 H new ATOM 565 N LEU A 40 -0.453 12.820 5.711 1.00 0.00 N ATOM 566 CA LEU A 40 -0.141 14.241 5.798 1.00 0.00 C ATOM 567 C LEU A 40 -1.323 15.071 5.308 1.00 0.00 C ATOM 568 O LEU A 40 -1.526 16.202 5.743 1.00 0.00 O ATOM 569 CB LEU A 40 1.107 14.566 4.975 1.00 0.00 C ATOM 570 CG LEU A 40 2.434 14.375 5.709 1.00 0.00 C ATOM 571 CD1 LEU A 40 3.604 14.623 4.771 1.00 0.00 C ATOM 572 CD2 LEU A 40 2.511 15.300 6.916 1.00 0.00 C ATOM 0 H LEU A 40 0.158 12.291 5.089 1.00 0.00 H new ATOM 0 HA LEU A 40 0.056 14.489 6.841 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.109 13.939 4.083 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.042 15.600 4.637 1.00 0.00 H new ATOM 0 HG LEU A 40 2.489 13.344 6.060 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.540 14.482 5.312 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.557 13.922 3.938 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.555 15.643 4.390 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.462 15.152 7.428 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.434 16.336 6.586 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.692 15.075 7.599 1.00 0.00 H new ATOM 584 N GLU A 41 -2.105 14.487 4.401 1.00 0.00 N ATOM 585 CA GLU A 41 -3.279 15.155 3.847 1.00 0.00 C ATOM 586 C GLU A 41 -2.888 16.265 2.877 1.00 0.00 C ATOM 587 O GLU A 41 -3.655 17.203 2.657 1.00 0.00 O ATOM 588 CB GLU A 41 -4.153 15.726 4.969 1.00 0.00 C ATOM 589 CG GLU A 41 -4.218 14.843 6.207 1.00 0.00 C ATOM 590 CD GLU A 41 -5.465 15.090 7.033 1.00 0.00 C ATOM 591 OE1 GLU A 41 -6.540 15.309 6.435 1.00 0.00 O ATOM 592 OE2 GLU A 41 -5.367 15.065 8.278 1.00 0.00 O ATOM 0 H GLU A 41 -1.945 13.549 4.034 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.849 14.408 3.294 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.769 16.706 5.253 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.163 15.877 4.589 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.188 13.796 5.904 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.337 15.022 6.823 1.00 0.00 H new ATOM 599 N GLU A 42 -1.696 16.161 2.295 1.00 0.00 N ATOM 600 CA GLU A 42 -1.232 17.167 1.347 1.00 0.00 C ATOM 601 C GLU A 42 -0.035 16.674 0.535 1.00 0.00 C ATOM 602 O GLU A 42 0.962 16.215 1.095 1.00 0.00 O ATOM 603 CB GLU A 42 -0.862 18.456 2.085 1.00 0.00 C ATOM 604 CG GLU A 42 -1.167 19.718 1.292 1.00 0.00 C ATOM 605 CD GLU A 42 -1.034 20.977 2.129 1.00 0.00 C ATOM 606 OE1 GLU A 42 -1.077 20.871 3.373 1.00 0.00 O ATOM 607 OE2 GLU A 42 -0.884 22.068 1.539 1.00 0.00 O ATOM 0 H GLU A 42 -1.040 15.398 2.462 1.00 0.00 H new ATOM 0 HA GLU A 42 -2.049 17.364 0.653 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -1.402 18.491 3.031 1.00 0.00 H new ATOM 0 HB3 GLU A 42 0.201 18.435 2.325 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -0.491 19.780 0.439 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.179 19.656 0.893 1.00 0.00 H new ATOM 614 N VAL A 43 -0.137 16.789 -0.786 1.00 0.00 N ATOM 615 CA VAL A 43 0.937 16.373 -1.682 1.00 0.00 C ATOM 616 C VAL A 43 1.017 17.308 -2.887 1.00 0.00 C ATOM 617 O VAL A 43 0.155 17.284 -3.758 1.00 0.00 O ATOM 618 CB VAL A 43 0.735 14.919 -2.165 1.00 0.00 C ATOM 619 CG1 VAL A 43 -0.652 14.736 -2.768 1.00 0.00 C ATOM 620 CG2 VAL A 43 1.816 14.521 -3.160 1.00 0.00 C ATOM 0 H VAL A 43 -0.956 17.168 -1.261 1.00 0.00 H new ATOM 0 HA VAL A 43 1.871 16.423 -1.123 1.00 0.00 H new ATOM 0 HB VAL A 43 0.817 14.262 -1.299 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.771 13.705 -3.101 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.408 14.964 -2.017 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.771 15.408 -3.618 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.651 13.494 -3.485 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.778 15.185 -4.024 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.794 14.599 -2.685 1.00 0.00 H new ATOM 630 N GLN A 44 2.057 18.137 -2.925 1.00 0.00 N ATOM 631 CA GLN A 44 2.245 19.090 -4.016 1.00 0.00 C ATOM 632 C GLN A 44 2.594 18.368 -5.324 1.00 0.00 C ATOM 633 O GLN A 44 3.547 17.589 -5.363 1.00 0.00 O ATOM 634 CB GLN A 44 3.360 20.075 -3.642 1.00 0.00 C ATOM 635 CG GLN A 44 3.851 20.937 -4.796 1.00 0.00 C ATOM 636 CD GLN A 44 5.326 20.748 -5.079 1.00 0.00 C ATOM 637 OE1 GLN A 44 6.181 21.172 -4.302 1.00 0.00 O ATOM 638 NE2 GLN A 44 5.631 20.107 -6.200 1.00 0.00 N ATOM 0 H GLN A 44 2.785 18.168 -2.211 1.00 0.00 H new ATOM 0 HA GLN A 44 1.313 19.633 -4.172 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.000 20.726 -2.845 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.203 19.514 -3.239 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.279 20.697 -5.692 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.660 21.986 -4.568 1.00 0.00 H new ATOM 0 HE21 GLN A 44 4.889 19.773 -6.815 1.00 0.00 H new ATOM 0 HE22 GLN A 44 6.608 19.948 -6.447 1.00 0.00 H new ATOM 647 N VAL A 45 1.818 18.624 -6.392 1.00 0.00 N ATOM 648 CA VAL A 45 2.041 18.005 -7.691 1.00 0.00 C ATOM 649 C VAL A 45 3.499 17.653 -7.937 1.00 0.00 C ATOM 650 O VAL A 45 4.397 18.475 -7.761 1.00 0.00 O ATOM 651 CB VAL A 45 1.527 18.918 -8.828 1.00 0.00 C ATOM 652 CG1 VAL A 45 2.383 18.798 -10.085 1.00 0.00 C ATOM 653 CG2 VAL A 45 0.087 18.568 -9.129 1.00 0.00 C ATOM 0 H VAL A 45 1.024 19.264 -6.370 1.00 0.00 H new ATOM 0 HA VAL A 45 1.477 17.072 -7.685 1.00 0.00 H new ATOM 0 HB VAL A 45 1.595 19.954 -8.497 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.987 19.456 -10.859 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.409 19.085 -9.855 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.365 17.768 -10.440 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.283 19.208 -9.930 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.023 17.525 -9.439 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.519 18.719 -8.235 1.00 0.00 H new ATOM 663 N GLY A 46 3.711 16.417 -8.357 1.00 0.00 N ATOM 664 CA GLY A 46 5.041 15.948 -8.637 1.00 0.00 C ATOM 665 C GLY A 46 5.583 15.038 -7.551 1.00 0.00 C ATOM 666 O GLY A 46 6.576 14.340 -7.754 1.00 0.00 O ATOM 0 H GLY A 46 2.975 15.728 -8.509 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.040 15.413 -9.587 1.00 0.00 H new ATOM 0 HA3 GLY A 46 5.706 16.804 -8.754 1.00 0.00 H new ATOM 670 N GLU A 47 4.928 15.046 -6.391 1.00 0.00 N ATOM 671 CA GLU A 47 5.346 14.216 -5.266 1.00 0.00 C ATOM 672 C GLU A 47 4.392 13.041 -5.078 1.00 0.00 C ATOM 673 O GLU A 47 3.341 12.974 -5.716 1.00 0.00 O ATOM 674 CB GLU A 47 5.404 15.056 -3.986 1.00 0.00 C ATOM 675 CG GLU A 47 6.297 14.473 -2.898 1.00 0.00 C ATOM 676 CD GLU A 47 7.646 14.017 -3.420 1.00 0.00 C ATOM 677 OE1 GLU A 47 8.529 14.878 -3.614 1.00 0.00 O ATOM 678 OE2 GLU A 47 7.818 12.799 -3.637 1.00 0.00 O ATOM 0 H GLU A 47 4.105 15.619 -6.207 1.00 0.00 H new ATOM 0 HA GLU A 47 6.340 13.822 -5.479 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.760 16.055 -4.236 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.394 15.167 -3.591 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.449 15.221 -2.120 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.789 13.628 -2.433 1.00 0.00 H new ATOM 685 N ASN A 48 4.765 12.117 -4.200 1.00 0.00 N ATOM 686 CA ASN A 48 3.943 10.943 -3.927 1.00 0.00 C ATOM 687 C ASN A 48 3.267 11.053 -2.565 1.00 0.00 C ATOM 688 O ASN A 48 3.609 11.917 -1.758 1.00 0.00 O ATOM 689 CB ASN A 48 4.794 9.674 -3.986 1.00 0.00 C ATOM 690 CG ASN A 48 5.303 9.383 -5.385 1.00 0.00 C ATOM 691 OD1 ASN A 48 4.652 8.684 -6.162 1.00 0.00 O ATOM 692 ND2 ASN A 48 6.473 9.919 -5.711 1.00 0.00 N ATOM 0 H ASN A 48 5.632 12.158 -3.664 1.00 0.00 H new ATOM 0 HA ASN A 48 3.168 10.889 -4.692 1.00 0.00 H new ATOM 0 HB2 ASN A 48 5.641 9.776 -3.308 1.00 0.00 H new ATOM 0 HB3 ASN A 48 4.204 8.828 -3.634 1.00 0.00 H new ATOM 0 HD21 ASN A 48 6.867 9.758 -6.638 1.00 0.00 H new ATOM 0 HD22 ASN A 48 6.978 10.492 -5.035 1.00 0.00 H new ATOM 699 N LEU A 49 2.303 10.170 -2.315 1.00 0.00 N ATOM 700 CA LEU A 49 1.575 10.165 -1.049 1.00 0.00 C ATOM 701 C LEU A 49 1.744 8.834 -0.326 1.00 0.00 C ATOM 702 O LEU A 49 1.924 7.792 -0.957 1.00 0.00 O ATOM 703 CB LEU A 49 0.089 10.437 -1.294 1.00 0.00 C ATOM 704 CG LEU A 49 -0.326 11.905 -1.209 1.00 0.00 C ATOM 705 CD1 LEU A 49 -1.798 12.064 -1.558 1.00 0.00 C ATOM 706 CD2 LEU A 49 -0.042 12.458 0.180 1.00 0.00 C ATOM 0 H LEU A 49 2.008 9.449 -2.973 1.00 0.00 H new ATOM 0 HA LEU A 49 1.987 10.954 -0.419 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.175 10.058 -2.281 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.493 9.869 -0.568 1.00 0.00 H new ATOM 0 HG LEU A 49 0.260 12.472 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.076 13.116 -1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.972 11.705 -2.572 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.402 11.485 -0.860 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.343 13.505 0.224 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.603 11.888 0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.024 12.378 0.392 1.00 0.00 H new ATOM 718 N GLU A 50 1.676 8.872 1.001 1.00 0.00 N ATOM 719 CA GLU A 50 1.813 7.668 1.808 1.00 0.00 C ATOM 720 C GLU A 50 0.772 7.650 2.920 1.00 0.00 C ATOM 721 O GLU A 50 0.996 8.200 3.999 1.00 0.00 O ATOM 722 CB GLU A 50 3.218 7.583 2.404 1.00 0.00 C ATOM 723 CG GLU A 50 3.656 8.852 3.115 1.00 0.00 C ATOM 724 CD GLU A 50 4.408 8.570 4.401 1.00 0.00 C ATOM 725 OE1 GLU A 50 3.791 8.032 5.344 1.00 0.00 O ATOM 726 OE2 GLU A 50 5.614 8.889 4.465 1.00 0.00 O ATOM 0 H GLU A 50 1.527 9.725 1.539 1.00 0.00 H new ATOM 0 HA GLU A 50 1.652 6.803 1.164 1.00 0.00 H new ATOM 0 HB2 GLU A 50 3.255 6.751 3.108 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.928 7.359 1.608 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.290 9.437 2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 50 2.779 9.461 3.337 1.00 0.00 H new ATOM 733 N VAL A 51 -0.366 7.016 2.657 1.00 0.00 N ATOM 734 CA VAL A 51 -1.433 6.933 3.646 1.00 0.00 C ATOM 735 C VAL A 51 -1.531 5.529 4.231 1.00 0.00 C ATOM 736 O VAL A 51 -2.152 4.642 3.646 1.00 0.00 O ATOM 737 CB VAL A 51 -2.793 7.326 3.034 1.00 0.00 C ATOM 738 CG1 VAL A 51 -2.784 8.784 2.596 1.00 0.00 C ATOM 739 CG2 VAL A 51 -3.143 6.412 1.865 1.00 0.00 C ATOM 0 H VAL A 51 -0.572 6.554 1.771 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.187 7.635 4.443 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.559 7.206 3.800 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.753 9.041 2.167 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.588 9.422 3.458 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.005 8.935 1.849 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.106 6.707 1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.375 6.494 1.096 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.199 5.381 2.214 1.00 0.00 H new ATOM 749 N GLY A 52 -0.914 5.337 5.391 1.00 0.00 N ATOM 750 CA GLY A 52 -0.937 4.043 6.042 1.00 0.00 C ATOM 751 C GLY A 52 -2.257 3.759 6.730 1.00 0.00 C ATOM 752 O GLY A 52 -2.357 3.847 7.954 1.00 0.00 O ATOM 0 H GLY A 52 -0.396 6.058 5.893 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.742 3.266 5.303 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.132 3.995 6.775 1.00 0.00 H new ATOM 756 N VAL A 53 -3.274 3.416 5.946 1.00 0.00 N ATOM 757 CA VAL A 53 -4.586 3.117 6.497 1.00 0.00 C ATOM 758 C VAL A 53 -4.621 1.710 7.088 1.00 0.00 C ATOM 759 O VAL A 53 -4.837 0.728 6.376 1.00 0.00 O ATOM 760 CB VAL A 53 -5.694 3.259 5.430 1.00 0.00 C ATOM 761 CG1 VAL A 53 -5.486 2.270 4.297 1.00 0.00 C ATOM 762 CG2 VAL A 53 -7.070 3.081 6.058 1.00 0.00 C ATOM 0 H VAL A 53 -3.213 3.339 4.931 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.774 3.842 7.289 1.00 0.00 H new ATOM 0 HB VAL A 53 -5.636 4.264 5.013 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.279 2.390 3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -4.521 2.454 3.826 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -5.509 1.254 4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.837 3.185 5.290 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.139 2.091 6.508 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.221 3.840 6.826 1.00 0.00 H new ATOM 772 N GLY A 54 -4.396 1.617 8.393 1.00 0.00 N ATOM 773 CA GLY A 54 -4.396 0.327 9.055 1.00 0.00 C ATOM 774 C GLY A 54 -5.639 0.095 9.891 1.00 0.00 C ATOM 775 O GLY A 54 -6.759 0.276 9.412 1.00 0.00 O ATOM 0 H GLY A 54 -4.213 2.413 9.005 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.316 -0.461 8.306 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.515 0.251 9.693 1.00 0.00 H new ATOM 779 N ILE A 55 -5.442 -0.310 11.141 1.00 0.00 N ATOM 780 CA ILE A 55 -6.561 -0.571 12.044 1.00 0.00 C ATOM 781 C ILE A 55 -6.698 0.518 13.100 1.00 0.00 C ATOM 782 O ILE A 55 -5.731 0.880 13.769 1.00 0.00 O ATOM 783 CB ILE A 55 -6.421 -1.947 12.748 1.00 0.00 C ATOM 784 CG1 ILE A 55 -7.386 -2.960 12.134 1.00 0.00 C ATOM 785 CG2 ILE A 55 -6.673 -1.838 14.251 1.00 0.00 C ATOM 786 CD1 ILE A 55 -6.703 -3.972 11.246 1.00 0.00 C ATOM 0 H ILE A 55 -4.522 -0.465 11.553 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.458 -0.579 11.425 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.396 -2.288 12.600 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.910 -3.483 12.934 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.140 -2.428 11.554 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.566 -2.821 14.710 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.951 -1.151 14.692 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -7.682 -1.464 14.425 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -7.445 -4.661 10.842 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.202 -3.457 10.426 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -5.968 -4.529 11.827 1.00 0.00 H new ATOM 798 N ASP A 56 -7.922 1.001 13.270 1.00 0.00 N ATOM 799 CA ASP A 56 -8.215 2.012 14.272 1.00 0.00 C ATOM 800 C ASP A 56 -8.776 1.334 15.516 1.00 0.00 C ATOM 801 O ASP A 56 -8.560 1.794 16.637 1.00 0.00 O ATOM 802 CB ASP A 56 -9.204 3.048 13.726 1.00 0.00 C ATOM 803 CG ASP A 56 -9.820 3.911 14.813 1.00 0.00 C ATOM 804 OD1 ASP A 56 -9.073 4.355 15.710 1.00 0.00 O ATOM 805 OD2 ASP A 56 -11.045 4.141 14.766 1.00 0.00 O ATOM 0 H ASP A 56 -8.730 0.706 12.723 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.296 2.538 14.532 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.691 3.688 13.008 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.998 2.534 13.184 1.00 0.00 H new ATOM 810 N GLU A 57 -9.482 0.222 15.305 1.00 0.00 N ATOM 811 CA GLU A 57 -10.058 -0.539 16.406 1.00 0.00 C ATOM 812 C GLU A 57 -10.780 -1.791 15.916 1.00 0.00 C ATOM 813 O GLU A 57 -11.582 -1.747 14.984 1.00 0.00 O ATOM 814 CB GLU A 57 -11.029 0.312 17.216 1.00 0.00 C ATOM 815 CG GLU A 57 -10.398 0.981 18.425 1.00 0.00 C ATOM 816 CD GLU A 57 -10.541 2.490 18.401 1.00 0.00 C ATOM 817 OE1 GLU A 57 -10.657 3.058 17.294 1.00 0.00 O ATOM 818 OE2 GLU A 57 -10.538 3.105 19.488 1.00 0.00 O ATOM 0 H GLU A 57 -9.667 -0.169 14.381 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.226 -0.842 17.041 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.453 1.079 16.568 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.856 -0.315 17.550 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -10.859 0.591 19.332 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -9.340 0.721 18.468 1.00 0.00 H new ATOM 825 N LEU A 58 -10.497 -2.893 16.588 1.00 0.00 N ATOM 826 CA LEU A 58 -11.110 -4.185 16.293 1.00 0.00 C ATOM 827 C LEU A 58 -10.987 -5.101 17.509 1.00 0.00 C ATOM 828 O LEU A 58 -9.880 -5.452 17.917 1.00 0.00 O ATOM 829 CB LEU A 58 -10.462 -4.837 15.063 1.00 0.00 C ATOM 830 CG LEU A 58 -9.154 -5.596 15.324 1.00 0.00 C ATOM 831 CD1 LEU A 58 -9.445 -7.024 15.764 1.00 0.00 C ATOM 832 CD2 LEU A 58 -8.275 -5.590 14.081 1.00 0.00 C ATOM 0 H LEU A 58 -9.831 -2.921 17.360 1.00 0.00 H new ATOM 0 HA LEU A 58 -12.164 -4.026 16.068 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -11.180 -5.528 14.621 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -10.269 -4.061 14.323 1.00 0.00 H new ATOM 0 HG LEU A 58 -8.618 -5.090 16.127 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.506 -7.548 15.945 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.035 -7.009 16.681 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -10.003 -7.539 14.982 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -7.352 -6.133 14.285 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.804 -6.071 13.259 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.038 -4.562 13.808 1.00 0.00 H new ATOM 844 N VAL A 59 -12.117 -5.474 18.104 1.00 0.00 N ATOM 845 CA VAL A 59 -12.089 -6.334 19.279 1.00 0.00 C ATOM 846 C VAL A 59 -13.092 -7.475 19.183 1.00 0.00 C ATOM 847 O VAL A 59 -14.282 -7.281 19.402 1.00 0.00 O ATOM 848 CB VAL A 59 -12.342 -5.531 20.572 1.00 0.00 C ATOM 849 CG1 VAL A 59 -13.730 -4.910 20.559 1.00 0.00 C ATOM 850 CG2 VAL A 59 -12.153 -6.413 21.797 1.00 0.00 C ATOM 0 H VAL A 59 -13.050 -5.198 17.796 1.00 0.00 H new ATOM 0 HA VAL A 59 -11.088 -6.764 19.317 1.00 0.00 H new ATOM 0 HB VAL A 59 -11.612 -4.723 20.620 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -13.886 -4.349 21.480 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -13.820 -4.238 19.705 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -14.480 -5.697 20.482 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -12.336 -5.828 22.698 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -12.854 -7.247 21.757 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -11.133 -6.797 21.815 1.00 0.00 H new ATOM 860 N ASN A 60 -12.566 -8.664 18.864 1.00 0.00 N ATOM 861 CA ASN A 60 -13.350 -9.906 18.726 1.00 0.00 C ATOM 862 C ASN A 60 -12.901 -10.734 17.519 1.00 0.00 C ATOM 863 O ASN A 60 -13.666 -11.552 17.007 1.00 0.00 O ATOM 864 CB ASN A 60 -14.861 -9.644 18.614 1.00 0.00 C ATOM 865 CG ASN A 60 -15.537 -9.578 19.965 1.00 0.00 C ATOM 866 OD1 ASN A 60 -16.226 -8.475 20.220 1.00 0.00 O flip ATOM 867 ND2 ASN A 60 -15.442 -10.506 20.769 1.00 0.00 N flip ATOM 0 H ASN A 60 -11.569 -8.796 18.691 1.00 0.00 H new ATOM 0 HA ASN A 60 -13.162 -10.468 19.641 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -15.026 -8.707 18.082 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -15.321 -10.433 18.019 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -14.900 -11.336 20.528 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -15.905 -10.445 21.676 1.00 0.00 H new ATOM 874 N ALA A 61 -11.670 -10.523 17.060 1.00 0.00 N ATOM 875 CA ALA A 61 -11.152 -11.257 15.914 1.00 0.00 C ATOM 876 C ALA A 61 -9.628 -11.214 15.876 1.00 0.00 C ATOM 877 O ALA A 61 -8.997 -10.530 16.680 1.00 0.00 O ATOM 878 CB ALA A 61 -11.733 -10.690 14.631 1.00 0.00 C ATOM 0 H ALA A 61 -11.017 -9.852 17.464 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.453 -12.300 16.010 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -11.341 -11.244 13.778 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.819 -10.779 14.653 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -11.457 -9.640 14.539 1.00 0.00 H new ATOM 884 N GLU A 62 -9.044 -11.949 14.934 1.00 0.00 N ATOM 885 CA GLU A 62 -7.593 -11.992 14.788 1.00 0.00 C ATOM 886 C GLU A 62 -7.188 -11.674 13.354 1.00 0.00 C ATOM 887 O GLU A 62 -7.026 -12.571 12.529 1.00 0.00 O ATOM 888 CB GLU A 62 -7.060 -13.369 15.192 1.00 0.00 C ATOM 889 CG GLU A 62 -6.456 -13.401 16.587 1.00 0.00 C ATOM 890 CD GLU A 62 -5.218 -12.534 16.706 1.00 0.00 C ATOM 891 OE1 GLU A 62 -4.473 -12.424 15.710 1.00 0.00 O ATOM 892 OE2 GLU A 62 -4.993 -11.966 17.796 1.00 0.00 O ATOM 0 H GLU A 62 -9.553 -12.522 14.261 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.159 -11.239 15.446 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.872 -14.094 15.140 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.306 -13.684 14.471 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.201 -13.066 17.309 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.201 -14.429 16.845 1.00 0.00 H new ATOM 899 N ALA A 63 -7.030 -10.387 13.061 1.00 0.00 N ATOM 900 CA ALA A 63 -6.652 -9.946 11.727 1.00 0.00 C ATOM 901 C ALA A 63 -5.274 -10.470 11.336 1.00 0.00 C ATOM 902 O ALA A 63 -4.260 -10.069 11.910 1.00 0.00 O ATOM 903 CB ALA A 63 -6.684 -8.429 11.646 1.00 0.00 C ATOM 0 H ALA A 63 -7.159 -9.631 13.733 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.375 -10.355 11.021 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -6.399 -8.112 10.643 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.691 -8.074 11.867 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.985 -8.011 12.371 1.00 0.00 H new ATOM 909 N PHE A 64 -5.246 -11.360 10.350 1.00 0.00 N ATOM 910 CA PHE A 64 -3.995 -11.934 9.869 1.00 0.00 C ATOM 911 C PHE A 64 -3.599 -11.293 8.544 1.00 0.00 C ATOM 912 O PHE A 64 -2.418 -11.079 8.269 1.00 0.00 O ATOM 913 CB PHE A 64 -4.134 -13.448 9.698 1.00 0.00 C ATOM 914 CG PHE A 64 -3.781 -14.229 10.932 1.00 0.00 C ATOM 915 CD1 PHE A 64 -4.225 -13.817 12.179 1.00 0.00 C ATOM 916 CD2 PHE A 64 -3.004 -15.373 10.846 1.00 0.00 C ATOM 917 CE1 PHE A 64 -3.902 -14.534 13.316 1.00 0.00 C ATOM 918 CE2 PHE A 64 -2.679 -16.093 11.979 1.00 0.00 C ATOM 919 CZ PHE A 64 -3.128 -15.673 13.215 1.00 0.00 C ATOM 0 H PHE A 64 -6.078 -11.700 9.867 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.216 -11.736 10.605 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -5.160 -13.680 9.413 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.494 -13.773 8.878 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.830 -12.926 12.263 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.648 -15.706 9.882 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.255 -14.204 14.282 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.074 -16.984 11.898 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.874 -16.235 14.102 1.00 0.00 H new ATOM 929 N ALA A 65 -4.604 -10.977 7.734 1.00 0.00 N ATOM 930 CA ALA A 65 -4.385 -10.347 6.439 1.00 0.00 C ATOM 931 C ALA A 65 -5.435 -9.270 6.189 1.00 0.00 C ATOM 932 O ALA A 65 -6.620 -9.569 6.038 1.00 0.00 O ATOM 933 CB ALA A 65 -4.411 -11.388 5.331 1.00 0.00 C ATOM 0 H ALA A 65 -5.585 -11.149 7.955 1.00 0.00 H new ATOM 0 HA ALA A 65 -3.402 -9.875 6.443 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -4.246 -10.901 4.370 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.626 -12.124 5.505 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -5.380 -11.887 5.323 1.00 0.00 H new ATOM 939 N TYR A 66 -4.996 -8.017 6.165 1.00 0.00 N ATOM 940 CA TYR A 66 -5.891 -6.896 5.957 1.00 0.00 C ATOM 941 C TYR A 66 -5.850 -6.430 4.501 1.00 0.00 C ATOM 942 O TYR A 66 -4.845 -6.596 3.813 1.00 0.00 O ATOM 943 CB TYR A 66 -5.487 -5.768 6.906 1.00 0.00 C ATOM 944 CG TYR A 66 -6.187 -4.461 6.653 1.00 0.00 C ATOM 945 CD1 TYR A 66 -7.521 -4.292 6.984 1.00 0.00 C ATOM 946 CD2 TYR A 66 -5.506 -3.394 6.092 1.00 0.00 C ATOM 947 CE1 TYR A 66 -8.162 -3.091 6.759 1.00 0.00 C ATOM 948 CE2 TYR A 66 -6.135 -2.191 5.865 1.00 0.00 C ATOM 949 CZ TYR A 66 -7.464 -2.043 6.200 1.00 0.00 C ATOM 950 OH TYR A 66 -8.098 -0.840 5.975 1.00 0.00 O ATOM 0 H TYR A 66 -4.018 -7.756 6.288 1.00 0.00 H new ATOM 0 HA TYR A 66 -6.916 -7.200 6.169 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.689 -6.082 7.930 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -4.411 -5.611 6.827 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -8.068 -5.112 7.425 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -4.465 -3.507 5.828 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -9.204 -2.973 7.019 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -5.590 -1.368 5.427 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.851 -0.977 5.363 1.00 0.00 H new ATOM 960 N ASP A 67 -6.953 -5.856 4.034 1.00 0.00 N ATOM 961 CA ASP A 67 -7.037 -5.374 2.659 1.00 0.00 C ATOM 962 C ASP A 67 -7.947 -4.156 2.565 1.00 0.00 C ATOM 963 O ASP A 67 -9.142 -4.240 2.849 1.00 0.00 O ATOM 964 CB ASP A 67 -7.554 -6.482 1.739 1.00 0.00 C ATOM 965 CG ASP A 67 -8.864 -7.071 2.222 1.00 0.00 C ATOM 966 OD1 ASP A 67 -8.863 -7.734 3.280 1.00 0.00 O ATOM 967 OD2 ASP A 67 -9.893 -6.870 1.541 1.00 0.00 O ATOM 0 H ASP A 67 -7.799 -5.713 4.585 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.036 -5.083 2.341 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.687 -6.083 0.734 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.807 -7.272 1.671 1.00 0.00 H new ATOM 972 N PHE A 68 -7.380 -3.019 2.169 1.00 0.00 N ATOM 973 CA PHE A 68 -8.160 -1.790 2.045 1.00 0.00 C ATOM 974 C PHE A 68 -8.176 -1.282 0.607 1.00 0.00 C ATOM 975 O PHE A 68 -7.169 -1.335 -0.096 1.00 0.00 O ATOM 976 CB PHE A 68 -7.617 -0.715 2.992 1.00 0.00 C ATOM 977 CG PHE A 68 -6.422 0.033 2.468 1.00 0.00 C ATOM 978 CD1 PHE A 68 -6.583 1.088 1.585 1.00 0.00 C ATOM 979 CD2 PHE A 68 -5.142 -0.313 2.869 1.00 0.00 C ATOM 980 CE1 PHE A 68 -5.488 1.786 1.112 1.00 0.00 C ATOM 981 CE2 PHE A 68 -4.042 0.380 2.398 1.00 0.00 C ATOM 982 CZ PHE A 68 -4.216 1.432 1.520 1.00 0.00 C ATOM 0 H PHE A 68 -6.393 -2.923 1.930 1.00 0.00 H new ATOM 0 HA PHE A 68 -9.188 -2.017 2.326 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -8.412 -0.001 3.204 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -7.349 -1.184 3.939 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.575 1.368 1.263 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -5.002 -1.133 3.557 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -5.626 2.607 0.424 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.049 0.099 2.716 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.359 1.977 1.153 1.00 0.00 H new ATOM 992 N THR A 69 -9.335 -0.792 0.177 1.00 0.00 N ATOM 993 CA THR A 69 -9.495 -0.273 -1.176 1.00 0.00 C ATOM 994 C THR A 69 -9.767 1.229 -1.150 1.00 0.00 C ATOM 995 O THR A 69 -10.912 1.659 -1.011 1.00 0.00 O ATOM 996 CB THR A 69 -10.637 -1.001 -1.887 1.00 0.00 C ATOM 997 OG1 THR A 69 -10.937 -2.221 -1.234 1.00 0.00 O ATOM 998 CG2 THR A 69 -10.341 -1.320 -3.335 1.00 0.00 C ATOM 0 H THR A 69 -10.179 -0.744 0.748 1.00 0.00 H new ATOM 0 HA THR A 69 -8.568 -0.446 -1.722 1.00 0.00 H new ATOM 0 HB THR A 69 -11.481 -0.312 -1.850 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.620 -2.066 -0.549 1.00 0.00 H new ATOM 0 HG21 THR A 69 -11.194 -1.836 -3.776 1.00 0.00 H new ATOM 0 HG22 THR A 69 -10.155 -0.395 -3.881 1.00 0.00 H new ATOM 0 HG23 THR A 69 -9.460 -1.960 -3.394 1.00 0.00 H new ATOM 1006 N LEU A 70 -8.709 2.021 -1.283 1.00 0.00 N ATOM 1007 CA LEU A 70 -8.837 3.474 -1.271 1.00 0.00 C ATOM 1008 C LEU A 70 -9.301 3.991 -2.628 1.00 0.00 C ATOM 1009 O LEU A 70 -8.859 3.510 -3.671 1.00 0.00 O ATOM 1010 CB LEU A 70 -7.504 4.124 -0.896 1.00 0.00 C ATOM 1011 CG LEU A 70 -7.527 5.653 -0.825 1.00 0.00 C ATOM 1012 CD1 LEU A 70 -7.646 6.120 0.617 1.00 0.00 C ATOM 1013 CD2 LEU A 70 -6.280 6.237 -1.473 1.00 0.00 C ATOM 0 H LEU A 70 -7.754 1.682 -1.400 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.585 3.739 -0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.187 3.735 0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.751 3.820 -1.624 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.399 6.008 -1.374 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.661 7.209 0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.568 5.733 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.794 5.753 1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -6.314 7.325 -1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.395 5.872 -0.952 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -6.237 5.933 -2.519 1.00 0.00 H new ATOM 1025 N ASN A 71 -10.194 4.975 -2.607 1.00 0.00 N ATOM 1026 CA ASN A 71 -10.719 5.559 -3.836 1.00 0.00 C ATOM 1027 C ASN A 71 -10.232 6.993 -4.006 1.00 0.00 C ATOM 1028 O ASN A 71 -10.718 7.908 -3.342 1.00 0.00 O ATOM 1029 CB ASN A 71 -12.248 5.525 -3.830 1.00 0.00 C ATOM 1030 CG ASN A 71 -12.794 4.140 -4.114 1.00 0.00 C ATOM 1031 OD1 ASN A 71 -13.488 3.925 -5.108 1.00 0.00 O ATOM 1032 ND2 ASN A 71 -12.484 3.192 -3.238 1.00 0.00 N ATOM 0 H ASN A 71 -10.569 5.385 -1.752 1.00 0.00 H new ATOM 0 HA ASN A 71 -10.353 4.967 -4.675 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.613 5.865 -2.861 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -12.628 6.223 -4.576 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -12.824 2.240 -3.375 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -11.906 3.415 -2.428 1.00 0.00 H new ATOM 1039 N TYR A 72 -9.270 7.183 -4.902 1.00 0.00 N ATOM 1040 CA TYR A 72 -8.718 8.508 -5.161 1.00 0.00 C ATOM 1041 C TYR A 72 -9.324 9.112 -6.423 1.00 0.00 C ATOM 1042 O TYR A 72 -10.283 8.577 -6.978 1.00 0.00 O ATOM 1043 CB TYR A 72 -7.193 8.436 -5.286 1.00 0.00 C ATOM 1044 CG TYR A 72 -6.718 7.641 -6.481 1.00 0.00 C ATOM 1045 CD1 TYR A 72 -6.665 6.254 -6.440 1.00 0.00 C ATOM 1046 CD2 TYR A 72 -6.320 8.278 -7.648 1.00 0.00 C ATOM 1047 CE1 TYR A 72 -6.229 5.523 -7.530 1.00 0.00 C ATOM 1048 CE2 TYR A 72 -5.883 7.556 -8.743 1.00 0.00 C ATOM 1049 CZ TYR A 72 -5.839 6.180 -8.678 1.00 0.00 C ATOM 1050 OH TYR A 72 -5.405 5.457 -9.765 1.00 0.00 O ATOM 0 H TYR A 72 -8.856 6.437 -5.461 1.00 0.00 H new ATOM 0 HA TYR A 72 -8.971 9.152 -4.319 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.795 9.448 -5.353 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -6.784 7.991 -4.379 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.969 5.737 -5.542 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.352 9.356 -7.702 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.194 4.445 -7.482 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -5.578 8.067 -9.644 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.850 4.584 -9.776 1.00 0.00 H new ATOM 1060 N ASP A 73 -8.766 10.233 -6.869 1.00 0.00 N ATOM 1061 CA ASP A 73 -9.258 10.910 -8.063 1.00 0.00 C ATOM 1062 C ASP A 73 -8.425 10.545 -9.286 1.00 0.00 C ATOM 1063 O ASP A 73 -7.202 10.688 -9.282 1.00 0.00 O ATOM 1064 CB ASP A 73 -9.246 12.426 -7.857 1.00 0.00 C ATOM 1065 CG ASP A 73 -9.870 13.172 -9.020 1.00 0.00 C ATOM 1066 OD1 ASP A 73 -11.115 13.265 -9.065 1.00 0.00 O ATOM 1067 OD2 ASP A 73 -9.115 13.664 -9.884 1.00 0.00 O ATOM 0 H ASP A 73 -7.973 10.692 -6.421 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.282 10.580 -8.237 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.785 12.670 -6.941 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.218 12.763 -7.722 1.00 0.00 H new ATOM 1072 N GLU A 74 -9.096 10.078 -10.335 1.00 0.00 N ATOM 1073 CA GLU A 74 -8.417 9.696 -11.568 1.00 0.00 C ATOM 1074 C GLU A 74 -8.213 10.906 -12.479 1.00 0.00 C ATOM 1075 O GLU A 74 -7.397 10.865 -13.401 1.00 0.00 O ATOM 1076 CB GLU A 74 -9.217 8.617 -12.304 1.00 0.00 C ATOM 1077 CG GLU A 74 -10.695 8.944 -12.443 1.00 0.00 C ATOM 1078 CD GLU A 74 -11.541 8.288 -11.370 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -11.334 8.600 -10.179 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -12.410 7.462 -11.721 1.00 0.00 O ATOM 0 H GLU A 74 -10.108 9.955 -10.355 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.438 9.296 -11.303 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.790 8.474 -13.297 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.111 7.672 -11.772 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.830 10.025 -12.397 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.044 8.621 -13.424 1.00 0.00 H new ATOM 1087 N ASN A 75 -8.954 11.980 -12.218 1.00 0.00 N ATOM 1088 CA ASN A 75 -8.847 13.197 -13.017 1.00 0.00 C ATOM 1089 C ASN A 75 -7.913 14.205 -12.355 1.00 0.00 C ATOM 1090 O ASN A 75 -8.070 15.414 -12.520 1.00 0.00 O ATOM 1091 CB ASN A 75 -10.228 13.821 -13.220 1.00 0.00 C ATOM 1092 CG ASN A 75 -11.192 12.880 -13.917 1.00 0.00 C ATOM 1093 OD1 ASN A 75 -11.111 12.674 -15.127 1.00 0.00 O ATOM 1094 ND2 ASN A 75 -12.114 12.305 -13.152 1.00 0.00 N ATOM 0 H ASN A 75 -9.634 12.032 -11.460 1.00 0.00 H new ATOM 0 HA ASN A 75 -8.430 12.928 -13.988 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.640 14.107 -12.252 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -10.128 14.734 -13.807 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -12.791 11.664 -13.565 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -12.144 12.505 -12.152 1.00 0.00 H new ATOM 1101 N ALA A 76 -6.940 13.698 -11.605 1.00 0.00 N ATOM 1102 CA ALA A 76 -5.976 14.549 -10.918 1.00 0.00 C ATOM 1103 C ALA A 76 -4.862 13.712 -10.301 1.00 0.00 C ATOM 1104 O ALA A 76 -3.679 14.000 -10.484 1.00 0.00 O ATOM 1105 CB ALA A 76 -6.671 15.378 -9.848 1.00 0.00 C ATOM 0 H ALA A 76 -6.798 12.699 -11.457 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.532 15.224 -11.649 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.939 16.008 -9.343 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -7.432 16.006 -10.311 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -7.140 14.715 -9.122 1.00 0.00 H new ATOM 1111 N PHE A 77 -5.250 12.669 -9.575 1.00 0.00 N ATOM 1112 CA PHE A 77 -4.285 11.782 -8.938 1.00 0.00 C ATOM 1113 C PHE A 77 -3.976 10.594 -9.844 1.00 0.00 C ATOM 1114 O PHE A 77 -4.638 10.391 -10.861 1.00 0.00 O ATOM 1115 CB PHE A 77 -4.823 11.289 -7.593 1.00 0.00 C ATOM 1116 CG PHE A 77 -4.302 12.063 -6.416 1.00 0.00 C ATOM 1117 CD1 PHE A 77 -2.967 11.985 -6.053 1.00 0.00 C ATOM 1118 CD2 PHE A 77 -5.150 12.866 -5.669 1.00 0.00 C ATOM 1119 CE1 PHE A 77 -2.487 12.695 -4.969 1.00 0.00 C ATOM 1120 CE2 PHE A 77 -4.676 13.577 -4.583 1.00 0.00 C ATOM 1121 CZ PHE A 77 -3.342 13.491 -4.233 1.00 0.00 C ATOM 0 H PHE A 77 -6.225 12.418 -9.413 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.365 12.340 -8.766 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -5.911 11.348 -7.603 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.562 10.238 -7.470 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.294 11.362 -6.624 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.193 12.937 -5.939 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.444 12.627 -4.698 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -5.347 14.199 -4.009 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.969 14.046 -3.385 1.00 0.00 H new ATOM 1131 N GLU A 78 -2.970 9.814 -9.470 1.00 0.00 N ATOM 1132 CA GLU A 78 -2.580 8.650 -10.257 1.00 0.00 C ATOM 1133 C GLU A 78 -1.922 7.591 -9.378 1.00 0.00 C ATOM 1134 O GLU A 78 -0.797 7.771 -8.913 1.00 0.00 O ATOM 1135 CB GLU A 78 -1.625 9.063 -11.378 1.00 0.00 C ATOM 1136 CG GLU A 78 -1.154 7.902 -12.239 1.00 0.00 C ATOM 1137 CD GLU A 78 -0.780 8.332 -13.644 1.00 0.00 C ATOM 1138 OE1 GLU A 78 -1.466 9.218 -14.197 1.00 0.00 O ATOM 1139 OE2 GLU A 78 0.200 7.784 -14.192 1.00 0.00 O ATOM 0 H GLU A 78 -2.411 9.965 -8.630 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.482 8.222 -10.695 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.121 9.797 -12.013 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.756 9.555 -10.940 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.293 7.430 -11.766 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -1.941 7.150 -12.291 1.00 0.00 H new ATOM 1146 N TYR A 79 -2.629 6.487 -9.160 1.00 0.00 N ATOM 1147 CA TYR A 79 -2.110 5.397 -8.340 1.00 0.00 C ATOM 1148 C TYR A 79 -0.734 4.959 -8.841 1.00 0.00 C ATOM 1149 O TYR A 79 -0.473 4.954 -10.044 1.00 0.00 O ATOM 1150 CB TYR A 79 -3.087 4.215 -8.350 1.00 0.00 C ATOM 1151 CG TYR A 79 -2.466 2.898 -7.937 1.00 0.00 C ATOM 1152 CD1 TYR A 79 -1.955 2.718 -6.657 1.00 0.00 C ATOM 1153 CD2 TYR A 79 -2.383 1.839 -8.831 1.00 0.00 C ATOM 1154 CE1 TYR A 79 -1.380 1.519 -6.281 1.00 0.00 C ATOM 1155 CE2 TYR A 79 -1.812 0.636 -8.461 1.00 0.00 C ATOM 1156 CZ TYR A 79 -1.312 0.483 -7.186 1.00 0.00 C ATOM 1157 OH TYR A 79 -0.737 -0.710 -6.817 1.00 0.00 O ATOM 0 H TYR A 79 -3.562 6.323 -9.539 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.004 5.752 -7.315 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -3.918 4.438 -7.681 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.504 4.110 -9.352 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.008 3.528 -5.945 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.771 1.957 -9.832 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -0.986 1.395 -5.283 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.758 -0.179 -9.167 1.00 0.00 H new ATOM 0 HH TYR A 79 -1.012 -1.413 -7.442 1.00 0.00 H new ATOM 1167 N VAL A 80 0.142 4.596 -7.910 1.00 0.00 N ATOM 1168 CA VAL A 80 1.488 4.162 -8.258 1.00 0.00 C ATOM 1169 C VAL A 80 1.778 2.765 -7.717 1.00 0.00 C ATOM 1170 O VAL A 80 1.842 1.798 -8.473 1.00 0.00 O ATOM 1171 CB VAL A 80 2.546 5.147 -7.722 1.00 0.00 C ATOM 1172 CG1 VAL A 80 3.938 4.745 -8.184 1.00 0.00 C ATOM 1173 CG2 VAL A 80 2.219 6.566 -8.160 1.00 0.00 C ATOM 0 H VAL A 80 -0.057 4.594 -6.910 1.00 0.00 H new ATOM 0 HA VAL A 80 1.543 4.137 -9.346 1.00 0.00 H new ATOM 0 HB VAL A 80 2.530 5.112 -6.633 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.669 5.453 -7.795 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.169 3.746 -7.816 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.975 4.748 -9.273 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.975 7.249 -7.774 1.00 0.00 H new ATOM 0 HG22 VAL A 80 2.206 6.617 -9.249 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.241 6.850 -7.772 1.00 0.00 H new ATOM 1183 N GLU A 81 1.955 2.669 -6.402 1.00 0.00 N ATOM 1184 CA GLU A 81 2.238 1.391 -5.764 1.00 0.00 C ATOM 1185 C GLU A 81 2.170 1.513 -4.246 1.00 0.00 C ATOM 1186 O GLU A 81 2.574 2.524 -3.676 1.00 0.00 O ATOM 1187 CB GLU A 81 3.619 0.882 -6.186 1.00 0.00 C ATOM 1188 CG GLU A 81 4.764 1.764 -5.710 1.00 0.00 C ATOM 1189 CD GLU A 81 6.080 1.421 -6.380 1.00 0.00 C ATOM 1190 OE1 GLU A 81 6.068 1.121 -7.593 1.00 0.00 O ATOM 1191 OE2 GLU A 81 7.122 1.451 -5.693 1.00 0.00 O ATOM 0 H GLU A 81 1.907 3.460 -5.760 1.00 0.00 H new ATOM 0 HA GLU A 81 1.480 0.677 -6.086 1.00 0.00 H new ATOM 0 HB2 GLU A 81 3.761 -0.126 -5.795 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.654 0.810 -7.273 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.521 2.808 -5.908 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.872 1.661 -4.630 1.00 0.00 H new ATOM 1198 N ALA A 82 1.654 0.474 -3.597 1.00 0.00 N ATOM 1199 CA ALA A 82 1.533 0.465 -2.144 1.00 0.00 C ATOM 1200 C ALA A 82 2.809 0.058 -1.488 1.00 0.00 C ATOM 1201 O ALA A 82 3.658 -0.619 -2.070 1.00 0.00 O ATOM 1202 CB ALA A 82 0.378 -0.419 -1.701 1.00 0.00 C ATOM 0 H ALA A 82 1.313 -0.372 -4.054 1.00 0.00 H new ATOM 0 HA ALA A 82 1.318 1.485 -1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 82 0.309 -0.409 -0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -0.552 -0.043 -2.127 1.00 0.00 H new ATOM 0 HB3 ALA A 82 0.548 -1.439 -2.044 1.00 0.00 H new ATOM 1208 N ILE A 83 2.948 0.537 -0.274 1.00 0.00 N ATOM 1209 CA ILE A 83 4.133 0.302 0.488 1.00 0.00 C ATOM 1210 C ILE A 83 3.842 -0.350 1.824 1.00 0.00 C ATOM 1211 O ILE A 83 2.768 -0.192 2.403 1.00 0.00 O ATOM 1212 CB ILE A 83 4.905 1.612 0.714 1.00 0.00 C ATOM 1213 CG1 ILE A 83 4.203 2.801 0.047 1.00 0.00 C ATOM 1214 CG2 ILE A 83 6.310 1.463 0.175 1.00 0.00 C ATOM 1215 CD1 ILE A 83 4.732 4.144 0.500 1.00 0.00 C ATOM 0 H ILE A 83 2.242 1.097 0.204 1.00 0.00 H new ATOM 0 HA ILE A 83 4.744 -0.387 -0.095 1.00 0.00 H new ATOM 0 HB ILE A 83 4.940 1.812 1.785 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.317 2.720 -1.034 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.135 2.749 0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.861 2.390 0.333 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.814 0.648 0.694 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.269 1.243 -0.892 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.191 4.940 -0.012 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.594 4.245 1.576 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.793 4.216 0.262 1.00 0.00 H new ATOM 1227 N SER A 84 4.833 -1.079 2.292 1.00 0.00 N ATOM 1228 CA SER A 84 4.751 -1.783 3.566 1.00 0.00 C ATOM 1229 C SER A 84 5.911 -1.390 4.477 1.00 0.00 C ATOM 1230 O SER A 84 6.687 -0.490 4.157 1.00 0.00 O ATOM 1231 CB SER A 84 4.756 -3.296 3.338 1.00 0.00 C ATOM 1232 OG SER A 84 5.297 -3.619 2.068 1.00 0.00 O ATOM 0 H SER A 84 5.720 -1.204 1.804 1.00 0.00 H new ATOM 0 HA SER A 84 3.817 -1.500 4.052 1.00 0.00 H new ATOM 0 HB2 SER A 84 5.339 -3.783 4.120 1.00 0.00 H new ATOM 0 HB3 SER A 84 3.739 -3.681 3.412 1.00 0.00 H new ATOM 0 HG SER A 84 5.766 -4.478 2.121 1.00 0.00 H new ATOM 1238 N ASP A 85 6.022 -2.071 5.613 1.00 0.00 N ATOM 1239 CA ASP A 85 7.088 -1.796 6.572 1.00 0.00 C ATOM 1240 C ASP A 85 8.320 -2.650 6.270 1.00 0.00 C ATOM 1241 O ASP A 85 8.496 -3.122 5.148 1.00 0.00 O ATOM 1242 CB ASP A 85 6.592 -2.057 7.998 1.00 0.00 C ATOM 1243 CG ASP A 85 5.215 -1.476 8.251 1.00 0.00 C ATOM 1244 OD1 ASP A 85 5.088 -0.234 8.261 1.00 0.00 O ATOM 1245 OD2 ASP A 85 4.263 -2.263 8.437 1.00 0.00 O ATOM 0 H ASP A 85 5.387 -2.818 5.893 1.00 0.00 H new ATOM 0 HA ASP A 85 7.372 -0.747 6.485 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.568 -3.132 8.180 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.299 -1.629 8.709 1.00 0.00 H new ATOM 1250 N ASP A 86 9.170 -2.849 7.277 1.00 0.00 N ATOM 1251 CA ASP A 86 10.380 -3.649 7.112 1.00 0.00 C ATOM 1252 C ASP A 86 10.127 -5.099 7.512 1.00 0.00 C ATOM 1253 O ASP A 86 10.990 -5.754 8.097 1.00 0.00 O ATOM 1254 CB ASP A 86 11.520 -3.066 7.948 1.00 0.00 C ATOM 1255 CG ASP A 86 11.117 -2.830 9.391 1.00 0.00 C ATOM 1256 OD1 ASP A 86 10.183 -3.510 9.866 1.00 0.00 O ATOM 1257 OD2 ASP A 86 11.734 -1.963 10.046 1.00 0.00 O ATOM 0 H ASP A 86 9.042 -2.467 8.214 1.00 0.00 H new ATOM 0 HA ASP A 86 10.664 -3.625 6.060 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.373 -3.744 7.918 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.846 -2.124 7.506 1.00 0.00 H new ATOM 1262 N GLY A 87 8.936 -5.592 7.192 1.00 0.00 N ATOM 1263 CA GLY A 87 8.577 -6.959 7.520 1.00 0.00 C ATOM 1264 C GLY A 87 7.275 -7.384 6.870 1.00 0.00 C ATOM 1265 O GLY A 87 7.100 -8.550 6.515 1.00 0.00 O ATOM 0 H GLY A 87 8.209 -5.065 6.708 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.376 -7.629 7.200 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.490 -7.060 8.602 1.00 0.00 H new ATOM 1269 N VAL A 88 6.356 -6.433 6.714 1.00 0.00 N ATOM 1270 CA VAL A 88 5.063 -6.709 6.103 1.00 0.00 C ATOM 1271 C VAL A 88 5.136 -6.580 4.584 1.00 0.00 C ATOM 1272 O VAL A 88 6.021 -5.913 4.051 1.00 0.00 O ATOM 1273 CB VAL A 88 3.976 -5.756 6.637 1.00 0.00 C ATOM 1274 CG1 VAL A 88 2.594 -6.235 6.227 1.00 0.00 C ATOM 1275 CG2 VAL A 88 4.075 -5.624 8.150 1.00 0.00 C ATOM 0 H VAL A 88 6.486 -5.464 7.004 1.00 0.00 H new ATOM 0 HA VAL A 88 4.799 -7.733 6.366 1.00 0.00 H new ATOM 0 HB VAL A 88 4.138 -4.772 6.198 1.00 0.00 H new ATOM 0 HG11 VAL A 88 1.841 -5.548 6.614 1.00 0.00 H new ATOM 0 HG12 VAL A 88 2.529 -6.270 5.140 1.00 0.00 H new ATOM 0 HG13 VAL A 88 2.419 -7.231 6.633 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.299 -4.947 8.508 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.943 -6.603 8.610 1.00 0.00 H new ATOM 0 HG23 VAL A 88 5.054 -5.227 8.417 1.00 0.00 H new ATOM 1285 N PHE A 89 4.200 -7.225 3.893 1.00 0.00 N ATOM 1286 CA PHE A 89 4.162 -7.183 2.436 1.00 0.00 C ATOM 1287 C PHE A 89 2.902 -6.476 1.943 1.00 0.00 C ATOM 1288 O PHE A 89 1.813 -7.048 1.949 1.00 0.00 O ATOM 1289 CB PHE A 89 4.221 -8.601 1.864 1.00 0.00 C ATOM 1290 CG PHE A 89 5.146 -8.736 0.688 1.00 0.00 C ATOM 1291 CD1 PHE A 89 6.476 -8.359 0.789 1.00 0.00 C ATOM 1292 CD2 PHE A 89 4.687 -9.241 -0.517 1.00 0.00 C ATOM 1293 CE1 PHE A 89 7.329 -8.481 -0.291 1.00 0.00 C ATOM 1294 CE2 PHE A 89 5.534 -9.365 -1.601 1.00 0.00 C ATOM 1295 CZ PHE A 89 6.858 -8.984 -1.487 1.00 0.00 C ATOM 0 H PHE A 89 3.459 -7.782 4.319 1.00 0.00 H new ATOM 0 HA PHE A 89 5.030 -6.621 2.091 1.00 0.00 H new ATOM 0 HB2 PHE A 89 4.541 -9.287 2.648 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.218 -8.905 1.564 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.850 -7.965 1.723 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.654 -9.542 -0.610 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.363 -8.183 -0.200 1.00 0.00 H new ATOM 0 HE2 PHE A 89 5.163 -9.759 -2.536 1.00 0.00 H new ATOM 0 HZ PHE A 89 7.523 -9.080 -2.333 1.00 0.00 H new ATOM 1305 N VAL A 90 3.064 -5.227 1.515 1.00 0.00 N ATOM 1306 CA VAL A 90 1.946 -4.436 1.015 1.00 0.00 C ATOM 1307 C VAL A 90 1.996 -4.335 -0.508 1.00 0.00 C ATOM 1308 O VAL A 90 2.973 -3.845 -1.075 1.00 0.00 O ATOM 1309 CB VAL A 90 1.950 -3.021 1.642 1.00 0.00 C ATOM 1310 CG1 VAL A 90 1.207 -2.020 0.772 1.00 0.00 C ATOM 1311 CG2 VAL A 90 1.349 -3.063 3.035 1.00 0.00 C ATOM 0 H VAL A 90 3.961 -4.741 1.505 1.00 0.00 H new ATOM 0 HA VAL A 90 1.023 -4.940 1.302 1.00 0.00 H new ATOM 0 HB VAL A 90 2.986 -2.690 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 90 1.231 -1.038 1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.684 -1.963 -0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 90 0.172 -2.340 0.653 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.358 -2.062 3.465 1.00 0.00 H new ATOM 0 HG22 VAL A 90 0.322 -3.424 2.978 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.935 -3.733 3.664 1.00 0.00 H new ATOM 1321 N ASN A 91 0.939 -4.808 -1.167 1.00 0.00 N ATOM 1322 CA ASN A 91 0.875 -4.774 -2.624 1.00 0.00 C ATOM 1323 C ASN A 91 -0.472 -4.269 -3.111 1.00 0.00 C ATOM 1324 O ASN A 91 -1.511 -4.877 -2.857 1.00 0.00 O ATOM 1325 CB ASN A 91 1.143 -6.161 -3.202 1.00 0.00 C ATOM 1326 CG ASN A 91 2.562 -6.610 -2.950 1.00 0.00 C ATOM 1327 OD1 ASN A 91 2.881 -6.848 -1.688 1.00 0.00 O flip ATOM 1328 ND2 ASN A 91 3.360 -6.741 -3.877 1.00 0.00 N flip ATOM 0 H ASN A 91 0.120 -5.217 -0.716 1.00 0.00 H new ATOM 0 HA ASN A 91 1.644 -4.083 -2.969 1.00 0.00 H new ATOM 0 HB2 ASN A 91 0.451 -6.878 -2.761 1.00 0.00 H new ATOM 0 HB3 ASN A 91 0.950 -6.151 -4.275 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.067 -6.545 -4.834 1.00 0.00 H new ATOM 0 HD22 ASN A 91 4.315 -7.045 -3.689 1.00 0.00 H new ATOM 1335 N ALA A 92 -0.442 -3.155 -3.825 1.00 0.00 N ATOM 1336 CA ALA A 92 -1.658 -2.562 -4.366 1.00 0.00 C ATOM 1337 C ALA A 92 -1.867 -2.973 -5.818 1.00 0.00 C ATOM 1338 O ALA A 92 -0.907 -3.163 -6.564 1.00 0.00 O ATOM 1339 CB ALA A 92 -1.615 -1.049 -4.241 1.00 0.00 C ATOM 0 H ALA A 92 0.412 -2.641 -4.044 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.502 -2.934 -3.785 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.531 -0.624 -4.650 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.525 -0.773 -3.190 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -0.758 -0.663 -4.793 1.00 0.00 H new ATOM 1345 N LYS A 93 -3.128 -3.113 -6.209 1.00 0.00 N ATOM 1346 CA LYS A 93 -3.459 -3.505 -7.573 1.00 0.00 C ATOM 1347 C LYS A 93 -4.543 -2.607 -8.163 1.00 0.00 C ATOM 1348 O LYS A 93 -5.716 -2.704 -7.802 1.00 0.00 O ATOM 1349 CB LYS A 93 -3.918 -4.964 -7.605 1.00 0.00 C ATOM 1350 CG LYS A 93 -3.457 -5.718 -8.842 1.00 0.00 C ATOM 1351 CD LYS A 93 -4.300 -5.363 -10.057 1.00 0.00 C ATOM 1352 CE LYS A 93 -3.472 -5.385 -11.332 1.00 0.00 C ATOM 1353 NZ LYS A 93 -2.512 -4.249 -11.393 1.00 0.00 N ATOM 0 H LYS A 93 -3.935 -2.962 -5.604 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.560 -3.394 -8.180 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.543 -5.474 -6.718 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.006 -4.995 -7.555 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.411 -5.485 -9.043 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.515 -6.791 -8.658 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.127 -6.067 -10.146 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.737 -4.374 -9.922 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.925 -6.326 -11.393 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.135 -5.346 -12.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.219 -4.095 -12.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.969 -3.388 -11.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.677 -4.469 -10.814 1.00 0.00 H new ATOM 1367 N LYS A 94 -4.130 -1.741 -9.079 1.00 0.00 N ATOM 1368 CA LYS A 94 -5.034 -0.819 -9.746 1.00 0.00 C ATOM 1369 C LYS A 94 -6.184 -1.561 -10.412 1.00 0.00 C ATOM 1370 O LYS A 94 -6.064 -2.036 -11.542 1.00 0.00 O ATOM 1371 CB LYS A 94 -4.275 0.004 -10.790 1.00 0.00 C ATOM 1372 CG LYS A 94 -4.898 1.363 -11.062 1.00 0.00 C ATOM 1373 CD LYS A 94 -4.301 2.011 -12.302 1.00 0.00 C ATOM 1374 CE LYS A 94 -5.002 3.316 -12.641 1.00 0.00 C ATOM 1375 NZ LYS A 94 -4.245 4.498 -12.142 1.00 0.00 N ATOM 0 H LYS A 94 -3.159 -1.659 -9.379 1.00 0.00 H new ATOM 0 HA LYS A 94 -5.448 -0.151 -8.991 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.248 0.145 -10.453 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.230 -0.559 -11.722 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.975 1.252 -11.191 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.745 2.013 -10.201 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.239 2.198 -12.141 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.379 1.325 -13.146 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.124 3.393 -13.721 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.002 3.315 -12.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.322 5.275 -12.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.639 4.803 -11.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.244 4.243 -12.019 1.00 0.00 H new ATOM 1389 N ILE A 95 -7.298 -1.647 -9.703 1.00 0.00 N ATOM 1390 CA ILE A 95 -8.481 -2.324 -10.217 1.00 0.00 C ATOM 1391 C ILE A 95 -9.267 -1.408 -11.151 1.00 0.00 C ATOM 1392 O ILE A 95 -9.922 -1.870 -12.085 1.00 0.00 O ATOM 1393 CB ILE A 95 -9.399 -2.788 -9.068 1.00 0.00 C ATOM 1394 CG1 ILE A 95 -10.625 -3.523 -9.615 1.00 0.00 C ATOM 1395 CG2 ILE A 95 -9.814 -1.597 -8.219 1.00 0.00 C ATOM 1396 CD1 ILE A 95 -10.655 -4.993 -9.262 1.00 0.00 C ATOM 0 H ILE A 95 -7.409 -1.256 -8.768 1.00 0.00 H new ATOM 0 HA ILE A 95 -8.140 -3.198 -10.773 1.00 0.00 H new ATOM 0 HB ILE A 95 -8.846 -3.486 -8.439 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.526 -3.047 -9.229 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.648 -3.418 -10.700 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -10.462 -1.935 -7.410 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.927 -1.123 -7.799 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.351 -0.878 -8.838 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.551 -5.450 -9.682 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -9.772 -5.484 -9.671 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -10.664 -5.107 -8.178 1.00 0.00 H new ATOM 1408 N GLU A 96 -9.196 -0.105 -10.893 1.00 0.00 N ATOM 1409 CA GLU A 96 -9.901 0.876 -11.712 1.00 0.00 C ATOM 1410 C GLU A 96 -9.300 2.269 -11.538 1.00 0.00 C ATOM 1411 O GLU A 96 -8.221 2.423 -10.965 1.00 0.00 O ATOM 1412 CB GLU A 96 -11.388 0.898 -11.350 1.00 0.00 C ATOM 1413 CG GLU A 96 -12.306 0.999 -12.556 1.00 0.00 C ATOM 1414 CD GLU A 96 -13.606 1.712 -12.241 1.00 0.00 C ATOM 1415 OE1 GLU A 96 -14.433 1.139 -11.501 1.00 0.00 O ATOM 1416 OE2 GLU A 96 -13.797 2.844 -12.734 1.00 0.00 O ATOM 0 H GLU A 96 -8.658 0.295 -10.124 1.00 0.00 H new ATOM 0 HA GLU A 96 -9.792 0.584 -12.757 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.631 -0.007 -10.793 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -11.579 1.741 -10.686 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.790 1.529 -13.357 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.526 -0.003 -12.926 1.00 0.00 H new ATOM 1423 N ASP A 97 -10.006 3.280 -12.037 1.00 0.00 N ATOM 1424 CA ASP A 97 -9.547 4.662 -11.940 1.00 0.00 C ATOM 1425 C ASP A 97 -9.921 5.269 -10.592 1.00 0.00 C ATOM 1426 O ASP A 97 -11.075 5.209 -10.171 1.00 0.00 O ATOM 1427 CB ASP A 97 -10.143 5.497 -13.073 1.00 0.00 C ATOM 1428 CG ASP A 97 -9.170 5.695 -14.220 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -7.990 6.001 -13.951 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -9.589 5.542 -15.387 1.00 0.00 O ATOM 0 H ASP A 97 -10.901 3.167 -12.514 1.00 0.00 H new ATOM 0 HA ASP A 97 -8.460 4.665 -12.027 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -11.044 5.009 -13.445 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -10.444 6.470 -12.684 1.00 0.00 H new ATOM 1435 N GLY A 98 -8.934 5.854 -9.919 1.00 0.00 N ATOM 1436 CA GLY A 98 -9.179 6.467 -8.626 1.00 0.00 C ATOM 1437 C GLY A 98 -9.720 5.483 -7.610 1.00 0.00 C ATOM 1438 O GLY A 98 -10.512 5.848 -6.741 1.00 0.00 O ATOM 0 H GLY A 98 -7.970 5.914 -10.246 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.251 6.898 -8.251 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -9.887 7.287 -8.745 1.00 0.00 H new ATOM 1442 N LYS A 99 -9.287 4.231 -7.714 1.00 0.00 N ATOM 1443 CA LYS A 99 -9.723 3.190 -6.798 1.00 0.00 C ATOM 1444 C LYS A 99 -8.950 1.917 -7.066 1.00 0.00 C ATOM 1445 O LYS A 99 -8.954 1.403 -8.185 1.00 0.00 O ATOM 1446 CB LYS A 99 -11.228 2.943 -6.923 1.00 0.00 C ATOM 1447 CG LYS A 99 -11.692 2.721 -8.353 1.00 0.00 C ATOM 1448 CD LYS A 99 -12.919 1.826 -8.409 1.00 0.00 C ATOM 1449 CE LYS A 99 -12.588 0.398 -8.007 1.00 0.00 C ATOM 1450 NZ LYS A 99 -13.673 -0.216 -7.193 1.00 0.00 N ATOM 0 H LYS A 99 -8.631 3.914 -8.428 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.525 3.519 -5.778 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -11.496 2.073 -6.324 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -11.763 3.795 -6.504 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -11.920 3.681 -8.816 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -10.886 2.271 -8.932 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -13.689 2.222 -7.747 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.331 1.834 -9.418 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -12.422 -0.202 -8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.658 0.387 -7.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -13.408 -1.189 -6.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -13.815 0.341 -6.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -14.555 -0.229 -7.744 1.00 0.00 H new ATOM 1464 N VAL A 100 -8.256 1.432 -6.051 1.00 0.00 N ATOM 1465 CA VAL A 100 -7.444 0.243 -6.207 1.00 0.00 C ATOM 1466 C VAL A 100 -7.348 -0.548 -4.905 1.00 0.00 C ATOM 1467 O VAL A 100 -7.536 0.000 -3.818 1.00 0.00 O ATOM 1468 CB VAL A 100 -6.050 0.633 -6.729 1.00 0.00 C ATOM 1469 CG1 VAL A 100 -6.192 1.599 -7.898 1.00 0.00 C ATOM 1470 CG2 VAL A 100 -5.215 1.277 -5.646 1.00 0.00 C ATOM 0 H VAL A 100 -8.240 1.842 -5.117 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.923 -0.410 -6.937 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.546 -0.277 -7.054 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.203 1.873 -8.265 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.757 1.121 -8.698 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.718 2.495 -7.568 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -4.237 1.540 -6.049 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.714 2.178 -5.289 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.091 0.578 -4.819 1.00 0.00 H new ATOM 1480 N ARG A 101 -7.084 -1.846 -5.026 1.00 0.00 N ATOM 1481 CA ARG A 101 -6.999 -2.722 -3.859 1.00 0.00 C ATOM 1482 C ARG A 101 -5.559 -2.927 -3.403 1.00 0.00 C ATOM 1483 O ARG A 101 -4.629 -2.852 -4.199 1.00 0.00 O ATOM 1484 CB ARG A 101 -7.640 -4.077 -4.173 1.00 0.00 C ATOM 1485 CG ARG A 101 -7.618 -5.047 -3.002 1.00 0.00 C ATOM 1486 CD ARG A 101 -8.488 -4.559 -1.856 1.00 0.00 C ATOM 1487 NE ARG A 101 -9.912 -4.722 -2.141 1.00 0.00 N ATOM 1488 CZ ARG A 101 -10.563 -5.878 -2.032 1.00 0.00 C ATOM 1489 NH1 ARG A 101 -9.922 -6.974 -1.645 1.00 0.00 N ATOM 1490 NH2 ARG A 101 -11.857 -5.939 -2.313 1.00 0.00 N ATOM 0 H ARG A 101 -6.925 -2.315 -5.918 1.00 0.00 H new ATOM 0 HA ARG A 101 -7.539 -2.237 -3.046 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -8.673 -3.918 -4.483 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -7.120 -4.529 -5.018 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -7.966 -6.026 -3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -6.593 -5.174 -2.653 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -8.235 -5.108 -0.949 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -8.275 -3.508 -1.662 1.00 0.00 H new ATOM 0 HE ARG A 101 -10.438 -3.901 -2.441 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -8.926 -6.933 -1.429 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -10.426 -7.857 -1.563 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -12.354 -5.100 -2.613 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -12.356 -6.825 -2.229 1.00 0.00 H new ATOM 1504 N VAL A 102 -5.391 -3.194 -2.109 1.00 0.00 N ATOM 1505 CA VAL A 102 -4.069 -3.421 -1.539 1.00 0.00 C ATOM 1506 C VAL A 102 -4.036 -4.718 -0.736 1.00 0.00 C ATOM 1507 O VAL A 102 -5.015 -5.087 -0.089 1.00 0.00 O ATOM 1508 CB VAL A 102 -3.634 -2.254 -0.633 1.00 0.00 C ATOM 1509 CG1 VAL A 102 -4.626 -2.061 0.502 1.00 0.00 C ATOM 1510 CG2 VAL A 102 -2.231 -2.487 -0.093 1.00 0.00 C ATOM 0 H VAL A 102 -6.156 -3.258 -1.437 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.373 -3.494 -2.374 1.00 0.00 H new ATOM 0 HB VAL A 102 -3.619 -1.342 -1.230 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -4.302 -1.232 1.131 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -5.611 -1.841 0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -4.677 -2.971 1.099 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -1.943 -1.651 0.545 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -2.213 -3.409 0.488 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -1.530 -2.568 -0.924 1.00 0.00 H new ATOM 1520 N LEU A 103 -2.902 -5.408 -0.792 1.00 0.00 N ATOM 1521 CA LEU A 103 -2.737 -6.671 -0.079 1.00 0.00 C ATOM 1522 C LEU A 103 -1.622 -6.580 0.959 1.00 0.00 C ATOM 1523 O LEU A 103 -0.443 -6.544 0.611 1.00 0.00 O ATOM 1524 CB LEU A 103 -2.426 -7.797 -1.066 1.00 0.00 C ATOM 1525 CG LEU A 103 -3.282 -7.803 -2.333 1.00 0.00 C ATOM 1526 CD1 LEU A 103 -2.613 -8.625 -3.425 1.00 0.00 C ATOM 1527 CD2 LEU A 103 -4.672 -8.341 -2.033 1.00 0.00 C ATOM 0 H LEU A 103 -2.083 -5.114 -1.324 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.672 -6.886 0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.377 -7.727 -1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.553 -8.752 -0.556 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.380 -6.777 -2.688 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -3.236 -8.618 -4.319 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.639 -8.195 -3.658 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.484 -9.651 -3.081 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -5.268 -8.338 -2.946 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.594 -9.360 -1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -5.152 -7.711 -1.284 1.00 0.00 H new ATOM 1539 N VAL A 104 -2.000 -6.558 2.235 1.00 0.00 N ATOM 1540 CA VAL A 104 -1.021 -6.488 3.314 1.00 0.00 C ATOM 1541 C VAL A 104 -0.934 -7.814 4.061 1.00 0.00 C ATOM 1542 O VAL A 104 -1.948 -8.450 4.347 1.00 0.00 O ATOM 1543 CB VAL A 104 -1.343 -5.355 4.313 1.00 0.00 C ATOM 1544 CG1 VAL A 104 -2.686 -5.582 4.988 1.00 0.00 C ATOM 1545 CG2 VAL A 104 -0.238 -5.225 5.350 1.00 0.00 C ATOM 0 H VAL A 104 -2.971 -6.587 2.545 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.059 -6.272 2.849 1.00 0.00 H new ATOM 0 HB VAL A 104 -1.403 -4.422 3.753 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.885 -4.768 5.685 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -3.472 -5.613 4.233 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.666 -6.527 5.530 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.483 -4.422 6.045 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.142 -6.162 5.898 1.00 0.00 H new ATOM 0 HG23 VAL A 104 0.704 -4.998 4.851 1.00 0.00 H new ATOM 1555 N SER A 105 0.288 -8.228 4.372 1.00 0.00 N ATOM 1556 CA SER A 105 0.520 -9.478 5.087 1.00 0.00 C ATOM 1557 C SER A 105 1.916 -9.494 5.697 1.00 0.00 C ATOM 1558 O SER A 105 2.889 -9.106 5.053 1.00 0.00 O ATOM 1559 CB SER A 105 0.348 -10.671 4.147 1.00 0.00 C ATOM 1560 OG SER A 105 1.130 -10.518 2.976 1.00 0.00 O ATOM 0 H SER A 105 1.138 -7.714 4.139 1.00 0.00 H new ATOM 0 HA SER A 105 -0.214 -9.553 5.889 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.636 -11.588 4.662 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.702 -10.774 3.875 1.00 0.00 H new ATOM 0 HG SER A 105 1.002 -11.296 2.393 1.00 0.00 H new ATOM 1566 N SER A 106 2.007 -9.937 6.944 1.00 0.00 N ATOM 1567 CA SER A 106 3.285 -9.991 7.639 1.00 0.00 C ATOM 1568 C SER A 106 4.097 -11.207 7.205 1.00 0.00 C ATOM 1569 O SER A 106 3.816 -12.333 7.618 1.00 0.00 O ATOM 1570 CB SER A 106 3.066 -10.023 9.151 1.00 0.00 C ATOM 1571 OG SER A 106 3.097 -8.717 9.699 1.00 0.00 O ATOM 0 H SER A 106 1.212 -10.263 7.494 1.00 0.00 H new ATOM 0 HA SER A 106 3.846 -9.094 7.378 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.107 -10.491 9.373 1.00 0.00 H new ATOM 0 HB3 SER A 106 3.836 -10.636 9.620 1.00 0.00 H new ATOM 0 HG SER A 106 2.874 -8.757 10.652 1.00 0.00 H new ATOM 1577 N LEU A 107 5.111 -10.969 6.381 1.00 0.00 N ATOM 1578 CA LEU A 107 5.974 -12.043 5.903 1.00 0.00 C ATOM 1579 C LEU A 107 6.869 -12.556 7.028 1.00 0.00 C ATOM 1580 O LEU A 107 7.496 -13.608 6.907 1.00 0.00 O ATOM 1581 CB LEU A 107 6.829 -11.556 4.732 1.00 0.00 C ATOM 1582 CG LEU A 107 6.997 -12.560 3.590 1.00 0.00 C ATOM 1583 CD1 LEU A 107 5.884 -12.395 2.568 1.00 0.00 C ATOM 1584 CD2 LEU A 107 8.359 -12.394 2.931 1.00 0.00 C ATOM 0 H LEU A 107 5.356 -10.043 6.030 1.00 0.00 H new ATOM 0 HA LEU A 107 5.342 -12.863 5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.384 -10.645 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 107 7.816 -11.290 5.109 1.00 0.00 H new ATOM 0 HG LEU A 107 6.936 -13.567 4.003 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.019 -13.117 1.763 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.921 -12.564 3.049 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.913 -11.385 2.158 1.00 0.00 H new ATOM 0 HD21 LEU A 107 8.462 -13.116 2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 107 8.449 -11.384 2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 107 9.143 -12.563 3.669 1.00 0.00 H new ATOM 1596 N THR A 108 6.922 -11.804 8.125 1.00 0.00 N ATOM 1597 CA THR A 108 7.735 -12.174 9.276 1.00 0.00 C ATOM 1598 C THR A 108 7.219 -13.459 9.917 1.00 0.00 C ATOM 1599 O THR A 108 7.976 -14.198 10.546 1.00 0.00 O ATOM 1600 CB THR A 108 7.729 -11.042 10.305 1.00 0.00 C ATOM 1601 OG1 THR A 108 6.436 -10.877 10.858 1.00 0.00 O ATOM 1602 CG2 THR A 108 8.155 -9.709 9.728 1.00 0.00 C ATOM 0 H THR A 108 6.408 -10.931 8.239 1.00 0.00 H new ATOM 0 HA THR A 108 8.755 -12.346 8.933 1.00 0.00 H new ATOM 0 HB THR A 108 8.450 -11.337 11.067 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.452 -10.150 11.515 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.129 -8.949 10.509 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.168 -9.790 9.334 1.00 0.00 H new ATOM 0 HG23 THR A 108 7.475 -9.426 8.924 1.00 0.00 H new ATOM 1610 N GLY A 109 5.924 -13.713 9.760 1.00 0.00 N ATOM 1611 CA GLY A 109 5.326 -14.904 10.333 1.00 0.00 C ATOM 1612 C GLY A 109 4.283 -14.577 11.384 1.00 0.00 C ATOM 1613 O GLY A 109 3.425 -15.404 11.694 1.00 0.00 O ATOM 0 H GLY A 109 5.278 -13.115 9.246 1.00 0.00 H new ATOM 0 HA2 GLY A 109 4.867 -15.494 9.540 1.00 0.00 H new ATOM 0 HA3 GLY A 109 6.106 -15.521 10.779 1.00 0.00 H new ATOM 1617 N GLU A 110 4.356 -13.368 11.934 1.00 0.00 N ATOM 1618 CA GLU A 110 3.410 -12.934 12.955 1.00 0.00 C ATOM 1619 C GLU A 110 2.227 -12.205 12.319 1.00 0.00 C ATOM 1620 O GLU A 110 2.395 -11.460 11.356 1.00 0.00 O ATOM 1621 CB GLU A 110 4.102 -12.019 13.968 1.00 0.00 C ATOM 1622 CG GLU A 110 5.526 -12.439 14.299 1.00 0.00 C ATOM 1623 CD GLU A 110 6.126 -11.627 15.430 1.00 0.00 C ATOM 1624 OE1 GLU A 110 5.771 -11.885 16.600 1.00 0.00 O ATOM 1625 OE2 GLU A 110 6.951 -10.732 15.147 1.00 0.00 O ATOM 0 H GLU A 110 5.061 -12.672 11.689 1.00 0.00 H new ATOM 0 HA GLU A 110 3.038 -13.818 13.472 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.114 -11.002 13.576 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.516 -12.000 14.887 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.536 -13.495 14.570 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.148 -12.332 13.410 1.00 0.00 H new ATOM 1632 N PRO A 111 1.009 -12.409 12.852 1.00 0.00 N ATOM 1633 CA PRO A 111 -0.199 -11.764 12.325 1.00 0.00 C ATOM 1634 C PRO A 111 -0.059 -10.247 12.245 1.00 0.00 C ATOM 1635 O PRO A 111 0.667 -9.638 13.030 1.00 0.00 O ATOM 1636 CB PRO A 111 -1.281 -12.146 13.338 1.00 0.00 C ATOM 1637 CG PRO A 111 -0.786 -13.400 13.971 1.00 0.00 C ATOM 1638 CD PRO A 111 0.712 -13.282 14.004 1.00 0.00 C ATOM 0 HA PRO A 111 -0.418 -12.085 11.307 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -1.424 -11.359 14.079 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -2.243 -12.303 12.849 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -1.191 -13.516 14.976 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -1.096 -14.275 13.400 1.00 0.00 H new ATOM 0 HD2 PRO A 111 1.061 -12.845 14.940 1.00 0.00 H new ATOM 0 HD3 PRO A 111 1.194 -14.255 13.907 1.00 0.00 H new ATOM 1646 N LEU A 112 -0.764 -9.642 11.292 1.00 0.00 N ATOM 1647 CA LEU A 112 -0.725 -8.194 11.110 1.00 0.00 C ATOM 1648 C LEU A 112 -1.118 -7.475 12.403 1.00 0.00 C ATOM 1649 O LEU A 112 -2.151 -7.781 12.999 1.00 0.00 O ATOM 1650 CB LEU A 112 -1.654 -7.788 9.959 1.00 0.00 C ATOM 1651 CG LEU A 112 -3.120 -7.565 10.334 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -3.356 -6.110 10.712 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -4.031 -7.975 9.187 1.00 0.00 C ATOM 0 H LEU A 112 -1.369 -10.133 10.634 1.00 0.00 H new ATOM 0 HA LEU A 112 0.294 -7.899 10.859 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.269 -6.871 9.513 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -1.608 -8.560 9.191 1.00 0.00 H new ATOM 0 HG LEU A 112 -3.355 -8.187 11.198 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.404 -5.968 10.976 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.728 -5.849 11.564 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -3.105 -5.469 9.867 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.070 -7.810 9.471 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -3.797 -7.379 8.305 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.880 -9.031 8.962 1.00 0.00 H new ATOM 1665 N PRO A 113 -0.296 -6.512 12.868 1.00 0.00 N ATOM 1666 CA PRO A 113 -0.572 -5.767 14.099 1.00 0.00 C ATOM 1667 C PRO A 113 -1.756 -4.820 13.949 1.00 0.00 C ATOM 1668 O PRO A 113 -2.590 -4.986 13.060 1.00 0.00 O ATOM 1669 CB PRO A 113 0.719 -4.969 14.350 1.00 0.00 C ATOM 1670 CG PRO A 113 1.732 -5.537 13.410 1.00 0.00 C ATOM 1671 CD PRO A 113 0.959 -6.074 12.243 1.00 0.00 C ATOM 0 HA PRO A 113 -0.837 -6.435 14.919 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.565 -3.906 14.165 1.00 0.00 H new ATOM 0 HB3 PRO A 113 1.046 -5.068 15.385 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.440 -4.772 13.090 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.311 -6.326 13.891 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.789 -5.311 11.483 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.480 -6.899 11.756 1.00 0.00 H new ATOM 1679 N ALA A 114 -1.823 -3.826 14.826 1.00 0.00 N ATOM 1680 CA ALA A 114 -2.900 -2.847 14.795 1.00 0.00 C ATOM 1681 C ALA A 114 -2.469 -1.546 15.454 1.00 0.00 C ATOM 1682 O ALA A 114 -1.449 -1.494 16.140 1.00 0.00 O ATOM 1683 CB ALA A 114 -4.138 -3.397 15.483 1.00 0.00 C ATOM 0 H ALA A 114 -1.141 -3.677 15.570 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.140 -2.641 13.752 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.933 -2.652 15.451 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.467 -4.302 14.971 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.903 -3.632 16.521 1.00 0.00 H new ATOM 1689 N LYS A 115 -3.258 -0.496 15.251 1.00 0.00 N ATOM 1690 CA LYS A 115 -2.958 0.806 15.835 1.00 0.00 C ATOM 1691 C LYS A 115 -1.679 1.395 15.238 1.00 0.00 C ATOM 1692 O LYS A 115 -1.118 2.350 15.773 1.00 0.00 O ATOM 1693 CB LYS A 115 -2.825 0.673 17.354 1.00 0.00 C ATOM 1694 CG LYS A 115 -3.964 1.322 18.123 1.00 0.00 C ATOM 1695 CD LYS A 115 -4.978 0.288 18.590 1.00 0.00 C ATOM 1696 CE LYS A 115 -6.172 0.219 17.652 1.00 0.00 C ATOM 1697 NZ LYS A 115 -7.018 -0.979 17.916 1.00 0.00 N ATOM 0 H LYS A 115 -4.108 -0.521 14.688 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.778 1.486 15.605 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.777 -0.384 17.615 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.883 1.122 17.669 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.565 1.857 18.984 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.459 2.059 17.491 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.502 -0.691 18.648 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.317 0.537 19.595 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.774 1.121 17.764 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.822 0.196 16.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.323 -1.394 17.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -6.468 -1.681 18.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.854 -0.699 18.468 1.00 0.00 H new ATOM 1711 N GLU A 116 -1.231 0.823 14.121 1.00 0.00 N ATOM 1712 CA GLU A 116 -0.027 1.290 13.444 1.00 0.00 C ATOM 1713 C GLU A 116 -0.259 1.339 11.938 1.00 0.00 C ATOM 1714 O GLU A 116 -1.397 1.254 11.476 1.00 0.00 O ATOM 1715 CB GLU A 116 1.164 0.371 13.749 1.00 0.00 C ATOM 1716 CG GLU A 116 1.197 -0.164 15.174 1.00 0.00 C ATOM 1717 CD GLU A 116 2.113 0.637 16.076 1.00 0.00 C ATOM 1718 OE1 GLU A 116 1.813 1.824 16.323 1.00 0.00 O ATOM 1719 OE2 GLU A 116 3.131 0.078 16.536 1.00 0.00 O ATOM 0 H GLU A 116 -1.688 0.032 13.666 1.00 0.00 H new ATOM 0 HA GLU A 116 0.201 2.291 13.811 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.143 -0.472 13.058 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.087 0.918 13.558 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.188 -0.153 15.586 1.00 0.00 H new ATOM 0 HG3 GLU A 116 1.525 -1.203 15.160 1.00 0.00 H new ATOM 1726 N VAL A 117 0.820 1.462 11.175 1.00 0.00 N ATOM 1727 CA VAL A 117 0.721 1.501 9.725 1.00 0.00 C ATOM 1728 C VAL A 117 0.684 0.088 9.158 1.00 0.00 C ATOM 1729 O VAL A 117 1.705 -0.596 9.104 1.00 0.00 O ATOM 1730 CB VAL A 117 1.901 2.268 9.097 1.00 0.00 C ATOM 1731 CG1 VAL A 117 1.700 2.427 7.597 1.00 0.00 C ATOM 1732 CG2 VAL A 117 2.074 3.622 9.767 1.00 0.00 C ATOM 0 H VAL A 117 1.771 1.536 11.537 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.203 2.023 9.477 1.00 0.00 H new ATOM 0 HB VAL A 117 2.812 1.690 9.257 1.00 0.00 H new ATOM 0 HG11 VAL A 117 2.544 2.971 7.172 1.00 0.00 H new ATOM 0 HG12 VAL A 117 1.632 1.443 7.133 1.00 0.00 H new ATOM 0 HG13 VAL A 117 0.780 2.981 7.410 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.912 4.149 9.311 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.164 4.209 9.642 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.270 3.480 10.830 1.00 0.00 H new ATOM 1742 N LEU A 118 -0.501 -0.348 8.745 1.00 0.00 N ATOM 1743 CA LEU A 118 -0.666 -1.685 8.192 1.00 0.00 C ATOM 1744 C LEU A 118 -0.384 -1.697 6.695 1.00 0.00 C ATOM 1745 O LEU A 118 0.152 -2.669 6.165 1.00 0.00 O ATOM 1746 CB LEU A 118 -2.084 -2.202 8.464 1.00 0.00 C ATOM 1747 CG LEU A 118 -2.167 -3.440 9.362 1.00 0.00 C ATOM 1748 CD1 LEU A 118 -1.264 -4.549 8.841 1.00 0.00 C ATOM 1749 CD2 LEU A 118 -1.805 -3.081 10.796 1.00 0.00 C ATOM 0 H LEU A 118 -1.358 0.204 8.783 1.00 0.00 H new ATOM 0 HA LEU A 118 0.053 -2.343 8.681 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.664 -1.401 8.923 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.558 -2.433 7.510 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.194 -3.806 9.346 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.340 -5.418 9.495 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -1.572 -4.826 7.833 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.232 -4.199 8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.869 -3.972 11.421 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.789 -2.688 10.827 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.498 -2.326 11.168 1.00 0.00 H new ATOM 1761 N ALA A 119 -0.743 -0.613 6.016 1.00 0.00 N ATOM 1762 CA ALA A 119 -0.520 -0.516 4.576 1.00 0.00 C ATOM 1763 C ALA A 119 -0.707 0.910 4.081 1.00 0.00 C ATOM 1764 O ALA A 119 -1.697 1.564 4.404 1.00 0.00 O ATOM 1765 CB ALA A 119 -1.450 -1.463 3.833 1.00 0.00 C ATOM 0 H ALA A 119 -1.186 0.205 6.434 1.00 0.00 H new ATOM 0 HA ALA A 119 0.512 -0.805 4.376 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.273 -1.380 2.761 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -1.259 -2.487 4.154 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.485 -1.201 4.051 1.00 0.00 H new ATOM 1771 N LYS A 120 0.252 1.386 3.293 1.00 0.00 N ATOM 1772 CA LYS A 120 0.198 2.739 2.757 1.00 0.00 C ATOM 1773 C LYS A 120 0.117 2.734 1.234 1.00 0.00 C ATOM 1774 O LYS A 120 1.008 2.220 0.557 1.00 0.00 O ATOM 1775 CB LYS A 120 1.425 3.538 3.203 1.00 0.00 C ATOM 1776 CG LYS A 120 1.768 3.366 4.675 1.00 0.00 C ATOM 1777 CD LYS A 120 3.270 3.243 4.884 1.00 0.00 C ATOM 1778 CE LYS A 120 3.892 4.578 5.255 1.00 0.00 C ATOM 1779 NZ LYS A 120 5.008 4.421 6.227 1.00 0.00 N ATOM 0 H LYS A 120 1.075 0.854 3.012 1.00 0.00 H new ATOM 0 HA LYS A 120 -0.704 3.210 3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.282 3.235 2.602 1.00 0.00 H new ATOM 0 HB3 LYS A 120 1.252 4.595 3.001 1.00 0.00 H new ATOM 0 HG2 LYS A 120 1.389 4.217 5.240 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.271 2.478 5.065 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.470 2.516 5.671 1.00 0.00 H new ATOM 0 HD3 LYS A 120 3.735 2.864 3.974 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.262 5.069 4.355 1.00 0.00 H new ATOM 0 HE3 LYS A 120 3.128 5.228 5.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.405 5.355 6.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 4.651 3.976 7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.749 3.822 5.811 1.00 0.00 H new ATOM 1793 N VAL A 121 -0.948 3.326 0.701 1.00 0.00 N ATOM 1794 CA VAL A 121 -1.133 3.409 -0.742 1.00 0.00 C ATOM 1795 C VAL A 121 -0.472 4.672 -1.282 1.00 0.00 C ATOM 1796 O VAL A 121 -0.489 5.715 -0.629 1.00 0.00 O ATOM 1797 CB VAL A 121 -2.627 3.405 -1.125 1.00 0.00 C ATOM 1798 CG1 VAL A 121 -3.348 4.588 -0.497 1.00 0.00 C ATOM 1799 CG2 VAL A 121 -2.796 3.409 -2.638 1.00 0.00 C ATOM 0 H VAL A 121 -1.695 3.755 1.247 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.666 2.529 -1.185 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.075 2.490 -0.736 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.400 4.565 -0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.263 4.531 0.588 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.898 5.517 -0.848 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -3.858 3.406 -2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -2.329 4.302 -3.054 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.323 2.522 -3.059 1.00 0.00 H new ATOM 1809 N VAL A 122 0.125 4.575 -2.465 1.00 0.00 N ATOM 1810 CA VAL A 122 0.802 5.720 -3.061 1.00 0.00 C ATOM 1811 C VAL A 122 0.109 6.203 -4.330 1.00 0.00 C ATOM 1812 O VAL A 122 0.039 5.486 -5.328 1.00 0.00 O ATOM 1813 CB VAL A 122 2.273 5.392 -3.387 1.00 0.00 C ATOM 1814 CG1 VAL A 122 3.012 6.643 -3.842 1.00 0.00 C ATOM 1815 CG2 VAL A 122 2.959 4.768 -2.181 1.00 0.00 C ATOM 0 H VAL A 122 0.154 3.723 -3.026 1.00 0.00 H new ATOM 0 HA VAL A 122 0.761 6.517 -2.318 1.00 0.00 H new ATOM 0 HB VAL A 122 2.293 4.670 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.048 6.392 -4.067 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.533 7.044 -4.735 1.00 0.00 H new ATOM 0 HG13 VAL A 122 2.984 7.391 -3.049 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.996 4.543 -2.429 1.00 0.00 H new ATOM 0 HG22 VAL A 122 2.929 5.466 -1.344 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.444 3.848 -1.905 1.00 0.00 H new ATOM 1825 N LEU A 123 -0.380 7.438 -4.283 1.00 0.00 N ATOM 1826 CA LEU A 123 -1.046 8.048 -5.428 1.00 0.00 C ATOM 1827 C LEU A 123 -0.236 9.248 -5.908 1.00 0.00 C ATOM 1828 O LEU A 123 -0.164 10.274 -5.232 1.00 0.00 O ATOM 1829 CB LEU A 123 -2.467 8.475 -5.055 1.00 0.00 C ATOM 1830 CG LEU A 123 -3.248 7.459 -4.219 1.00 0.00 C ATOM 1831 CD1 LEU A 123 -4.252 8.168 -3.322 1.00 0.00 C ATOM 1832 CD2 LEU A 123 -3.949 6.450 -5.119 1.00 0.00 C ATOM 0 H LEU A 123 -0.327 8.038 -3.460 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.113 7.317 -6.234 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.415 9.414 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -3.023 8.674 -5.971 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.544 6.919 -3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.799 7.431 -2.734 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -3.725 8.848 -2.652 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.952 8.734 -3.936 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.499 5.736 -4.506 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.642 6.971 -5.779 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -3.208 5.920 -5.717 1.00 0.00 H new ATOM 1844 N ARG A 124 0.401 9.095 -7.062 1.00 0.00 N ATOM 1845 CA ARG A 124 1.243 10.147 -7.621 1.00 0.00 C ATOM 1846 C ARG A 124 0.456 11.407 -7.982 1.00 0.00 C ATOM 1847 O ARG A 124 -0.372 11.401 -8.893 1.00 0.00 O ATOM 1848 CB ARG A 124 1.983 9.629 -8.858 1.00 0.00 C ATOM 1849 CG ARG A 124 2.717 10.711 -9.634 1.00 0.00 C ATOM 1850 CD ARG A 124 3.800 10.122 -10.523 1.00 0.00 C ATOM 1851 NE ARG A 124 4.724 9.276 -9.773 1.00 0.00 N ATOM 1852 CZ ARG A 124 5.647 8.503 -10.339 1.00 0.00 C ATOM 1853 NH1 ARG A 124 5.771 8.464 -11.660 1.00 0.00 N ATOM 1854 NH2 ARG A 124 6.449 7.765 -9.582 1.00 0.00 N ATOM 0 H ARG A 124 0.351 8.250 -7.631 1.00 0.00 H new ATOM 0 HA ARG A 124 1.958 10.423 -6.846 1.00 0.00 H new ATOM 0 HB2 ARG A 124 2.699 8.868 -8.549 1.00 0.00 H new ATOM 0 HB3 ARG A 124 1.267 9.142 -9.520 1.00 0.00 H new ATOM 0 HG2 ARG A 124 2.006 11.268 -10.245 1.00 0.00 H new ATOM 0 HG3 ARG A 124 3.163 11.421 -8.937 1.00 0.00 H new ATOM 0 HD2 ARG A 124 3.338 9.537 -11.318 1.00 0.00 H new ATOM 0 HD3 ARG A 124 4.355 10.929 -11.002 1.00 0.00 H new ATOM 0 HE ARG A 124 4.658 9.278 -8.755 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.157 9.029 -12.247 1.00 0.00 H new ATOM 0 HH12 ARG A 124 6.481 7.869 -12.088 1.00 0.00 H new ATOM 0 HH21 ARG A 124 6.358 7.790 -8.566 1.00 0.00 H new ATOM 0 HH22 ARG A 124 7.157 7.172 -10.016 1.00 0.00 H new ATOM 1868 N ALA A 125 0.764 12.494 -7.282 1.00 0.00 N ATOM 1869 CA ALA A 125 0.139 13.789 -7.540 1.00 0.00 C ATOM 1870 C ALA A 125 0.710 14.379 -8.822 1.00 0.00 C ATOM 1871 O ALA A 125 1.502 15.315 -8.788 1.00 0.00 O ATOM 1872 CB ALA A 125 0.380 14.728 -6.366 1.00 0.00 C ATOM 0 H ALA A 125 1.448 12.504 -6.526 1.00 0.00 H new ATOM 0 HA ALA A 125 -0.937 13.657 -7.658 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -0.090 15.691 -6.568 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -0.049 14.297 -5.461 1.00 0.00 H new ATOM 0 HB3 ALA A 125 1.452 14.869 -6.227 1.00 0.00 H new ATOM 1878 N GLU A 126 0.298 13.828 -9.955 1.00 0.00 N ATOM 1879 CA GLU A 126 0.762 14.302 -11.251 1.00 0.00 C ATOM 1880 C GLU A 126 -0.129 15.435 -11.723 1.00 0.00 C ATOM 1881 O GLU A 126 0.122 16.065 -12.750 1.00 0.00 O ATOM 1882 CB GLU A 126 0.759 13.164 -12.273 1.00 0.00 C ATOM 1883 CG GLU A 126 2.106 12.477 -12.422 1.00 0.00 C ATOM 1884 CD GLU A 126 2.854 12.921 -13.664 1.00 0.00 C ATOM 1885 OE1 GLU A 126 2.844 14.135 -13.960 1.00 0.00 O ATOM 1886 OE2 GLU A 126 3.448 12.057 -14.342 1.00 0.00 O ATOM 0 H GLU A 126 -0.359 13.049 -10.003 1.00 0.00 H new ATOM 0 HA GLU A 126 1.785 14.665 -11.151 1.00 0.00 H new ATOM 0 HB2 GLU A 126 0.014 12.425 -11.979 1.00 0.00 H new ATOM 0 HB3 GLU A 126 0.452 13.558 -13.242 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.715 12.685 -11.542 1.00 0.00 H new ATOM 0 HG3 GLU A 126 1.957 11.398 -12.459 1.00 0.00 H new ATOM 1893 N ALA A 127 -1.164 15.695 -10.938 1.00 0.00 N ATOM 1894 CA ALA A 127 -2.100 16.751 -11.221 1.00 0.00 C ATOM 1895 C ALA A 127 -2.885 17.071 -9.973 1.00 0.00 C ATOM 1896 O ALA A 127 -3.503 16.201 -9.359 1.00 0.00 O ATOM 1897 CB ALA A 127 -3.024 16.390 -12.367 1.00 0.00 C ATOM 0 H ALA A 127 -1.371 15.173 -10.087 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.542 17.634 -11.532 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.715 17.213 -12.550 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -2.435 16.205 -13.265 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -3.587 15.493 -12.111 1.00 0.00 H new ATOM 1903 N LYS A 128 -2.819 18.319 -9.594 1.00 0.00 N ATOM 1904 CA LYS A 128 -3.479 18.801 -8.395 1.00 0.00 C ATOM 1905 C LYS A 128 -4.934 18.330 -8.301 1.00 0.00 C ATOM 1906 O LYS A 128 -5.664 18.304 -9.291 1.00 0.00 O ATOM 1907 CB LYS A 128 -3.390 20.334 -8.334 1.00 0.00 C ATOM 1908 CG LYS A 128 -4.500 21.007 -7.536 1.00 0.00 C ATOM 1909 CD LYS A 128 -4.415 22.522 -7.640 1.00 0.00 C ATOM 1910 CE LYS A 128 -3.408 23.095 -6.656 1.00 0.00 C ATOM 1911 NZ LYS A 128 -3.126 24.532 -6.921 1.00 0.00 N ATOM 0 H LYS A 128 -2.306 19.038 -10.105 1.00 0.00 H new ATOM 0 HA LYS A 128 -2.961 18.377 -7.535 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -2.430 20.611 -7.899 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -3.404 20.726 -9.351 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.470 20.669 -7.902 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -4.432 20.708 -6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -4.133 22.802 -8.655 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -5.397 22.956 -7.451 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.788 22.981 -5.641 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -2.480 22.526 -6.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.448 24.888 -6.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -2.723 24.637 -7.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -4.010 25.077 -6.857 1.00 0.00 H new ATOM 1925 N ALA A 129 -5.331 17.971 -7.084 1.00 0.00 N ATOM 1926 CA ALA A 129 -6.679 17.507 -6.799 1.00 0.00 C ATOM 1927 C ALA A 129 -7.097 17.956 -5.402 1.00 0.00 C ATOM 1928 O ALA A 129 -7.341 17.133 -4.519 1.00 0.00 O ATOM 1929 CB ALA A 129 -6.747 15.993 -6.909 1.00 0.00 C ATOM 0 H ALA A 129 -4.722 17.995 -6.266 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.365 17.938 -7.528 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.761 15.658 -6.693 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -6.471 15.689 -7.919 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.057 15.545 -6.194 1.00 0.00 H new ATOM 1935 N GLU A 130 -7.157 19.268 -5.204 1.00 0.00 N ATOM 1936 CA GLU A 130 -7.521 19.830 -3.908 1.00 0.00 C ATOM 1937 C GLU A 130 -8.878 19.311 -3.443 1.00 0.00 C ATOM 1938 O GLU A 130 -9.912 19.616 -4.041 1.00 0.00 O ATOM 1939 CB GLU A 130 -7.545 21.357 -3.980 1.00 0.00 C ATOM 1940 CG GLU A 130 -7.610 22.030 -2.619 1.00 0.00 C ATOM 1941 CD GLU A 130 -8.458 23.286 -2.629 1.00 0.00 C ATOM 1942 OE1 GLU A 130 -7.935 24.354 -3.010 1.00 0.00 O ATOM 1943 OE2 GLU A 130 -9.649 23.202 -2.256 1.00 0.00 O ATOM 0 H GLU A 130 -6.958 19.963 -5.924 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.769 19.516 -3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.654 21.702 -4.504 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -8.404 21.671 -4.573 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.015 21.328 -1.890 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -6.600 22.280 -2.293 1.00 0.00 H new ATOM 1950 N GLY A 131 -8.862 18.523 -2.372 1.00 0.00 N ATOM 1951 CA GLY A 131 -10.090 17.967 -1.836 1.00 0.00 C ATOM 1952 C GLY A 131 -10.426 16.613 -2.432 1.00 0.00 C ATOM 1953 O GLY A 131 -11.565 16.158 -2.342 1.00 0.00 O ATOM 0 H GLY A 131 -8.017 18.259 -1.865 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -9.999 17.871 -0.754 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -10.911 18.658 -2.027 1.00 0.00 H new ATOM 1957 N SER A 132 -9.434 15.965 -3.039 1.00 0.00 N ATOM 1958 CA SER A 132 -9.639 14.653 -3.642 1.00 0.00 C ATOM 1959 C SER A 132 -9.836 13.598 -2.560 1.00 0.00 C ATOM 1960 O SER A 132 -9.002 12.710 -2.379 1.00 0.00 O ATOM 1961 CB SER A 132 -8.453 14.283 -4.533 1.00 0.00 C ATOM 1962 OG SER A 132 -8.772 14.453 -5.903 1.00 0.00 O ATOM 0 H SER A 132 -8.484 16.327 -3.125 1.00 0.00 H new ATOM 0 HA SER A 132 -10.537 14.693 -4.259 1.00 0.00 H new ATOM 0 HB2 SER A 132 -7.594 14.903 -4.277 1.00 0.00 H new ATOM 0 HB3 SER A 132 -8.165 13.248 -4.349 1.00 0.00 H new ATOM 0 HG SER A 132 -9.419 15.183 -6.000 1.00 0.00 H new ATOM 1968 N ASN A 133 -10.943 13.712 -1.832 1.00 0.00 N ATOM 1969 CA ASN A 133 -11.264 12.790 -0.753 1.00 0.00 C ATOM 1970 C ASN A 133 -10.995 11.336 -1.134 1.00 0.00 C ATOM 1971 O ASN A 133 -11.387 10.875 -2.204 1.00 0.00 O ATOM 1972 CB ASN A 133 -12.725 12.963 -0.353 1.00 0.00 C ATOM 1973 CG ASN A 133 -12.927 12.910 1.133 1.00 0.00 C ATOM 1974 OD1 ASN A 133 -12.646 11.904 1.785 1.00 0.00 O ATOM 1975 ND2 ASN A 133 -13.424 14.005 1.673 1.00 0.00 N ATOM 0 H ASN A 133 -11.639 14.444 -1.974 1.00 0.00 H new ATOM 0 HA ASN A 133 -10.615 13.027 0.090 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -13.091 13.917 -0.732 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -13.322 12.183 -0.825 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -13.593 14.046 2.678 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -13.639 14.811 1.086 1.00 0.00 H new ATOM 1982 N LEU A 134 -10.334 10.622 -0.229 1.00 0.00 N ATOM 1983 CA LEU A 134 -10.013 9.216 -0.434 1.00 0.00 C ATOM 1984 C LEU A 134 -10.696 8.369 0.632 1.00 0.00 C ATOM 1985 O LEU A 134 -10.412 8.505 1.821 1.00 0.00 O ATOM 1986 CB LEU A 134 -8.500 8.999 -0.389 1.00 0.00 C ATOM 1987 CG LEU A 134 -7.671 10.065 -1.108 1.00 0.00 C ATOM 1988 CD1 LEU A 134 -6.414 10.391 -0.314 1.00 0.00 C ATOM 1989 CD2 LEU A 134 -7.314 9.606 -2.515 1.00 0.00 C ATOM 0 H LEU A 134 -10.008 10.999 0.661 1.00 0.00 H new ATOM 0 HA LEU A 134 -10.375 8.914 -1.417 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.185 8.958 0.654 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.274 8.027 -0.829 1.00 0.00 H new ATOM 0 HG LEU A 134 -8.271 10.972 -1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.837 11.151 -0.841 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.693 10.765 0.671 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.810 9.490 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.724 10.377 -3.011 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.734 8.685 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -8.227 9.427 -3.082 1.00 0.00 H new ATOM 2001 N SER A 135 -11.610 7.508 0.201 1.00 0.00 N ATOM 2002 CA SER A 135 -12.347 6.657 1.129 1.00 0.00 C ATOM 2003 C SER A 135 -11.930 5.197 1.003 1.00 0.00 C ATOM 2004 O SER A 135 -11.922 4.633 -0.091 1.00 0.00 O ATOM 2005 CB SER A 135 -13.851 6.790 0.887 1.00 0.00 C ATOM 2006 OG SER A 135 -14.158 6.652 -0.490 1.00 0.00 O ATOM 0 H SER A 135 -11.858 7.380 -0.780 1.00 0.00 H new ATOM 0 HA SER A 135 -12.111 6.989 2.140 1.00 0.00 H new ATOM 0 HB2 SER A 135 -14.384 6.031 1.460 1.00 0.00 H new ATOM 0 HB3 SER A 135 -14.196 7.760 1.245 1.00 0.00 H new ATOM 0 HG SER A 135 -13.515 6.043 -0.909 1.00 0.00 H new ATOM 2012 N VAL A 136 -11.597 4.588 2.137 1.00 0.00 N ATOM 2013 CA VAL A 136 -11.192 3.189 2.164 1.00 0.00 C ATOM 2014 C VAL A 136 -12.299 2.318 2.749 1.00 0.00 C ATOM 2015 O VAL A 136 -12.409 2.170 3.966 1.00 0.00 O ATOM 2016 CB VAL A 136 -9.906 2.987 2.988 1.00 0.00 C ATOM 2017 CG1 VAL A 136 -8.698 3.526 2.237 1.00 0.00 C ATOM 2018 CG2 VAL A 136 -10.034 3.648 4.351 1.00 0.00 C ATOM 0 H VAL A 136 -11.600 5.043 3.050 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.998 2.893 1.133 1.00 0.00 H new ATOM 0 HB VAL A 136 -9.761 1.918 3.141 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -7.800 3.374 2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -8.595 3.000 1.288 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -8.832 4.591 2.048 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -9.116 3.494 4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -10.206 4.717 4.222 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -10.872 3.208 4.892 1.00 0.00 H new ATOM 2028 N THR A 137 -13.119 1.748 1.873 1.00 0.00 N ATOM 2029 CA THR A 137 -14.221 0.894 2.303 1.00 0.00 C ATOM 2030 C THR A 137 -13.828 -0.577 2.229 1.00 0.00 C ATOM 2031 O THR A 137 -12.644 -0.906 2.137 1.00 0.00 O ATOM 2032 CB THR A 137 -15.457 1.152 1.438 1.00 0.00 C ATOM 2033 OG1 THR A 137 -15.313 0.548 0.166 1.00 0.00 O ATOM 2034 CG2 THR A 137 -15.739 2.623 1.219 1.00 0.00 C ATOM 0 H THR A 137 -13.042 1.861 0.862 1.00 0.00 H new ATOM 0 HA THR A 137 -14.456 1.135 3.340 1.00 0.00 H new ATOM 0 HB THR A 137 -16.291 0.718 1.989 1.00 0.00 H new ATOM 0 HG1 THR A 137 -16.114 0.723 -0.372 1.00 0.00 H new ATOM 0 HG21 THR A 137 -16.628 2.735 0.598 1.00 0.00 H new ATOM 0 HG22 THR A 137 -15.905 3.109 2.181 1.00 0.00 H new ATOM 0 HG23 THR A 137 -14.888 3.086 0.720 1.00 0.00 H new ATOM 2042 N ASN A 138 -14.827 -1.461 2.269 1.00 0.00 N ATOM 2043 CA ASN A 138 -14.600 -2.912 2.201 1.00 0.00 C ATOM 2044 C ASN A 138 -13.430 -3.350 3.084 1.00 0.00 C ATOM 2045 O ASN A 138 -12.854 -4.418 2.878 1.00 0.00 O ATOM 2046 CB ASN A 138 -14.359 -3.364 0.753 1.00 0.00 C ATOM 2047 CG ASN A 138 -14.298 -2.205 -0.219 1.00 0.00 C ATOM 2048 OD1 ASN A 138 -13.176 -1.502 -0.220 1.00 0.00 O flip ATOM 2049 ND2 ASN A 138 -15.248 -1.946 -0.960 1.00 0.00 N flip ATOM 0 H ASN A 138 -15.809 -1.198 2.349 1.00 0.00 H new ATOM 0 HA ASN A 138 -15.504 -3.391 2.577 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -13.426 -3.925 0.702 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -15.156 -4.044 0.452 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -16.093 -2.516 -0.924 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -15.189 -1.162 -1.609 1.00 0.00 H new ATOM 2056 N SER A 139 -13.091 -2.527 4.068 1.00 0.00 N ATOM 2057 CA SER A 139 -11.998 -2.836 4.983 1.00 0.00 C ATOM 2058 C SER A 139 -12.266 -4.150 5.709 1.00 0.00 C ATOM 2059 O SER A 139 -13.052 -4.200 6.654 1.00 0.00 O ATOM 2060 CB SER A 139 -11.813 -1.706 5.996 1.00 0.00 C ATOM 2061 OG SER A 139 -11.407 -0.509 5.356 1.00 0.00 O ATOM 0 H SER A 139 -13.557 -1.639 4.254 1.00 0.00 H new ATOM 0 HA SER A 139 -11.082 -2.938 4.401 1.00 0.00 H new ATOM 0 HB2 SER A 139 -12.747 -1.537 6.532 1.00 0.00 H new ATOM 0 HB3 SER A 139 -11.069 -1.996 6.737 1.00 0.00 H new ATOM 0 HG SER A 139 -12.063 0.196 5.535 1.00 0.00 H new ATOM 2067 N SER A 140 -11.612 -5.215 5.255 1.00 0.00 N ATOM 2068 CA SER A 140 -11.788 -6.533 5.852 1.00 0.00 C ATOM 2069 C SER A 140 -10.509 -7.006 6.538 1.00 0.00 C ATOM 2070 O SER A 140 -9.432 -6.451 6.317 1.00 0.00 O ATOM 2071 CB SER A 140 -12.206 -7.538 4.781 1.00 0.00 C ATOM 2072 OG SER A 140 -13.549 -7.951 4.963 1.00 0.00 O ATOM 0 H SER A 140 -10.955 -5.190 4.475 1.00 0.00 H new ATOM 0 HA SER A 140 -12.570 -6.460 6.608 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.091 -7.091 3.794 1.00 0.00 H new ATOM 0 HB3 SER A 140 -11.548 -8.406 4.816 1.00 0.00 H new ATOM 0 HG SER A 140 -13.842 -8.464 4.181 1.00 0.00 H new ATOM 2078 N VAL A 141 -10.638 -8.038 7.364 1.00 0.00 N ATOM 2079 CA VAL A 141 -9.496 -8.594 8.081 1.00 0.00 C ATOM 2080 C VAL A 141 -9.611 -10.111 8.201 1.00 0.00 C ATOM 2081 O VAL A 141 -10.615 -10.630 8.688 1.00 0.00 O ATOM 2082 CB VAL A 141 -9.366 -7.987 9.491 1.00 0.00 C ATOM 2083 CG1 VAL A 141 -9.071 -6.497 9.407 1.00 0.00 C ATOM 2084 CG2 VAL A 141 -10.626 -8.248 10.306 1.00 0.00 C ATOM 0 H VAL A 141 -11.523 -8.507 7.554 1.00 0.00 H new ATOM 0 HA VAL A 141 -8.606 -8.342 7.504 1.00 0.00 H new ATOM 0 HB VAL A 141 -8.530 -8.469 9.998 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -8.983 -6.086 10.413 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -8.137 -6.341 8.868 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.882 -5.995 8.880 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -10.514 -7.811 11.299 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -11.483 -7.797 9.806 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -10.784 -9.323 10.398 1.00 0.00 H new ATOM 2094 N GLY A 142 -8.579 -10.816 7.752 1.00 0.00 N ATOM 2095 CA GLY A 142 -8.585 -12.265 7.815 1.00 0.00 C ATOM 2096 C GLY A 142 -8.391 -12.788 9.227 1.00 0.00 C ATOM 2097 O GLY A 142 -7.270 -12.831 9.731 1.00 0.00 O ATOM 0 H GLY A 142 -7.737 -10.409 7.345 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -9.530 -12.638 7.420 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -7.794 -12.656 7.175 1.00 0.00 H new ATOM 2101 N ASP A 143 -9.488 -13.189 9.864 1.00 0.00 N ATOM 2102 CA ASP A 143 -9.435 -13.713 11.226 1.00 0.00 C ATOM 2103 C ASP A 143 -8.440 -14.865 11.330 1.00 0.00 C ATOM 2104 O ASP A 143 -8.063 -15.467 10.323 1.00 0.00 O ATOM 2105 CB ASP A 143 -10.823 -14.184 11.667 1.00 0.00 C ATOM 2106 CG ASP A 143 -10.841 -14.661 13.104 1.00 0.00 C ATOM 2107 OD1 ASP A 143 -10.009 -14.179 13.901 1.00 0.00 O ATOM 2108 OD2 ASP A 143 -11.689 -15.518 13.435 1.00 0.00 O ATOM 0 H ASP A 143 -10.424 -13.161 9.459 1.00 0.00 H new ATOM 0 HA ASP A 143 -9.103 -12.910 11.884 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -11.535 -13.367 11.549 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.154 -14.992 11.015 1.00 0.00 H new ATOM 2113 N GLY A 144 -8.018 -15.167 12.553 1.00 0.00 N ATOM 2114 CA GLY A 144 -7.071 -16.246 12.765 1.00 0.00 C ATOM 2115 C GLY A 144 -7.640 -17.600 12.390 1.00 0.00 C ATOM 2116 O GLY A 144 -6.900 -18.508 12.014 1.00 0.00 O ATOM 0 H GLY A 144 -8.315 -14.684 13.401 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -6.173 -16.057 12.177 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -6.769 -16.260 13.812 1.00 0.00 H new ATOM 2120 N GLU A 145 -8.958 -17.736 12.495 1.00 0.00 N ATOM 2121 CA GLU A 145 -9.626 -18.989 12.164 1.00 0.00 C ATOM 2122 C GLU A 145 -9.734 -19.164 10.653 1.00 0.00 C ATOM 2123 O GLU A 145 -9.648 -20.281 10.140 1.00 0.00 O ATOM 2124 CB GLU A 145 -11.018 -19.030 12.795 1.00 0.00 C ATOM 2125 CG GLU A 145 -11.001 -18.963 14.313 1.00 0.00 C ATOM 2126 CD GLU A 145 -12.317 -19.396 14.931 1.00 0.00 C ATOM 2127 OE1 GLU A 145 -13.354 -18.780 14.609 1.00 0.00 O ATOM 2128 OE2 GLU A 145 -12.308 -20.348 15.738 1.00 0.00 O ATOM 0 H GLU A 145 -9.584 -16.994 12.807 1.00 0.00 H new ATOM 0 HA GLU A 145 -9.029 -19.808 12.565 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -11.607 -18.198 12.410 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.521 -19.946 12.486 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -10.200 -19.597 14.692 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -10.775 -17.943 14.625 1.00 0.00 H new ATOM 2135 N GLY A 146 -9.923 -18.056 9.944 1.00 0.00 N ATOM 2136 CA GLY A 146 -10.040 -18.111 8.499 1.00 0.00 C ATOM 2137 C GLY A 146 -11.097 -17.163 7.966 1.00 0.00 C ATOM 2138 O GLY A 146 -10.997 -16.684 6.836 1.00 0.00 O ATOM 0 H GLY A 146 -9.997 -17.121 10.345 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -9.077 -17.866 8.050 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -10.283 -19.129 8.196 1.00 0.00 H new ATOM 2142 N LEU A 147 -12.110 -16.891 8.782 1.00 0.00 N ATOM 2143 CA LEU A 147 -13.190 -15.994 8.385 1.00 0.00 C ATOM 2144 C LEU A 147 -12.715 -14.544 8.372 1.00 0.00 C ATOM 2145 O LEU A 147 -11.701 -14.207 8.981 1.00 0.00 O ATOM 2146 CB LEU A 147 -14.380 -16.145 9.334 1.00 0.00 C ATOM 2147 CG LEU A 147 -15.362 -17.259 8.970 1.00 0.00 C ATOM 2148 CD1 LEU A 147 -16.519 -17.295 9.955 1.00 0.00 C ATOM 2149 CD2 LEU A 147 -15.874 -17.073 7.548 1.00 0.00 C ATOM 0 H LEU A 147 -12.206 -17.278 9.721 1.00 0.00 H new ATOM 0 HA LEU A 147 -13.502 -16.264 7.376 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -14.002 -16.329 10.340 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -14.922 -15.200 9.366 1.00 0.00 H new ATOM 0 HG LEU A 147 -14.837 -18.213 9.025 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -17.207 -18.094 9.679 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -16.136 -17.476 10.959 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -17.045 -16.340 9.934 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -16.572 -17.874 7.305 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -16.382 -16.112 7.467 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -15.035 -17.099 6.853 1.00 0.00 H new ATOM 2161 N VAL A 148 -13.458 -13.691 7.674 1.00 0.00 N ATOM 2162 CA VAL A 148 -13.114 -12.277 7.581 1.00 0.00 C ATOM 2163 C VAL A 148 -14.156 -11.411 8.282 1.00 0.00 C ATOM 2164 O VAL A 148 -15.358 -11.630 8.138 1.00 0.00 O ATOM 2165 CB VAL A 148 -12.986 -11.824 6.112 1.00 0.00 C ATOM 2166 CG1 VAL A 148 -14.307 -11.995 5.378 1.00 0.00 C ATOM 2167 CG2 VAL A 148 -12.506 -10.381 6.034 1.00 0.00 C ATOM 0 H VAL A 148 -14.302 -13.954 7.165 1.00 0.00 H new ATOM 0 HA VAL A 148 -12.151 -12.152 8.075 1.00 0.00 H new ATOM 0 HB VAL A 148 -12.244 -12.456 5.624 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -14.193 -11.669 4.344 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -14.601 -13.044 5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -15.075 -11.394 5.865 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -12.422 -10.081 4.989 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -13.220 -9.732 6.542 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -11.532 -10.295 6.515 1.00 0.00 H new ATOM 2177 N HIS A 149 -13.685 -10.427 9.041 1.00 0.00 N ATOM 2178 CA HIS A 149 -14.577 -9.527 9.763 1.00 0.00 C ATOM 2179 C HIS A 149 -14.551 -8.131 9.152 1.00 0.00 C ATOM 2180 O HIS A 149 -13.741 -7.289 9.542 1.00 0.00 O ATOM 2181 CB HIS A 149 -14.182 -9.458 11.240 1.00 0.00 C ATOM 2182 CG HIS A 149 -14.309 -10.768 11.953 1.00 0.00 C ATOM 2183 ND1 HIS A 149 -13.280 -11.680 12.041 1.00 0.00 N ATOM 2184 CD2 HIS A 149 -15.355 -11.318 12.616 1.00 0.00 C ATOM 2185 CE1 HIS A 149 -13.686 -12.735 12.725 1.00 0.00 C ATOM 2186 NE2 HIS A 149 -14.941 -12.540 13.085 1.00 0.00 N ATOM 0 H HIS A 149 -12.692 -10.233 9.172 1.00 0.00 H new ATOM 0 HA HIS A 149 -15.591 -9.920 9.684 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -13.152 -9.110 11.317 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -14.807 -8.718 11.741 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -16.332 -10.877 12.750 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -13.092 -13.608 12.951 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -15.511 -13.192 13.624 1.00 0.00 H new ATOM 2195 N GLU A 150 -15.443 -7.886 8.197 1.00 0.00 N ATOM 2196 CA GLU A 150 -15.521 -6.586 7.537 1.00 0.00 C ATOM 2197 C GLU A 150 -15.598 -5.468 8.571 1.00 0.00 C ATOM 2198 O GLU A 150 -16.622 -5.290 9.231 1.00 0.00 O ATOM 2199 CB GLU A 150 -16.740 -6.529 6.614 1.00 0.00 C ATOM 2200 CG GLU A 150 -16.452 -6.998 5.197 1.00 0.00 C ATOM 2201 CD GLU A 150 -17.509 -6.549 4.208 1.00 0.00 C ATOM 2202 OE1 GLU A 150 -17.904 -5.365 4.258 1.00 0.00 O ATOM 2203 OE2 GLU A 150 -17.942 -7.381 3.383 1.00 0.00 O ATOM 0 H GLU A 150 -16.122 -8.570 7.863 1.00 0.00 H new ATOM 0 HA GLU A 150 -14.620 -6.450 6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -17.535 -7.144 7.037 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -17.112 -5.505 6.580 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -15.480 -6.617 4.883 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -16.387 -8.086 5.185 1.00 0.00 H new ATOM 2210 N ILE A 151 -14.506 -4.728 8.720 1.00 0.00 N ATOM 2211 CA ILE A 151 -14.453 -3.641 9.688 1.00 0.00 C ATOM 2212 C ILE A 151 -15.037 -2.352 9.118 1.00 0.00 C ATOM 2213 O ILE A 151 -15.440 -2.294 7.957 1.00 0.00 O ATOM 2214 CB ILE A 151 -13.007 -3.386 10.189 1.00 0.00 C ATOM 2215 CG1 ILE A 151 -12.264 -2.393 9.273 1.00 0.00 C ATOM 2216 CG2 ILE A 151 -12.250 -4.704 10.307 1.00 0.00 C ATOM 2217 CD1 ILE A 151 -10.785 -2.687 9.099 1.00 0.00 C ATOM 0 H ILE A 151 -13.648 -4.861 8.184 1.00 0.00 H new ATOM 0 HA ILE A 151 -15.062 -3.953 10.537 1.00 0.00 H new ATOM 0 HB ILE A 151 -13.062 -2.932 11.179 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -12.740 -2.396 8.293 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -12.377 -1.388 9.680 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -11.237 -4.511 10.659 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -12.762 -5.356 11.015 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -12.209 -5.189 9.331 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -10.341 -1.941 8.440 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -10.291 -2.654 10.070 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -10.660 -3.677 8.661 1.00 0.00 H new ATOM 2229 N ALA A 152 -15.073 -1.327 9.956 1.00 0.00 N ATOM 2230 CA ALA A 152 -15.598 -0.027 9.573 1.00 0.00 C ATOM 2231 C ALA A 152 -14.772 0.585 8.438 1.00 0.00 C ATOM 2232 O ALA A 152 -14.293 -0.130 7.558 1.00 0.00 O ATOM 2233 CB ALA A 152 -15.639 0.877 10.799 1.00 0.00 C ATOM 0 H ALA A 152 -14.740 -1.374 10.919 1.00 0.00 H new ATOM 0 HA ALA A 152 -16.613 -0.141 9.193 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -16.032 1.854 10.518 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -16.282 0.432 11.558 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -14.632 0.993 11.200 1.00 0.00 H new ATOM 2239 N GLY A 153 -14.613 1.906 8.452 1.00 0.00 N ATOM 2240 CA GLY A 153 -13.854 2.573 7.414 1.00 0.00 C ATOM 2241 C GLY A 153 -13.611 4.037 7.726 1.00 0.00 C ATOM 2242 O GLY A 153 -14.206 4.588 8.652 1.00 0.00 O ATOM 0 H GLY A 153 -14.998 2.525 9.166 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -12.897 2.068 7.286 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -14.387 2.490 6.467 1.00 0.00 H new ATOM 2246 N THR A 154 -12.732 4.666 6.955 1.00 0.00 N ATOM 2247 CA THR A 154 -12.406 6.073 7.152 1.00 0.00 C ATOM 2248 C THR A 154 -11.873 6.686 5.862 1.00 0.00 C ATOM 2249 O THR A 154 -11.217 6.012 5.070 1.00 0.00 O ATOM 2250 CB THR A 154 -11.374 6.223 8.270 1.00 0.00 C ATOM 2251 OG1 THR A 154 -11.846 5.632 9.469 1.00 0.00 O ATOM 2252 CG2 THR A 154 -11.022 7.662 8.576 1.00 0.00 C ATOM 0 H THR A 154 -12.231 4.222 6.185 1.00 0.00 H new ATOM 0 HA THR A 154 -13.316 6.601 7.436 1.00 0.00 H new ATOM 0 HB THR A 154 -10.479 5.719 7.904 1.00 0.00 H new ATOM 0 HG1 THR A 154 -11.172 5.736 10.173 1.00 0.00 H new ATOM 0 HG21 THR A 154 -10.285 7.694 9.379 1.00 0.00 H new ATOM 0 HG22 THR A 154 -10.608 8.133 7.684 1.00 0.00 H new ATOM 0 HG23 THR A 154 -11.919 8.198 8.886 1.00 0.00 H new ATOM 2260 N GLU A 155 -12.166 7.966 5.651 1.00 0.00 N ATOM 2261 CA GLU A 155 -11.716 8.658 4.449 1.00 0.00 C ATOM 2262 C GLU A 155 -10.677 9.728 4.777 1.00 0.00 C ATOM 2263 O GLU A 155 -10.474 10.082 5.939 1.00 0.00 O ATOM 2264 CB GLU A 155 -12.909 9.281 3.713 1.00 0.00 C ATOM 2265 CG GLU A 155 -13.390 10.598 4.306 1.00 0.00 C ATOM 2266 CD GLU A 155 -14.012 10.432 5.677 1.00 0.00 C ATOM 2267 OE1 GLU A 155 -14.972 9.642 5.802 1.00 0.00 O ATOM 2268 OE2 GLU A 155 -13.541 11.091 6.628 1.00 0.00 O ATOM 0 H GLU A 155 -12.710 8.542 6.293 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.244 7.922 3.798 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -12.634 9.444 2.671 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -13.735 8.570 3.717 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -12.550 11.289 4.375 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -14.119 11.049 3.633 1.00 0.00 H new ATOM 2275 N LYS A 156 -10.025 10.235 3.737 1.00 0.00 N ATOM 2276 CA LYS A 156 -9.005 11.269 3.889 1.00 0.00 C ATOM 2277 C LYS A 156 -9.133 12.300 2.782 1.00 0.00 C ATOM 2278 O LYS A 156 -9.861 12.100 1.814 1.00 0.00 O ATOM 2279 CB LYS A 156 -7.607 10.646 3.857 1.00 0.00 C ATOM 2280 CG LYS A 156 -6.479 11.598 4.230 1.00 0.00 C ATOM 2281 CD LYS A 156 -6.721 12.280 5.566 1.00 0.00 C ATOM 2282 CE LYS A 156 -6.652 11.293 6.716 1.00 0.00 C ATOM 2283 NZ LYS A 156 -7.602 11.642 7.808 1.00 0.00 N ATOM 0 H LYS A 156 -10.185 9.945 2.772 1.00 0.00 H new ATOM 0 HA LYS A 156 -9.152 11.760 4.851 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -7.587 9.796 4.539 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -7.420 10.257 2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -5.539 11.047 4.270 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -6.372 12.354 3.452 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -5.980 13.065 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -7.698 12.762 5.557 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -6.875 10.291 6.348 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -5.637 11.269 7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -7.523 10.943 8.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -7.374 12.587 8.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -8.573 11.640 7.437 1.00 0.00 H new ATOM 2297 N THR A 157 -8.422 13.400 2.938 1.00 0.00 N ATOM 2298 CA THR A 157 -8.448 14.476 1.958 1.00 0.00 C ATOM 2299 C THR A 157 -7.064 15.095 1.799 1.00 0.00 C ATOM 2300 O THR A 157 -6.526 15.682 2.737 1.00 0.00 O ATOM 2301 CB THR A 157 -9.461 15.541 2.379 1.00 0.00 C ATOM 2302 OG1 THR A 157 -9.384 15.770 3.777 1.00 0.00 O ATOM 2303 CG2 THR A 157 -10.889 15.167 2.057 1.00 0.00 C ATOM 0 H THR A 157 -7.815 13.575 3.738 1.00 0.00 H new ATOM 0 HA THR A 157 -8.748 14.062 0.995 1.00 0.00 H new ATOM 0 HB THR A 157 -9.200 16.435 1.812 1.00 0.00 H new ATOM 0 HG1 THR A 157 -8.445 15.854 4.043 1.00 0.00 H new ATOM 0 HG21 THR A 157 -11.556 15.965 2.382 1.00 0.00 H new ATOM 0 HG22 THR A 157 -10.993 15.022 0.982 1.00 0.00 H new ATOM 0 HG23 THR A 157 -11.149 14.244 2.575 1.00 0.00 H new ATOM 2311 N VAL A 158 -6.493 14.962 0.608 1.00 0.00 N ATOM 2312 CA VAL A 158 -5.170 15.513 0.332 1.00 0.00 C ATOM 2313 C VAL A 158 -5.255 16.687 -0.632 1.00 0.00 C ATOM 2314 O VAL A 158 -5.830 16.574 -1.715 1.00 0.00 O ATOM 2315 CB VAL A 158 -4.217 14.452 -0.255 1.00 0.00 C ATOM 2316 CG1 VAL A 158 -3.493 13.712 0.858 1.00 0.00 C ATOM 2317 CG2 VAL A 158 -4.967 13.479 -1.152 1.00 0.00 C ATOM 0 H VAL A 158 -6.923 14.479 -0.181 1.00 0.00 H new ATOM 0 HA VAL A 158 -4.771 15.853 1.288 1.00 0.00 H new ATOM 0 HB VAL A 158 -3.475 14.965 -0.867 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -2.825 12.967 0.425 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -2.912 14.421 1.449 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -4.222 13.216 1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -4.271 12.742 -1.552 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.739 12.972 -0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -5.430 14.025 -1.974 1.00 0.00 H new ATOM 2327 N ASN A 159 -4.676 17.817 -0.236 1.00 0.00 N ATOM 2328 CA ASN A 159 -4.688 19.008 -1.076 1.00 0.00 C ATOM 2329 C ASN A 159 -3.401 19.125 -1.859 1.00 0.00 C ATOM 2330 O ASN A 159 -2.361 19.495 -1.315 1.00 0.00 O ATOM 2331 CB ASN A 159 -4.877 20.292 -0.253 1.00 0.00 C ATOM 2332 CG ASN A 159 -5.220 20.025 1.200 1.00 0.00 C ATOM 2333 OD1 ASN A 159 -6.258 19.231 1.428 1.00 0.00 O flip ATOM 2334 ND2 ASN A 159 -4.559 20.529 2.110 1.00 0.00 N flip ATOM 0 H ASN A 159 -4.195 17.932 0.656 1.00 0.00 H new ATOM 0 HA ASN A 159 -5.533 18.898 -1.756 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.963 20.884 -0.301 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -5.669 20.891 -0.703 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.768 21.134 1.891 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -4.803 20.341 3.082 1.00 0.00 H new ATOM 2341 N ILE A 160 -3.478 18.840 -3.144 1.00 0.00 N ATOM 2342 CA ILE A 160 -2.315 18.952 -3.992 1.00 0.00 C ATOM 2343 C ILE A 160 -2.094 20.402 -4.340 1.00 0.00 C ATOM 2344 O ILE A 160 -2.979 21.077 -4.865 1.00 0.00 O ATOM 2345 CB ILE A 160 -2.453 18.138 -5.276 1.00 0.00 C ATOM 2346 CG1 ILE A 160 -3.045 16.764 -4.970 1.00 0.00 C ATOM 2347 CG2 ILE A 160 -1.104 18.011 -5.967 1.00 0.00 C ATOM 2348 CD1 ILE A 160 -3.274 15.916 -6.201 1.00 0.00 C ATOM 0 H ILE A 160 -4.327 18.532 -3.618 1.00 0.00 H new ATOM 0 HA ILE A 160 -1.463 18.553 -3.441 1.00 0.00 H new ATOM 0 HB ILE A 160 -3.132 18.656 -5.953 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -2.377 16.233 -4.292 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -3.993 16.894 -4.447 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -1.217 17.428 -6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -0.727 19.003 -6.214 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -0.400 17.510 -5.302 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -3.696 14.955 -5.907 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -3.966 16.426 -6.871 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -2.326 15.755 -6.713 1.00 0.00 H new ATOM 2360 N ILE A 161 -0.921 20.883 -4.009 1.00 0.00 N ATOM 2361 CA ILE A 161 -0.572 22.262 -4.244 1.00 0.00 C ATOM 2362 C ILE A 161 0.396 22.377 -5.408 1.00 0.00 C ATOM 2363 O ILE A 161 1.387 21.656 -5.475 1.00 0.00 O ATOM 2364 CB ILE A 161 0.045 22.893 -2.978 1.00 0.00 C ATOM 2365 CG1 ILE A 161 -0.245 22.033 -1.734 1.00 0.00 C ATOM 2366 CG2 ILE A 161 -0.489 24.303 -2.785 1.00 0.00 C ATOM 2367 CD1 ILE A 161 0.978 21.793 -0.878 1.00 0.00 C ATOM 0 H ILE A 161 -0.183 20.331 -3.570 1.00 0.00 H new ATOM 0 HA ILE A 161 -1.485 22.804 -4.493 1.00 0.00 H new ATOM 0 HB ILE A 161 1.126 22.939 -3.110 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -1.011 22.522 -1.133 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -0.653 21.073 -2.051 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -0.048 24.740 -1.889 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -0.230 24.912 -3.651 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -1.573 24.270 -2.676 1.00 0.00 H new ATOM 0 HD11 ILE A 161 0.706 21.181 -0.018 1.00 0.00 H new ATOM 0 HD12 ILE A 161 1.737 21.277 -1.465 1.00 0.00 H new ATOM 0 HD13 ILE A 161 1.374 22.748 -0.533 1.00 0.00 H new ATOM 2379 N GLU A 162 0.098 23.276 -6.334 1.00 0.00 N ATOM 2380 CA GLU A 162 0.945 23.464 -7.504 1.00 0.00 C ATOM 2381 C GLU A 162 2.362 23.852 -7.102 1.00 0.00 C ATOM 2382 O GLU A 162 2.571 24.563 -6.118 1.00 0.00 O ATOM 2383 CB GLU A 162 0.355 24.523 -8.433 1.00 0.00 C ATOM 2384 CG GLU A 162 -0.274 23.938 -9.685 1.00 0.00 C ATOM 2385 CD GLU A 162 -0.597 24.994 -10.724 1.00 0.00 C ATOM 2386 OE1 GLU A 162 0.000 26.089 -10.664 1.00 0.00 O ATOM 2387 OE2 GLU A 162 -1.446 24.725 -11.601 1.00 0.00 O ATOM 0 H GLU A 162 -0.720 23.885 -6.299 1.00 0.00 H new ATOM 0 HA GLU A 162 0.989 22.514 -8.036 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -0.397 25.095 -7.890 1.00 0.00 H new ATOM 0 HB3 GLU A 162 1.140 25.222 -8.721 1.00 0.00 H new ATOM 0 HG2 GLU A 162 0.404 23.203 -10.118 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -1.188 23.408 -9.415 1.00 0.00 H new ATOM 2394 N GLY A 163 3.333 23.376 -7.873 1.00 0.00 N ATOM 2395 CA GLY A 163 4.724 23.678 -7.590 1.00 0.00 C ATOM 2396 C GLY A 163 5.420 24.352 -8.756 1.00 0.00 C ATOM 2397 O GLY A 163 4.835 25.196 -9.433 1.00 0.00 O ATOM 0 H GLY A 163 3.181 22.785 -8.691 1.00 0.00 H new ATOM 0 HA2 GLY A 163 4.781 24.324 -6.714 1.00 0.00 H new ATOM 0 HA3 GLY A 163 5.249 22.756 -7.341 1.00 0.00 H new