USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 379 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 91 MET CE :methyl -171:sc= 0 (180deg=-0.0839) USER MOD Set 1.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.419 K(o=-0.42,f=-1.2) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -167:sc= -0.201 (180deg=-0.304) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0.113 USER MOD Single : A 113 ASN : amide:sc= -3.19 K(o=-3.2,f=-5!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 170:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 72:sc= -0.442 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 150:sc= -0.174 USER MOD Single : A 125 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.623) USER MOD Single : A 126 GLN : amide:sc= -1.46 K(o=-1.5,f=-2.9!) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.0168 K(o=-0.017,f=-0.53) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 66.998 9.284 -50.370 1.00 0.00 N ATOM 463 CA VAL A 82 67.044 9.761 -51.747 1.00 0.00 C ATOM 464 C VAL A 82 67.414 8.636 -52.707 1.00 0.00 C ATOM 465 O VAL A 82 68.283 7.815 -52.412 1.00 0.00 O ATOM 466 CB VAL A 82 68.054 10.912 -51.909 1.00 0.00 C ATOM 467 CG1 VAL A 82 69.434 10.482 -51.436 1.00 0.00 C ATOM 468 CG2 VAL A 82 68.099 11.382 -53.355 1.00 0.00 C ATOM 0 HA VAL A 82 66.046 10.127 -51.988 1.00 0.00 H new ATOM 0 HB VAL A 82 67.728 11.748 -51.290 1.00 0.00 H new ATOM 0 HG11 VAL A 82 70.134 11.308 -51.558 1.00 0.00 H new ATOM 0 HG12 VAL A 82 69.386 10.199 -50.384 1.00 0.00 H new ATOM 0 HG13 VAL A 82 69.772 9.630 -52.026 1.00 0.00 H new ATOM 0 HG21 VAL A 82 68.818 12.196 -53.451 1.00 0.00 H new ATOM 0 HG22 VAL A 82 68.400 10.554 -53.997 1.00 0.00 H new ATOM 0 HG23 VAL A 82 67.112 11.733 -53.654 1.00 0.00 H new ATOM 478 N VAL A 83 66.749 8.604 -53.857 1.00 0.00 N ATOM 479 CA VAL A 83 67.009 7.580 -54.862 1.00 0.00 C ATOM 480 C VAL A 83 68.447 7.655 -55.364 1.00 0.00 C ATOM 481 O VAL A 83 68.850 8.644 -55.975 1.00 0.00 O ATOM 482 CB VAL A 83 66.051 7.715 -56.061 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.197 6.525 -56.998 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.614 7.853 -55.581 1.00 0.00 C ATOM 0 H VAL A 83 66.026 9.275 -54.116 1.00 0.00 H new ATOM 0 HA VAL A 83 66.845 6.616 -54.381 1.00 0.00 H new ATOM 0 HB VAL A 83 66.314 8.617 -56.614 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.513 6.638 -57.839 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.221 6.477 -57.368 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.962 5.607 -56.460 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.951 7.947 -56.441 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.337 6.971 -55.004 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.523 8.740 -54.954 1.00 0.00 H new ATOM 494 N GLU A 84 69.215 6.602 -55.102 1.00 0.00 N ATOM 495 CA GLU A 84 70.609 6.550 -55.526 1.00 0.00 C ATOM 496 C GLU A 84 70.712 6.236 -57.016 1.00 0.00 C ATOM 497 O GLU A 84 71.502 6.845 -57.738 1.00 0.00 O ATOM 498 CB GLU A 84 71.372 5.498 -54.718 1.00 0.00 C ATOM 499 CG GLU A 84 72.882 5.649 -54.795 1.00 0.00 C ATOM 500 CD GLU A 84 73.618 4.492 -54.148 1.00 0.00 C ATOM 501 OE1 GLU A 84 73.213 3.332 -54.374 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.598 4.745 -53.417 1.00 0.00 O ATOM 0 H GLU A 84 68.896 5.774 -54.599 1.00 0.00 H new ATOM 0 HA GLU A 84 71.054 7.529 -55.346 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.062 5.558 -53.675 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.096 4.506 -55.076 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.183 5.727 -55.840 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.176 6.579 -54.308 1.00 0.00 H new ATOM 509 N LYS A 85 69.908 5.280 -57.470 1.00 0.00 N ATOM 510 CA LYS A 85 69.907 4.884 -58.874 1.00 0.00 C ATOM 511 C LYS A 85 68.762 3.918 -59.165 1.00 0.00 C ATOM 512 O LYS A 85 68.045 3.498 -58.257 1.00 0.00 O ATOM 513 CB LYS A 85 71.242 4.234 -59.243 1.00 0.00 C ATOM 514 CG LYS A 85 71.595 3.035 -58.380 1.00 0.00 C ATOM 515 CD LYS A 85 72.364 1.988 -59.168 1.00 0.00 C ATOM 516 CE LYS A 85 73.673 2.545 -59.706 1.00 0.00 C ATOM 517 NZ LYS A 85 74.705 1.482 -59.862 1.00 0.00 N ATOM 0 H LYS A 85 69.249 4.765 -56.886 1.00 0.00 H new ATOM 0 HA LYS A 85 69.767 5.780 -59.479 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.208 3.922 -60.287 1.00 0.00 H new ATOM 0 HB3 LYS A 85 72.034 4.978 -59.158 1.00 0.00 H new ATOM 0 HG2 LYS A 85 72.192 3.362 -57.528 1.00 0.00 H new ATOM 0 HG3 LYS A 85 70.683 2.593 -57.979 1.00 0.00 H new ATOM 0 HD2 LYS A 85 72.568 1.128 -58.530 1.00 0.00 H new ATOM 0 HD3 LYS A 85 71.751 1.632 -59.996 1.00 0.00 H new ATOM 0 HE2 LYS A 85 73.496 3.023 -60.669 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.045 3.316 -59.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 75.582 1.901 -60.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 74.893 1.042 -58.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 74.361 0.759 -60.526 1.00 0.00 H new ATOM 531 N VAL A 86 68.598 3.569 -60.437 1.00 0.00 N ATOM 532 CA VAL A 86 67.542 2.651 -60.848 1.00 0.00 C ATOM 533 C VAL A 86 67.948 1.202 -60.601 1.00 0.00 C ATOM 534 O VAL A 86 69.087 0.811 -60.863 1.00 0.00 O ATOM 535 CB VAL A 86 67.192 2.828 -62.337 1.00 0.00 C ATOM 536 CG1 VAL A 86 66.115 1.838 -62.754 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.750 4.257 -62.613 1.00 0.00 C ATOM 0 H VAL A 86 69.183 3.908 -61.201 1.00 0.00 H new ATOM 0 HA VAL A 86 66.664 2.888 -60.246 1.00 0.00 H new ATOM 0 HB VAL A 86 68.085 2.627 -62.929 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.881 1.978 -63.809 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.474 0.821 -62.594 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.218 2.004 -62.158 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.506 4.365 -63.670 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.870 4.488 -62.012 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.556 4.944 -62.355 1.00 0.00 H new ATOM 547 N LEU A 87 67.010 0.408 -60.097 1.00 0.00 N ATOM 548 CA LEU A 87 67.269 -1.000 -59.816 1.00 0.00 C ATOM 549 C LEU A 87 66.958 -1.864 -61.033 1.00 0.00 C ATOM 550 O LEU A 87 67.758 -2.714 -61.426 1.00 0.00 O ATOM 551 CB LEU A 87 66.434 -1.463 -58.620 1.00 0.00 C ATOM 552 CG LEU A 87 66.969 -2.675 -57.858 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.937 -3.916 -58.737 1.00 0.00 C ATOM 554 CD2 LEU A 87 68.382 -2.410 -57.358 1.00 0.00 C ATOM 0 H LEU A 87 66.063 0.715 -59.874 1.00 0.00 H new ATOM 0 HA LEU A 87 68.327 -1.109 -59.577 1.00 0.00 H new ATOM 0 HB2 LEU A 87 66.343 -0.631 -57.922 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.429 -1.695 -58.972 1.00 0.00 H new ATOM 0 HG LEU A 87 66.326 -2.849 -56.995 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.322 -4.768 -58.177 1.00 0.00 H new ATOM 0 HD12 LEU A 87 65.911 -4.117 -59.045 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.555 -3.753 -59.620 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.747 -3.284 -56.818 1.00 0.00 H new ATOM 0 HD22 LEU A 87 69.036 -2.209 -58.206 1.00 0.00 H new ATOM 0 HD23 LEU A 87 68.376 -1.548 -56.691 1.00 0.00 H new ATOM 566 N LYS A 88 65.791 -1.641 -61.628 1.00 0.00 N ATOM 567 CA LYS A 88 65.375 -2.397 -62.804 1.00 0.00 C ATOM 568 C LYS A 88 64.170 -1.742 -63.473 1.00 0.00 C ATOM 569 O LYS A 88 63.496 -0.903 -62.875 1.00 0.00 O ATOM 570 CB LYS A 88 65.035 -3.837 -62.416 1.00 0.00 C ATOM 571 CG LYS A 88 66.174 -4.815 -62.650 1.00 0.00 C ATOM 572 CD LYS A 88 65.662 -6.234 -62.832 1.00 0.00 C ATOM 573 CE LYS A 88 66.804 -7.218 -63.032 1.00 0.00 C ATOM 574 NZ LYS A 88 66.386 -8.619 -62.752 1.00 0.00 N ATOM 0 H LYS A 88 65.116 -0.943 -61.315 1.00 0.00 H new ATOM 0 HA LYS A 88 66.203 -2.404 -63.512 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.754 -3.864 -61.363 1.00 0.00 H new ATOM 0 HB3 LYS A 88 64.165 -4.162 -62.986 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.737 -4.514 -63.533 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.863 -4.781 -61.806 1.00 0.00 H new ATOM 0 HD2 LYS A 88 65.078 -6.526 -61.959 1.00 0.00 H new ATOM 0 HD3 LYS A 88 64.992 -6.273 -63.691 1.00 0.00 H new ATOM 0 HE2 LYS A 88 67.170 -7.146 -64.056 1.00 0.00 H new ATOM 0 HE3 LYS A 88 67.633 -6.949 -62.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.193 -9.258 -62.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 66.061 -8.694 -61.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 65.612 -8.885 -63.393 1.00 0.00 H new ATOM 588 N HIS A 89 63.905 -2.132 -64.716 1.00 0.00 N ATOM 589 CA HIS A 89 62.780 -1.584 -65.465 1.00 0.00 C ATOM 590 C HIS A 89 61.773 -2.677 -65.811 1.00 0.00 C ATOM 591 O HIS A 89 62.133 -3.847 -65.940 1.00 0.00 O ATOM 592 CB HIS A 89 63.273 -0.906 -66.744 1.00 0.00 C ATOM 593 CG HIS A 89 63.509 -1.859 -67.875 1.00 0.00 C ATOM 594 ND1 HIS A 89 62.498 -2.323 -68.690 1.00 0.00 N ATOM 595 CD2 HIS A 89 64.648 -2.434 -68.325 1.00 0.00 C ATOM 596 CE1 HIS A 89 63.006 -3.144 -69.592 1.00 0.00 C ATOM 597 NE2 HIS A 89 64.309 -3.228 -69.393 1.00 0.00 N ATOM 0 H HIS A 89 64.454 -2.825 -65.225 1.00 0.00 H new ATOM 0 HA HIS A 89 62.285 -0.843 -64.837 1.00 0.00 H new ATOM 0 HB2 HIS A 89 62.542 -0.160 -67.055 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.200 -0.374 -66.529 1.00 0.00 H new ATOM 0 HD2 HIS A 89 65.639 -2.295 -67.920 1.00 0.00 H new ATOM 0 HE1 HIS A 89 62.450 -3.659 -70.361 1.00 0.00 H new ATOM 0 HE2 HIS A 89 64.958 -3.791 -69.943 1.00 0.00 H new ATOM 605 N ARG A 90 60.511 -2.287 -65.959 1.00 0.00 N ATOM 606 CA ARG A 90 59.453 -3.234 -66.287 1.00 0.00 C ATOM 607 C ARG A 90 58.244 -2.515 -66.879 1.00 0.00 C ATOM 608 O ARG A 90 57.943 -1.380 -66.510 1.00 0.00 O ATOM 609 CB ARG A 90 59.034 -4.016 -65.041 1.00 0.00 C ATOM 610 CG ARG A 90 58.201 -5.250 -65.347 1.00 0.00 C ATOM 611 CD ARG A 90 59.079 -6.444 -65.691 1.00 0.00 C ATOM 612 NE ARG A 90 58.289 -7.619 -66.048 1.00 0.00 N ATOM 613 CZ ARG A 90 57.649 -7.751 -67.205 1.00 0.00 C ATOM 614 NH1 ARG A 90 57.707 -6.786 -68.112 1.00 0.00 N ATOM 615 NH2 ARG A 90 56.951 -8.851 -67.456 1.00 0.00 N ATOM 0 H ARG A 90 60.197 -1.322 -65.857 1.00 0.00 H new ATOM 0 HA ARG A 90 59.841 -3.930 -67.031 1.00 0.00 H new ATOM 0 HB2 ARG A 90 59.927 -4.318 -64.494 1.00 0.00 H new ATOM 0 HB3 ARG A 90 58.465 -3.358 -64.384 1.00 0.00 H new ATOM 0 HG2 ARG A 90 57.577 -5.492 -64.487 1.00 0.00 H new ATOM 0 HG3 ARG A 90 57.529 -5.040 -66.179 1.00 0.00 H new ATOM 0 HD2 ARG A 90 59.736 -6.184 -66.520 1.00 0.00 H new ATOM 0 HD3 ARG A 90 59.718 -6.681 -64.840 1.00 0.00 H new ATOM 0 HE ARG A 90 58.225 -8.380 -65.372 1.00 0.00 H new ATOM 0 HH11 ARG A 90 58.244 -5.940 -67.923 1.00 0.00 H new ATOM 0 HH12 ARG A 90 57.215 -6.890 -68.999 1.00 0.00 H new ATOM 0 HH21 ARG A 90 56.905 -9.596 -66.761 1.00 0.00 H new ATOM 0 HH22 ARG A 90 56.460 -8.952 -68.344 1.00 0.00 H new ATOM 629 N MET A 91 57.556 -3.183 -67.799 1.00 0.00 N ATOM 630 CA MET A 91 56.380 -2.608 -68.441 1.00 0.00 C ATOM 631 C MET A 91 55.185 -2.614 -67.493 1.00 0.00 C ATOM 632 O MET A 91 54.999 -3.554 -66.721 1.00 0.00 O ATOM 633 CB MET A 91 56.039 -3.382 -69.716 1.00 0.00 C ATOM 634 CG MET A 91 54.958 -2.722 -70.557 1.00 0.00 C ATOM 635 SD MET A 91 54.574 -3.654 -72.051 1.00 0.00 S ATOM 636 CE MET A 91 56.002 -3.274 -73.064 1.00 0.00 C ATOM 0 H MET A 91 57.793 -4.123 -68.117 1.00 0.00 H new ATOM 0 HA MET A 91 56.608 -1.575 -68.702 1.00 0.00 H new ATOM 0 HB2 MET A 91 56.941 -3.490 -70.318 1.00 0.00 H new ATOM 0 HB3 MET A 91 55.715 -4.387 -69.445 1.00 0.00 H new ATOM 0 HG2 MET A 91 54.053 -2.614 -69.959 1.00 0.00 H new ATOM 0 HG3 MET A 91 55.280 -1.718 -70.833 1.00 0.00 H new ATOM 0 HE1 MET A 91 55.839 -3.645 -74.076 1.00 0.00 H new ATOM 0 HE2 MET A 91 56.151 -2.195 -73.093 1.00 0.00 H new ATOM 0 HE3 MET A 91 56.886 -3.751 -72.641 1.00 0.00 H new ATOM 646 N ALA A 92 54.379 -1.559 -67.557 1.00 0.00 N ATOM 647 CA ALA A 92 53.202 -1.445 -66.705 1.00 0.00 C ATOM 648 C ALA A 92 52.067 -2.325 -67.217 1.00 0.00 C ATOM 649 O ALA A 92 51.872 -2.464 -68.425 1.00 0.00 O ATOM 650 CB ALA A 92 52.751 0.006 -66.621 1.00 0.00 C ATOM 0 H ALA A 92 54.520 -0.772 -68.190 1.00 0.00 H new ATOM 0 HA ALA A 92 53.471 -1.789 -65.706 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.871 0.077 -65.982 1.00 0.00 H new ATOM 0 HB2 ALA A 92 53.554 0.613 -66.202 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.505 0.369 -67.619 1.00 0.00 H new ATOM 716 N GLY A 97 52.918 3.059 -70.229 1.00 0.00 N ATOM 717 CA GLY A 97 54.288 3.490 -70.438 1.00 0.00 C ATOM 718 C GLY A 97 55.297 2.493 -69.904 1.00 0.00 C ATOM 719 O GLY A 97 55.256 1.312 -70.249 1.00 0.00 O ATOM 0 HA2 GLY A 97 54.460 3.641 -71.504 1.00 0.00 H new ATOM 0 HA3 GLY A 97 54.441 4.453 -69.951 1.00 0.00 H new ATOM 723 N TYR A 98 56.206 2.969 -69.060 1.00 0.00 N ATOM 724 CA TYR A 98 57.233 2.111 -68.480 1.00 0.00 C ATOM 725 C TYR A 98 57.500 2.488 -67.026 1.00 0.00 C ATOM 726 O TYR A 98 57.454 3.662 -66.660 1.00 0.00 O ATOM 727 CB TYR A 98 58.527 2.210 -69.290 1.00 0.00 C ATOM 728 CG TYR A 98 58.512 1.387 -70.558 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.839 0.036 -70.536 1.00 0.00 C ATOM 730 CD2 TYR A 98 58.172 1.959 -71.778 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.827 -0.720 -71.692 1.00 0.00 C ATOM 732 CE2 TYR A 98 58.157 1.210 -72.938 1.00 0.00 C ATOM 733 CZ TYR A 98 58.485 -0.129 -72.891 1.00 0.00 C ATOM 734 OH TYR A 98 58.472 -0.878 -74.045 1.00 0.00 O ATOM 0 H TYR A 98 56.253 3.944 -68.762 1.00 0.00 H new ATOM 0 HA TYR A 98 56.871 1.083 -68.510 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.706 3.254 -69.547 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.361 1.887 -68.667 1.00 0.00 H new ATOM 0 HD1 TYR A 98 59.107 -0.430 -69.599 1.00 0.00 H new ATOM 0 HD2 TYR A 98 57.915 3.007 -71.820 1.00 0.00 H new ATOM 0 HE1 TYR A 98 59.084 -1.768 -71.658 1.00 0.00 H new ATOM 0 HE2 TYR A 98 57.890 1.670 -73.878 1.00 0.00 H new ATOM 0 HH TYR A 98 58.209 -0.311 -74.800 1.00 0.00 H new ATOM 744 N GLU A 99 57.780 1.483 -66.203 1.00 0.00 N ATOM 745 CA GLU A 99 58.055 1.708 -64.789 1.00 0.00 C ATOM 746 C GLU A 99 59.485 1.306 -64.441 1.00 0.00 C ATOM 747 O GLU A 99 60.062 0.417 -65.068 1.00 0.00 O ATOM 748 CB GLU A 99 57.068 0.921 -63.923 1.00 0.00 C ATOM 749 CG GLU A 99 55.652 1.471 -63.962 1.00 0.00 C ATOM 750 CD GLU A 99 54.794 0.954 -62.823 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.269 0.071 -62.078 1.00 0.00 O ATOM 752 OE2 GLU A 99 53.650 1.431 -62.678 1.00 0.00 O ATOM 0 H GLU A 99 57.822 0.505 -66.491 1.00 0.00 H new ATOM 0 HA GLU A 99 57.936 2.773 -64.588 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.055 -0.117 -64.254 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.421 0.922 -62.892 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.688 2.560 -63.920 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.188 1.204 -64.912 1.00 0.00 H new ATOM 759 N TYR A 100 60.053 1.968 -63.439 1.00 0.00 N ATOM 760 CA TYR A 100 61.417 1.683 -63.010 1.00 0.00 C ATOM 761 C TYR A 100 61.512 1.645 -61.488 1.00 0.00 C ATOM 762 O TYR A 100 60.848 2.416 -60.792 1.00 0.00 O ATOM 763 CB TYR A 100 62.379 2.735 -63.566 1.00 0.00 C ATOM 764 CG TYR A 100 62.162 3.039 -65.031 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.205 3.963 -65.434 1.00 0.00 C ATOM 766 CD2 TYR A 100 62.913 2.404 -66.011 1.00 0.00 C ATOM 767 CE1 TYR A 100 61.003 4.244 -66.771 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.719 2.680 -67.351 1.00 0.00 C ATOM 769 CZ TYR A 100 61.763 3.601 -67.726 1.00 0.00 C ATOM 770 OH TYR A 100 61.566 3.877 -69.059 1.00 0.00 O ATOM 0 H TYR A 100 59.590 2.706 -62.909 1.00 0.00 H new ATOM 0 HA TYR A 100 61.696 0.703 -63.398 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.269 3.655 -62.992 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.403 2.391 -63.423 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.609 4.470 -64.689 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.662 1.682 -65.721 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.254 4.963 -67.067 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.312 2.177 -68.100 1.00 0.00 H new ATOM 0 HH TYR A 100 62.183 3.340 -69.599 1.00 0.00 H new ATOM 780 N LEU A 101 62.342 0.743 -60.976 1.00 0.00 N ATOM 781 CA LEU A 101 62.526 0.603 -59.536 1.00 0.00 C ATOM 782 C LEU A 101 63.507 1.644 -59.008 1.00 0.00 C ATOM 783 O LEU A 101 64.503 1.962 -59.661 1.00 0.00 O ATOM 784 CB LEU A 101 63.028 -0.803 -59.201 1.00 0.00 C ATOM 785 CG LEU A 101 61.957 -1.890 -59.094 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.594 -3.238 -58.793 1.00 0.00 C ATOM 787 CD2 LEU A 101 60.936 -1.530 -58.025 1.00 0.00 C ATOM 0 H LEU A 101 62.898 0.098 -61.537 1.00 0.00 H new ATOM 0 HA LEU A 101 61.561 0.763 -59.054 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.746 -1.102 -59.964 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.568 -0.759 -58.255 1.00 0.00 H new ATOM 0 HG LEU A 101 61.441 -1.960 -60.051 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.817 -3.999 -58.720 1.00 0.00 H new ATOM 0 HD12 LEU A 101 63.286 -3.500 -59.594 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.136 -3.182 -57.849 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.182 -2.315 -57.963 1.00 0.00 H new ATOM 0 HD22 LEU A 101 61.437 -1.431 -57.062 1.00 0.00 H new ATOM 0 HD23 LEU A 101 60.457 -0.586 -58.283 1.00 0.00 H new ATOM 799 N LEU A 102 63.222 2.172 -57.823 1.00 0.00 N ATOM 800 CA LEU A 102 64.080 3.177 -57.206 1.00 0.00 C ATOM 801 C LEU A 102 64.984 2.547 -56.151 1.00 0.00 C ATOM 802 O LEU A 102 64.525 2.158 -55.076 1.00 0.00 O ATOM 803 CB LEU A 102 63.232 4.282 -56.573 1.00 0.00 C ATOM 804 CG LEU A 102 62.171 4.912 -57.475 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.131 5.646 -56.643 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.816 5.857 -58.479 1.00 0.00 C ATOM 0 H LEU A 102 62.403 1.921 -57.270 1.00 0.00 H new ATOM 0 HA LEU A 102 64.708 3.611 -57.985 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.736 3.873 -55.693 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.899 5.070 -56.225 1.00 0.00 H new ATOM 0 HG LEU A 102 61.671 4.115 -58.026 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.384 6.088 -57.302 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.646 4.944 -55.964 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.616 6.433 -56.065 1.00 0.00 H new ATOM 0 HD21 LEU A 102 62.045 6.296 -59.113 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.343 6.649 -57.947 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.522 5.304 -59.098 1.00 0.00 H new ATOM 818 N LYS A 103 66.272 2.451 -56.463 1.00 0.00 N ATOM 819 CA LYS A 103 67.242 1.872 -55.542 1.00 0.00 C ATOM 820 C LYS A 103 67.651 2.883 -54.476 1.00 0.00 C ATOM 821 O LYS A 103 68.066 3.998 -54.792 1.00 0.00 O ATOM 822 CB LYS A 103 68.478 1.392 -56.306 1.00 0.00 C ATOM 823 CG LYS A 103 69.370 0.465 -55.499 1.00 0.00 C ATOM 824 CD LYS A 103 70.832 0.622 -55.883 1.00 0.00 C ATOM 825 CE LYS A 103 71.248 -0.407 -56.923 1.00 0.00 C ATOM 826 NZ LYS A 103 72.693 -0.752 -56.814 1.00 0.00 N ATOM 0 H LYS A 103 66.668 2.767 -57.348 1.00 0.00 H new ATOM 0 HA LYS A 103 66.774 1.020 -55.049 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.158 0.877 -57.212 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.059 2.259 -56.621 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.248 0.675 -54.436 1.00 0.00 H new ATOM 0 HG3 LYS A 103 69.060 -0.568 -55.657 1.00 0.00 H new ATOM 0 HD2 LYS A 103 71.001 1.625 -56.274 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.456 0.517 -54.995 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.649 -1.309 -56.801 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.041 -0.019 -57.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 72.989 -1.278 -57.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 73.253 0.121 -56.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 72.847 -1.340 -55.970 1.00 0.00 H new ATOM 840 N TRP A 104 67.533 2.486 -53.214 1.00 0.00 N ATOM 841 CA TRP A 104 67.892 3.358 -52.102 1.00 0.00 C ATOM 842 C TRP A 104 69.400 3.360 -51.877 1.00 0.00 C ATOM 843 O TRP A 104 70.060 2.333 -52.032 1.00 0.00 O ATOM 844 CB TRP A 104 67.174 2.915 -50.826 1.00 0.00 C ATOM 845 CG TRP A 104 65.680 2.932 -50.949 1.00 0.00 C ATOM 846 CD1 TRP A 104 64.862 1.857 -51.151 1.00 0.00 C ATOM 847 CD2 TRP A 104 64.828 4.080 -50.880 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.553 2.268 -51.211 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.505 3.627 -51.047 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.053 5.446 -50.692 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.414 4.493 -51.033 1.00 0.00 C ATOM 852 CZ3 TRP A 104 63.970 6.304 -50.678 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.664 5.825 -50.846 1.00 0.00 C ATOM 0 H TRP A 104 67.192 1.566 -52.935 1.00 0.00 H new ATOM 0 HA TRP A 104 67.579 4.372 -52.353 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.499 1.907 -50.566 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.471 3.567 -50.005 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.195 0.834 -51.249 1.00 0.00 H new ATOM 0 HE1 TRP A 104 62.747 1.660 -51.354 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.056 5.825 -50.560 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.407 4.126 -51.165 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.133 7.362 -50.535 1.00 0.00 H new ATOM 0 HH2 TRP A 104 61.838 6.521 -50.828 1.00 0.00 H new ATOM 864 N GLU A 105 69.938 4.519 -51.509 1.00 0.00 N ATOM 865 CA GLU A 105 71.369 4.652 -51.263 1.00 0.00 C ATOM 866 C GLU A 105 71.804 3.777 -50.091 1.00 0.00 C ATOM 867 O GLU A 105 71.335 3.949 -48.967 1.00 0.00 O ATOM 868 CB GLU A 105 71.728 6.113 -50.983 1.00 0.00 C ATOM 869 CG GLU A 105 70.972 6.711 -49.809 1.00 0.00 C ATOM 870 CD GLU A 105 71.163 8.211 -49.694 1.00 0.00 C ATOM 871 OE1 GLU A 105 71.679 8.819 -50.655 1.00 0.00 O ATOM 872 OE2 GLU A 105 70.795 8.776 -48.643 1.00 0.00 O ATOM 0 H GLU A 105 69.405 5.378 -51.375 1.00 0.00 H new ATOM 0 HA GLU A 105 71.897 4.320 -52.157 1.00 0.00 H new ATOM 0 HB2 GLU A 105 72.798 6.185 -50.790 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.525 6.706 -51.875 1.00 0.00 H new ATOM 0 HG2 GLU A 105 69.910 6.491 -49.916 1.00 0.00 H new ATOM 0 HG3 GLU A 105 71.305 6.235 -48.887 1.00 0.00 H new ATOM 879 N GLY A 106 72.704 2.836 -50.364 1.00 0.00 N ATOM 880 CA GLY A 106 73.186 1.948 -49.323 1.00 0.00 C ATOM 881 C GLY A 106 72.383 0.665 -49.238 1.00 0.00 C ATOM 882 O GLY A 106 72.923 -0.394 -48.915 1.00 0.00 O ATOM 0 H GLY A 106 73.107 2.674 -51.287 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.232 1.707 -49.511 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.145 2.463 -48.363 1.00 0.00 H new ATOM 886 N TYR A 107 71.090 0.758 -49.527 1.00 0.00 N ATOM 887 CA TYR A 107 70.210 -0.404 -49.477 1.00 0.00 C ATOM 888 C TYR A 107 69.896 -0.909 -50.882 1.00 0.00 C ATOM 889 O TYR A 107 69.414 -0.159 -51.731 1.00 0.00 O ATOM 890 CB TYR A 107 68.912 -0.056 -48.747 1.00 0.00 C ATOM 891 CG TYR A 107 69.126 0.725 -47.470 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.369 0.074 -46.267 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.086 2.114 -47.466 1.00 0.00 C ATOM 894 CE1 TYR A 107 69.565 0.783 -45.097 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.282 2.831 -46.302 1.00 0.00 C ATOM 896 CZ TYR A 107 69.521 2.161 -45.120 1.00 0.00 C ATOM 897 OH TYR A 107 69.715 2.872 -43.958 1.00 0.00 O ATOM 0 H TYR A 107 70.628 1.626 -49.798 1.00 0.00 H new ATOM 0 HA TYR A 107 70.725 -1.195 -48.932 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.274 0.523 -49.414 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.378 -0.977 -48.514 1.00 0.00 H new ATOM 0 HD1 TYR A 107 69.405 -1.005 -46.246 1.00 0.00 H new ATOM 0 HD2 TYR A 107 68.898 2.642 -48.389 1.00 0.00 H new ATOM 0 HE1 TYR A 107 69.752 0.261 -44.170 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.248 3.910 -46.317 1.00 0.00 H new ATOM 0 HH TYR A 107 69.653 3.832 -44.147 1.00 0.00 H new ATOM 907 N ASP A 108 70.173 -2.187 -51.119 1.00 0.00 N ATOM 908 CA ASP A 108 69.919 -2.796 -52.420 1.00 0.00 C ATOM 909 C ASP A 108 68.810 -3.839 -52.324 1.00 0.00 C ATOM 910 O ASP A 108 69.053 -4.984 -51.943 1.00 0.00 O ATOM 911 CB ASP A 108 71.196 -3.439 -52.964 1.00 0.00 C ATOM 912 CG ASP A 108 71.108 -3.736 -54.448 1.00 0.00 C ATOM 913 OD1 ASP A 108 69.976 -3.859 -54.962 1.00 0.00 O ATOM 914 OD2 ASP A 108 72.170 -3.844 -55.095 1.00 0.00 O ATOM 0 H ASP A 108 70.573 -2.821 -50.427 1.00 0.00 H new ATOM 0 HA ASP A 108 69.597 -2.011 -53.105 1.00 0.00 H new ATOM 0 HB2 ASP A 108 72.041 -2.775 -52.779 1.00 0.00 H new ATOM 0 HB3 ASP A 108 71.393 -4.364 -52.422 1.00 0.00 H new ATOM 919 N ASP A 109 67.593 -3.435 -52.672 1.00 0.00 N ATOM 920 CA ASP A 109 66.447 -4.335 -52.626 1.00 0.00 C ATOM 921 C ASP A 109 66.308 -5.106 -53.935 1.00 0.00 C ATOM 922 O ASP A 109 66.806 -4.693 -54.983 1.00 0.00 O ATOM 923 CB ASP A 109 65.165 -3.548 -52.344 1.00 0.00 C ATOM 924 CG ASP A 109 64.605 -3.829 -50.964 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.319 -3.576 -49.971 1.00 0.00 O ATOM 926 OD2 ASP A 109 63.453 -4.304 -50.876 1.00 0.00 O ATOM 0 H ASP A 109 67.375 -2.490 -52.989 1.00 0.00 H new ATOM 0 HA ASP A 109 66.610 -5.050 -51.820 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.368 -2.481 -52.440 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.416 -3.799 -53.095 1.00 0.00 H new ATOM 931 N PRO A 110 65.615 -6.253 -53.876 1.00 0.00 N ATOM 932 CA PRO A 110 65.395 -7.106 -55.047 1.00 0.00 C ATOM 933 C PRO A 110 64.445 -6.470 -56.057 1.00 0.00 C ATOM 934 O PRO A 110 64.176 -5.270 -56.000 1.00 0.00 O ATOM 935 CB PRO A 110 64.773 -8.372 -54.452 1.00 0.00 C ATOM 936 CG PRO A 110 64.132 -7.920 -53.186 1.00 0.00 C ATOM 937 CD PRO A 110 64.993 -6.805 -52.661 1.00 0.00 C ATOM 0 HA PRO A 110 66.318 -7.287 -55.599 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.042 -8.811 -55.131 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.530 -9.134 -54.263 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.114 -7.575 -53.366 1.00 0.00 H new ATOM 0 HG3 PRO A 110 64.070 -8.737 -52.467 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.402 -6.055 -52.136 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.741 -7.172 -51.958 1.00 0.00 H new ATOM 945 N SER A 111 63.940 -7.282 -56.980 1.00 0.00 N ATOM 946 CA SER A 111 63.022 -6.798 -58.005 1.00 0.00 C ATOM 947 C SER A 111 61.713 -6.325 -57.381 1.00 0.00 C ATOM 948 O SER A 111 60.893 -5.687 -58.042 1.00 0.00 O ATOM 949 CB SER A 111 62.744 -7.898 -59.031 1.00 0.00 C ATOM 950 OG SER A 111 62.969 -9.183 -58.476 1.00 0.00 O ATOM 0 H SER A 111 64.151 -8.278 -57.039 1.00 0.00 H new ATOM 0 HA SER A 111 63.491 -5.952 -58.508 1.00 0.00 H new ATOM 0 HB2 SER A 111 61.713 -7.824 -59.378 1.00 0.00 H new ATOM 0 HB3 SER A 111 63.384 -7.757 -59.902 1.00 0.00 H new ATOM 0 HG SER A 111 62.783 -9.868 -59.151 1.00 0.00 H new ATOM 956 N ASP A 112 61.524 -6.643 -56.106 1.00 0.00 N ATOM 957 CA ASP A 112 60.315 -6.250 -55.391 1.00 0.00 C ATOM 958 C ASP A 112 60.471 -4.860 -54.782 1.00 0.00 C ATOM 959 O ASP A 112 59.706 -4.468 -53.902 1.00 0.00 O ATOM 960 CB ASP A 112 59.991 -7.267 -54.296 1.00 0.00 C ATOM 961 CG ASP A 112 58.560 -7.156 -53.807 1.00 0.00 C ATOM 962 OD1 ASP A 112 57.641 -7.489 -54.584 1.00 0.00 O ATOM 963 OD2 ASP A 112 58.359 -6.735 -52.648 1.00 0.00 O ATOM 0 H ASP A 112 62.192 -7.172 -55.546 1.00 0.00 H new ATOM 0 HA ASP A 112 59.493 -6.223 -56.106 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.165 -8.274 -54.676 1.00 0.00 H new ATOM 0 HB3 ASP A 112 60.671 -7.122 -53.457 1.00 0.00 H new ATOM 968 N ASN A 113 61.468 -4.120 -55.256 1.00 0.00 N ATOM 969 CA ASN A 113 61.726 -2.774 -54.757 1.00 0.00 C ATOM 970 C ASN A 113 60.522 -1.867 -54.993 1.00 0.00 C ATOM 971 O ASN A 113 59.414 -2.340 -55.251 1.00 0.00 O ATOM 972 CB ASN A 113 62.964 -2.185 -55.436 1.00 0.00 C ATOM 973 CG ASN A 113 63.942 -1.594 -54.439 1.00 0.00 C ATOM 974 OD1 ASN A 113 63.587 -1.313 -53.295 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.183 -1.402 -54.872 1.00 0.00 N ATOM 0 H ASN A 113 62.111 -4.430 -55.985 1.00 0.00 H new ATOM 0 HA ASN A 113 61.905 -2.839 -53.684 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.463 -2.963 -56.014 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.656 -1.413 -56.141 1.00 0.00 H new ATOM 0 HD21 ASN A 113 65.886 -1.007 -54.247 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.433 -1.650 -55.829 1.00 0.00 H new ATOM 982 N THR A 114 60.747 -0.560 -54.905 1.00 0.00 N ATOM 983 CA THR A 114 59.682 0.414 -55.108 1.00 0.00 C ATOM 984 C THR A 114 59.563 0.800 -56.578 1.00 0.00 C ATOM 985 O THR A 114 60.480 1.388 -57.151 1.00 0.00 O ATOM 986 CB THR A 114 59.918 1.687 -54.272 1.00 0.00 C ATOM 987 OG1 THR A 114 60.621 1.359 -53.069 1.00 0.00 O ATOM 988 CG2 THR A 114 58.598 2.360 -53.927 1.00 0.00 C ATOM 0 H THR A 114 61.658 -0.151 -54.694 1.00 0.00 H new ATOM 0 HA THR A 114 58.755 -0.059 -54.783 1.00 0.00 H new ATOM 0 HB THR A 114 60.516 2.379 -54.865 1.00 0.00 H new ATOM 0 HG1 THR A 114 60.769 2.173 -52.544 1.00 0.00 H new ATOM 0 HG21 THR A 114 58.790 3.256 -53.337 1.00 0.00 H new ATOM 0 HG22 THR A 114 58.079 2.635 -54.845 1.00 0.00 H new ATOM 0 HG23 THR A 114 57.978 1.672 -53.351 1.00 0.00 H new ATOM 996 N TRP A 115 58.428 0.466 -57.182 1.00 0.00 N ATOM 997 CA TRP A 115 58.190 0.779 -58.586 1.00 0.00 C ATOM 998 C TRP A 115 57.723 2.221 -58.751 1.00 0.00 C ATOM 999 O TRP A 115 56.680 2.609 -58.225 1.00 0.00 O ATOM 1000 CB TRP A 115 57.150 -0.177 -59.173 1.00 0.00 C ATOM 1001 CG TRP A 115 57.518 -1.622 -59.020 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.220 -2.436 -57.964 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.253 -2.423 -59.951 1.00 0.00 C ATOM 1004 NE1 TRP A 115 57.726 -3.694 -58.183 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.364 -3.712 -59.395 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.827 -2.177 -61.201 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.026 -4.749 -60.047 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.484 -3.207 -61.847 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.579 -4.480 -61.270 1.00 0.00 C ATOM 0 H TRP A 115 57.659 -0.021 -56.722 1.00 0.00 H new ATOM 0 HA TRP A 115 59.130 0.658 -59.124 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.190 -0.001 -58.688 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.018 0.047 -60.232 1.00 0.00 H new ATOM 0 HD1 TRP A 115 56.668 -2.135 -57.086 1.00 0.00 H new ATOM 0 HE1 TRP A 115 57.641 -4.486 -57.546 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.758 -1.199 -61.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.101 -5.731 -59.603 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.932 -3.027 -62.813 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.099 -5.264 -61.800 1.00 0.00 H new ATOM 1020 N SER A 116 58.501 3.010 -59.484 1.00 0.00 N ATOM 1021 CA SER A 116 58.168 4.411 -59.715 1.00 0.00 C ATOM 1022 C SER A 116 57.811 4.650 -61.179 1.00 0.00 C ATOM 1023 O SER A 116 58.408 4.060 -62.080 1.00 0.00 O ATOM 1024 CB SER A 116 59.339 5.309 -59.311 1.00 0.00 C ATOM 1025 OG SER A 116 59.498 6.381 -60.223 1.00 0.00 O ATOM 0 H SER A 116 59.366 2.703 -59.928 1.00 0.00 H new ATOM 0 HA SER A 116 57.301 4.659 -59.102 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.171 5.702 -58.308 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.256 4.721 -59.273 1.00 0.00 H new ATOM 0 HG SER A 116 60.141 7.026 -59.861 1.00 0.00 H new ATOM 1031 N SER A 117 56.833 5.521 -61.409 1.00 0.00 N ATOM 1032 CA SER A 117 56.393 5.837 -62.763 1.00 0.00 C ATOM 1033 C SER A 117 57.263 6.930 -63.376 1.00 0.00 C ATOM 1034 O SER A 117 58.139 7.485 -62.713 1.00 0.00 O ATOM 1035 CB SER A 117 54.928 6.278 -62.755 1.00 0.00 C ATOM 1036 OG SER A 117 54.070 5.194 -62.446 1.00 0.00 O ATOM 0 H SER A 117 56.330 6.020 -60.675 1.00 0.00 H new ATOM 0 HA SER A 117 56.491 4.937 -63.370 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.789 7.075 -62.025 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.663 6.689 -63.729 1.00 0.00 H new ATOM 0 HG SER A 117 53.140 5.503 -62.446 1.00 0.00 H new ATOM 1042 N GLU A 118 57.013 7.234 -64.645 1.00 0.00 N ATOM 1043 CA GLU A 118 57.773 8.261 -65.348 1.00 0.00 C ATOM 1044 C GLU A 118 57.589 9.623 -64.687 1.00 0.00 C ATOM 1045 O GLU A 118 58.450 10.496 -64.789 1.00 0.00 O ATOM 1046 CB GLU A 118 57.342 8.331 -66.815 1.00 0.00 C ATOM 1047 CG GLU A 118 57.996 9.465 -67.587 1.00 0.00 C ATOM 1048 CD GLU A 118 57.440 9.611 -68.990 1.00 0.00 C ATOM 1049 OE1 GLU A 118 57.641 8.688 -69.807 1.00 0.00 O ATOM 1050 OE2 GLU A 118 56.804 10.649 -69.272 1.00 0.00 O ATOM 0 H GLU A 118 56.291 6.784 -65.207 1.00 0.00 H new ATOM 0 HA GLU A 118 58.828 7.993 -65.299 1.00 0.00 H new ATOM 0 HB2 GLU A 118 57.582 7.385 -67.301 1.00 0.00 H new ATOM 0 HB3 GLU A 118 56.259 8.448 -66.862 1.00 0.00 H new ATOM 0 HG2 GLU A 118 57.853 10.399 -67.044 1.00 0.00 H new ATOM 0 HG3 GLU A 118 59.070 9.290 -67.642 1.00 0.00 H new ATOM 1057 N ALA A 119 56.459 9.797 -64.009 1.00 0.00 N ATOM 1058 CA ALA A 119 56.161 11.052 -63.329 1.00 0.00 C ATOM 1059 C ALA A 119 57.277 11.430 -62.361 1.00 0.00 C ATOM 1060 O ALA A 119 57.727 12.575 -62.334 1.00 0.00 O ATOM 1061 CB ALA A 119 54.833 10.951 -62.594 1.00 0.00 C ATOM 0 H ALA A 119 55.735 9.085 -63.916 1.00 0.00 H new ATOM 0 HA ALA A 119 56.088 11.837 -64.082 1.00 0.00 H new ATOM 0 HB1 ALA A 119 54.623 11.895 -62.091 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.038 10.735 -63.308 1.00 0.00 H new ATOM 0 HB3 ALA A 119 54.885 10.150 -61.856 1.00 0.00 H new ATOM 1067 N ASP A 120 57.718 10.461 -61.567 1.00 0.00 N ATOM 1068 CA ASP A 120 58.782 10.692 -60.596 1.00 0.00 C ATOM 1069 C ASP A 120 60.150 10.662 -61.272 1.00 0.00 C ATOM 1070 O ASP A 120 61.083 11.337 -60.836 1.00 0.00 O ATOM 1071 CB ASP A 120 58.725 9.642 -59.485 1.00 0.00 C ATOM 1072 CG ASP A 120 57.795 10.043 -58.357 1.00 0.00 C ATOM 1073 OD1 ASP A 120 56.885 10.862 -58.602 1.00 0.00 O ATOM 1074 OD2 ASP A 120 57.979 9.539 -57.229 1.00 0.00 O ATOM 0 H ASP A 120 57.355 9.508 -61.576 1.00 0.00 H new ATOM 0 HA ASP A 120 58.634 11.680 -60.159 1.00 0.00 H new ATOM 0 HB2 ASP A 120 58.395 8.692 -59.904 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.727 9.484 -59.087 1.00 0.00 H new ATOM 1079 N CYS A 121 60.261 9.875 -62.336 1.00 0.00 N ATOM 1080 CA CYS A 121 61.515 9.755 -63.071 1.00 0.00 C ATOM 1081 C CYS A 121 62.019 11.125 -63.513 1.00 0.00 C ATOM 1082 O CYS A 121 63.220 11.328 -63.693 1.00 0.00 O ATOM 1083 CB CYS A 121 61.333 8.848 -64.288 1.00 0.00 C ATOM 1084 SG CYS A 121 61.062 7.108 -63.878 1.00 0.00 S ATOM 0 H CYS A 121 59.498 9.310 -62.709 1.00 0.00 H new ATOM 0 HA CYS A 121 62.256 9.312 -62.406 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.487 9.208 -64.873 1.00 0.00 H new ATOM 0 HB3 CYS A 121 62.216 8.927 -64.922 1.00 0.00 H new ATOM 0 HG CYS A 121 59.873 6.961 -63.374 1.00 0.00 H new ATOM 1090 N SER A 122 61.093 12.062 -63.689 1.00 0.00 N ATOM 1091 CA SER A 122 61.442 13.412 -64.116 1.00 0.00 C ATOM 1092 C SER A 122 62.527 14.001 -63.220 1.00 0.00 C ATOM 1093 O SER A 122 63.332 14.822 -63.659 1.00 0.00 O ATOM 1094 CB SER A 122 60.205 14.312 -64.096 1.00 0.00 C ATOM 1095 OG SER A 122 60.424 15.497 -64.842 1.00 0.00 O ATOM 0 H SER A 122 60.095 11.911 -63.542 1.00 0.00 H new ATOM 0 HA SER A 122 61.826 13.357 -65.135 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.352 13.772 -64.507 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.954 14.568 -63.067 1.00 0.00 H new ATOM 0 HG SER A 122 59.618 16.054 -64.815 1.00 0.00 H new ATOM 1101 N GLY A 123 62.543 13.575 -61.961 1.00 0.00 N ATOM 1102 CA GLY A 123 63.533 14.070 -61.022 1.00 0.00 C ATOM 1103 C GLY A 123 64.796 13.232 -61.016 1.00 0.00 C ATOM 1104 O GLY A 123 65.897 13.758 -60.851 1.00 0.00 O ATOM 0 H GLY A 123 61.888 12.896 -61.574 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.785 15.100 -61.274 1.00 0.00 H new ATOM 0 HA3 GLY A 123 63.104 14.083 -60.020 1.00 0.00 H new ATOM 1108 N CYS A 124 64.638 11.925 -61.194 1.00 0.00 N ATOM 1109 CA CYS A 124 65.775 11.012 -61.206 1.00 0.00 C ATOM 1110 C CYS A 124 66.215 10.710 -62.634 1.00 0.00 C ATOM 1111 O CYS A 124 66.675 9.608 -62.935 1.00 0.00 O ATOM 1112 CB CYS A 124 65.419 9.712 -60.484 1.00 0.00 C ATOM 1113 SG CYS A 124 64.969 9.931 -58.746 1.00 0.00 S ATOM 0 H CYS A 124 63.734 11.474 -61.332 1.00 0.00 H new ATOM 0 HA CYS A 124 66.602 11.494 -60.685 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.589 9.235 -61.006 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.268 9.031 -60.545 1.00 0.00 H new ATOM 0 HG CYS A 124 64.120 9.010 -58.398 1.00 0.00 H new ATOM 1119 N LYS A 125 66.071 11.696 -63.513 1.00 0.00 N ATOM 1120 CA LYS A 125 66.453 11.538 -64.911 1.00 0.00 C ATOM 1121 C LYS A 125 67.867 10.980 -65.029 1.00 0.00 C ATOM 1122 O LYS A 125 68.109 10.033 -65.777 1.00 0.00 O ATOM 1123 CB LYS A 125 66.360 12.880 -65.642 1.00 0.00 C ATOM 1124 CG LYS A 125 67.080 14.011 -64.929 1.00 0.00 C ATOM 1125 CD LYS A 125 66.781 15.355 -65.572 1.00 0.00 C ATOM 1126 CE LYS A 125 67.789 15.688 -66.661 1.00 0.00 C ATOM 1127 NZ LYS A 125 67.402 15.098 -67.973 1.00 0.00 N ATOM 0 H LYS A 125 65.692 12.614 -63.281 1.00 0.00 H new ATOM 0 HA LYS A 125 65.763 10.832 -65.372 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.777 12.769 -66.643 1.00 0.00 H new ATOM 0 HB3 LYS A 125 65.310 13.147 -65.762 1.00 0.00 H new ATOM 0 HG2 LYS A 125 66.779 14.033 -63.882 1.00 0.00 H new ATOM 0 HG3 LYS A 125 68.154 13.829 -64.948 1.00 0.00 H new ATOM 0 HD2 LYS A 125 65.777 15.341 -65.996 1.00 0.00 H new ATOM 0 HD3 LYS A 125 66.795 16.135 -64.811 1.00 0.00 H new ATOM 0 HE2 LYS A 125 67.873 16.770 -66.760 1.00 0.00 H new ATOM 0 HE3 LYS A 125 68.772 15.317 -66.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 67.812 15.664 -68.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 67.758 14.123 -68.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 66.366 15.095 -68.060 1.00 0.00 H new ATOM 1141 N GLN A 126 68.796 11.572 -64.286 1.00 0.00 N ATOM 1142 CA GLN A 126 70.186 11.132 -64.307 1.00 0.00 C ATOM 1143 C GLN A 126 70.288 9.636 -64.032 1.00 0.00 C ATOM 1144 O GLN A 126 71.148 8.949 -64.586 1.00 0.00 O ATOM 1145 CB GLN A 126 71.005 11.909 -63.275 1.00 0.00 C ATOM 1146 CG GLN A 126 70.348 11.982 -61.906 1.00 0.00 C ATOM 1147 CD GLN A 126 69.588 13.276 -61.692 1.00 0.00 C ATOM 1148 OE1 GLN A 126 69.890 14.297 -62.311 1.00 0.00 O ATOM 1149 NE2 GLN A 126 68.595 13.241 -60.811 1.00 0.00 N ATOM 0 H GLN A 126 68.612 12.357 -63.662 1.00 0.00 H new ATOM 0 HA GLN A 126 70.587 11.328 -65.301 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.984 11.441 -63.174 1.00 0.00 H new ATOM 0 HB3 GLN A 126 71.171 12.921 -63.643 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.665 11.140 -61.790 1.00 0.00 H new ATOM 0 HG3 GLN A 126 71.112 11.882 -61.135 1.00 0.00 H new ATOM 0 HE21 GLN A 126 68.379 12.373 -60.320 1.00 0.00 H new ATOM 0 HE22 GLN A 126 68.048 14.082 -60.625 1.00 0.00 H new ATOM 1158 N LEU A 127 69.406 9.136 -63.174 1.00 0.00 N ATOM 1159 CA LEU A 127 69.396 7.719 -62.824 1.00 0.00 C ATOM 1160 C LEU A 127 68.832 6.881 -63.966 1.00 0.00 C ATOM 1161 O LEU A 127 69.393 5.845 -64.325 1.00 0.00 O ATOM 1162 CB LEU A 127 68.574 7.493 -61.554 1.00 0.00 C ATOM 1163 CG LEU A 127 68.945 8.360 -60.350 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.234 7.868 -59.099 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.453 8.365 -60.142 1.00 0.00 C ATOM 0 H LEU A 127 68.688 9.690 -62.707 1.00 0.00 H new ATOM 0 HA LEU A 127 70.424 7.407 -62.643 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.524 7.665 -61.790 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.669 6.446 -61.265 1.00 0.00 H new ATOM 0 HG LEU A 127 68.622 9.382 -60.548 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.510 8.497 -58.253 1.00 0.00 H new ATOM 0 HD12 LEU A 127 67.156 7.916 -59.251 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.526 6.838 -58.896 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.700 8.987 -59.281 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.799 7.347 -59.965 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.942 8.765 -61.030 1.00 0.00 H new ATOM 1177 N ILE A 128 67.719 7.335 -64.533 1.00 0.00 N ATOM 1178 CA ILE A 128 67.081 6.628 -65.637 1.00 0.00 C ATOM 1179 C ILE A 128 68.055 6.417 -66.791 1.00 0.00 C ATOM 1180 O ILE A 128 68.127 5.331 -67.364 1.00 0.00 O ATOM 1181 CB ILE A 128 65.847 7.390 -66.154 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.877 7.674 -65.005 1.00 0.00 C ATOM 1183 CG2 ILE A 128 65.156 6.595 -67.252 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.376 6.425 -64.314 1.00 0.00 C ATOM 0 H ILE A 128 67.241 8.189 -64.246 1.00 0.00 H new ATOM 0 HA ILE A 128 66.764 5.659 -65.251 1.00 0.00 H new ATOM 0 HB ILE A 128 66.175 8.342 -66.572 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.372 8.311 -64.272 1.00 0.00 H new ATOM 0 HG13 ILE A 128 64.024 8.233 -65.390 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.286 7.146 -67.608 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.849 6.438 -68.079 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.838 5.630 -66.857 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.693 6.702 -63.511 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.853 5.796 -65.034 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.221 5.875 -63.899 1.00 0.00 H new ATOM 1196 N GLU A 129 68.804 7.464 -67.125 1.00 0.00 N ATOM 1197 CA GLU A 129 69.774 7.392 -68.211 1.00 0.00 C ATOM 1198 C GLU A 129 71.021 6.627 -67.776 1.00 0.00 C ATOM 1199 O GLU A 129 71.578 5.841 -68.542 1.00 0.00 O ATOM 1200 CB GLU A 129 70.161 8.799 -68.673 1.00 0.00 C ATOM 1201 CG GLU A 129 70.786 9.648 -67.579 1.00 0.00 C ATOM 1202 CD GLU A 129 70.887 11.112 -67.963 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.834 11.776 -68.054 1.00 0.00 O ATOM 1204 OE2 GLU A 129 72.021 11.592 -68.171 1.00 0.00 O ATOM 0 H GLU A 129 68.757 8.370 -66.660 1.00 0.00 H new ATOM 0 HA GLU A 129 69.312 6.859 -69.042 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.861 8.720 -69.504 1.00 0.00 H new ATOM 0 HB3 GLU A 129 69.273 9.305 -69.052 1.00 0.00 H new ATOM 0 HG2 GLU A 129 70.194 9.555 -66.669 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.781 9.266 -67.352 1.00 0.00 H new ATOM 1211 N ALA A 130 71.453 6.864 -66.542 1.00 0.00 N ATOM 1212 CA ALA A 130 72.633 6.196 -66.005 1.00 0.00 C ATOM 1213 C ALA A 130 72.501 4.681 -66.109 1.00 0.00 C ATOM 1214 O ALA A 130 73.428 3.996 -66.541 1.00 0.00 O ATOM 1215 CB ALA A 130 72.859 6.610 -64.558 1.00 0.00 C ATOM 0 H ALA A 130 71.004 7.513 -65.895 1.00 0.00 H new ATOM 0 HA ALA A 130 73.495 6.500 -66.598 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.743 6.104 -64.169 1.00 0.00 H new ATOM 0 HB2 ALA A 130 73.006 7.689 -64.507 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.990 6.334 -63.961 1.00 0.00 H new ATOM 1221 N TYR A 131 71.344 4.163 -65.711 1.00 0.00 N ATOM 1222 CA TYR A 131 71.093 2.728 -65.757 1.00 0.00 C ATOM 1223 C TYR A 131 71.188 2.204 -67.186 1.00 0.00 C ATOM 1224 O TYR A 131 71.709 1.114 -67.426 1.00 0.00 O ATOM 1225 CB TYR A 131 69.714 2.411 -65.177 1.00 0.00 C ATOM 1226 CG TYR A 131 69.336 0.951 -65.276 1.00 0.00 C ATOM 1227 CD1 TYR A 131 69.921 0.003 -64.445 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.394 0.518 -66.201 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.580 -1.332 -64.532 1.00 0.00 C ATOM 1230 CE2 TYR A 131 68.045 -0.816 -66.294 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.640 -1.737 -65.458 1.00 0.00 C ATOM 1232 OH TYR A 131 68.297 -3.066 -65.549 1.00 0.00 O ATOM 0 H TYR A 131 70.565 4.716 -65.353 1.00 0.00 H new ATOM 0 HA TYR A 131 71.855 2.233 -65.156 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.691 2.713 -64.130 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.965 3.008 -65.697 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.656 0.316 -63.718 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.927 1.236 -66.858 1.00 0.00 H new ATOM 0 HE1 TYR A 131 70.046 -2.055 -63.879 1.00 0.00 H new ATOM 0 HE2 TYR A 131 67.310 -1.135 -67.018 1.00 0.00 H new ATOM 0 HH TYR A 131 67.621 -3.182 -66.249 1.00 0.00 H new ATOM 1242 N TRP A 132 70.683 2.988 -68.132 1.00 0.00 N ATOM 1243 CA TRP A 132 70.711 2.604 -69.538 1.00 0.00 C ATOM 1244 C TRP A 132 72.130 2.663 -70.091 1.00 0.00 C ATOM 1245 O TRP A 132 72.502 1.873 -70.957 1.00 0.00 O ATOM 1246 CB TRP A 132 69.794 3.516 -70.355 1.00 0.00 C ATOM 1247 CG TRP A 132 68.342 3.168 -70.227 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.654 2.936 -69.070 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.400 3.011 -71.294 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.342 2.644 -69.354 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.160 2.684 -70.711 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.483 3.117 -72.685 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.016 2.462 -71.472 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.347 2.895 -73.439 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.126 2.572 -72.831 1.00 0.00 C ATOM 0 H TRP A 132 70.249 3.893 -67.951 1.00 0.00 H new ATOM 0 HA TRP A 132 70.354 1.577 -69.615 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.942 4.548 -70.036 1.00 0.00 H new ATOM 0 HB3 TRP A 132 70.082 3.462 -71.405 1.00 0.00 H new ATOM 0 HD1 TRP A 132 68.079 2.976 -68.078 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.620 2.432 -68.666 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.419 3.368 -73.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.074 2.212 -71.006 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 66.401 2.972 -74.515 1.00 0.00 H new ATOM 0 HH2 TRP A 132 64.255 2.407 -73.448 1.00 0.00 H new ATOM 1266 N ASN A 133 72.919 3.605 -69.584 1.00 0.00 N ATOM 1267 CA ASN A 133 74.299 3.767 -70.028 1.00 0.00 C ATOM 1268 C ASN A 133 75.123 2.523 -69.708 1.00 0.00 C ATOM 1269 O ASN A 133 76.009 2.141 -70.472 1.00 0.00 O ATOM 1270 CB ASN A 133 74.930 4.993 -69.365 1.00 0.00 C ATOM 1271 CG ASN A 133 76.434 5.041 -69.549 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.949 4.735 -70.625 1.00 0.00 O ATOM 1273 ND2 ASN A 133 77.147 5.425 -68.497 1.00 0.00 N ATOM 0 H ASN A 133 72.627 4.267 -68.866 1.00 0.00 H new ATOM 0 HA ASN A 133 74.292 3.909 -71.109 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.487 5.897 -69.783 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.697 4.987 -68.300 1.00 0.00 H new ATOM 0 HD21 ASN A 133 78.164 5.476 -68.561 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.678 5.669 -67.625 1.00 0.00 H new ATOM 1280 N GLU A 134 74.822 1.895 -68.575 1.00 0.00 N ATOM 1281 CA GLU A 134 75.535 0.694 -68.156 1.00 0.00 C ATOM 1282 C GLU A 134 75.364 -0.425 -69.178 1.00 0.00 C ATOM 1283 O GLU A 134 76.235 -1.282 -69.329 1.00 0.00 O ATOM 1284 CB GLU A 134 75.035 0.230 -66.786 1.00 0.00 C ATOM 1285 CG GLU A 134 76.136 0.110 -65.745 1.00 0.00 C ATOM 1286 CD GLU A 134 76.993 1.358 -65.656 1.00 0.00 C ATOM 1287 OE1 GLU A 134 76.589 2.307 -64.952 1.00 0.00 O ATOM 1288 OE2 GLU A 134 78.068 1.385 -66.290 1.00 0.00 O ATOM 0 H GLU A 134 74.090 2.198 -67.932 1.00 0.00 H new ATOM 0 HA GLU A 134 76.595 0.938 -68.085 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.282 0.931 -66.427 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.544 -0.737 -66.896 1.00 0.00 H new ATOM 0 HG2 GLU A 134 75.690 -0.090 -64.771 1.00 0.00 H new ATOM 0 HG3 GLU A 134 76.768 -0.744 -65.987 1.00 0.00 H new ATOM 1295 N HIS A 135 74.234 -0.412 -69.878 1.00 0.00 N ATOM 1296 CA HIS A 135 73.947 -1.426 -70.887 1.00 0.00 C ATOM 1297 C HIS A 135 74.744 -1.165 -72.161 1.00 0.00 C ATOM 1298 O HIS A 135 75.100 -2.094 -72.884 1.00 0.00 O ATOM 1299 CB HIS A 135 72.452 -1.452 -71.203 1.00 0.00 C ATOM 1300 CG HIS A 135 71.980 -2.761 -71.757 1.00 0.00 C ATOM 1301 ND1 HIS A 135 71.578 -2.924 -73.066 1.00 0.00 N ATOM 1302 CD2 HIS A 135 71.848 -3.974 -71.171 1.00 0.00 C ATOM 1303 CE1 HIS A 135 71.218 -4.180 -73.261 1.00 0.00 C ATOM 1304 NE2 HIS A 135 71.373 -4.839 -72.127 1.00 0.00 N ATOM 0 H HIS A 135 73.502 0.289 -69.765 1.00 0.00 H new ATOM 0 HA HIS A 135 74.243 -2.396 -70.487 1.00 0.00 H new ATOM 0 HB2 HIS A 135 71.893 -1.229 -70.294 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.226 -0.661 -71.919 1.00 0.00 H new ATOM 0 HD2 HIS A 135 72.074 -4.217 -70.143 1.00 0.00 H new ATOM 0 HE1 HIS A 135 70.858 -4.597 -74.190 1.00 0.00 H new ATOM 0 HE2 HIS A 135 71.173 -5.829 -71.984 1.00 0.00 H new ATOM 1312 N GLY A 136 75.021 0.108 -72.431 1.00 0.00 N ATOM 1313 CA GLY A 136 75.773 0.468 -73.619 1.00 0.00 C ATOM 1314 C GLY A 136 74.878 0.915 -74.758 1.00 0.00 C ATOM 1315 O GLY A 136 75.267 0.853 -75.923 1.00 0.00 O ATOM 0 H GLY A 136 74.738 0.896 -71.848 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.472 1.268 -73.374 1.00 0.00 H new ATOM 0 HA3 GLY A 136 76.367 -0.387 -73.942 1.00 0.00 H new