USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 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 106 SER OG : rot -44:sc= 1.01 USER MOD Set 1.2: A 115 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 116 ASN : amide:sc= -3.19! K(o=-2.2!,f=0.83) USER MOD Set 2.1: A 50 SER OG : rot -170:sc= 0.631 USER MOD Set 2.2: A 127 GLN : amide:sc= 0.705 K(o=1.3,f=0.026) USER MOD Set 3.1: A 36 LYS NZ :NH3+ -132:sc= -0.617 (180deg=0) USER MOD Set 3.2: A 72 TYR OH : rot 150:sc= -0.67 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 159:sc= -0.152 (180deg=-0.651) USER MOD Single : A 45 CYS SG : rot 84:sc= 0.605 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -59:sc= 1.31 USER MOD Single : A 59 ASN : amide:sc= -2! C(o=-2!,f=-3!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 65 THR OG1 : rot 81:sc= 0.732 USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 GLN : amide:sc= -0.921 K(o=-0.92,f=0) USER MOD Single : A 73 CYS SG : rot 79:sc= 0.383 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= -3.17! K(o=-3.2!,f=-1.7) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.267 K(o=-0.27,f=-3.9!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 167:sc= -0.0421 (180deg=-0.226) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.204 K(o=-0.2,f=-0.72) USER MOD Single : A 104 GLN : amide:sc= -1.29 K(o=-1.3,f=-0.53) USER MOD Single : A 107 SER OG : rot 180:sc=-0.00898 USER MOD Single : A 120 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 121 ASN : amide:sc= -0.272 K(o=-0.27,f=-3.6!) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 CYS SG : rot 83:sc= 0.595 USER MOD Single : A 130 SER OG : rot 180:sc=-0.00856 USER MOD Single : A 134 GLN : amide:sc= -0.0132 K(o=-0.013,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 528 N LYS A 36 -7.860 -11.413 -11.234 1.00 31.21 N ATOM 529 CA LYS A 36 -7.136 -10.457 -12.078 1.00 55.33 C ATOM 530 C LYS A 36 -5.927 -9.884 -11.320 1.00 63.24 C ATOM 531 O LYS A 36 -4.936 -9.465 -11.923 1.00 73.12 O ATOM 532 CB LYS A 36 -8.093 -9.328 -12.523 1.00 5.14 C ATOM 533 CG LYS A 36 -7.490 -8.299 -13.493 1.00 2.34 C ATOM 534 CD LYS A 36 -6.778 -7.147 -12.772 1.00 73.32 C ATOM 535 CE LYS A 36 -6.141 -6.168 -13.759 1.00 21.01 C ATOM 536 NZ LYS A 36 -5.446 -5.039 -13.077 1.00 10.43 N ATOM 0 HA LYS A 36 -6.765 -10.970 -12.965 1.00 55.33 H new ATOM 0 HB2 LYS A 36 -8.966 -9.779 -12.995 1.00 5.14 H new ATOM 0 HB3 LYS A 36 -8.446 -8.803 -11.636 1.00 5.14 H new ATOM 0 HG2 LYS A 36 -6.783 -8.800 -14.153 1.00 2.34 H new ATOM 0 HG3 LYS A 36 -8.282 -7.893 -14.123 1.00 2.34 H new ATOM 0 HD2 LYS A 36 -7.492 -6.616 -12.142 1.00 73.32 H new ATOM 0 HD3 LYS A 36 -6.009 -7.550 -12.113 1.00 73.32 H new ATOM 0 HE2 LYS A 36 -5.428 -6.703 -14.387 1.00 21.01 H new ATOM 0 HE3 LYS A 36 -6.912 -5.770 -14.419 1.00 21.01 H new ATOM 0 HZ1 LYS A 36 -5.732 -4.140 -13.515 1.00 10.43 H new ATOM 0 HZ2 LYS A 36 -5.703 -5.031 -12.069 1.00 10.43 H new ATOM 0 HZ3 LYS A 36 -4.417 -5.158 -13.170 1.00 10.43 H new ATOM 550 N ILE A 37 -6.016 -9.867 -9.994 1.00 65.54 N ATOM 551 CA ILE A 37 -4.923 -9.369 -9.158 1.00 24.43 C ATOM 552 C ILE A 37 -3.736 -10.350 -9.154 1.00 35.25 C ATOM 553 O ILE A 37 -3.744 -11.358 -8.447 1.00 74.01 O ATOM 554 CB ILE A 37 -5.385 -9.125 -7.698 1.00 3.41 C ATOM 555 CG1 ILE A 37 -6.663 -8.265 -7.659 1.00 65.11 C ATOM 556 CG2 ILE A 37 -4.270 -8.469 -6.883 1.00 44.43 C ATOM 557 CD1 ILE A 37 -6.549 -6.942 -8.387 1.00 13.53 C ATOM 0 H ILE A 37 -6.831 -10.191 -9.473 1.00 65.54 H new ATOM 0 HA ILE A 37 -4.606 -8.420 -9.590 1.00 24.43 H new ATOM 0 HB ILE A 37 -5.616 -10.092 -7.251 1.00 3.41 H new ATOM 0 HG12 ILE A 37 -7.484 -8.836 -8.094 1.00 65.11 H new ATOM 0 HG13 ILE A 37 -6.925 -8.072 -6.619 1.00 65.11 H new ATOM 0 HG21 ILE A 37 -4.614 -8.306 -5.862 1.00 44.43 H new ATOM 0 HG22 ILE A 37 -3.396 -9.120 -6.872 1.00 44.43 H new ATOM 0 HG23 ILE A 37 -4.005 -7.513 -7.333 1.00 44.43 H new ATOM 0 HD11 ILE A 37 -7.492 -6.402 -8.309 1.00 13.53 H new ATOM 0 HD12 ILE A 37 -5.752 -6.348 -7.939 1.00 13.53 H new ATOM 0 HD13 ILE A 37 -6.320 -7.123 -9.437 1.00 13.53 H new ATOM 569 N SER A 38 -2.727 -10.057 -9.970 1.00 43.24 N ATOM 570 CA SER A 38 -1.525 -10.900 -10.049 1.00 14.10 C ATOM 571 C SER A 38 -0.362 -10.298 -9.255 1.00 12.02 C ATOM 572 O SER A 38 -0.359 -9.105 -8.941 1.00 40.23 O ATOM 573 CB SER A 38 -1.100 -11.102 -11.512 1.00 75.23 C ATOM 574 OG SER A 38 -2.132 -11.715 -12.269 1.00 62.53 O ATOM 0 H SER A 38 -2.712 -9.245 -10.587 1.00 43.24 H new ATOM 0 HA SER A 38 -1.777 -11.865 -9.610 1.00 14.10 H new ATOM 0 HB2 SER A 38 -0.844 -10.139 -11.955 1.00 75.23 H new ATOM 0 HB3 SER A 38 -0.202 -11.719 -11.550 1.00 75.23 H new ATOM 0 HG SER A 38 -1.834 -11.829 -13.196 1.00 62.53 H new ATOM 580 N LYS A 39 0.633 -11.130 -8.955 1.00 51.31 N ATOM 581 CA LYS A 39 1.821 -10.712 -8.201 1.00 72.10 C ATOM 582 C LYS A 39 2.490 -9.490 -8.858 1.00 20.31 C ATOM 583 O LYS A 39 2.713 -8.465 -8.211 1.00 73.43 O ATOM 584 CB LYS A 39 2.786 -11.910 -8.116 1.00 41.34 C ATOM 585 CG LYS A 39 3.968 -11.755 -7.157 1.00 63.52 C ATOM 586 CD LYS A 39 5.159 -11.045 -7.796 1.00 54.20 C ATOM 587 CE LYS A 39 6.413 -11.178 -6.937 1.00 1.12 C ATOM 588 NZ LYS A 39 6.809 -12.602 -6.753 1.00 32.21 N ATOM 0 H LYS A 39 0.642 -12.113 -9.226 1.00 51.31 H new ATOM 0 HA LYS A 39 1.535 -10.406 -7.195 1.00 72.10 H new ATOM 0 HB2 LYS A 39 2.215 -12.790 -7.818 1.00 41.34 H new ATOM 0 HB3 LYS A 39 3.177 -12.107 -9.114 1.00 41.34 H new ATOM 0 HG2 LYS A 39 3.646 -11.196 -6.278 1.00 63.52 H new ATOM 0 HG3 LYS A 39 4.281 -12.740 -6.811 1.00 63.52 H new ATOM 0 HD2 LYS A 39 5.347 -11.464 -8.784 1.00 54.20 H new ATOM 0 HD3 LYS A 39 4.923 -9.990 -7.937 1.00 54.20 H new ATOM 0 HE2 LYS A 39 7.232 -10.630 -7.403 1.00 1.12 H new ATOM 0 HE3 LYS A 39 6.237 -10.721 -5.963 1.00 1.12 H new ATOM 0 HZ1 LYS A 39 7.814 -12.652 -6.489 1.00 32.21 H new ATOM 0 HZ2 LYS A 39 6.232 -13.028 -6.000 1.00 32.21 H new ATOM 0 HZ3 LYS A 39 6.658 -13.122 -7.641 1.00 32.21 H new ATOM 602 N GLU A 40 2.785 -9.602 -10.151 1.00 23.32 N ATOM 603 CA GLU A 40 3.378 -8.494 -10.918 1.00 52.44 C ATOM 604 C GLU A 40 2.422 -7.287 -11.026 1.00 14.42 C ATOM 605 O GLU A 40 2.860 -6.133 -11.045 1.00 23.34 O ATOM 606 CB GLU A 40 3.768 -8.981 -12.321 1.00 45.44 C ATOM 607 CG GLU A 40 2.613 -9.611 -13.099 1.00 40.03 C ATOM 608 CD GLU A 40 3.024 -10.088 -14.484 1.00 31.43 C ATOM 609 OE1 GLU A 40 3.564 -11.209 -14.603 1.00 15.13 O ATOM 610 OE2 GLU A 40 2.808 -9.347 -15.464 1.00 31.44 O ATOM 0 H GLU A 40 2.625 -10.449 -10.697 1.00 23.32 H new ATOM 0 HA GLU A 40 4.267 -8.161 -10.382 1.00 52.44 H new ATOM 0 HB2 GLU A 40 4.161 -8.139 -12.891 1.00 45.44 H new ATOM 0 HB3 GLU A 40 4.574 -9.710 -12.231 1.00 45.44 H new ATOM 0 HG2 GLU A 40 2.217 -10.454 -12.533 1.00 40.03 H new ATOM 0 HG3 GLU A 40 1.807 -8.884 -13.195 1.00 40.03 H new ATOM 617 N ALA A 41 1.120 -7.562 -11.092 1.00 52.31 N ATOM 618 CA ALA A 41 0.103 -6.506 -11.222 1.00 3.22 C ATOM 619 C ALA A 41 -0.009 -5.658 -9.946 1.00 54.43 C ATOM 620 O ALA A 41 -0.310 -4.465 -10.001 1.00 53.44 O ATOM 621 CB ALA A 41 -1.248 -7.122 -11.569 1.00 41.43 C ATOM 0 H ALA A 41 0.739 -8.507 -11.058 1.00 52.31 H new ATOM 0 HA ALA A 41 0.415 -5.842 -12.028 1.00 3.22 H new ATOM 0 HB1 ALA A 41 -1.994 -6.333 -11.663 1.00 41.43 H new ATOM 0 HB2 ALA A 41 -1.170 -7.662 -12.513 1.00 41.43 H new ATOM 0 HB3 ALA A 41 -1.547 -7.812 -10.780 1.00 41.43 H new ATOM 627 N LEU A 42 0.224 -6.284 -8.797 1.00 33.15 N ATOM 628 CA LEU A 42 0.220 -5.573 -7.516 1.00 41.31 C ATOM 629 C LEU A 42 1.474 -4.687 -7.396 1.00 63.20 C ATOM 630 O LEU A 42 1.395 -3.530 -6.971 1.00 41.25 O ATOM 631 CB LEU A 42 0.138 -6.592 -6.356 1.00 53.21 C ATOM 632 CG LEU A 42 -0.100 -6.012 -4.940 1.00 42.14 C ATOM 633 CD1 LEU A 42 -0.689 -7.079 -4.015 1.00 63.41 C ATOM 634 CD2 LEU A 42 1.195 -5.458 -4.341 1.00 31.34 C ATOM 0 H LEU A 42 0.418 -7.283 -8.723 1.00 33.15 H new ATOM 0 HA LEU A 42 -0.653 -4.923 -7.463 1.00 41.31 H new ATOM 0 HB2 LEU A 42 -0.666 -7.295 -6.576 1.00 53.21 H new ATOM 0 HB3 LEU A 42 1.066 -7.164 -6.339 1.00 53.21 H new ATOM 0 HG LEU A 42 -0.811 -5.191 -5.034 1.00 42.14 H new ATOM 0 HD11 LEU A 42 -0.850 -6.653 -3.024 1.00 63.41 H new ATOM 0 HD12 LEU A 42 -1.640 -7.426 -4.419 1.00 63.41 H new ATOM 0 HD13 LEU A 42 0.002 -7.919 -3.941 1.00 63.41 H new ATOM 0 HD21 LEU A 42 0.994 -5.058 -3.347 1.00 31.34 H new ATOM 0 HD22 LEU A 42 1.933 -6.257 -4.269 1.00 31.34 H new ATOM 0 HD23 LEU A 42 1.581 -4.664 -4.980 1.00 31.34 H new ATOM 646 N LEU A 43 2.624 -5.237 -7.795 1.00 21.53 N ATOM 647 CA LEU A 43 3.907 -4.522 -7.714 1.00 53.12 C ATOM 648 C LEU A 43 3.890 -3.198 -8.498 1.00 63.23 C ATOM 649 O LEU A 43 4.243 -2.154 -7.957 1.00 64.45 O ATOM 650 CB LEU A 43 5.046 -5.414 -8.230 1.00 3.52 C ATOM 651 CG LEU A 43 5.269 -6.724 -7.457 1.00 0.05 C ATOM 652 CD1 LEU A 43 6.440 -7.500 -8.050 1.00 54.24 C ATOM 653 CD2 LEU A 43 5.497 -6.448 -5.973 1.00 30.23 C ATOM 0 H LEU A 43 2.696 -6.179 -8.179 1.00 21.53 H new ATOM 0 HA LEU A 43 4.072 -4.281 -6.664 1.00 53.12 H new ATOM 0 HB2 LEU A 43 4.847 -5.659 -9.273 1.00 3.52 H new ATOM 0 HB3 LEU A 43 5.972 -4.839 -8.208 1.00 3.52 H new ATOM 0 HG LEU A 43 4.370 -7.334 -7.551 1.00 0.05 H new ATOM 0 HD11 LEU A 43 6.584 -8.425 -7.491 1.00 54.24 H new ATOM 0 HD12 LEU A 43 6.229 -7.736 -9.093 1.00 54.24 H new ATOM 0 HD13 LEU A 43 7.345 -6.895 -7.990 1.00 54.24 H new ATOM 0 HD21 LEU A 43 5.652 -7.390 -5.447 1.00 30.23 H new ATOM 0 HD22 LEU A 43 6.376 -5.815 -5.851 1.00 30.23 H new ATOM 0 HD23 LEU A 43 4.625 -5.941 -5.559 1.00 30.23 H new ATOM 665 N GLU A 44 3.466 -3.241 -9.765 1.00 25.33 N ATOM 666 CA GLU A 44 3.463 -2.035 -10.615 1.00 1.35 C ATOM 667 C GLU A 44 2.681 -0.879 -9.964 1.00 33.43 C ATOM 668 O GLU A 44 3.129 0.269 -9.971 1.00 42.44 O ATOM 669 CB GLU A 44 2.883 -2.340 -12.006 1.00 1.35 C ATOM 670 CG GLU A 44 1.445 -2.851 -11.987 1.00 64.43 C ATOM 671 CD GLU A 44 0.830 -2.951 -13.377 1.00 3.10 C ATOM 672 OE1 GLU A 44 1.145 -3.912 -14.109 1.00 65.12 O ATOM 673 OE2 GLU A 44 0.027 -2.070 -13.748 1.00 22.12 O ATOM 0 H GLU A 44 3.123 -4.084 -10.225 1.00 25.33 H new ATOM 0 HA GLU A 44 4.502 -1.723 -10.726 1.00 1.35 H new ATOM 0 HB2 GLU A 44 2.927 -1.435 -12.612 1.00 1.35 H new ATOM 0 HB3 GLU A 44 3.514 -3.082 -12.495 1.00 1.35 H new ATOM 0 HG2 GLU A 44 1.420 -3.832 -11.513 1.00 64.43 H new ATOM 0 HG3 GLU A 44 0.837 -2.186 -11.374 1.00 64.43 H new ATOM 680 N CYS A 45 1.524 -1.196 -9.381 1.00 23.30 N ATOM 681 CA CYS A 45 0.687 -0.189 -8.714 1.00 34.41 C ATOM 682 C CYS A 45 1.404 0.409 -7.495 1.00 52.11 C ATOM 683 O CYS A 45 1.374 1.618 -7.270 1.00 2.12 O ATOM 684 CB CYS A 45 -0.648 -0.811 -8.281 1.00 34.32 C ATOM 685 SG CYS A 45 -1.623 -1.503 -9.642 1.00 61.41 S ATOM 0 H CYS A 45 1.142 -2.142 -9.355 1.00 23.30 H new ATOM 0 HA CYS A 45 0.496 0.614 -9.426 1.00 34.41 H new ATOM 0 HB2 CYS A 45 -0.450 -1.599 -7.554 1.00 34.32 H new ATOM 0 HB3 CYS A 45 -1.242 -0.051 -7.773 1.00 34.32 H new ATOM 0 HG CYS A 45 -1.206 -2.705 -9.907 1.00 61.41 H new ATOM 691 N ALA A 46 2.058 -0.451 -6.718 1.00 14.42 N ATOM 692 CA ALA A 46 2.780 -0.020 -5.517 1.00 32.50 C ATOM 693 C ALA A 46 4.003 0.847 -5.867 1.00 5.04 C ATOM 694 O ALA A 46 4.230 1.896 -5.255 1.00 10.55 O ATOM 695 CB ALA A 46 3.193 -1.240 -4.699 1.00 53.41 C ATOM 0 H ALA A 46 2.105 -1.454 -6.897 1.00 14.42 H new ATOM 0 HA ALA A 46 2.111 0.600 -4.920 1.00 32.50 H new ATOM 0 HB1 ALA A 46 3.729 -0.916 -3.807 1.00 53.41 H new ATOM 0 HB2 ALA A 46 2.304 -1.799 -4.405 1.00 53.41 H new ATOM 0 HB3 ALA A 46 3.841 -1.879 -5.300 1.00 53.41 H new ATOM 701 N ASP A 47 4.784 0.409 -6.858 1.00 44.12 N ATOM 702 CA ASP A 47 5.947 1.170 -7.336 1.00 10.03 C ATOM 703 C ASP A 47 5.563 2.598 -7.767 1.00 4.53 C ATOM 704 O ASP A 47 6.352 3.533 -7.612 1.00 43.00 O ATOM 705 CB ASP A 47 6.626 0.431 -8.499 1.00 25.33 C ATOM 706 CG ASP A 47 7.442 -0.769 -8.038 1.00 51.12 C ATOM 707 OD1 ASP A 47 7.007 -1.481 -7.111 1.00 44.20 O ATOM 708 OD2 ASP A 47 8.536 -0.998 -8.597 1.00 13.42 O ATOM 0 H ASP A 47 4.633 -0.473 -7.348 1.00 44.12 H new ATOM 0 HA ASP A 47 6.647 1.254 -6.504 1.00 10.03 H new ATOM 0 HB2 ASP A 47 5.866 0.098 -9.205 1.00 25.33 H new ATOM 0 HB3 ASP A 47 7.276 1.123 -9.033 1.00 25.33 H new ATOM 713 N LEU A 48 4.354 2.765 -8.308 1.00 25.12 N ATOM 714 CA LEU A 48 3.845 4.099 -8.661 1.00 74.42 C ATOM 715 C LEU A 48 3.835 5.029 -7.439 1.00 4.23 C ATOM 716 O LEU A 48 4.331 6.154 -7.502 1.00 22.50 O ATOM 717 CB LEU A 48 2.435 4.002 -9.263 1.00 31.25 C ATOM 718 CG LEU A 48 2.364 3.385 -10.669 1.00 2.31 C ATOM 719 CD1 LEU A 48 0.916 3.295 -11.145 1.00 41.22 C ATOM 720 CD2 LEU A 48 3.216 4.194 -11.652 1.00 23.14 C ATOM 0 H LEU A 48 3.710 2.000 -8.512 1.00 25.12 H new ATOM 0 HA LEU A 48 4.516 4.522 -9.408 1.00 74.42 H new ATOM 0 HB2 LEU A 48 1.811 3.411 -8.593 1.00 31.25 H new ATOM 0 HB3 LEU A 48 2.004 5.002 -9.301 1.00 31.25 H new ATOM 0 HG LEU A 48 2.766 2.373 -10.624 1.00 2.31 H new ATOM 0 HD11 LEU A 48 0.887 2.856 -12.142 1.00 41.22 H new ATOM 0 HD12 LEU A 48 0.345 2.671 -10.457 1.00 41.22 H new ATOM 0 HD13 LEU A 48 0.480 4.294 -11.176 1.00 41.22 H new ATOM 0 HD21 LEU A 48 3.155 3.744 -12.643 1.00 23.14 H new ATOM 0 HD22 LEU A 48 2.847 5.219 -11.696 1.00 23.14 H new ATOM 0 HD23 LEU A 48 4.254 4.196 -11.318 1.00 23.14 H new ATOM 732 N LEU A 49 3.284 4.548 -6.324 1.00 4.33 N ATOM 733 CA LEU A 49 3.285 5.313 -5.069 1.00 23.42 C ATOM 734 C LEU A 49 4.721 5.574 -4.593 1.00 61.42 C ATOM 735 O LEU A 49 5.090 6.708 -4.294 1.00 11.11 O ATOM 736 CB LEU A 49 2.505 4.573 -3.967 1.00 22.33 C ATOM 737 CG LEU A 49 0.972 4.599 -4.088 1.00 51.34 C ATOM 738 CD1 LEU A 49 0.499 3.905 -5.362 1.00 72.00 C ATOM 739 CD2 LEU A 49 0.333 3.958 -2.859 1.00 61.11 C ATOM 0 H LEU A 49 2.832 3.636 -6.260 1.00 4.33 H new ATOM 0 HA LEU A 49 2.794 6.266 -5.266 1.00 23.42 H new ATOM 0 HB2 LEU A 49 2.830 3.533 -3.956 1.00 22.33 H new ATOM 0 HB3 LEU A 49 2.780 5.003 -3.004 1.00 22.33 H new ATOM 0 HG LEU A 49 0.659 5.641 -4.145 1.00 51.34 H new ATOM 0 HD11 LEU A 49 -0.589 3.943 -5.414 1.00 72.00 H new ATOM 0 HD12 LEU A 49 0.922 4.411 -6.230 1.00 72.00 H new ATOM 0 HD13 LEU A 49 0.826 2.865 -5.353 1.00 72.00 H new ATOM 0 HD21 LEU A 49 -0.752 3.983 -2.958 1.00 61.11 H new ATOM 0 HD22 LEU A 49 0.666 2.923 -2.774 1.00 61.11 H new ATOM 0 HD23 LEU A 49 0.629 4.509 -1.966 1.00 61.11 H new ATOM 751 N SER A 50 5.523 4.512 -4.540 1.00 73.32 N ATOM 752 CA SER A 50 6.924 4.606 -4.096 1.00 63.55 C ATOM 753 C SER A 50 7.710 5.661 -4.891 1.00 12.41 C ATOM 754 O SER A 50 8.482 6.432 -4.323 1.00 63.55 O ATOM 755 CB SER A 50 7.613 3.239 -4.223 1.00 62.44 C ATOM 756 OG SER A 50 8.977 3.306 -3.832 1.00 14.44 O ATOM 0 H SER A 50 5.230 3.570 -4.799 1.00 73.32 H new ATOM 0 HA SER A 50 6.914 4.916 -3.051 1.00 63.55 H new ATOM 0 HB2 SER A 50 7.091 2.509 -3.605 1.00 62.44 H new ATOM 0 HB3 SER A 50 7.545 2.890 -5.254 1.00 62.44 H new ATOM 0 HG SER A 50 9.427 2.469 -4.071 1.00 14.44 H new ATOM 762 N SER A 51 7.500 5.700 -6.205 1.00 61.00 N ATOM 763 CA SER A 51 8.190 6.667 -7.071 1.00 52.12 C ATOM 764 C SER A 51 7.592 8.073 -6.947 1.00 23.32 C ATOM 765 O SER A 51 8.319 9.058 -6.872 1.00 32.14 O ATOM 766 CB SER A 51 8.137 6.216 -8.535 1.00 15.43 C ATOM 767 OG SER A 51 8.780 7.154 -9.388 1.00 3.52 O ATOM 0 H SER A 51 6.860 5.077 -6.697 1.00 61.00 H new ATOM 0 HA SER A 51 9.228 6.707 -6.740 1.00 52.12 H new ATOM 0 HB2 SER A 51 8.616 5.242 -8.635 1.00 15.43 H new ATOM 0 HB3 SER A 51 7.099 6.094 -8.843 1.00 15.43 H new ATOM 0 HG SER A 51 8.732 6.840 -10.315 1.00 3.52 H new ATOM 773 N ALA A 52 6.264 8.162 -6.920 1.00 63.12 N ATOM 774 CA ALA A 52 5.572 9.456 -6.850 1.00 50.32 C ATOM 775 C ALA A 52 5.914 10.228 -5.563 1.00 13.11 C ATOM 776 O ALA A 52 6.064 11.447 -5.582 1.00 20.51 O ATOM 777 CB ALA A 52 4.062 9.256 -6.965 1.00 64.12 C ATOM 0 H ALA A 52 5.641 7.355 -6.945 1.00 63.12 H new ATOM 0 HA ALA A 52 5.920 10.057 -7.690 1.00 50.32 H new ATOM 0 HB1 ALA A 52 3.562 10.223 -6.912 1.00 64.12 H new ATOM 0 HB2 ALA A 52 3.830 8.779 -7.917 1.00 64.12 H new ATOM 0 HB3 ALA A 52 3.716 8.623 -6.148 1.00 64.12 H new ATOM 783 N LEU A 53 6.063 9.506 -4.454 1.00 2.14 N ATOM 784 CA LEU A 53 6.347 10.127 -3.148 1.00 11.35 C ATOM 785 C LEU A 53 7.753 10.758 -3.072 1.00 52.12 C ATOM 786 O LEU A 53 8.083 11.424 -2.092 1.00 63.21 O ATOM 787 CB LEU A 53 6.181 9.087 -2.028 1.00 75.23 C ATOM 788 CG LEU A 53 4.740 8.596 -1.795 1.00 4.44 C ATOM 789 CD1 LEU A 53 4.711 7.457 -0.779 1.00 0.24 C ATOM 790 CD2 LEU A 53 3.852 9.749 -1.334 1.00 71.32 C ATOM 0 H LEU A 53 5.993 8.489 -4.427 1.00 2.14 H new ATOM 0 HA LEU A 53 5.629 10.937 -3.021 1.00 11.35 H new ATOM 0 HB2 LEU A 53 6.808 8.226 -2.258 1.00 75.23 H new ATOM 0 HB3 LEU A 53 6.556 9.515 -1.098 1.00 75.23 H new ATOM 0 HG LEU A 53 4.352 8.216 -2.740 1.00 4.44 H new ATOM 0 HD11 LEU A 53 3.683 7.127 -0.631 1.00 0.24 H new ATOM 0 HD12 LEU A 53 5.309 6.624 -1.149 1.00 0.24 H new ATOM 0 HD13 LEU A 53 5.120 7.805 0.169 1.00 0.24 H new ATOM 0 HD21 LEU A 53 2.837 9.385 -1.174 1.00 71.32 H new ATOM 0 HD22 LEU A 53 4.242 10.158 -0.402 1.00 71.32 H new ATOM 0 HD23 LEU A 53 3.842 10.528 -2.096 1.00 71.32 H new ATOM 802 N THR A 54 8.579 10.551 -4.099 1.00 50.23 N ATOM 803 CA THR A 54 9.935 11.133 -4.128 1.00 62.10 C ATOM 804 C THR A 54 9.925 12.565 -4.685 1.00 71.11 C ATOM 805 O THR A 54 10.896 13.313 -4.530 1.00 42.42 O ATOM 806 CB THR A 54 10.916 10.283 -4.973 1.00 43.00 C ATOM 807 OG1 THR A 54 10.565 10.351 -6.363 1.00 52.40 O ATOM 808 CG2 THR A 54 10.915 8.827 -4.514 1.00 11.32 C ATOM 0 H THR A 54 8.342 9.991 -4.918 1.00 50.23 H new ATOM 0 HA THR A 54 10.275 11.146 -3.093 1.00 62.10 H new ATOM 0 HB THR A 54 11.917 10.690 -4.834 1.00 43.00 H new ATOM 0 HG1 THR A 54 9.652 10.017 -6.486 1.00 52.40 H new ATOM 0 HG21 THR A 54 11.612 8.253 -5.124 1.00 11.32 H new ATOM 0 HG22 THR A 54 11.219 8.775 -3.469 1.00 11.32 H new ATOM 0 HG23 THR A 54 9.913 8.412 -4.621 1.00 11.32 H new ATOM 816 N GLU A 55 8.823 12.940 -5.332 1.00 11.33 N ATOM 817 CA GLU A 55 8.669 14.279 -5.917 1.00 24.03 C ATOM 818 C GLU A 55 7.365 14.942 -5.433 1.00 54.10 C ATOM 819 O GLU A 55 6.478 14.264 -4.917 1.00 51.11 O ATOM 820 CB GLU A 55 8.691 14.186 -7.453 1.00 74.10 C ATOM 821 CG GLU A 55 7.585 13.319 -8.047 1.00 62.53 C ATOM 822 CD GLU A 55 7.636 13.270 -9.567 1.00 70.44 C ATOM 823 OE1 GLU A 55 8.442 12.488 -10.116 1.00 64.22 O ATOM 824 OE2 GLU A 55 6.879 14.018 -10.222 1.00 31.42 O ATOM 0 H GLU A 55 8.015 12.332 -5.467 1.00 11.33 H new ATOM 0 HA GLU A 55 9.503 14.900 -5.589 1.00 24.03 H new ATOM 0 HB2 GLU A 55 8.610 15.191 -7.867 1.00 74.10 H new ATOM 0 HB3 GLU A 55 9.656 13.788 -7.767 1.00 74.10 H new ATOM 0 HG2 GLU A 55 7.669 12.307 -7.651 1.00 62.53 H new ATOM 0 HG3 GLU A 55 6.616 13.705 -7.731 1.00 62.53 H new ATOM 831 N PRO A 56 7.230 16.280 -5.568 1.00 22.45 N ATOM 832 CA PRO A 56 6.008 16.984 -5.137 1.00 63.42 C ATOM 833 C PRO A 56 4.766 16.573 -5.950 1.00 1.20 C ATOM 834 O PRO A 56 4.735 16.702 -7.176 1.00 74.42 O ATOM 835 CB PRO A 56 6.350 18.465 -5.377 1.00 60.31 C ATOM 836 CG PRO A 56 7.432 18.445 -6.403 1.00 2.01 C ATOM 837 CD PRO A 56 8.234 17.204 -6.129 1.00 63.31 C ATOM 0 HA PRO A 56 5.749 16.753 -4.104 1.00 63.42 H new ATOM 0 HB2 PRO A 56 5.480 19.020 -5.730 1.00 60.31 H new ATOM 0 HB3 PRO A 56 6.685 18.948 -4.459 1.00 60.31 H new ATOM 0 HG2 PRO A 56 7.015 18.427 -7.410 1.00 2.01 H new ATOM 0 HG3 PRO A 56 8.055 19.337 -6.332 1.00 2.01 H new ATOM 0 HD2 PRO A 56 8.686 16.806 -7.038 1.00 63.31 H new ATOM 0 HD3 PRO A 56 9.045 17.394 -5.426 1.00 63.31 H new ATOM 845 N VAL A 57 3.740 16.096 -5.250 1.00 44.22 N ATOM 846 CA VAL A 57 2.490 15.653 -5.879 1.00 45.04 C ATOM 847 C VAL A 57 1.268 16.049 -5.024 1.00 0.10 C ATOM 848 O VAL A 57 1.373 16.174 -3.800 1.00 13.03 O ATOM 849 CB VAL A 57 2.486 14.117 -6.110 1.00 14.34 C ATOM 850 CG1 VAL A 57 3.423 13.730 -7.257 1.00 42.12 C ATOM 851 CG2 VAL A 57 2.872 13.380 -4.827 1.00 1.43 C ATOM 0 H VAL A 57 3.747 16.004 -4.234 1.00 44.22 H new ATOM 0 HA VAL A 57 2.424 16.152 -6.846 1.00 45.04 H new ATOM 0 HB VAL A 57 1.475 13.821 -6.388 1.00 14.34 H new ATOM 0 HG11 VAL A 57 3.400 12.649 -7.396 1.00 42.12 H new ATOM 0 HG12 VAL A 57 3.098 14.221 -8.174 1.00 42.12 H new ATOM 0 HG13 VAL A 57 4.439 14.044 -7.018 1.00 42.12 H new ATOM 0 HG21 VAL A 57 2.864 12.305 -5.008 1.00 1.43 H new ATOM 0 HG22 VAL A 57 3.871 13.688 -4.517 1.00 1.43 H new ATOM 0 HG23 VAL A 57 2.157 13.621 -4.040 1.00 1.43 H new ATOM 861 N PRO A 58 0.094 16.262 -5.654 1.00 23.11 N ATOM 862 CA PRO A 58 -1.137 16.638 -4.934 1.00 72.32 C ATOM 863 C PRO A 58 -1.732 15.491 -4.087 1.00 31.14 C ATOM 864 O PRO A 58 -1.584 14.308 -4.412 1.00 21.21 O ATOM 865 CB PRO A 58 -2.093 17.044 -6.064 1.00 33.43 C ATOM 866 CG PRO A 58 -1.618 16.286 -7.256 1.00 10.05 C ATOM 867 CD PRO A 58 -0.123 16.168 -7.112 1.00 13.31 C ATOM 0 HA PRO A 58 -0.950 17.427 -4.206 1.00 72.32 H new ATOM 0 HB2 PRO A 58 -3.125 16.791 -5.819 1.00 33.43 H new ATOM 0 HB3 PRO A 58 -2.062 18.119 -6.241 1.00 33.43 H new ATOM 0 HG2 PRO A 58 -2.083 15.301 -7.302 1.00 10.05 H new ATOM 0 HG3 PRO A 58 -1.880 16.806 -8.178 1.00 10.05 H new ATOM 0 HD2 PRO A 58 0.245 15.223 -7.512 1.00 13.31 H new ATOM 0 HD3 PRO A 58 0.395 16.964 -7.647 1.00 13.31 H new ATOM 875 N ASN A 59 -2.431 15.862 -3.012 1.00 52.30 N ATOM 876 CA ASN A 59 -2.996 14.895 -2.060 1.00 2.41 C ATOM 877 C ASN A 59 -4.010 13.944 -2.726 1.00 32.31 C ATOM 878 O ASN A 59 -3.899 12.723 -2.603 1.00 32.43 O ATOM 879 CB ASN A 59 -3.661 15.647 -0.897 1.00 71.12 C ATOM 880 CG ASN A 59 -4.239 14.719 0.161 1.00 52.33 C ATOM 881 OD1 ASN A 59 -5.396 14.324 0.097 1.00 33.54 O ATOM 882 ND2 ASN A 59 -3.438 14.366 1.145 1.00 62.21 N ATOM 0 H ASN A 59 -2.622 16.835 -2.775 1.00 52.30 H new ATOM 0 HA ASN A 59 -2.177 14.280 -1.686 1.00 2.41 H new ATOM 0 HB2 ASN A 59 -2.928 16.306 -0.432 1.00 71.12 H new ATOM 0 HB3 ASN A 59 -4.456 16.281 -1.289 1.00 71.12 H new ATOM 0 HD21 ASN A 59 -3.777 13.747 1.881 1.00 62.21 H new ATOM 0 HD22 ASN A 59 -2.479 14.712 1.171 1.00 62.21 H new ATOM 889 N SER A 60 -4.994 14.512 -3.429 1.00 42.15 N ATOM 890 CA SER A 60 -6.048 13.716 -4.089 1.00 30.21 C ATOM 891 C SER A 60 -5.456 12.644 -5.016 1.00 4.52 C ATOM 892 O SER A 60 -5.947 11.515 -5.062 1.00 32.23 O ATOM 893 CB SER A 60 -6.997 14.621 -4.891 1.00 32.14 C ATOM 894 OG SER A 60 -8.042 13.871 -5.500 1.00 33.22 O ATOM 0 H SER A 60 -5.088 15.519 -3.559 1.00 42.15 H new ATOM 0 HA SER A 60 -6.609 13.216 -3.300 1.00 30.21 H new ATOM 0 HB2 SER A 60 -7.426 15.376 -4.232 1.00 32.14 H new ATOM 0 HB3 SER A 60 -6.434 15.152 -5.659 1.00 32.14 H new ATOM 0 HG SER A 60 -8.629 14.475 -6.001 1.00 33.22 H new ATOM 900 N GLN A 61 -4.402 13.008 -5.746 1.00 24.13 N ATOM 901 CA GLN A 61 -3.719 12.077 -6.656 1.00 1.24 C ATOM 902 C GLN A 61 -3.116 10.884 -5.889 1.00 22.42 C ATOM 903 O GLN A 61 -3.275 9.726 -6.291 1.00 4.33 O ATOM 904 CB GLN A 61 -2.624 12.826 -7.432 1.00 51.21 C ATOM 905 CG GLN A 61 -1.925 11.998 -8.507 1.00 62.22 C ATOM 906 CD GLN A 61 -0.972 12.830 -9.354 1.00 42.43 C ATOM 907 OE1 GLN A 61 -1.174 14.025 -9.552 1.00 42.14 O ATOM 908 NE2 GLN A 61 0.072 12.210 -9.865 1.00 14.13 N ATOM 0 H GLN A 61 -3.998 13.944 -5.727 1.00 24.13 H new ATOM 0 HA GLN A 61 -4.452 11.680 -7.358 1.00 1.24 H new ATOM 0 HB2 GLN A 61 -3.066 13.705 -7.900 1.00 51.21 H new ATOM 0 HB3 GLN A 61 -1.876 13.184 -6.724 1.00 51.21 H new ATOM 0 HG2 GLN A 61 -1.372 11.187 -8.034 1.00 62.22 H new ATOM 0 HG3 GLN A 61 -2.674 11.539 -9.153 1.00 62.22 H new ATOM 0 HE21 GLN A 61 0.214 11.216 -9.684 1.00 14.13 H new ATOM 0 HE22 GLN A 61 0.738 12.724 -10.442 1.00 14.13 H new ATOM 917 N LEU A 62 -2.425 11.173 -4.784 1.00 31.14 N ATOM 918 CA LEU A 62 -1.843 10.127 -3.932 1.00 21.04 C ATOM 919 C LEU A 62 -2.919 9.200 -3.350 1.00 11.32 C ATOM 920 O LEU A 62 -2.838 7.980 -3.487 1.00 32.14 O ATOM 921 CB LEU A 62 -1.031 10.754 -2.788 1.00 34.33 C ATOM 922 CG LEU A 62 0.284 11.425 -3.207 1.00 62.23 C ATOM 923 CD1 LEU A 62 0.960 12.082 -2.003 1.00 61.22 C ATOM 924 CD2 LEU A 62 1.212 10.406 -3.869 1.00 75.54 C ATOM 0 H LEU A 62 -2.253 12.123 -4.456 1.00 31.14 H new ATOM 0 HA LEU A 62 -1.184 9.529 -4.562 1.00 21.04 H new ATOM 0 HB2 LEU A 62 -1.654 11.495 -2.286 1.00 34.33 H new ATOM 0 HB3 LEU A 62 -0.807 9.978 -2.056 1.00 34.33 H new ATOM 0 HG LEU A 62 0.061 12.206 -3.934 1.00 62.23 H new ATOM 0 HD11 LEU A 62 1.891 12.552 -2.320 1.00 61.22 H new ATOM 0 HD12 LEU A 62 0.297 12.837 -1.581 1.00 61.22 H new ATOM 0 HD13 LEU A 62 1.175 11.325 -1.248 1.00 61.22 H new ATOM 0 HD21 LEU A 62 2.141 10.896 -4.161 1.00 75.54 H new ATOM 0 HD22 LEU A 62 1.431 9.603 -3.166 1.00 75.54 H new ATOM 0 HD23 LEU A 62 0.727 9.992 -4.753 1.00 75.54 H new ATOM 936 N VAL A 63 -3.922 9.787 -2.703 1.00 61.44 N ATOM 937 CA VAL A 63 -4.992 9.013 -2.064 1.00 53.02 C ATOM 938 C VAL A 63 -5.754 8.148 -3.083 1.00 2.21 C ATOM 939 O VAL A 63 -6.055 6.981 -2.821 1.00 64.33 O ATOM 940 CB VAL A 63 -5.989 9.941 -1.329 1.00 15.22 C ATOM 941 CG1 VAL A 63 -7.084 9.132 -0.634 1.00 41.10 C ATOM 942 CG2 VAL A 63 -5.259 10.833 -0.325 1.00 0.32 C ATOM 0 H VAL A 63 -4.020 10.798 -2.605 1.00 61.44 H new ATOM 0 HA VAL A 63 -4.514 8.355 -1.338 1.00 53.02 H new ATOM 0 HB VAL A 63 -6.464 10.579 -2.074 1.00 15.22 H new ATOM 0 HG11 VAL A 63 -7.770 9.810 -0.126 1.00 41.10 H new ATOM 0 HG12 VAL A 63 -7.632 8.549 -1.375 1.00 41.10 H new ATOM 0 HG13 VAL A 63 -6.632 8.459 0.095 1.00 41.10 H new ATOM 0 HG21 VAL A 63 -5.979 11.477 0.180 1.00 0.32 H new ATOM 0 HG22 VAL A 63 -4.749 10.211 0.411 1.00 0.32 H new ATOM 0 HG23 VAL A 63 -4.527 11.448 -0.849 1.00 0.32 H new ATOM 952 N ASP A 64 -6.047 8.723 -4.249 1.00 34.11 N ATOM 953 CA ASP A 64 -6.762 8.006 -5.311 1.00 15.34 C ATOM 954 C ASP A 64 -5.947 6.803 -5.816 1.00 32.21 C ATOM 955 O ASP A 64 -6.427 5.667 -5.821 1.00 23.40 O ATOM 956 CB ASP A 64 -7.064 8.964 -6.471 1.00 25.14 C ATOM 957 CG ASP A 64 -7.924 8.324 -7.545 1.00 22.33 C ATOM 958 OD1 ASP A 64 -9.157 8.236 -7.347 1.00 62.21 O ATOM 959 OD2 ASP A 64 -7.378 7.919 -8.592 1.00 42.44 O ATOM 0 H ASP A 64 -5.801 9.684 -4.485 1.00 34.11 H new ATOM 0 HA ASP A 64 -7.698 7.628 -4.900 1.00 15.34 H new ATOM 0 HB2 ASP A 64 -7.570 9.849 -6.085 1.00 25.14 H new ATOM 0 HB3 ASP A 64 -6.126 9.300 -6.914 1.00 25.14 H new ATOM 964 N THR A 65 -4.703 7.062 -6.211 1.00 14.20 N ATOM 965 CA THR A 65 -3.809 6.009 -6.708 1.00 5.11 C ATOM 966 C THR A 65 -3.516 4.959 -5.622 1.00 33.12 C ATOM 967 O THR A 65 -3.364 3.775 -5.911 1.00 53.45 O ATOM 968 CB THR A 65 -2.473 6.605 -7.220 1.00 31.14 C ATOM 969 OG1 THR A 65 -2.742 7.639 -8.182 1.00 62.54 O ATOM 970 CG2 THR A 65 -1.589 5.540 -7.866 1.00 24.33 C ATOM 0 H THR A 65 -4.287 7.993 -6.198 1.00 14.20 H new ATOM 0 HA THR A 65 -4.324 5.522 -7.537 1.00 5.11 H new ATOM 0 HB THR A 65 -1.942 7.014 -6.360 1.00 31.14 H new ATOM 0 HG1 THR A 65 -2.973 8.469 -7.714 1.00 62.54 H new ATOM 0 HG21 THR A 65 -0.662 5.997 -8.212 1.00 24.33 H new ATOM 0 HG22 THR A 65 -1.360 4.765 -7.135 1.00 24.33 H new ATOM 0 HG23 THR A 65 -2.113 5.097 -8.713 1.00 24.33 H new ATOM 978 N GLY A 66 -3.441 5.403 -4.370 1.00 1.24 N ATOM 979 CA GLY A 66 -3.242 4.481 -3.256 1.00 51.33 C ATOM 980 C GLY A 66 -4.497 3.682 -2.913 1.00 73.25 C ATOM 981 O GLY A 66 -4.415 2.552 -2.428 1.00 34.04 O ATOM 0 H GLY A 66 -3.514 6.385 -4.103 1.00 1.24 H new ATOM 0 HA2 GLY A 66 -2.435 3.791 -3.502 1.00 51.33 H new ATOM 0 HA3 GLY A 66 -2.925 5.043 -2.378 1.00 51.33 H new ATOM 985 N HIS A 67 -5.665 4.266 -3.178 1.00 33.41 N ATOM 986 CA HIS A 67 -6.947 3.620 -2.876 1.00 33.23 C ATOM 987 C HIS A 67 -7.110 2.290 -3.637 1.00 51.51 C ATOM 988 O HIS A 67 -7.764 1.367 -3.148 1.00 62.45 O ATOM 989 CB HIS A 67 -8.107 4.574 -3.206 1.00 45.10 C ATOM 990 CG HIS A 67 -9.451 4.093 -2.742 1.00 63.13 C ATOM 991 ND1 HIS A 67 -10.521 3.910 -3.589 1.00 50.31 N ATOM 992 CD2 HIS A 67 -9.900 3.770 -1.503 1.00 41.11 C ATOM 993 CE1 HIS A 67 -11.566 3.497 -2.900 1.00 14.04 C ATOM 994 NE2 HIS A 67 -11.218 3.403 -1.632 1.00 14.24 N ATOM 0 H HIS A 67 -5.752 5.189 -3.603 1.00 33.41 H new ATOM 0 HA HIS A 67 -6.963 3.390 -1.811 1.00 33.23 H new ATOM 0 HB2 HIS A 67 -7.905 5.544 -2.753 1.00 45.10 H new ATOM 0 HB3 HIS A 67 -8.141 4.727 -4.285 1.00 45.10 H new ATOM 0 HD2 HIS A 67 -9.329 3.796 -0.587 1.00 41.11 H new ATOM 0 HE1 HIS A 67 -12.542 3.274 -3.305 1.00 14.04 H new ATOM 0 HE2 HIS A 67 -11.828 3.106 -0.870 1.00 14.24 H new ATOM 1003 N GLN A 68 -6.508 2.190 -4.824 1.00 24.11 N ATOM 1004 CA GLN A 68 -6.596 0.961 -5.624 1.00 51.12 C ATOM 1005 C GLN A 68 -5.758 -0.172 -4.999 1.00 62.52 C ATOM 1006 O GLN A 68 -6.082 -1.351 -5.152 1.00 2.12 O ATOM 1007 CB GLN A 68 -6.157 1.215 -7.079 1.00 4.04 C ATOM 1008 CG GLN A 68 -4.645 1.341 -7.275 1.00 63.32 C ATOM 1009 CD GLN A 68 -4.240 1.597 -8.724 1.00 14.11 C ATOM 1010 OE1 GLN A 68 -3.219 2.217 -8.996 1.00 3.31 O ATOM 1011 NE2 GLN A 68 -5.031 1.118 -9.667 1.00 4.40 N ATOM 0 H GLN A 68 -5.959 2.936 -5.252 1.00 24.11 H new ATOM 0 HA GLN A 68 -7.640 0.648 -5.631 1.00 51.12 H new ATOM 0 HB2 GLN A 68 -6.524 0.400 -7.703 1.00 4.04 H new ATOM 0 HB3 GLN A 68 -6.634 2.129 -7.434 1.00 4.04 H new ATOM 0 HG2 GLN A 68 -4.272 2.154 -6.652 1.00 63.32 H new ATOM 0 HG3 GLN A 68 -4.164 0.427 -6.927 1.00 63.32 H new ATOM 0 HE21 GLN A 68 -5.875 0.605 -9.413 1.00 4.40 H new ATOM 0 HE22 GLN A 68 -4.798 1.261 -10.650 1.00 4.40 H new ATOM 1020 N LEU A 69 -4.689 0.190 -4.282 1.00 20.21 N ATOM 1021 CA LEU A 69 -3.846 -0.802 -3.599 1.00 40.02 C ATOM 1022 C LEU A 69 -4.658 -1.611 -2.577 1.00 41.32 C ATOM 1023 O LEU A 69 -4.417 -2.801 -2.391 1.00 73.25 O ATOM 1024 CB LEU A 69 -2.640 -0.131 -2.910 1.00 21.25 C ATOM 1025 CG LEU A 69 -1.391 0.072 -3.790 1.00 71.21 C ATOM 1026 CD1 LEU A 69 -0.849 -1.272 -4.274 1.00 61.33 C ATOM 1027 CD2 LEU A 69 -1.690 0.989 -4.974 1.00 73.53 C ATOM 0 H LEU A 69 -4.387 1.156 -4.159 1.00 20.21 H new ATOM 0 HA LEU A 69 -3.470 -1.486 -4.359 1.00 40.02 H new ATOM 0 HB2 LEU A 69 -2.956 0.841 -2.532 1.00 21.25 H new ATOM 0 HB3 LEU A 69 -2.358 -0.733 -2.046 1.00 21.25 H new ATOM 0 HG LEU A 69 -0.627 0.554 -3.179 1.00 71.21 H new ATOM 0 HD11 LEU A 69 0.032 -1.107 -4.894 1.00 61.33 H new ATOM 0 HD12 LEU A 69 -0.579 -1.886 -3.415 1.00 61.33 H new ATOM 0 HD13 LEU A 69 -1.613 -1.783 -4.859 1.00 61.33 H new ATOM 0 HD21 LEU A 69 -0.789 1.112 -5.575 1.00 73.53 H new ATOM 0 HD22 LEU A 69 -2.477 0.548 -5.586 1.00 73.53 H new ATOM 0 HD23 LEU A 69 -2.017 1.962 -4.607 1.00 73.53 H new ATOM 1039 N LEU A 70 -5.624 -0.961 -1.929 1.00 71.43 N ATOM 1040 CA LEU A 70 -6.517 -1.643 -0.982 1.00 4.41 C ATOM 1041 C LEU A 70 -7.416 -2.669 -1.691 1.00 63.54 C ATOM 1042 O LEU A 70 -7.739 -3.718 -1.131 1.00 62.55 O ATOM 1043 CB LEU A 70 -7.375 -0.621 -0.213 1.00 13.01 C ATOM 1044 CG LEU A 70 -6.697 0.021 1.012 1.00 10.23 C ATOM 1045 CD1 LEU A 70 -6.405 -1.035 2.075 1.00 42.43 C ATOM 1046 CD2 LEU A 70 -5.415 0.748 0.617 1.00 73.45 C ATOM 0 H LEU A 70 -5.811 0.036 -2.040 1.00 71.43 H new ATOM 0 HA LEU A 70 -5.891 -2.183 -0.271 1.00 4.41 H new ATOM 0 HB2 LEU A 70 -7.670 0.171 -0.901 1.00 13.01 H new ATOM 0 HB3 LEU A 70 -8.290 -1.114 0.116 1.00 13.01 H new ATOM 0 HG LEU A 70 -7.385 0.757 1.428 1.00 10.23 H new ATOM 0 HD11 LEU A 70 -5.926 -0.564 2.934 1.00 42.43 H new ATOM 0 HD12 LEU A 70 -7.338 -1.501 2.391 1.00 42.43 H new ATOM 0 HD13 LEU A 70 -5.742 -1.795 1.661 1.00 42.43 H new ATOM 0 HD21 LEU A 70 -4.960 1.190 1.503 1.00 73.45 H new ATOM 0 HD22 LEU A 70 -4.719 0.040 0.167 1.00 73.45 H new ATOM 0 HD23 LEU A 70 -5.649 1.534 -0.101 1.00 73.45 H new ATOM 1058 N ASP A 71 -7.816 -2.364 -2.925 1.00 63.10 N ATOM 1059 CA ASP A 71 -8.617 -3.293 -3.725 1.00 5.32 C ATOM 1060 C ASP A 71 -7.762 -4.510 -4.135 1.00 43.13 C ATOM 1061 O ASP A 71 -8.167 -5.666 -3.964 1.00 14.23 O ATOM 1062 CB ASP A 71 -9.165 -2.572 -4.964 1.00 24.43 C ATOM 1063 CG ASP A 71 -10.376 -3.270 -5.558 1.00 63.13 C ATOM 1064 OD1 ASP A 71 -10.204 -4.192 -6.380 1.00 70.05 O ATOM 1065 OD2 ASP A 71 -11.515 -2.904 -5.197 1.00 41.50 O ATOM 0 H ASP A 71 -7.600 -1.484 -3.392 1.00 63.10 H new ATOM 0 HA ASP A 71 -9.458 -3.649 -3.130 1.00 5.32 H new ATOM 0 HB2 ASP A 71 -9.434 -1.550 -4.696 1.00 24.43 H new ATOM 0 HB3 ASP A 71 -8.381 -2.507 -5.719 1.00 24.43 H new ATOM 1070 N TYR A 72 -6.565 -4.226 -4.660 1.00 34.50 N ATOM 1071 CA TYR A 72 -5.587 -5.266 -5.013 1.00 13.12 C ATOM 1072 C TYR A 72 -5.212 -6.129 -3.796 1.00 30.05 C ATOM 1073 O TYR A 72 -5.173 -7.353 -3.884 1.00 53.23 O ATOM 1074 CB TYR A 72 -4.321 -4.623 -5.614 1.00 34.51 C ATOM 1075 CG TYR A 72 -4.442 -4.277 -7.090 1.00 24.43 C ATOM 1076 CD1 TYR A 72 -5.347 -3.317 -7.537 1.00 12.33 C ATOM 1077 CD2 TYR A 72 -3.651 -4.922 -8.038 1.00 32.33 C ATOM 1078 CE1 TYR A 72 -5.457 -3.013 -8.883 1.00 15.42 C ATOM 1079 CE2 TYR A 72 -3.754 -4.619 -9.380 1.00 23.04 C ATOM 1080 CZ TYR A 72 -4.660 -3.669 -9.798 1.00 25.13 C ATOM 1081 OH TYR A 72 -4.767 -3.376 -11.139 1.00 12.52 O ATOM 0 H TYR A 72 -6.247 -3.276 -4.852 1.00 34.50 H new ATOM 0 HA TYR A 72 -6.049 -5.917 -5.755 1.00 13.12 H new ATOM 0 HB2 TYR A 72 -4.088 -3.716 -5.057 1.00 34.51 H new ATOM 0 HB3 TYR A 72 -3.481 -5.305 -5.479 1.00 34.51 H new ATOM 0 HD1 TYR A 72 -5.972 -2.802 -6.823 1.00 12.33 H new ATOM 0 HD2 TYR A 72 -2.944 -5.673 -7.717 1.00 32.33 H new ATOM 0 HE1 TYR A 72 -6.163 -2.266 -9.215 1.00 15.42 H new ATOM 0 HE2 TYR A 72 -3.127 -5.124 -10.100 1.00 23.04 H new ATOM 0 HH TYR A 72 -3.900 -3.516 -11.575 1.00 12.52 H new ATOM 1091 N CYS A 73 -4.949 -5.484 -2.662 1.00 1.22 N ATOM 1092 CA CYS A 73 -4.563 -6.190 -1.432 1.00 43.14 C ATOM 1093 C CYS A 73 -5.706 -7.061 -0.891 1.00 4.12 C ATOM 1094 O CYS A 73 -5.503 -8.230 -0.563 1.00 63.51 O ATOM 1095 CB CYS A 73 -4.107 -5.196 -0.354 1.00 43.21 C ATOM 1096 SG CYS A 73 -2.568 -4.326 -0.747 1.00 34.12 S ATOM 0 H CYS A 73 -4.995 -4.470 -2.564 1.00 1.22 H new ATOM 0 HA CYS A 73 -3.731 -6.847 -1.687 1.00 43.14 H new ATOM 0 HB2 CYS A 73 -4.896 -4.461 -0.197 1.00 43.21 H new ATOM 0 HB3 CYS A 73 -3.978 -5.732 0.587 1.00 43.21 H new ATOM 0 HG CYS A 73 -2.814 -3.368 -1.590 1.00 34.12 H new ATOM 1102 N SER A 74 -6.909 -6.486 -0.808 1.00 71.14 N ATOM 1103 CA SER A 74 -8.095 -7.220 -0.326 1.00 72.35 C ATOM 1104 C SER A 74 -8.362 -8.474 -1.170 1.00 12.31 C ATOM 1105 O SER A 74 -8.883 -9.476 -0.670 1.00 33.43 O ATOM 1106 CB SER A 74 -9.333 -6.312 -0.346 1.00 52.42 C ATOM 1107 OG SER A 74 -10.503 -7.009 0.061 1.00 4.11 O ATOM 0 H SER A 74 -7.093 -5.517 -1.066 1.00 71.14 H new ATOM 0 HA SER A 74 -7.892 -7.533 0.698 1.00 72.35 H new ATOM 0 HB2 SER A 74 -9.170 -5.459 0.313 1.00 52.42 H new ATOM 0 HB3 SER A 74 -9.477 -5.915 -1.351 1.00 52.42 H new ATOM 0 HG SER A 74 -11.271 -6.401 0.038 1.00 4.11 H new ATOM 1113 N GLY A 75 -8.001 -8.415 -2.449 1.00 72.15 N ATOM 1114 CA GLY A 75 -8.159 -9.567 -3.324 1.00 43.01 C ATOM 1115 C GLY A 75 -6.984 -10.545 -3.254 1.00 54.01 C ATOM 1116 O GLY A 75 -7.181 -11.755 -3.144 1.00 21.22 O ATOM 0 H GLY A 75 -7.602 -7.590 -2.897 1.00 72.15 H new ATOM 0 HA2 GLY A 75 -9.077 -10.093 -3.059 1.00 43.01 H new ATOM 0 HA3 GLY A 75 -8.275 -9.221 -4.351 1.00 43.01 H new ATOM 1120 N TYR A 76 -5.759 -10.022 -3.303 1.00 10.54 N ATOM 1121 CA TYR A 76 -4.552 -10.861 -3.346 1.00 72.31 C ATOM 1122 C TYR A 76 -4.349 -11.648 -2.040 1.00 15.11 C ATOM 1123 O TYR A 76 -3.845 -12.772 -2.057 1.00 21.32 O ATOM 1124 CB TYR A 76 -3.317 -9.997 -3.639 1.00 30.52 C ATOM 1125 CG TYR A 76 -2.080 -10.803 -4.007 1.00 12.24 C ATOM 1126 CD1 TYR A 76 -2.002 -11.468 -5.230 1.00 61.25 C ATOM 1127 CD2 TYR A 76 -0.994 -10.904 -3.139 1.00 74.43 C ATOM 1128 CE1 TYR A 76 -0.883 -12.207 -5.574 1.00 70.03 C ATOM 1129 CE2 TYR A 76 0.128 -11.641 -3.479 1.00 21.12 C ATOM 1130 CZ TYR A 76 0.178 -12.289 -4.698 1.00 34.54 C ATOM 1131 OH TYR A 76 1.294 -13.024 -5.042 1.00 4.10 O ATOM 0 H TYR A 76 -5.572 -9.019 -3.314 1.00 10.54 H new ATOM 0 HA TYR A 76 -4.687 -11.586 -4.148 1.00 72.31 H new ATOM 0 HB2 TYR A 76 -3.549 -9.312 -4.454 1.00 30.52 H new ATOM 0 HB3 TYR A 76 -3.095 -9.387 -2.763 1.00 30.52 H new ATOM 0 HD1 TYR A 76 -2.829 -11.405 -5.921 1.00 61.25 H new ATOM 0 HD2 TYR A 76 -1.028 -10.399 -2.185 1.00 74.43 H new ATOM 0 HE1 TYR A 76 -0.842 -12.717 -6.525 1.00 70.03 H new ATOM 0 HE2 TYR A 76 0.960 -11.709 -2.794 1.00 21.12 H new ATOM 0 HH TYR A 76 1.951 -12.980 -4.316 1.00 4.10 H new ATOM 1141 N VAL A 77 -4.750 -11.057 -0.911 1.00 35.44 N ATOM 1142 CA VAL A 77 -4.615 -11.714 0.397 1.00 54.13 C ATOM 1143 C VAL A 77 -5.387 -13.049 0.447 1.00 34.41 C ATOM 1144 O VAL A 77 -5.018 -13.969 1.178 1.00 63.22 O ATOM 1145 CB VAL A 77 -5.081 -10.789 1.554 1.00 21.34 C ATOM 1146 CG1 VAL A 77 -6.572 -10.468 1.455 1.00 52.33 C ATOM 1147 CG2 VAL A 77 -4.752 -11.407 2.910 1.00 65.31 C ATOM 0 H VAL A 77 -5.170 -10.128 -0.874 1.00 35.44 H new ATOM 0 HA VAL A 77 -3.554 -11.925 0.531 1.00 54.13 H new ATOM 0 HB VAL A 77 -4.535 -9.850 1.461 1.00 21.34 H new ATOM 0 HG11 VAL A 77 -6.860 -9.819 2.282 1.00 52.33 H new ATOM 0 HG12 VAL A 77 -6.774 -9.963 0.510 1.00 52.33 H new ATOM 0 HG13 VAL A 77 -7.147 -11.393 1.502 1.00 52.33 H new ATOM 0 HG21 VAL A 77 -5.088 -10.741 3.705 1.00 65.31 H new ATOM 0 HG22 VAL A 77 -5.258 -12.368 3.004 1.00 65.31 H new ATOM 0 HG23 VAL A 77 -3.675 -11.554 2.991 1.00 65.31 H new ATOM 1157 N ASP A 78 -6.450 -13.151 -0.350 1.00 31.51 N ATOM 1158 CA ASP A 78 -7.243 -14.384 -0.445 1.00 44.52 C ATOM 1159 C ASP A 78 -6.483 -15.477 -1.227 1.00 34.45 C ATOM 1160 O ASP A 78 -6.797 -16.665 -1.136 1.00 52.33 O ATOM 1161 CB ASP A 78 -8.589 -14.073 -1.121 1.00 60.42 C ATOM 1162 CG ASP A 78 -9.527 -15.268 -1.171 1.00 21.05 C ATOM 1163 OD1 ASP A 78 -10.136 -15.595 -0.129 1.00 50.42 O ATOM 1164 OD2 ASP A 78 -9.687 -15.866 -2.257 1.00 43.40 O ATOM 0 H ASP A 78 -6.786 -12.393 -0.943 1.00 31.51 H new ATOM 0 HA ASP A 78 -7.422 -14.765 0.561 1.00 44.52 H new ATOM 0 HB2 ASP A 78 -9.077 -13.259 -0.585 1.00 60.42 H new ATOM 0 HB3 ASP A 78 -8.405 -13.721 -2.136 1.00 60.42 H new ATOM 1169 N CYS A 79 -5.468 -15.062 -1.985 1.00 1.50 N ATOM 1170 CA CYS A 79 -4.699 -15.979 -2.840 1.00 55.31 C ATOM 1171 C CYS A 79 -3.298 -16.288 -2.279 1.00 42.33 C ATOM 1172 O CYS A 79 -2.527 -17.014 -2.910 1.00 20.23 O ATOM 1173 CB CYS A 79 -4.571 -15.389 -4.252 1.00 72.00 C ATOM 1174 SG CYS A 79 -6.154 -15.099 -5.079 1.00 44.02 S ATOM 0 H CYS A 79 -5.155 -14.092 -2.027 1.00 1.50 H new ATOM 0 HA CYS A 79 -5.247 -16.921 -2.870 1.00 55.31 H new ATOM 0 HB2 CYS A 79 -4.027 -14.446 -4.192 1.00 72.00 H new ATOM 0 HB3 CYS A 79 -3.972 -16.064 -4.863 1.00 72.00 H new ATOM 0 HG CYS A 79 -5.941 -14.599 -6.260 1.00 44.02 H new ATOM 1180 N ILE A 80 -2.967 -15.753 -1.101 1.00 42.25 N ATOM 1181 CA ILE A 80 -1.640 -15.977 -0.496 1.00 41.11 C ATOM 1182 C ILE A 80 -1.584 -17.307 0.288 1.00 65.42 C ATOM 1183 O ILE A 80 -2.326 -17.500 1.253 1.00 15.14 O ATOM 1184 CB ILE A 80 -1.241 -14.816 0.452 1.00 71.03 C ATOM 1185 CG1 ILE A 80 -1.236 -13.475 -0.305 1.00 14.13 C ATOM 1186 CG2 ILE A 80 0.129 -15.081 1.083 1.00 5.21 C ATOM 1187 CD1 ILE A 80 -0.835 -12.284 0.544 1.00 73.45 C ATOM 0 H ILE A 80 -3.590 -15.166 -0.547 1.00 42.25 H new ATOM 0 HA ILE A 80 -0.932 -16.023 -1.324 1.00 41.11 H new ATOM 0 HB ILE A 80 -1.981 -14.757 1.250 1.00 71.03 H new ATOM 0 HG12 ILE A 80 -0.553 -13.551 -1.151 1.00 14.13 H new ATOM 0 HG13 ILE A 80 -2.231 -13.297 -0.714 1.00 14.13 H new ATOM 0 HG21 ILE A 80 0.391 -14.255 1.745 1.00 5.21 H new ATOM 0 HG22 ILE A 80 0.093 -16.007 1.656 1.00 5.21 H new ATOM 0 HG23 ILE A 80 0.880 -15.169 0.298 1.00 5.21 H new ATOM 0 HD11 ILE A 80 -0.857 -11.380 -0.064 1.00 73.45 H new ATOM 0 HD12 ILE A 80 -1.532 -12.179 1.376 1.00 73.45 H new ATOM 0 HD13 ILE A 80 0.172 -12.436 0.932 1.00 73.45 H new ATOM 1199 N PRO A 81 -0.701 -18.243 -0.117 1.00 72.50 N ATOM 1200 CA PRO A 81 -0.560 -19.555 0.548 1.00 1.22 C ATOM 1201 C PRO A 81 0.081 -19.465 1.949 1.00 60.54 C ATOM 1202 O PRO A 81 -0.435 -20.023 2.915 1.00 11.44 O ATOM 1203 CB PRO A 81 0.351 -20.351 -0.410 1.00 62.40 C ATOM 1204 CG PRO A 81 0.397 -19.553 -1.676 1.00 71.25 C ATOM 1205 CD PRO A 81 0.210 -18.122 -1.265 1.00 43.33 C ATOM 0 HA PRO A 81 -1.533 -20.015 0.722 1.00 1.22 H new ATOM 0 HB2 PRO A 81 1.349 -20.476 0.011 1.00 62.40 H new ATOM 0 HB3 PRO A 81 -0.047 -21.350 -0.590 1.00 62.40 H new ATOM 0 HG2 PRO A 81 1.348 -19.691 -2.191 1.00 71.25 H new ATOM 0 HG3 PRO A 81 -0.387 -19.867 -2.365 1.00 71.25 H new ATOM 0 HD2 PRO A 81 1.153 -17.652 -0.988 1.00 43.33 H new ATOM 0 HD3 PRO A 81 -0.222 -17.522 -2.066 1.00 43.33 H new ATOM 1213 N GLN A 82 1.215 -18.768 2.046 1.00 70.35 N ATOM 1214 CA GLN A 82 1.933 -18.611 3.324 1.00 62.00 C ATOM 1215 C GLN A 82 1.167 -17.689 4.289 1.00 31.22 C ATOM 1216 O GLN A 82 1.060 -16.487 4.048 1.00 72.01 O ATOM 1217 CB GLN A 82 3.342 -18.038 3.079 1.00 73.52 C ATOM 1218 CG GLN A 82 4.344 -19.013 2.459 1.00 11.45 C ATOM 1219 CD GLN A 82 3.895 -19.579 1.120 1.00 51.35 C ATOM 1220 OE1 GLN A 82 4.123 -18.989 0.069 1.00 4.32 O ATOM 1221 NE2 GLN A 82 3.268 -20.737 1.144 1.00 2.30 N ATOM 0 H GLN A 82 1.661 -18.301 1.257 1.00 70.35 H new ATOM 0 HA GLN A 82 2.013 -19.598 3.779 1.00 62.00 H new ATOM 0 HB2 GLN A 82 3.255 -17.169 2.427 1.00 73.52 H new ATOM 0 HB3 GLN A 82 3.743 -17.685 4.029 1.00 73.52 H new ATOM 0 HG2 GLN A 82 5.299 -18.504 2.327 1.00 11.45 H new ATOM 0 HG3 GLN A 82 4.514 -19.836 3.153 1.00 11.45 H new ATOM 0 HE21 GLN A 82 3.093 -21.204 2.034 1.00 2.30 H new ATOM 0 HE22 GLN A 82 2.958 -21.167 0.273 1.00 2.30 H new ATOM 1230 N THR A 83 0.645 -18.248 5.385 1.00 15.10 N ATOM 1231 CA THR A 83 -0.128 -17.457 6.357 1.00 20.14 C ATOM 1232 C THR A 83 0.744 -16.419 7.079 1.00 13.43 C ATOM 1233 O THR A 83 0.292 -15.307 7.353 1.00 23.32 O ATOM 1234 CB THR A 83 -0.838 -18.339 7.416 1.00 2.11 C ATOM 1235 OG1 THR A 83 -1.629 -19.351 6.769 1.00 52.02 O ATOM 1236 CG2 THR A 83 -1.743 -17.491 8.313 1.00 3.43 C ATOM 0 H THR A 83 0.740 -19.235 5.623 1.00 15.10 H new ATOM 0 HA THR A 83 -0.887 -16.943 5.768 1.00 20.14 H new ATOM 0 HB THR A 83 -0.071 -18.810 8.030 1.00 2.11 H new ATOM 0 HG1 THR A 83 -2.072 -19.903 7.447 1.00 52.02 H new ATOM 0 HG21 THR A 83 -2.230 -18.132 9.048 1.00 3.43 H new ATOM 0 HG22 THR A 83 -1.144 -16.739 8.827 1.00 3.43 H new ATOM 0 HG23 THR A 83 -2.500 -16.997 7.703 1.00 3.43 H new ATOM 1244 N ARG A 84 1.991 -16.776 7.390 1.00 73.43 N ATOM 1245 CA ARG A 84 2.922 -15.822 8.011 1.00 41.33 C ATOM 1246 C ARG A 84 3.123 -14.592 7.113 1.00 21.23 C ATOM 1247 O ARG A 84 2.915 -13.455 7.540 1.00 41.33 O ATOM 1248 CB ARG A 84 4.280 -16.477 8.299 1.00 22.23 C ATOM 1249 CG ARG A 84 4.265 -17.514 9.423 1.00 63.33 C ATOM 1250 CD ARG A 84 3.825 -16.918 10.761 1.00 12.00 C ATOM 1251 NE ARG A 84 2.370 -16.777 10.855 1.00 22.33 N ATOM 1252 CZ ARG A 84 1.753 -15.807 11.472 1.00 15.22 C ATOM 1253 NH1 ARG A 84 2.417 -14.819 11.979 1.00 20.04 N ATOM 1254 NH2 ARG A 84 0.463 -15.814 11.559 1.00 73.52 N ATOM 0 H ARG A 84 2.380 -17.705 7.226 1.00 73.43 H new ATOM 0 HA ARG A 84 2.481 -15.505 8.956 1.00 41.33 H new ATOM 0 HB2 ARG A 84 4.638 -16.955 7.387 1.00 22.23 H new ATOM 0 HB3 ARG A 84 4.998 -15.697 8.553 1.00 22.23 H new ATOM 0 HG2 ARG A 84 3.593 -18.329 9.153 1.00 63.33 H new ATOM 0 HG3 ARG A 84 5.261 -17.944 9.530 1.00 63.33 H new ATOM 0 HD2 ARG A 84 4.180 -17.553 11.573 1.00 12.00 H new ATOM 0 HD3 ARG A 84 4.292 -15.942 10.892 1.00 12.00 H new ATOM 0 HE ARG A 84 1.797 -17.490 10.405 1.00 22.33 H new ATOM 0 HH11 ARG A 84 3.433 -14.793 11.898 1.00 20.04 H new ATOM 0 HH12 ARG A 84 1.924 -14.066 12.459 1.00 20.04 H new ATOM 0 HH21 ARG A 84 -0.072 -16.578 11.145 1.00 73.52 H new ATOM 0 HH22 ARG A 84 -0.020 -15.056 12.041 1.00 73.52 H new ATOM 1268 N ASN A 85 3.528 -14.833 5.866 1.00 52.12 N ATOM 1269 CA ASN A 85 3.675 -13.759 4.877 1.00 15.30 C ATOM 1270 C ASN A 85 2.346 -13.014 4.677 1.00 54.53 C ATOM 1271 O ASN A 85 2.321 -11.795 4.529 1.00 52.24 O ATOM 1272 CB ASN A 85 4.159 -14.326 3.535 1.00 12.41 C ATOM 1273 CG ASN A 85 5.512 -15.013 3.643 1.00 42.04 C ATOM 1274 OD1 ASN A 85 5.876 -15.540 4.688 1.00 2.11 O ATOM 1275 ND2 ASN A 85 6.263 -15.024 2.557 1.00 14.13 N ATOM 0 H ASN A 85 3.761 -15.762 5.514 1.00 52.12 H new ATOM 0 HA ASN A 85 4.417 -13.055 5.254 1.00 15.30 H new ATOM 0 HB2 ASN A 85 3.424 -15.037 3.159 1.00 12.41 H new ATOM 0 HB3 ASN A 85 4.223 -13.518 2.806 1.00 12.41 H new ATOM 0 HD21 ASN A 85 7.175 -15.480 2.572 1.00 14.13 H new ATOM 0 HD22 ASN A 85 5.931 -14.576 1.703 1.00 14.13 H new ATOM 1282 N LYS A 86 1.243 -13.762 4.684 1.00 74.24 N ATOM 1283 CA LYS A 86 -0.092 -13.179 4.521 1.00 45.12 C ATOM 1284 C LYS A 86 -0.432 -12.208 5.662 1.00 32.24 C ATOM 1285 O LYS A 86 -1.010 -11.146 5.433 1.00 25.24 O ATOM 1286 CB LYS A 86 -1.148 -14.287 4.451 1.00 35.22 C ATOM 1287 CG LYS A 86 -2.547 -13.775 4.136 1.00 44.42 C ATOM 1288 CD LYS A 86 -3.554 -14.908 3.983 1.00 72.31 C ATOM 1289 CE LYS A 86 -3.752 -15.682 5.279 1.00 25.21 C ATOM 1290 NZ LYS A 86 -4.729 -16.785 5.111 1.00 4.01 N ATOM 0 H LYS A 86 1.246 -14.775 4.801 1.00 74.24 H new ATOM 0 HA LYS A 86 -0.092 -12.615 3.588 1.00 45.12 H new ATOM 0 HB2 LYS A 86 -0.855 -15.010 3.690 1.00 35.22 H new ATOM 0 HB3 LYS A 86 -1.170 -14.818 5.403 1.00 35.22 H new ATOM 0 HG2 LYS A 86 -2.874 -13.105 4.931 1.00 44.42 H new ATOM 0 HG3 LYS A 86 -2.519 -13.189 3.217 1.00 44.42 H new ATOM 0 HD2 LYS A 86 -4.510 -14.500 3.656 1.00 72.31 H new ATOM 0 HD3 LYS A 86 -3.215 -15.590 3.203 1.00 72.31 H new ATOM 0 HE2 LYS A 86 -2.797 -16.089 5.610 1.00 25.21 H new ATOM 0 HE3 LYS A 86 -4.098 -15.004 6.059 1.00 25.21 H new ATOM 0 HZ1 LYS A 86 -4.840 -17.291 6.013 1.00 4.01 H new ATOM 0 HZ2 LYS A 86 -5.647 -16.394 4.818 1.00 4.01 H new ATOM 0 HZ3 LYS A 86 -4.386 -17.445 4.384 1.00 4.01 H new ATOM 1304 N PHE A 87 -0.078 -12.574 6.892 1.00 21.02 N ATOM 1305 CA PHE A 87 -0.325 -11.702 8.041 1.00 72.41 C ATOM 1306 C PHE A 87 0.582 -10.467 7.978 1.00 71.41 C ATOM 1307 O PHE A 87 0.120 -9.341 8.154 1.00 21.32 O ATOM 1308 CB PHE A 87 -0.114 -12.449 9.363 1.00 22.20 C ATOM 1309 CG PHE A 87 -0.641 -11.686 10.555 1.00 51.25 C ATOM 1310 CD1 PHE A 87 0.158 -10.776 11.230 1.00 24.11 C ATOM 1311 CD2 PHE A 87 -1.949 -11.869 10.986 1.00 64.34 C ATOM 1312 CE1 PHE A 87 -0.334 -10.067 12.311 1.00 1.02 C ATOM 1313 CE2 PHE A 87 -2.442 -11.165 12.067 1.00 12.12 C ATOM 1314 CZ PHE A 87 -1.636 -10.263 12.731 1.00 63.11 C ATOM 0 H PHE A 87 0.376 -13.459 7.119 1.00 21.02 H new ATOM 0 HA PHE A 87 -1.366 -11.380 7.999 1.00 72.41 H new ATOM 0 HB2 PHE A 87 -0.609 -13.419 9.310 1.00 22.20 H new ATOM 0 HB3 PHE A 87 0.950 -12.641 9.501 1.00 22.20 H new ATOM 0 HD1 PHE A 87 1.177 -10.619 10.908 1.00 24.11 H new ATOM 0 HD2 PHE A 87 -2.588 -12.570 10.470 1.00 64.34 H new ATOM 0 HE1 PHE A 87 0.299 -9.360 12.827 1.00 1.02 H new ATOM 0 HE2 PHE A 87 -3.460 -11.321 12.393 1.00 12.12 H new ATOM 0 HZ PHE A 87 -2.021 -9.712 13.576 1.00 63.11 H new ATOM 1324 N ALA A 88 1.872 -10.690 7.711 1.00 60.54 N ATOM 1325 CA ALA A 88 2.831 -9.592 7.515 1.00 0.12 C ATOM 1326 C ALA A 88 2.347 -8.626 6.420 1.00 30.34 C ATOM 1327 O ALA A 88 2.576 -7.415 6.485 1.00 23.21 O ATOM 1328 CB ALA A 88 4.205 -10.153 7.163 1.00 74.11 C ATOM 0 H ALA A 88 2.279 -11.621 7.625 1.00 60.54 H new ATOM 0 HA ALA A 88 2.907 -9.032 8.447 1.00 0.12 H new ATOM 0 HB1 ALA A 88 4.907 -9.332 7.020 1.00 74.11 H new ATOM 0 HB2 ALA A 88 4.555 -10.793 7.973 1.00 74.11 H new ATOM 0 HB3 ALA A 88 4.136 -10.735 6.244 1.00 74.11 H new ATOM 1334 N PHE A 89 1.682 -9.189 5.416 1.00 70.55 N ATOM 1335 CA PHE A 89 1.044 -8.417 4.346 1.00 73.31 C ATOM 1336 C PHE A 89 -0.163 -7.625 4.880 1.00 30.45 C ATOM 1337 O PHE A 89 -0.283 -6.422 4.656 1.00 21.11 O ATOM 1338 CB PHE A 89 0.607 -9.390 3.236 1.00 73.14 C ATOM 1339 CG PHE A 89 -0.111 -8.760 2.068 1.00 74.13 C ATOM 1340 CD1 PHE A 89 0.601 -8.209 1.013 1.00 41.40 C ATOM 1341 CD2 PHE A 89 -1.499 -8.742 2.013 1.00 43.33 C ATOM 1342 CE1 PHE A 89 -0.055 -7.649 -0.066 1.00 70.23 C ATOM 1343 CE2 PHE A 89 -2.158 -8.184 0.934 1.00 53.42 C ATOM 1344 CZ PHE A 89 -1.435 -7.637 -0.106 1.00 12.44 C ATOM 0 H PHE A 89 1.568 -10.198 5.318 1.00 70.55 H new ATOM 0 HA PHE A 89 1.755 -7.693 3.946 1.00 73.31 H new ATOM 0 HB2 PHE A 89 1.490 -9.907 2.861 1.00 73.14 H new ATOM 0 HB3 PHE A 89 -0.043 -10.147 3.675 1.00 73.14 H new ATOM 0 HD1 PHE A 89 1.681 -8.218 1.035 1.00 41.40 H new ATOM 0 HD2 PHE A 89 -2.070 -9.169 2.824 1.00 43.33 H new ATOM 0 HE1 PHE A 89 0.512 -7.220 -0.879 1.00 70.23 H new ATOM 0 HE2 PHE A 89 -3.238 -8.176 0.905 1.00 53.42 H new ATOM 0 HZ PHE A 89 -1.948 -7.200 -0.950 1.00 12.44 H new ATOM 1354 N ARG A 90 -1.045 -8.311 5.607 1.00 72.44 N ATOM 1355 CA ARG A 90 -2.280 -7.705 6.126 1.00 11.33 C ATOM 1356 C ARG A 90 -2.020 -6.583 7.143 1.00 31.31 C ATOM 1357 O ARG A 90 -2.668 -5.535 7.090 1.00 32.31 O ATOM 1358 CB ARG A 90 -3.182 -8.785 6.738 1.00 13.31 C ATOM 1359 CG ARG A 90 -4.111 -9.444 5.725 1.00 14.24 C ATOM 1360 CD ARG A 90 -5.117 -8.440 5.169 1.00 32.13 C ATOM 1361 NE ARG A 90 -5.944 -7.874 6.231 1.00 73.52 N ATOM 1362 CZ ARG A 90 -6.342 -6.629 6.292 1.00 21.00 C ATOM 1363 NH1 ARG A 90 -6.063 -5.792 5.343 1.00 25.14 N ATOM 1364 NH2 ARG A 90 -7.040 -6.227 7.305 1.00 62.13 N ATOM 0 H ARG A 90 -0.929 -9.294 5.853 1.00 72.44 H new ATOM 0 HA ARG A 90 -2.785 -7.243 5.278 1.00 11.33 H new ATOM 0 HB2 ARG A 90 -2.558 -9.551 7.199 1.00 13.31 H new ATOM 0 HB3 ARG A 90 -3.781 -8.340 7.533 1.00 13.31 H new ATOM 0 HG2 ARG A 90 -3.524 -9.866 4.909 1.00 14.24 H new ATOM 0 HG3 ARG A 90 -4.641 -10.271 6.197 1.00 14.24 H new ATOM 0 HD2 ARG A 90 -4.587 -7.640 4.652 1.00 32.13 H new ATOM 0 HD3 ARG A 90 -5.753 -8.930 4.432 1.00 32.13 H new ATOM 0 HE ARG A 90 -6.234 -8.498 6.984 1.00 73.52 H new ATOM 0 HH11 ARG A 90 -5.526 -6.100 4.533 1.00 25.14 H new ATOM 0 HH12 ARG A 90 -6.381 -4.825 5.406 1.00 25.14 H new ATOM 0 HH21 ARG A 90 -7.278 -6.880 8.052 1.00 62.13 H new ATOM 0 HH22 ARG A 90 -7.352 -5.257 7.357 1.00 62.13 H new ATOM 1378 N GLU A 91 -1.092 -6.799 8.072 1.00 74.33 N ATOM 1379 CA GLU A 91 -0.740 -5.761 9.047 1.00 71.14 C ATOM 1380 C GLU A 91 -0.194 -4.509 8.337 1.00 52.14 C ATOM 1381 O GLU A 91 -0.541 -3.381 8.691 1.00 21.40 O ATOM 1382 CB GLU A 91 0.280 -6.286 10.072 1.00 52.43 C ATOM 1383 CG GLU A 91 1.561 -6.825 9.450 1.00 15.31 C ATOM 1384 CD GLU A 91 2.597 -7.244 10.484 1.00 73.45 C ATOM 1385 OE1 GLU A 91 2.479 -8.352 11.047 1.00 64.43 O ATOM 1386 OE2 GLU A 91 3.535 -6.459 10.738 1.00 1.21 O ATOM 0 H GLU A 91 -0.573 -7.672 8.173 1.00 74.33 H new ATOM 0 HA GLU A 91 -1.648 -5.486 9.584 1.00 71.14 H new ATOM 0 HB2 GLU A 91 0.534 -5.481 10.762 1.00 52.43 H new ATOM 0 HB3 GLU A 91 -0.186 -7.076 10.661 1.00 52.43 H new ATOM 0 HG2 GLU A 91 1.319 -7.680 8.819 1.00 15.31 H new ATOM 0 HG3 GLU A 91 1.992 -6.062 8.801 1.00 15.31 H new ATOM 1393 N ALA A 92 0.639 -4.717 7.317 1.00 33.44 N ATOM 1394 CA ALA A 92 1.157 -3.614 6.502 1.00 33.52 C ATOM 1395 C ALA A 92 0.013 -2.877 5.781 1.00 4.03 C ATOM 1396 O ALA A 92 -0.033 -1.644 5.761 1.00 40.32 O ATOM 1397 CB ALA A 92 2.180 -4.142 5.502 1.00 75.55 C ATOM 0 H ALA A 92 0.971 -5.639 7.034 1.00 33.44 H new ATOM 0 HA ALA A 92 1.649 -2.897 7.159 1.00 33.52 H new ATOM 0 HB1 ALA A 92 2.560 -3.317 4.900 1.00 75.55 H new ATOM 0 HB2 ALA A 92 3.005 -4.610 6.039 1.00 75.55 H new ATOM 0 HB3 ALA A 92 1.707 -4.877 4.851 1.00 75.55 H new ATOM 1403 N VAL A 93 -0.914 -3.645 5.201 1.00 14.02 N ATOM 1404 CA VAL A 93 -2.126 -3.075 4.592 1.00 22.32 C ATOM 1405 C VAL A 93 -2.923 -2.252 5.616 1.00 13.34 C ATOM 1406 O VAL A 93 -3.423 -1.171 5.304 1.00 22.53 O ATOM 1407 CB VAL A 93 -3.043 -4.180 4.001 1.00 25.40 C ATOM 1408 CG1 VAL A 93 -4.360 -3.595 3.495 1.00 31.14 C ATOM 1409 CG2 VAL A 93 -2.327 -4.935 2.886 1.00 41.12 C ATOM 0 H VAL A 93 -0.851 -4.661 5.139 1.00 14.02 H new ATOM 0 HA VAL A 93 -1.796 -2.423 3.783 1.00 22.32 H new ATOM 0 HB VAL A 93 -3.275 -4.883 4.801 1.00 25.40 H new ATOM 0 HG11 VAL A 93 -4.980 -4.393 3.087 1.00 31.14 H new ATOM 0 HG12 VAL A 93 -4.885 -3.113 4.320 1.00 31.14 H new ATOM 0 HG13 VAL A 93 -4.156 -2.860 2.716 1.00 31.14 H new ATOM 0 HG21 VAL A 93 -2.987 -5.705 2.486 1.00 41.12 H new ATOM 0 HG22 VAL A 93 -2.056 -4.240 2.091 1.00 41.12 H new ATOM 0 HG23 VAL A 93 -1.425 -5.401 3.283 1.00 41.12 H new ATOM 1419 N SER A 94 -3.017 -2.763 6.843 1.00 23.43 N ATOM 1420 CA SER A 94 -3.716 -2.062 7.929 1.00 1.31 C ATOM 1421 C SER A 94 -3.107 -0.673 8.177 1.00 35.51 C ATOM 1422 O SER A 94 -3.825 0.307 8.356 1.00 11.35 O ATOM 1423 CB SER A 94 -3.678 -2.890 9.219 1.00 72.02 C ATOM 1424 OG SER A 94 -4.341 -2.225 10.285 1.00 24.10 O ATOM 0 H SER A 94 -2.618 -3.662 7.114 1.00 23.43 H new ATOM 0 HA SER A 94 -4.754 -1.931 7.624 1.00 1.31 H new ATOM 0 HB2 SER A 94 -4.147 -3.858 9.045 1.00 72.02 H new ATOM 0 HB3 SER A 94 -2.642 -3.084 9.498 1.00 72.02 H new ATOM 0 HG SER A 94 -4.300 -2.779 11.092 1.00 24.10 H new ATOM 1430 N LYS A 95 -1.779 -0.589 8.176 1.00 15.33 N ATOM 1431 CA LYS A 95 -1.098 0.706 8.310 1.00 0.22 C ATOM 1432 C LYS A 95 -1.289 1.575 7.053 1.00 54.42 C ATOM 1433 O LYS A 95 -1.346 2.804 7.140 1.00 42.45 O ATOM 1434 CB LYS A 95 0.404 0.514 8.600 1.00 41.33 C ATOM 1435 CG LYS A 95 0.730 0.207 10.064 1.00 72.24 C ATOM 1436 CD LYS A 95 0.182 -1.143 10.515 1.00 53.55 C ATOM 1437 CE LYS A 95 0.453 -1.401 11.994 1.00 44.21 C ATOM 1438 NZ LYS A 95 -0.231 -0.411 12.869 1.00 1.12 N ATOM 0 H LYS A 95 -1.154 -1.390 8.085 1.00 15.33 H new ATOM 0 HA LYS A 95 -1.552 1.224 9.154 1.00 0.22 H new ATOM 0 HB2 LYS A 95 0.781 -0.298 7.978 1.00 41.33 H new ATOM 0 HB3 LYS A 95 0.938 1.417 8.303 1.00 41.33 H new ATOM 0 HG2 LYS A 95 1.811 0.221 10.203 1.00 72.24 H new ATOM 0 HG3 LYS A 95 0.317 0.993 10.697 1.00 72.24 H new ATOM 0 HD2 LYS A 95 -0.892 -1.179 10.331 1.00 53.55 H new ATOM 0 HD3 LYS A 95 0.634 -1.936 9.919 1.00 53.55 H new ATOM 0 HE2 LYS A 95 0.119 -2.406 12.254 1.00 44.21 H new ATOM 0 HE3 LYS A 95 1.527 -1.365 12.177 1.00 44.21 H new ATOM 0 HZ1 LYS A 95 -0.207 -0.743 13.854 1.00 1.12 H new ATOM 0 HZ2 LYS A 95 0.254 0.506 12.801 1.00 1.12 H new ATOM 0 HZ3 LYS A 95 -1.220 -0.303 12.565 1.00 1.12 H new ATOM 1452 N LEU A 96 -1.392 0.933 5.887 1.00 11.34 N ATOM 1453 CA LEU A 96 -1.596 1.646 4.618 1.00 43.42 C ATOM 1454 C LEU A 96 -2.963 2.353 4.580 1.00 51.21 C ATOM 1455 O LEU A 96 -3.044 3.553 4.317 1.00 2.42 O ATOM 1456 CB LEU A 96 -1.479 0.669 3.437 1.00 71.11 C ATOM 1457 CG LEU A 96 -1.699 1.286 2.042 1.00 51.21 C ATOM 1458 CD1 LEU A 96 -0.628 2.327 1.732 1.00 12.30 C ATOM 1459 CD2 LEU A 96 -1.730 0.203 0.965 1.00 34.43 C ATOM 0 H LEU A 96 -1.338 -0.081 5.793 1.00 11.34 H new ATOM 0 HA LEU A 96 -0.821 2.408 4.537 1.00 43.42 H new ATOM 0 HB2 LEU A 96 -0.489 0.213 3.462 1.00 71.11 H new ATOM 0 HB3 LEU A 96 -2.203 -0.133 3.579 1.00 71.11 H new ATOM 0 HG LEU A 96 -2.667 1.787 2.046 1.00 51.21 H new ATOM 0 HD11 LEU A 96 -0.805 2.748 0.742 1.00 12.30 H new ATOM 0 HD12 LEU A 96 -0.667 3.122 2.477 1.00 12.30 H new ATOM 0 HD13 LEU A 96 0.355 1.856 1.755 1.00 12.30 H new ATOM 0 HD21 LEU A 96 -1.886 0.664 -0.010 1.00 34.43 H new ATOM 0 HD22 LEU A 96 -0.783 -0.336 0.964 1.00 34.43 H new ATOM 0 HD23 LEU A 96 -2.543 -0.493 1.172 1.00 34.43 H new ATOM 1471 N GLU A 97 -4.034 1.605 4.860 1.00 75.30 N ATOM 1472 CA GLU A 97 -5.391 2.171 4.867 1.00 73.34 C ATOM 1473 C GLU A 97 -5.514 3.308 5.891 1.00 21.24 C ATOM 1474 O GLU A 97 -6.048 4.378 5.584 1.00 42.20 O ATOM 1475 CB GLU A 97 -6.439 1.084 5.159 1.00 44.25 C ATOM 1476 CG GLU A 97 -6.170 0.283 6.426 1.00 61.32 C ATOM 1477 CD GLU A 97 -7.272 -0.714 6.747 1.00 25.13 C ATOM 1478 OE1 GLU A 97 -7.304 -1.800 6.129 1.00 61.34 O ATOM 1479 OE2 GLU A 97 -8.119 -0.415 7.616 1.00 20.42 O ATOM 0 H GLU A 97 -3.991 0.611 5.084 1.00 75.30 H new ATOM 0 HA GLU A 97 -5.579 2.580 3.874 1.00 73.34 H new ATOM 0 HB2 GLU A 97 -7.420 1.553 5.240 1.00 44.25 H new ATOM 0 HB3 GLU A 97 -6.482 0.399 4.312 1.00 44.25 H new ATOM 0 HG2 GLU A 97 -5.226 -0.251 6.318 1.00 61.32 H new ATOM 0 HG3 GLU A 97 -6.054 0.969 7.265 1.00 61.32 H new ATOM 1486 N LEU A 98 -5.008 3.076 7.105 1.00 32.13 N ATOM 1487 CA LEU A 98 -5.002 4.108 8.149 1.00 12.45 C ATOM 1488 C LEU A 98 -4.216 5.346 7.693 1.00 41.20 C ATOM 1489 O LEU A 98 -4.663 6.479 7.862 1.00 11.31 O ATOM 1490 CB LEU A 98 -4.410 3.550 9.453 1.00 42.33 C ATOM 1491 CG LEU A 98 -5.240 2.443 10.124 1.00 0.04 C ATOM 1492 CD1 LEU A 98 -4.505 1.873 11.332 1.00 11.42 C ATOM 1493 CD2 LEU A 98 -6.614 2.969 10.531 1.00 42.14 C ATOM 0 H LEU A 98 -4.598 2.187 7.390 1.00 32.13 H new ATOM 0 HA LEU A 98 -6.033 4.408 8.333 1.00 12.45 H new ATOM 0 HB2 LEU A 98 -3.414 3.160 9.244 1.00 42.33 H new ATOM 0 HB3 LEU A 98 -4.289 4.371 10.160 1.00 42.33 H new ATOM 0 HG LEU A 98 -5.382 1.640 9.400 1.00 0.04 H new ATOM 0 HD11 LEU A 98 -5.111 1.092 11.791 1.00 11.42 H new ATOM 0 HD12 LEU A 98 -3.551 1.452 11.013 1.00 11.42 H new ATOM 0 HD13 LEU A 98 -4.327 2.667 12.057 1.00 11.42 H new ATOM 0 HD21 LEU A 98 -7.184 2.169 11.004 1.00 42.14 H new ATOM 0 HD22 LEU A 98 -6.494 3.794 11.234 1.00 42.14 H new ATOM 0 HD23 LEU A 98 -7.146 3.320 9.647 1.00 42.14 H new ATOM 1505 N SER A 99 -3.057 5.114 7.078 1.00 22.42 N ATOM 1506 CA SER A 99 -2.204 6.208 6.596 1.00 4.53 C ATOM 1507 C SER A 99 -2.890 7.012 5.478 1.00 62.22 C ATOM 1508 O SER A 99 -2.707 8.224 5.371 1.00 24.33 O ATOM 1509 CB SER A 99 -0.859 5.663 6.099 1.00 0.35 C ATOM 1510 OG SER A 99 0.037 6.712 5.767 1.00 65.04 O ATOM 0 H SER A 99 -2.685 4.181 6.900 1.00 22.42 H new ATOM 0 HA SER A 99 -2.030 6.880 7.436 1.00 4.53 H new ATOM 0 HB2 SER A 99 -0.414 5.033 6.869 1.00 0.35 H new ATOM 0 HB3 SER A 99 -1.022 5.032 5.225 1.00 0.35 H new ATOM 0 HG SER A 99 0.885 6.332 5.455 1.00 65.04 H new ATOM 1516 N LEU A 100 -3.681 6.336 4.649 1.00 72.40 N ATOM 1517 CA LEU A 100 -4.428 7.006 3.575 1.00 75.10 C ATOM 1518 C LEU A 100 -5.598 7.839 4.124 1.00 23.52 C ATOM 1519 O LEU A 100 -5.786 8.996 3.732 1.00 10.22 O ATOM 1520 CB LEU A 100 -4.946 5.979 2.557 1.00 75.24 C ATOM 1521 CG LEU A 100 -3.868 5.317 1.684 1.00 10.24 C ATOM 1522 CD1 LEU A 100 -4.477 4.236 0.798 1.00 14.41 C ATOM 1523 CD2 LEU A 100 -3.149 6.365 0.834 1.00 72.41 C ATOM 0 H LEU A 100 -3.825 5.327 4.696 1.00 72.40 H new ATOM 0 HA LEU A 100 -3.738 7.688 3.078 1.00 75.10 H new ATOM 0 HB2 LEU A 100 -5.484 5.198 3.095 1.00 75.24 H new ATOM 0 HB3 LEU A 100 -5.667 6.471 1.904 1.00 75.24 H new ATOM 0 HG LEU A 100 -3.138 4.846 2.343 1.00 10.24 H new ATOM 0 HD11 LEU A 100 -3.695 3.782 0.189 1.00 14.41 H new ATOM 0 HD12 LEU A 100 -4.941 3.472 1.422 1.00 14.41 H new ATOM 0 HD13 LEU A 100 -5.231 4.680 0.148 1.00 14.41 H new ATOM 0 HD21 LEU A 100 -2.389 5.878 0.222 1.00 72.41 H new ATOM 0 HD22 LEU A 100 -3.870 6.866 0.187 1.00 72.41 H new ATOM 0 HD23 LEU A 100 -2.675 7.099 1.486 1.00 72.41 H new ATOM 1535 N GLN A 101 -6.387 7.260 5.031 1.00 43.02 N ATOM 1536 CA GLN A 101 -7.541 7.968 5.600 1.00 71.54 C ATOM 1537 C GLN A 101 -7.110 9.172 6.454 1.00 72.45 C ATOM 1538 O GLN A 101 -7.818 10.179 6.520 1.00 43.31 O ATOM 1539 CB GLN A 101 -8.430 7.016 6.418 1.00 1.11 C ATOM 1540 CG GLN A 101 -7.715 6.327 7.572 1.00 54.01 C ATOM 1541 CD GLN A 101 -8.625 5.398 8.360 1.00 1.14 C ATOM 1542 OE1 GLN A 101 -8.768 4.223 8.036 1.00 3.20 O ATOM 1543 NE2 GLN A 101 -9.242 5.915 9.402 1.00 55.15 N ATOM 0 H GLN A 101 -6.253 6.313 5.386 1.00 43.02 H new ATOM 0 HA GLN A 101 -8.125 8.349 4.762 1.00 71.54 H new ATOM 0 HB2 GLN A 101 -9.276 7.578 6.814 1.00 1.11 H new ATOM 0 HB3 GLN A 101 -8.837 6.255 5.752 1.00 1.11 H new ATOM 0 HG2 GLN A 101 -6.872 5.757 7.182 1.00 54.01 H new ATOM 0 HG3 GLN A 101 -7.306 7.083 8.243 1.00 54.01 H new ATOM 0 HE21 GLN A 101 -9.101 6.896 9.643 1.00 55.15 H new ATOM 0 HE22 GLN A 101 -9.861 5.335 9.968 1.00 55.15 H new ATOM 1552 N GLU A 102 -5.951 9.075 7.106 1.00 71.41 N ATOM 1553 CA GLU A 102 -5.416 10.201 7.881 1.00 34.32 C ATOM 1554 C GLU A 102 -4.745 11.244 6.966 1.00 62.23 C ATOM 1555 O GLU A 102 -4.819 12.440 7.227 1.00 40.55 O ATOM 1556 CB GLU A 102 -4.425 9.717 8.952 1.00 32.23 C ATOM 1557 CG GLU A 102 -3.124 9.163 8.391 1.00 72.35 C ATOM 1558 CD GLU A 102 -2.174 8.678 9.474 1.00 3.11 C ATOM 1559 OE1 GLU A 102 -2.251 7.496 9.859 1.00 43.52 O ATOM 1560 OE2 GLU A 102 -1.347 9.482 9.951 1.00 4.40 O ATOM 0 H GLU A 102 -5.368 8.238 7.115 1.00 71.41 H new ATOM 0 HA GLU A 102 -6.259 10.678 8.381 1.00 34.32 H new ATOM 0 HB2 GLU A 102 -4.195 10.547 9.620 1.00 32.23 H new ATOM 0 HB3 GLU A 102 -4.906 8.946 9.554 1.00 32.23 H new ATOM 0 HG2 GLU A 102 -3.348 8.338 7.714 1.00 72.35 H new ATOM 0 HG3 GLU A 102 -2.631 9.935 7.800 1.00 72.35 H new ATOM 1567 N LEU A 103 -4.098 10.791 5.888 1.00 31.12 N ATOM 1568 CA LEU A 103 -3.429 11.709 4.951 1.00 42.01 C ATOM 1569 C LEU A 103 -4.418 12.691 4.308 1.00 20.40 C ATOM 1570 O LEU A 103 -4.161 13.892 4.240 1.00 4.44 O ATOM 1571 CB LEU A 103 -2.699 10.933 3.844 1.00 72.55 C ATOM 1572 CG LEU A 103 -1.955 11.812 2.821 1.00 44.22 C ATOM 1573 CD1 LEU A 103 -0.838 12.610 3.494 1.00 11.22 C ATOM 1574 CD2 LEU A 103 -1.406 10.970 1.673 1.00 21.53 C ATOM 0 H LEU A 103 -4.021 9.804 5.641 1.00 31.12 H new ATOM 0 HA LEU A 103 -2.705 12.277 5.535 1.00 42.01 H new ATOM 0 HB2 LEU A 103 -1.983 10.254 4.307 1.00 72.55 H new ATOM 0 HB3 LEU A 103 -3.424 10.317 3.313 1.00 72.55 H new ATOM 0 HG LEU A 103 -2.672 12.521 2.406 1.00 44.22 H new ATOM 0 HD11 LEU A 103 -0.329 13.222 2.750 1.00 11.22 H new ATOM 0 HD12 LEU A 103 -1.264 13.254 4.264 1.00 11.22 H new ATOM 0 HD13 LEU A 103 -0.124 11.924 3.949 1.00 11.22 H new ATOM 0 HD21 LEU A 103 -0.885 11.615 0.965 1.00 21.53 H new ATOM 0 HD22 LEU A 103 -0.711 10.228 2.066 1.00 21.53 H new ATOM 0 HD23 LEU A 103 -2.228 10.465 1.167 1.00 21.53 H new ATOM 1586 N GLN A 104 -5.547 12.174 3.834 1.00 52.50 N ATOM 1587 CA GLN A 104 -6.555 13.004 3.162 1.00 63.14 C ATOM 1588 C GLN A 104 -7.153 14.069 4.105 1.00 10.40 C ATOM 1589 O GLN A 104 -7.589 15.129 3.655 1.00 44.33 O ATOM 1590 CB GLN A 104 -7.661 12.115 2.571 1.00 2.44 C ATOM 1591 CG GLN A 104 -8.375 11.241 3.595 1.00 63.41 C ATOM 1592 CD GLN A 104 -9.298 10.220 2.952 1.00 13.31 C ATOM 1593 OE1 GLN A 104 -10.474 10.477 2.725 1.00 44.01 O ATOM 1594 NE2 GLN A 104 -8.767 9.054 2.642 1.00 11.31 N ATOM 0 H GLN A 104 -5.792 11.186 3.900 1.00 52.50 H new ATOM 0 HA GLN A 104 -6.058 13.540 2.353 1.00 63.14 H new ATOM 0 HB2 GLN A 104 -8.396 12.750 2.076 1.00 2.44 H new ATOM 0 HB3 GLN A 104 -7.226 11.474 1.804 1.00 2.44 H new ATOM 0 HG2 GLN A 104 -7.634 10.723 4.204 1.00 63.41 H new ATOM 0 HG3 GLN A 104 -8.953 11.875 4.268 1.00 63.41 H new ATOM 0 HE21 GLN A 104 -7.784 8.871 2.844 1.00 11.31 H new ATOM 0 HE22 GLN A 104 -9.339 8.335 2.200 1.00 11.31 H new ATOM 1603 N VAL A 105 -7.166 13.791 5.412 1.00 1.44 N ATOM 1604 CA VAL A 105 -7.659 14.762 6.402 1.00 43.12 C ATOM 1605 C VAL A 105 -6.508 15.592 7.009 1.00 41.22 C ATOM 1606 O VAL A 105 -6.733 16.663 7.569 1.00 13.22 O ATOM 1607 CB VAL A 105 -8.458 14.069 7.541 1.00 24.22 C ATOM 1608 CG1 VAL A 105 -9.626 13.267 6.967 1.00 22.54 C ATOM 1609 CG2 VAL A 105 -7.554 13.179 8.395 1.00 12.52 C ATOM 0 H VAL A 105 -6.844 12.909 5.810 1.00 1.44 H new ATOM 0 HA VAL A 105 -8.329 15.434 5.866 1.00 43.12 H new ATOM 0 HB VAL A 105 -8.860 14.848 8.189 1.00 24.22 H new ATOM 0 HG11 VAL A 105 -10.173 12.789 7.779 1.00 22.54 H new ATOM 0 HG12 VAL A 105 -10.294 13.935 6.423 1.00 22.54 H new ATOM 0 HG13 VAL A 105 -9.245 12.504 6.288 1.00 22.54 H new ATOM 0 HG21 VAL A 105 -8.144 12.710 9.182 1.00 12.52 H new ATOM 0 HG22 VAL A 105 -7.106 12.408 7.768 1.00 12.52 H new ATOM 0 HG23 VAL A 105 -6.767 13.784 8.844 1.00 12.52 H new ATOM 1619 N SER A 106 -5.276 15.091 6.884 1.00 21.31 N ATOM 1620 CA SER A 106 -4.079 15.778 7.415 1.00 74.53 C ATOM 1621 C SER A 106 -3.213 16.353 6.283 1.00 12.22 C ATOM 1622 O SER A 106 -2.042 16.665 6.488 1.00 32.40 O ATOM 1623 CB SER A 106 -3.232 14.808 8.261 1.00 10.01 C ATOM 1624 OG SER A 106 -2.105 15.457 8.842 1.00 60.22 O ATOM 0 H SER A 106 -5.073 14.207 6.418 1.00 21.31 H new ATOM 0 HA SER A 106 -4.426 16.601 8.040 1.00 74.53 H new ATOM 0 HB2 SER A 106 -3.850 14.379 9.049 1.00 10.01 H new ATOM 0 HB3 SER A 106 -2.893 13.982 7.636 1.00 10.01 H new ATOM 0 HG SER A 106 -1.675 16.029 8.172 1.00 60.22 H new ATOM 1630 N SER A 107 -3.800 16.493 5.095 1.00 25.34 N ATOM 1631 CA SER A 107 -3.082 17.002 3.911 1.00 11.01 C ATOM 1632 C SER A 107 -2.313 18.296 4.220 1.00 32.22 C ATOM 1633 O SER A 107 -1.089 18.349 4.079 1.00 1.10 O ATOM 1634 CB SER A 107 -4.065 17.250 2.760 1.00 10.11 C ATOM 1635 OG SER A 107 -5.039 18.221 3.108 1.00 1.13 O ATOM 0 H SER A 107 -4.778 16.261 4.919 1.00 25.34 H new ATOM 0 HA SER A 107 -2.358 16.241 3.619 1.00 11.01 H new ATOM 0 HB2 SER A 107 -3.518 17.582 1.878 1.00 10.11 H new ATOM 0 HB3 SER A 107 -4.560 16.316 2.495 1.00 10.11 H new ATOM 0 HG SER A 107 -5.649 18.358 2.353 1.00 1.13 H new ATOM 1641 N ALA A 108 -3.048 19.339 4.612 1.00 35.00 N ATOM 1642 CA ALA A 108 -2.452 20.603 5.070 1.00 24.55 C ATOM 1643 C ALA A 108 -1.522 21.245 4.023 1.00 21.25 C ATOM 1644 O ALA A 108 -0.676 22.076 4.362 1.00 12.32 O ATOM 1645 CB ALA A 108 -1.702 20.372 6.381 1.00 12.41 C ATOM 0 H ALA A 108 -4.068 19.335 4.622 1.00 35.00 H new ATOM 0 HA ALA A 108 -3.269 21.307 5.228 1.00 24.55 H new ATOM 0 HB1 ALA A 108 -1.261 21.310 6.718 1.00 12.41 H new ATOM 0 HB2 ALA A 108 -2.396 20.004 7.137 1.00 12.41 H new ATOM 0 HB3 ALA A 108 -0.913 19.636 6.224 1.00 12.41 H new ATOM 1651 N ALA A 109 -1.698 20.886 2.751 1.00 24.03 N ATOM 1652 CA ALA A 109 -0.833 21.396 1.681 1.00 24.21 C ATOM 1653 C ALA A 109 -1.428 21.148 0.286 1.00 74.51 C ATOM 1654 O ALA A 109 -2.129 20.160 0.058 1.00 33.23 O ATOM 1655 CB ALA A 109 0.551 20.758 1.779 1.00 44.31 C ATOM 0 H ALA A 109 -2.428 20.247 2.435 1.00 24.03 H new ATOM 0 HA ALA A 109 -0.751 22.475 1.814 1.00 24.21 H new ATOM 0 HB1 ALA A 109 1.186 21.142 0.981 1.00 44.31 H new ATOM 0 HB2 ALA A 109 0.995 20.999 2.745 1.00 44.31 H new ATOM 0 HB3 ALA A 109 0.461 19.676 1.682 1.00 44.31 H new ATOM 1661 N ALA A 110 -1.124 22.042 -0.652 1.00 42.30 N ATOM 1662 CA ALA A 110 -1.593 21.918 -2.036 1.00 1.35 C ATOM 1663 C ALA A 110 -0.592 21.126 -2.899 1.00 63.51 C ATOM 1664 O ALA A 110 -0.372 21.442 -4.069 1.00 62.11 O ATOM 1665 CB ALA A 110 -1.828 23.305 -2.624 1.00 40.15 C ATOM 0 H ALA A 110 -0.550 22.868 -0.480 1.00 42.30 H new ATOM 0 HA ALA A 110 -2.532 21.365 -2.034 1.00 1.35 H new ATOM 0 HB1 ALA A 110 -2.176 23.210 -3.652 1.00 40.15 H new ATOM 0 HB2 ALA A 110 -2.580 23.828 -2.033 1.00 40.15 H new ATOM 0 HB3 ALA A 110 -0.896 23.870 -2.607 1.00 40.15 H new ATOM 1671 N GLY A 111 -0.008 20.077 -2.320 1.00 32.50 N ATOM 1672 CA GLY A 111 0.984 19.270 -3.032 1.00 2.30 C ATOM 1673 C GLY A 111 2.424 19.580 -2.622 1.00 24.50 C ATOM 1674 O GLY A 111 3.332 19.594 -3.457 1.00 4.31 O ATOM 0 H GLY A 111 -0.202 19.767 -1.368 1.00 32.50 H new ATOM 0 HA2 GLY A 111 0.781 18.215 -2.850 1.00 2.30 H new ATOM 0 HA3 GLY A 111 0.875 19.436 -4.104 1.00 2.30 H new ATOM 1678 N VAL A 112 2.635 19.825 -1.331 1.00 23.35 N ATOM 1679 CA VAL A 112 3.971 20.123 -0.800 1.00 24.32 C ATOM 1680 C VAL A 112 4.598 18.875 -0.154 1.00 12.14 C ATOM 1681 O VAL A 112 4.014 18.269 0.747 1.00 54.34 O ATOM 1682 CB VAL A 112 3.917 21.269 0.243 1.00 55.54 C ATOM 1683 CG1 VAL A 112 5.316 21.600 0.765 1.00 5.33 C ATOM 1684 CG2 VAL A 112 3.249 22.512 -0.353 1.00 41.14 C ATOM 0 H VAL A 112 1.897 19.824 -0.627 1.00 23.35 H new ATOM 0 HA VAL A 112 4.589 20.439 -1.640 1.00 24.32 H new ATOM 0 HB VAL A 112 3.316 20.931 1.087 1.00 55.54 H new ATOM 0 HG11 VAL A 112 5.251 22.407 1.495 1.00 5.33 H new ATOM 0 HG12 VAL A 112 5.746 20.717 1.238 1.00 5.33 H new ATOM 0 HG13 VAL A 112 5.950 21.912 -0.065 1.00 5.33 H new ATOM 0 HG21 VAL A 112 3.221 23.304 0.395 1.00 41.14 H new ATOM 0 HG22 VAL A 112 3.818 22.851 -1.219 1.00 41.14 H new ATOM 0 HG23 VAL A 112 2.232 22.267 -0.660 1.00 41.14 H new ATOM 1694 N PRO A 113 5.800 18.465 -0.608 1.00 3.20 N ATOM 1695 CA PRO A 113 6.480 17.275 -0.070 1.00 12.42 C ATOM 1696 C PRO A 113 7.116 17.523 1.312 1.00 52.30 C ATOM 1697 O PRO A 113 7.667 18.595 1.572 1.00 12.43 O ATOM 1698 CB PRO A 113 7.557 16.989 -1.124 1.00 70.23 C ATOM 1699 CG PRO A 113 7.874 18.325 -1.713 1.00 72.10 C ATOM 1700 CD PRO A 113 6.588 19.118 -1.678 1.00 31.24 C ATOM 0 HA PRO A 113 5.790 16.448 0.095 1.00 12.42 H new ATOM 0 HB2 PRO A 113 8.440 16.534 -0.675 1.00 70.23 H new ATOM 0 HB3 PRO A 113 7.194 16.297 -1.884 1.00 70.23 H new ATOM 0 HG2 PRO A 113 8.656 18.826 -1.142 1.00 72.10 H new ATOM 0 HG3 PRO A 113 8.241 18.223 -2.734 1.00 72.10 H new ATOM 0 HD2 PRO A 113 6.772 20.169 -1.455 1.00 31.24 H new ATOM 0 HD3 PRO A 113 6.069 19.082 -2.636 1.00 31.24 H new ATOM 1708 N GLY A 114 7.018 16.533 2.201 1.00 5.33 N ATOM 1709 CA GLY A 114 7.642 16.637 3.523 1.00 62.52 C ATOM 1710 C GLY A 114 6.795 17.377 4.560 1.00 44.14 C ATOM 1711 O GLY A 114 7.150 17.415 5.740 1.00 34.23 O ATOM 0 H GLY A 114 6.519 15.659 2.034 1.00 5.33 H new ATOM 0 HA2 GLY A 114 7.854 15.634 3.892 1.00 62.52 H new ATOM 0 HA3 GLY A 114 8.600 17.148 3.421 1.00 62.52 H new ATOM 1715 N THR A 115 5.677 17.963 4.129 1.00 73.51 N ATOM 1716 CA THR A 115 4.791 18.718 5.036 1.00 1.21 C ATOM 1717 C THR A 115 4.265 17.854 6.197 1.00 45.02 C ATOM 1718 O THR A 115 4.209 18.302 7.346 1.00 75.31 O ATOM 1719 CB THR A 115 3.585 19.331 4.282 1.00 10.41 C ATOM 1720 OG1 THR A 115 2.735 20.033 5.200 1.00 22.11 O ATOM 1721 CG2 THR A 115 2.774 18.259 3.557 1.00 12.24 C ATOM 0 H THR A 115 5.358 17.933 3.161 1.00 73.51 H new ATOM 0 HA THR A 115 5.406 19.519 5.447 1.00 1.21 H new ATOM 0 HB THR A 115 3.978 20.025 3.539 1.00 10.41 H new ATOM 0 HG1 THR A 115 1.976 20.418 4.714 1.00 22.11 H new ATOM 0 HG21 THR A 115 1.936 18.725 3.039 1.00 12.24 H new ATOM 0 HG22 THR A 115 3.410 17.749 2.833 1.00 12.24 H new ATOM 0 HG23 THR A 115 2.397 17.537 4.281 1.00 12.24 H new ATOM 1729 N ASN A 116 3.893 16.613 5.891 1.00 52.44 N ATOM 1730 CA ASN A 116 3.382 15.673 6.899 1.00 41.32 C ATOM 1731 C ASN A 116 4.142 14.338 6.842 1.00 61.33 C ATOM 1732 O ASN A 116 4.399 13.810 5.756 1.00 41.43 O ATOM 1733 CB ASN A 116 1.880 15.422 6.689 1.00 44.02 C ATOM 1734 CG ASN A 116 1.020 16.578 7.163 1.00 31.13 C ATOM 1735 OD1 ASN A 116 0.608 16.626 8.318 1.00 2.04 O ATOM 1736 ND2 ASN A 116 0.730 17.511 6.281 1.00 44.41 N ATOM 0 H ASN A 116 3.935 16.228 4.947 1.00 52.44 H new ATOM 0 HA ASN A 116 3.536 16.121 7.881 1.00 41.32 H new ATOM 0 HB2 ASN A 116 1.690 15.244 5.630 1.00 44.02 H new ATOM 0 HB3 ASN A 116 1.589 14.516 7.222 1.00 44.02 H new ATOM 0 HD21 ASN A 116 0.147 18.303 6.550 1.00 44.41 H new ATOM 0 HD22 ASN A 116 1.088 17.442 5.329 1.00 44.41 H new ATOM 1743 N PRO A 117 4.487 13.759 8.014 1.00 2.04 N ATOM 1744 CA PRO A 117 5.219 12.477 8.087 1.00 74.31 C ATOM 1745 C PRO A 117 4.447 11.328 7.423 1.00 31.12 C ATOM 1746 O PRO A 117 5.037 10.343 6.977 1.00 51.40 O ATOM 1747 CB PRO A 117 5.375 12.235 9.601 1.00 30.24 C ATOM 1748 CG PRO A 117 4.329 13.089 10.241 1.00 74.21 C ATOM 1749 CD PRO A 117 4.195 14.299 9.358 1.00 34.41 C ATOM 0 HA PRO A 117 6.170 12.517 7.556 1.00 74.31 H new ATOM 0 HB2 PRO A 117 5.231 11.183 9.849 1.00 30.24 H new ATOM 0 HB3 PRO A 117 6.373 12.510 9.944 1.00 30.24 H new ATOM 0 HG2 PRO A 117 3.382 12.555 10.320 1.00 74.21 H new ATOM 0 HG3 PRO A 117 4.620 13.373 11.252 1.00 74.21 H new ATOM 0 HD2 PRO A 117 3.195 14.730 9.412 1.00 34.41 H new ATOM 0 HD3 PRO A 117 4.896 15.084 9.639 1.00 34.41 H new ATOM 1757 N VAL A 118 3.124 11.482 7.336 1.00 4.13 N ATOM 1758 CA VAL A 118 2.246 10.476 6.724 1.00 44.31 C ATOM 1759 C VAL A 118 2.722 10.080 5.315 1.00 60.32 C ATOM 1760 O VAL A 118 2.542 8.940 4.883 1.00 20.33 O ATOM 1761 CB VAL A 118 0.785 10.987 6.642 1.00 62.31 C ATOM 1762 CG1 VAL A 118 -0.156 9.870 6.196 1.00 15.02 C ATOM 1763 CG2 VAL A 118 0.341 11.578 7.979 1.00 43.10 C ATOM 0 H VAL A 118 2.630 12.303 7.686 1.00 4.13 H new ATOM 0 HA VAL A 118 2.287 9.596 7.365 1.00 44.31 H new ATOM 0 HB VAL A 118 0.743 11.779 5.895 1.00 62.31 H new ATOM 0 HG11 VAL A 118 -1.176 10.252 6.146 1.00 15.02 H new ATOM 0 HG12 VAL A 118 0.146 9.511 5.212 1.00 15.02 H new ATOM 0 HG13 VAL A 118 -0.111 9.049 6.911 1.00 15.02 H new ATOM 0 HG21 VAL A 118 -0.687 11.930 7.898 1.00 43.10 H new ATOM 0 HG22 VAL A 118 0.402 10.813 8.753 1.00 43.10 H new ATOM 0 HG23 VAL A 118 0.991 12.413 8.241 1.00 43.10 H new ATOM 1773 N LEU A 119 3.339 11.024 4.608 1.00 61.13 N ATOM 1774 CA LEU A 119 3.908 10.753 3.281 1.00 43.33 C ATOM 1775 C LEU A 119 5.007 9.681 3.368 1.00 62.14 C ATOM 1776 O LEU A 119 5.077 8.770 2.542 1.00 30.21 O ATOM 1777 CB LEU A 119 4.477 12.045 2.678 1.00 3.41 C ATOM 1778 CG LEU A 119 3.458 13.179 2.480 1.00 30.14 C ATOM 1779 CD1 LEU A 119 4.144 14.448 1.976 1.00 30.21 C ATOM 1780 CD2 LEU A 119 2.351 12.750 1.522 1.00 54.43 C ATOM 0 H LEU A 119 3.460 11.985 4.928 1.00 61.13 H new ATOM 0 HA LEU A 119 3.113 10.379 2.636 1.00 43.33 H new ATOM 0 HB2 LEU A 119 5.278 12.406 3.323 1.00 3.41 H new ATOM 0 HB3 LEU A 119 4.927 11.810 1.713 1.00 3.41 H new ATOM 0 HG LEU A 119 3.007 13.399 3.448 1.00 30.14 H new ATOM 0 HD11 LEU A 119 3.402 15.235 1.844 1.00 30.21 H new ATOM 0 HD12 LEU A 119 4.890 14.771 2.702 1.00 30.21 H new ATOM 0 HD13 LEU A 119 4.630 14.244 1.022 1.00 30.21 H new ATOM 0 HD21 LEU A 119 1.641 13.568 1.397 1.00 54.43 H new ATOM 0 HD22 LEU A 119 2.785 12.495 0.555 1.00 54.43 H new ATOM 0 HD23 LEU A 119 1.835 11.881 1.929 1.00 54.43 H new ATOM 1792 N ASN A 120 5.857 9.799 4.387 1.00 22.21 N ATOM 1793 CA ASN A 120 6.919 8.820 4.634 1.00 22.22 C ATOM 1794 C ASN A 120 6.322 7.490 5.123 1.00 13.54 C ATOM 1795 O ASN A 120 6.802 6.411 4.769 1.00 2.11 O ATOM 1796 CB ASN A 120 7.915 9.370 5.667 1.00 61.50 C ATOM 1797 CG ASN A 120 9.148 8.496 5.813 1.00 30.11 C ATOM 1798 OD1 ASN A 120 9.596 7.868 4.864 1.00 71.11 O ATOM 1799 ND2 ASN A 120 9.713 8.457 7.004 1.00 72.34 N ATOM 0 H ASN A 120 5.832 10.566 5.059 1.00 22.21 H new ATOM 0 HA ASN A 120 7.448 8.637 3.699 1.00 22.22 H new ATOM 0 HB2 ASN A 120 8.219 10.375 5.374 1.00 61.50 H new ATOM 0 HB3 ASN A 120 7.419 9.457 6.634 1.00 61.50 H new ATOM 0 HD21 ASN A 120 10.548 7.891 7.154 1.00 72.34 H new ATOM 0 HD22 ASN A 120 9.315 8.993 7.775 1.00 72.34 H new ATOM 1806 N ASN A 121 5.270 7.581 5.938 1.00 43.24 N ATOM 1807 CA ASN A 121 4.540 6.398 6.409 1.00 23.31 C ATOM 1808 C ASN A 121 4.015 5.565 5.230 1.00 74.11 C ATOM 1809 O ASN A 121 4.163 4.342 5.211 1.00 3.12 O ATOM 1810 CB ASN A 121 3.377 6.814 7.320 1.00 3.54 C ATOM 1811 CG ASN A 121 3.853 7.491 8.594 1.00 61.20 C ATOM 1812 OD1 ASN A 121 4.910 8.109 8.628 1.00 31.50 O ATOM 1813 ND2 ASN A 121 3.081 7.383 9.652 1.00 1.45 N ATOM 0 H ASN A 121 4.901 8.465 6.288 1.00 43.24 H new ATOM 0 HA ASN A 121 5.234 5.781 6.980 1.00 23.31 H new ATOM 0 HB2 ASN A 121 2.718 7.491 6.777 1.00 3.54 H new ATOM 0 HB3 ASN A 121 2.788 5.934 7.578 1.00 3.54 H new ATOM 0 HD21 ASN A 121 3.357 7.820 10.531 1.00 1.45 H new ATOM 0 HD22 ASN A 121 2.206 6.862 9.594 1.00 1.45 H new ATOM 1820 N LEU A 122 3.402 6.232 4.250 1.00 54.21 N ATOM 1821 CA LEU A 122 2.961 5.563 3.024 1.00 34.54 C ATOM 1822 C LEU A 122 4.137 4.894 2.306 1.00 51.15 C ATOM 1823 O LEU A 122 4.076 3.717 1.967 1.00 31.11 O ATOM 1824 CB LEU A 122 2.274 6.554 2.071 1.00 72.03 C ATOM 1825 CG LEU A 122 0.879 7.029 2.501 1.00 64.32 C ATOM 1826 CD1 LEU A 122 0.317 8.016 1.484 1.00 22.40 C ATOM 1827 CD2 LEU A 122 -0.067 5.842 2.677 1.00 70.52 C ATOM 0 H LEU A 122 3.200 7.231 4.281 1.00 54.21 H new ATOM 0 HA LEU A 122 2.243 4.796 3.315 1.00 34.54 H new ATOM 0 HB2 LEU A 122 2.917 7.427 1.958 1.00 72.03 H new ATOM 0 HB3 LEU A 122 2.193 6.089 1.089 1.00 72.03 H new ATOM 0 HG LEU A 122 0.970 7.536 3.462 1.00 64.32 H new ATOM 0 HD11 LEU A 122 -0.672 8.343 1.803 1.00 22.40 H new ATOM 0 HD12 LEU A 122 0.979 8.879 1.411 1.00 22.40 H new ATOM 0 HD13 LEU A 122 0.242 7.532 0.510 1.00 22.40 H new ATOM 0 HD21 LEU A 122 -1.050 6.202 2.982 1.00 70.52 H new ATOM 0 HD22 LEU A 122 -0.155 5.303 1.733 1.00 70.52 H new ATOM 0 HD23 LEU A 122 0.327 5.173 3.442 1.00 70.52 H new ATOM 1839 N LEU A 123 5.207 5.655 2.087 1.00 75.43 N ATOM 1840 CA LEU A 123 6.405 5.137 1.417 1.00 1.30 C ATOM 1841 C LEU A 123 6.898 3.839 2.083 1.00 73.14 C ATOM 1842 O LEU A 123 7.059 2.812 1.424 1.00 3.22 O ATOM 1843 CB LEU A 123 7.518 6.196 1.440 1.00 43.44 C ATOM 1844 CG LEU A 123 8.802 5.830 0.673 1.00 63.13 C ATOM 1845 CD1 LEU A 123 8.507 5.634 -0.813 1.00 61.11 C ATOM 1846 CD2 LEU A 123 9.877 6.898 0.880 1.00 35.12 C ATOM 0 H LEU A 123 5.272 6.635 2.363 1.00 75.43 H new ATOM 0 HA LEU A 123 6.144 4.909 0.383 1.00 1.30 H new ATOM 0 HB2 LEU A 123 7.121 7.123 1.026 1.00 43.44 H new ATOM 0 HB3 LEU A 123 7.782 6.397 2.478 1.00 43.44 H new ATOM 0 HG LEU A 123 9.180 4.887 1.069 1.00 63.13 H new ATOM 0 HD11 LEU A 123 9.428 5.376 -1.336 1.00 61.11 H new ATOM 0 HD12 LEU A 123 7.782 4.830 -0.937 1.00 61.11 H new ATOM 0 HD13 LEU A 123 8.100 6.556 -1.228 1.00 61.11 H new ATOM 0 HD21 LEU A 123 10.776 6.621 0.330 1.00 35.12 H new ATOM 0 HD22 LEU A 123 9.511 7.858 0.516 1.00 35.12 H new ATOM 0 HD23 LEU A 123 10.111 6.978 1.942 1.00 35.12 H new ATOM 1858 N SER A 124 7.112 3.895 3.398 1.00 30.12 N ATOM 1859 CA SER A 124 7.581 2.731 4.170 1.00 52.11 C ATOM 1860 C SER A 124 6.597 1.546 4.093 1.00 53.32 C ATOM 1861 O SER A 124 6.999 0.409 3.835 1.00 52.43 O ATOM 1862 CB SER A 124 7.801 3.127 5.638 1.00 50.34 C ATOM 1863 OG SER A 124 8.233 2.023 6.420 1.00 12.21 O ATOM 0 H SER A 124 6.969 4.736 3.958 1.00 30.12 H new ATOM 0 HA SER A 124 8.523 2.407 3.728 1.00 52.11 H new ATOM 0 HB2 SER A 124 8.542 3.924 5.693 1.00 50.34 H new ATOM 0 HB3 SER A 124 6.874 3.525 6.051 1.00 50.34 H new ATOM 0 HG SER A 124 8.365 2.311 7.348 1.00 12.21 H new ATOM 1869 N CYS A 125 5.309 1.821 4.315 1.00 12.55 N ATOM 1870 CA CYS A 125 4.273 0.773 4.294 1.00 51.21 C ATOM 1871 C CYS A 125 4.160 0.111 2.912 1.00 73.01 C ATOM 1872 O CYS A 125 4.164 -1.114 2.798 1.00 73.33 O ATOM 1873 CB CYS A 125 2.909 1.353 4.705 1.00 2.21 C ATOM 1874 SG CYS A 125 2.868 2.052 6.377 1.00 60.10 S ATOM 0 H CYS A 125 4.954 2.757 4.511 1.00 12.55 H new ATOM 0 HA CYS A 125 4.572 0.009 5.012 1.00 51.21 H new ATOM 0 HB2 CYS A 125 2.628 2.129 3.993 1.00 2.21 H new ATOM 0 HB3 CYS A 125 2.157 0.567 4.634 1.00 2.21 H new ATOM 0 HG CYS A 125 3.334 3.265 6.352 1.00 60.10 H new ATOM 1880 N VAL A 126 4.069 0.930 1.865 1.00 11.43 N ATOM 1881 CA VAL A 126 3.937 0.430 0.488 1.00 73.14 C ATOM 1882 C VAL A 126 5.133 -0.451 0.079 1.00 32.32 C ATOM 1883 O VAL A 126 4.948 -1.572 -0.400 1.00 12.20 O ATOM 1884 CB VAL A 126 3.783 1.597 -0.526 1.00 44.44 C ATOM 1885 CG1 VAL A 126 3.774 1.080 -1.966 1.00 74.01 C ATOM 1886 CG2 VAL A 126 2.512 2.397 -0.236 1.00 73.41 C ATOM 0 H VAL A 126 4.084 1.947 1.940 1.00 11.43 H new ATOM 0 HA VAL A 126 3.035 -0.181 0.467 1.00 73.14 H new ATOM 0 HB VAL A 126 4.643 2.257 -0.411 1.00 44.44 H new ATOM 0 HG11 VAL A 126 3.665 1.919 -2.653 1.00 74.01 H new ATOM 0 HG12 VAL A 126 4.710 0.561 -2.172 1.00 74.01 H new ATOM 0 HG13 VAL A 126 2.940 0.391 -2.100 1.00 74.01 H new ATOM 0 HG21 VAL A 126 2.421 3.210 -0.956 1.00 73.41 H new ATOM 0 HG22 VAL A 126 1.644 1.743 -0.316 1.00 73.41 H new ATOM 0 HG23 VAL A 126 2.564 2.809 0.772 1.00 73.41 H new ATOM 1896 N GLN A 127 6.351 0.057 0.284 1.00 50.30 N ATOM 1897 CA GLN A 127 7.569 -0.693 -0.059 1.00 23.25 C ATOM 1898 C GLN A 127 7.659 -2.012 0.726 1.00 33.00 C ATOM 1899 O GLN A 127 8.229 -2.994 0.248 1.00 42.11 O ATOM 1900 CB GLN A 127 8.820 0.162 0.198 1.00 1.02 C ATOM 1901 CG GLN A 127 8.893 1.422 -0.662 1.00 54.55 C ATOM 1902 CD GLN A 127 10.152 2.239 -0.413 1.00 13.04 C ATOM 1903 OE1 GLN A 127 10.707 2.236 0.679 1.00 65.12 O ATOM 1904 NE2 GLN A 127 10.610 2.944 -1.425 1.00 32.32 N ATOM 0 H GLN A 127 6.523 0.980 0.684 1.00 50.30 H new ATOM 0 HA GLN A 127 7.517 -0.936 -1.120 1.00 23.25 H new ATOM 0 HB2 GLN A 127 8.843 0.449 1.249 1.00 1.02 H new ATOM 0 HB3 GLN A 127 9.707 -0.444 0.014 1.00 1.02 H new ATOM 0 HG2 GLN A 127 8.852 1.140 -1.714 1.00 54.55 H new ATOM 0 HG3 GLN A 127 8.019 2.042 -0.463 1.00 54.55 H new ATOM 0 HE21 GLN A 127 10.124 2.925 -2.322 1.00 32.32 H new ATOM 0 HE22 GLN A 127 11.451 3.510 -1.313 1.00 32.32 H new ATOM 1913 N GLU A 128 7.097 -2.022 1.934 1.00 11.32 N ATOM 1914 CA GLU A 128 7.024 -3.245 2.743 1.00 22.42 C ATOM 1915 C GLU A 128 6.015 -4.242 2.144 1.00 14.32 C ATOM 1916 O GLU A 128 6.323 -5.420 1.978 1.00 73.54 O ATOM 1917 CB GLU A 128 6.636 -2.900 4.189 1.00 30.52 C ATOM 1918 CG GLU A 128 6.576 -4.103 5.133 1.00 31.12 C ATOM 1919 CD GLU A 128 7.914 -4.815 5.306 1.00 63.43 C ATOM 1920 OE1 GLU A 128 8.967 -4.145 5.277 1.00 34.31 O ATOM 1921 OE2 GLU A 128 7.918 -6.047 5.510 1.00 14.23 O ATOM 0 H GLU A 128 6.685 -1.200 2.376 1.00 11.32 H new ATOM 0 HA GLU A 128 8.007 -3.715 2.742 1.00 22.42 H new ATOM 0 HB2 GLU A 128 7.354 -2.180 4.583 1.00 30.52 H new ATOM 0 HB3 GLU A 128 5.663 -2.409 4.184 1.00 30.52 H new ATOM 0 HG2 GLU A 128 6.223 -3.770 6.109 1.00 31.12 H new ATOM 0 HG3 GLU A 128 5.842 -4.815 4.754 1.00 31.12 H new ATOM 1928 N ILE A 129 4.815 -3.756 1.819 1.00 4.43 N ATOM 1929 CA ILE A 129 3.771 -4.594 1.205 1.00 75.54 C ATOM 1930 C ILE A 129 4.282 -5.291 -0.066 1.00 42.10 C ATOM 1931 O ILE A 129 4.190 -6.515 -0.195 1.00 32.35 O ATOM 1932 CB ILE A 129 2.510 -3.758 0.855 1.00 21.33 C ATOM 1933 CG1 ILE A 129 1.884 -3.169 2.131 1.00 50.20 C ATOM 1934 CG2 ILE A 129 1.488 -4.607 0.096 1.00 12.34 C ATOM 1935 CD1 ILE A 129 0.670 -2.302 1.875 1.00 54.33 C ATOM 0 H ILE A 129 4.538 -2.786 1.969 1.00 4.43 H new ATOM 0 HA ILE A 129 3.505 -5.352 1.942 1.00 75.54 H new ATOM 0 HB ILE A 129 2.814 -2.935 0.208 1.00 21.33 H new ATOM 0 HG12 ILE A 129 1.601 -3.986 2.796 1.00 50.20 H new ATOM 0 HG13 ILE A 129 2.636 -2.578 2.654 1.00 50.20 H new ATOM 0 HG21 ILE A 129 0.613 -4.000 -0.138 1.00 12.34 H new ATOM 0 HG22 ILE A 129 1.934 -4.973 -0.829 1.00 12.34 H new ATOM 0 HG23 ILE A 129 1.188 -5.453 0.714 1.00 12.34 H new ATOM 0 HD11 ILE A 129 0.286 -1.924 2.823 1.00 54.33 H new ATOM 0 HD12 ILE A 129 0.950 -1.464 1.237 1.00 54.33 H new ATOM 0 HD13 ILE A 129 -0.101 -2.893 1.381 1.00 54.33 H new ATOM 1947 N SER A 130 4.823 -4.507 -0.998 1.00 54.22 N ATOM 1948 CA SER A 130 5.378 -5.054 -2.244 1.00 14.13 C ATOM 1949 C SER A 130 6.479 -6.079 -1.947 1.00 74.13 C ATOM 1950 O SER A 130 6.530 -7.151 -2.553 1.00 64.13 O ATOM 1951 CB SER A 130 5.943 -3.933 -3.128 1.00 54.54 C ATOM 1952 OG SER A 130 6.999 -3.246 -2.475 1.00 34.33 O ATOM 0 H SER A 130 4.891 -3.492 -0.918 1.00 54.22 H new ATOM 0 HA SER A 130 4.567 -5.551 -2.777 1.00 14.13 H new ATOM 0 HB2 SER A 130 6.305 -4.354 -4.066 1.00 54.54 H new ATOM 0 HB3 SER A 130 5.149 -3.230 -3.379 1.00 54.54 H new ATOM 0 HG SER A 130 7.341 -2.539 -3.061 1.00 34.33 H new ATOM 1958 N ASP A 131 7.349 -5.745 -0.998 1.00 71.20 N ATOM 1959 CA ASP A 131 8.416 -6.649 -0.565 1.00 11.52 C ATOM 1960 C ASP A 131 7.846 -7.988 -0.055 1.00 35.22 C ATOM 1961 O ASP A 131 8.369 -9.052 -0.381 1.00 10.12 O ATOM 1962 CB ASP A 131 9.265 -5.977 0.518 1.00 22.11 C ATOM 1963 CG ASP A 131 10.418 -6.848 0.976 1.00 50.21 C ATOM 1964 OD1 ASP A 131 11.257 -7.227 0.133 1.00 43.43 O ATOM 1965 OD2 ASP A 131 10.489 -7.169 2.181 1.00 42.31 O ATOM 0 H ASP A 131 7.337 -4.849 -0.510 1.00 71.20 H new ATOM 0 HA ASP A 131 9.047 -6.867 -1.426 1.00 11.52 H new ATOM 0 HB2 ASP A 131 9.656 -5.034 0.136 1.00 22.11 H new ATOM 0 HB3 ASP A 131 8.633 -5.737 1.373 1.00 22.11 H new ATOM 1970 N VAL A 132 6.772 -7.931 0.737 1.00 0.43 N ATOM 1971 CA VAL A 132 6.091 -9.148 1.200 1.00 62.23 C ATOM 1972 C VAL A 132 5.585 -9.982 0.009 1.00 40.33 C ATOM 1973 O VAL A 132 5.710 -11.210 -0.011 1.00 73.51 O ATOM 1974 CB VAL A 132 4.898 -8.821 2.138 1.00 32.31 C ATOM 1975 CG1 VAL A 132 4.182 -10.099 2.569 1.00 14.34 C ATOM 1976 CG2 VAL A 132 5.364 -8.030 3.362 1.00 44.44 C ATOM 0 H VAL A 132 6.355 -7.062 1.071 1.00 0.43 H new ATOM 0 HA VAL A 132 6.826 -9.724 1.762 1.00 62.23 H new ATOM 0 HB VAL A 132 4.194 -8.203 1.581 1.00 32.31 H new ATOM 0 HG11 VAL A 132 3.350 -9.846 3.226 1.00 14.34 H new ATOM 0 HG12 VAL A 132 3.804 -10.619 1.689 1.00 14.34 H new ATOM 0 HG13 VAL A 132 4.880 -10.745 3.101 1.00 14.34 H new ATOM 0 HG21 VAL A 132 4.509 -7.814 4.003 1.00 44.44 H new ATOM 0 HG22 VAL A 132 6.095 -8.617 3.918 1.00 44.44 H new ATOM 0 HG23 VAL A 132 5.821 -7.095 3.038 1.00 44.44 H new ATOM 1986 N VAL A 133 5.026 -9.298 -0.985 1.00 14.11 N ATOM 1987 CA VAL A 133 4.568 -9.943 -2.221 1.00 73.30 C ATOM 1988 C VAL A 133 5.751 -10.545 -3.005 1.00 4.32 C ATOM 1989 O VAL A 133 5.589 -11.495 -3.770 1.00 32.23 O ATOM 1990 CB VAL A 133 3.801 -8.936 -3.121 1.00 41.32 C ATOM 1991 CG1 VAL A 133 3.300 -9.605 -4.399 1.00 2.13 C ATOM 1992 CG2 VAL A 133 2.640 -8.313 -2.352 1.00 55.34 C ATOM 0 H VAL A 133 4.877 -8.289 -0.962 1.00 14.11 H new ATOM 0 HA VAL A 133 3.891 -10.749 -1.937 1.00 73.30 H new ATOM 0 HB VAL A 133 4.495 -8.146 -3.408 1.00 41.32 H new ATOM 0 HG11 VAL A 133 2.767 -8.874 -5.008 1.00 2.13 H new ATOM 0 HG12 VAL A 133 4.148 -9.996 -4.961 1.00 2.13 H new ATOM 0 HG13 VAL A 133 2.627 -10.423 -4.142 1.00 2.13 H new ATOM 0 HG21 VAL A 133 2.113 -7.610 -2.996 1.00 55.34 H new ATOM 0 HG22 VAL A 133 1.954 -9.097 -2.032 1.00 55.34 H new ATOM 0 HG23 VAL A 133 3.023 -7.787 -1.478 1.00 55.34 H new ATOM 2002 N GLN A 134 6.947 -9.995 -2.794 1.00 5.24 N ATOM 2003 CA GLN A 134 8.164 -10.490 -3.451 1.00 45.04 C ATOM 2004 C GLN A 134 8.827 -11.637 -2.661 1.00 52.53 C ATOM 2005 O GLN A 134 9.960 -12.025 -2.957 1.00 64.23 O ATOM 2006 CB GLN A 134 9.177 -9.350 -3.631 1.00 2.23 C ATOM 2007 CG GLN A 134 8.709 -8.227 -4.553 1.00 45.45 C ATOM 2008 CD GLN A 134 9.758 -7.141 -4.727 1.00 50.05 C ATOM 2009 OE1 GLN A 134 10.956 -7.404 -4.670 1.00 22.24 O ATOM 2010 NE2 GLN A 134 9.322 -5.920 -4.946 1.00 72.30 N ATOM 0 H GLN A 134 7.103 -9.203 -2.171 1.00 5.24 H new ATOM 0 HA GLN A 134 7.862 -10.878 -4.424 1.00 45.04 H new ATOM 0 HB2 GLN A 134 9.407 -8.928 -2.653 1.00 2.23 H new ATOM 0 HB3 GLN A 134 10.105 -9.764 -4.026 1.00 2.23 H new ATOM 0 HG2 GLN A 134 8.457 -8.643 -5.528 1.00 45.45 H new ATOM 0 HG3 GLN A 134 7.798 -7.786 -4.149 1.00 45.45 H new ATOM 0 HE21 GLN A 134 8.320 -5.736 -4.987 1.00 72.30 H new ATOM 0 HE22 GLN A 134 9.986 -5.157 -5.075 1.00 72.30 H new ATOM 2019 N ARG A 135 8.126 -12.179 -1.662 1.00 12.14 N ATOM 2020 CA ARG A 135 8.657 -13.294 -0.852 1.00 32.44 C ATOM 2021 C ARG A 135 8.015 -14.643 -1.248 1.00 72.34 C ATOM 2022 O ARG A 135 7.175 -15.168 -0.480 1.00 37.19 O ATOM 2023 CB ARG A 135 8.428 -13.010 0.642 1.00 10.15 C ATOM 2024 CG ARG A 135 9.009 -11.678 1.099 1.00 25.24 C ATOM 2025 CD ARG A 135 8.690 -11.379 2.558 1.00 50.11 C ATOM 2026 NE ARG A 135 9.059 -10.012 2.925 1.00 30.24 N ATOM 2027 CZ ARG A 135 8.627 -9.395 3.992 1.00 65.42 C ATOM 2028 NH1 ARG A 135 7.869 -10.008 4.845 1.00 73.24 N ATOM 2029 NH2 ARG A 135 8.957 -8.166 4.203 1.00 54.23 N ATOM 2030 OXT ARG A 135 8.351 -15.163 -2.335 1.00 37.19 O ATOM 0 H ARG A 135 7.193 -11.870 -1.390 1.00 12.14 H new ATOM 0 HA ARG A 135 9.727 -13.371 -1.045 1.00 32.44 H new ATOM 0 HB2 ARG A 135 7.357 -13.021 0.847 1.00 10.15 H new ATOM 0 HB3 ARG A 135 8.873 -13.813 1.230 1.00 10.15 H new ATOM 0 HG2 ARG A 135 10.090 -11.689 0.961 1.00 25.24 H new ATOM 0 HG3 ARG A 135 8.615 -10.878 0.472 1.00 25.24 H new ATOM 0 HD2 ARG A 135 7.625 -11.528 2.735 1.00 50.11 H new ATOM 0 HD3 ARG A 135 9.221 -12.083 3.198 1.00 50.11 H new ATOM 0 HE ARG A 135 9.695 -9.508 2.307 1.00 30.24 H new ATOM 0 HH11 ARG A 135 7.605 -10.980 4.686 1.00 73.24 H new ATOM 0 HH12 ARG A 135 7.536 -9.518 5.676 1.00 73.24 H new ATOM 0 HH21 ARG A 135 9.555 -7.677 3.537 1.00 54.23 H new ATOM 0 HH22 ARG A 135 8.620 -7.683 5.036 1.00 54.23 H new