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 59 ASN : amide:sc= -3.76! C(o=-2.6!,f=-2.6!) USER MOD Set 1.2: A 107 SER OG : rot 76:sc= 1.19 USER MOD Set 2.1: A 83 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 86 LYS NZ :NH3+ -150:sc= -3.08! (180deg=-4.43!) USER MOD Set 3.1: A 61 GLN : amide:sc= -1.05 K(o=-0.31,f=-1.6!) USER MOD Set 3.2: A 65 THR OG1 : rot 74:sc= 0.74 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0187) USER MOD Single : A 45 CYS SG : rot 77:sc= 0.731 USER MOD Single : A 50 SER OG : rot 180:sc= -0.0243 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -40:sc= 0.899 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.57 K(o=-1.6,f=-3.4!) USER MOD Single : A 68 GLN : amide:sc= -0.078 K(o=-0.078,f=-0.64) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot 85:sc=-0.000911 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= -0.304 K(o=-0.3,f=-2.6) USER MOD Single : A 85 ASN : amide:sc= -0.201 K(o=-0.2,f=-10!) USER MOD Single : A 94 SER OG : rot 68:sc= 0.427 USER MOD Single : A 95 LYS NZ :NH3+ -165:sc= -0.0822 (180deg=-0.394) USER MOD Single : A 99 SER OG : rot 83:sc= 0.838 USER MOD Single : A 101 GLN : amide:sc= -0.469 X(o=-0.47,f=-0.47) USER MOD Single : A 104 GLN : amide:sc= -0.902 X(o=-0.9,f=-0.42) USER MOD Single : A 106 SER OG : rot 87:sc= 0.084 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -3.95! C(o=-4!,f=-6.5!) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 121 ASN : amide:sc= -2.02! K(o=-2!,f=-1.3) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 CYS SG : rot 69:sc= -0.665 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 130 SER OG : rot -78:sc= 0.548 USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 528 N LYS A 36 -7.632 -12.666 -10.783 1.00 71.14 N ATOM 529 CA LYS A 36 -7.189 -11.794 -11.875 1.00 60.13 C ATOM 530 C LYS A 36 -6.023 -10.907 -11.408 1.00 32.14 C ATOM 531 O LYS A 36 -5.158 -10.522 -12.202 1.00 3.44 O ATOM 532 CB LYS A 36 -8.379 -10.948 -12.373 1.00 22.43 C ATOM 533 CG LYS A 36 -8.106 -10.101 -13.623 1.00 70.12 C ATOM 534 CD LYS A 36 -7.535 -8.720 -13.287 1.00 52.10 C ATOM 535 CE LYS A 36 -7.306 -7.884 -14.543 1.00 12.20 C ATOM 536 NZ LYS A 36 -6.818 -6.517 -14.222 1.00 21.11 N ATOM 0 HA LYS A 36 -6.828 -12.401 -12.705 1.00 60.13 H new ATOM 0 HB2 LYS A 36 -9.215 -11.615 -12.582 1.00 22.43 H new ATOM 0 HB3 LYS A 36 -8.694 -10.285 -11.567 1.00 22.43 H new ATOM 0 HG2 LYS A 36 -7.408 -10.631 -14.271 1.00 70.12 H new ATOM 0 HG3 LYS A 36 -9.032 -9.980 -14.185 1.00 70.12 H new ATOM 0 HD2 LYS A 36 -8.219 -8.195 -12.620 1.00 52.10 H new ATOM 0 HD3 LYS A 36 -6.593 -8.836 -12.750 1.00 52.10 H new ATOM 0 HE2 LYS A 36 -6.582 -8.386 -15.185 1.00 12.20 H new ATOM 0 HE3 LYS A 36 -8.237 -7.814 -15.106 1.00 12.20 H new ATOM 0 HZ1 LYS A 36 -6.676 -5.983 -15.103 1.00 21.11 H new ATOM 0 HZ2 LYS A 36 -7.520 -6.028 -13.631 1.00 21.11 H new ATOM 0 HZ3 LYS A 36 -5.917 -6.582 -13.707 1.00 21.11 H new ATOM 550 N ILE A 37 -6.002 -10.592 -10.111 1.00 44.13 N ATOM 551 CA ILE A 37 -4.904 -9.823 -9.520 1.00 74.22 C ATOM 552 C ILE A 37 -3.604 -10.642 -9.520 1.00 52.14 C ATOM 553 O ILE A 37 -3.386 -11.493 -8.654 1.00 41.43 O ATOM 554 CB ILE A 37 -5.221 -9.378 -8.067 1.00 53.12 C ATOM 555 CG1 ILE A 37 -6.581 -8.662 -7.999 1.00 3.20 C ATOM 556 CG2 ILE A 37 -4.110 -8.475 -7.527 1.00 42.13 C ATOM 557 CD1 ILE A 37 -6.688 -7.444 -8.896 1.00 43.02 C ATOM 0 H ILE A 37 -6.732 -10.857 -9.450 1.00 44.13 H new ATOM 0 HA ILE A 37 -4.780 -8.932 -10.135 1.00 74.22 H new ATOM 0 HB ILE A 37 -5.275 -10.270 -7.442 1.00 53.12 H new ATOM 0 HG12 ILE A 37 -7.365 -9.369 -8.270 1.00 3.20 H new ATOM 0 HG13 ILE A 37 -6.768 -8.358 -6.969 1.00 3.20 H new ATOM 0 HG21 ILE A 37 -4.350 -8.173 -6.507 1.00 42.13 H new ATOM 0 HG22 ILE A 37 -3.165 -9.018 -7.532 1.00 42.13 H new ATOM 0 HG23 ILE A 37 -4.023 -7.589 -8.157 1.00 42.13 H new ATOM 0 HD11 ILE A 37 -7.677 -6.999 -8.788 1.00 43.02 H new ATOM 0 HD12 ILE A 37 -5.929 -6.715 -8.612 1.00 43.02 H new ATOM 0 HD13 ILE A 37 -6.535 -7.742 -9.933 1.00 43.02 H new ATOM 569 N SER A 38 -2.757 -10.402 -10.514 1.00 10.12 N ATOM 570 CA SER A 38 -1.479 -11.116 -10.635 1.00 72.41 C ATOM 571 C SER A 38 -0.359 -10.415 -9.856 1.00 55.53 C ATOM 572 O SER A 38 -0.419 -9.208 -9.611 1.00 14.01 O ATOM 573 CB SER A 38 -1.079 -11.241 -12.111 1.00 70.44 C ATOM 574 OG SER A 38 -2.085 -11.902 -12.865 1.00 63.41 O ATOM 0 H SER A 38 -2.927 -9.719 -11.252 1.00 10.12 H new ATOM 0 HA SER A 38 -1.618 -12.109 -10.207 1.00 72.41 H new ATOM 0 HB2 SER A 38 -0.903 -10.249 -12.527 1.00 70.44 H new ATOM 0 HB3 SER A 38 -0.142 -11.791 -12.190 1.00 70.44 H new ATOM 0 HG SER A 38 -1.803 -11.966 -13.801 1.00 63.41 H new ATOM 580 N LYS A 39 0.667 -11.180 -9.485 1.00 11.15 N ATOM 581 CA LYS A 39 1.822 -10.652 -8.743 1.00 31.32 C ATOM 582 C LYS A 39 2.408 -9.395 -9.411 1.00 14.13 C ATOM 583 O LYS A 39 2.673 -8.393 -8.745 1.00 10.31 O ATOM 584 CB LYS A 39 2.888 -11.752 -8.610 1.00 63.31 C ATOM 585 CG LYS A 39 4.156 -11.322 -7.876 1.00 65.11 C ATOM 586 CD LYS A 39 5.039 -12.523 -7.539 1.00 35.34 C ATOM 587 CE LYS A 39 6.371 -12.106 -6.923 1.00 1.43 C ATOM 588 NZ LYS A 39 7.283 -11.492 -7.925 1.00 54.31 N ATOM 0 H LYS A 39 0.726 -12.178 -9.687 1.00 11.15 H new ATOM 0 HA LYS A 39 1.486 -10.352 -7.751 1.00 31.32 H new ATOM 0 HB2 LYS A 39 2.451 -12.602 -8.086 1.00 63.31 H new ATOM 0 HB3 LYS A 39 3.161 -12.098 -9.607 1.00 63.31 H new ATOM 0 HG2 LYS A 39 4.715 -10.619 -8.494 1.00 65.11 H new ATOM 0 HG3 LYS A 39 3.887 -10.797 -6.959 1.00 65.11 H new ATOM 0 HD2 LYS A 39 4.510 -13.178 -6.846 1.00 35.34 H new ATOM 0 HD3 LYS A 39 5.225 -13.100 -8.445 1.00 35.34 H new ATOM 0 HE2 LYS A 39 6.190 -11.397 -6.115 1.00 1.43 H new ATOM 0 HE3 LYS A 39 6.854 -12.977 -6.480 1.00 1.43 H new ATOM 0 HZ1 LYS A 39 8.177 -12.022 -7.951 1.00 54.31 H new ATOM 0 HZ2 LYS A 39 6.836 -11.520 -8.864 1.00 54.31 H new ATOM 0 HZ3 LYS A 39 7.474 -10.504 -7.661 1.00 54.31 H new ATOM 602 N GLU A 40 2.588 -9.451 -10.731 1.00 41.43 N ATOM 603 CA GLU A 40 3.066 -8.297 -11.505 1.00 21.31 C ATOM 604 C GLU A 40 2.165 -7.063 -11.308 1.00 24.23 C ATOM 605 O GLU A 40 2.653 -5.957 -11.083 1.00 1.21 O ATOM 606 CB GLU A 40 3.137 -8.659 -13.000 1.00 25.33 C ATOM 607 CG GLU A 40 1.815 -9.158 -13.582 1.00 64.42 C ATOM 608 CD GLU A 40 1.898 -9.442 -15.076 1.00 31.05 C ATOM 609 OE1 GLU A 40 2.283 -10.568 -15.453 1.00 4.22 O ATOM 610 OE2 GLU A 40 1.584 -8.537 -15.877 1.00 44.44 O ATOM 0 H GLU A 40 2.410 -10.285 -11.291 1.00 41.43 H new ATOM 0 HA GLU A 40 4.062 -8.044 -11.141 1.00 21.31 H new ATOM 0 HB2 GLU A 40 3.461 -7.782 -13.561 1.00 25.33 H new ATOM 0 HB3 GLU A 40 3.897 -9.427 -13.142 1.00 25.33 H new ATOM 0 HG2 GLU A 40 1.513 -10.066 -13.060 1.00 64.42 H new ATOM 0 HG3 GLU A 40 1.039 -8.414 -13.401 1.00 64.42 H new ATOM 617 N ALA A 41 0.848 -7.270 -11.367 1.00 65.32 N ATOM 618 CA ALA A 41 -0.123 -6.172 -11.269 1.00 53.33 C ATOM 619 C ALA A 41 -0.032 -5.448 -9.919 1.00 31.24 C ATOM 620 O ALA A 41 -0.022 -4.217 -9.862 1.00 45.20 O ATOM 621 CB ALA A 41 -1.537 -6.699 -11.494 1.00 41.11 C ATOM 0 H ALA A 41 0.425 -8.191 -11.483 1.00 65.32 H new ATOM 0 HA ALA A 41 0.118 -5.447 -12.046 1.00 53.33 H new ATOM 0 HB1 ALA A 41 -2.248 -5.876 -11.419 1.00 41.11 H new ATOM 0 HB2 ALA A 41 -1.605 -7.148 -12.485 1.00 41.11 H new ATOM 0 HB3 ALA A 41 -1.770 -7.450 -10.739 1.00 41.11 H new ATOM 627 N LEU A 42 0.038 -6.219 -8.837 1.00 44.35 N ATOM 628 CA LEU A 42 0.139 -5.651 -7.488 1.00 62.02 C ATOM 629 C LEU A 42 1.418 -4.812 -7.350 1.00 3.31 C ATOM 630 O LEU A 42 1.371 -3.657 -6.921 1.00 43.43 O ATOM 631 CB LEU A 42 0.106 -6.779 -6.437 1.00 51.11 C ATOM 632 CG LEU A 42 -0.046 -6.339 -4.961 1.00 31.32 C ATOM 633 CD1 LEU A 42 -0.568 -7.496 -4.115 1.00 15.23 C ATOM 634 CD2 LEU A 42 1.277 -5.830 -4.384 1.00 62.33 C ATOM 0 H LEU A 42 0.027 -7.239 -8.864 1.00 44.35 H new ATOM 0 HA LEU A 42 -0.714 -4.994 -7.318 1.00 62.02 H new ATOM 0 HB2 LEU A 42 -0.719 -7.449 -6.681 1.00 51.11 H new ATOM 0 HB3 LEU A 42 1.025 -7.358 -6.528 1.00 51.11 H new ATOM 0 HG LEU A 42 -0.763 -5.518 -4.935 1.00 31.32 H new ATOM 0 HD11 LEU A 42 -0.670 -7.172 -3.079 1.00 15.23 H new ATOM 0 HD12 LEU A 42 -1.540 -7.814 -4.493 1.00 15.23 H new ATOM 0 HD13 LEU A 42 0.132 -8.330 -4.167 1.00 15.23 H new ATOM 0 HD21 LEU A 42 1.130 -5.530 -3.346 1.00 62.33 H new ATOM 0 HD22 LEU A 42 2.023 -6.623 -4.431 1.00 62.33 H new ATOM 0 HD23 LEU A 42 1.621 -4.973 -4.964 1.00 62.33 H new ATOM 646 N LEU A 43 2.556 -5.398 -7.725 1.00 62.34 N ATOM 647 CA LEU A 43 3.847 -4.704 -7.646 1.00 64.24 C ATOM 648 C LEU A 43 3.844 -3.408 -8.475 1.00 14.40 C ATOM 649 O LEU A 43 4.309 -2.367 -8.013 1.00 23.34 O ATOM 650 CB LEU A 43 4.975 -5.633 -8.115 1.00 13.25 C ATOM 651 CG LEU A 43 5.145 -6.923 -7.294 1.00 13.10 C ATOM 652 CD1 LEU A 43 6.245 -7.801 -7.879 1.00 2.01 C ATOM 653 CD2 LEU A 43 5.435 -6.602 -5.829 1.00 33.11 C ATOM 0 H LEU A 43 2.612 -6.350 -8.086 1.00 62.34 H new ATOM 0 HA LEU A 43 4.017 -4.431 -6.605 1.00 64.24 H new ATOM 0 HB2 LEU A 43 4.792 -5.904 -9.155 1.00 13.25 H new ATOM 0 HB3 LEU A 43 5.914 -5.079 -8.091 1.00 13.25 H new ATOM 0 HG LEU A 43 4.207 -7.476 -7.343 1.00 13.10 H new ATOM 0 HD11 LEU A 43 6.345 -8.706 -7.280 1.00 2.01 H new ATOM 0 HD12 LEU A 43 5.989 -8.070 -8.904 1.00 2.01 H new ATOM 0 HD13 LEU A 43 7.189 -7.255 -7.872 1.00 2.01 H new ATOM 0 HD21 LEU A 43 5.551 -7.530 -5.269 1.00 33.11 H new ATOM 0 HD22 LEU A 43 6.353 -6.019 -5.759 1.00 33.11 H new ATOM 0 HD23 LEU A 43 4.608 -6.028 -5.412 1.00 33.11 H new ATOM 665 N GLU A 44 3.313 -3.481 -9.697 1.00 70.24 N ATOM 666 CA GLU A 44 3.198 -2.307 -10.575 1.00 42.41 C ATOM 667 C GLU A 44 2.352 -1.191 -9.937 1.00 64.44 C ATOM 668 O GLU A 44 2.740 -0.019 -9.948 1.00 31.23 O ATOM 669 CB GLU A 44 2.581 -2.719 -11.918 1.00 74.43 C ATOM 670 CG GLU A 44 3.509 -3.552 -12.800 1.00 63.22 C ATOM 671 CD GLU A 44 4.717 -2.767 -13.282 1.00 73.50 C ATOM 672 OE1 GLU A 44 4.565 -1.945 -14.209 1.00 12.55 O ATOM 673 OE2 GLU A 44 5.826 -2.967 -12.740 1.00 15.51 O ATOM 0 H GLU A 44 2.953 -4.344 -10.106 1.00 70.24 H new ATOM 0 HA GLU A 44 4.203 -1.914 -10.732 1.00 42.41 H new ATOM 0 HB2 GLU A 44 1.670 -3.287 -11.728 1.00 74.43 H new ATOM 0 HB3 GLU A 44 2.289 -1.821 -12.462 1.00 74.43 H new ATOM 0 HG2 GLU A 44 3.847 -4.425 -12.242 1.00 63.22 H new ATOM 0 HG3 GLU A 44 2.952 -3.920 -13.662 1.00 63.22 H new ATOM 680 N CYS A 45 1.195 -1.563 -9.388 1.00 42.25 N ATOM 681 CA CYS A 45 0.297 -0.598 -8.735 1.00 60.32 C ATOM 682 C CYS A 45 0.957 0.038 -7.502 1.00 74.30 C ATOM 683 O CYS A 45 0.813 1.233 -7.256 1.00 23.31 O ATOM 684 CB CYS A 45 -1.019 -1.276 -8.325 1.00 32.22 C ATOM 685 SG CYS A 45 -2.004 -1.894 -9.711 1.00 21.41 S ATOM 0 H CYS A 45 0.854 -2.524 -9.380 1.00 42.25 H new ATOM 0 HA CYS A 45 0.085 0.191 -9.457 1.00 60.32 H new ATOM 0 HB2 CYS A 45 -0.793 -2.107 -7.657 1.00 32.22 H new ATOM 0 HB3 CYS A 45 -1.619 -0.565 -7.757 1.00 32.22 H new ATOM 0 HG CYS A 45 -1.480 -2.997 -10.158 1.00 21.41 H new ATOM 691 N ALA A 46 1.682 -0.772 -6.734 1.00 75.23 N ATOM 692 CA ALA A 46 2.365 -0.291 -5.528 1.00 42.31 C ATOM 693 C ALA A 46 3.563 0.610 -5.870 1.00 22.23 C ATOM 694 O ALA A 46 3.807 1.615 -5.196 1.00 3.33 O ATOM 695 CB ALA A 46 2.808 -1.473 -4.679 1.00 74.24 C ATOM 0 H ALA A 46 1.814 -1.766 -6.923 1.00 75.23 H new ATOM 0 HA ALA A 46 1.659 0.315 -4.960 1.00 42.31 H new ATOM 0 HB1 ALA A 46 3.315 -1.109 -3.785 1.00 74.24 H new ATOM 0 HB2 ALA A 46 1.936 -2.060 -4.389 1.00 74.24 H new ATOM 0 HB3 ALA A 46 3.491 -2.098 -5.254 1.00 74.24 H new ATOM 701 N ASP A 47 4.298 0.249 -6.925 1.00 55.41 N ATOM 702 CA ASP A 47 5.463 1.030 -7.376 1.00 71.45 C ATOM 703 C ASP A 47 5.068 2.492 -7.660 1.00 21.34 C ATOM 704 O ASP A 47 5.873 3.409 -7.513 1.00 5.33 O ATOM 705 CB ASP A 47 6.064 0.385 -8.634 1.00 0.32 C ATOM 706 CG ASP A 47 7.472 0.875 -8.934 1.00 5.52 C ATOM 707 OD1 ASP A 47 7.630 2.031 -9.382 1.00 3.32 O ATOM 708 OD2 ASP A 47 8.436 0.106 -8.721 1.00 74.40 O ATOM 0 H ASP A 47 4.110 -0.581 -7.487 1.00 55.41 H new ATOM 0 HA ASP A 47 6.210 1.031 -6.582 1.00 71.45 H new ATOM 0 HB2 ASP A 47 6.080 -0.698 -8.509 1.00 0.32 H new ATOM 0 HB3 ASP A 47 5.421 0.598 -9.488 1.00 0.32 H new ATOM 713 N LEU A 48 3.811 2.692 -8.058 1.00 14.14 N ATOM 714 CA LEU A 48 3.272 4.032 -8.316 1.00 64.52 C ATOM 715 C LEU A 48 3.372 4.944 -7.084 1.00 21.34 C ATOM 716 O LEU A 48 3.649 6.136 -7.211 1.00 45.33 O ATOM 717 CB LEU A 48 1.809 3.933 -8.764 1.00 24.35 C ATOM 718 CG LEU A 48 1.588 3.304 -10.148 1.00 11.31 C ATOM 719 CD1 LEU A 48 0.097 3.121 -10.426 1.00 35.03 C ATOM 720 CD2 LEU A 48 2.245 4.163 -11.229 1.00 22.02 C ATOM 0 H LEU A 48 3.141 1.938 -8.210 1.00 14.14 H new ATOM 0 HA LEU A 48 3.875 4.476 -9.108 1.00 64.52 H new ATOM 0 HB2 LEU A 48 1.259 3.350 -8.026 1.00 24.35 H new ATOM 0 HB3 LEU A 48 1.378 4.934 -8.765 1.00 24.35 H new ATOM 0 HG LEU A 48 2.054 2.319 -10.162 1.00 11.31 H new ATOM 0 HD11 LEU A 48 -0.037 2.674 -11.411 1.00 35.03 H new ATOM 0 HD12 LEU A 48 -0.337 2.468 -9.669 1.00 35.03 H new ATOM 0 HD13 LEU A 48 -0.400 4.090 -10.396 1.00 35.03 H new ATOM 0 HD21 LEU A 48 2.082 3.707 -12.205 1.00 22.02 H new ATOM 0 HD22 LEU A 48 1.807 5.161 -11.217 1.00 22.02 H new ATOM 0 HD23 LEU A 48 3.315 4.234 -11.036 1.00 22.02 H new ATOM 732 N LEU A 49 3.145 4.385 -5.897 1.00 42.40 N ATOM 733 CA LEU A 49 3.194 5.170 -4.660 1.00 32.20 C ATOM 734 C LEU A 49 4.642 5.500 -4.274 1.00 43.24 C ATOM 735 O LEU A 49 4.973 6.654 -4.010 1.00 34.21 O ATOM 736 CB LEU A 49 2.489 4.440 -3.501 1.00 43.24 C ATOM 737 CG LEU A 49 0.964 4.260 -3.649 1.00 5.24 C ATOM 738 CD1 LEU A 49 0.630 3.226 -4.720 1.00 35.43 C ATOM 739 CD2 LEU A 49 0.323 3.881 -2.313 1.00 15.11 C ATOM 0 H LEU A 49 2.926 3.398 -5.763 1.00 42.40 H new ATOM 0 HA LEU A 49 2.662 6.103 -4.848 1.00 32.20 H new ATOM 0 HB2 LEU A 49 2.943 3.455 -3.387 1.00 43.24 H new ATOM 0 HB3 LEU A 49 2.683 4.989 -2.579 1.00 43.24 H new ATOM 0 HG LEU A 49 0.549 5.217 -3.965 1.00 5.24 H new ATOM 0 HD11 LEU A 49 -0.452 3.122 -4.800 1.00 35.43 H new ATOM 0 HD12 LEU A 49 1.035 3.551 -5.678 1.00 35.43 H new ATOM 0 HD13 LEU A 49 1.068 2.266 -4.448 1.00 35.43 H new ATOM 0 HD21 LEU A 49 -0.752 3.760 -2.446 1.00 15.11 H new ATOM 0 HD22 LEU A 49 0.752 2.944 -1.956 1.00 15.11 H new ATOM 0 HD23 LEU A 49 0.512 4.668 -1.583 1.00 15.11 H new ATOM 751 N SER A 50 5.508 4.485 -4.258 1.00 64.21 N ATOM 752 CA SER A 50 6.932 4.687 -3.946 1.00 13.44 C ATOM 753 C SER A 50 7.580 5.664 -4.937 1.00 60.41 C ATOM 754 O SER A 50 8.372 6.526 -4.553 1.00 43.31 O ATOM 755 CB SER A 50 7.684 3.348 -3.965 1.00 3.53 C ATOM 756 OG SER A 50 7.523 2.686 -5.209 1.00 23.03 O ATOM 0 H SER A 50 5.254 3.517 -4.456 1.00 64.21 H new ATOM 0 HA SER A 50 6.996 5.115 -2.946 1.00 13.44 H new ATOM 0 HB2 SER A 50 8.744 3.521 -3.777 1.00 3.53 H new ATOM 0 HB3 SER A 50 7.317 2.710 -3.161 1.00 3.53 H new ATOM 0 HG SER A 50 8.013 1.838 -5.194 1.00 23.03 H new ATOM 762 N SER A 51 7.231 5.523 -6.213 1.00 50.51 N ATOM 763 CA SER A 51 7.716 6.434 -7.260 1.00 14.50 C ATOM 764 C SER A 51 7.210 7.869 -7.052 1.00 70.32 C ATOM 765 O SER A 51 7.982 8.823 -7.107 1.00 0.42 O ATOM 766 CB SER A 51 7.279 5.937 -8.645 1.00 43.00 C ATOM 767 OG SER A 51 7.697 6.820 -9.679 1.00 24.13 O ATOM 0 H SER A 51 6.613 4.786 -6.553 1.00 50.51 H new ATOM 0 HA SER A 51 8.804 6.444 -7.197 1.00 14.50 H new ATOM 0 HB2 SER A 51 7.695 4.945 -8.823 1.00 43.00 H new ATOM 0 HB3 SER A 51 6.194 5.836 -8.669 1.00 43.00 H new ATOM 0 HG SER A 51 7.403 6.471 -10.546 1.00 24.13 H new ATOM 773 N ALA A 52 5.910 8.011 -6.808 1.00 33.55 N ATOM 774 CA ALA A 52 5.286 9.333 -6.666 1.00 31.23 C ATOM 775 C ALA A 52 5.790 10.093 -5.425 1.00 72.14 C ATOM 776 O ALA A 52 5.965 11.306 -5.465 1.00 53.55 O ATOM 777 CB ALA A 52 3.767 9.194 -6.627 1.00 31.34 C ATOM 0 H ALA A 52 5.264 7.229 -6.704 1.00 33.55 H new ATOM 0 HA ALA A 52 5.574 9.923 -7.536 1.00 31.23 H new ATOM 0 HB1 ALA A 52 3.314 10.180 -6.522 1.00 31.34 H new ATOM 0 HB2 ALA A 52 3.420 8.732 -7.551 1.00 31.34 H new ATOM 0 HB3 ALA A 52 3.480 8.570 -5.780 1.00 31.34 H new ATOM 783 N LEU A 53 6.031 9.373 -4.330 1.00 32.43 N ATOM 784 CA LEU A 53 6.469 9.999 -3.071 1.00 23.45 C ATOM 785 C LEU A 53 7.883 10.609 -3.162 1.00 21.23 C ATOM 786 O LEU A 53 8.267 11.423 -2.314 1.00 44.00 O ATOM 787 CB LEU A 53 6.409 8.978 -1.927 1.00 23.34 C ATOM 788 CG LEU A 53 4.993 8.521 -1.538 1.00 60.12 C ATOM 789 CD1 LEU A 53 5.041 7.418 -0.485 1.00 10.23 C ATOM 790 CD2 LEU A 53 4.165 9.701 -1.039 1.00 45.43 C ATOM 0 H LEU A 53 5.932 8.359 -4.283 1.00 32.43 H new ATOM 0 HA LEU A 53 5.782 10.822 -2.872 1.00 23.45 H new ATOM 0 HB2 LEU A 53 6.992 8.102 -2.211 1.00 23.34 H new ATOM 0 HB3 LEU A 53 6.889 9.410 -1.049 1.00 23.34 H new ATOM 0 HG LEU A 53 4.515 8.115 -2.430 1.00 60.12 H new ATOM 0 HD11 LEU A 53 4.026 7.115 -0.229 1.00 10.23 H new ATOM 0 HD12 LEU A 53 5.587 6.561 -0.880 1.00 10.23 H new ATOM 0 HD13 LEU A 53 5.545 7.789 0.408 1.00 10.23 H new ATOM 0 HD21 LEU A 53 3.167 9.357 -0.769 1.00 45.43 H new ATOM 0 HD22 LEU A 53 4.646 10.140 -0.165 1.00 45.43 H new ATOM 0 HD23 LEU A 53 4.089 10.451 -1.826 1.00 45.43 H new ATOM 802 N THR A 54 8.658 10.216 -4.177 1.00 22.25 N ATOM 803 CA THR A 54 10.021 10.753 -4.372 1.00 62.53 C ATOM 804 C THR A 54 10.021 11.976 -5.302 1.00 63.41 C ATOM 805 O THR A 54 11.068 12.574 -5.564 1.00 33.34 O ATOM 806 CB THR A 54 10.989 9.689 -4.948 1.00 22.02 C ATOM 807 OG1 THR A 54 10.561 9.270 -6.255 1.00 55.41 O ATOM 808 CG2 THR A 54 11.077 8.478 -4.022 1.00 43.23 C ATOM 0 H THR A 54 8.373 9.531 -4.877 1.00 22.25 H new ATOM 0 HA THR A 54 10.369 11.050 -3.383 1.00 62.53 H new ATOM 0 HB THR A 54 11.977 10.143 -5.027 1.00 22.02 H new ATOM 0 HG1 THR A 54 9.584 9.190 -6.269 1.00 55.41 H new ATOM 0 HG21 THR A 54 11.762 7.744 -4.447 1.00 43.23 H new ATOM 0 HG22 THR A 54 11.443 8.793 -3.045 1.00 43.23 H new ATOM 0 HG23 THR A 54 10.089 8.031 -3.913 1.00 43.23 H new ATOM 816 N GLU A 55 8.841 12.346 -5.788 1.00 21.01 N ATOM 817 CA GLU A 55 8.669 13.524 -6.650 1.00 1.11 C ATOM 818 C GLU A 55 7.473 14.365 -6.166 1.00 1.10 C ATOM 819 O GLU A 55 6.705 13.913 -5.316 1.00 34.50 O ATOM 820 CB GLU A 55 8.462 13.080 -8.108 1.00 64.35 C ATOM 821 CG GLU A 55 7.225 12.211 -8.327 1.00 45.22 C ATOM 822 CD GLU A 55 7.045 11.810 -9.782 1.00 70.04 C ATOM 823 OE1 GLU A 55 7.741 10.882 -10.240 1.00 40.13 O ATOM 824 OE2 GLU A 55 6.214 12.429 -10.482 1.00 65.02 O ATOM 0 H GLU A 55 7.974 11.843 -5.599 1.00 21.01 H new ATOM 0 HA GLU A 55 9.567 14.139 -6.597 1.00 1.11 H new ATOM 0 HB2 GLU A 55 8.387 13.966 -8.739 1.00 64.35 H new ATOM 0 HB3 GLU A 55 9.343 12.529 -8.437 1.00 64.35 H new ATOM 0 HG2 GLU A 55 7.302 11.314 -7.713 1.00 45.22 H new ATOM 0 HG3 GLU A 55 6.341 12.752 -7.991 1.00 45.22 H new ATOM 831 N PRO A 56 7.291 15.607 -6.663 1.00 52.35 N ATOM 832 CA PRO A 56 6.122 16.410 -6.276 1.00 71.14 C ATOM 833 C PRO A 56 4.817 15.883 -6.898 1.00 2.01 C ATOM 834 O PRO A 56 4.676 15.809 -8.120 1.00 43.14 O ATOM 835 CB PRO A 56 6.460 17.807 -6.818 1.00 73.23 C ATOM 836 CG PRO A 56 7.388 17.557 -7.960 1.00 54.32 C ATOM 837 CD PRO A 56 8.187 16.332 -7.588 1.00 71.13 C ATOM 0 HA PRO A 56 5.946 16.388 -5.201 1.00 71.14 H new ATOM 0 HB2 PRO A 56 5.563 18.333 -7.145 1.00 73.23 H new ATOM 0 HB3 PRO A 56 6.931 18.425 -6.053 1.00 73.23 H new ATOM 0 HG2 PRO A 56 6.834 17.395 -8.885 1.00 54.32 H new ATOM 0 HG3 PRO A 56 8.042 18.413 -8.126 1.00 54.32 H new ATOM 0 HD2 PRO A 56 8.432 15.731 -8.464 1.00 71.13 H new ATOM 0 HD3 PRO A 56 9.130 16.597 -7.109 1.00 71.13 H new ATOM 845 N VAL A 57 3.862 15.531 -6.042 1.00 63.45 N ATOM 846 CA VAL A 57 2.535 15.073 -6.471 1.00 2.52 C ATOM 847 C VAL A 57 1.450 15.599 -5.520 1.00 41.14 C ATOM 848 O VAL A 57 1.712 15.819 -4.334 1.00 34.13 O ATOM 849 CB VAL A 57 2.444 13.519 -6.526 1.00 70.44 C ATOM 850 CG1 VAL A 57 3.262 12.953 -7.685 1.00 13.02 C ATOM 851 CG2 VAL A 57 2.890 12.904 -5.199 1.00 53.14 C ATOM 0 H VAL A 57 3.982 15.554 -5.029 1.00 63.45 H new ATOM 0 HA VAL A 57 2.376 15.466 -7.475 1.00 2.52 H new ATOM 0 HB VAL A 57 1.400 13.254 -6.696 1.00 70.44 H new ATOM 0 HG11 VAL A 57 3.177 11.866 -7.694 1.00 13.02 H new ATOM 0 HG12 VAL A 57 2.886 13.355 -8.626 1.00 13.02 H new ATOM 0 HG13 VAL A 57 4.308 13.234 -7.563 1.00 13.02 H new ATOM 0 HG21 VAL A 57 2.819 11.818 -5.259 1.00 53.14 H new ATOM 0 HG22 VAL A 57 3.922 13.189 -4.994 1.00 53.14 H new ATOM 0 HG23 VAL A 57 2.248 13.266 -4.396 1.00 53.14 H new ATOM 861 N PRO A 58 0.219 15.825 -6.016 1.00 41.24 N ATOM 862 CA PRO A 58 -0.908 16.199 -5.150 1.00 73.13 C ATOM 863 C PRO A 58 -1.332 15.042 -4.224 1.00 11.34 C ATOM 864 O PRO A 58 -1.558 13.922 -4.682 1.00 50.22 O ATOM 865 CB PRO A 58 -2.026 16.555 -6.142 1.00 63.35 C ATOM 866 CG PRO A 58 -1.669 15.845 -7.408 1.00 13.45 C ATOM 867 CD PRO A 58 -0.164 15.755 -7.440 1.00 72.33 C ATOM 0 HA PRO A 58 -0.658 17.019 -4.477 1.00 73.13 H new ATOM 0 HB2 PRO A 58 -2.999 16.233 -5.771 1.00 63.35 H new ATOM 0 HB3 PRO A 58 -2.085 17.632 -6.298 1.00 63.35 H new ATOM 0 HG2 PRO A 58 -2.117 14.852 -7.435 1.00 13.45 H new ATOM 0 HG3 PRO A 58 -2.044 16.388 -8.276 1.00 13.45 H new ATOM 0 HD2 PRO A 58 0.172 14.826 -7.900 1.00 72.33 H new ATOM 0 HD3 PRO A 58 0.274 16.572 -8.014 1.00 72.33 H new ATOM 875 N ASN A 59 -1.446 15.316 -2.925 1.00 1.15 N ATOM 876 CA ASN A 59 -1.812 14.283 -1.944 1.00 61.25 C ATOM 877 C ASN A 59 -3.137 13.589 -2.313 1.00 23.45 C ATOM 878 O ASN A 59 -3.345 12.415 -1.995 1.00 21.32 O ATOM 879 CB ASN A 59 -1.896 14.890 -0.538 1.00 50.41 C ATOM 880 CG ASN A 59 -0.552 15.408 -0.052 1.00 34.34 C ATOM 881 OD1 ASN A 59 -0.202 16.566 -0.253 1.00 74.55 O ATOM 882 ND2 ASN A 59 0.217 14.550 0.584 1.00 34.23 N ATOM 0 H ASN A 59 -1.292 16.241 -2.524 1.00 1.15 H new ATOM 0 HA ASN A 59 -1.031 13.523 -1.956 1.00 61.25 H new ATOM 0 HB2 ASN A 59 -2.618 15.706 -0.540 1.00 50.41 H new ATOM 0 HB3 ASN A 59 -2.266 14.138 0.159 1.00 50.41 H new ATOM 0 HD21 ASN A 59 1.133 14.842 0.925 1.00 34.23 H new ATOM 0 HD22 ASN A 59 -0.103 13.593 0.736 1.00 34.23 H new ATOM 889 N SER A 60 -4.023 14.321 -2.988 1.00 61.54 N ATOM 890 CA SER A 60 -5.272 13.748 -3.516 1.00 40.40 C ATOM 891 C SER A 60 -4.981 12.589 -4.486 1.00 13.23 C ATOM 892 O SER A 60 -5.637 11.548 -4.448 1.00 71.43 O ATOM 893 CB SER A 60 -6.095 14.830 -4.233 1.00 60.30 C ATOM 894 OG SER A 60 -6.383 15.916 -3.363 1.00 41.23 O ATOM 0 H SER A 60 -3.903 15.315 -3.185 1.00 61.54 H new ATOM 0 HA SER A 60 -5.845 13.360 -2.674 1.00 40.40 H new ATOM 0 HB2 SER A 60 -5.546 15.192 -5.102 1.00 60.30 H new ATOM 0 HB3 SER A 60 -7.026 14.399 -4.601 1.00 60.30 H new ATOM 0 HG SER A 60 -6.906 16.591 -3.844 1.00 41.23 H new ATOM 900 N GLN A 61 -3.977 12.783 -5.345 1.00 2.41 N ATOM 901 CA GLN A 61 -3.529 11.751 -6.294 1.00 10.23 C ATOM 902 C GLN A 61 -2.983 10.521 -5.549 1.00 54.12 C ATOM 903 O GLN A 61 -3.224 9.381 -5.947 1.00 13.52 O ATOM 904 CB GLN A 61 -2.457 12.354 -7.226 1.00 42.10 C ATOM 905 CG GLN A 61 -1.858 11.398 -8.264 1.00 43.02 C ATOM 906 CD GLN A 61 -0.758 10.498 -7.712 1.00 13.20 C ATOM 907 OE1 GLN A 61 -0.064 10.850 -6.767 1.00 33.41 O ATOM 908 NE2 GLN A 61 -0.581 9.340 -8.314 1.00 43.21 N ATOM 0 H GLN A 61 -3.451 13.655 -5.405 1.00 2.41 H new ATOM 0 HA GLN A 61 -4.377 11.418 -6.892 1.00 10.23 H new ATOM 0 HB2 GLN A 61 -2.896 13.202 -7.752 1.00 42.10 H new ATOM 0 HB3 GLN A 61 -1.647 12.745 -6.611 1.00 42.10 H new ATOM 0 HG2 GLN A 61 -2.654 10.775 -8.671 1.00 43.02 H new ATOM 0 HG3 GLN A 61 -1.455 11.982 -9.092 1.00 43.02 H new ATOM 0 HE21 GLN A 61 -1.177 9.077 -9.099 1.00 43.21 H new ATOM 0 HE22 GLN A 61 0.152 8.706 -7.995 1.00 43.21 H new ATOM 917 N LEU A 62 -2.240 10.765 -4.472 1.00 21.11 N ATOM 918 CA LEU A 62 -1.704 9.684 -3.634 1.00 52.44 C ATOM 919 C LEU A 62 -2.828 8.828 -3.030 1.00 30.14 C ATOM 920 O LEU A 62 -2.814 7.599 -3.132 1.00 61.42 O ATOM 921 CB LEU A 62 -0.830 10.268 -2.518 1.00 4.44 C ATOM 922 CG LEU A 62 0.443 10.982 -2.998 1.00 13.34 C ATOM 923 CD1 LEU A 62 1.164 11.651 -1.833 1.00 11.43 C ATOM 924 CD2 LEU A 62 1.368 10.000 -3.711 1.00 43.11 C ATOM 0 H LEU A 62 -1.993 11.702 -4.155 1.00 21.11 H new ATOM 0 HA LEU A 62 -1.097 9.039 -4.269 1.00 52.44 H new ATOM 0 HB2 LEU A 62 -1.428 10.973 -1.940 1.00 4.44 H new ATOM 0 HB3 LEU A 62 -0.544 9.462 -1.842 1.00 4.44 H new ATOM 0 HG LEU A 62 0.152 11.759 -3.705 1.00 13.34 H new ATOM 0 HD11 LEU A 62 2.062 12.149 -2.199 1.00 11.43 H new ATOM 0 HD12 LEU A 62 0.504 12.385 -1.370 1.00 11.43 H new ATOM 0 HD13 LEU A 62 1.442 10.897 -1.096 1.00 11.43 H new ATOM 0 HD21 LEU A 62 2.265 10.522 -4.045 1.00 43.11 H new ATOM 0 HD22 LEU A 62 1.647 9.200 -3.025 1.00 43.11 H new ATOM 0 HD23 LEU A 62 0.853 9.576 -4.573 1.00 43.11 H new ATOM 936 N VAL A 63 -3.802 9.487 -2.405 1.00 74.41 N ATOM 937 CA VAL A 63 -4.953 8.792 -1.817 1.00 75.55 C ATOM 938 C VAL A 63 -5.761 8.043 -2.892 1.00 40.33 C ATOM 939 O VAL A 63 -6.168 6.895 -2.694 1.00 63.12 O ATOM 940 CB VAL A 63 -5.881 9.778 -1.063 1.00 70.30 C ATOM 941 CG1 VAL A 63 -7.066 9.047 -0.429 1.00 21.01 C ATOM 942 CG2 VAL A 63 -5.097 10.551 -0.004 1.00 12.32 C ATOM 0 H VAL A 63 -3.820 10.500 -2.291 1.00 74.41 H new ATOM 0 HA VAL A 63 -4.558 8.067 -1.105 1.00 75.55 H new ATOM 0 HB VAL A 63 -6.275 10.489 -1.789 1.00 70.30 H new ATOM 0 HG11 VAL A 63 -7.699 9.765 0.093 1.00 21.01 H new ATOM 0 HG12 VAL A 63 -7.646 8.550 -1.207 1.00 21.01 H new ATOM 0 HG13 VAL A 63 -6.699 8.305 0.280 1.00 21.01 H new ATOM 0 HG21 VAL A 63 -5.766 11.238 0.514 1.00 12.32 H new ATOM 0 HG22 VAL A 63 -4.668 9.852 0.713 1.00 12.32 H new ATOM 0 HG23 VAL A 63 -4.297 11.116 -0.483 1.00 12.32 H new ATOM 952 N ASP A 64 -5.981 8.701 -4.031 1.00 23.25 N ATOM 953 CA ASP A 64 -6.678 8.088 -5.165 1.00 25.31 C ATOM 954 C ASP A 64 -5.955 6.816 -5.635 1.00 41.32 C ATOM 955 O ASP A 64 -6.568 5.757 -5.784 1.00 1.11 O ATOM 956 CB ASP A 64 -6.795 9.096 -6.316 1.00 72.23 C ATOM 957 CG ASP A 64 -7.582 8.548 -7.491 1.00 25.43 C ATOM 958 OD1 ASP A 64 -8.769 8.216 -7.308 1.00 23.01 O ATOM 959 OD2 ASP A 64 -7.024 8.455 -8.602 1.00 73.33 O ATOM 0 H ASP A 64 -5.685 9.663 -4.194 1.00 23.25 H new ATOM 0 HA ASP A 64 -7.679 7.803 -4.840 1.00 25.31 H new ATOM 0 HB2 ASP A 64 -7.277 10.004 -5.952 1.00 72.23 H new ATOM 0 HB3 ASP A 64 -5.797 9.377 -6.651 1.00 72.23 H new ATOM 964 N THR A 65 -4.646 6.923 -5.847 1.00 12.51 N ATOM 965 CA THR A 65 -3.823 5.770 -6.243 1.00 11.43 C ATOM 966 C THR A 65 -3.857 4.668 -5.172 1.00 13.32 C ATOM 967 O THR A 65 -3.886 3.478 -5.487 1.00 32.14 O ATOM 968 CB THR A 65 -2.349 6.180 -6.504 1.00 2.31 C ATOM 969 OG1 THR A 65 -2.289 7.200 -7.514 1.00 24.31 O ATOM 970 CG2 THR A 65 -1.509 4.986 -6.948 1.00 22.44 C ATOM 0 H THR A 65 -4.126 7.795 -5.753 1.00 12.51 H new ATOM 0 HA THR A 65 -4.250 5.386 -7.169 1.00 11.43 H new ATOM 0 HB THR A 65 -1.943 6.562 -5.567 1.00 2.31 H new ATOM 0 HG1 THR A 65 -2.590 8.053 -7.136 1.00 24.31 H new ATOM 0 HG21 THR A 65 -0.482 5.308 -7.122 1.00 22.44 H new ATOM 0 HG22 THR A 65 -1.523 4.222 -6.170 1.00 22.44 H new ATOM 0 HG23 THR A 65 -1.921 4.574 -7.869 1.00 22.44 H new ATOM 978 N GLY A 66 -3.864 5.076 -3.906 1.00 54.14 N ATOM 979 CA GLY A 66 -3.923 4.119 -2.806 1.00 64.33 C ATOM 980 C GLY A 66 -5.219 3.308 -2.770 1.00 73.12 C ATOM 981 O GLY A 66 -5.238 2.177 -2.282 1.00 11.32 O ATOM 0 H GLY A 66 -3.830 6.054 -3.618 1.00 54.14 H new ATOM 0 HA2 GLY A 66 -3.078 3.435 -2.885 1.00 64.33 H new ATOM 0 HA3 GLY A 66 -3.813 4.655 -1.863 1.00 64.33 H new ATOM 985 N HIS A 67 -6.307 3.883 -3.287 1.00 12.12 N ATOM 986 CA HIS A 67 -7.613 3.208 -3.285 1.00 34.11 C ATOM 987 C HIS A 67 -7.574 1.864 -4.037 1.00 34.42 C ATOM 988 O HIS A 67 -8.066 0.850 -3.528 1.00 61.25 O ATOM 989 CB HIS A 67 -8.694 4.113 -3.888 1.00 43.33 C ATOM 990 CG HIS A 67 -8.987 5.335 -3.073 1.00 61.44 C ATOM 991 ND1 HIS A 67 -9.408 6.521 -3.628 1.00 71.14 N ATOM 992 CD2 HIS A 67 -8.938 5.547 -1.736 1.00 41.34 C ATOM 993 CE1 HIS A 67 -9.600 7.409 -2.675 1.00 25.12 C ATOM 994 NE2 HIS A 67 -9.327 6.846 -1.517 1.00 64.32 N ATOM 0 H HIS A 67 -6.313 4.810 -3.711 1.00 12.12 H new ATOM 0 HA HIS A 67 -7.859 2.999 -2.244 1.00 34.11 H new ATOM 0 HB2 HIS A 67 -8.381 4.420 -4.886 1.00 43.33 H new ATOM 0 HB3 HIS A 67 -9.612 3.537 -4.005 1.00 43.33 H new ATOM 0 HD2 HIS A 67 -8.647 4.829 -0.983 1.00 41.34 H new ATOM 0 HE1 HIS A 67 -9.927 8.428 -2.819 1.00 25.12 H new ATOM 0 HE2 HIS A 67 -9.393 7.300 -0.606 1.00 64.32 H new ATOM 1003 N GLN A 68 -6.993 1.851 -5.242 1.00 13.20 N ATOM 1004 CA GLN A 68 -6.892 0.608 -6.024 1.00 3.42 C ATOM 1005 C GLN A 68 -6.013 -0.428 -5.306 1.00 35.33 C ATOM 1006 O GLN A 68 -6.246 -1.630 -5.411 1.00 4.12 O ATOM 1007 CB GLN A 68 -6.351 0.871 -7.443 1.00 41.22 C ATOM 1008 CG GLN A 68 -4.891 1.316 -7.496 1.00 71.33 C ATOM 1009 CD GLN A 68 -4.368 1.479 -8.918 1.00 60.33 C ATOM 1010 OE1 GLN A 68 -4.823 0.816 -9.845 1.00 51.12 O ATOM 1011 NE2 GLN A 68 -3.404 2.358 -9.101 1.00 74.53 N ATOM 0 H GLN A 68 -6.590 2.672 -5.694 1.00 13.20 H new ATOM 0 HA GLN A 68 -7.901 0.205 -6.116 1.00 3.42 H new ATOM 0 HB2 GLN A 68 -6.461 -0.038 -8.034 1.00 41.22 H new ATOM 0 HB3 GLN A 68 -6.967 1.635 -7.916 1.00 41.22 H new ATOM 0 HG2 GLN A 68 -4.786 2.263 -6.966 1.00 71.33 H new ATOM 0 HG3 GLN A 68 -4.275 0.586 -6.970 1.00 71.33 H new ATOM 0 HE21 GLN A 68 -3.046 2.894 -8.311 1.00 74.53 H new ATOM 0 HE22 GLN A 68 -3.015 2.502 -10.033 1.00 74.53 H new ATOM 1020 N LEU A 69 -5.008 0.045 -4.564 1.00 44.11 N ATOM 1021 CA LEU A 69 -4.151 -0.845 -3.773 1.00 74.20 C ATOM 1022 C LEU A 69 -4.964 -1.623 -2.730 1.00 31.20 C ATOM 1023 O LEU A 69 -4.737 -2.811 -2.527 1.00 24.25 O ATOM 1024 CB LEU A 69 -3.017 -0.057 -3.088 1.00 43.31 C ATOM 1025 CG LEU A 69 -1.724 0.092 -3.908 1.00 32.31 C ATOM 1026 CD1 LEU A 69 -1.100 -1.274 -4.183 1.00 44.43 C ATOM 1027 CD2 LEU A 69 -1.988 0.834 -5.217 1.00 51.20 C ATOM 0 H LEU A 69 -4.768 1.034 -4.494 1.00 44.11 H new ATOM 0 HA LEU A 69 -3.706 -1.564 -4.461 1.00 74.20 H new ATOM 0 HB2 LEU A 69 -3.387 0.938 -2.842 1.00 43.31 H new ATOM 0 HB3 LEU A 69 -2.774 -0.549 -2.146 1.00 43.31 H new ATOM 0 HG LEU A 69 -1.020 0.681 -3.321 1.00 32.31 H new ATOM 0 HD11 LEU A 69 -0.187 -1.146 -4.764 1.00 44.43 H new ATOM 0 HD12 LEU A 69 -0.863 -1.763 -3.238 1.00 44.43 H new ATOM 0 HD13 LEU A 69 -1.804 -1.889 -4.744 1.00 44.43 H new ATOM 0 HD21 LEU A 69 -1.058 0.926 -5.777 1.00 51.20 H new ATOM 0 HD22 LEU A 69 -2.715 0.279 -5.810 1.00 51.20 H new ATOM 0 HD23 LEU A 69 -2.380 1.828 -4.999 1.00 51.20 H new ATOM 1039 N LEU A 70 -5.910 -0.955 -2.073 1.00 33.35 N ATOM 1040 CA LEU A 70 -6.792 -1.625 -1.105 1.00 55.15 C ATOM 1041 C LEU A 70 -7.628 -2.738 -1.767 1.00 20.41 C ATOM 1042 O LEU A 70 -7.826 -3.807 -1.185 1.00 3.12 O ATOM 1043 CB LEU A 70 -7.715 -0.608 -0.411 1.00 32.40 C ATOM 1044 CG LEU A 70 -7.156 0.026 0.877 1.00 64.22 C ATOM 1045 CD1 LEU A 70 -6.953 -1.041 1.951 1.00 44.21 C ATOM 1046 CD2 LEU A 70 -5.853 0.776 0.605 1.00 30.23 C ATOM 0 H LEU A 70 -6.089 0.043 -2.188 1.00 33.35 H new ATOM 0 HA LEU A 70 -6.152 -2.090 -0.355 1.00 55.15 H new ATOM 0 HB2 LEU A 70 -7.944 0.190 -1.118 1.00 32.40 H new ATOM 0 HB3 LEU A 70 -8.657 -1.102 -0.172 1.00 32.40 H new ATOM 0 HG LEU A 70 -7.885 0.750 1.241 1.00 64.22 H new ATOM 0 HD11 LEU A 70 -6.558 -0.577 2.855 1.00 44.21 H new ATOM 0 HD12 LEU A 70 -7.907 -1.518 2.175 1.00 44.21 H new ATOM 0 HD13 LEU A 70 -6.249 -1.791 1.590 1.00 44.21 H new ATOM 0 HD21 LEU A 70 -5.484 1.212 1.533 1.00 30.23 H new ATOM 0 HD22 LEU A 70 -5.110 0.083 0.209 1.00 30.23 H new ATOM 0 HD23 LEU A 70 -6.034 1.568 -0.121 1.00 30.23 H new ATOM 1058 N ASP A 71 -8.108 -2.486 -2.984 1.00 11.44 N ATOM 1059 CA ASP A 71 -8.900 -3.476 -3.724 1.00 52.24 C ATOM 1060 C ASP A 71 -8.028 -4.666 -4.171 1.00 12.33 C ATOM 1061 O ASP A 71 -8.355 -5.828 -3.902 1.00 2.51 O ATOM 1062 CB ASP A 71 -9.572 -2.813 -4.934 1.00 23.12 C ATOM 1063 CG ASP A 71 -10.452 -3.779 -5.713 1.00 14.04 C ATOM 1064 OD1 ASP A 71 -11.571 -4.084 -5.246 1.00 70.43 O ATOM 1065 OD2 ASP A 71 -10.035 -4.235 -6.793 1.00 43.22 O ATOM 0 H ASP A 71 -7.964 -1.607 -3.481 1.00 11.44 H new ATOM 0 HA ASP A 71 -9.672 -3.863 -3.059 1.00 52.24 H new ATOM 0 HB2 ASP A 71 -10.175 -1.971 -4.595 1.00 23.12 H new ATOM 0 HB3 ASP A 71 -8.805 -2.410 -5.596 1.00 23.12 H new ATOM 1070 N TYR A 72 -6.916 -4.366 -4.847 1.00 53.31 N ATOM 1071 CA TYR A 72 -5.957 -5.395 -5.270 1.00 20.44 C ATOM 1072 C TYR A 72 -5.458 -6.228 -4.075 1.00 74.04 C ATOM 1073 O TYR A 72 -5.433 -7.456 -4.125 1.00 34.30 O ATOM 1074 CB TYR A 72 -4.763 -4.744 -5.988 1.00 73.13 C ATOM 1075 CG TYR A 72 -5.043 -4.353 -7.433 1.00 72.22 C ATOM 1076 CD1 TYR A 72 -6.132 -3.554 -7.770 1.00 53.12 C ATOM 1077 CD2 TYR A 72 -4.207 -4.786 -8.459 1.00 44.13 C ATOM 1078 CE1 TYR A 72 -6.384 -3.206 -9.085 1.00 63.33 C ATOM 1079 CE2 TYR A 72 -4.451 -4.439 -9.774 1.00 33.31 C ATOM 1080 CZ TYR A 72 -5.539 -3.650 -10.083 1.00 40.44 C ATOM 1081 OH TYR A 72 -5.785 -3.312 -11.398 1.00 61.13 O ATOM 0 H TYR A 72 -6.655 -3.417 -5.115 1.00 53.31 H new ATOM 0 HA TYR A 72 -6.472 -6.066 -5.957 1.00 20.44 H new ATOM 0 HB2 TYR A 72 -4.461 -3.855 -5.434 1.00 73.13 H new ATOM 0 HB3 TYR A 72 -3.920 -5.434 -5.967 1.00 73.13 H new ATOM 0 HD1 TYR A 72 -6.791 -3.200 -6.992 1.00 53.12 H new ATOM 0 HD2 TYR A 72 -3.353 -5.404 -8.223 1.00 44.13 H new ATOM 0 HE1 TYR A 72 -7.237 -2.590 -9.330 1.00 63.33 H new ATOM 0 HE2 TYR A 72 -3.792 -4.784 -10.557 1.00 33.31 H new ATOM 0 HH TYR A 72 -5.094 -3.705 -11.971 1.00 61.13 H new ATOM 1091 N CYS A 73 -5.075 -5.544 -3.001 1.00 35.24 N ATOM 1092 CA CYS A 73 -4.581 -6.208 -1.786 1.00 32.21 C ATOM 1093 C CYS A 73 -5.657 -7.083 -1.131 1.00 31.53 C ATOM 1094 O CYS A 73 -5.384 -8.208 -0.712 1.00 61.22 O ATOM 1095 CB CYS A 73 -4.074 -5.172 -0.772 1.00 31.11 C ATOM 1096 SG CYS A 73 -2.587 -4.286 -1.298 1.00 72.42 S ATOM 0 H CYS A 73 -5.095 -4.526 -2.942 1.00 35.24 H new ATOM 0 HA CYS A 73 -3.758 -6.855 -2.090 1.00 32.21 H new ATOM 0 HB2 CYS A 73 -4.866 -4.448 -0.582 1.00 31.11 H new ATOM 0 HB3 CYS A 73 -3.868 -5.675 0.173 1.00 31.11 H new ATOM 0 HG CYS A 73 -2.924 -3.281 -2.051 1.00 72.42 H new ATOM 1102 N SER A 74 -6.882 -6.566 -1.052 1.00 5.25 N ATOM 1103 CA SER A 74 -7.992 -7.291 -0.417 1.00 71.34 C ATOM 1104 C SER A 74 -8.270 -8.625 -1.124 1.00 63.25 C ATOM 1105 O SER A 74 -8.661 -9.608 -0.490 1.00 12.11 O ATOM 1106 CB SER A 74 -9.264 -6.434 -0.414 1.00 22.42 C ATOM 1107 OG SER A 74 -10.258 -6.992 0.432 1.00 31.13 O ATOM 0 H SER A 74 -7.135 -5.648 -1.418 1.00 5.25 H new ATOM 0 HA SER A 74 -7.697 -7.502 0.611 1.00 71.34 H new ATOM 0 HB2 SER A 74 -9.024 -5.424 -0.081 1.00 22.42 H new ATOM 0 HB3 SER A 74 -9.652 -6.351 -1.429 1.00 22.42 H new ATOM 0 HG SER A 74 -11.057 -6.425 0.416 1.00 31.13 H new ATOM 1113 N GLY A 75 -8.057 -8.655 -2.439 1.00 74.33 N ATOM 1114 CA GLY A 75 -8.253 -9.881 -3.209 1.00 51.43 C ATOM 1115 C GLY A 75 -7.016 -10.779 -3.251 1.00 62.41 C ATOM 1116 O GLY A 75 -7.098 -11.974 -2.968 1.00 41.42 O ATOM 0 H GLY A 75 -7.751 -7.852 -2.989 1.00 74.33 H new ATOM 0 HA2 GLY A 75 -9.084 -10.441 -2.780 1.00 51.43 H new ATOM 0 HA3 GLY A 75 -8.537 -9.619 -4.228 1.00 51.43 H new ATOM 1120 N TYR A 76 -5.864 -10.197 -3.592 1.00 12.35 N ATOM 1121 CA TYR A 76 -4.615 -10.956 -3.753 1.00 72.55 C ATOM 1122 C TYR A 76 -4.213 -11.699 -2.465 1.00 1.13 C ATOM 1123 O TYR A 76 -3.715 -12.827 -2.521 1.00 44.44 O ATOM 1124 CB TYR A 76 -3.478 -10.014 -4.178 1.00 53.30 C ATOM 1125 CG TYR A 76 -2.192 -10.727 -4.571 1.00 61.02 C ATOM 1126 CD1 TYR A 76 -1.974 -11.133 -5.884 1.00 64.21 C ATOM 1127 CD2 TYR A 76 -1.194 -10.989 -3.635 1.00 40.53 C ATOM 1128 CE1 TYR A 76 -0.808 -11.778 -6.251 1.00 31.24 C ATOM 1129 CE2 TYR A 76 -0.025 -11.634 -3.997 1.00 35.15 C ATOM 1130 CZ TYR A 76 0.162 -12.025 -5.306 1.00 15.31 C ATOM 1131 OH TYR A 76 1.327 -12.665 -5.671 1.00 23.22 O ATOM 0 H TYR A 76 -5.767 -9.196 -3.764 1.00 12.35 H new ATOM 0 HA TYR A 76 -4.790 -11.704 -4.526 1.00 72.55 H new ATOM 0 HB2 TYR A 76 -3.817 -9.410 -5.019 1.00 53.30 H new ATOM 0 HB3 TYR A 76 -3.264 -9.328 -3.359 1.00 53.30 H new ATOM 0 HD1 TYR A 76 -2.730 -10.940 -6.631 1.00 64.21 H new ATOM 0 HD2 TYR A 76 -1.335 -10.683 -2.609 1.00 40.53 H new ATOM 0 HE1 TYR A 76 -0.659 -12.087 -7.275 1.00 31.24 H new ATOM 0 HE2 TYR A 76 0.738 -11.830 -3.258 1.00 35.15 H new ATOM 0 HH TYR A 76 1.907 -12.761 -4.887 1.00 23.22 H new ATOM 1141 N VAL A 77 -4.430 -11.064 -1.309 1.00 63.14 N ATOM 1142 CA VAL A 77 -4.041 -11.646 -0.015 1.00 53.22 C ATOM 1143 C VAL A 77 -4.658 -13.041 0.203 1.00 21.43 C ATOM 1144 O VAL A 77 -4.073 -13.896 0.872 1.00 15.21 O ATOM 1145 CB VAL A 77 -4.427 -10.719 1.170 1.00 45.55 C ATOM 1146 CG1 VAL A 77 -5.947 -10.588 1.309 1.00 33.20 C ATOM 1147 CG2 VAL A 77 -3.793 -11.211 2.470 1.00 4.12 C ATOM 0 H VAL A 77 -4.872 -10.148 -1.240 1.00 63.14 H new ATOM 0 HA VAL A 77 -2.956 -11.749 -0.045 1.00 53.22 H new ATOM 0 HB VAL A 77 -4.035 -9.725 0.957 1.00 45.55 H new ATOM 0 HG11 VAL A 77 -6.180 -9.932 2.148 1.00 33.20 H new ATOM 0 HG12 VAL A 77 -6.361 -10.167 0.393 1.00 33.20 H new ATOM 0 HG13 VAL A 77 -6.382 -11.572 1.485 1.00 33.20 H new ATOM 0 HG21 VAL A 77 -4.076 -10.547 3.287 1.00 4.12 H new ATOM 0 HG22 VAL A 77 -4.142 -12.221 2.685 1.00 4.12 H new ATOM 0 HG23 VAL A 77 -2.708 -11.216 2.366 1.00 4.12 H new ATOM 1157 N ASP A 78 -5.828 -13.268 -0.390 1.00 42.21 N ATOM 1158 CA ASP A 78 -6.531 -14.551 -0.283 1.00 32.55 C ATOM 1159 C ASP A 78 -5.682 -15.706 -0.849 1.00 30.33 C ATOM 1160 O ASP A 78 -5.769 -16.842 -0.381 1.00 55.04 O ATOM 1161 CB ASP A 78 -7.872 -14.451 -1.030 1.00 25.23 C ATOM 1162 CG ASP A 78 -8.719 -15.714 -0.931 1.00 24.21 C ATOM 1163 OD1 ASP A 78 -9.527 -15.823 0.016 1.00 60.15 O ATOM 1164 OD2 ASP A 78 -8.600 -16.591 -1.814 1.00 71.35 O ATOM 0 H ASP A 78 -6.316 -12.574 -0.956 1.00 42.21 H new ATOM 0 HA ASP A 78 -6.711 -14.767 0.770 1.00 32.55 H new ATOM 0 HB2 ASP A 78 -8.439 -13.610 -0.631 1.00 25.23 H new ATOM 0 HB3 ASP A 78 -7.678 -14.234 -2.081 1.00 25.23 H new ATOM 1169 N CYS A 79 -4.838 -15.401 -1.840 1.00 40.14 N ATOM 1170 CA CYS A 79 -4.055 -16.429 -2.546 1.00 54.40 C ATOM 1171 C CYS A 79 -2.590 -16.506 -2.073 1.00 14.32 C ATOM 1172 O CYS A 79 -1.796 -17.252 -2.652 1.00 43.31 O ATOM 1173 CB CYS A 79 -4.085 -16.162 -4.059 1.00 53.52 C ATOM 1174 SG CYS A 79 -5.740 -16.190 -4.790 1.00 33.13 S ATOM 0 H CYS A 79 -4.677 -14.451 -2.174 1.00 40.14 H new ATOM 0 HA CYS A 79 -4.520 -17.387 -2.315 1.00 54.40 H new ATOM 0 HB2 CYS A 79 -3.632 -15.190 -4.253 1.00 53.52 H new ATOM 0 HB3 CYS A 79 -3.467 -16.908 -4.560 1.00 53.52 H new ATOM 0 HG CYS A 79 -5.655 -15.952 -6.065 1.00 33.13 H new ATOM 1180 N ILE A 80 -2.223 -15.756 -1.030 1.00 53.40 N ATOM 1181 CA ILE A 80 -0.833 -15.763 -0.537 1.00 33.13 C ATOM 1182 C ILE A 80 -0.505 -17.055 0.248 1.00 13.13 C ATOM 1183 O ILE A 80 -1.075 -17.303 1.314 1.00 21.11 O ATOM 1184 CB ILE A 80 -0.533 -14.528 0.353 1.00 74.53 C ATOM 1185 CG1 ILE A 80 -0.719 -13.230 -0.452 1.00 12.23 C ATOM 1186 CG2 ILE A 80 0.887 -14.604 0.926 1.00 33.21 C ATOM 1187 CD1 ILE A 80 -0.409 -11.968 0.330 1.00 1.51 C ATOM 0 H ILE A 80 -2.854 -15.143 -0.514 1.00 53.40 H new ATOM 0 HA ILE A 80 -0.197 -15.722 -1.421 1.00 33.13 H new ATOM 0 HB ILE A 80 -1.237 -14.526 1.185 1.00 74.53 H new ATOM 0 HG12 ILE A 80 -0.078 -13.266 -1.333 1.00 12.23 H new ATOM 0 HG13 ILE A 80 -1.748 -13.180 -0.809 1.00 12.23 H new ATOM 0 HG21 ILE A 80 1.076 -13.728 1.547 1.00 33.21 H new ATOM 0 HG22 ILE A 80 0.988 -15.506 1.530 1.00 33.21 H new ATOM 0 HG23 ILE A 80 1.608 -14.632 0.109 1.00 33.21 H new ATOM 0 HD11 ILE A 80 -0.564 -11.098 -0.307 1.00 1.51 H new ATOM 0 HD12 ILE A 80 -1.068 -11.906 1.196 1.00 1.51 H new ATOM 0 HD13 ILE A 80 0.628 -11.993 0.664 1.00 1.51 H new ATOM 1199 N PRO A 81 0.430 -17.888 -0.268 1.00 50.13 N ATOM 1200 CA PRO A 81 0.797 -19.171 0.367 1.00 45.13 C ATOM 1201 C PRO A 81 1.424 -19.008 1.770 1.00 54.31 C ATOM 1202 O PRO A 81 0.842 -19.441 2.769 1.00 55.33 O ATOM 1203 CB PRO A 81 1.799 -19.794 -0.622 1.00 71.41 C ATOM 1204 CG PRO A 81 2.322 -18.644 -1.419 1.00 33.32 C ATOM 1205 CD PRO A 81 1.191 -17.654 -1.513 1.00 24.23 C ATOM 0 HA PRO A 81 -0.082 -19.790 0.546 1.00 45.13 H new ATOM 0 HB2 PRO A 81 2.604 -20.309 -0.097 1.00 71.41 H new ATOM 0 HB3 PRO A 81 1.315 -20.531 -1.263 1.00 71.41 H new ATOM 0 HG2 PRO A 81 3.191 -18.198 -0.936 1.00 33.32 H new ATOM 0 HG3 PRO A 81 2.639 -18.969 -2.410 1.00 33.32 H new ATOM 0 HD2 PRO A 81 1.557 -16.629 -1.574 1.00 24.23 H new ATOM 0 HD3 PRO A 81 0.578 -17.826 -2.398 1.00 24.23 H new ATOM 1213 N GLN A 82 2.611 -18.394 1.851 1.00 3.32 N ATOM 1214 CA GLN A 82 3.263 -18.154 3.149 1.00 32.53 C ATOM 1215 C GLN A 82 2.373 -17.300 4.066 1.00 72.25 C ATOM 1216 O GLN A 82 2.148 -16.118 3.803 1.00 1.11 O ATOM 1217 CB GLN A 82 4.630 -17.461 2.981 1.00 1.02 C ATOM 1218 CG GLN A 82 5.713 -18.313 2.314 1.00 21.25 C ATOM 1219 CD GLN A 82 5.545 -18.438 0.807 1.00 5.41 C ATOM 1220 OE1 GLN A 82 4.888 -19.344 0.316 1.00 65.23 O ATOM 1221 NE2 GLN A 82 6.135 -17.524 0.059 1.00 54.13 N ATOM 0 H GLN A 82 3.136 -18.057 1.044 1.00 3.32 H new ATOM 0 HA GLN A 82 3.420 -19.131 3.606 1.00 32.53 H new ATOM 0 HB2 GLN A 82 4.490 -16.554 2.393 1.00 1.02 H new ATOM 0 HB3 GLN A 82 4.987 -17.152 3.964 1.00 1.02 H new ATOM 0 HG2 GLN A 82 6.689 -17.878 2.528 1.00 21.25 H new ATOM 0 HG3 GLN A 82 5.704 -19.309 2.756 1.00 21.25 H new ATOM 0 HE21 GLN A 82 6.677 -16.779 0.497 1.00 54.13 H new ATOM 0 HE22 GLN A 82 6.049 -17.563 -0.957 1.00 54.13 H new ATOM 1230 N THR A 83 1.872 -17.899 5.144 1.00 42.20 N ATOM 1231 CA THR A 83 1.007 -17.184 6.092 1.00 54.13 C ATOM 1232 C THR A 83 1.744 -16.020 6.754 1.00 41.04 C ATOM 1233 O THR A 83 1.154 -14.976 7.014 1.00 53.31 O ATOM 1234 CB THR A 83 0.443 -18.111 7.192 1.00 75.44 C ATOM 1235 OG1 THR A 83 -0.190 -19.248 6.588 1.00 1.25 O ATOM 1236 CG2 THR A 83 -0.574 -17.371 8.059 1.00 32.43 C ATOM 0 H THR A 83 2.047 -18.874 5.386 1.00 42.20 H new ATOM 0 HA THR A 83 0.174 -16.800 5.503 1.00 54.13 H new ATOM 0 HB THR A 83 1.270 -18.436 7.822 1.00 75.44 H new ATOM 0 HG1 THR A 83 -0.545 -19.835 7.288 1.00 1.25 H new ATOM 0 HG21 THR A 83 -0.957 -18.044 8.826 1.00 32.43 H new ATOM 0 HG22 THR A 83 -0.093 -16.516 8.534 1.00 32.43 H new ATOM 0 HG23 THR A 83 -1.399 -17.024 7.436 1.00 32.43 H new ATOM 1244 N ARG A 84 3.033 -16.201 7.018 1.00 12.42 N ATOM 1245 CA ARG A 84 3.873 -15.113 7.533 1.00 22.43 C ATOM 1246 C ARG A 84 3.815 -13.887 6.605 1.00 24.13 C ATOM 1247 O ARG A 84 3.753 -12.747 7.064 1.00 71.22 O ATOM 1248 CB ARG A 84 5.321 -15.596 7.697 1.00 72.40 C ATOM 1249 CG ARG A 84 5.496 -16.645 8.792 1.00 20.45 C ATOM 1250 CD ARG A 84 5.193 -16.073 10.175 1.00 11.02 C ATOM 1251 NE ARG A 84 6.091 -14.970 10.513 1.00 13.05 N ATOM 1252 CZ ARG A 84 5.835 -14.048 11.402 1.00 12.44 C ATOM 1253 NH1 ARG A 84 4.731 -14.063 12.080 1.00 0.21 N ATOM 1254 NH2 ARG A 84 6.696 -13.108 11.618 1.00 21.55 N ATOM 0 H ARG A 84 3.523 -17.086 6.886 1.00 12.42 H new ATOM 0 HA ARG A 84 3.489 -14.815 8.509 1.00 22.43 H new ATOM 0 HB2 ARG A 84 5.666 -16.011 6.750 1.00 72.40 H new ATOM 0 HB3 ARG A 84 5.957 -14.740 7.921 1.00 72.40 H new ATOM 0 HG2 ARG A 84 4.836 -17.490 8.595 1.00 20.45 H new ATOM 0 HG3 ARG A 84 6.517 -17.026 8.771 1.00 20.45 H new ATOM 0 HD2 ARG A 84 4.161 -15.724 10.206 1.00 11.02 H new ATOM 0 HD3 ARG A 84 5.286 -16.860 10.923 1.00 11.02 H new ATOM 0 HE ARG A 84 6.982 -14.917 10.019 1.00 13.05 H new ATOM 0 HH11 ARG A 84 4.046 -14.803 11.923 1.00 0.21 H new ATOM 0 HH12 ARG A 84 4.547 -13.335 12.771 1.00 0.21 H new ATOM 0 HH21 ARG A 84 7.571 -13.088 11.095 1.00 21.55 H new ATOM 0 HH22 ARG A 84 6.500 -12.386 12.311 1.00 21.55 H new ATOM 1268 N ASN A 85 3.814 -14.135 5.296 1.00 71.23 N ATOM 1269 CA ASN A 85 3.662 -13.067 4.307 1.00 41.44 C ATOM 1270 C ASN A 85 2.217 -12.560 4.250 1.00 25.44 C ATOM 1271 O ASN A 85 1.981 -11.365 4.152 1.00 43.25 O ATOM 1272 CB ASN A 85 4.094 -13.544 2.920 1.00 23.14 C ATOM 1273 CG ASN A 85 5.571 -13.858 2.857 1.00 70.10 C ATOM 1274 OD1 ASN A 85 6.368 -13.300 3.602 1.00 22.35 O ATOM 1275 ND2 ASN A 85 5.948 -14.741 1.962 1.00 12.54 N ATOM 0 H ASN A 85 3.917 -15.067 4.895 1.00 71.23 H new ATOM 0 HA ASN A 85 4.306 -12.244 4.618 1.00 41.44 H new ATOM 0 HB2 ASN A 85 3.524 -14.433 2.650 1.00 23.14 H new ATOM 0 HB3 ASN A 85 3.856 -12.776 2.184 1.00 23.14 H new ATOM 0 HD21 ASN A 85 6.934 -14.984 1.869 1.00 12.54 H new ATOM 0 HD22 ASN A 85 5.255 -15.184 1.360 1.00 12.54 H new ATOM 1282 N LYS A 86 1.254 -13.478 4.310 1.00 53.24 N ATOM 1283 CA LYS A 86 -0.167 -13.112 4.284 1.00 22.43 C ATOM 1284 C LYS A 86 -0.531 -12.212 5.479 1.00 41.52 C ATOM 1285 O LYS A 86 -1.325 -11.277 5.352 1.00 21.23 O ATOM 1286 CB LYS A 86 -1.048 -14.377 4.264 1.00 33.41 C ATOM 1287 CG LYS A 86 -2.541 -14.084 4.121 1.00 41.44 C ATOM 1288 CD LYS A 86 -3.365 -15.325 3.759 1.00 52.41 C ATOM 1289 CE LYS A 86 -3.422 -16.358 4.880 1.00 23.12 C ATOM 1290 NZ LYS A 86 -2.190 -17.189 4.958 1.00 43.43 N ATOM 0 H LYS A 86 1.428 -14.481 4.377 1.00 53.24 H new ATOM 0 HA LYS A 86 -0.354 -12.545 3.372 1.00 22.43 H new ATOM 0 HB2 LYS A 86 -0.732 -15.016 3.440 1.00 33.41 H new ATOM 0 HB3 LYS A 86 -0.883 -14.938 5.184 1.00 33.41 H new ATOM 0 HG2 LYS A 86 -2.915 -13.667 5.056 1.00 41.44 H new ATOM 0 HG3 LYS A 86 -2.684 -13.323 3.353 1.00 41.44 H new ATOM 0 HD2 LYS A 86 -4.380 -15.018 3.505 1.00 52.41 H new ATOM 0 HD3 LYS A 86 -2.940 -15.788 2.869 1.00 52.41 H new ATOM 0 HE2 LYS A 86 -3.572 -15.848 5.831 1.00 23.12 H new ATOM 0 HE3 LYS A 86 -4.284 -17.007 4.727 1.00 23.12 H new ATOM 0 HZ1 LYS A 86 -2.430 -18.132 5.325 1.00 43.43 H new ATOM 0 HZ2 LYS A 86 -1.773 -17.282 4.010 1.00 43.43 H new ATOM 0 HZ3 LYS A 86 -1.504 -16.734 5.594 1.00 43.43 H new ATOM 1304 N PHE A 87 0.073 -12.490 6.631 1.00 11.02 N ATOM 1305 CA PHE A 87 -0.135 -11.685 7.837 1.00 22.55 C ATOM 1306 C PHE A 87 0.578 -10.327 7.717 1.00 64.45 C ATOM 1307 O PHE A 87 -0.028 -9.274 7.942 1.00 64.00 O ATOM 1308 CB PHE A 87 0.368 -12.443 9.077 1.00 0.40 C ATOM 1309 CG PHE A 87 0.006 -11.775 10.382 1.00 62.13 C ATOM 1310 CD1 PHE A 87 -1.213 -12.036 10.994 1.00 74.34 C ATOM 1311 CD2 PHE A 87 0.878 -10.883 10.992 1.00 55.44 C ATOM 1312 CE1 PHE A 87 -1.548 -11.423 12.186 1.00 0.11 C ATOM 1313 CE2 PHE A 87 0.545 -10.268 12.183 1.00 62.23 C ATOM 1314 CZ PHE A 87 -0.670 -10.537 12.781 1.00 53.24 C ATOM 0 H PHE A 87 0.716 -13.272 6.758 1.00 11.02 H new ATOM 0 HA PHE A 87 -1.204 -11.502 7.946 1.00 22.55 H new ATOM 0 HB2 PHE A 87 -0.045 -13.452 9.068 1.00 0.40 H new ATOM 0 HB3 PHE A 87 1.452 -12.542 9.017 1.00 0.40 H new ATOM 0 HD1 PHE A 87 -1.906 -12.725 10.534 1.00 74.34 H new ATOM 0 HD2 PHE A 87 1.829 -10.667 10.529 1.00 55.44 H new ATOM 0 HE1 PHE A 87 -2.498 -11.637 12.654 1.00 0.11 H new ATOM 0 HE2 PHE A 87 1.234 -9.577 12.646 1.00 62.23 H new ATOM 0 HZ PHE A 87 -0.934 -10.056 13.711 1.00 53.24 H new ATOM 1324 N ALA A 88 1.870 -10.361 7.371 1.00 20.04 N ATOM 1325 CA ALA A 88 2.656 -9.138 7.152 1.00 63.33 C ATOM 1326 C ALA A 88 2.013 -8.240 6.087 1.00 55.51 C ATOM 1327 O ALA A 88 2.034 -7.014 6.185 1.00 64.32 O ATOM 1328 CB ALA A 88 4.080 -9.492 6.752 1.00 52.11 C ATOM 0 H ALA A 88 2.396 -11.224 7.236 1.00 20.04 H new ATOM 0 HA ALA A 88 2.676 -8.582 8.089 1.00 63.33 H new ATOM 0 HB1 ALA A 88 4.651 -8.577 6.593 1.00 52.11 H new ATOM 0 HB2 ALA A 88 4.546 -10.077 7.545 1.00 52.11 H new ATOM 0 HB3 ALA A 88 4.065 -10.075 5.831 1.00 52.11 H new ATOM 1334 N PHE A 89 1.437 -8.874 5.076 1.00 15.24 N ATOM 1335 CA PHE A 89 0.726 -8.169 4.014 1.00 43.04 C ATOM 1336 C PHE A 89 -0.461 -7.381 4.588 1.00 64.34 C ATOM 1337 O PHE A 89 -0.572 -6.174 4.385 1.00 21.34 O ATOM 1338 CB PHE A 89 0.245 -9.181 2.969 1.00 54.41 C ATOM 1339 CG PHE A 89 -0.323 -8.566 1.720 1.00 13.11 C ATOM 1340 CD1 PHE A 89 0.509 -8.210 0.668 1.00 1.52 C ATOM 1341 CD2 PHE A 89 -1.687 -8.357 1.591 1.00 21.13 C ATOM 1342 CE1 PHE A 89 -0.009 -7.660 -0.484 1.00 5.12 C ATOM 1343 CE2 PHE A 89 -2.208 -7.809 0.439 1.00 14.21 C ATOM 1344 CZ PHE A 89 -1.368 -7.457 -0.600 1.00 31.42 C ATOM 0 H PHE A 89 1.448 -9.888 4.967 1.00 15.24 H new ATOM 0 HA PHE A 89 1.403 -7.457 3.541 1.00 43.04 H new ATOM 0 HB2 PHE A 89 1.080 -9.825 2.694 1.00 54.41 H new ATOM 0 HB3 PHE A 89 -0.514 -9.819 3.422 1.00 54.41 H new ATOM 0 HD1 PHE A 89 1.574 -8.366 0.753 1.00 1.52 H new ATOM 0 HD2 PHE A 89 -2.348 -8.626 2.401 1.00 21.13 H new ATOM 0 HE1 PHE A 89 0.649 -7.388 -1.296 1.00 5.12 H new ATOM 0 HE2 PHE A 89 -3.273 -7.655 0.348 1.00 14.21 H new ATOM 0 HZ PHE A 89 -1.775 -7.024 -1.502 1.00 31.42 H new ATOM 1354 N ARG A 90 -1.334 -8.071 5.326 1.00 72.03 N ATOM 1355 CA ARG A 90 -2.518 -7.438 5.920 1.00 44.13 C ATOM 1356 C ARG A 90 -2.152 -6.308 6.895 1.00 2.21 C ATOM 1357 O ARG A 90 -2.726 -5.221 6.827 1.00 40.12 O ATOM 1358 CB ARG A 90 -3.398 -8.475 6.636 1.00 72.23 C ATOM 1359 CG ARG A 90 -4.184 -9.390 5.699 1.00 3.24 C ATOM 1360 CD ARG A 90 -5.001 -8.596 4.678 1.00 70.51 C ATOM 1361 NE ARG A 90 -5.773 -7.515 5.295 1.00 34.30 N ATOM 1362 CZ ARG A 90 -6.645 -6.775 4.658 1.00 54.34 C ATOM 1363 NH1 ARG A 90 -6.946 -7.027 3.424 1.00 52.23 N ATOM 1364 NH2 ARG A 90 -7.225 -5.788 5.262 1.00 23.02 N ATOM 0 H ARG A 90 -1.245 -9.067 5.527 1.00 72.03 H new ATOM 0 HA ARG A 90 -3.078 -6.998 5.095 1.00 44.13 H new ATOM 0 HB2 ARG A 90 -2.766 -9.089 7.278 1.00 72.23 H new ATOM 0 HB3 ARG A 90 -4.099 -7.952 7.286 1.00 72.23 H new ATOM 0 HG2 ARG A 90 -3.494 -10.052 5.176 1.00 3.24 H new ATOM 0 HG3 ARG A 90 -4.851 -10.023 6.285 1.00 3.24 H new ATOM 0 HD2 ARG A 90 -4.330 -8.177 3.928 1.00 70.51 H new ATOM 0 HD3 ARG A 90 -5.680 -9.271 4.157 1.00 70.51 H new ATOM 0 HE ARG A 90 -5.621 -7.326 6.286 1.00 34.30 H new ATOM 0 HH11 ARG A 90 -6.502 -7.808 2.940 1.00 52.23 H new ATOM 0 HH12 ARG A 90 -7.627 -6.445 2.936 1.00 52.23 H new ATOM 0 HH21 ARG A 90 -7.003 -5.585 6.237 1.00 23.02 H new ATOM 0 HH22 ARG A 90 -7.904 -5.213 4.763 1.00 23.02 H new ATOM 1378 N GLU A 91 -1.200 -6.559 7.796 1.00 12.55 N ATOM 1379 CA GLU A 91 -0.815 -5.547 8.790 1.00 62.12 C ATOM 1380 C GLU A 91 -0.257 -4.289 8.102 1.00 4.23 C ATOM 1381 O GLU A 91 -0.582 -3.167 8.486 1.00 11.43 O ATOM 1382 CB GLU A 91 0.200 -6.109 9.806 1.00 32.41 C ATOM 1383 CG GLU A 91 1.554 -6.484 9.213 1.00 61.44 C ATOM 1384 CD GLU A 91 2.558 -6.932 10.264 1.00 32.50 C ATOM 1385 OE1 GLU A 91 2.995 -6.082 11.068 1.00 72.44 O ATOM 1386 OE2 GLU A 91 2.924 -8.127 10.290 1.00 12.15 O ATOM 0 H GLU A 91 -0.687 -7.438 7.861 1.00 12.55 H new ATOM 0 HA GLU A 91 -1.714 -5.268 9.340 1.00 62.12 H new ATOM 0 HB2 GLU A 91 0.355 -5.369 10.591 1.00 32.41 H new ATOM 0 HB3 GLU A 91 -0.231 -6.991 10.280 1.00 32.41 H new ATOM 0 HG2 GLU A 91 1.417 -7.283 8.485 1.00 61.44 H new ATOM 0 HG3 GLU A 91 1.958 -5.627 8.674 1.00 61.44 H new ATOM 1393 N ALA A 92 0.561 -4.486 7.066 1.00 12.10 N ATOM 1394 CA ALA A 92 1.103 -3.370 6.284 1.00 71.24 C ATOM 1395 C ALA A 92 -0.013 -2.605 5.553 1.00 71.52 C ATOM 1396 O ALA A 92 -0.018 -1.373 5.520 1.00 25.31 O ATOM 1397 CB ALA A 92 2.140 -3.876 5.289 1.00 62.23 C ATOM 0 H ALA A 92 0.863 -5.407 6.748 1.00 12.10 H new ATOM 0 HA ALA A 92 1.585 -2.678 6.975 1.00 71.24 H new ATOM 0 HB1 ALA A 92 2.534 -3.037 4.715 1.00 62.23 H new ATOM 0 HB2 ALA A 92 2.954 -4.362 5.827 1.00 62.23 H new ATOM 0 HB3 ALA A 92 1.675 -4.592 4.611 1.00 62.23 H new ATOM 1403 N VAL A 93 -0.962 -3.345 4.974 1.00 55.24 N ATOM 1404 CA VAL A 93 -2.132 -2.741 4.324 1.00 52.35 C ATOM 1405 C VAL A 93 -2.957 -1.912 5.324 1.00 11.54 C ATOM 1406 O VAL A 93 -3.458 -0.837 4.990 1.00 24.51 O ATOM 1407 CB VAL A 93 -3.038 -3.819 3.670 1.00 13.01 C ATOM 1408 CG1 VAL A 93 -4.339 -3.209 3.146 1.00 72.01 C ATOM 1409 CG2 VAL A 93 -2.294 -4.534 2.541 1.00 24.44 C ATOM 0 H VAL A 93 -0.945 -4.364 4.941 1.00 55.24 H new ATOM 0 HA VAL A 93 -1.756 -2.081 3.542 1.00 52.35 H new ATOM 0 HB VAL A 93 -3.294 -4.548 4.439 1.00 13.01 H new ATOM 0 HG11 VAL A 93 -4.951 -3.990 2.694 1.00 72.01 H new ATOM 0 HG12 VAL A 93 -4.885 -2.752 3.971 1.00 72.01 H new ATOM 0 HG13 VAL A 93 -4.110 -2.450 2.398 1.00 72.01 H new ATOM 0 HG21 VAL A 93 -2.945 -5.286 2.095 1.00 24.44 H new ATOM 0 HG22 VAL A 93 -2.003 -3.809 1.781 1.00 24.44 H new ATOM 0 HG23 VAL A 93 -1.403 -5.017 2.941 1.00 24.44 H new ATOM 1419 N SER A 94 -3.084 -2.413 6.555 1.00 3.12 N ATOM 1420 CA SER A 94 -3.791 -1.688 7.621 1.00 14.23 C ATOM 1421 C SER A 94 -3.163 -0.309 7.867 1.00 74.43 C ATOM 1422 O SER A 94 -3.869 0.693 7.974 1.00 20.22 O ATOM 1423 CB SER A 94 -3.803 -2.502 8.924 1.00 55.43 C ATOM 1424 OG SER A 94 -4.492 -3.732 8.753 1.00 4.45 O ATOM 0 H SER A 94 -2.708 -3.317 6.841 1.00 3.12 H new ATOM 0 HA SER A 94 -4.820 -1.543 7.291 1.00 14.23 H new ATOM 0 HB2 SER A 94 -2.779 -2.697 9.244 1.00 55.43 H new ATOM 0 HB3 SER A 94 -4.279 -1.922 9.714 1.00 55.43 H new ATOM 0 HG SER A 94 -3.978 -4.315 8.156 1.00 4.45 H new ATOM 1430 N LYS A 95 -1.834 -0.257 7.938 1.00 63.45 N ATOM 1431 CA LYS A 95 -1.130 1.028 8.069 1.00 54.11 C ATOM 1432 C LYS A 95 -1.309 1.888 6.810 1.00 73.42 C ATOM 1433 O LYS A 95 -1.402 3.114 6.894 1.00 13.41 O ATOM 1434 CB LYS A 95 0.371 0.830 8.349 1.00 71.32 C ATOM 1435 CG LYS A 95 0.707 0.457 9.793 1.00 71.45 C ATOM 1436 CD LYS A 95 0.198 -0.929 10.168 1.00 52.14 C ATOM 1437 CE LYS A 95 0.610 -1.323 11.579 1.00 24.34 C ATOM 1438 NZ LYS A 95 2.083 -1.254 11.766 1.00 22.45 N ATOM 0 H LYS A 95 -1.225 -1.075 7.908 1.00 63.45 H new ATOM 0 HA LYS A 95 -1.574 1.545 8.920 1.00 54.11 H new ATOM 0 HB2 LYS A 95 0.750 0.050 7.689 1.00 71.32 H new ATOM 0 HB3 LYS A 95 0.899 1.749 8.093 1.00 71.32 H new ATOM 0 HG2 LYS A 95 1.787 0.495 9.933 1.00 71.45 H new ATOM 0 HG3 LYS A 95 0.272 1.195 10.467 1.00 71.45 H new ATOM 0 HD2 LYS A 95 -0.889 -0.950 10.088 1.00 52.14 H new ATOM 0 HD3 LYS A 95 0.584 -1.662 9.459 1.00 52.14 H new ATOM 0 HE2 LYS A 95 0.122 -0.664 12.297 1.00 24.34 H new ATOM 0 HE3 LYS A 95 0.264 -2.335 11.789 1.00 24.34 H new ATOM 0 HZ1 LYS A 95 2.347 -1.762 12.634 1.00 22.45 H new ATOM 0 HZ2 LYS A 95 2.557 -1.692 10.951 1.00 22.45 H new ATOM 0 HZ3 LYS A 95 2.377 -0.259 11.844 1.00 22.45 H new ATOM 1452 N LEU A 96 -1.364 1.240 5.645 1.00 25.01 N ATOM 1453 CA LEU A 96 -1.565 1.948 4.376 1.00 40.24 C ATOM 1454 C LEU A 96 -2.912 2.692 4.361 1.00 53.32 C ATOM 1455 O LEU A 96 -2.959 3.898 4.123 1.00 41.24 O ATOM 1456 CB LEU A 96 -1.497 0.957 3.200 1.00 2.34 C ATOM 1457 CG LEU A 96 -1.648 1.577 1.798 1.00 23.20 C ATOM 1458 CD1 LEU A 96 -0.496 2.535 1.502 1.00 22.41 C ATOM 1459 CD2 LEU A 96 -1.733 0.488 0.731 1.00 75.43 C ATOM 0 H LEU A 96 -1.273 0.228 5.552 1.00 25.01 H new ATOM 0 HA LEU A 96 -0.769 2.685 4.271 1.00 40.24 H new ATOM 0 HB2 LEU A 96 -0.543 0.432 3.245 1.00 2.34 H new ATOM 0 HB3 LEU A 96 -2.278 0.209 3.333 1.00 2.34 H new ATOM 0 HG LEU A 96 -2.577 2.147 1.778 1.00 23.20 H new ATOM 0 HD11 LEU A 96 -0.624 2.961 0.507 1.00 22.41 H new ATOM 0 HD12 LEU A 96 -0.490 3.336 2.241 1.00 22.41 H new ATOM 0 HD13 LEU A 96 0.449 1.993 1.546 1.00 22.41 H new ATOM 0 HD21 LEU A 96 -1.839 0.948 -0.251 1.00 75.43 H new ATOM 0 HD22 LEU A 96 -0.825 -0.115 0.753 1.00 75.43 H new ATOM 0 HD23 LEU A 96 -2.596 -0.148 0.929 1.00 75.43 H new ATOM 1471 N GLU A 97 -3.997 1.976 4.656 1.00 53.25 N ATOM 1472 CA GLU A 97 -5.343 2.567 4.642 1.00 43.51 C ATOM 1473 C GLU A 97 -5.513 3.636 5.738 1.00 1.34 C ATOM 1474 O GLU A 97 -6.061 4.713 5.483 1.00 4.22 O ATOM 1475 CB GLU A 97 -6.414 1.471 4.775 1.00 22.15 C ATOM 1476 CG GLU A 97 -6.244 0.569 5.992 1.00 4.13 C ATOM 1477 CD GLU A 97 -7.299 -0.526 6.068 1.00 2.42 C ATOM 1478 OE1 GLU A 97 -8.443 -0.222 6.467 1.00 21.32 O ATOM 1479 OE2 GLU A 97 -6.991 -1.693 5.742 1.00 53.52 O ATOM 0 H GLU A 97 -3.975 0.988 4.908 1.00 53.25 H new ATOM 0 HA GLU A 97 -5.472 3.067 3.682 1.00 43.51 H new ATOM 0 HB2 GLU A 97 -7.395 1.943 4.822 1.00 22.15 H new ATOM 0 HB3 GLU A 97 -6.399 0.855 3.876 1.00 22.15 H new ATOM 0 HG2 GLU A 97 -5.255 0.112 5.965 1.00 4.13 H new ATOM 0 HG3 GLU A 97 -6.290 1.175 6.897 1.00 4.13 H new ATOM 1486 N LEU A 98 -5.034 3.350 6.955 1.00 54.41 N ATOM 1487 CA LEU A 98 -5.066 4.335 8.048 1.00 24.23 C ATOM 1488 C LEU A 98 -4.279 5.604 7.681 1.00 65.31 C ATOM 1489 O LEU A 98 -4.739 6.722 7.919 1.00 61.35 O ATOM 1490 CB LEU A 98 -4.523 3.726 9.358 1.00 25.12 C ATOM 1491 CG LEU A 98 -5.571 3.036 10.257 1.00 33.53 C ATOM 1492 CD1 LEU A 98 -6.593 4.049 10.771 1.00 62.00 C ATOM 1493 CD2 LEU A 98 -6.273 1.901 9.515 1.00 40.25 C ATOM 0 H LEU A 98 -4.622 2.452 7.209 1.00 54.41 H new ATOM 0 HA LEU A 98 -6.108 4.616 8.204 1.00 24.23 H new ATOM 0 HB2 LEU A 98 -3.751 2.999 9.107 1.00 25.12 H new ATOM 0 HB3 LEU A 98 -4.041 4.517 9.933 1.00 25.12 H new ATOM 0 HG LEU A 98 -5.046 2.608 11.111 1.00 33.53 H new ATOM 0 HD11 LEU A 98 -7.322 3.542 11.402 1.00 62.00 H new ATOM 0 HD12 LEU A 98 -6.083 4.818 11.351 1.00 62.00 H new ATOM 0 HD13 LEU A 98 -7.104 4.511 9.926 1.00 62.00 H new ATOM 0 HD21 LEU A 98 -7.005 1.434 10.174 1.00 40.25 H new ATOM 0 HD22 LEU A 98 -6.778 2.299 8.635 1.00 40.25 H new ATOM 0 HD23 LEU A 98 -5.537 1.158 9.206 1.00 40.25 H new ATOM 1505 N SER A 99 -3.106 5.429 7.081 1.00 50.55 N ATOM 1506 CA SER A 99 -2.292 6.568 6.646 1.00 15.23 C ATOM 1507 C SER A 99 -2.959 7.324 5.483 1.00 50.33 C ATOM 1508 O SER A 99 -2.844 8.540 5.381 1.00 1.04 O ATOM 1509 CB SER A 99 -0.879 6.115 6.253 1.00 63.21 C ATOM 1510 OG SER A 99 -0.181 5.572 7.367 1.00 14.21 O ATOM 0 H SER A 99 -2.696 4.516 6.884 1.00 50.55 H new ATOM 0 HA SER A 99 -2.212 7.253 7.490 1.00 15.23 H new ATOM 0 HB2 SER A 99 -0.941 5.368 5.461 1.00 63.21 H new ATOM 0 HB3 SER A 99 -0.323 6.961 5.850 1.00 63.21 H new ATOM 0 HG SER A 99 -0.434 4.633 7.485 1.00 14.21 H new ATOM 1516 N LEU A 100 -3.666 6.603 4.613 1.00 73.02 N ATOM 1517 CA LEU A 100 -4.392 7.235 3.499 1.00 60.04 C ATOM 1518 C LEU A 100 -5.560 8.109 3.993 1.00 51.24 C ATOM 1519 O LEU A 100 -5.782 9.215 3.485 1.00 43.31 O ATOM 1520 CB LEU A 100 -4.914 6.170 2.522 1.00 44.34 C ATOM 1521 CG LEU A 100 -3.838 5.472 1.671 1.00 4.22 C ATOM 1522 CD1 LEU A 100 -4.450 4.350 0.839 1.00 41.54 C ATOM 1523 CD2 LEU A 100 -3.128 6.479 0.769 1.00 35.20 C ATOM 0 H LEU A 100 -3.755 5.588 4.653 1.00 73.02 H new ATOM 0 HA LEU A 100 -3.685 7.884 2.983 1.00 60.04 H new ATOM 0 HB2 LEU A 100 -5.452 5.412 3.091 1.00 44.34 H new ATOM 0 HB3 LEU A 100 -5.636 6.638 1.853 1.00 44.34 H new ATOM 0 HG LEU A 100 -3.102 5.035 2.346 1.00 4.22 H new ATOM 0 HD11 LEU A 100 -3.671 3.871 0.246 1.00 41.54 H new ATOM 0 HD12 LEU A 100 -4.907 3.614 1.501 1.00 41.54 H new ATOM 0 HD13 LEU A 100 -5.210 4.762 0.175 1.00 41.54 H new ATOM 0 HD21 LEU A 100 -2.371 5.966 0.176 1.00 35.20 H new ATOM 0 HD22 LEU A 100 -3.854 6.947 0.104 1.00 35.20 H new ATOM 0 HD23 LEU A 100 -2.651 7.244 1.382 1.00 35.20 H new ATOM 1535 N GLN A 101 -6.309 7.616 4.979 1.00 62.13 N ATOM 1536 CA GLN A 101 -7.453 8.364 5.518 1.00 63.53 C ATOM 1537 C GLN A 101 -7.004 9.567 6.373 1.00 72.43 C ATOM 1538 O GLN A 101 -7.656 10.613 6.365 1.00 11.13 O ATOM 1539 CB GLN A 101 -8.392 7.442 6.317 1.00 4.13 C ATOM 1540 CG GLN A 101 -7.728 6.705 7.473 1.00 53.33 C ATOM 1541 CD GLN A 101 -8.683 5.767 8.196 1.00 2.12 C ATOM 1542 OE1 GLN A 101 -8.825 4.600 7.837 1.00 41.14 O ATOM 1543 NE2 GLN A 101 -9.340 6.265 9.222 1.00 32.22 N ATOM 0 H GLN A 101 -6.149 6.710 5.420 1.00 62.13 H new ATOM 0 HA GLN A 101 -8.007 8.759 4.667 1.00 63.53 H new ATOM 0 HB2 GLN A 101 -9.216 8.037 6.709 1.00 4.13 H new ATOM 0 HB3 GLN A 101 -8.824 6.708 5.637 1.00 4.13 H new ATOM 0 HG2 GLN A 101 -6.880 6.134 7.095 1.00 53.33 H new ATOM 0 HG3 GLN A 101 -7.332 7.432 8.182 1.00 53.33 H new ATOM 0 HE21 GLN A 101 -9.199 7.238 9.494 1.00 32.22 H new ATOM 0 HE22 GLN A 101 -9.990 5.678 9.745 1.00 32.22 H new ATOM 1552 N GLU A 102 -5.886 9.437 7.096 1.00 24.22 N ATOM 1553 CA GLU A 102 -5.351 10.571 7.867 1.00 5.13 C ATOM 1554 C GLU A 102 -4.598 11.559 6.956 1.00 63.22 C ATOM 1555 O GLU A 102 -4.549 12.756 7.229 1.00 42.20 O ATOM 1556 CB GLU A 102 -4.440 10.092 9.014 1.00 0.44 C ATOM 1557 CG GLU A 102 -3.123 9.471 8.563 1.00 33.12 C ATOM 1558 CD GLU A 102 -2.236 9.057 9.730 1.00 70.01 C ATOM 1559 OE1 GLU A 102 -1.520 9.924 10.279 1.00 14.52 O ATOM 1560 OE2 GLU A 102 -2.251 7.866 10.109 1.00 32.35 O ATOM 0 H GLU A 102 -5.341 8.577 7.165 1.00 24.22 H new ATOM 0 HA GLU A 102 -6.201 11.093 8.307 1.00 5.13 H new ATOM 0 HB2 GLU A 102 -4.223 10.939 9.665 1.00 0.44 H new ATOM 0 HB3 GLU A 102 -4.985 9.361 9.612 1.00 0.44 H new ATOM 0 HG2 GLU A 102 -3.331 8.599 7.943 1.00 33.12 H new ATOM 0 HG3 GLU A 102 -2.585 10.184 7.939 1.00 33.12 H new ATOM 1567 N LEU A 103 -4.024 11.060 5.860 1.00 4.33 N ATOM 1568 CA LEU A 103 -3.328 11.921 4.890 1.00 62.04 C ATOM 1569 C LEU A 103 -4.279 12.961 4.278 1.00 5.23 C ATOM 1570 O LEU A 103 -4.032 14.166 4.352 1.00 12.04 O ATOM 1571 CB LEU A 103 -2.713 11.080 3.762 1.00 53.24 C ATOM 1572 CG LEU A 103 -1.915 11.877 2.713 1.00 0.01 C ATOM 1573 CD1 LEU A 103 -0.667 12.498 3.337 1.00 44.03 C ATOM 1574 CD2 LEU A 103 -1.545 10.993 1.524 1.00 34.30 C ATOM 0 H LEU A 103 -4.025 10.069 5.618 1.00 4.33 H new ATOM 0 HA LEU A 103 -2.538 12.442 5.431 1.00 62.04 H new ATOM 0 HB2 LEU A 103 -2.055 10.332 4.205 1.00 53.24 H new ATOM 0 HB3 LEU A 103 -3.513 10.541 3.255 1.00 53.24 H new ATOM 0 HG LEU A 103 -2.549 12.685 2.349 1.00 0.01 H new ATOM 0 HD11 LEU A 103 -0.119 13.056 2.577 1.00 44.03 H new ATOM 0 HD12 LEU A 103 -0.960 13.172 4.142 1.00 44.03 H new ATOM 0 HD13 LEU A 103 -0.030 11.710 3.738 1.00 44.03 H new ATOM 0 HD21 LEU A 103 -0.982 11.578 0.797 1.00 34.30 H new ATOM 0 HD22 LEU A 103 -0.935 10.157 1.868 1.00 34.30 H new ATOM 0 HD23 LEU A 103 -2.453 10.612 1.058 1.00 34.30 H new ATOM 1586 N GLN A 104 -5.371 12.481 3.685 1.00 53.42 N ATOM 1587 CA GLN A 104 -6.333 13.346 2.981 1.00 72.43 C ATOM 1588 C GLN A 104 -6.912 14.465 3.876 1.00 32.15 C ATOM 1589 O GLN A 104 -7.476 15.443 3.373 1.00 14.54 O ATOM 1590 CB GLN A 104 -7.468 12.486 2.404 1.00 72.44 C ATOM 1591 CG GLN A 104 -8.179 11.626 3.445 1.00 11.42 C ATOM 1592 CD GLN A 104 -9.137 10.621 2.827 1.00 55.30 C ATOM 1593 OE1 GLN A 104 -10.316 10.899 2.635 1.00 64.41 O ATOM 1594 NE2 GLN A 104 -8.639 9.443 2.510 1.00 63.34 N ATOM 0 H GLN A 104 -5.618 11.491 3.675 1.00 53.42 H new ATOM 0 HA GLN A 104 -5.791 13.845 2.178 1.00 72.43 H new ATOM 0 HB2 GLN A 104 -8.198 13.138 1.925 1.00 72.44 H new ATOM 0 HB3 GLN A 104 -7.062 11.838 1.627 1.00 72.44 H new ATOM 0 HG2 GLN A 104 -7.436 11.094 4.039 1.00 11.42 H new ATOM 0 HG3 GLN A 104 -8.730 12.272 4.128 1.00 11.42 H new ATOM 0 HE21 GLN A 104 -7.654 9.243 2.682 1.00 63.34 H new ATOM 0 HE22 GLN A 104 -9.239 8.731 2.092 1.00 63.34 H new ATOM 1603 N VAL A 105 -6.776 14.324 5.196 1.00 72.42 N ATOM 1604 CA VAL A 105 -7.275 15.339 6.137 1.00 75.40 C ATOM 1605 C VAL A 105 -6.134 16.157 6.780 1.00 32.54 C ATOM 1606 O VAL A 105 -6.299 17.345 7.057 1.00 50.43 O ATOM 1607 CB VAL A 105 -8.147 14.700 7.254 1.00 4.42 C ATOM 1608 CG1 VAL A 105 -9.323 13.936 6.650 1.00 74.33 C ATOM 1609 CG2 VAL A 105 -7.318 13.786 8.157 1.00 1.40 C ATOM 0 H VAL A 105 -6.327 13.523 5.640 1.00 72.42 H new ATOM 0 HA VAL A 105 -7.890 16.019 5.548 1.00 75.40 H new ATOM 0 HB VAL A 105 -8.539 15.509 7.870 1.00 4.42 H new ATOM 0 HG11 VAL A 105 -9.920 13.497 7.449 1.00 74.33 H new ATOM 0 HG12 VAL A 105 -9.941 14.620 6.069 1.00 74.33 H new ATOM 0 HG13 VAL A 105 -8.948 13.145 6.000 1.00 74.33 H new ATOM 0 HG21 VAL A 105 -7.959 13.356 8.927 1.00 1.40 H new ATOM 0 HG22 VAL A 105 -6.880 12.985 7.561 1.00 1.40 H new ATOM 0 HG23 VAL A 105 -6.523 14.364 8.628 1.00 1.40 H new ATOM 1619 N SER A 106 -4.978 15.527 7.007 1.00 33.55 N ATOM 1620 CA SER A 106 -3.854 16.184 7.713 1.00 71.41 C ATOM 1621 C SER A 106 -2.882 16.916 6.766 1.00 74.34 C ATOM 1622 O SER A 106 -2.100 17.757 7.213 1.00 30.41 O ATOM 1623 CB SER A 106 -3.064 15.160 8.548 1.00 54.14 C ATOM 1624 OG SER A 106 -3.871 14.579 9.565 1.00 32.42 O ATOM 0 H SER A 106 -4.788 14.568 6.717 1.00 33.55 H new ATOM 0 HA SER A 106 -4.309 16.933 8.361 1.00 71.41 H new ATOM 0 HB2 SER A 106 -2.680 14.376 7.895 1.00 54.14 H new ATOM 0 HB3 SER A 106 -2.201 15.648 9.002 1.00 54.14 H new ATOM 0 HG SER A 106 -4.350 13.805 9.201 1.00 32.42 H new ATOM 1630 N SER A 107 -2.922 16.595 5.471 1.00 51.11 N ATOM 1631 CA SER A 107 -2.008 17.212 4.486 1.00 3.52 C ATOM 1632 C SER A 107 -2.108 18.744 4.483 1.00 2.13 C ATOM 1633 O SER A 107 -1.121 19.433 4.743 1.00 2.33 O ATOM 1634 CB SER A 107 -2.286 16.683 3.071 1.00 13.13 C ATOM 1635 OG SER A 107 -1.952 15.311 2.958 1.00 31.24 O ATOM 0 H SER A 107 -3.571 15.916 5.074 1.00 51.11 H new ATOM 0 HA SER A 107 -0.997 16.936 4.787 1.00 3.52 H new ATOM 0 HB2 SER A 107 -3.339 16.824 2.829 1.00 13.13 H new ATOM 0 HB3 SER A 107 -1.712 17.260 2.346 1.00 13.13 H new ATOM 0 HG SER A 107 -2.642 14.769 3.395 1.00 31.24 H new ATOM 1641 N ALA A 108 -3.301 19.262 4.168 1.00 62.01 N ATOM 1642 CA ALA A 108 -3.568 20.713 4.117 1.00 22.13 C ATOM 1643 C ALA A 108 -2.904 21.405 2.908 1.00 4.02 C ATOM 1644 O ALA A 108 -3.564 22.133 2.164 1.00 32.44 O ATOM 1645 CB ALA A 108 -3.153 21.393 5.423 1.00 11.52 C ATOM 0 H ALA A 108 -4.114 18.689 3.940 1.00 62.01 H new ATOM 0 HA ALA A 108 -4.645 20.823 3.989 1.00 22.13 H new ATOM 0 HB1 ALA A 108 -3.360 22.461 5.359 1.00 11.52 H new ATOM 0 HB2 ALA A 108 -3.716 20.963 6.252 1.00 11.52 H new ATOM 0 HB3 ALA A 108 -2.087 21.240 5.590 1.00 11.52 H new ATOM 1651 N ALA A 109 -1.609 21.157 2.703 1.00 14.34 N ATOM 1652 CA ALA A 109 -0.834 21.797 1.629 1.00 53.02 C ATOM 1653 C ALA A 109 -1.233 21.328 0.212 1.00 3.24 C ATOM 1654 O ALA A 109 -0.591 21.715 -0.767 1.00 74.43 O ATOM 1655 CB ALA A 109 0.653 21.543 1.857 1.00 2.41 C ATOM 0 H ALA A 109 -1.066 20.509 3.273 1.00 14.34 H new ATOM 0 HA ALA A 109 -1.057 22.863 1.673 1.00 53.02 H new ATOM 0 HB1 ALA A 109 1.229 22.017 1.062 1.00 2.41 H new ATOM 0 HB2 ALA A 109 0.950 21.961 2.819 1.00 2.41 H new ATOM 0 HB3 ALA A 109 0.844 20.470 1.853 1.00 2.41 H new ATOM 1661 N ALA A 110 -2.274 20.496 0.113 1.00 12.12 N ATOM 1662 CA ALA A 110 -2.798 20.007 -1.180 1.00 22.05 C ATOM 1663 C ALA A 110 -1.867 18.978 -1.856 1.00 22.41 C ATOM 1664 O ALA A 110 -2.277 17.845 -2.120 1.00 24.53 O ATOM 1665 CB ALA A 110 -3.098 21.172 -2.126 1.00 4.10 C ATOM 0 H ALA A 110 -2.782 20.139 0.922 1.00 12.12 H new ATOM 0 HA ALA A 110 -3.730 19.487 -0.958 1.00 22.05 H new ATOM 0 HB1 ALA A 110 -3.482 20.785 -3.070 1.00 4.10 H new ATOM 0 HB2 ALA A 110 -3.842 21.827 -1.673 1.00 4.10 H new ATOM 0 HB3 ALA A 110 -2.183 21.736 -2.310 1.00 4.10 H new ATOM 1671 N GLY A 111 -0.627 19.372 -2.148 1.00 61.13 N ATOM 1672 CA GLY A 111 0.315 18.456 -2.785 1.00 20.31 C ATOM 1673 C GLY A 111 1.770 18.913 -2.710 1.00 21.20 C ATOM 1674 O GLY A 111 2.290 19.505 -3.656 1.00 4.13 O ATOM 0 H GLY A 111 -0.257 20.303 -1.957 1.00 61.13 H new ATOM 0 HA2 GLY A 111 0.228 17.476 -2.315 1.00 20.31 H new ATOM 0 HA3 GLY A 111 0.036 18.334 -3.832 1.00 20.31 H new ATOM 1678 N VAL A 112 2.432 18.628 -1.590 1.00 31.11 N ATOM 1679 CA VAL A 112 3.850 18.974 -1.412 1.00 71.22 C ATOM 1680 C VAL A 112 4.665 17.737 -0.981 1.00 23.13 C ATOM 1681 O VAL A 112 4.324 17.073 0.001 1.00 64.10 O ATOM 1682 CB VAL A 112 4.032 20.109 -0.364 1.00 75.53 C ATOM 1683 CG1 VAL A 112 5.510 20.463 -0.187 1.00 0.53 C ATOM 1684 CG2 VAL A 112 3.222 21.347 -0.758 1.00 35.41 C ATOM 0 H VAL A 112 2.012 18.158 -0.788 1.00 31.11 H new ATOM 0 HA VAL A 112 4.219 19.330 -2.374 1.00 71.22 H new ATOM 0 HB VAL A 112 3.657 19.745 0.592 1.00 75.53 H new ATOM 0 HG11 VAL A 112 5.608 21.259 0.551 1.00 0.53 H new ATOM 0 HG12 VAL A 112 6.057 19.583 0.153 1.00 0.53 H new ATOM 0 HG13 VAL A 112 5.920 20.799 -1.139 1.00 0.53 H new ATOM 0 HG21 VAL A 112 3.364 22.128 -0.011 1.00 35.41 H new ATOM 0 HG22 VAL A 112 3.559 21.708 -1.729 1.00 35.41 H new ATOM 0 HG23 VAL A 112 2.165 21.087 -0.815 1.00 35.41 H new ATOM 1694 N PRO A 113 5.758 17.414 -1.707 1.00 62.21 N ATOM 1695 CA PRO A 113 6.575 16.214 -1.432 1.00 20.52 C ATOM 1696 C PRO A 113 7.209 16.217 -0.028 1.00 72.34 C ATOM 1697 O PRO A 113 7.882 17.172 0.367 1.00 45.21 O ATOM 1698 CB PRO A 113 7.666 16.261 -2.520 1.00 61.31 C ATOM 1699 CG PRO A 113 7.707 17.689 -2.958 1.00 2.41 C ATOM 1700 CD PRO A 113 6.294 18.190 -2.842 1.00 22.21 C ATOM 0 HA PRO A 113 5.968 15.309 -1.453 1.00 20.52 H new ATOM 0 HB2 PRO A 113 8.631 15.940 -2.127 1.00 61.31 H new ATOM 0 HB3 PRO A 113 7.424 15.599 -3.351 1.00 61.31 H new ATOM 0 HG2 PRO A 113 8.382 18.272 -2.331 1.00 2.41 H new ATOM 0 HG3 PRO A 113 8.070 17.774 -3.982 1.00 2.41 H new ATOM 0 HD2 PRO A 113 6.261 19.262 -2.649 1.00 22.21 H new ATOM 0 HD3 PRO A 113 5.727 18.013 -3.756 1.00 22.21 H new ATOM 1708 N GLY A 114 6.976 15.138 0.722 1.00 12.33 N ATOM 1709 CA GLY A 114 7.552 14.987 2.057 1.00 63.15 C ATOM 1710 C GLY A 114 7.145 16.075 3.051 1.00 72.14 C ATOM 1711 O GLY A 114 7.824 16.279 4.057 1.00 14.40 O ATOM 0 H GLY A 114 6.392 14.356 0.426 1.00 12.33 H new ATOM 0 HA2 GLY A 114 7.257 14.017 2.458 1.00 63.15 H new ATOM 0 HA3 GLY A 114 8.639 14.979 1.971 1.00 63.15 H new ATOM 1715 N THR A 115 6.035 16.765 2.788 1.00 65.12 N ATOM 1716 CA THR A 115 5.600 17.871 3.660 1.00 61.30 C ATOM 1717 C THR A 115 5.062 17.384 5.014 1.00 72.14 C ATOM 1718 O THR A 115 5.083 18.125 5.994 1.00 61.24 O ATOM 1719 CB THR A 115 4.522 18.756 2.991 1.00 23.02 C ATOM 1720 OG1 THR A 115 4.274 19.925 3.793 1.00 74.04 O ATOM 1721 CG2 THR A 115 3.214 17.992 2.788 1.00 71.31 C ATOM 0 H THR A 115 5.424 16.586 1.991 1.00 65.12 H new ATOM 0 HA THR A 115 6.499 18.463 3.831 1.00 61.30 H new ATOM 0 HB THR A 115 4.900 19.053 2.013 1.00 23.02 H new ATOM 0 HG1 THR A 115 3.591 20.480 3.361 1.00 74.04 H new ATOM 0 HG21 THR A 115 2.480 18.645 2.316 1.00 71.31 H new ATOM 0 HG22 THR A 115 3.393 17.127 2.150 1.00 71.31 H new ATOM 0 HG23 THR A 115 2.834 17.658 3.754 1.00 71.31 H new ATOM 1729 N ASN A 116 4.566 16.149 5.064 1.00 32.31 N ATOM 1730 CA ASN A 116 4.041 15.578 6.312 1.00 53.45 C ATOM 1731 C ASN A 116 4.556 14.144 6.537 1.00 31.14 C ATOM 1732 O ASN A 116 4.776 13.399 5.577 1.00 3.11 O ATOM 1733 CB ASN A 116 2.504 15.597 6.316 1.00 23.23 C ATOM 1734 CG ASN A 116 1.900 14.835 5.149 1.00 71.43 C ATOM 1735 OD1 ASN A 116 1.775 13.618 5.187 1.00 35.23 O ATOM 1736 ND2 ASN A 116 1.502 15.545 4.112 1.00 50.30 N ATOM 0 H ASN A 116 4.515 15.523 4.260 1.00 32.31 H new ATOM 0 HA ASN A 116 4.402 16.199 7.132 1.00 53.45 H new ATOM 0 HB2 ASN A 116 2.143 15.167 7.250 1.00 23.23 H new ATOM 0 HB3 ASN A 116 2.158 16.630 6.286 1.00 23.23 H new ATOM 0 HD21 ASN A 116 1.075 15.081 3.310 1.00 50.30 H new ATOM 0 HD22 ASN A 116 1.621 16.558 4.112 1.00 50.30 H new ATOM 1743 N PRO A 117 4.758 13.741 7.813 1.00 64.13 N ATOM 1744 CA PRO A 117 5.254 12.391 8.163 1.00 42.44 C ATOM 1745 C PRO A 117 4.389 11.246 7.601 1.00 10.35 C ATOM 1746 O PRO A 117 4.882 10.141 7.369 1.00 60.14 O ATOM 1747 CB PRO A 117 5.217 12.385 9.701 1.00 71.43 C ATOM 1748 CG PRO A 117 5.303 13.823 10.085 1.00 74.13 C ATOM 1749 CD PRO A 117 4.550 14.573 9.018 1.00 75.20 C ATOM 0 HA PRO A 117 6.241 12.214 7.736 1.00 42.44 H new ATOM 0 HB2 PRO A 117 4.300 11.929 10.074 1.00 71.43 H new ATOM 0 HB3 PRO A 117 6.048 11.814 10.115 1.00 71.43 H new ATOM 0 HG2 PRO A 117 4.864 13.993 11.068 1.00 74.13 H new ATOM 0 HG3 PRO A 117 6.340 14.153 10.138 1.00 74.13 H new ATOM 0 HD2 PRO A 117 3.492 14.670 9.263 1.00 75.20 H new ATOM 0 HD3 PRO A 117 4.940 15.582 8.883 1.00 75.20 H new ATOM 1757 N VAL A 118 3.101 11.517 7.383 1.00 60.14 N ATOM 1758 CA VAL A 118 2.177 10.511 6.838 1.00 43.01 C ATOM 1759 C VAL A 118 2.674 9.972 5.487 1.00 1.22 C ATOM 1760 O VAL A 118 2.506 8.791 5.174 1.00 43.04 O ATOM 1761 CB VAL A 118 0.744 11.080 6.668 1.00 63.52 C ATOM 1762 CG1 VAL A 118 -0.224 9.991 6.208 1.00 64.11 C ATOM 1763 CG2 VAL A 118 0.261 11.727 7.965 1.00 53.05 C ATOM 0 H VAL A 118 2.671 12.422 7.574 1.00 60.14 H new ATOM 0 HA VAL A 118 2.145 9.694 7.559 1.00 43.01 H new ATOM 0 HB VAL A 118 0.774 11.850 5.897 1.00 63.52 H new ATOM 0 HG11 VAL A 118 -1.222 10.415 6.096 1.00 64.11 H new ATOM 0 HG12 VAL A 118 0.109 9.589 5.251 1.00 64.11 H new ATOM 0 HG13 VAL A 118 -0.250 9.191 6.948 1.00 64.11 H new ATOM 0 HG21 VAL A 118 -0.746 12.119 7.823 1.00 53.05 H new ATOM 0 HG22 VAL A 118 0.252 10.983 8.761 1.00 53.05 H new ATOM 0 HG23 VAL A 118 0.932 12.541 8.237 1.00 53.05 H new ATOM 1773 N LEU A 119 3.296 10.845 4.695 1.00 31.11 N ATOM 1774 CA LEU A 119 3.902 10.446 3.420 1.00 24.54 C ATOM 1775 C LEU A 119 5.015 9.406 3.639 1.00 21.10 C ATOM 1776 O LEU A 119 5.173 8.472 2.852 1.00 73.34 O ATOM 1777 CB LEU A 119 4.463 11.680 2.698 1.00 41.44 C ATOM 1778 CG LEU A 119 3.422 12.755 2.350 1.00 3.11 C ATOM 1779 CD1 LEU A 119 4.085 13.989 1.746 1.00 14.45 C ATOM 1780 CD2 LEU A 119 2.365 12.191 1.406 1.00 63.12 C ATOM 0 H LEU A 119 3.395 11.837 4.913 1.00 31.11 H new ATOM 0 HA LEU A 119 3.130 9.989 2.801 1.00 24.54 H new ATOM 0 HB2 LEU A 119 5.233 12.130 3.324 1.00 41.44 H new ATOM 0 HB3 LEU A 119 4.949 11.355 1.778 1.00 41.44 H new ATOM 0 HG LEU A 119 2.931 13.060 3.274 1.00 3.11 H new ATOM 0 HD11 LEU A 119 3.324 14.732 1.510 1.00 14.45 H new ATOM 0 HD12 LEU A 119 4.792 14.409 2.461 1.00 14.45 H new ATOM 0 HD13 LEU A 119 4.613 13.709 0.835 1.00 14.45 H new ATOM 0 HD21 LEU A 119 1.636 12.967 1.171 1.00 63.12 H new ATOM 0 HD22 LEU A 119 2.842 11.851 0.487 1.00 63.12 H new ATOM 0 HD23 LEU A 119 1.860 11.352 1.885 1.00 63.12 H new ATOM 1792 N ASN A 120 5.776 9.575 4.721 1.00 44.31 N ATOM 1793 CA ASN A 120 6.814 8.607 5.099 1.00 32.55 C ATOM 1794 C ASN A 120 6.172 7.278 5.525 1.00 74.32 C ATOM 1795 O ASN A 120 6.661 6.199 5.188 1.00 70.42 O ATOM 1796 CB ASN A 120 7.681 9.170 6.236 1.00 53.02 C ATOM 1797 CG ASN A 120 8.796 8.222 6.664 1.00 1.53 C ATOM 1798 OD1 ASN A 120 9.326 7.458 5.864 1.00 45.41 O ATOM 1799 ND2 ASN A 120 9.156 8.258 7.931 1.00 64.13 N ATOM 0 H ASN A 120 5.695 10.372 5.353 1.00 44.31 H new ATOM 0 HA ASN A 120 7.452 8.425 4.234 1.00 32.55 H new ATOM 0 HB2 ASN A 120 8.119 10.116 5.917 1.00 53.02 H new ATOM 0 HB3 ASN A 120 7.047 9.387 7.095 1.00 53.02 H new ATOM 0 HD21 ASN A 120 9.893 7.640 8.269 1.00 64.13 H new ATOM 0 HD22 ASN A 120 8.697 8.904 8.573 1.00 64.13 H new ATOM 1806 N ASN A 121 5.062 7.369 6.262 1.00 71.11 N ATOM 1807 CA ASN A 121 4.294 6.183 6.659 1.00 14.24 C ATOM 1808 C ASN A 121 3.852 5.381 5.423 1.00 63.43 C ATOM 1809 O ASN A 121 4.039 4.166 5.361 1.00 41.42 O ATOM 1810 CB ASN A 121 3.063 6.584 7.480 1.00 34.52 C ATOM 1811 CG ASN A 121 3.414 7.377 8.725 1.00 65.25 C ATOM 1812 OD1 ASN A 121 4.497 7.252 9.278 1.00 52.11 O ATOM 1813 ND2 ASN A 121 2.486 8.185 9.192 1.00 5.25 N ATOM 0 H ASN A 121 4.674 8.251 6.597 1.00 71.11 H new ATOM 0 HA ASN A 121 4.941 5.557 7.274 1.00 14.24 H new ATOM 0 HB2 ASN A 121 2.394 7.176 6.856 1.00 34.52 H new ATOM 0 HB3 ASN A 121 2.518 5.686 7.770 1.00 34.52 H new ATOM 0 HD21 ASN A 121 2.661 8.728 10.037 1.00 5.25 H new ATOM 0 HD22 ASN A 121 1.592 8.268 8.708 1.00 5.25 H new ATOM 1820 N LEU A 122 3.268 6.076 4.444 1.00 11.11 N ATOM 1821 CA LEU A 122 2.875 5.450 3.175 1.00 45.23 C ATOM 1822 C LEU A 122 4.071 4.779 2.490 1.00 40.03 C ATOM 1823 O LEU A 122 3.990 3.624 2.077 1.00 71.30 O ATOM 1824 CB LEU A 122 2.253 6.485 2.228 1.00 4.21 C ATOM 1825 CG LEU A 122 0.891 7.048 2.668 1.00 63.01 C ATOM 1826 CD1 LEU A 122 0.369 8.053 1.647 1.00 31.15 C ATOM 1827 CD2 LEU A 122 -0.120 5.918 2.870 1.00 24.43 C ATOM 0 H LEU A 122 3.056 7.072 4.504 1.00 11.11 H new ATOM 0 HA LEU A 122 2.134 4.685 3.406 1.00 45.23 H new ATOM 0 HB2 LEU A 122 2.951 7.315 2.115 1.00 4.21 H new ATOM 0 HB3 LEU A 122 2.138 6.030 1.244 1.00 4.21 H new ATOM 0 HG LEU A 122 1.027 7.563 3.619 1.00 63.01 H new ATOM 0 HD11 LEU A 122 -0.595 8.439 1.977 1.00 31.15 H new ATOM 0 HD12 LEU A 122 1.077 8.877 1.552 1.00 31.15 H new ATOM 0 HD13 LEU A 122 0.252 7.562 0.681 1.00 31.15 H new ATOM 0 HD21 LEU A 122 -1.077 6.337 3.181 1.00 24.43 H new ATOM 0 HD22 LEU A 122 -0.249 5.374 1.934 1.00 24.43 H new ATOM 0 HD23 LEU A 122 0.245 5.237 3.639 1.00 24.43 H new ATOM 1839 N LEU A 123 5.180 5.510 2.380 1.00 25.02 N ATOM 1840 CA LEU A 123 6.407 4.973 1.784 1.00 32.03 C ATOM 1841 C LEU A 123 6.822 3.659 2.466 1.00 70.52 C ATOM 1842 O LEU A 123 7.013 2.637 1.805 1.00 44.14 O ATOM 1843 CB LEU A 123 7.538 6.007 1.888 1.00 2.13 C ATOM 1844 CG LEU A 123 8.863 5.613 1.213 1.00 23.24 C ATOM 1845 CD1 LEU A 123 8.663 5.399 -0.287 1.00 71.21 C ATOM 1846 CD2 LEU A 123 9.937 6.669 1.474 1.00 71.41 C ATOM 0 H LEU A 123 5.256 6.477 2.696 1.00 25.02 H new ATOM 0 HA LEU A 123 6.213 4.761 0.733 1.00 32.03 H new ATOM 0 HB2 LEU A 123 7.192 6.943 1.449 1.00 2.13 H new ATOM 0 HB3 LEU A 123 7.732 6.202 2.943 1.00 2.13 H new ATOM 0 HG LEU A 123 9.201 4.672 1.647 1.00 23.24 H new ATOM 0 HD11 LEU A 123 9.612 5.121 -0.745 1.00 71.21 H new ATOM 0 HD12 LEU A 123 7.936 4.603 -0.447 1.00 71.21 H new ATOM 0 HD13 LEU A 123 8.298 6.320 -0.740 1.00 71.21 H new ATOM 0 HD21 LEU A 123 10.866 6.371 0.988 1.00 71.41 H new ATOM 0 HD22 LEU A 123 9.609 7.628 1.073 1.00 71.41 H new ATOM 0 HD23 LEU A 123 10.103 6.762 2.547 1.00 71.41 H new ATOM 1858 N SER A 124 6.934 3.695 3.792 1.00 53.04 N ATOM 1859 CA SER A 124 7.294 2.510 4.580 1.00 45.01 C ATOM 1860 C SER A 124 6.294 1.361 4.364 1.00 3.13 C ATOM 1861 O SER A 124 6.683 0.200 4.226 1.00 73.42 O ATOM 1862 CB SER A 124 7.362 2.866 6.073 1.00 70.31 C ATOM 1863 OG SER A 124 7.754 1.749 6.857 1.00 0.34 O ATOM 0 H SER A 124 6.780 4.535 4.349 1.00 53.04 H new ATOM 0 HA SER A 124 8.274 2.174 4.241 1.00 45.01 H new ATOM 0 HB2 SER A 124 8.069 3.682 6.222 1.00 70.31 H new ATOM 0 HB3 SER A 124 6.388 3.223 6.408 1.00 70.31 H new ATOM 0 HG SER A 124 7.789 2.008 7.801 1.00 0.34 H new ATOM 1869 N CYS A 125 5.002 1.696 4.320 1.00 63.23 N ATOM 1870 CA CYS A 125 3.944 0.693 4.116 1.00 54.42 C ATOM 1871 C CYS A 125 4.048 0.031 2.733 1.00 33.33 C ATOM 1872 O CYS A 125 4.009 -1.191 2.618 1.00 10.32 O ATOM 1873 CB CYS A 125 2.557 1.330 4.279 1.00 31.52 C ATOM 1874 SG CYS A 125 2.239 2.027 5.919 1.00 52.34 S ATOM 0 H CYS A 125 4.660 2.651 4.422 1.00 63.23 H new ATOM 0 HA CYS A 125 4.080 -0.078 4.875 1.00 54.42 H new ATOM 0 HB2 CYS A 125 2.444 2.118 3.535 1.00 31.52 H new ATOM 0 HB3 CYS A 125 1.798 0.578 4.065 1.00 31.52 H new ATOM 0 HG CYS A 125 2.986 3.076 6.097 1.00 52.34 H new ATOM 1880 N VAL A 126 4.178 0.847 1.690 1.00 0.03 N ATOM 1881 CA VAL A 126 4.293 0.345 0.311 1.00 72.01 C ATOM 1882 C VAL A 126 5.538 -0.536 0.132 1.00 2.44 C ATOM 1883 O VAL A 126 5.468 -1.619 -0.461 1.00 40.23 O ATOM 1884 CB VAL A 126 4.340 1.514 -0.704 1.00 71.12 C ATOM 1885 CG1 VAL A 126 4.533 0.998 -2.129 1.00 4.31 C ATOM 1886 CG2 VAL A 126 3.073 2.358 -0.603 1.00 10.14 C ATOM 0 H VAL A 126 4.207 1.864 1.768 1.00 0.03 H new ATOM 0 HA VAL A 126 3.407 -0.261 0.120 1.00 72.01 H new ATOM 0 HB VAL A 126 5.196 2.142 -0.458 1.00 71.12 H new ATOM 0 HG11 VAL A 126 4.562 1.840 -2.820 1.00 4.31 H new ATOM 0 HG12 VAL A 126 5.470 0.444 -2.192 1.00 4.31 H new ATOM 0 HG13 VAL A 126 3.705 0.341 -2.393 1.00 4.31 H new ATOM 0 HG21 VAL A 126 3.122 3.175 -1.323 1.00 10.14 H new ATOM 0 HG22 VAL A 126 2.204 1.737 -0.818 1.00 10.14 H new ATOM 0 HG23 VAL A 126 2.987 2.766 0.404 1.00 10.14 H new ATOM 1896 N GLN A 127 6.675 -0.068 0.650 1.00 30.33 N ATOM 1897 CA GLN A 127 7.919 -0.847 0.622 1.00 22.34 C ATOM 1898 C GLN A 127 7.740 -2.186 1.352 1.00 71.24 C ATOM 1899 O GLN A 127 8.196 -3.225 0.879 1.00 1.14 O ATOM 1900 CB GLN A 127 9.068 -0.046 1.255 1.00 63.45 C ATOM 1901 CG GLN A 127 9.390 1.252 0.514 1.00 62.22 C ATOM 1902 CD GLN A 127 10.435 2.106 1.220 1.00 74.52 C ATOM 1903 OE1 GLN A 127 10.565 2.073 2.440 1.00 63.02 O ATOM 1904 NE2 GLN A 127 11.182 2.883 0.461 1.00 25.23 N ATOM 0 H GLN A 127 6.762 0.846 1.094 1.00 30.33 H new ATOM 0 HA GLN A 127 8.168 -1.053 -0.419 1.00 22.34 H new ATOM 0 HB2 GLN A 127 8.810 0.189 2.288 1.00 63.45 H new ATOM 0 HB3 GLN A 127 9.962 -0.669 1.284 1.00 63.45 H new ATOM 0 HG2 GLN A 127 9.744 1.012 -0.488 1.00 62.22 H new ATOM 0 HG3 GLN A 127 8.475 1.832 0.398 1.00 62.22 H new ATOM 0 HE21 GLN A 127 11.049 2.888 -0.550 1.00 25.23 H new ATOM 0 HE22 GLN A 127 11.893 3.479 0.885 1.00 25.23 H new ATOM 1913 N GLU A 128 7.054 -2.147 2.497 1.00 74.11 N ATOM 1914 CA GLU A 128 6.755 -3.358 3.271 1.00 55.03 C ATOM 1915 C GLU A 128 5.892 -4.342 2.454 1.00 22.42 C ATOM 1916 O GLU A 128 6.270 -5.493 2.251 1.00 60.30 O ATOM 1917 CB GLU A 128 6.018 -2.974 4.566 1.00 41.34 C ATOM 1918 CG GLU A 128 5.827 -4.128 5.546 1.00 33.44 C ATOM 1919 CD GLU A 128 7.103 -4.490 6.296 1.00 5.43 C ATOM 1920 OE1 GLU A 128 7.892 -5.310 5.786 1.00 31.53 O ATOM 1921 OE2 GLU A 128 7.320 -3.947 7.405 1.00 24.04 O ATOM 0 H GLU A 128 6.693 -1.287 2.911 1.00 74.11 H new ATOM 0 HA GLU A 128 7.697 -3.851 3.514 1.00 55.03 H new ATOM 0 HB2 GLU A 128 6.573 -2.178 5.063 1.00 41.34 H new ATOM 0 HB3 GLU A 128 5.040 -2.567 4.307 1.00 41.34 H new ATOM 0 HG2 GLU A 128 5.052 -3.862 6.265 1.00 33.44 H new ATOM 0 HG3 GLU A 128 5.471 -5.003 5.003 1.00 33.44 H new ATOM 1928 N ILE A 129 4.750 -3.860 1.960 1.00 50.31 N ATOM 1929 CA ILE A 129 3.814 -4.687 1.182 1.00 74.24 C ATOM 1930 C ILE A 129 4.510 -5.374 -0.009 1.00 5.24 C ATOM 1931 O ILE A 129 4.472 -6.601 -0.143 1.00 41.44 O ATOM 1932 CB ILE A 129 2.628 -3.833 0.655 1.00 51.34 C ATOM 1933 CG1 ILE A 129 1.822 -3.249 1.830 1.00 61.21 C ATOM 1934 CG2 ILE A 129 1.725 -4.657 -0.265 1.00 0.14 C ATOM 1935 CD1 ILE A 129 0.714 -2.303 1.410 1.00 32.10 C ATOM 0 H ILE A 129 4.446 -2.894 2.084 1.00 50.31 H new ATOM 0 HA ILE A 129 3.439 -5.457 1.856 1.00 74.24 H new ATOM 0 HB ILE A 129 3.036 -3.007 0.072 1.00 51.34 H new ATOM 0 HG12 ILE A 129 1.388 -4.069 2.402 1.00 61.21 H new ATOM 0 HG13 ILE A 129 2.503 -2.721 2.497 1.00 61.21 H new ATOM 0 HG21 ILE A 129 0.903 -4.035 -0.620 1.00 0.14 H new ATOM 0 HG22 ILE A 129 2.303 -5.015 -1.117 1.00 0.14 H new ATOM 0 HG23 ILE A 129 1.325 -5.508 0.285 1.00 0.14 H new ATOM 0 HD11 ILE A 129 0.194 -1.936 2.295 1.00 32.10 H new ATOM 0 HD12 ILE A 129 1.141 -1.462 0.864 1.00 32.10 H new ATOM 0 HD13 ILE A 129 0.009 -2.831 0.768 1.00 32.10 H new ATOM 1947 N SER A 130 5.149 -4.573 -0.861 1.00 23.43 N ATOM 1948 CA SER A 130 5.843 -5.090 -2.052 1.00 41.33 C ATOM 1949 C SER A 130 6.930 -6.111 -1.680 1.00 4.24 C ATOM 1950 O SER A 130 6.987 -7.203 -2.246 1.00 23.43 O ATOM 1951 CB SER A 130 6.469 -3.935 -2.850 1.00 13.14 C ATOM 1952 OG SER A 130 7.381 -3.196 -2.052 1.00 51.22 O ATOM 0 H SER A 130 5.203 -3.560 -0.753 1.00 23.43 H new ATOM 0 HA SER A 130 5.099 -5.597 -2.667 1.00 41.33 H new ATOM 0 HB2 SER A 130 6.985 -4.331 -3.725 1.00 13.14 H new ATOM 0 HB3 SER A 130 5.683 -3.274 -3.216 1.00 13.14 H new ATOM 0 HG SER A 130 6.884 -2.592 -1.461 1.00 51.22 H new ATOM 1958 N ASP A 131 7.777 -5.753 -0.717 1.00 13.40 N ATOM 1959 CA ASP A 131 8.873 -6.623 -0.273 1.00 23.11 C ATOM 1960 C ASP A 131 8.343 -7.976 0.247 1.00 15.35 C ATOM 1961 O ASP A 131 8.844 -9.040 -0.131 1.00 62.21 O ATOM 1962 CB ASP A 131 9.670 -5.904 0.821 1.00 22.01 C ATOM 1963 CG ASP A 131 11.012 -6.552 1.104 1.00 33.44 C ATOM 1964 OD1 ASP A 131 11.049 -7.598 1.782 1.00 60.10 O ATOM 1965 OD2 ASP A 131 12.047 -6.012 0.652 1.00 34.33 O ATOM 0 H ASP A 131 7.727 -4.861 -0.224 1.00 13.40 H new ATOM 0 HA ASP A 131 9.521 -6.833 -1.124 1.00 23.11 H new ATOM 0 HB2 ASP A 131 9.829 -4.867 0.524 1.00 22.01 H new ATOM 0 HB3 ASP A 131 9.082 -5.886 1.738 1.00 22.01 H new ATOM 1970 N VAL A 132 7.325 -7.923 1.107 1.00 22.34 N ATOM 1971 CA VAL A 132 6.704 -9.131 1.666 1.00 22.34 C ATOM 1972 C VAL A 132 6.234 -10.101 0.563 1.00 4.54 C ATOM 1973 O VAL A 132 6.466 -11.310 0.651 1.00 34.41 O ATOM 1974 CB VAL A 132 5.508 -8.764 2.587 1.00 14.12 C ATOM 1975 CG1 VAL A 132 4.716 -10.006 2.986 1.00 43.43 C ATOM 1976 CG2 VAL A 132 5.993 -8.019 3.832 1.00 73.52 C ATOM 0 H VAL A 132 6.909 -7.052 1.435 1.00 22.34 H new ATOM 0 HA VAL A 132 7.469 -9.635 2.256 1.00 22.34 H new ATOM 0 HB VAL A 132 4.845 -8.107 2.024 1.00 14.12 H new ATOM 0 HG11 VAL A 132 3.886 -9.717 3.630 1.00 43.43 H new ATOM 0 HG12 VAL A 132 4.328 -10.493 2.091 1.00 43.43 H new ATOM 0 HG13 VAL A 132 5.367 -10.696 3.522 1.00 43.43 H new ATOM 0 HG21 VAL A 132 5.140 -7.771 4.463 1.00 73.52 H new ATOM 0 HG22 VAL A 132 6.684 -8.652 4.388 1.00 73.52 H new ATOM 0 HG23 VAL A 132 6.501 -7.102 3.533 1.00 73.52 H new ATOM 1986 N VAL A 133 5.587 -9.568 -0.475 1.00 43.24 N ATOM 1987 CA VAL A 133 5.122 -10.385 -1.610 1.00 15.42 C ATOM 1988 C VAL A 133 6.296 -11.088 -2.320 1.00 33.31 C ATOM 1989 O VAL A 133 6.156 -12.197 -2.841 1.00 12.04 O ATOM 1990 CB VAL A 133 4.347 -9.520 -2.642 1.00 53.54 C ATOM 1991 CG1 VAL A 133 3.881 -10.359 -3.835 1.00 73.35 C ATOM 1992 CG2 VAL A 133 3.161 -8.826 -1.977 1.00 53.55 C ATOM 0 H VAL A 133 5.371 -8.575 -0.558 1.00 43.24 H new ATOM 0 HA VAL A 133 4.454 -11.142 -1.200 1.00 15.42 H new ATOM 0 HB VAL A 133 5.030 -8.758 -3.018 1.00 53.54 H new ATOM 0 HG11 VAL A 133 3.342 -9.724 -4.538 1.00 73.35 H new ATOM 0 HG12 VAL A 133 4.747 -10.797 -4.332 1.00 73.35 H new ATOM 0 HG13 VAL A 133 3.222 -11.154 -3.486 1.00 73.35 H new ATOM 0 HG21 VAL A 133 2.630 -8.225 -2.715 1.00 53.55 H new ATOM 0 HG22 VAL A 133 2.485 -9.575 -1.566 1.00 53.55 H new ATOM 0 HG23 VAL A 133 3.520 -8.181 -1.175 1.00 53.55 H new ATOM 2002 N GLN A 134 7.459 -10.440 -2.316 1.00 12.03 N ATOM 2003 CA GLN A 134 8.646 -10.963 -3.005 1.00 3.55 C ATOM 2004 C GLN A 134 9.309 -12.125 -2.240 1.00 61.33 C ATOM 2005 O GLN A 134 10.220 -12.776 -2.758 1.00 11.43 O ATOM 2006 CB GLN A 134 9.667 -9.837 -3.218 1.00 52.21 C ATOM 2007 CG GLN A 134 9.124 -8.651 -4.009 1.00 43.41 C ATOM 2008 CD GLN A 134 10.152 -7.549 -4.195 1.00 53.42 C ATOM 2009 OE1 GLN A 134 11.023 -7.347 -3.360 1.00 14.23 O ATOM 2010 NE2 GLN A 134 10.069 -6.831 -5.298 1.00 32.54 N ATOM 0 H GLN A 134 7.609 -9.549 -1.843 1.00 12.03 H new ATOM 0 HA GLN A 134 8.312 -11.353 -3.966 1.00 3.55 H new ATOM 0 HB2 GLN A 134 10.013 -9.485 -2.246 1.00 52.21 H new ATOM 0 HB3 GLN A 134 10.535 -10.241 -3.738 1.00 52.21 H new ATOM 0 HG2 GLN A 134 8.786 -8.996 -4.986 1.00 43.41 H new ATOM 0 HG3 GLN A 134 8.252 -8.246 -3.495 1.00 43.41 H new ATOM 0 HE21 GLN A 134 9.332 -7.022 -5.977 1.00 32.54 H new ATOM 0 HE22 GLN A 134 10.742 -6.085 -5.472 1.00 32.54 H new ATOM 2019 N ARG A 135 8.856 -12.385 -1.012 1.00 1.10 N ATOM 2020 CA ARG A 135 9.441 -13.452 -0.180 1.00 42.33 C ATOM 2021 C ARG A 135 8.800 -14.829 -0.481 1.00 21.24 C ATOM 2022 O ARG A 135 7.980 -15.312 0.329 1.00 38.40 O ATOM 2023 CB ARG A 135 9.294 -13.098 1.312 1.00 65.21 C ATOM 2024 CG ARG A 135 9.864 -11.729 1.678 1.00 73.32 C ATOM 2025 CD ARG A 135 9.869 -11.491 3.186 1.00 72.11 C ATOM 2026 NE ARG A 135 8.535 -11.619 3.783 1.00 11.41 N ATOM 2027 CZ ARG A 135 8.250 -11.294 5.019 1.00 64.15 C ATOM 2028 NH1 ARG A 135 9.160 -10.813 5.803 1.00 44.22 N ATOM 2029 NH2 ARG A 135 7.049 -11.459 5.472 1.00 73.21 N ATOM 2030 OXT ARG A 135 9.117 -15.420 -1.537 1.00 38.40 O ATOM 0 H ARG A 135 8.090 -11.877 -0.569 1.00 1.10 H new ATOM 0 HA ARG A 135 10.500 -13.527 -0.425 1.00 42.33 H new ATOM 0 HB2 ARG A 135 8.238 -13.125 1.580 1.00 65.21 H new ATOM 0 HB3 ARG A 135 9.794 -13.861 1.908 1.00 65.21 H new ATOM 0 HG2 ARG A 135 10.881 -11.647 1.296 1.00 73.32 H new ATOM 0 HG3 ARG A 135 9.277 -10.951 1.191 1.00 73.32 H new ATOM 0 HD2 ARG A 135 10.545 -12.203 3.660 1.00 72.11 H new ATOM 0 HD3 ARG A 135 10.261 -10.495 3.391 1.00 72.11 H new ATOM 0 HE ARG A 135 7.783 -11.984 3.199 1.00 11.41 H new ATOM 0 HH11 ARG A 135 10.112 -10.683 5.460 1.00 44.22 H new ATOM 0 HH12 ARG A 135 8.926 -10.564 6.764 1.00 44.22 H new ATOM 0 HH21 ARG A 135 6.324 -11.842 4.866 1.00 73.21 H new ATOM 0 HH22 ARG A 135 6.828 -11.206 6.435 1.00 73.21 H new