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 130 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 134 GLN : amide:sc= 0.0395 K(o=0.04,f=-0.67) USER MOD Set 2.1: A 82 GLN : amide:sc= -0.293 X(o=-0.43,f=-0.12) USER MOD Set 2.2: A 85 ASN : amide:sc= -0.14 X(o=-0.43,f=-0.37) USER MOD Set 3.1: A 45 CYS SG : rot 170:sc= 1.64 USER MOD Set 3.2: A 72 TYR OH : rot 102:sc= 0.0143 USER MOD Set 4.1: A 50 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 127 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 36 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0521) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.0587) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -42:sc= 1.09 USER MOD Single : A 59 ASN : amide:sc= -2.6! C(o=-2.6!,f=-3.5!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 65 THR OG1 : rot 83:sc= 0.9 USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=-0.0062) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 73 CYS SG : rot 79:sc= 0.514 USER MOD Single : A 74 SER OG : rot -26:sc= 0.521 USER MOD Single : A 76 TYR OH : rot 180:sc=-0.00165 USER MOD Single : A 79 CYS SG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 69:sc= 0.819 USER MOD Single : A 95 LYS NZ :NH3+ -170:sc= 1.07 (180deg=0.795) USER MOD Single : A 99 SER OG : rot 180:sc= -0.0611 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 104 GLN : amide:sc= -0.328 X(o=-0.33,f=-0.016) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -94:sc= 0.398 USER MOD Single : A 115 THR OG1 : rot 150:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0.0535 K(o=0.053,f=-0.62) USER MOD Single : A 120 ASN : amide:sc=-0.00554 K(o=-0.0055,f=-0.84) 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 78:sc= -1.35! USER MOD ----------------------------------------------------------------- ATOM 528 N LYS A 36 -8.302 -12.269 -10.654 1.00 43.55 N ATOM 529 CA LYS A 36 -7.550 -11.733 -11.797 1.00 75.04 C ATOM 530 C LYS A 36 -6.291 -10.969 -11.341 1.00 11.21 C ATOM 531 O LYS A 36 -5.300 -10.900 -12.071 1.00 43.03 O ATOM 532 CB LYS A 36 -8.482 -10.833 -12.639 1.00 2.00 C ATOM 533 CG LYS A 36 -7.830 -10.138 -13.840 1.00 10.25 C ATOM 534 CD LYS A 36 -7.229 -8.778 -13.470 1.00 1.34 C ATOM 535 CE LYS A 36 -6.706 -8.035 -14.693 1.00 32.04 C ATOM 536 NZ LYS A 36 -5.611 -8.776 -15.371 1.00 24.43 N ATOM 0 HA LYS A 36 -7.203 -12.563 -12.412 1.00 75.04 H new ATOM 0 HB2 LYS A 36 -9.312 -11.439 -13.001 1.00 2.00 H new ATOM 0 HB3 LYS A 36 -8.905 -10.069 -11.987 1.00 2.00 H new ATOM 0 HG2 LYS A 36 -7.048 -10.779 -14.248 1.00 10.25 H new ATOM 0 HG3 LYS A 36 -8.573 -10.003 -14.626 1.00 10.25 H new ATOM 0 HD2 LYS A 36 -7.985 -8.171 -12.972 1.00 1.34 H new ATOM 0 HD3 LYS A 36 -6.416 -8.922 -12.758 1.00 1.34 H new ATOM 0 HE2 LYS A 36 -7.523 -7.874 -15.396 1.00 32.04 H new ATOM 0 HE3 LYS A 36 -6.346 -7.051 -14.392 1.00 32.04 H new ATOM 0 HZ1 LYS A 36 -5.217 -8.191 -16.135 1.00 24.43 H new ATOM 0 HZ2 LYS A 36 -4.863 -8.997 -14.683 1.00 24.43 H new ATOM 0 HZ3 LYS A 36 -5.986 -9.660 -15.771 1.00 24.43 H new ATOM 550 N ILE A 37 -6.327 -10.410 -10.131 1.00 54.23 N ATOM 551 CA ILE A 37 -5.193 -9.647 -9.593 1.00 74.34 C ATOM 552 C ILE A 37 -3.917 -10.506 -9.499 1.00 2.24 C ATOM 553 O ILE A 37 -3.810 -11.396 -8.656 1.00 31.25 O ATOM 554 CB ILE A 37 -5.518 -9.069 -8.190 1.00 64.23 C ATOM 555 CG1 ILE A 37 -6.761 -8.162 -8.245 1.00 12.12 C ATOM 556 CG2 ILE A 37 -4.319 -8.309 -7.619 1.00 40.00 C ATOM 557 CD1 ILE A 37 -6.635 -7.000 -9.210 1.00 52.04 C ATOM 0 H ILE A 37 -7.128 -10.470 -9.502 1.00 54.23 H new ATOM 0 HA ILE A 37 -5.015 -8.828 -10.289 1.00 74.34 H new ATOM 0 HB ILE A 37 -5.736 -9.905 -7.526 1.00 64.23 H new ATOM 0 HG12 ILE A 37 -7.625 -8.764 -8.528 1.00 12.12 H new ATOM 0 HG13 ILE A 37 -6.958 -7.772 -7.246 1.00 12.12 H new ATOM 0 HG21 ILE A 37 -4.573 -7.914 -6.635 1.00 40.00 H new ATOM 0 HG22 ILE A 37 -3.469 -8.985 -7.530 1.00 40.00 H new ATOM 0 HG23 ILE A 37 -4.060 -7.486 -8.284 1.00 40.00 H new ATOM 0 HD11 ILE A 37 -7.551 -6.410 -9.190 1.00 52.04 H new ATOM 0 HD12 ILE A 37 -5.793 -6.373 -8.917 1.00 52.04 H new ATOM 0 HD13 ILE A 37 -6.470 -7.380 -10.218 1.00 52.04 H new ATOM 569 N SER A 38 -2.954 -10.232 -10.377 1.00 30.12 N ATOM 570 CA SER A 38 -1.682 -10.973 -10.396 1.00 43.35 C ATOM 571 C SER A 38 -0.641 -10.344 -9.456 1.00 53.30 C ATOM 572 O SER A 38 -0.734 -9.166 -9.101 1.00 31.43 O ATOM 573 CB SER A 38 -1.122 -11.035 -11.825 1.00 40.44 C ATOM 574 OG SER A 38 -2.019 -11.702 -12.703 1.00 4.44 O ATOM 0 H SER A 38 -3.025 -9.503 -11.087 1.00 30.12 H new ATOM 0 HA SER A 38 -1.888 -11.983 -10.042 1.00 43.35 H new ATOM 0 HB2 SER A 38 -0.937 -10.025 -12.189 1.00 40.44 H new ATOM 0 HB3 SER A 38 -0.163 -11.553 -11.820 1.00 40.44 H new ATOM 0 HG SER A 38 -1.637 -11.725 -13.605 1.00 4.44 H new ATOM 580 N LYS A 39 0.355 -11.142 -9.071 1.00 71.32 N ATOM 581 CA LYS A 39 1.429 -10.702 -8.167 1.00 15.53 C ATOM 582 C LYS A 39 2.126 -9.426 -8.674 1.00 62.04 C ATOM 583 O LYS A 39 2.153 -8.405 -7.981 1.00 51.53 O ATOM 584 CB LYS A 39 2.446 -11.848 -7.993 1.00 10.40 C ATOM 585 CG LYS A 39 3.719 -11.470 -7.234 1.00 1.12 C ATOM 586 CD LYS A 39 4.564 -12.705 -6.908 1.00 43.13 C ATOM 587 CE LYS A 39 5.930 -12.337 -6.331 1.00 73.10 C ATOM 588 NZ LYS A 39 6.822 -11.731 -7.356 1.00 72.21 N ATOM 0 H LYS A 39 0.444 -12.112 -9.374 1.00 71.32 H new ATOM 0 HA LYS A 39 0.986 -10.454 -7.203 1.00 15.53 H new ATOM 0 HB2 LYS A 39 1.959 -12.670 -7.469 1.00 10.40 H new ATOM 0 HB3 LYS A 39 2.725 -12.219 -8.979 1.00 10.40 H new ATOM 0 HG2 LYS A 39 4.307 -10.773 -7.831 1.00 1.12 H new ATOM 0 HG3 LYS A 39 3.454 -10.955 -6.311 1.00 1.12 H new ATOM 0 HD2 LYS A 39 4.028 -13.332 -6.195 1.00 43.13 H new ATOM 0 HD3 LYS A 39 4.702 -13.297 -7.813 1.00 43.13 H new ATOM 0 HE2 LYS A 39 5.799 -11.638 -5.505 1.00 73.10 H new ATOM 0 HE3 LYS A 39 6.403 -13.229 -5.921 1.00 73.10 H new ATOM 0 HZ1 LYS A 39 7.732 -12.234 -7.365 1.00 72.21 H new ATOM 0 HZ2 LYS A 39 6.376 -11.806 -8.292 1.00 72.21 H new ATOM 0 HZ3 LYS A 39 6.982 -10.729 -7.128 1.00 72.21 H new ATOM 602 N GLU A 40 2.673 -9.480 -9.889 1.00 42.11 N ATOM 603 CA GLU A 40 3.383 -8.330 -10.466 1.00 60.13 C ATOM 604 C GLU A 40 2.451 -7.124 -10.674 1.00 30.15 C ATOM 605 O GLU A 40 2.886 -5.973 -10.612 1.00 71.10 O ATOM 606 CB GLU A 40 4.048 -8.715 -11.793 1.00 40.03 C ATOM 607 CG GLU A 40 3.071 -9.167 -12.873 1.00 3.42 C ATOM 608 CD GLU A 40 3.768 -9.517 -14.176 1.00 41.45 C ATOM 609 OE1 GLU A 40 4.188 -10.682 -14.338 1.00 13.20 O ATOM 610 OE2 GLU A 40 3.910 -8.628 -15.041 1.00 23.01 O ATOM 0 H GLU A 40 2.640 -10.302 -10.493 1.00 42.11 H new ATOM 0 HA GLU A 40 4.153 -8.037 -9.752 1.00 60.13 H new ATOM 0 HB2 GLU A 40 4.613 -7.860 -12.165 1.00 40.03 H new ATOM 0 HB3 GLU A 40 4.765 -9.515 -11.609 1.00 40.03 H new ATOM 0 HG2 GLU A 40 2.516 -10.035 -12.517 1.00 3.42 H new ATOM 0 HG3 GLU A 40 2.343 -8.376 -13.055 1.00 3.42 H new ATOM 617 N ALA A 41 1.169 -7.395 -10.918 1.00 14.04 N ATOM 618 CA ALA A 41 0.169 -6.335 -11.093 1.00 43.41 C ATOM 619 C ALA A 41 0.051 -5.469 -9.829 1.00 31.35 C ATOM 620 O ALA A 41 0.044 -4.238 -9.899 1.00 24.13 O ATOM 621 CB ALA A 41 -1.183 -6.943 -11.454 1.00 53.01 C ATOM 0 H ALA A 41 0.795 -8.341 -11.000 1.00 14.04 H new ATOM 0 HA ALA A 41 0.495 -5.690 -11.909 1.00 43.41 H new ATOM 0 HB1 ALA A 41 -1.917 -6.148 -11.581 1.00 53.01 H new ATOM 0 HB2 ALA A 41 -1.092 -7.506 -12.383 1.00 53.01 H new ATOM 0 HB3 ALA A 41 -1.506 -7.611 -10.656 1.00 53.01 H new ATOM 627 N LEU A 42 -0.030 -6.126 -8.674 1.00 33.52 N ATOM 628 CA LEU A 42 -0.078 -5.435 -7.380 1.00 44.33 C ATOM 629 C LEU A 42 1.233 -4.670 -7.126 1.00 41.23 C ATOM 630 O LEU A 42 1.217 -3.501 -6.728 1.00 14.45 O ATOM 631 CB LEU A 42 -0.354 -6.465 -6.262 1.00 52.14 C ATOM 632 CG LEU A 42 -0.602 -5.899 -4.842 1.00 3.42 C ATOM 633 CD1 LEU A 42 -1.389 -6.901 -3.997 1.00 41.41 C ATOM 634 CD2 LEU A 42 0.714 -5.551 -4.140 1.00 60.12 C ATOM 0 H LEU A 42 -0.064 -7.143 -8.604 1.00 33.52 H new ATOM 0 HA LEU A 42 -0.885 -4.703 -7.388 1.00 44.33 H new ATOM 0 HB2 LEU A 42 -1.224 -7.055 -6.550 1.00 52.14 H new ATOM 0 HB3 LEU A 42 0.493 -7.149 -6.213 1.00 52.14 H new ATOM 0 HG LEU A 42 -1.184 -4.984 -4.951 1.00 3.42 H new ATOM 0 HD11 LEU A 42 -1.554 -6.487 -3.002 1.00 41.41 H new ATOM 0 HD12 LEU A 42 -2.350 -7.101 -4.471 1.00 41.41 H new ATOM 0 HD13 LEU A 42 -0.825 -7.830 -3.914 1.00 41.41 H new ATOM 0 HD21 LEU A 42 0.503 -5.157 -3.146 1.00 60.12 H new ATOM 0 HD22 LEU A 42 1.328 -6.448 -4.052 1.00 60.12 H new ATOM 0 HD23 LEU A 42 1.249 -4.801 -4.722 1.00 60.12 H new ATOM 646 N LEU A 43 2.362 -5.333 -7.379 1.00 21.11 N ATOM 647 CA LEU A 43 3.687 -4.735 -7.166 1.00 54.41 C ATOM 648 C LEU A 43 3.858 -3.421 -7.944 1.00 64.13 C ATOM 649 O LEU A 43 4.293 -2.417 -7.385 1.00 64.52 O ATOM 650 CB LEU A 43 4.790 -5.726 -7.567 1.00 73.23 C ATOM 651 CG LEU A 43 4.793 -7.054 -6.790 1.00 73.30 C ATOM 652 CD1 LEU A 43 5.903 -7.972 -7.292 1.00 62.12 C ATOM 653 CD2 LEU A 43 4.928 -6.807 -5.289 1.00 71.44 C ATOM 0 H LEU A 43 2.388 -6.289 -7.733 1.00 21.11 H new ATOM 0 HA LEU A 43 3.771 -4.506 -6.104 1.00 54.41 H new ATOM 0 HB2 LEU A 43 4.690 -5.946 -8.630 1.00 73.23 H new ATOM 0 HB3 LEU A 43 5.757 -5.242 -7.432 1.00 73.23 H new ATOM 0 HG LEU A 43 3.838 -7.550 -6.964 1.00 73.30 H new ATOM 0 HD11 LEU A 43 5.886 -8.905 -6.729 1.00 62.12 H new ATOM 0 HD12 LEU A 43 5.749 -8.184 -8.350 1.00 62.12 H new ATOM 0 HD13 LEU A 43 6.868 -7.484 -7.157 1.00 62.12 H new ATOM 0 HD21 LEU A 43 4.928 -7.761 -4.762 1.00 71.44 H new ATOM 0 HD22 LEU A 43 5.862 -6.282 -5.089 1.00 71.44 H new ATOM 0 HD23 LEU A 43 4.091 -6.201 -4.943 1.00 71.44 H new ATOM 665 N GLU A 44 3.503 -3.429 -9.229 1.00 71.22 N ATOM 666 CA GLU A 44 3.634 -2.234 -10.076 1.00 54.22 C ATOM 667 C GLU A 44 2.696 -1.102 -9.623 1.00 4.22 C ATOM 668 O GLU A 44 3.075 0.071 -9.631 1.00 3.15 O ATOM 669 CB GLU A 44 3.377 -2.590 -11.547 1.00 34.42 C ATOM 670 CG GLU A 44 4.393 -3.573 -12.124 1.00 12.43 C ATOM 671 CD GLU A 44 5.823 -3.051 -12.060 1.00 22.10 C ATOM 672 OE1 GLU A 44 6.194 -2.211 -12.910 1.00 74.11 O ATOM 673 OE2 GLU A 44 6.585 -3.482 -11.165 1.00 32.05 O ATOM 0 H GLU A 44 3.123 -4.245 -9.709 1.00 71.22 H new ATOM 0 HA GLU A 44 4.656 -1.870 -9.972 1.00 54.22 H new ATOM 0 HB2 GLU A 44 2.378 -3.016 -11.640 1.00 34.42 H new ATOM 0 HB3 GLU A 44 3.390 -1.676 -12.141 1.00 34.42 H new ATOM 0 HG2 GLU A 44 4.330 -4.515 -11.579 1.00 12.43 H new ATOM 0 HG3 GLU A 44 4.136 -3.787 -13.161 1.00 12.43 H new ATOM 680 N CYS A 45 1.472 -1.452 -9.226 1.00 51.30 N ATOM 681 CA CYS A 45 0.532 -0.458 -8.689 1.00 34.32 C ATOM 682 C CYS A 45 1.106 0.218 -7.436 1.00 31.33 C ATOM 683 O CYS A 45 0.942 1.421 -7.233 1.00 1.33 O ATOM 684 CB CYS A 45 -0.821 -1.107 -8.365 1.00 44.05 C ATOM 685 SG CYS A 45 -1.724 -1.692 -9.819 1.00 35.32 S ATOM 0 H CYS A 45 1.108 -2.404 -9.264 1.00 51.30 H new ATOM 0 HA CYS A 45 0.379 0.303 -9.454 1.00 34.32 H new ATOM 0 HB2 CYS A 45 -0.657 -1.947 -7.690 1.00 44.05 H new ATOM 0 HB3 CYS A 45 -1.440 -0.385 -7.832 1.00 44.05 H new ATOM 0 HG CYS A 45 -2.746 -2.400 -9.439 1.00 35.32 H new ATOM 691 N ALA A 46 1.785 -0.567 -6.600 1.00 5.45 N ATOM 692 CA ALA A 46 2.475 -0.036 -5.421 1.00 1.54 C ATOM 693 C ALA A 46 3.734 0.755 -5.820 1.00 11.42 C ATOM 694 O ALA A 46 4.071 1.768 -5.202 1.00 5.53 O ATOM 695 CB ALA A 46 2.833 -1.175 -4.472 1.00 70.13 C ATOM 0 H ALA A 46 1.873 -1.576 -6.717 1.00 5.45 H new ATOM 0 HA ALA A 46 1.802 0.653 -4.910 1.00 1.54 H new ATOM 0 HB1 ALA A 46 3.346 -0.773 -3.598 1.00 70.13 H new ATOM 0 HB2 ALA A 46 1.923 -1.685 -4.156 1.00 70.13 H new ATOM 0 HB3 ALA A 46 3.487 -1.882 -4.983 1.00 70.13 H new ATOM 701 N ASP A 47 4.415 0.288 -6.865 1.00 42.14 N ATOM 702 CA ASP A 47 5.610 0.954 -7.391 1.00 64.50 C ATOM 703 C ASP A 47 5.306 2.418 -7.769 1.00 33.33 C ATOM 704 O ASP A 47 6.125 3.317 -7.546 1.00 21.40 O ATOM 705 CB ASP A 47 6.131 0.173 -8.603 1.00 33.23 C ATOM 706 CG ASP A 47 7.447 0.705 -9.130 1.00 74.01 C ATOM 707 OD1 ASP A 47 8.504 0.370 -8.550 1.00 53.41 O ATOM 708 OD2 ASP A 47 7.436 1.455 -10.128 1.00 3.14 O ATOM 0 H ASP A 47 4.157 -0.559 -7.371 1.00 42.14 H new ATOM 0 HA ASP A 47 6.378 0.971 -6.618 1.00 64.50 H new ATOM 0 HB2 ASP A 47 6.253 -0.875 -8.328 1.00 33.23 H new ATOM 0 HB3 ASP A 47 5.387 0.209 -9.398 1.00 33.23 H new ATOM 713 N LEU A 48 4.116 2.646 -8.327 1.00 43.31 N ATOM 714 CA LEU A 48 3.639 4.004 -8.618 1.00 4.05 C ATOM 715 C LEU A 48 3.680 4.894 -7.365 1.00 3.14 C ATOM 716 O LEU A 48 4.159 6.028 -7.411 1.00 71.34 O ATOM 717 CB LEU A 48 2.210 3.956 -9.172 1.00 54.42 C ATOM 718 CG LEU A 48 2.071 3.332 -10.570 1.00 61.11 C ATOM 719 CD1 LEU A 48 0.600 3.176 -10.949 1.00 55.45 C ATOM 720 CD2 LEU A 48 2.811 4.178 -11.605 1.00 71.32 C ATOM 0 H LEU A 48 3.462 1.908 -8.588 1.00 43.31 H new ATOM 0 HA LEU A 48 4.304 4.436 -9.365 1.00 4.05 H new ATOM 0 HB2 LEU A 48 1.587 3.394 -8.477 1.00 54.42 H new ATOM 0 HB3 LEU A 48 1.815 4.972 -9.204 1.00 54.42 H new ATOM 0 HG LEU A 48 2.521 2.339 -10.551 1.00 61.11 H new ATOM 0 HD11 LEU A 48 0.525 2.733 -11.942 1.00 55.45 H new ATOM 0 HD12 LEU A 48 0.104 2.530 -10.225 1.00 55.45 H new ATOM 0 HD13 LEU A 48 0.119 4.154 -10.951 1.00 55.45 H new ATOM 0 HD21 LEU A 48 2.704 3.724 -12.590 1.00 71.32 H new ATOM 0 HD22 LEU A 48 2.390 5.183 -11.621 1.00 71.32 H new ATOM 0 HD23 LEU A 48 3.868 4.231 -11.343 1.00 71.32 H new ATOM 732 N LEU A 49 3.182 4.368 -6.247 1.00 22.34 N ATOM 733 CA LEU A 49 3.207 5.095 -4.972 1.00 32.13 C ATOM 734 C LEU A 49 4.650 5.351 -4.512 1.00 63.53 C ATOM 735 O LEU A 49 4.969 6.429 -4.013 1.00 1.24 O ATOM 736 CB LEU A 49 2.441 4.327 -3.881 1.00 1.31 C ATOM 737 CG LEU A 49 0.904 4.382 -3.971 1.00 53.31 C ATOM 738 CD1 LEU A 49 0.401 3.794 -5.285 1.00 55.35 C ATOM 739 CD2 LEU A 49 0.277 3.653 -2.784 1.00 54.31 C ATOM 0 H LEU A 49 2.756 3.443 -6.195 1.00 22.34 H new ATOM 0 HA LEU A 49 2.715 6.054 -5.134 1.00 32.13 H new ATOM 0 HB2 LEU A 49 2.750 3.282 -3.914 1.00 1.31 H new ATOM 0 HB3 LEU A 49 2.743 4.718 -2.909 1.00 1.31 H new ATOM 0 HG LEU A 49 0.604 5.429 -3.940 1.00 53.31 H new ATOM 0 HD11 LEU A 49 -0.687 3.849 -5.315 1.00 55.35 H new ATOM 0 HD12 LEU A 49 0.816 4.360 -6.119 1.00 55.35 H new ATOM 0 HD13 LEU A 49 0.714 2.753 -5.361 1.00 55.35 H new ATOM 0 HD21 LEU A 49 -0.809 3.700 -2.861 1.00 54.31 H new ATOM 0 HD22 LEU A 49 0.596 2.611 -2.787 1.00 54.31 H new ATOM 0 HD23 LEU A 49 0.596 4.127 -1.856 1.00 54.31 H new ATOM 751 N SER A 50 5.520 4.358 -4.702 1.00 34.14 N ATOM 752 CA SER A 50 6.939 4.484 -4.329 1.00 71.24 C ATOM 753 C SER A 50 7.575 5.732 -4.956 1.00 34.22 C ATOM 754 O SER A 50 8.281 6.487 -4.289 1.00 44.14 O ATOM 755 CB SER A 50 7.727 3.235 -4.757 1.00 3.40 C ATOM 756 OG SER A 50 9.106 3.351 -4.423 1.00 71.13 O ATOM 0 H SER A 50 5.272 3.457 -5.111 1.00 34.14 H new ATOM 0 HA SER A 50 6.981 4.582 -3.244 1.00 71.24 H new ATOM 0 HB2 SER A 50 7.307 2.354 -4.272 1.00 3.40 H new ATOM 0 HB3 SER A 50 7.623 3.088 -5.832 1.00 3.40 H new ATOM 0 HG SER A 50 9.580 2.541 -4.706 1.00 71.13 H new ATOM 762 N SER A 51 7.318 5.947 -6.244 1.00 75.33 N ATOM 763 CA SER A 51 7.844 7.125 -6.949 1.00 55.15 C ATOM 764 C SER A 51 7.053 8.398 -6.601 1.00 22.23 C ATOM 765 O SER A 51 7.635 9.427 -6.250 1.00 74.14 O ATOM 766 CB SER A 51 7.815 6.896 -8.469 1.00 64.23 C ATOM 767 OG SER A 51 8.310 8.029 -9.171 1.00 72.23 O ATOM 0 H SER A 51 6.752 5.327 -6.823 1.00 75.33 H new ATOM 0 HA SER A 51 8.874 7.267 -6.622 1.00 55.15 H new ATOM 0 HB2 SER A 51 8.414 6.020 -8.719 1.00 64.23 H new ATOM 0 HB3 SER A 51 6.794 6.685 -8.788 1.00 64.23 H new ATOM 0 HG SER A 51 8.281 7.855 -10.135 1.00 72.23 H new ATOM 773 N ALA A 52 5.723 8.309 -6.672 1.00 54.14 N ATOM 774 CA ALA A 52 4.841 9.470 -6.477 1.00 63.43 C ATOM 775 C ALA A 52 4.993 10.115 -5.084 1.00 1.21 C ATOM 776 O ALA A 52 4.880 11.328 -4.944 1.00 12.20 O ATOM 777 CB ALA A 52 3.389 9.065 -6.716 1.00 14.24 C ATOM 0 H ALA A 52 5.227 7.439 -6.865 1.00 54.14 H new ATOM 0 HA ALA A 52 5.141 10.224 -7.204 1.00 63.43 H new ATOM 0 HB1 ALA A 52 2.741 9.929 -6.570 1.00 14.24 H new ATOM 0 HB2 ALA A 52 3.277 8.696 -7.736 1.00 14.24 H new ATOM 0 HB3 ALA A 52 3.110 8.280 -6.013 1.00 14.24 H new ATOM 783 N LEU A 53 5.251 9.301 -4.061 1.00 12.52 N ATOM 784 CA LEU A 53 5.388 9.804 -2.683 1.00 51.53 C ATOM 785 C LEU A 53 6.704 10.569 -2.457 1.00 5.50 C ATOM 786 O LEU A 53 6.807 11.379 -1.533 1.00 54.13 O ATOM 787 CB LEU A 53 5.290 8.638 -1.687 1.00 62.44 C ATOM 788 CG LEU A 53 3.893 8.008 -1.545 1.00 15.02 C ATOM 789 CD1 LEU A 53 3.966 6.711 -0.745 1.00 73.31 C ATOM 790 CD2 LEU A 53 2.930 8.992 -0.883 1.00 64.11 C ATOM 0 H LEU A 53 5.370 8.292 -4.154 1.00 12.52 H new ATOM 0 HA LEU A 53 4.572 10.508 -2.519 1.00 51.53 H new ATOM 0 HB2 LEU A 53 5.991 7.861 -1.993 1.00 62.44 H new ATOM 0 HB3 LEU A 53 5.612 8.991 -0.707 1.00 62.44 H new ATOM 0 HG LEU A 53 3.519 7.774 -2.542 1.00 15.02 H new ATOM 0 HD11 LEU A 53 2.968 6.282 -0.656 1.00 73.31 H new ATOM 0 HD12 LEU A 53 4.621 6.005 -1.256 1.00 73.31 H new ATOM 0 HD13 LEU A 53 4.362 6.919 0.249 1.00 73.31 H new ATOM 0 HD21 LEU A 53 1.946 8.532 -0.790 1.00 64.11 H new ATOM 0 HD22 LEU A 53 3.303 9.256 0.107 1.00 64.11 H new ATOM 0 HD23 LEU A 53 2.853 9.892 -1.493 1.00 64.11 H new ATOM 802 N THR A 54 7.708 10.309 -3.292 1.00 52.32 N ATOM 803 CA THR A 54 9.029 10.936 -3.123 1.00 3.25 C ATOM 804 C THR A 54 9.120 12.290 -3.847 1.00 4.42 C ATOM 805 O THR A 54 9.851 13.185 -3.416 1.00 13.23 O ATOM 806 CB THR A 54 10.177 10.026 -3.626 1.00 33.34 C ATOM 807 OG1 THR A 54 10.106 9.860 -5.053 1.00 63.03 O ATOM 808 CG2 THR A 54 10.134 8.660 -2.947 1.00 54.14 C ATOM 0 H THR A 54 7.639 9.675 -4.088 1.00 52.32 H new ATOM 0 HA THR A 54 9.143 11.093 -2.050 1.00 3.25 H new ATOM 0 HB THR A 54 11.118 10.512 -3.370 1.00 33.34 H new ATOM 0 HG1 THR A 54 9.172 9.731 -5.321 1.00 63.03 H new ATOM 0 HG21 THR A 54 10.951 8.043 -3.320 1.00 54.14 H new ATOM 0 HG22 THR A 54 10.237 8.786 -1.869 1.00 54.14 H new ATOM 0 HG23 THR A 54 9.183 8.174 -3.167 1.00 54.14 H new ATOM 816 N GLU A 55 8.382 12.429 -4.945 1.00 64.50 N ATOM 817 CA GLU A 55 8.344 13.686 -5.709 1.00 30.44 C ATOM 818 C GLU A 55 7.133 14.545 -5.294 1.00 21.00 C ATOM 819 O GLU A 55 6.166 14.029 -4.738 1.00 2.24 O ATOM 820 CB GLU A 55 8.271 13.379 -7.216 1.00 61.03 C ATOM 821 CG GLU A 55 7.031 12.584 -7.622 1.00 21.22 C ATOM 822 CD GLU A 55 6.913 12.396 -9.127 1.00 54.04 C ATOM 823 OE1 GLU A 55 7.569 11.487 -9.676 1.00 12.01 O ATOM 824 OE2 GLU A 55 6.156 13.154 -9.771 1.00 10.05 O ATOM 0 H GLU A 55 7.798 11.687 -5.332 1.00 64.50 H new ATOM 0 HA GLU A 55 9.254 14.246 -5.494 1.00 30.44 H new ATOM 0 HB2 GLU A 55 8.287 14.318 -7.770 1.00 61.03 H new ATOM 0 HB3 GLU A 55 9.161 12.821 -7.508 1.00 61.03 H new ATOM 0 HG2 GLU A 55 7.059 11.607 -7.140 1.00 21.22 H new ATOM 0 HG3 GLU A 55 6.141 13.096 -7.254 1.00 21.22 H new ATOM 831 N PRO A 56 7.157 15.874 -5.540 1.00 24.31 N ATOM 832 CA PRO A 56 5.995 16.727 -5.249 1.00 31.31 C ATOM 833 C PRO A 56 4.801 16.409 -6.166 1.00 23.15 C ATOM 834 O PRO A 56 4.890 16.532 -7.391 1.00 4.31 O ATOM 835 CB PRO A 56 6.514 18.155 -5.520 1.00 25.32 C ATOM 836 CG PRO A 56 8.004 18.035 -5.594 1.00 74.31 C ATOM 837 CD PRO A 56 8.288 16.640 -6.077 1.00 52.22 C ATOM 0 HA PRO A 56 5.628 16.582 -4.233 1.00 31.31 H new ATOM 0 HB2 PRO A 56 6.106 18.550 -6.450 1.00 25.32 H new ATOM 0 HB3 PRO A 56 6.215 18.838 -4.725 1.00 25.32 H new ATOM 0 HG2 PRO A 56 8.421 18.776 -6.276 1.00 74.31 H new ATOM 0 HG3 PRO A 56 8.458 18.209 -4.618 1.00 74.31 H new ATOM 0 HD2 PRO A 56 8.331 16.589 -7.165 1.00 52.22 H new ATOM 0 HD3 PRO A 56 9.242 16.269 -5.703 1.00 52.22 H new ATOM 845 N VAL A 57 3.687 16.013 -5.556 1.00 13.44 N ATOM 846 CA VAL A 57 2.442 15.712 -6.278 1.00 13.15 C ATOM 847 C VAL A 57 1.217 16.153 -5.453 1.00 44.03 C ATOM 848 O VAL A 57 1.322 16.356 -4.241 1.00 2.40 O ATOM 849 CB VAL A 57 2.322 14.196 -6.600 1.00 72.34 C ATOM 850 CG1 VAL A 57 3.337 13.773 -7.664 1.00 43.34 C ATOM 851 CG2 VAL A 57 2.494 13.366 -5.331 1.00 64.32 C ATOM 0 H VAL A 57 3.616 15.890 -4.546 1.00 13.44 H new ATOM 0 HA VAL A 57 2.471 16.267 -7.216 1.00 13.15 H new ATOM 0 HB VAL A 57 1.325 14.015 -7.001 1.00 72.34 H new ATOM 0 HG11 VAL A 57 3.228 12.708 -7.868 1.00 43.34 H new ATOM 0 HG12 VAL A 57 3.161 14.337 -8.580 1.00 43.34 H new ATOM 0 HG13 VAL A 57 4.346 13.972 -7.304 1.00 43.34 H new ATOM 0 HG21 VAL A 57 2.407 12.307 -5.574 1.00 64.32 H new ATOM 0 HG22 VAL A 57 3.476 13.560 -4.900 1.00 64.32 H new ATOM 0 HG23 VAL A 57 1.722 13.637 -4.611 1.00 64.32 H new ATOM 861 N PRO A 58 0.034 16.317 -6.090 1.00 4.15 N ATOM 862 CA PRO A 58 -1.207 16.643 -5.362 1.00 42.43 C ATOM 863 C PRO A 58 -1.667 15.495 -4.442 1.00 32.00 C ATOM 864 O PRO A 58 -1.669 14.326 -4.839 1.00 51.41 O ATOM 865 CB PRO A 58 -2.228 16.890 -6.485 1.00 43.10 C ATOM 866 CG PRO A 58 -1.692 16.145 -7.663 1.00 11.45 C ATOM 867 CD PRO A 58 -0.191 16.206 -7.548 1.00 64.32 C ATOM 0 HA PRO A 58 -1.078 17.497 -4.697 1.00 42.43 H new ATOM 0 HB2 PRO A 58 -3.218 16.528 -6.206 1.00 43.10 H new ATOM 0 HB3 PRO A 58 -2.327 17.954 -6.702 1.00 43.10 H new ATOM 0 HG2 PRO A 58 -2.041 15.112 -7.663 1.00 11.45 H new ATOM 0 HG3 PRO A 58 -2.030 16.596 -8.596 1.00 11.45 H new ATOM 0 HD2 PRO A 58 0.281 15.314 -7.961 1.00 64.32 H new ATOM 0 HD3 PRO A 58 0.219 17.061 -8.085 1.00 64.32 H new ATOM 875 N ASN A 59 -2.067 15.835 -3.216 1.00 22.35 N ATOM 876 CA ASN A 59 -2.496 14.836 -2.228 1.00 70.13 C ATOM 877 C ASN A 59 -3.663 13.983 -2.748 1.00 12.14 C ATOM 878 O ASN A 59 -3.730 12.779 -2.484 1.00 4.14 O ATOM 879 CB ASN A 59 -2.888 15.522 -0.915 1.00 13.41 C ATOM 880 CG ASN A 59 -1.756 16.349 -0.324 1.00 62.13 C ATOM 881 OD1 ASN A 59 -1.987 17.358 0.335 1.00 21.24 O ATOM 882 ND2 ASN A 59 -0.522 15.930 -0.540 1.00 71.31 N ATOM 0 H ASN A 59 -2.104 16.797 -2.880 1.00 22.35 H new ATOM 0 HA ASN A 59 -1.653 14.169 -2.048 1.00 70.13 H new ATOM 0 HB2 ASN A 59 -3.750 16.166 -1.089 1.00 13.41 H new ATOM 0 HB3 ASN A 59 -3.196 14.766 -0.193 1.00 13.41 H new ATOM 0 HD21 ASN A 59 0.267 16.449 -0.155 1.00 71.31 H new ATOM 0 HD22 ASN A 59 -0.359 15.088 -1.092 1.00 71.31 H new ATOM 889 N SER A 60 -4.579 14.611 -3.487 1.00 23.55 N ATOM 890 CA SER A 60 -5.693 13.895 -4.127 1.00 35.14 C ATOM 891 C SER A 60 -5.187 12.726 -4.983 1.00 62.34 C ATOM 892 O SER A 60 -5.725 11.620 -4.925 1.00 2.12 O ATOM 893 CB SER A 60 -6.517 14.851 -5.002 1.00 33.54 C ATOM 894 OG SER A 60 -7.585 14.173 -5.642 1.00 32.23 O ATOM 0 H SER A 60 -4.574 15.616 -3.660 1.00 23.55 H new ATOM 0 HA SER A 60 -6.324 13.496 -3.333 1.00 35.14 H new ATOM 0 HB2 SER A 60 -6.913 15.659 -4.388 1.00 33.54 H new ATOM 0 HB3 SER A 60 -5.872 15.308 -5.752 1.00 33.54 H new ATOM 0 HG SER A 60 -8.093 14.807 -6.191 1.00 32.23 H new ATOM 900 N GLN A 61 -4.133 12.974 -5.763 1.00 70.13 N ATOM 901 CA GLN A 61 -3.520 11.931 -6.593 1.00 54.11 C ATOM 902 C GLN A 61 -2.968 10.787 -5.730 1.00 45.34 C ATOM 903 O GLN A 61 -3.164 9.618 -6.041 1.00 63.33 O ATOM 904 CB GLN A 61 -2.395 12.524 -7.457 1.00 14.34 C ATOM 905 CG GLN A 61 -1.651 11.491 -8.303 1.00 4.54 C ATOM 906 CD GLN A 61 -0.551 12.105 -9.153 1.00 72.22 C ATOM 907 OE1 GLN A 61 -0.641 13.255 -9.571 1.00 32.13 O ATOM 908 NE2 GLN A 61 0.497 11.349 -9.415 1.00 15.40 N ATOM 0 H GLN A 61 -3.685 13.887 -5.838 1.00 70.13 H new ATOM 0 HA GLN A 61 -4.295 11.526 -7.244 1.00 54.11 H new ATOM 0 HB2 GLN A 61 -2.818 13.282 -8.116 1.00 14.34 H new ATOM 0 HB3 GLN A 61 -1.680 13.030 -6.808 1.00 14.34 H new ATOM 0 HG2 GLN A 61 -1.218 10.736 -7.647 1.00 4.54 H new ATOM 0 HG3 GLN A 61 -2.362 10.980 -8.952 1.00 4.54 H new ATOM 0 HE21 GLN A 61 0.542 10.397 -9.053 1.00 15.40 H new ATOM 0 HE22 GLN A 61 1.263 11.717 -9.980 1.00 15.40 H new ATOM 917 N LEU A 62 -2.276 11.136 -4.648 1.00 24.12 N ATOM 918 CA LEU A 62 -1.712 10.135 -3.730 1.00 73.30 C ATOM 919 C LEU A 62 -2.797 9.217 -3.147 1.00 43.20 C ATOM 920 O LEU A 62 -2.675 7.992 -3.185 1.00 20.12 O ATOM 921 CB LEU A 62 -0.953 10.830 -2.593 1.00 2.31 C ATOM 922 CG LEU A 62 0.317 11.580 -3.022 1.00 51.42 C ATOM 923 CD1 LEU A 62 0.957 12.291 -1.831 1.00 71.33 C ATOM 924 CD2 LEU A 62 1.308 10.616 -3.670 1.00 55.25 C ATOM 0 H LEU A 62 -2.089 12.103 -4.381 1.00 24.12 H new ATOM 0 HA LEU A 62 -1.024 9.515 -4.304 1.00 73.30 H new ATOM 0 HB2 LEU A 62 -1.626 11.535 -2.105 1.00 2.31 H new ATOM 0 HB3 LEU A 62 -0.681 10.082 -1.848 1.00 2.31 H new ATOM 0 HG LEU A 62 0.038 12.336 -3.756 1.00 51.42 H new ATOM 0 HD11 LEU A 62 1.855 12.815 -2.159 1.00 71.33 H new ATOM 0 HD12 LEU A 62 0.251 13.008 -1.413 1.00 71.33 H new ATOM 0 HD13 LEU A 62 1.223 11.558 -1.070 1.00 71.33 H new ATOM 0 HD21 LEU A 62 2.203 11.161 -3.969 1.00 55.25 H new ATOM 0 HD22 LEU A 62 1.578 9.838 -2.956 1.00 55.25 H new ATOM 0 HD23 LEU A 62 0.851 10.160 -4.548 1.00 55.25 H new ATOM 936 N VAL A 63 -3.859 9.821 -2.616 1.00 73.44 N ATOM 937 CA VAL A 63 -4.961 9.067 -2.007 1.00 21.42 C ATOM 938 C VAL A 63 -5.707 8.215 -3.050 1.00 5.04 C ATOM 939 O VAL A 63 -5.917 7.021 -2.850 1.00 53.33 O ATOM 940 CB VAL A 63 -5.969 10.011 -1.299 1.00 51.14 C ATOM 941 CG1 VAL A 63 -7.116 9.218 -0.666 1.00 35.51 C ATOM 942 CG2 VAL A 63 -5.254 10.874 -0.255 1.00 12.30 C ATOM 0 H VAL A 63 -3.982 10.833 -2.594 1.00 73.44 H new ATOM 0 HA VAL A 63 -4.514 8.404 -1.266 1.00 21.42 H new ATOM 0 HB VAL A 63 -6.401 10.673 -2.050 1.00 51.14 H new ATOM 0 HG11 VAL A 63 -7.807 9.905 -0.177 1.00 35.51 H new ATOM 0 HG12 VAL A 63 -7.644 8.662 -1.440 1.00 35.51 H new ATOM 0 HG13 VAL A 63 -6.714 8.522 0.070 1.00 35.51 H new ATOM 0 HG21 VAL A 63 -5.976 11.530 0.231 1.00 12.30 H new ATOM 0 HG22 VAL A 63 -4.788 10.231 0.491 1.00 12.30 H new ATOM 0 HG23 VAL A 63 -4.488 11.477 -0.744 1.00 12.30 H new ATOM 952 N ASP A 64 -6.084 8.834 -4.166 1.00 61.33 N ATOM 953 CA ASP A 64 -6.825 8.146 -5.227 1.00 4.25 C ATOM 954 C ASP A 64 -5.997 7.003 -5.854 1.00 73.12 C ATOM 955 O ASP A 64 -6.480 5.873 -5.994 1.00 32.41 O ATOM 956 CB ASP A 64 -7.241 9.165 -6.290 1.00 32.13 C ATOM 957 CG ASP A 64 -8.081 8.566 -7.402 1.00 73.43 C ATOM 958 OD1 ASP A 64 -9.040 7.821 -7.103 1.00 72.44 O ATOM 959 OD2 ASP A 64 -7.811 8.865 -8.585 1.00 1.51 O ATOM 0 H ASP A 64 -5.889 9.816 -4.362 1.00 61.33 H new ATOM 0 HA ASP A 64 -7.714 7.690 -4.792 1.00 4.25 H new ATOM 0 HB2 ASP A 64 -7.803 9.968 -5.813 1.00 32.13 H new ATOM 0 HB3 ASP A 64 -6.347 9.614 -6.722 1.00 32.13 H new ATOM 964 N THR A 65 -4.746 7.300 -6.213 1.00 10.23 N ATOM 965 CA THR A 65 -3.835 6.289 -6.783 1.00 74.24 C ATOM 966 C THR A 65 -3.550 5.166 -5.775 1.00 3.42 C ATOM 967 O THR A 65 -3.475 3.994 -6.141 1.00 70.11 O ATOM 968 CB THR A 65 -2.482 6.911 -7.229 1.00 24.22 C ATOM 969 OG1 THR A 65 -2.703 7.965 -8.180 1.00 44.43 O ATOM 970 CG2 THR A 65 -1.560 5.861 -7.845 1.00 12.14 C ATOM 0 H THR A 65 -4.336 8.229 -6.122 1.00 10.23 H new ATOM 0 HA THR A 65 -4.342 5.880 -7.657 1.00 74.24 H new ATOM 0 HB THR A 65 -2.001 7.316 -6.339 1.00 24.22 H new ATOM 0 HG1 THR A 65 -2.917 8.795 -7.705 1.00 44.43 H new ATOM 0 HG21 THR A 65 -0.623 6.331 -8.146 1.00 12.14 H new ATOM 0 HG22 THR A 65 -1.356 5.081 -7.112 1.00 12.14 H new ATOM 0 HG23 THR A 65 -2.042 5.421 -8.718 1.00 12.14 H new ATOM 978 N GLY A 66 -3.384 5.535 -4.507 1.00 24.03 N ATOM 979 CA GLY A 66 -3.149 4.546 -3.460 1.00 31.22 C ATOM 980 C GLY A 66 -4.405 3.768 -3.078 1.00 62.42 C ATOM 981 O GLY A 66 -4.326 2.634 -2.608 1.00 53.31 O ATOM 0 H GLY A 66 -3.408 6.502 -4.183 1.00 24.03 H new ATOM 0 HA2 GLY A 66 -2.383 3.846 -3.795 1.00 31.22 H new ATOM 0 HA3 GLY A 66 -2.757 5.048 -2.576 1.00 31.22 H new ATOM 985 N HIS A 67 -5.569 4.376 -3.292 1.00 1.44 N ATOM 986 CA HIS A 67 -6.846 3.762 -2.924 1.00 43.22 C ATOM 987 C HIS A 67 -7.075 2.426 -3.658 1.00 61.24 C ATOM 988 O HIS A 67 -7.603 1.476 -3.076 1.00 64.24 O ATOM 989 CB HIS A 67 -8.001 4.732 -3.208 1.00 64.21 C ATOM 990 CG HIS A 67 -9.319 4.281 -2.656 1.00 61.10 C ATOM 991 ND1 HIS A 67 -10.399 3.954 -3.446 1.00 32.24 N ATOM 992 CD2 HIS A 67 -9.732 4.109 -1.376 1.00 32.41 C ATOM 993 CE1 HIS A 67 -11.414 3.602 -2.682 1.00 71.41 C ATOM 994 NE2 HIS A 67 -11.035 3.686 -1.425 1.00 23.23 N ATOM 0 H HIS A 67 -5.656 5.298 -3.720 1.00 1.44 H new ATOM 0 HA HIS A 67 -6.812 3.546 -1.856 1.00 43.22 H new ATOM 0 HB2 HIS A 67 -7.756 5.707 -2.787 1.00 64.21 H new ATOM 0 HB3 HIS A 67 -8.095 4.864 -4.286 1.00 64.21 H new ATOM 0 HD2 HIS A 67 -9.145 4.274 -0.485 1.00 32.41 H new ATOM 0 HE1 HIS A 67 -12.390 3.297 -3.029 1.00 71.41 H new ATOM 0 HE2 HIS A 67 -11.618 3.471 -0.616 1.00 23.23 H new ATOM 1003 N GLN A 68 -6.672 2.350 -4.930 1.00 41.14 N ATOM 1004 CA GLN A 68 -6.839 1.119 -5.720 1.00 21.34 C ATOM 1005 C GLN A 68 -6.023 -0.045 -5.128 1.00 51.34 C ATOM 1006 O GLN A 68 -6.426 -1.206 -5.226 1.00 15.40 O ATOM 1007 CB GLN A 68 -6.436 1.347 -7.187 1.00 33.25 C ATOM 1008 CG GLN A 68 -4.956 1.660 -7.383 1.00 51.43 C ATOM 1009 CD GLN A 68 -4.546 1.755 -8.844 1.00 14.04 C ATOM 1010 OE1 GLN A 68 -5.111 1.092 -9.709 1.00 72.21 O ATOM 1011 NE2 GLN A 68 -3.556 2.576 -9.128 1.00 72.13 N ATOM 0 H GLN A 68 -6.231 3.119 -5.435 1.00 41.14 H new ATOM 0 HA GLN A 68 -7.895 0.852 -5.682 1.00 21.34 H new ATOM 0 HB2 GLN A 68 -6.688 0.458 -7.765 1.00 33.25 H new ATOM 0 HB3 GLN A 68 -7.027 2.168 -7.592 1.00 33.25 H new ATOM 0 HG2 GLN A 68 -4.723 2.602 -6.886 1.00 51.43 H new ATOM 0 HG3 GLN A 68 -4.361 0.887 -6.896 1.00 51.43 H new ATOM 0 HE21 GLN A 68 -3.109 3.112 -8.384 1.00 72.13 H new ATOM 0 HE22 GLN A 68 -3.237 2.676 -10.092 1.00 72.13 H new ATOM 1020 N LEU A 69 -4.886 0.271 -4.498 1.00 31.02 N ATOM 1021 CA LEU A 69 -4.033 -0.748 -3.864 1.00 75.12 C ATOM 1022 C LEU A 69 -4.831 -1.620 -2.887 1.00 54.02 C ATOM 1023 O LEU A 69 -4.578 -2.818 -2.762 1.00 21.44 O ATOM 1024 CB LEU A 69 -2.843 -0.089 -3.138 1.00 51.11 C ATOM 1025 CG LEU A 69 -1.583 0.138 -3.994 1.00 54.02 C ATOM 1026 CD1 LEU A 69 -1.030 -1.191 -4.506 1.00 4.44 C ATOM 1027 CD2 LEU A 69 -1.871 1.087 -5.156 1.00 71.53 C ATOM 0 H LEU A 69 -4.533 1.224 -4.412 1.00 31.02 H new ATOM 0 HA LEU A 69 -3.650 -1.392 -4.656 1.00 75.12 H new ATOM 0 HB2 LEU A 69 -3.170 0.873 -2.742 1.00 51.11 H new ATOM 0 HB3 LEU A 69 -2.573 -0.710 -2.284 1.00 51.11 H new ATOM 0 HG LEU A 69 -0.827 0.602 -3.361 1.00 54.02 H new ATOM 0 HD11 LEU A 69 -0.140 -1.007 -5.108 1.00 4.44 H new ATOM 0 HD12 LEU A 69 -0.770 -1.827 -3.660 1.00 4.44 H new ATOM 0 HD13 LEU A 69 -1.784 -1.688 -5.116 1.00 4.44 H new ATOM 0 HD21 LEU A 69 -0.964 1.229 -5.743 1.00 71.53 H new ATOM 0 HD22 LEU A 69 -2.650 0.662 -5.789 1.00 71.53 H new ATOM 0 HD23 LEU A 69 -2.205 2.049 -4.766 1.00 71.53 H new ATOM 1039 N LEU A 70 -5.801 -1.016 -2.209 1.00 35.24 N ATOM 1040 CA LEU A 70 -6.659 -1.743 -1.268 1.00 55.33 C ATOM 1041 C LEU A 70 -7.535 -2.784 -1.988 1.00 54.14 C ATOM 1042 O LEU A 70 -7.796 -3.864 -1.454 1.00 14.51 O ATOM 1043 CB LEU A 70 -7.527 -0.759 -0.468 1.00 14.42 C ATOM 1044 CG LEU A 70 -6.819 -0.063 0.711 1.00 43.31 C ATOM 1045 CD1 LEU A 70 -6.366 -1.096 1.738 1.00 43.15 C ATOM 1046 CD2 LEU A 70 -5.634 0.778 0.237 1.00 54.54 C ATOM 0 H LEU A 70 -6.017 -0.022 -2.291 1.00 35.24 H new ATOM 0 HA LEU A 70 -6.014 -2.284 -0.576 1.00 55.33 H new ATOM 0 HB2 LEU A 70 -7.901 0.006 -1.148 1.00 14.42 H new ATOM 0 HB3 LEU A 70 -8.395 -1.295 -0.084 1.00 14.42 H new ATOM 0 HG LEU A 70 -7.535 0.612 1.180 1.00 43.31 H new ATOM 0 HD11 LEU A 70 -5.867 -0.592 2.566 1.00 43.15 H new ATOM 0 HD12 LEU A 70 -7.233 -1.640 2.114 1.00 43.15 H new ATOM 0 HD13 LEU A 70 -5.674 -1.796 1.269 1.00 43.15 H new ATOM 0 HD21 LEU A 70 -5.159 1.254 1.095 1.00 54.54 H new ATOM 0 HD22 LEU A 70 -4.912 0.137 -0.268 1.00 54.54 H new ATOM 0 HD23 LEU A 70 -5.985 1.544 -0.454 1.00 54.54 H new ATOM 1058 N ASP A 71 -7.977 -2.466 -3.203 1.00 72.21 N ATOM 1059 CA ASP A 71 -8.742 -3.419 -4.015 1.00 3.20 C ATOM 1060 C ASP A 71 -7.861 -4.641 -4.342 1.00 4.21 C ATOM 1061 O ASP A 71 -8.222 -5.784 -4.044 1.00 75.43 O ATOM 1062 CB ASP A 71 -9.230 -2.742 -5.308 1.00 65.25 C ATOM 1063 CG ASP A 71 -10.398 -3.473 -5.959 1.00 22.53 C ATOM 1064 OD1 ASP A 71 -10.320 -4.705 -6.136 1.00 11.43 O ATOM 1065 OD2 ASP A 71 -11.420 -2.822 -6.275 1.00 70.22 O ATOM 0 H ASP A 71 -7.821 -1.561 -3.648 1.00 72.21 H new ATOM 0 HA ASP A 71 -9.615 -3.753 -3.454 1.00 3.20 H new ATOM 0 HB2 ASP A 71 -9.529 -1.718 -5.085 1.00 65.25 H new ATOM 0 HB3 ASP A 71 -8.403 -2.686 -6.016 1.00 65.25 H new ATOM 1070 N TYR A 72 -6.686 -4.372 -4.920 1.00 33.23 N ATOM 1071 CA TYR A 72 -5.698 -5.416 -5.228 1.00 61.25 C ATOM 1072 C TYR A 72 -5.355 -6.259 -3.986 1.00 22.11 C ATOM 1073 O TYR A 72 -5.397 -7.488 -4.022 1.00 30.42 O ATOM 1074 CB TYR A 72 -4.407 -4.786 -5.780 1.00 24.05 C ATOM 1075 CG TYR A 72 -4.535 -4.201 -7.178 1.00 1.35 C ATOM 1076 CD1 TYR A 72 -5.272 -3.043 -7.409 1.00 14.52 C ATOM 1077 CD2 TYR A 72 -3.907 -4.802 -8.265 1.00 35.05 C ATOM 1078 CE1 TYR A 72 -5.382 -2.506 -8.677 1.00 63.10 C ATOM 1079 CE2 TYR A 72 -4.014 -4.271 -9.537 1.00 24.22 C ATOM 1080 CZ TYR A 72 -4.751 -3.123 -9.736 1.00 23.24 C ATOM 1081 OH TYR A 72 -4.857 -2.591 -11.000 1.00 63.11 O ATOM 0 H TYR A 72 -6.392 -3.432 -5.187 1.00 33.23 H new ATOM 0 HA TYR A 72 -6.143 -6.069 -5.979 1.00 61.25 H new ATOM 0 HB2 TYR A 72 -4.083 -3.999 -5.099 1.00 24.05 H new ATOM 0 HB3 TYR A 72 -3.623 -5.543 -5.788 1.00 24.05 H new ATOM 0 HD1 TYR A 72 -5.767 -2.556 -6.582 1.00 14.52 H new ATOM 0 HD2 TYR A 72 -3.326 -5.699 -8.112 1.00 35.05 H new ATOM 0 HE1 TYR A 72 -5.959 -1.608 -8.838 1.00 63.10 H new ATOM 0 HE2 TYR A 72 -3.523 -4.753 -10.370 1.00 24.22 H new ATOM 0 HH TYR A 72 -4.033 -2.109 -11.222 1.00 63.11 H new ATOM 1091 N CYS A 73 -5.019 -5.582 -2.889 1.00 5.45 N ATOM 1092 CA CYS A 73 -4.591 -6.253 -1.652 1.00 74.02 C ATOM 1093 C CYS A 73 -5.703 -7.118 -1.039 1.00 73.31 C ATOM 1094 O CYS A 73 -5.463 -8.259 -0.646 1.00 53.51 O ATOM 1095 CB CYS A 73 -4.117 -5.221 -0.622 1.00 21.42 C ATOM 1096 SG CYS A 73 -2.624 -4.320 -1.105 1.00 73.43 S ATOM 0 H CYS A 73 -5.034 -4.564 -2.827 1.00 5.45 H new ATOM 0 HA CYS A 73 -3.767 -6.914 -1.920 1.00 74.02 H new ATOM 0 HB2 CYS A 73 -4.919 -4.504 -0.447 1.00 21.42 H new ATOM 0 HB3 CYS A 73 -3.931 -5.728 0.325 1.00 21.42 H new ATOM 0 HG CYS A 73 -2.935 -3.391 -1.960 1.00 73.43 H new ATOM 1102 N SER A 74 -6.914 -6.570 -0.954 1.00 64.30 N ATOM 1103 CA SER A 74 -8.049 -7.290 -0.349 1.00 20.53 C ATOM 1104 C SER A 74 -8.370 -8.589 -1.104 1.00 4.42 C ATOM 1105 O SER A 74 -8.810 -9.571 -0.504 1.00 43.25 O ATOM 1106 CB SER A 74 -9.296 -6.395 -0.296 1.00 1.21 C ATOM 1107 OG SER A 74 -9.728 -6.026 -1.597 1.00 3.43 O ATOM 0 H SER A 74 -7.141 -5.635 -1.293 1.00 64.30 H new ATOM 0 HA SER A 74 -7.755 -7.554 0.667 1.00 20.53 H new ATOM 0 HB2 SER A 74 -10.100 -6.920 0.220 1.00 1.21 H new ATOM 0 HB3 SER A 74 -9.077 -5.498 0.284 1.00 1.21 H new ATOM 0 HG SER A 74 -8.964 -6.039 -2.211 1.00 3.43 H new ATOM 1113 N GLY A 75 -8.154 -8.589 -2.419 1.00 4.14 N ATOM 1114 CA GLY A 75 -8.368 -9.797 -3.210 1.00 22.42 C ATOM 1115 C GLY A 75 -7.179 -10.758 -3.174 1.00 32.02 C ATOM 1116 O GLY A 75 -7.333 -11.942 -2.869 1.00 74.05 O ATOM 0 H GLY A 75 -7.836 -7.779 -2.951 1.00 4.14 H new ATOM 0 HA2 GLY A 75 -9.255 -10.312 -2.842 1.00 22.42 H new ATOM 0 HA3 GLY A 75 -8.569 -9.516 -4.244 1.00 22.42 H new ATOM 1120 N TYR A 76 -5.986 -10.237 -3.466 1.00 24.20 N ATOM 1121 CA TYR A 76 -4.770 -11.057 -3.569 1.00 32.31 C ATOM 1122 C TYR A 76 -4.405 -11.750 -2.241 1.00 71.50 C ATOM 1123 O TYR A 76 -3.881 -12.866 -2.242 1.00 41.40 O ATOM 1124 CB TYR A 76 -3.594 -10.188 -4.047 1.00 35.11 C ATOM 1125 CG TYR A 76 -2.313 -10.963 -4.315 1.00 51.41 C ATOM 1126 CD1 TYR A 76 -2.157 -11.689 -5.490 1.00 0.11 C ATOM 1127 CD2 TYR A 76 -1.266 -10.975 -3.396 1.00 14.14 C ATOM 1128 CE1 TYR A 76 -0.999 -12.400 -5.745 1.00 32.40 C ATOM 1129 CE2 TYR A 76 -0.104 -11.684 -3.645 1.00 23.52 C ATOM 1130 CZ TYR A 76 0.023 -12.397 -4.820 1.00 71.33 C ATOM 1131 OH TYR A 76 1.176 -13.111 -5.071 1.00 35.10 O ATOM 0 H TYR A 76 -5.832 -9.243 -3.637 1.00 24.20 H new ATOM 0 HA TYR A 76 -4.974 -11.844 -4.295 1.00 32.31 H new ATOM 0 HB2 TYR A 76 -3.888 -9.668 -4.959 1.00 35.11 H new ATOM 0 HB3 TYR A 76 -3.393 -9.424 -3.296 1.00 35.11 H new ATOM 0 HD1 TYR A 76 -2.955 -11.698 -6.217 1.00 0.11 H new ATOM 0 HD2 TYR A 76 -1.363 -10.422 -2.474 1.00 14.14 H new ATOM 0 HE1 TYR A 76 -0.896 -12.956 -6.665 1.00 32.40 H new ATOM 0 HE2 TYR A 76 0.700 -11.679 -2.923 1.00 23.52 H new ATOM 0 HH TYR A 76 1.797 -13.004 -4.321 1.00 35.10 H new ATOM 1141 N VAL A 77 -4.689 -11.093 -1.114 1.00 11.22 N ATOM 1142 CA VAL A 77 -4.295 -11.609 0.207 1.00 75.22 C ATOM 1143 C VAL A 77 -4.805 -13.043 0.458 1.00 43.34 C ATOM 1144 O VAL A 77 -4.096 -13.871 1.031 1.00 63.35 O ATOM 1145 CB VAL A 77 -4.783 -10.683 1.352 1.00 34.25 C ATOM 1146 CG1 VAL A 77 -6.310 -10.641 1.427 1.00 13.35 C ATOM 1147 CG2 VAL A 77 -4.184 -11.115 2.689 1.00 32.31 C ATOM 0 H VAL A 77 -5.189 -10.204 -1.085 1.00 11.22 H new ATOM 0 HA VAL A 77 -3.205 -11.630 0.203 1.00 75.22 H new ATOM 0 HB VAL A 77 -4.437 -9.673 1.131 1.00 34.25 H new ATOM 0 HG11 VAL A 77 -6.616 -9.983 2.240 1.00 13.35 H new ATOM 0 HG12 VAL A 77 -6.710 -10.265 0.485 1.00 13.35 H new ATOM 0 HG13 VAL A 77 -6.693 -11.645 1.609 1.00 13.35 H new ATOM 0 HG21 VAL A 77 -4.539 -10.452 3.478 1.00 32.31 H new ATOM 0 HG22 VAL A 77 -4.488 -12.138 2.910 1.00 32.31 H new ATOM 0 HG23 VAL A 77 -3.097 -11.063 2.634 1.00 32.31 H new ATOM 1157 N ASP A 78 -6.027 -13.338 0.013 1.00 72.40 N ATOM 1158 CA ASP A 78 -6.627 -14.661 0.223 1.00 23.03 C ATOM 1159 C ASP A 78 -5.916 -15.739 -0.617 1.00 24.04 C ATOM 1160 O ASP A 78 -5.914 -16.922 -0.265 1.00 2.21 O ATOM 1161 CB ASP A 78 -8.124 -14.611 -0.117 1.00 14.14 C ATOM 1162 CG ASP A 78 -8.871 -15.865 0.306 1.00 13.52 C ATOM 1163 OD1 ASP A 78 -9.146 -16.016 1.516 1.00 52.35 O ATOM 1164 OD2 ASP A 78 -9.196 -16.702 -0.563 1.00 44.44 O ATOM 0 H ASP A 78 -6.621 -12.682 -0.494 1.00 72.40 H new ATOM 0 HA ASP A 78 -6.507 -14.931 1.272 1.00 23.03 H new ATOM 0 HB2 ASP A 78 -8.573 -13.746 0.370 1.00 14.14 H new ATOM 0 HB3 ASP A 78 -8.242 -14.469 -1.191 1.00 14.14 H new ATOM 1169 N CYS A 79 -5.297 -15.317 -1.718 1.00 72.30 N ATOM 1170 CA CYS A 79 -4.593 -16.238 -2.624 1.00 34.43 C ATOM 1171 C CYS A 79 -3.168 -16.556 -2.135 1.00 54.15 C ATOM 1172 O CYS A 79 -2.544 -17.507 -2.608 1.00 72.13 O ATOM 1173 CB CYS A 79 -4.532 -15.646 -4.040 1.00 71.14 C ATOM 1174 SG CYS A 79 -6.154 -15.293 -4.767 1.00 21.22 S ATOM 0 H CYS A 79 -5.266 -14.340 -2.010 1.00 72.30 H new ATOM 0 HA CYS A 79 -5.157 -17.171 -2.637 1.00 34.43 H new ATOM 0 HB2 CYS A 79 -3.950 -14.725 -4.012 1.00 71.14 H new ATOM 0 HB3 CYS A 79 -3.998 -16.340 -4.689 1.00 71.14 H new ATOM 0 HG CYS A 79 -5.997 -14.796 -5.958 1.00 21.22 H new ATOM 1180 N ILE A 80 -2.659 -15.759 -1.192 1.00 1.51 N ATOM 1181 CA ILE A 80 -1.303 -15.954 -0.651 1.00 54.14 C ATOM 1182 C ILE A 80 -1.201 -17.248 0.180 1.00 51.42 C ATOM 1183 O ILE A 80 -1.828 -17.366 1.234 1.00 53.43 O ATOM 1184 CB ILE A 80 -0.874 -14.755 0.238 1.00 65.12 C ATOM 1185 CG1 ILE A 80 -0.900 -13.446 -0.570 1.00 72.31 C ATOM 1186 CG2 ILE A 80 0.514 -14.993 0.837 1.00 62.20 C ATOM 1187 CD1 ILE A 80 -0.527 -12.218 0.237 1.00 22.42 C ATOM 0 H ILE A 80 -3.162 -14.971 -0.784 1.00 1.51 H new ATOM 0 HA ILE A 80 -0.636 -16.029 -1.510 1.00 54.14 H new ATOM 0 HB ILE A 80 -1.587 -14.666 1.058 1.00 65.12 H new ATOM 0 HG12 ILE A 80 -0.214 -13.537 -1.412 1.00 72.31 H new ATOM 0 HG13 ILE A 80 -1.898 -13.306 -0.985 1.00 72.31 H new ATOM 0 HG21 ILE A 80 0.794 -14.141 1.456 1.00 62.20 H new ATOM 0 HG22 ILE A 80 0.497 -15.895 1.448 1.00 62.20 H new ATOM 0 HG23 ILE A 80 1.241 -15.113 0.034 1.00 62.20 H new ATOM 0 HD11 ILE A 80 -0.569 -11.336 -0.402 1.00 22.42 H new ATOM 0 HD12 ILE A 80 -1.227 -12.100 1.064 1.00 22.42 H new ATOM 0 HD13 ILE A 80 0.483 -12.334 0.630 1.00 22.42 H new ATOM 1199 N PRO A 81 -0.405 -18.235 -0.277 1.00 75.24 N ATOM 1200 CA PRO A 81 -0.218 -19.503 0.451 1.00 62.21 C ATOM 1201 C PRO A 81 0.544 -19.318 1.777 1.00 21.02 C ATOM 1202 O PRO A 81 0.071 -19.730 2.840 1.00 45.13 O ATOM 1203 CB PRO A 81 0.594 -20.376 -0.528 1.00 71.10 C ATOM 1204 CG PRO A 81 0.512 -19.676 -1.848 1.00 2.44 C ATOM 1205 CD PRO A 81 0.361 -18.214 -1.534 1.00 15.03 C ATOM 0 HA PRO A 81 -1.172 -19.945 0.737 1.00 62.21 H new ATOM 0 HB2 PRO A 81 1.629 -20.475 -0.200 1.00 71.10 H new ATOM 0 HB3 PRO A 81 0.181 -21.383 -0.591 1.00 71.10 H new ATOM 0 HG2 PRO A 81 1.408 -19.857 -2.442 1.00 2.44 H new ATOM 0 HG3 PRO A 81 -0.335 -20.039 -2.430 1.00 2.44 H new ATOM 0 HD2 PRO A 81 1.327 -17.723 -1.412 1.00 15.03 H new ATOM 0 HD3 PRO A 81 -0.170 -17.682 -2.324 1.00 15.03 H new ATOM 1213 N GLN A 82 1.722 -18.692 1.707 1.00 40.22 N ATOM 1214 CA GLN A 82 2.558 -18.460 2.895 1.00 21.53 C ATOM 1215 C GLN A 82 1.849 -17.572 3.929 1.00 5.34 C ATOM 1216 O GLN A 82 1.768 -16.352 3.771 1.00 23.12 O ATOM 1217 CB GLN A 82 3.895 -17.822 2.490 1.00 50.41 C ATOM 1218 CG GLN A 82 4.760 -18.718 1.609 1.00 70.23 C ATOM 1219 CD GLN A 82 6.027 -18.025 1.136 1.00 41.32 C ATOM 1220 OE1 GLN A 82 7.068 -18.091 1.780 1.00 2.21 O ATOM 1221 NE2 GLN A 82 5.946 -17.348 0.009 1.00 63.30 N ATOM 0 H GLN A 82 2.122 -18.335 0.839 1.00 40.22 H new ATOM 0 HA GLN A 82 2.743 -19.430 3.357 1.00 21.53 H new ATOM 0 HB2 GLN A 82 3.697 -16.890 1.961 1.00 50.41 H new ATOM 0 HB3 GLN A 82 4.453 -17.566 3.391 1.00 50.41 H new ATOM 0 HG2 GLN A 82 5.028 -19.617 2.164 1.00 70.23 H new ATOM 0 HG3 GLN A 82 4.181 -19.038 0.743 1.00 70.23 H new ATOM 0 HE21 GLN A 82 5.064 -17.313 -0.503 1.00 63.30 H new ATOM 0 HE22 GLN A 82 6.765 -16.859 -0.352 1.00 63.30 H new ATOM 1230 N THR A 83 1.342 -18.192 4.993 1.00 20.04 N ATOM 1231 CA THR A 83 0.625 -17.463 6.048 1.00 31.44 C ATOM 1232 C THR A 83 1.537 -16.433 6.731 1.00 54.35 C ATOM 1233 O THR A 83 1.082 -15.364 7.139 1.00 0.41 O ATOM 1234 CB THR A 83 0.047 -18.421 7.119 1.00 62.12 C ATOM 1235 OG1 THR A 83 -0.680 -19.485 6.483 1.00 54.51 O ATOM 1236 CG2 THR A 83 -0.881 -17.678 8.079 1.00 30.31 C ATOM 0 H THR A 83 1.412 -19.197 5.151 1.00 20.04 H new ATOM 0 HA THR A 83 -0.201 -16.945 5.561 1.00 31.44 H new ATOM 0 HB THR A 83 0.881 -18.831 7.689 1.00 62.12 H new ATOM 0 HG1 THR A 83 -1.041 -20.088 7.166 1.00 54.51 H new ATOM 0 HG21 THR A 83 -1.272 -18.375 8.820 1.00 30.31 H new ATOM 0 HG22 THR A 83 -0.326 -16.887 8.583 1.00 30.31 H new ATOM 0 HG23 THR A 83 -1.708 -17.241 7.520 1.00 30.31 H new ATOM 1244 N ARG A 84 2.831 -16.753 6.840 1.00 21.44 N ATOM 1245 CA ARG A 84 3.813 -15.817 7.408 1.00 21.12 C ATOM 1246 C ARG A 84 3.832 -14.490 6.631 1.00 23.02 C ATOM 1247 O ARG A 84 3.928 -13.414 7.223 1.00 72.11 O ATOM 1248 CB ARG A 84 5.221 -16.435 7.420 1.00 15.55 C ATOM 1249 CG ARG A 84 5.342 -17.678 8.295 1.00 31.24 C ATOM 1250 CD ARG A 84 6.787 -18.160 8.395 1.00 10.41 C ATOM 1251 NE ARG A 84 6.913 -19.377 9.200 1.00 23.50 N ATOM 1252 CZ ARG A 84 8.048 -19.965 9.466 1.00 14.20 C ATOM 1253 NH1 ARG A 84 9.162 -19.477 9.025 1.00 31.32 N ATOM 1254 NH2 ARG A 84 8.067 -21.044 10.179 1.00 24.02 N ATOM 0 H ARG A 84 3.223 -17.647 6.545 1.00 21.44 H new ATOM 0 HA ARG A 84 3.510 -15.613 8.435 1.00 21.12 H new ATOM 0 HB2 ARG A 84 5.503 -16.692 6.399 1.00 15.55 H new ATOM 0 HB3 ARG A 84 5.933 -15.687 7.768 1.00 15.55 H new ATOM 0 HG2 ARG A 84 4.962 -17.459 9.293 1.00 31.24 H new ATOM 0 HG3 ARG A 84 4.721 -18.474 7.884 1.00 31.24 H new ATOM 0 HD2 ARG A 84 7.175 -18.348 7.394 1.00 10.41 H new ATOM 0 HD3 ARG A 84 7.401 -17.373 8.832 1.00 10.41 H new ATOM 0 HE ARG A 84 6.060 -19.791 9.577 1.00 23.50 H new ATOM 0 HH11 ARG A 84 9.159 -18.625 8.464 1.00 31.32 H new ATOM 0 HH12 ARG A 84 10.043 -19.944 9.238 1.00 31.32 H new ATOM 0 HH21 ARG A 84 7.195 -21.436 10.534 1.00 24.02 H new ATOM 0 HH22 ARG A 84 8.954 -21.503 10.386 1.00 24.02 H new ATOM 1268 N ASN A 85 3.745 -14.573 5.303 1.00 54.21 N ATOM 1269 CA ASN A 85 3.666 -13.374 4.461 1.00 51.01 C ATOM 1270 C ASN A 85 2.281 -12.724 4.565 1.00 70.52 C ATOM 1271 O ASN A 85 2.162 -11.504 4.654 1.00 23.22 O ATOM 1272 CB ASN A 85 3.962 -13.706 2.995 1.00 75.53 C ATOM 1273 CG ASN A 85 5.353 -14.269 2.782 1.00 23.11 C ATOM 1274 OD1 ASN A 85 6.273 -14.009 3.550 1.00 15.23 O ATOM 1275 ND2 ASN A 85 5.520 -15.035 1.726 1.00 22.10 N ATOM 0 H ASN A 85 3.727 -15.453 4.787 1.00 54.21 H new ATOM 0 HA ASN A 85 4.419 -12.674 4.823 1.00 51.01 H new ATOM 0 HB2 ASN A 85 3.226 -14.426 2.636 1.00 75.53 H new ATOM 0 HB3 ASN A 85 3.845 -12.804 2.394 1.00 75.53 H new ATOM 0 HD21 ASN A 85 6.437 -15.433 1.525 1.00 22.10 H new ATOM 0 HD22 ASN A 85 4.732 -15.231 1.108 1.00 22.10 H new ATOM 1282 N LYS A 86 1.236 -13.552 4.554 1.00 62.24 N ATOM 1283 CA LYS A 86 -0.147 -13.063 4.624 1.00 62.33 C ATOM 1284 C LYS A 86 -0.397 -12.221 5.889 1.00 64.35 C ATOM 1285 O LYS A 86 -1.134 -11.233 5.851 1.00 55.41 O ATOM 1286 CB LYS A 86 -1.127 -14.244 4.563 1.00 71.35 C ATOM 1287 CG LYS A 86 -2.596 -13.831 4.591 1.00 50.04 C ATOM 1288 CD LYS A 86 -3.525 -14.977 4.187 1.00 32.44 C ATOM 1289 CE LYS A 86 -3.397 -16.182 5.110 1.00 13.21 C ATOM 1290 NZ LYS A 86 -4.268 -17.305 4.672 1.00 35.24 N ATOM 0 H LYS A 86 1.318 -14.567 4.497 1.00 62.24 H new ATOM 0 HA LYS A 86 -0.312 -12.413 3.765 1.00 62.33 H new ATOM 0 HB2 LYS A 86 -0.937 -14.814 3.654 1.00 71.35 H new ATOM 0 HB3 LYS A 86 -0.931 -14.910 5.403 1.00 71.35 H new ATOM 0 HG2 LYS A 86 -2.857 -13.490 5.593 1.00 50.04 H new ATOM 0 HG3 LYS A 86 -2.748 -12.988 3.917 1.00 50.04 H new ATOM 0 HD2 LYS A 86 -4.556 -14.625 4.195 1.00 32.44 H new ATOM 0 HD3 LYS A 86 -3.300 -15.280 3.165 1.00 32.44 H new ATOM 0 HE2 LYS A 86 -2.359 -16.514 5.133 1.00 13.21 H new ATOM 0 HE3 LYS A 86 -3.661 -15.891 6.127 1.00 13.21 H new ATOM 0 HZ1 LYS A 86 -4.154 -18.107 5.324 1.00 35.24 H new ATOM 0 HZ2 LYS A 86 -5.261 -16.995 4.674 1.00 35.24 H new ATOM 0 HZ3 LYS A 86 -3.999 -17.599 3.711 1.00 35.24 H new ATOM 1304 N PHE A 87 0.223 -12.612 7.003 1.00 1.32 N ATOM 1305 CA PHE A 87 0.102 -11.859 8.259 1.00 34.24 C ATOM 1306 C PHE A 87 0.686 -10.441 8.109 1.00 72.15 C ATOM 1307 O PHE A 87 0.004 -9.445 8.361 1.00 23.21 O ATOM 1308 CB PHE A 87 0.822 -12.604 9.393 1.00 2.45 C ATOM 1309 CG PHE A 87 0.538 -12.051 10.767 1.00 34.45 C ATOM 1310 CD1 PHE A 87 -0.583 -12.460 11.474 1.00 22.41 C ATOM 1311 CD2 PHE A 87 1.390 -11.122 11.352 1.00 62.41 C ATOM 1312 CE1 PHE A 87 -0.849 -11.957 12.734 1.00 72.03 C ATOM 1313 CE2 PHE A 87 1.128 -10.617 12.613 1.00 5.35 C ATOM 1314 CZ PHE A 87 0.007 -11.034 13.303 1.00 22.12 C ATOM 0 H PHE A 87 0.813 -13.442 7.065 1.00 1.32 H new ATOM 0 HA PHE A 87 -0.957 -11.771 8.502 1.00 34.24 H new ATOM 0 HB2 PHE A 87 0.530 -13.654 9.367 1.00 2.45 H new ATOM 0 HB3 PHE A 87 1.896 -12.568 9.213 1.00 2.45 H new ATOM 0 HD1 PHE A 87 -1.257 -13.181 11.035 1.00 22.41 H new ATOM 0 HD2 PHE A 87 2.267 -10.790 10.816 1.00 62.41 H new ATOM 0 HE1 PHE A 87 -1.725 -12.285 13.273 1.00 72.03 H new ATOM 0 HE2 PHE A 87 1.800 -9.897 13.057 1.00 5.35 H new ATOM 0 HZ PHE A 87 -0.200 -10.639 14.287 1.00 22.12 H new ATOM 1324 N ALA A 88 1.946 -10.366 7.676 1.00 35.44 N ATOM 1325 CA ALA A 88 2.618 -9.081 7.441 1.00 60.42 C ATOM 1326 C ALA A 88 1.897 -8.265 6.356 1.00 2.22 C ATOM 1327 O ALA A 88 1.808 -7.041 6.432 1.00 41.23 O ATOM 1328 CB ALA A 88 4.075 -9.316 7.055 1.00 35.21 C ATOM 0 H ALA A 88 2.526 -11.182 7.480 1.00 35.44 H new ATOM 0 HA ALA A 88 2.585 -8.505 8.366 1.00 60.42 H new ATOM 0 HB1 ALA A 88 4.565 -8.358 6.883 1.00 35.21 H new ATOM 0 HB2 ALA A 88 4.584 -9.844 7.861 1.00 35.21 H new ATOM 0 HB3 ALA A 88 4.118 -9.914 6.145 1.00 35.21 H new ATOM 1334 N PHE A 89 1.377 -8.959 5.352 1.00 4.34 N ATOM 1335 CA PHE A 89 0.624 -8.323 4.272 1.00 73.31 C ATOM 1336 C PHE A 89 -0.654 -7.659 4.814 1.00 74.14 C ATOM 1337 O PHE A 89 -0.957 -6.513 4.492 1.00 32.13 O ATOM 1338 CB PHE A 89 0.277 -9.369 3.202 1.00 12.52 C ATOM 1339 CG PHE A 89 -0.331 -8.794 1.948 1.00 15.20 C ATOM 1340 CD1 PHE A 89 0.477 -8.386 0.895 1.00 21.13 C ATOM 1341 CD2 PHE A 89 -1.707 -8.671 1.815 1.00 15.45 C ATOM 1342 CE1 PHE A 89 -0.077 -7.865 -0.259 1.00 3.25 C ATOM 1343 CE2 PHE A 89 -2.261 -8.151 0.662 1.00 22.24 C ATOM 1344 CZ PHE A 89 -1.445 -7.750 -0.376 1.00 62.25 C ATOM 0 H PHE A 89 1.463 -9.971 5.261 1.00 4.34 H new ATOM 0 HA PHE A 89 1.240 -7.544 3.823 1.00 73.31 H new ATOM 0 HB2 PHE A 89 1.183 -9.914 2.936 1.00 12.52 H new ATOM 0 HB3 PHE A 89 -0.417 -10.093 3.629 1.00 12.52 H new ATOM 0 HD1 PHE A 89 1.550 -8.477 0.979 1.00 21.13 H new ATOM 0 HD2 PHE A 89 -2.352 -8.986 2.622 1.00 15.45 H new ATOM 0 HE1 PHE A 89 0.563 -7.548 -1.069 1.00 3.25 H new ATOM 0 HE2 PHE A 89 -3.333 -8.058 0.573 1.00 22.24 H new ATOM 0 HZ PHE A 89 -1.878 -7.346 -1.279 1.00 62.25 H new ATOM 1354 N ARG A 90 -1.396 -8.389 5.646 1.00 52.43 N ATOM 1355 CA ARG A 90 -2.621 -7.864 6.261 1.00 35.34 C ATOM 1356 C ARG A 90 -2.338 -6.641 7.144 1.00 52.15 C ATOM 1357 O ARG A 90 -3.008 -5.610 7.021 1.00 4.52 O ATOM 1358 CB ARG A 90 -3.316 -8.958 7.088 1.00 14.32 C ATOM 1359 CG ARG A 90 -4.055 -10.007 6.252 1.00 13.55 C ATOM 1360 CD ARG A 90 -5.372 -9.473 5.682 1.00 52.23 C ATOM 1361 NE ARG A 90 -5.179 -8.368 4.738 1.00 1.55 N ATOM 1362 CZ ARG A 90 -6.000 -7.359 4.616 1.00 32.31 C ATOM 1363 NH1 ARG A 90 -7.059 -7.280 5.353 1.00 20.41 N ATOM 1364 NH2 ARG A 90 -5.762 -6.428 3.752 1.00 44.43 N ATOM 0 H ARG A 90 -1.172 -9.348 5.912 1.00 52.43 H new ATOM 0 HA ARG A 90 -3.281 -7.547 5.453 1.00 35.34 H new ATOM 0 HB2 ARG A 90 -2.570 -9.461 7.703 1.00 14.32 H new ATOM 0 HB3 ARG A 90 -4.026 -8.487 7.768 1.00 14.32 H new ATOM 0 HG2 ARG A 90 -3.414 -10.334 5.434 1.00 13.55 H new ATOM 0 HG3 ARG A 90 -4.257 -10.883 6.868 1.00 13.55 H new ATOM 0 HD2 ARG A 90 -5.900 -10.284 5.181 1.00 52.23 H new ATOM 0 HD3 ARG A 90 -6.007 -9.137 6.502 1.00 52.23 H new ATOM 0 HE ARG A 90 -4.353 -8.388 4.140 1.00 1.55 H new ATOM 0 HH11 ARG A 90 -7.260 -8.009 6.037 1.00 20.41 H new ATOM 0 HH12 ARG A 90 -7.694 -6.488 5.250 1.00 20.41 H new ATOM 0 HH21 ARG A 90 -4.931 -6.479 3.163 1.00 44.43 H new ATOM 0 HH22 ARG A 90 -6.405 -5.642 3.659 1.00 44.43 H new ATOM 1378 N GLU A 91 -1.347 -6.754 8.026 1.00 72.13 N ATOM 1379 CA GLU A 91 -1.011 -5.658 8.942 1.00 75.11 C ATOM 1380 C GLU A 91 -0.469 -4.436 8.172 1.00 30.31 C ATOM 1381 O GLU A 91 -0.873 -3.303 8.432 1.00 1.22 O ATOM 1382 CB GLU A 91 -0.015 -6.140 10.020 1.00 10.04 C ATOM 1383 CG GLU A 91 1.410 -6.394 9.523 1.00 43.43 C ATOM 1384 CD GLU A 91 2.412 -5.366 10.034 1.00 13.34 C ATOM 1385 OE1 GLU A 91 2.527 -4.281 9.428 1.00 54.52 O ATOM 1386 OE2 GLU A 91 3.088 -5.641 11.047 1.00 43.41 O ATOM 0 H GLU A 91 -0.765 -7.585 8.128 1.00 72.13 H new ATOM 0 HA GLU A 91 -1.923 -5.341 9.448 1.00 75.11 H new ATOM 0 HB2 GLU A 91 0.022 -5.396 10.816 1.00 10.04 H new ATOM 0 HB3 GLU A 91 -0.398 -7.060 10.461 1.00 10.04 H new ATOM 0 HG2 GLU A 91 1.726 -7.389 9.837 1.00 43.43 H new ATOM 0 HG3 GLU A 91 1.415 -6.387 8.433 1.00 43.43 H new ATOM 1393 N ALA A 92 0.408 -4.673 7.193 1.00 21.04 N ATOM 1394 CA ALA A 92 0.972 -3.590 6.375 1.00 60.42 C ATOM 1395 C ALA A 92 -0.121 -2.852 5.585 1.00 60.41 C ATOM 1396 O ALA A 92 -0.149 -1.621 5.544 1.00 1.35 O ATOM 1397 CB ALA A 92 2.037 -4.138 5.431 1.00 42.22 C ATOM 0 H ALA A 92 0.744 -5.604 6.946 1.00 21.04 H new ATOM 0 HA ALA A 92 1.435 -2.870 7.049 1.00 60.42 H new ATOM 0 HB1 ALA A 92 2.445 -3.324 4.832 1.00 42.22 H new ATOM 0 HB2 ALA A 92 2.837 -4.598 6.012 1.00 42.22 H new ATOM 0 HB3 ALA A 92 1.591 -4.884 4.774 1.00 42.22 H new ATOM 1403 N VAL A 93 -1.022 -3.611 4.960 1.00 21.23 N ATOM 1404 CA VAL A 93 -2.169 -3.023 4.258 1.00 60.25 C ATOM 1405 C VAL A 93 -3.052 -2.216 5.226 1.00 13.30 C ATOM 1406 O VAL A 93 -3.604 -1.177 4.858 1.00 14.54 O ATOM 1407 CB VAL A 93 -3.012 -4.112 3.544 1.00 73.41 C ATOM 1408 CG1 VAL A 93 -4.326 -3.540 3.017 1.00 43.01 C ATOM 1409 CG2 VAL A 93 -2.212 -4.740 2.406 1.00 22.25 C ATOM 0 H VAL A 93 -0.982 -4.630 4.924 1.00 21.23 H new ATOM 0 HA VAL A 93 -1.776 -2.346 3.500 1.00 60.25 H new ATOM 0 HB VAL A 93 -3.252 -4.884 4.275 1.00 73.41 H new ATOM 0 HG11 VAL A 93 -4.893 -4.328 2.522 1.00 43.01 H new ATOM 0 HG12 VAL A 93 -4.908 -3.141 3.848 1.00 43.01 H new ATOM 0 HG13 VAL A 93 -4.116 -2.742 2.305 1.00 43.01 H new ATOM 0 HG21 VAL A 93 -2.816 -5.502 1.914 1.00 22.25 H new ATOM 0 HG22 VAL A 93 -1.941 -3.970 1.684 1.00 22.25 H new ATOM 0 HG23 VAL A 93 -1.307 -5.197 2.806 1.00 22.25 H new ATOM 1419 N SER A 94 -3.165 -2.691 6.468 1.00 72.54 N ATOM 1420 CA SER A 94 -3.876 -1.940 7.513 1.00 42.20 C ATOM 1421 C SER A 94 -3.219 -0.569 7.730 1.00 5.32 C ATOM 1422 O SER A 94 -3.900 0.455 7.749 1.00 22.53 O ATOM 1423 CB SER A 94 -3.911 -2.724 8.836 1.00 33.15 C ATOM 1424 OG SER A 94 -4.639 -3.940 8.700 1.00 63.43 O ATOM 0 H SER A 94 -2.779 -3.583 6.776 1.00 72.54 H new ATOM 0 HA SER A 94 -4.902 -1.792 7.177 1.00 42.20 H new ATOM 0 HB2 SER A 94 -2.893 -2.942 9.159 1.00 33.15 H new ATOM 0 HB3 SER A 94 -4.367 -2.110 9.613 1.00 33.15 H new ATOM 0 HG SER A 94 -4.144 -4.555 8.119 1.00 63.43 H new ATOM 1430 N LYS A 95 -1.890 -0.556 7.880 1.00 52.42 N ATOM 1431 CA LYS A 95 -1.132 0.706 7.949 1.00 2.10 C ATOM 1432 C LYS A 95 -1.412 1.588 6.718 1.00 44.45 C ATOM 1433 O LYS A 95 -1.566 2.803 6.835 1.00 44.55 O ATOM 1434 CB LYS A 95 0.387 0.448 8.046 1.00 61.52 C ATOM 1435 CG LYS A 95 0.915 0.139 9.448 1.00 13.05 C ATOM 1436 CD LYS A 95 0.330 -1.144 10.027 1.00 12.53 C ATOM 1437 CE LYS A 95 1.085 -1.602 11.270 1.00 51.11 C ATOM 1438 NZ LYS A 95 2.489 -1.985 10.956 1.00 14.04 N ATOM 0 H LYS A 95 -1.317 -1.396 7.956 1.00 52.42 H new ATOM 0 HA LYS A 95 -1.463 1.224 8.849 1.00 2.10 H new ATOM 0 HB2 LYS A 95 0.639 -0.385 7.390 1.00 61.52 H new ATOM 0 HB3 LYS A 95 0.912 1.324 7.664 1.00 61.52 H new ATOM 0 HG2 LYS A 95 2.001 0.055 9.412 1.00 13.05 H new ATOM 0 HG3 LYS A 95 0.682 0.972 10.111 1.00 13.05 H new ATOM 0 HD2 LYS A 95 -0.719 -0.984 10.277 1.00 12.53 H new ATOM 0 HD3 LYS A 95 0.361 -1.930 9.273 1.00 12.53 H new ATOM 0 HE2 LYS A 95 1.084 -0.803 12.011 1.00 51.11 H new ATOM 0 HE3 LYS A 95 0.568 -2.451 11.717 1.00 51.11 H new ATOM 0 HZ1 LYS A 95 2.916 -2.447 11.784 1.00 14.04 H new ATOM 0 HZ2 LYS A 95 2.498 -2.642 10.150 1.00 14.04 H new ATOM 0 HZ3 LYS A 95 3.035 -1.134 10.715 1.00 14.04 H new ATOM 1452 N LEU A 96 -1.486 0.962 5.541 1.00 74.42 N ATOM 1453 CA LEU A 96 -1.682 1.694 4.285 1.00 20.31 C ATOM 1454 C LEU A 96 -3.023 2.448 4.259 1.00 33.34 C ATOM 1455 O LEU A 96 -3.051 3.659 4.033 1.00 23.30 O ATOM 1456 CB LEU A 96 -1.598 0.727 3.093 1.00 13.24 C ATOM 1457 CG LEU A 96 -1.745 1.367 1.700 1.00 62.22 C ATOM 1458 CD1 LEU A 96 -0.626 2.374 1.441 1.00 30.21 C ATOM 1459 CD2 LEU A 96 -1.766 0.291 0.613 1.00 2.13 C ATOM 0 H LEU A 96 -1.413 -0.049 5.430 1.00 74.42 H new ATOM 0 HA LEU A 96 -0.887 2.436 4.211 1.00 20.31 H new ATOM 0 HB2 LEU A 96 -0.639 0.210 3.135 1.00 13.24 H new ATOM 0 HB3 LEU A 96 -2.374 -0.030 3.208 1.00 13.24 H new ATOM 0 HG LEU A 96 -2.694 1.903 1.672 1.00 62.22 H new ATOM 0 HD11 LEU A 96 -0.753 2.812 0.451 1.00 30.21 H new ATOM 0 HD12 LEU A 96 -0.664 3.162 2.194 1.00 30.21 H new ATOM 0 HD13 LEU A 96 0.338 1.868 1.494 1.00 30.21 H new ATOM 0 HD21 LEU A 96 -1.870 0.763 -0.364 1.00 2.13 H new ATOM 0 HD22 LEU A 96 -0.836 -0.276 0.644 1.00 2.13 H new ATOM 0 HD23 LEU A 96 -2.607 -0.381 0.783 1.00 2.13 H new ATOM 1471 N GLU A 97 -4.132 1.750 4.520 1.00 15.41 N ATOM 1472 CA GLU A 97 -5.456 2.389 4.469 1.00 63.11 C ATOM 1473 C GLU A 97 -5.642 3.401 5.609 1.00 1.15 C ATOM 1474 O GLU A 97 -6.204 4.481 5.405 1.00 71.14 O ATOM 1475 CB GLU A 97 -6.592 1.348 4.484 1.00 43.04 C ATOM 1476 CG GLU A 97 -6.633 0.457 5.721 1.00 74.25 C ATOM 1477 CD GLU A 97 -7.877 -0.424 5.758 1.00 2.35 C ATOM 1478 OE1 GLU A 97 -8.915 0.028 6.294 1.00 52.54 O ATOM 1479 OE2 GLU A 97 -7.834 -1.560 5.236 1.00 5.31 O ATOM 0 H GLU A 97 -4.144 0.760 4.765 1.00 15.41 H new ATOM 0 HA GLU A 97 -5.506 2.930 3.524 1.00 63.11 H new ATOM 0 HB2 GLU A 97 -7.545 1.871 4.399 1.00 43.04 H new ATOM 0 HB3 GLU A 97 -6.496 0.715 3.602 1.00 43.04 H new ATOM 0 HG2 GLU A 97 -5.744 -0.173 5.742 1.00 74.25 H new ATOM 0 HG3 GLU A 97 -6.604 1.079 6.615 1.00 74.25 H new ATOM 1486 N LEU A 98 -5.151 3.063 6.800 1.00 44.35 N ATOM 1487 CA LEU A 98 -5.250 3.962 7.953 1.00 43.14 C ATOM 1488 C LEU A 98 -4.392 5.221 7.754 1.00 52.12 C ATOM 1489 O LEU A 98 -4.800 6.328 8.113 1.00 50.15 O ATOM 1490 CB LEU A 98 -4.839 3.233 9.242 1.00 61.22 C ATOM 1491 CG LEU A 98 -5.705 2.015 9.607 1.00 3.24 C ATOM 1492 CD1 LEU A 98 -5.249 1.396 10.926 1.00 72.24 C ATOM 1493 CD2 LEU A 98 -7.180 2.399 9.668 1.00 35.22 C ATOM 0 H LEU A 98 -4.682 2.178 6.994 1.00 44.35 H new ATOM 0 HA LEU A 98 -6.290 4.275 8.043 1.00 43.14 H new ATOM 0 HB2 LEU A 98 -3.804 2.907 9.142 1.00 61.22 H new ATOM 0 HB3 LEU A 98 -4.871 3.943 10.069 1.00 61.22 H new ATOM 0 HG LEU A 98 -5.581 1.266 8.825 1.00 3.24 H new ATOM 0 HD11 LEU A 98 -5.877 0.537 11.161 1.00 72.24 H new ATOM 0 HD12 LEU A 98 -4.212 1.073 10.837 1.00 72.24 H new ATOM 0 HD13 LEU A 98 -5.332 2.135 11.723 1.00 72.24 H new ATOM 0 HD21 LEU A 98 -7.774 1.523 9.928 1.00 35.22 H new ATOM 0 HD22 LEU A 98 -7.324 3.172 10.423 1.00 35.22 H new ATOM 0 HD23 LEU A 98 -7.498 2.778 8.697 1.00 35.22 H new ATOM 1505 N SER A 99 -3.210 5.054 7.164 1.00 11.02 N ATOM 1506 CA SER A 99 -2.325 6.190 6.881 1.00 20.24 C ATOM 1507 C SER A 99 -2.878 7.046 5.728 1.00 32.34 C ATOM 1508 O SER A 99 -2.627 8.249 5.663 1.00 21.41 O ATOM 1509 CB SER A 99 -0.903 5.709 6.550 1.00 61.44 C ATOM 1510 OG SER A 99 -0.007 6.798 6.369 1.00 72.14 O ATOM 0 H SER A 99 -2.841 4.149 6.872 1.00 11.02 H new ATOM 0 HA SER A 99 -2.282 6.807 7.778 1.00 20.24 H new ATOM 0 HB2 SER A 99 -0.539 5.069 7.354 1.00 61.44 H new ATOM 0 HB3 SER A 99 -0.926 5.102 5.645 1.00 61.44 H new ATOM 0 HG SER A 99 0.887 6.455 6.162 1.00 72.14 H new ATOM 1516 N LEU A 100 -3.632 6.423 4.819 1.00 12.24 N ATOM 1517 CA LEU A 100 -4.291 7.154 3.726 1.00 40.41 C ATOM 1518 C LEU A 100 -5.436 8.045 4.242 1.00 43.50 C ATOM 1519 O LEU A 100 -5.593 9.187 3.799 1.00 34.44 O ATOM 1520 CB LEU A 100 -4.829 6.176 2.659 1.00 73.11 C ATOM 1521 CG LEU A 100 -3.769 5.536 1.741 1.00 24.35 C ATOM 1522 CD1 LEU A 100 -4.401 4.485 0.824 1.00 60.11 C ATOM 1523 CD2 LEU A 100 -3.058 6.609 0.917 1.00 41.33 C ATOM 0 H LEU A 100 -3.803 5.417 4.815 1.00 12.24 H new ATOM 0 HA LEU A 100 -3.538 7.799 3.273 1.00 40.41 H new ATOM 0 HB2 LEU A 100 -5.373 5.379 3.165 1.00 73.11 H new ATOM 0 HB3 LEU A 100 -5.549 6.707 2.036 1.00 73.11 H new ATOM 0 HG LEU A 100 -3.032 5.036 2.370 1.00 24.35 H new ATOM 0 HD11 LEU A 100 -3.632 4.049 0.187 1.00 60.11 H new ATOM 0 HD12 LEU A 100 -4.858 3.702 1.429 1.00 60.11 H new ATOM 0 HD13 LEU A 100 -5.163 4.955 0.203 1.00 60.11 H new ATOM 0 HD21 LEU A 100 -2.313 6.140 0.274 1.00 41.33 H new ATOM 0 HD22 LEU A 100 -3.786 7.138 0.302 1.00 41.33 H new ATOM 0 HD23 LEU A 100 -2.567 7.316 1.586 1.00 41.33 H new ATOM 1535 N GLN A 101 -6.240 7.526 5.173 1.00 20.32 N ATOM 1536 CA GLN A 101 -7.382 8.285 5.702 1.00 72.14 C ATOM 1537 C GLN A 101 -6.929 9.470 6.575 1.00 30.33 C ATOM 1538 O GLN A 101 -7.522 10.548 6.519 1.00 62.43 O ATOM 1539 CB GLN A 101 -8.347 7.372 6.480 1.00 23.05 C ATOM 1540 CG GLN A 101 -7.752 6.723 7.727 1.00 21.23 C ATOM 1541 CD GLN A 101 -8.746 5.831 8.457 1.00 0.44 C ATOM 1542 OE1 GLN A 101 -9.632 5.239 7.851 1.00 35.03 O ATOM 1543 NE2 GLN A 101 -8.602 5.718 9.763 1.00 41.42 N ATOM 0 H GLN A 101 -6.126 6.595 5.574 1.00 20.32 H new ATOM 0 HA GLN A 101 -7.917 8.694 4.845 1.00 72.14 H new ATOM 0 HB2 GLN A 101 -9.220 7.956 6.773 1.00 23.05 H new ATOM 0 HB3 GLN A 101 -8.699 6.586 5.812 1.00 23.05 H new ATOM 0 HG2 GLN A 101 -6.881 6.133 7.444 1.00 21.23 H new ATOM 0 HG3 GLN A 101 -7.403 7.502 8.405 1.00 21.23 H new ATOM 0 HE21 GLN A 101 -7.855 6.223 10.239 1.00 41.42 H new ATOM 0 HE22 GLN A 101 -9.238 5.125 10.297 1.00 41.42 H new ATOM 1552 N GLU A 102 -5.872 9.282 7.370 1.00 53.23 N ATOM 1553 CA GLU A 102 -5.330 10.383 8.177 1.00 11.20 C ATOM 1554 C GLU A 102 -4.619 11.421 7.292 1.00 42.51 C ATOM 1555 O GLU A 102 -4.659 12.618 7.573 1.00 41.33 O ATOM 1556 CB GLU A 102 -4.375 9.861 9.267 1.00 54.13 C ATOM 1557 CG GLU A 102 -3.151 9.126 8.735 1.00 74.23 C ATOM 1558 CD GLU A 102 -2.201 8.690 9.840 1.00 61.44 C ATOM 1559 OE1 GLU A 102 -2.658 8.019 10.791 1.00 43.34 O ATOM 1560 OE2 GLU A 102 -1.002 9.024 9.772 1.00 73.15 O ATOM 0 H GLU A 102 -5.380 8.394 7.473 1.00 53.23 H new ATOM 0 HA GLU A 102 -6.171 10.871 8.669 1.00 11.20 H new ATOM 0 HB2 GLU A 102 -4.042 10.703 9.874 1.00 54.13 H new ATOM 0 HB3 GLU A 102 -4.927 9.191 9.926 1.00 54.13 H new ATOM 0 HG2 GLU A 102 -3.474 8.250 8.173 1.00 74.23 H new ATOM 0 HG3 GLU A 102 -2.618 9.773 8.038 1.00 74.23 H new ATOM 1567 N LEU A 103 -3.985 10.961 6.211 1.00 62.04 N ATOM 1568 CA LEU A 103 -3.317 11.867 5.270 1.00 71.10 C ATOM 1569 C LEU A 103 -4.309 12.835 4.613 1.00 12.51 C ATOM 1570 O LEU A 103 -4.132 14.046 4.672 1.00 63.34 O ATOM 1571 CB LEU A 103 -2.583 11.083 4.175 1.00 32.32 C ATOM 1572 CG LEU A 103 -1.868 11.954 3.126 1.00 55.11 C ATOM 1573 CD1 LEU A 103 -0.765 12.791 3.772 1.00 54.23 C ATOM 1574 CD2 LEU A 103 -1.308 11.095 1.995 1.00 62.32 C ATOM 0 H LEU A 103 -3.919 9.973 5.965 1.00 62.04 H new ATOM 0 HA LEU A 103 -2.596 12.443 5.850 1.00 71.10 H new ATOM 0 HB2 LEU A 103 -1.848 10.430 4.646 1.00 32.32 H new ATOM 0 HB3 LEU A 103 -3.301 10.440 3.665 1.00 32.32 H new ATOM 0 HG LEU A 103 -2.602 12.637 2.699 1.00 55.11 H new ATOM 0 HD11 LEU A 103 -0.275 13.397 3.010 1.00 54.23 H new ATOM 0 HD12 LEU A 103 -1.199 13.442 4.530 1.00 54.23 H new ATOM 0 HD13 LEU A 103 -0.033 12.131 4.237 1.00 54.23 H new ATOM 0 HD21 LEU A 103 -0.808 11.733 1.267 1.00 62.32 H new ATOM 0 HD22 LEU A 103 -0.594 10.379 2.401 1.00 62.32 H new ATOM 0 HD23 LEU A 103 -2.122 10.558 1.508 1.00 62.32 H new ATOM 1586 N GLN A 104 -5.352 12.294 3.985 1.00 53.23 N ATOM 1587 CA GLN A 104 -6.315 13.116 3.241 1.00 45.25 C ATOM 1588 C GLN A 104 -6.993 14.173 4.132 1.00 11.21 C ATOM 1589 O GLN A 104 -7.206 15.310 3.704 1.00 52.41 O ATOM 1590 CB GLN A 104 -7.366 12.226 2.559 1.00 42.44 C ATOM 1591 CG GLN A 104 -8.141 11.328 3.515 1.00 10.32 C ATOM 1592 CD GLN A 104 -9.063 10.360 2.791 1.00 61.01 C ATOM 1593 OE1 GLN A 104 -10.220 10.662 2.529 1.00 51.11 O ATOM 1594 NE2 GLN A 104 -8.557 9.190 2.456 1.00 62.22 N ATOM 0 H GLN A 104 -5.554 11.294 3.974 1.00 53.23 H new ATOM 0 HA GLN A 104 -5.756 13.655 2.476 1.00 45.25 H new ATOM 0 HB2 GLN A 104 -8.071 12.862 2.024 1.00 42.44 H new ATOM 0 HB3 GLN A 104 -6.870 11.603 1.815 1.00 42.44 H new ATOM 0 HG2 GLN A 104 -7.438 10.764 4.128 1.00 10.32 H new ATOM 0 HG3 GLN A 104 -8.730 11.947 4.192 1.00 10.32 H new ATOM 0 HE21 GLN A 104 -7.589 8.968 2.688 1.00 62.22 H new ATOM 0 HE22 GLN A 104 -9.133 8.507 1.964 1.00 62.22 H new ATOM 1603 N VAL A 105 -7.314 13.806 5.373 1.00 31.31 N ATOM 1604 CA VAL A 105 -7.957 14.743 6.307 1.00 52.00 C ATOM 1605 C VAL A 105 -6.951 15.743 6.909 1.00 34.24 C ATOM 1606 O VAL A 105 -7.311 16.873 7.243 1.00 63.22 O ATOM 1607 CB VAL A 105 -8.687 13.997 7.456 1.00 75.25 C ATOM 1608 CG1 VAL A 105 -9.713 13.016 6.900 1.00 65.44 C ATOM 1609 CG2 VAL A 105 -7.695 13.280 8.370 1.00 24.25 C ATOM 0 H VAL A 105 -7.143 12.876 5.756 1.00 31.31 H new ATOM 0 HA VAL A 105 -8.690 15.297 5.721 1.00 52.00 H new ATOM 0 HB VAL A 105 -9.213 14.742 8.053 1.00 75.25 H new ATOM 0 HG11 VAL A 105 -10.212 12.505 7.724 1.00 65.44 H new ATOM 0 HG12 VAL A 105 -10.451 13.558 6.309 1.00 65.44 H new ATOM 0 HG13 VAL A 105 -9.211 12.283 6.269 1.00 65.44 H new ATOM 0 HG21 VAL A 105 -8.237 12.767 9.164 1.00 24.25 H new ATOM 0 HG22 VAL A 105 -7.127 12.553 7.791 1.00 24.25 H new ATOM 0 HG23 VAL A 105 -7.012 14.008 8.808 1.00 24.25 H new ATOM 1619 N SER A 106 -5.691 15.327 7.035 1.00 63.33 N ATOM 1620 CA SER A 106 -4.633 16.176 7.618 1.00 43.21 C ATOM 1621 C SER A 106 -3.641 16.658 6.549 1.00 71.02 C ATOM 1622 O SER A 106 -2.524 17.069 6.864 1.00 53.31 O ATOM 1623 CB SER A 106 -3.879 15.406 8.713 1.00 25.10 C ATOM 1624 OG SER A 106 -4.750 15.038 9.774 1.00 73.10 O ATOM 0 H SER A 106 -5.370 14.404 6.742 1.00 63.33 H new ATOM 0 HA SER A 106 -5.115 17.052 8.052 1.00 43.21 H new ATOM 0 HB2 SER A 106 -3.424 14.512 8.286 1.00 25.10 H new ATOM 0 HB3 SER A 106 -3.068 16.022 9.102 1.00 25.10 H new ATOM 0 HG SER A 106 -4.245 14.548 10.456 1.00 73.10 H new ATOM 1630 N SER A 107 -4.058 16.598 5.286 1.00 72.50 N ATOM 1631 CA SER A 107 -3.192 16.969 4.157 1.00 74.33 C ATOM 1632 C SER A 107 -2.796 18.453 4.204 1.00 52.33 C ATOM 1633 O SER A 107 -1.644 18.774 4.494 1.00 14.31 O ATOM 1634 CB SER A 107 -3.878 16.643 2.820 1.00 53.51 C ATOM 1635 OG SER A 107 -5.110 17.337 2.677 1.00 21.05 O ATOM 0 H SER A 107 -4.993 16.295 5.013 1.00 72.50 H new ATOM 0 HA SER A 107 -2.279 16.380 4.241 1.00 74.33 H new ATOM 0 HB2 SER A 107 -3.214 16.907 1.997 1.00 53.51 H new ATOM 0 HB3 SER A 107 -4.056 15.570 2.755 1.00 53.51 H new ATOM 0 HG SER A 107 -5.845 16.765 2.981 1.00 21.05 H new ATOM 1641 N ALA A 108 -3.757 19.340 3.913 1.00 24.33 N ATOM 1642 CA ALA A 108 -3.560 20.803 3.975 1.00 64.21 C ATOM 1643 C ALA A 108 -2.616 21.352 2.881 1.00 41.13 C ATOM 1644 O ALA A 108 -3.005 22.213 2.090 1.00 51.25 O ATOM 1645 CB ALA A 108 -3.063 21.221 5.357 1.00 23.42 C ATOM 0 H ALA A 108 -4.697 19.067 3.627 1.00 24.33 H new ATOM 0 HA ALA A 108 -4.539 21.243 3.786 1.00 64.21 H new ATOM 0 HB1 ALA A 108 -2.924 22.302 5.382 1.00 23.42 H new ATOM 0 HB2 ALA A 108 -3.796 20.932 6.110 1.00 23.42 H new ATOM 0 HB3 ALA A 108 -2.114 20.728 5.567 1.00 23.42 H new ATOM 1651 N ALA A 109 -1.377 20.860 2.849 1.00 44.13 N ATOM 1652 CA ALA A 109 -0.331 21.377 1.953 1.00 4.11 C ATOM 1653 C ALA A 109 -0.702 21.335 0.456 1.00 30.00 C ATOM 1654 O ALA A 109 -0.086 22.042 -0.347 1.00 60.11 O ATOM 1655 CB ALA A 109 0.958 20.602 2.184 1.00 22.32 C ATOM 0 H ALA A 109 -1.066 20.091 3.442 1.00 44.13 H new ATOM 0 HA ALA A 109 -0.207 22.431 2.202 1.00 4.11 H new ATOM 0 HB1 ALA A 109 1.735 20.983 1.521 1.00 22.32 H new ATOM 0 HB2 ALA A 109 1.274 20.722 3.220 1.00 22.32 H new ATOM 0 HB3 ALA A 109 0.790 19.545 1.976 1.00 22.32 H new ATOM 1661 N ALA A 110 -1.678 20.499 0.087 1.00 21.24 N ATOM 1662 CA ALA A 110 -2.124 20.354 -1.315 1.00 63.32 C ATOM 1663 C ALA A 110 -1.091 19.619 -2.195 1.00 2.14 C ATOM 1664 O ALA A 110 -1.366 18.534 -2.709 1.00 10.21 O ATOM 1665 CB ALA A 110 -2.485 21.713 -1.920 1.00 3.32 C ATOM 0 H ALA A 110 -2.183 19.904 0.743 1.00 21.24 H new ATOM 0 HA ALA A 110 -3.020 19.733 -1.294 1.00 63.32 H new ATOM 0 HB1 ALA A 110 -2.810 21.577 -2.952 1.00 3.32 H new ATOM 0 HB2 ALA A 110 -3.291 22.166 -1.342 1.00 3.32 H new ATOM 0 HB3 ALA A 110 -1.612 22.365 -1.897 1.00 3.32 H new ATOM 1671 N GLY A 111 0.095 20.205 -2.363 1.00 60.12 N ATOM 1672 CA GLY A 111 1.121 19.602 -3.216 1.00 20.33 C ATOM 1673 C GLY A 111 2.545 19.913 -2.762 1.00 31.43 C ATOM 1674 O GLY A 111 3.354 20.438 -3.529 1.00 22.24 O ATOM 0 H GLY A 111 0.367 21.085 -1.926 1.00 60.12 H new ATOM 0 HA2 GLY A 111 0.980 18.521 -3.232 1.00 20.33 H new ATOM 0 HA3 GLY A 111 0.988 19.956 -4.238 1.00 20.33 H new ATOM 1678 N VAL A 112 2.854 19.585 -1.509 1.00 2.34 N ATOM 1679 CA VAL A 112 4.190 19.826 -0.945 1.00 23.44 C ATOM 1680 C VAL A 112 4.832 18.517 -0.442 1.00 64.41 C ATOM 1681 O VAL A 112 4.238 17.794 0.361 1.00 64.34 O ATOM 1682 CB VAL A 112 4.125 20.845 0.224 1.00 13.21 C ATOM 1683 CG1 VAL A 112 5.516 21.120 0.795 1.00 74.44 C ATOM 1684 CG2 VAL A 112 3.459 22.143 -0.229 1.00 32.32 C ATOM 0 H VAL A 112 2.198 19.150 -0.860 1.00 2.34 H new ATOM 0 HA VAL A 112 4.805 20.236 -1.746 1.00 23.44 H new ATOM 0 HB VAL A 112 3.520 20.407 1.018 1.00 13.21 H new ATOM 0 HG11 VAL A 112 5.439 21.837 1.612 1.00 74.44 H new ATOM 0 HG12 VAL A 112 5.947 20.191 1.168 1.00 74.44 H new ATOM 0 HG13 VAL A 112 6.156 21.529 0.013 1.00 74.44 H new ATOM 0 HG21 VAL A 112 3.423 22.844 0.605 1.00 32.32 H new ATOM 0 HG22 VAL A 112 4.033 22.580 -1.046 1.00 32.32 H new ATOM 0 HG23 VAL A 112 2.445 21.932 -0.569 1.00 32.32 H new ATOM 1694 N PRO A 113 6.058 18.196 -0.906 1.00 73.11 N ATOM 1695 CA PRO A 113 6.757 16.961 -0.508 1.00 5.13 C ATOM 1696 C PRO A 113 7.325 17.022 0.922 1.00 61.44 C ATOM 1697 O PRO A 113 7.799 18.067 1.374 1.00 43.02 O ATOM 1698 CB PRO A 113 7.889 16.865 -1.537 1.00 2.43 C ATOM 1699 CG PRO A 113 8.191 18.284 -1.887 1.00 55.25 C ATOM 1700 CD PRO A 113 6.865 19.006 -1.848 1.00 12.52 C ATOM 0 HA PRO A 113 6.088 16.100 -0.495 1.00 5.13 H new ATOM 0 HB2 PRO A 113 8.763 16.363 -1.121 1.00 2.43 H new ATOM 0 HB3 PRO A 113 7.582 16.296 -2.414 1.00 2.43 H new ATOM 0 HG2 PRO A 113 8.895 18.720 -1.179 1.00 55.25 H new ATOM 0 HG3 PRO A 113 8.647 18.355 -2.875 1.00 55.25 H new ATOM 0 HD2 PRO A 113 6.977 20.033 -1.500 1.00 12.52 H new ATOM 0 HD3 PRO A 113 6.404 19.052 -2.835 1.00 12.52 H new ATOM 1708 N GLY A 114 7.255 15.897 1.633 1.00 41.13 N ATOM 1709 CA GLY A 114 7.827 15.805 2.977 1.00 62.43 C ATOM 1710 C GLY A 114 7.175 16.727 4.014 1.00 12.25 C ATOM 1711 O GLY A 114 7.675 16.849 5.134 1.00 42.03 O ATOM 0 H GLY A 114 6.810 15.040 1.303 1.00 41.13 H new ATOM 0 HA2 GLY A 114 7.744 14.775 3.323 1.00 62.43 H new ATOM 0 HA3 GLY A 114 8.890 16.037 2.921 1.00 62.43 H new ATOM 1715 N THR A 115 6.064 17.376 3.654 1.00 32.33 N ATOM 1716 CA THR A 115 5.359 18.273 4.590 1.00 23.23 C ATOM 1717 C THR A 115 4.826 17.512 5.815 1.00 52.21 C ATOM 1718 O THR A 115 5.048 17.914 6.959 1.00 31.02 O ATOM 1719 CB THR A 115 4.185 19.025 3.910 1.00 53.32 C ATOM 1720 OG1 THR A 115 3.491 19.833 4.876 1.00 62.41 O ATOM 1721 CG2 THR A 115 3.206 18.056 3.248 1.00 4.42 C ATOM 0 H THR A 115 5.633 17.302 2.733 1.00 32.33 H new ATOM 0 HA THR A 115 6.099 19.004 4.916 1.00 23.23 H new ATOM 0 HB THR A 115 4.605 19.664 3.133 1.00 53.32 H new ATOM 0 HG1 THR A 115 3.112 20.620 4.432 1.00 62.41 H new ATOM 0 HG21 THR A 115 2.397 18.618 2.782 1.00 4.42 H new ATOM 0 HG22 THR A 115 3.728 17.474 2.488 1.00 4.42 H new ATOM 0 HG23 THR A 115 2.794 17.384 4.001 1.00 4.42 H new ATOM 1729 N ASN A 116 4.131 16.403 5.569 1.00 50.40 N ATOM 1730 CA ASN A 116 3.603 15.555 6.641 1.00 2.33 C ATOM 1731 C ASN A 116 4.333 14.203 6.665 1.00 42.42 C ATOM 1732 O ASN A 116 4.411 13.525 5.641 1.00 64.14 O ATOM 1733 CB ASN A 116 2.095 15.322 6.445 1.00 61.14 C ATOM 1734 CG ASN A 116 1.277 16.594 6.575 1.00 33.04 C ATOM 1735 OD1 ASN A 116 1.621 17.502 7.328 1.00 60.04 O ATOM 1736 ND2 ASN A 116 0.183 16.671 5.846 1.00 31.32 N ATOM 0 H ASN A 116 3.918 16.067 4.630 1.00 50.40 H new ATOM 0 HA ASN A 116 3.766 16.065 7.591 1.00 2.33 H new ATOM 0 HB2 ASN A 116 1.925 14.886 5.460 1.00 61.14 H new ATOM 0 HB3 ASN A 116 1.747 14.596 7.179 1.00 61.14 H new ATOM 0 HD21 ASN A 116 -0.406 17.502 5.897 1.00 31.32 H new ATOM 0 HD22 ASN A 116 -0.075 15.900 5.230 1.00 31.32 H new ATOM 1743 N PRO A 117 4.871 13.786 7.831 1.00 20.43 N ATOM 1744 CA PRO A 117 5.545 12.477 7.979 1.00 11.33 C ATOM 1745 C PRO A 117 4.706 11.307 7.432 1.00 1.20 C ATOM 1746 O PRO A 117 5.240 10.267 7.040 1.00 74.04 O ATOM 1747 CB PRO A 117 5.721 12.352 9.499 1.00 3.33 C ATOM 1748 CG PRO A 117 5.811 13.760 9.979 1.00 70.12 C ATOM 1749 CD PRO A 117 4.887 14.555 9.093 1.00 41.42 C ATOM 0 HA PRO A 117 6.477 12.431 7.416 1.00 11.33 H new ATOM 0 HB2 PRO A 117 4.880 11.830 9.955 1.00 3.33 H new ATOM 0 HB3 PRO A 117 6.620 11.788 9.750 1.00 3.33 H new ATOM 0 HG2 PRO A 117 5.512 13.837 11.024 1.00 70.12 H new ATOM 0 HG3 PRO A 117 6.833 14.132 9.911 1.00 70.12 H new ATOM 0 HD2 PRO A 117 3.890 14.638 9.525 1.00 41.42 H new ATOM 0 HD3 PRO A 117 5.253 15.570 8.940 1.00 41.42 H new ATOM 1757 N VAL A 118 3.387 11.502 7.406 1.00 61.20 N ATOM 1758 CA VAL A 118 2.445 10.512 6.868 1.00 3.00 C ATOM 1759 C VAL A 118 2.834 10.063 5.445 1.00 72.05 C ATOM 1760 O VAL A 118 2.613 8.913 5.065 1.00 3.54 O ATOM 1761 CB VAL A 118 1.002 11.078 6.852 1.00 31.41 C ATOM 1762 CG1 VAL A 118 0.005 10.012 6.417 1.00 43.11 C ATOM 1763 CG2 VAL A 118 0.626 11.645 8.220 1.00 1.44 C ATOM 0 H VAL A 118 2.939 12.349 7.756 1.00 61.20 H new ATOM 0 HA VAL A 118 2.488 9.644 7.526 1.00 3.00 H new ATOM 0 HB VAL A 118 0.967 11.890 6.126 1.00 31.41 H new ATOM 0 HG11 VAL A 118 -1.000 10.434 6.414 1.00 43.11 H new ATOM 0 HG12 VAL A 118 0.257 9.666 5.414 1.00 43.11 H new ATOM 0 HG13 VAL A 118 0.044 9.172 7.111 1.00 43.11 H new ATOM 0 HG21 VAL A 118 -0.391 12.036 8.185 1.00 1.44 H new ATOM 0 HG22 VAL A 118 0.685 10.856 8.970 1.00 1.44 H new ATOM 0 HG23 VAL A 118 1.315 12.448 8.483 1.00 1.44 H new ATOM 1773 N LEU A 119 3.426 10.975 4.670 1.00 23.34 N ATOM 1774 CA LEU A 119 3.884 10.662 3.308 1.00 34.21 C ATOM 1775 C LEU A 119 4.932 9.534 3.310 1.00 13.24 C ATOM 1776 O LEU A 119 4.810 8.551 2.576 1.00 63.30 O ATOM 1777 CB LEU A 119 4.464 11.920 2.643 1.00 13.22 C ATOM 1778 CG LEU A 119 3.481 13.096 2.495 1.00 71.14 C ATOM 1779 CD1 LEU A 119 4.181 14.325 1.915 1.00 13.34 C ATOM 1780 CD2 LEU A 119 2.290 12.695 1.627 1.00 21.23 C ATOM 0 H LEU A 119 3.601 11.937 4.960 1.00 23.34 H new ATOM 0 HA LEU A 119 3.022 10.317 2.737 1.00 34.21 H new ATOM 0 HB2 LEU A 119 5.322 12.256 3.225 1.00 13.22 H new ATOM 0 HB3 LEU A 119 4.835 11.651 1.654 1.00 13.22 H new ATOM 0 HG LEU A 119 3.112 13.355 3.487 1.00 71.14 H new ATOM 0 HD11 LEU A 119 3.465 15.141 1.821 1.00 13.34 H new ATOM 0 HD12 LEU A 119 4.992 14.628 2.577 1.00 13.34 H new ATOM 0 HD13 LEU A 119 4.587 14.083 0.933 1.00 13.34 H new ATOM 0 HD21 LEU A 119 1.607 13.539 1.534 1.00 21.23 H new ATOM 0 HD22 LEU A 119 2.643 12.403 0.638 1.00 21.23 H new ATOM 0 HD23 LEU A 119 1.769 11.856 2.089 1.00 21.23 H new ATOM 1792 N ASN A 120 5.957 9.679 4.152 1.00 1.35 N ATOM 1793 CA ASN A 120 7.005 8.662 4.274 1.00 32.34 C ATOM 1794 C ASN A 120 6.487 7.410 4.999 1.00 31.14 C ATOM 1795 O ASN A 120 6.968 6.305 4.756 1.00 22.52 O ATOM 1796 CB ASN A 120 8.227 9.235 4.999 1.00 35.41 C ATOM 1797 CG ASN A 120 8.948 10.291 4.179 1.00 30.33 C ATOM 1798 OD1 ASN A 120 8.980 10.236 2.951 1.00 70.51 O ATOM 1799 ND2 ASN A 120 9.525 11.264 4.847 1.00 75.00 N ATOM 0 H ASN A 120 6.084 10.489 4.759 1.00 1.35 H new ATOM 0 HA ASN A 120 7.302 8.366 3.268 1.00 32.34 H new ATOM 0 HB2 ASN A 120 7.912 9.669 5.948 1.00 35.41 H new ATOM 0 HB3 ASN A 120 8.919 8.426 5.233 1.00 35.41 H new ATOM 0 HD21 ASN A 120 10.018 12.004 4.347 1.00 75.00 H new ATOM 0 HD22 ASN A 120 9.480 11.280 5.866 1.00 75.00 H new ATOM 1806 N ASN A 121 5.506 7.587 5.891 1.00 2.31 N ATOM 1807 CA ASN A 121 4.838 6.445 6.530 1.00 71.04 C ATOM 1808 C ASN A 121 4.191 5.547 5.466 1.00 61.22 C ATOM 1809 O ASN A 121 4.347 4.323 5.486 1.00 24.14 O ATOM 1810 CB ASN A 121 3.773 6.912 7.534 1.00 54.41 C ATOM 1811 CG ASN A 121 4.351 7.729 8.675 1.00 14.54 C ATOM 1812 OD1 ASN A 121 5.517 7.596 9.028 1.00 3.34 O ATOM 1813 ND2 ASN A 121 3.533 8.562 9.280 1.00 31.50 N ATOM 0 H ASN A 121 5.159 8.500 6.185 1.00 2.31 H new ATOM 0 HA ASN A 121 5.593 5.877 7.073 1.00 71.04 H new ATOM 0 HB2 ASN A 121 3.025 7.507 7.011 1.00 54.41 H new ATOM 0 HB3 ASN A 121 3.259 6.041 7.942 1.00 54.41 H new ATOM 0 HD21 ASN A 121 3.864 9.120 10.067 1.00 31.50 H new ATOM 0 HD22 ASN A 121 2.568 8.650 8.962 1.00 31.50 H new ATOM 1820 N LEU A 122 3.470 6.170 4.535 1.00 34.24 N ATOM 1821 CA LEU A 122 2.924 5.462 3.374 1.00 62.53 C ATOM 1822 C LEU A 122 4.041 4.792 2.571 1.00 4.54 C ATOM 1823 O LEU A 122 3.973 3.602 2.282 1.00 42.31 O ATOM 1824 CB LEU A 122 2.146 6.428 2.469 1.00 21.13 C ATOM 1825 CG LEU A 122 0.796 6.908 3.022 1.00 4.54 C ATOM 1826 CD1 LEU A 122 0.202 7.983 2.119 1.00 60.51 C ATOM 1827 CD2 LEU A 122 -0.171 5.734 3.170 1.00 11.31 C ATOM 0 H LEU A 122 3.249 7.165 4.561 1.00 34.24 H new ATOM 0 HA LEU A 122 2.244 4.693 3.741 1.00 62.53 H new ATOM 0 HB2 LEU A 122 2.771 7.300 2.276 1.00 21.13 H new ATOM 0 HB3 LEU A 122 1.973 5.940 1.510 1.00 21.13 H new ATOM 0 HG LEU A 122 0.961 7.341 4.009 1.00 4.54 H new ATOM 0 HD11 LEU A 122 -0.754 8.312 2.525 1.00 60.51 H new ATOM 0 HD12 LEU A 122 0.885 8.831 2.065 1.00 60.51 H new ATOM 0 HD13 LEU A 122 0.051 7.576 1.119 1.00 60.51 H new ATOM 0 HD21 LEU A 122 -1.122 6.093 3.563 1.00 11.31 H new ATOM 0 HD22 LEU A 122 -0.332 5.271 2.197 1.00 11.31 H new ATOM 0 HD23 LEU A 122 0.251 4.999 3.856 1.00 11.31 H new ATOM 1839 N LEU A 123 5.075 5.562 2.229 1.00 30.03 N ATOM 1840 CA LEU A 123 6.205 5.054 1.441 1.00 5.32 C ATOM 1841 C LEU A 123 6.789 3.768 2.046 1.00 71.01 C ATOM 1842 O LEU A 123 6.972 2.767 1.348 1.00 41.31 O ATOM 1843 CB LEU A 123 7.293 6.131 1.335 1.00 12.14 C ATOM 1844 CG LEU A 123 8.505 5.766 0.462 1.00 74.01 C ATOM 1845 CD1 LEU A 123 8.071 5.457 -0.969 1.00 51.52 C ATOM 1846 CD2 LEU A 123 9.534 6.894 0.480 1.00 55.20 C ATOM 0 H LEU A 123 5.156 6.546 2.486 1.00 30.03 H new ATOM 0 HA LEU A 123 5.836 4.810 0.445 1.00 5.32 H new ATOM 0 HB2 LEU A 123 6.842 7.040 0.937 1.00 12.14 H new ATOM 0 HB3 LEU A 123 7.648 6.364 2.339 1.00 12.14 H new ATOM 0 HG LEU A 123 8.967 4.870 0.876 1.00 74.01 H new ATOM 0 HD11 LEU A 123 8.946 5.202 -1.567 1.00 51.52 H new ATOM 0 HD12 LEU A 123 7.376 4.617 -0.965 1.00 51.52 H new ATOM 0 HD13 LEU A 123 7.581 6.331 -1.397 1.00 51.52 H new ATOM 0 HD21 LEU A 123 10.386 6.620 -0.143 1.00 55.20 H new ATOM 0 HD22 LEU A 123 9.080 7.806 0.093 1.00 55.20 H new ATOM 0 HD23 LEU A 123 9.872 7.062 1.503 1.00 55.20 H new ATOM 1858 N SER A 124 7.064 3.798 3.350 1.00 44.23 N ATOM 1859 CA SER A 124 7.586 2.621 4.062 1.00 60.32 C ATOM 1860 C SER A 124 6.631 1.426 3.941 1.00 3.04 C ATOM 1861 O SER A 124 7.052 0.319 3.606 1.00 4.43 O ATOM 1862 CB SER A 124 7.825 2.944 5.548 1.00 54.31 C ATOM 1863 OG SER A 124 8.260 1.798 6.269 1.00 61.24 O ATOM 0 H SER A 124 6.936 4.621 3.938 1.00 44.23 H new ATOM 0 HA SER A 124 8.535 2.354 3.597 1.00 60.32 H new ATOM 0 HB2 SER A 124 8.571 3.734 5.634 1.00 54.31 H new ATOM 0 HB3 SER A 124 6.905 3.326 5.991 1.00 54.31 H new ATOM 0 HG SER A 124 8.404 2.038 7.208 1.00 61.24 H new ATOM 1869 N CYS A 125 5.342 1.659 4.195 1.00 30.11 N ATOM 1870 CA CYS A 125 4.328 0.595 4.118 1.00 50.04 C ATOM 1871 C CYS A 125 4.189 0.039 2.689 1.00 71.01 C ATOM 1872 O CYS A 125 4.072 -1.168 2.494 1.00 23.03 O ATOM 1873 CB CYS A 125 2.972 1.116 4.613 1.00 35.14 C ATOM 1874 SG CYS A 125 2.980 1.683 6.331 1.00 13.14 S ATOM 0 H CYS A 125 4.972 2.573 4.456 1.00 30.11 H new ATOM 0 HA CYS A 125 4.659 -0.220 4.761 1.00 50.04 H new ATOM 0 HB2 CYS A 125 2.655 1.939 3.972 1.00 35.14 H new ATOM 0 HB3 CYS A 125 2.230 0.325 4.506 1.00 35.14 H new ATOM 0 HG CYS A 125 3.526 2.861 6.397 1.00 13.14 H new ATOM 1880 N VAL A 126 4.213 0.928 1.696 1.00 1.44 N ATOM 1881 CA VAL A 126 4.106 0.531 0.284 1.00 24.12 C ATOM 1882 C VAL A 126 5.267 -0.387 -0.132 1.00 53.44 C ATOM 1883 O VAL A 126 5.054 -1.471 -0.687 1.00 14.44 O ATOM 1884 CB VAL A 126 4.075 1.773 -0.645 1.00 45.00 C ATOM 1885 CG1 VAL A 126 4.117 1.361 -2.115 1.00 71.22 C ATOM 1886 CG2 VAL A 126 2.838 2.622 -0.366 1.00 51.33 C ATOM 0 H VAL A 126 4.306 1.933 1.840 1.00 1.44 H new ATOM 0 HA VAL A 126 3.170 -0.018 0.179 1.00 24.12 H new ATOM 0 HB VAL A 126 4.962 2.371 -0.435 1.00 45.00 H new ATOM 0 HG11 VAL A 126 4.094 2.251 -2.743 1.00 71.22 H new ATOM 0 HG12 VAL A 126 5.032 0.803 -2.310 1.00 71.22 H new ATOM 0 HG13 VAL A 126 3.254 0.734 -2.342 1.00 71.22 H new ATOM 0 HG21 VAL A 126 2.834 3.488 -1.028 1.00 51.33 H new ATOM 0 HG22 VAL A 126 1.941 2.028 -0.542 1.00 51.33 H new ATOM 0 HG23 VAL A 126 2.853 2.957 0.671 1.00 51.33 H new ATOM 1896 N GLN A 127 6.493 0.059 0.133 1.00 45.53 N ATOM 1897 CA GLN A 127 7.689 -0.740 -0.160 1.00 55.41 C ATOM 1898 C GLN A 127 7.682 -2.051 0.645 1.00 53.42 C ATOM 1899 O GLN A 127 8.037 -3.112 0.127 1.00 13.02 O ATOM 1900 CB GLN A 127 8.959 0.064 0.155 1.00 63.23 C ATOM 1901 CG GLN A 127 9.078 1.365 -0.637 1.00 2.53 C ATOM 1902 CD GLN A 127 10.312 2.172 -0.267 1.00 71.12 C ATOM 1903 OE1 GLN A 127 10.790 2.119 0.860 1.00 10.02 O ATOM 1904 NE2 GLN A 127 10.839 2.922 -1.214 1.00 3.21 N ATOM 0 H GLN A 127 6.688 0.969 0.550 1.00 45.53 H new ATOM 0 HA GLN A 127 7.680 -0.987 -1.222 1.00 55.41 H new ATOM 0 HB2 GLN A 127 8.976 0.295 1.220 1.00 63.23 H new ATOM 0 HB3 GLN A 127 9.831 -0.557 -0.051 1.00 63.23 H new ATOM 0 HG2 GLN A 127 9.107 1.135 -1.702 1.00 2.53 H new ATOM 0 HG3 GLN A 127 8.189 1.971 -0.466 1.00 2.53 H new ATOM 0 HE21 GLN A 127 10.416 2.943 -2.142 1.00 3.21 H new ATOM 0 HE22 GLN A 127 11.670 3.481 -1.019 1.00 3.21 H new ATOM 1913 N GLU A 128 7.259 -1.962 1.908 1.00 42.41 N ATOM 1914 CA GLU A 128 7.145 -3.133 2.784 1.00 2.34 C ATOM 1915 C GLU A 128 6.222 -4.196 2.160 1.00 4.22 C ATOM 1916 O GLU A 128 6.615 -5.347 1.992 1.00 54.34 O ATOM 1917 CB GLU A 128 6.598 -2.712 4.156 1.00 10.55 C ATOM 1918 CG GLU A 128 6.741 -3.778 5.237 1.00 41.44 C ATOM 1919 CD GLU A 128 8.182 -3.963 5.696 1.00 32.30 C ATOM 1920 OE1 GLU A 128 8.678 -3.108 6.462 1.00 15.41 O ATOM 1921 OE2 GLU A 128 8.825 -4.961 5.298 1.00 30.41 O ATOM 0 H GLU A 128 6.988 -1.084 2.351 1.00 42.41 H new ATOM 0 HA GLU A 128 8.138 -3.565 2.907 1.00 2.34 H new ATOM 0 HB2 GLU A 128 7.116 -1.809 4.480 1.00 10.55 H new ATOM 0 HB3 GLU A 128 5.544 -2.455 4.052 1.00 10.55 H new ATOM 0 HG2 GLU A 128 6.124 -3.506 6.093 1.00 41.44 H new ATOM 0 HG3 GLU A 128 6.360 -4.727 4.858 1.00 41.44 H new ATOM 1928 N ILE A 129 4.999 -3.790 1.802 1.00 51.13 N ATOM 1929 CA ILE A 129 4.036 -4.684 1.137 1.00 25.41 C ATOM 1930 C ILE A 129 4.648 -5.315 -0.125 1.00 73.42 C ATOM 1931 O ILE A 129 4.603 -6.534 -0.312 1.00 73.32 O ATOM 1932 CB ILE A 129 2.736 -3.927 0.749 1.00 43.32 C ATOM 1933 CG1 ILE A 129 2.026 -3.393 2.005 1.00 33.45 C ATOM 1934 CG2 ILE A 129 1.800 -4.830 -0.058 1.00 33.31 C ATOM 1935 CD1 ILE A 129 0.806 -2.545 1.709 1.00 72.43 C ATOM 0 H ILE A 129 4.649 -2.845 1.961 1.00 51.13 H new ATOM 0 HA ILE A 129 3.789 -5.471 1.849 1.00 25.41 H new ATOM 0 HB ILE A 129 3.011 -3.078 0.123 1.00 43.32 H new ATOM 0 HG12 ILE A 129 1.727 -4.237 2.627 1.00 33.45 H new ATOM 0 HG13 ILE A 129 2.734 -2.803 2.587 1.00 33.45 H new ATOM 0 HG21 ILE A 129 0.897 -4.278 -0.318 1.00 33.31 H new ATOM 0 HG22 ILE A 129 2.303 -5.153 -0.969 1.00 33.31 H new ATOM 0 HG23 ILE A 129 1.533 -5.703 0.538 1.00 33.31 H new ATOM 0 HD11 ILE A 129 0.362 -2.207 2.645 1.00 72.43 H new ATOM 0 HD12 ILE A 129 1.100 -1.681 1.114 1.00 72.43 H new ATOM 0 HD13 ILE A 129 0.077 -3.137 1.155 1.00 72.43 H new ATOM 1947 N SER A 130 5.233 -4.472 -0.978 1.00 22.34 N ATOM 1948 CA SER A 130 5.879 -4.933 -2.217 1.00 51.45 C ATOM 1949 C SER A 130 6.963 -5.981 -1.926 1.00 73.34 C ATOM 1950 O SER A 130 7.142 -6.929 -2.687 1.00 12.03 O ATOM 1951 CB SER A 130 6.493 -3.750 -2.985 1.00 25.12 C ATOM 1952 OG SER A 130 7.055 -4.165 -4.224 1.00 23.13 O ATOM 0 H SER A 130 5.275 -3.463 -0.836 1.00 22.34 H new ATOM 0 HA SER A 130 5.108 -5.396 -2.833 1.00 51.45 H new ATOM 0 HB2 SER A 130 5.727 -2.996 -3.167 1.00 25.12 H new ATOM 0 HB3 SER A 130 7.264 -3.280 -2.374 1.00 25.12 H new ATOM 0 HG SER A 130 7.435 -3.389 -4.687 1.00 23.13 H new ATOM 1958 N ASP A 131 7.677 -5.802 -0.817 1.00 14.31 N ATOM 1959 CA ASP A 131 8.715 -6.743 -0.391 1.00 0.20 C ATOM 1960 C ASP A 131 8.113 -8.051 0.161 1.00 75.32 C ATOM 1961 O ASP A 131 8.547 -9.144 -0.204 1.00 60.31 O ATOM 1962 CB ASP A 131 9.604 -6.075 0.663 1.00 51.12 C ATOM 1963 CG ASP A 131 10.680 -6.999 1.202 1.00 74.13 C ATOM 1964 OD1 ASP A 131 11.609 -7.343 0.442 1.00 23.30 O ATOM 1965 OD2 ASP A 131 10.610 -7.371 2.390 1.00 51.43 O ATOM 0 H ASP A 131 7.555 -5.006 -0.190 1.00 14.31 H new ATOM 0 HA ASP A 131 9.314 -7.009 -1.262 1.00 0.20 H new ATOM 0 HB2 ASP A 131 10.074 -5.193 0.228 1.00 51.12 H new ATOM 0 HB3 ASP A 131 8.982 -5.730 1.489 1.00 51.12 H new ATOM 1970 N VAL A 132 7.109 -7.930 1.034 1.00 3.00 N ATOM 1971 CA VAL A 132 6.453 -9.097 1.646 1.00 4.30 C ATOM 1972 C VAL A 132 5.952 -10.093 0.586 1.00 12.11 C ATOM 1973 O VAL A 132 6.130 -11.305 0.724 1.00 42.31 O ATOM 1974 CB VAL A 132 5.269 -8.667 2.553 1.00 13.43 C ATOM 1975 CG1 VAL A 132 4.525 -9.884 3.102 1.00 72.04 C ATOM 1976 CG2 VAL A 132 5.761 -7.780 3.699 1.00 2.44 C ATOM 0 H VAL A 132 6.729 -7.033 1.336 1.00 3.00 H new ATOM 0 HA VAL A 132 7.207 -9.593 2.257 1.00 4.30 H new ATOM 0 HB VAL A 132 4.573 -8.092 1.943 1.00 13.43 H new ATOM 0 HG11 VAL A 132 3.701 -9.552 3.734 1.00 72.04 H new ATOM 0 HG12 VAL A 132 4.133 -10.475 2.274 1.00 72.04 H new ATOM 0 HG13 VAL A 132 5.210 -10.494 3.690 1.00 72.04 H new ATOM 0 HG21 VAL A 132 4.916 -7.489 4.323 1.00 2.44 H new ATOM 0 HG22 VAL A 132 6.484 -8.331 4.301 1.00 2.44 H new ATOM 0 HG23 VAL A 132 6.234 -6.887 3.291 1.00 2.44 H new ATOM 1986 N VAL A 133 5.340 -9.571 -0.474 1.00 64.21 N ATOM 1987 CA VAL A 133 4.835 -10.410 -1.569 1.00 53.12 C ATOM 1988 C VAL A 133 5.976 -11.170 -2.277 1.00 33.42 C ATOM 1989 O VAL A 133 5.769 -12.258 -2.819 1.00 70.20 O ATOM 1990 CB VAL A 133 4.058 -9.562 -2.610 1.00 63.24 C ATOM 1991 CG1 VAL A 133 3.491 -10.440 -3.727 1.00 12.24 C ATOM 1992 CG2 VAL A 133 2.944 -8.768 -1.932 1.00 43.33 C ATOM 0 H VAL A 133 5.180 -8.572 -0.602 1.00 64.21 H new ATOM 0 HA VAL A 133 4.157 -11.137 -1.122 1.00 53.12 H new ATOM 0 HB VAL A 133 4.759 -8.859 -3.060 1.00 63.24 H new ATOM 0 HG11 VAL A 133 2.952 -9.817 -4.441 1.00 12.24 H new ATOM 0 HG12 VAL A 133 4.307 -10.953 -4.236 1.00 12.24 H new ATOM 0 HG13 VAL A 133 2.810 -11.176 -3.301 1.00 12.24 H new ATOM 0 HG21 VAL A 133 2.410 -8.180 -2.678 1.00 43.33 H new ATOM 0 HG22 VAL A 133 2.250 -9.455 -1.448 1.00 43.33 H new ATOM 0 HG23 VAL A 133 3.375 -8.102 -1.185 1.00 43.33 H new ATOM 2002 N GLN A 134 7.181 -10.602 -2.252 1.00 72.55 N ATOM 2003 CA GLN A 134 8.333 -11.192 -2.949 1.00 64.44 C ATOM 2004 C GLN A 134 9.043 -12.267 -2.107 1.00 10.45 C ATOM 2005 O GLN A 134 9.911 -12.982 -2.611 1.00 14.10 O ATOM 2006 CB GLN A 134 9.347 -10.098 -3.319 1.00 44.03 C ATOM 2007 CG GLN A 134 8.767 -8.969 -4.167 1.00 71.54 C ATOM 2008 CD GLN A 134 9.817 -7.947 -4.579 1.00 3.21 C ATOM 2009 OE1 GLN A 134 10.981 -8.282 -4.785 1.00 4.44 O ATOM 2010 NE2 GLN A 134 9.419 -6.694 -4.689 1.00 60.34 N ATOM 0 H GLN A 134 7.389 -9.734 -1.758 1.00 72.55 H new ATOM 0 HA GLN A 134 7.944 -11.670 -3.848 1.00 64.44 H new ATOM 0 HB2 GLN A 134 9.758 -9.675 -2.403 1.00 44.03 H new ATOM 0 HB3 GLN A 134 10.176 -10.554 -3.860 1.00 44.03 H new ATOM 0 HG2 GLN A 134 8.306 -9.391 -5.060 1.00 71.54 H new ATOM 0 HG3 GLN A 134 7.978 -8.468 -3.607 1.00 71.54 H new ATOM 0 HE21 GLN A 134 8.445 -6.451 -4.511 1.00 60.34 H new ATOM 0 HE22 GLN A 134 10.086 -5.968 -4.952 1.00 60.34 H new ATOM 2019 N ARG A 135 8.676 -12.378 -0.833 1.00 31.51 N ATOM 2020 CA ARG A 135 9.339 -13.314 0.092 1.00 14.30 C ATOM 2021 C ARG A 135 8.930 -14.778 -0.167 1.00 13.31 C ATOM 2022 O ARG A 135 9.739 -15.536 -0.750 1.00 38.26 O ATOM 2023 CB ARG A 135 9.030 -12.919 1.544 1.00 53.23 C ATOM 2024 CG ARG A 135 9.491 -11.508 1.897 1.00 23.31 C ATOM 2025 CD ARG A 135 9.158 -11.132 3.334 1.00 71.42 C ATOM 2026 NE ARG A 135 9.502 -9.741 3.618 1.00 13.45 N ATOM 2027 CZ ARG A 135 9.205 -9.116 4.721 1.00 64.52 C ATOM 2028 NH1 ARG A 135 8.587 -9.720 5.683 1.00 73.04 N ATOM 2029 NH2 ARG A 135 9.537 -7.876 4.852 1.00 1.32 N ATOM 2030 OXT ARG A 135 7.803 -15.165 0.205 1.00 38.26 O ATOM 0 H ARG A 135 7.924 -11.834 -0.410 1.00 31.51 H new ATOM 0 HA ARG A 135 10.413 -13.247 -0.083 1.00 14.30 H new ATOM 0 HB2 ARG A 135 7.956 -12.996 1.713 1.00 53.23 H new ATOM 0 HB3 ARG A 135 9.510 -13.630 2.217 1.00 53.23 H new ATOM 0 HG2 ARG A 135 10.568 -11.431 1.744 1.00 23.31 H new ATOM 0 HG3 ARG A 135 9.021 -10.795 1.219 1.00 23.31 H new ATOM 0 HD2 ARG A 135 8.095 -11.289 3.515 1.00 71.42 H new ATOM 0 HD3 ARG A 135 9.698 -11.788 4.017 1.00 71.42 H new ATOM 0 HE ARG A 135 10.011 -9.223 2.902 1.00 13.45 H new ATOM 0 HH11 ARG A 135 8.325 -10.701 5.584 1.00 73.04 H new ATOM 0 HH12 ARG A 135 8.362 -9.216 6.541 1.00 73.04 H new ATOM 0 HH21 ARG A 135 10.026 -7.397 4.096 1.00 1.32 H new ATOM 0 HH22 ARG A 135 9.310 -7.375 5.711 1.00 1.32 H new