USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 821 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 38 HIS : no HE2:sc= -3.22! C(o=-2!,f=-11!) USER MOD Set 1.2: A 89 THR OG1 : rot -52:sc= 1.2 USER MOD Set 2.1: A 19 GLN : amide:sc= -0.252 K(o=0.44,f=-12!) USER MOD Set 2.2: A 23 ASN : amide:sc=-0.00335 K(o=0.44,f=-1.8) USER MOD Set 2.3: A 62 LYS NZ :NH3+ 163:sc= 0.695 (180deg=-0.0381) USER MOD Set 3.1: A 12 LYS NZ :NH3+ 150:sc= 1.06 (180deg=0) USER MOD Set 3.2: A 83 TYR OH : rot 100:sc= 0.914 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -145:sc= -0.598! (180deg=-0.808!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 163:sc= 0.731 (180deg=-0.251) USER MOD Single : A 20 ASN : amide:sc= -0.107 K(o=-0.11,f=-1.6!) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HE2:sc= 0.134 K(o=0.13,f=-1) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 37 LYS NZ :NH3+ 138:sc= 1.18 (180deg=0.37) USER MOD Single : A 46 LYS NZ :NH3+ 167:sc= -0.0168 (180deg=-0.223) USER MOD Single : A 50 MET CE :methyl 167:sc= -0.115 (180deg=-0.422) USER MOD Single : A 52 THR OG1 : rot 33:sc= 0.545 USER MOD Single : A 65 THR OG1 : rot 71:sc= 0.927 USER MOD Single : A 66 MET CE :methyl 162:sc= -0.0821 (180deg=-0.527) USER MOD Single : A 69 ASN : amide:sc= -1.05 K(o=-1.1,f=-6.6!) USER MOD Single : A 72 ASN : amide:sc= -1.93! C(o=-1.9!,f=-3.9!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc=-0.00868 K(o=-0.0087,f=-1.5) USER MOD Single : A 85 ASN : amide:sc= -2! C(o=-2!,f=-6.8!) USER MOD Single : A 86 MET CE :methyl 132:sc= -0.0574 (180deg=-0.654) USER MOD Single : A 91 LYS NZ :NH3+ 148:sc= 1.21 (180deg=0.7) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= 1.12 K(o=1.1,f=-4.3!) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -8.440 -40.113 13.446 1.00 0.00 N ATOM 2 CA LYS A 4 -8.364 -41.391 14.153 1.00 0.00 C ATOM 3 C LYS A 4 -8.685 -41.233 15.621 1.00 0.00 C ATOM 4 O LYS A 4 -7.804 -41.134 16.471 1.00 0.00 O ATOM 5 CB LYS A 4 -6.975 -42.045 13.939 1.00 0.00 C ATOM 6 CG LYS A 4 -6.739 -42.441 12.488 1.00 0.00 C ATOM 7 CD LYS A 4 -5.359 -43.029 12.262 1.00 0.00 C ATOM 8 CE LYS A 4 -5.143 -43.406 10.797 1.00 0.00 C ATOM 9 NZ LYS A 4 -3.779 -43.929 10.548 1.00 0.00 N ATOM 0 HA LYS A 4 -9.119 -42.056 13.734 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.197 -41.350 14.255 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.890 -42.928 14.572 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.494 -43.167 12.186 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -6.866 -41.566 11.851 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -4.601 -42.308 12.569 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -5.232 -43.912 12.888 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -5.877 -44.157 10.505 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -5.315 -42.531 10.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -3.679 -44.171 9.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -3.078 -43.204 10.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -3.622 -44.779 11.126 1.00 0.00 H new ATOM 23 N VAL A 5 -9.960 -41.197 15.924 1.00 0.00 N ATOM 24 CA VAL A 5 -10.387 -41.028 17.289 1.00 0.00 C ATOM 25 C VAL A 5 -10.454 -42.379 17.981 1.00 0.00 C ATOM 26 O VAL A 5 -11.420 -43.129 17.821 1.00 0.00 O ATOM 27 CB VAL A 5 -11.769 -40.327 17.367 1.00 0.00 C ATOM 28 CG1 VAL A 5 -12.195 -40.130 18.812 1.00 0.00 C ATOM 29 CG2 VAL A 5 -11.747 -38.992 16.631 1.00 0.00 C ATOM 0 H VAL A 5 -10.717 -41.282 15.245 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.658 -40.394 17.794 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.498 -40.973 16.879 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.167 -39.637 18.841 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -12.265 -41.099 19.306 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.459 -39.513 19.327 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.728 -38.522 16.701 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.999 -38.340 17.082 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.499 -39.158 15.583 1.00 0.00 H new ATOM 39 N ILE A 6 -9.400 -42.697 18.709 1.00 0.00 N ATOM 40 CA ILE A 6 -9.320 -43.935 19.433 1.00 0.00 C ATOM 41 C ILE A 6 -10.049 -43.776 20.764 1.00 0.00 C ATOM 42 O ILE A 6 -9.894 -42.749 21.428 1.00 0.00 O ATOM 43 CB ILE A 6 -7.840 -44.339 19.705 1.00 0.00 C ATOM 44 CG1 ILE A 6 -7.066 -44.478 18.382 1.00 0.00 C ATOM 45 CG2 ILE A 6 -7.772 -45.630 20.497 1.00 0.00 C ATOM 46 CD1 ILE A 6 -7.639 -45.514 17.422 1.00 0.00 C ATOM 0 H ILE A 6 -8.580 -42.099 18.810 1.00 0.00 H new ATOM 0 HA ILE A 6 -9.781 -44.718 18.832 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.375 -43.550 20.296 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.047 -43.509 17.883 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.032 -44.741 18.606 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.729 -45.893 20.675 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.281 -45.498 21.452 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.256 -46.428 19.934 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.033 -45.546 16.517 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -7.632 -46.494 17.898 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -8.663 -45.244 17.164 1.00 0.00 H new ATOM 58 N ASP A 7 -10.842 -44.769 21.148 1.00 0.00 N ATOM 59 CA ASP A 7 -11.607 -44.664 22.367 1.00 0.00 C ATOM 60 C ASP A 7 -10.731 -44.900 23.566 1.00 0.00 C ATOM 61 O ASP A 7 -10.198 -45.974 23.740 1.00 0.00 O ATOM 62 CB ASP A 7 -12.764 -45.649 22.351 1.00 0.00 C ATOM 63 CG ASP A 7 -13.505 -45.687 23.665 1.00 0.00 C ATOM 64 OD1 ASP A 7 -13.789 -44.614 24.232 1.00 0.00 O ATOM 65 OD2 ASP A 7 -13.828 -46.789 24.137 1.00 0.00 O ATOM 0 H ASP A 7 -10.966 -45.642 20.635 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.011 -43.654 22.434 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -13.457 -45.379 21.554 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -12.386 -46.645 22.121 1.00 0.00 H new ATOM 70 N ILE A 8 -10.562 -43.886 24.362 1.00 0.00 N ATOM 71 CA ILE A 8 -9.770 -43.990 25.557 1.00 0.00 C ATOM 72 C ILE A 8 -10.608 -43.646 26.765 1.00 0.00 C ATOM 73 O ILE A 8 -11.365 -42.676 26.746 1.00 0.00 O ATOM 74 CB ILE A 8 -8.496 -43.114 25.492 1.00 0.00 C ATOM 75 CG1 ILE A 8 -7.584 -43.624 24.363 1.00 0.00 C ATOM 76 CG2 ILE A 8 -7.758 -43.103 26.828 1.00 0.00 C ATOM 77 CD1 ILE A 8 -6.335 -42.810 24.178 1.00 0.00 C ATOM 0 H ILE A 8 -10.968 -42.964 24.204 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.433 -45.023 25.644 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.788 -42.086 25.280 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.306 -44.657 24.572 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.146 -43.628 23.429 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.868 -42.478 26.747 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.413 -42.703 27.602 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.465 -44.120 27.090 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.744 -43.231 23.365 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.603 -41.781 23.937 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.750 -42.826 25.098 1.00 0.00 H new ATOM 89 N LYS A 9 -10.504 -44.475 27.788 1.00 0.00 N ATOM 90 CA LYS A 9 -11.286 -44.283 28.986 1.00 0.00 C ATOM 91 C LYS A 9 -10.702 -43.252 29.881 1.00 0.00 C ATOM 92 O LYS A 9 -9.482 -43.093 29.967 1.00 0.00 O ATOM 93 CB LYS A 9 -11.463 -45.581 29.762 1.00 0.00 C ATOM 94 CG LYS A 9 -12.820 -46.229 29.551 1.00 0.00 C ATOM 95 CD LYS A 9 -12.844 -47.242 28.425 1.00 0.00 C ATOM 96 CE LYS A 9 -12.692 -46.615 27.048 1.00 0.00 C ATOM 97 NZ LYS A 9 -13.738 -45.592 26.790 1.00 0.00 N ATOM 0 H LYS A 9 -9.885 -45.286 27.809 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.263 -43.936 28.649 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.683 -46.283 29.465 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -11.325 -45.382 30.825 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -13.126 -46.719 30.475 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -13.555 -45.452 29.344 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -12.042 -47.964 28.578 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -13.783 -47.795 28.463 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -11.707 -46.157 26.964 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -12.748 -47.393 26.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -14.004 -45.614 25.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -14.574 -45.795 27.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -13.369 -44.650 27.030 1.00 0.00 H new ATOM 111 N GLU A 10 -11.571 -42.574 30.563 1.00 0.00 N ATOM 112 CA GLU A 10 -11.148 -41.520 31.458 1.00 0.00 C ATOM 113 C GLU A 10 -11.852 -41.635 32.785 1.00 0.00 C ATOM 114 O GLU A 10 -13.064 -41.453 32.884 1.00 0.00 O ATOM 115 CB GLU A 10 -11.397 -40.131 30.841 1.00 0.00 C ATOM 116 CG GLU A 10 -10.661 -39.893 29.537 1.00 0.00 C ATOM 117 CD GLU A 10 -10.849 -38.476 29.022 1.00 0.00 C ATOM 118 OE1 GLU A 10 -11.986 -37.971 29.046 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.843 -37.867 28.589 1.00 0.00 O ATOM 0 H GLU A 10 -12.579 -42.724 30.524 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.076 -41.632 31.619 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.466 -40.007 30.670 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.099 -39.367 31.559 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.598 -40.087 29.681 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.016 -40.600 28.787 1.00 0.00 H new ATOM 126 N ILE A 11 -11.093 -41.958 33.810 1.00 0.00 N ATOM 127 CA ILE A 11 -11.635 -42.053 35.169 1.00 0.00 C ATOM 128 C ILE A 11 -11.140 -40.869 35.996 1.00 0.00 C ATOM 129 O ILE A 11 -9.942 -40.714 36.240 1.00 0.00 O ATOM 130 CB ILE A 11 -11.285 -43.439 35.835 1.00 0.00 C ATOM 131 CG1 ILE A 11 -12.084 -44.556 35.171 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.537 -43.419 37.354 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.704 -45.946 35.642 1.00 0.00 C ATOM 0 H ILE A 11 -10.096 -42.161 33.739 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.723 -42.007 35.125 1.00 0.00 H new ATOM 0 HB ILE A 11 -10.222 -43.626 35.684 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -13.145 -44.395 35.364 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.944 -44.498 34.092 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -11.285 -44.391 37.778 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.917 -42.650 37.816 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.588 -43.202 37.546 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.315 -46.685 35.125 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.652 -46.129 35.424 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.871 -46.025 36.716 1.00 0.00 H new ATOM 145 N LYS A 12 -12.065 -40.006 36.392 1.00 0.00 N ATOM 146 CA LYS A 12 -11.736 -38.827 37.170 1.00 0.00 C ATOM 147 C LYS A 12 -11.699 -39.113 38.664 1.00 0.00 C ATOM 148 O LYS A 12 -12.616 -39.703 39.243 1.00 0.00 O ATOM 149 CB LYS A 12 -12.686 -37.658 36.857 1.00 0.00 C ATOM 150 CG LYS A 12 -12.396 -36.392 37.671 1.00 0.00 C ATOM 151 CD LYS A 12 -13.299 -35.247 37.248 1.00 0.00 C ATOM 152 CE LYS A 12 -13.017 -33.967 38.049 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.776 -32.797 37.536 1.00 0.00 N ATOM 0 H LYS A 12 -13.058 -40.105 36.183 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.730 -38.531 36.873 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.617 -37.420 35.795 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.712 -37.974 37.047 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.539 -36.598 38.732 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -11.353 -36.103 37.540 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.159 -35.048 36.185 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -14.341 -35.538 37.383 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -13.274 -34.133 39.095 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.950 -33.748 38.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.976 -32.142 38.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -13.213 -32.308 36.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -14.672 -33.120 37.118 1.00 0.00 H new ATOM 167 N LEU A 13 -10.630 -38.670 39.277 1.00 0.00 N ATOM 168 CA LEU A 13 -10.381 -38.837 40.695 1.00 0.00 C ATOM 169 C LEU A 13 -10.012 -37.485 41.309 1.00 0.00 C ATOM 170 O LEU A 13 -9.963 -36.467 40.605 1.00 0.00 O ATOM 171 CB LEU A 13 -9.242 -39.834 40.907 1.00 0.00 C ATOM 172 CG LEU A 13 -9.490 -41.229 40.338 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.254 -42.088 40.466 1.00 0.00 C ATOM 174 CD2 LEU A 13 -10.678 -41.886 41.042 1.00 0.00 C ATOM 0 H LEU A 13 -9.885 -38.168 38.793 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.280 -39.219 41.179 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.337 -39.429 40.455 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.052 -39.923 41.977 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.725 -41.131 39.278 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.454 -43.077 40.054 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.432 -41.627 39.919 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.983 -42.181 41.518 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -10.843 -42.880 40.626 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.468 -41.969 42.108 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.570 -41.278 40.894 1.00 0.00 H new ATOM 186 N SER A 14 -9.766 -37.461 42.579 1.00 0.00 N ATOM 187 CA SER A 14 -9.377 -36.239 43.240 1.00 0.00 C ATOM 188 C SER A 14 -8.474 -36.565 44.410 1.00 0.00 C ATOM 189 O SER A 14 -8.497 -37.669 44.938 1.00 0.00 O ATOM 190 CB SER A 14 -10.626 -35.456 43.726 1.00 0.00 C ATOM 191 OG SER A 14 -11.461 -36.285 44.535 1.00 0.00 O ATOM 0 H SER A 14 -9.826 -38.275 43.190 1.00 0.00 H new ATOM 0 HA SER A 14 -8.838 -35.610 42.532 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.313 -34.581 44.296 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.190 -35.092 42.867 1.00 0.00 H new ATOM 0 HG SER A 14 -12.241 -35.772 44.832 1.00 0.00 H new ATOM 197 N VAL A 15 -7.678 -35.612 44.817 1.00 0.00 N ATOM 198 CA VAL A 15 -6.786 -35.798 45.946 1.00 0.00 C ATOM 199 C VAL A 15 -7.583 -35.881 47.241 1.00 0.00 C ATOM 200 O VAL A 15 -7.111 -36.395 48.256 1.00 0.00 O ATOM 201 CB VAL A 15 -5.738 -34.651 45.999 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.848 -34.752 47.222 1.00 0.00 C ATOM 203 CG2 VAL A 15 -4.893 -34.662 44.741 1.00 0.00 C ATOM 0 H VAL A 15 -7.624 -34.690 44.384 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.248 -36.738 45.823 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.284 -33.710 46.066 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.131 -33.931 47.219 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.459 -34.696 48.123 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.313 -35.701 47.205 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.162 -33.855 44.787 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.375 -35.617 44.659 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.534 -34.521 43.871 1.00 0.00 H new ATOM 213 N LYS A 16 -8.815 -35.416 47.159 1.00 0.00 N ATOM 214 CA LYS A 16 -9.743 -35.375 48.287 1.00 0.00 C ATOM 215 C LYS A 16 -10.677 -36.608 48.262 1.00 0.00 C ATOM 216 O LYS A 16 -11.795 -36.568 48.780 1.00 0.00 O ATOM 217 CB LYS A 16 -10.557 -34.095 48.186 1.00 0.00 C ATOM 218 CG LYS A 16 -9.704 -32.842 48.338 1.00 0.00 C ATOM 219 CD LYS A 16 -10.529 -31.586 48.099 1.00 0.00 C ATOM 220 CE LYS A 16 -9.692 -30.341 48.302 1.00 0.00 C ATOM 221 NZ LYS A 16 -8.491 -30.308 47.410 1.00 0.00 N ATOM 0 H LYS A 16 -9.212 -35.048 46.294 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.189 -35.394 49.226 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.066 -34.068 47.223 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -11.330 -34.099 48.955 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.271 -32.812 49.338 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.874 -32.875 47.632 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.930 -31.598 47.086 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.381 -31.571 48.779 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -10.305 -29.460 48.114 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -9.370 -30.289 49.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.115 -29.339 47.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.761 -30.947 47.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.760 -30.615 46.454 1.00 0.00 H new ATOM 235 N ILE A 17 -10.203 -37.690 47.662 1.00 0.00 N ATOM 236 CA ILE A 17 -10.977 -38.916 47.579 1.00 0.00 C ATOM 237 C ILE A 17 -10.736 -39.803 48.790 1.00 0.00 C ATOM 238 O ILE A 17 -9.613 -39.901 49.288 1.00 0.00 O ATOM 239 CB ILE A 17 -10.654 -39.723 46.290 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.601 -40.931 46.140 1.00 0.00 C ATOM 241 CG2 ILE A 17 -9.202 -40.183 46.293 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.434 -41.675 44.845 1.00 0.00 C ATOM 0 H ILE A 17 -9.283 -37.742 47.225 1.00 0.00 H new ATOM 0 HA ILE A 17 -12.024 -38.615 47.550 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.807 -39.064 45.436 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.431 -41.619 46.968 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.632 -40.585 46.219 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.997 -40.746 45.382 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.545 -39.314 46.338 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.023 -40.819 47.160 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -12.133 -42.510 44.813 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.633 -41.002 44.011 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.414 -42.053 44.771 1.00 0.00 H new ATOM 254 N ALA A 18 -11.804 -40.403 49.295 1.00 0.00 N ATOM 255 CA ALA A 18 -11.715 -41.329 50.417 1.00 0.00 C ATOM 256 C ALA A 18 -11.066 -42.637 49.963 1.00 0.00 C ATOM 257 O ALA A 18 -11.290 -43.093 48.835 1.00 0.00 O ATOM 258 CB ALA A 18 -13.101 -41.590 50.975 1.00 0.00 C ATOM 0 H ALA A 18 -12.751 -40.264 48.942 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.098 -40.889 51.201 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.031 -42.283 51.814 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.539 -40.652 51.315 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.730 -42.024 50.198 1.00 0.00 H new ATOM 264 N GLN A 19 -10.294 -43.257 50.854 1.00 0.00 N ATOM 265 CA GLN A 19 -9.555 -44.474 50.523 1.00 0.00 C ATOM 266 C GLN A 19 -10.460 -45.584 50.010 1.00 0.00 C ATOM 267 O GLN A 19 -10.122 -46.292 49.060 1.00 0.00 O ATOM 268 CB GLN A 19 -8.729 -44.957 51.715 1.00 0.00 C ATOM 269 CG GLN A 19 -8.040 -46.289 51.495 1.00 0.00 C ATOM 270 CD GLN A 19 -7.052 -46.267 50.346 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.415 -45.252 50.076 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.937 -47.376 49.645 1.00 0.00 N ATOM 0 H GLN A 19 -10.164 -42.935 51.813 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.875 -44.215 49.711 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.975 -44.205 51.949 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.380 -45.037 52.585 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.519 -46.577 52.408 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.793 -47.053 51.304 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.483 -48.199 49.900 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -6.302 -47.412 48.847 1.00 0.00 H new ATOM 281 N ASN A 20 -11.615 -45.726 50.627 1.00 0.00 N ATOM 282 CA ASN A 20 -12.542 -46.786 50.243 1.00 0.00 C ATOM 283 C ASN A 20 -13.026 -46.620 48.811 1.00 0.00 C ATOM 284 O ASN A 20 -13.239 -47.606 48.096 1.00 0.00 O ATOM 285 CB ASN A 20 -13.717 -46.883 51.220 1.00 0.00 C ATOM 286 CG ASN A 20 -13.317 -47.555 52.522 1.00 0.00 C ATOM 287 OD1 ASN A 20 -12.438 -48.412 52.546 1.00 0.00 O ATOM 288 ND2 ASN A 20 -13.967 -47.186 53.603 1.00 0.00 N ATOM 0 H ASN A 20 -11.938 -45.131 51.390 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.993 -47.726 50.292 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.098 -45.884 51.430 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.529 -47.443 50.757 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -13.747 -47.615 54.502 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.691 -46.470 53.543 1.00 0.00 H new ATOM 295 N ASP A 21 -13.212 -45.374 48.400 1.00 0.00 N ATOM 296 CA ASP A 21 -13.650 -45.083 47.030 1.00 0.00 C ATOM 297 C ASP A 21 -12.527 -45.355 46.019 1.00 0.00 C ATOM 298 O ASP A 21 -12.791 -45.774 44.895 1.00 0.00 O ATOM 299 CB ASP A 21 -14.165 -43.657 46.898 1.00 0.00 C ATOM 300 CG ASP A 21 -15.002 -43.447 45.637 1.00 0.00 C ATOM 301 OD1 ASP A 21 -16.106 -44.012 45.540 1.00 0.00 O ATOM 302 OD2 ASP A 21 -14.568 -42.685 44.770 1.00 0.00 O ATOM 0 H ASP A 21 -13.070 -44.550 48.985 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.478 -45.755 46.805 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.766 -43.409 47.773 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.319 -42.969 46.887 1.00 0.00 H new ATOM 307 N ILE A 22 -11.266 -45.132 46.439 1.00 0.00 N ATOM 308 CA ILE A 22 -10.108 -45.346 45.556 1.00 0.00 C ATOM 309 C ILE A 22 -10.083 -46.783 45.092 1.00 0.00 C ATOM 310 O ILE A 22 -9.955 -47.043 43.894 1.00 0.00 O ATOM 311 CB ILE A 22 -8.767 -45.061 46.275 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.728 -43.651 46.863 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.587 -45.261 45.324 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.458 -43.377 47.642 1.00 0.00 C ATOM 0 H ILE A 22 -11.027 -44.807 47.376 1.00 0.00 H new ATOM 0 HA ILE A 22 -10.214 -44.657 44.718 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.686 -45.773 47.097 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.819 -42.923 46.057 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.588 -43.511 47.518 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.656 -45.055 45.851 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.580 -46.290 44.964 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.683 -44.581 44.478 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.485 -42.361 48.036 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.377 -44.085 48.467 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.596 -43.488 46.984 1.00 0.00 H new ATOM 326 N ASN A 23 -10.263 -47.691 46.036 1.00 0.00 N ATOM 327 CA ASN A 23 -10.231 -49.116 45.768 1.00 0.00 C ATOM 328 C ASN A 23 -11.262 -49.484 44.721 1.00 0.00 C ATOM 329 O ASN A 23 -10.993 -50.269 43.811 1.00 0.00 O ATOM 330 CB ASN A 23 -10.535 -49.902 47.059 1.00 0.00 C ATOM 331 CG ASN A 23 -9.325 -50.085 47.949 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.412 -49.262 47.950 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.311 -51.156 48.726 1.00 0.00 N ATOM 0 H ASN A 23 -10.436 -47.458 47.014 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.236 -49.370 45.402 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.313 -49.382 47.618 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.934 -50.881 46.794 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.524 -51.321 49.354 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.087 -51.817 48.697 1.00 0.00 H new ATOM 340 N TYR A 24 -12.414 -48.899 44.852 1.00 0.00 N ATOM 341 CA TYR A 24 -13.511 -49.113 43.947 1.00 0.00 C ATOM 342 C TYR A 24 -13.172 -48.640 42.505 1.00 0.00 C ATOM 343 O TYR A 24 -13.361 -49.386 41.546 1.00 0.00 O ATOM 344 CB TYR A 24 -14.724 -48.371 44.496 1.00 0.00 C ATOM 345 CG TYR A 24 -15.931 -48.373 43.595 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.809 -49.452 43.576 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.196 -47.299 42.770 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.913 -49.449 42.749 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.301 -47.294 41.941 1.00 0.00 C ATOM 350 CZ TYR A 24 -18.153 -48.366 41.937 1.00 0.00 C ATOM 351 OH TYR A 24 -19.258 -48.359 41.116 1.00 0.00 O ATOM 0 H TYR A 24 -12.626 -48.245 45.606 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.721 -50.180 43.876 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -15.002 -48.816 45.452 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.440 -47.338 44.696 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.624 -50.302 44.216 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.529 -46.449 42.772 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.586 -50.294 42.739 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.492 -46.447 41.298 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.283 -47.521 40.608 1.00 0.00 H new ATOM 361 N LYS A 25 -12.626 -47.416 42.382 1.00 0.00 N ATOM 362 CA LYS A 25 -12.295 -46.836 41.076 1.00 0.00 C ATOM 363 C LYS A 25 -11.192 -47.648 40.384 1.00 0.00 C ATOM 364 O LYS A 25 -11.271 -47.918 39.175 1.00 0.00 O ATOM 365 CB LYS A 25 -11.832 -45.381 41.240 1.00 0.00 C ATOM 366 CG LYS A 25 -12.846 -44.446 41.898 1.00 0.00 C ATOM 367 CD LYS A 25 -14.061 -44.213 41.013 1.00 0.00 C ATOM 368 CE LYS A 25 -15.003 -43.221 41.664 1.00 0.00 C ATOM 369 NZ LYS A 25 -16.236 -42.981 40.866 1.00 0.00 N ATOM 0 H LYS A 25 -12.406 -46.813 43.174 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.193 -46.862 40.459 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.917 -45.372 41.832 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.580 -44.984 40.257 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.166 -44.870 42.850 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.369 -43.491 42.119 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.744 -43.839 40.040 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.579 -45.156 40.839 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.282 -43.587 42.652 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -14.482 -42.275 41.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.841 -42.295 41.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -15.977 -42.604 39.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -16.752 -43.876 40.747 1.00 0.00 H new ATOM 383 N VAL A 26 -10.180 -48.021 41.164 1.00 0.00 N ATOM 384 CA VAL A 26 -9.040 -48.761 40.638 1.00 0.00 C ATOM 385 C VAL A 26 -9.495 -50.131 40.115 1.00 0.00 C ATOM 386 O VAL A 26 -9.074 -50.576 39.044 1.00 0.00 O ATOM 387 CB VAL A 26 -7.943 -48.944 41.719 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.741 -49.664 41.134 1.00 0.00 C ATOM 389 CG2 VAL A 26 -7.521 -47.617 42.316 1.00 0.00 C ATOM 0 H VAL A 26 -10.128 -47.822 42.163 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.615 -48.185 39.816 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.366 -49.549 42.521 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.979 -49.785 41.904 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.047 -50.644 40.768 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.333 -49.080 40.309 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.751 -47.785 43.069 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.125 -46.974 41.530 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.383 -47.136 42.779 1.00 0.00 H new ATOM 399 N LYS A 27 -10.371 -50.787 40.874 1.00 0.00 N ATOM 400 CA LYS A 27 -10.891 -52.105 40.496 1.00 0.00 C ATOM 401 C LYS A 27 -11.563 -52.041 39.111 1.00 0.00 C ATOM 402 O LYS A 27 -11.321 -52.890 38.256 1.00 0.00 O ATOM 403 CB LYS A 27 -11.900 -52.603 41.539 1.00 0.00 C ATOM 404 CG LYS A 27 -12.411 -54.016 41.284 1.00 0.00 C ATOM 405 CD LYS A 27 -13.393 -54.455 42.335 1.00 0.00 C ATOM 406 CE LYS A 27 -13.879 -55.844 42.044 1.00 0.00 C ATOM 407 NZ LYS A 27 -14.856 -56.306 43.052 1.00 0.00 N ATOM 0 H LYS A 27 -10.738 -50.429 41.756 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.054 -52.802 40.452 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.435 -52.568 42.524 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.749 -51.920 41.563 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -12.885 -54.059 40.303 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.569 -54.708 41.262 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.922 -54.425 43.318 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.237 -53.766 42.365 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.337 -55.869 41.055 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -13.031 -56.528 42.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -15.168 -57.270 42.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.411 -56.306 43.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.677 -55.668 43.058 1.00 0.00 H new ATOM 421 N HIS A 28 -12.388 -51.012 38.909 1.00 0.00 N ATOM 422 CA HIS A 28 -13.055 -50.805 37.624 1.00 0.00 C ATOM 423 C HIS A 28 -12.055 -50.478 36.518 1.00 0.00 C ATOM 424 O HIS A 28 -12.200 -50.926 35.371 1.00 0.00 O ATOM 425 CB HIS A 28 -14.150 -49.732 37.728 1.00 0.00 C ATOM 426 CG HIS A 28 -15.416 -50.225 38.356 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.546 -50.492 39.696 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.630 -50.514 37.807 1.00 0.00 C ATOM 429 CE1 HIS A 28 -16.768 -50.917 39.939 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.440 -50.937 38.816 1.00 0.00 N ATOM 0 H HIS A 28 -12.609 -50.312 39.617 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.540 -51.743 37.354 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.769 -48.892 38.309 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -14.373 -49.354 36.730 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -14.811 -50.379 40.394 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.899 -50.424 36.765 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.153 -51.202 40.907 1.00 0.00 H new ATOM 438 N ALA A 29 -11.023 -49.716 36.860 1.00 0.00 N ATOM 439 CA ALA A 29 -9.996 -49.342 35.907 1.00 0.00 C ATOM 440 C ALA A 29 -9.341 -50.590 35.332 1.00 0.00 C ATOM 441 O ALA A 29 -9.055 -50.660 34.145 1.00 0.00 O ATOM 442 CB ALA A 29 -8.958 -48.448 36.559 1.00 0.00 C ATOM 0 H ALA A 29 -10.879 -49.345 37.799 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.461 -48.783 35.095 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.197 -48.180 35.826 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.439 -47.543 36.931 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.491 -48.978 37.389 1.00 0.00 H new ATOM 448 N LEU A 30 -9.132 -51.573 36.193 1.00 0.00 N ATOM 449 CA LEU A 30 -8.539 -52.848 35.809 1.00 0.00 C ATOM 450 C LEU A 30 -9.423 -53.554 34.800 1.00 0.00 C ATOM 451 O LEU A 30 -8.957 -54.115 33.826 1.00 0.00 O ATOM 452 CB LEU A 30 -8.330 -53.743 37.029 1.00 0.00 C ATOM 453 CG LEU A 30 -7.282 -53.280 38.046 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.290 -54.170 39.283 1.00 0.00 C ATOM 455 CD2 LEU A 30 -5.911 -53.274 37.417 1.00 0.00 C ATOM 0 H LEU A 30 -9.369 -51.511 37.183 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.568 -52.646 35.357 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.285 -53.844 37.545 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.050 -54.737 36.679 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.534 -52.266 38.355 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.537 -53.819 39.989 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.273 -54.132 39.753 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.066 -55.197 38.994 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.176 -52.943 38.150 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.661 -54.280 37.081 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.905 -52.594 36.565 1.00 0.00 H new ATOM 467 N GLU A 31 -10.716 -53.495 35.039 1.00 0.00 N ATOM 468 CA GLU A 31 -11.682 -54.144 34.169 1.00 0.00 C ATOM 469 C GLU A 31 -11.641 -53.526 32.764 1.00 0.00 C ATOM 470 O GLU A 31 -11.754 -54.229 31.770 1.00 0.00 O ATOM 471 CB GLU A 31 -13.067 -54.004 34.749 1.00 0.00 C ATOM 472 CG GLU A 31 -13.202 -54.594 36.143 1.00 0.00 C ATOM 473 CD GLU A 31 -14.582 -54.424 36.717 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.108 -53.294 36.681 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.153 -55.425 37.216 1.00 0.00 O ATOM 0 H GLU A 31 -11.127 -53.002 35.832 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.427 -55.201 34.092 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.333 -52.948 34.783 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.781 -54.492 34.086 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -12.956 -55.655 36.109 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.477 -54.120 36.805 1.00 0.00 H new ATOM 482 N PHE A 32 -11.491 -52.195 32.703 1.00 0.00 N ATOM 483 CA PHE A 32 -11.390 -51.497 31.409 1.00 0.00 C ATOM 484 C PHE A 32 -10.108 -51.881 30.689 1.00 0.00 C ATOM 485 O PHE A 32 -10.067 -51.965 29.462 1.00 0.00 O ATOM 486 CB PHE A 32 -11.493 -49.984 31.574 1.00 0.00 C ATOM 487 CG PHE A 32 -12.877 -49.505 31.923 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.843 -49.374 30.946 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.210 -49.183 33.226 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.117 -48.944 31.261 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.479 -48.751 33.549 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.436 -48.637 32.555 1.00 0.00 C ATOM 0 H PHE A 32 -11.437 -51.586 33.520 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.235 -51.814 30.797 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.801 -49.665 32.353 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.175 -49.504 30.648 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.599 -49.611 29.921 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.465 -49.271 34.003 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.862 -48.850 30.485 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.725 -48.503 34.571 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.434 -48.306 32.801 1.00 0.00 H new ATOM 502 N LEU A 33 -9.054 -52.093 31.464 1.00 0.00 N ATOM 503 CA LEU A 33 -7.771 -52.494 30.919 1.00 0.00 C ATOM 504 C LEU A 33 -7.891 -53.855 30.227 1.00 0.00 C ATOM 505 O LEU A 33 -7.366 -54.068 29.138 1.00 0.00 O ATOM 506 CB LEU A 33 -6.726 -52.555 32.038 1.00 0.00 C ATOM 507 CG LEU A 33 -6.321 -51.204 32.632 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.392 -51.403 33.818 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.659 -50.345 31.569 1.00 0.00 C ATOM 0 H LEU A 33 -9.066 -51.992 32.479 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.454 -51.758 30.180 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.113 -53.184 32.840 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.833 -53.045 31.651 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.216 -50.691 32.984 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.113 -50.433 34.229 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.900 -51.989 34.584 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.495 -51.930 33.493 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.375 -49.386 32.002 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.770 -50.852 31.193 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.357 -50.180 30.748 1.00 0.00 H new ATOM 521 N GLU A 34 -8.621 -54.760 30.878 1.00 0.00 N ATOM 522 CA GLU A 34 -8.867 -56.104 30.362 1.00 0.00 C ATOM 523 C GLU A 34 -9.516 -56.036 28.973 1.00 0.00 C ATOM 524 O GLU A 34 -9.267 -56.875 28.109 1.00 0.00 O ATOM 525 CB GLU A 34 -9.813 -56.859 31.307 1.00 0.00 C ATOM 526 CG GLU A 34 -9.302 -57.048 32.724 1.00 0.00 C ATOM 527 CD GLU A 34 -10.284 -57.820 33.599 1.00 0.00 C ATOM 528 OE1 GLU A 34 -11.252 -58.400 33.060 1.00 0.00 O ATOM 529 OE2 GLU A 34 -10.088 -57.858 34.833 1.00 0.00 O ATOM 0 H GLU A 34 -9.059 -54.580 31.781 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.911 -56.623 30.292 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.761 -56.323 31.349 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.020 -57.840 30.879 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.350 -57.578 32.696 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.111 -56.073 33.171 1.00 0.00 H new ATOM 536 N GLN A 35 -10.352 -55.027 28.783 1.00 0.00 N ATOM 537 CA GLN A 35 -11.057 -54.824 27.523 1.00 0.00 C ATOM 538 C GLN A 35 -10.099 -54.462 26.397 1.00 0.00 C ATOM 539 O GLN A 35 -10.448 -54.596 25.225 1.00 0.00 O ATOM 540 CB GLN A 35 -12.095 -53.728 27.687 1.00 0.00 C ATOM 541 CG GLN A 35 -13.215 -54.072 28.654 1.00 0.00 C ATOM 542 CD GLN A 35 -14.198 -52.917 28.868 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.482 -52.151 27.938 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.703 -52.783 30.069 1.00 0.00 N ATOM 0 H GLN A 35 -10.562 -54.327 29.494 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.547 -55.761 27.258 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.598 -52.821 28.031 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.528 -53.504 26.712 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.758 -54.939 28.278 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.784 -54.357 29.614 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.442 -53.436 30.808 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.357 -52.025 30.266 1.00 0.00 H new ATOM 553 N GLY A 36 -8.909 -53.992 26.750 1.00 0.00 N ATOM 554 CA GLY A 36 -7.944 -53.589 25.752 1.00 0.00 C ATOM 555 C GLY A 36 -8.020 -52.109 25.444 1.00 0.00 C ATOM 556 O GLY A 36 -7.871 -51.688 24.302 1.00 0.00 O ATOM 0 H GLY A 36 -8.596 -53.883 27.715 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.941 -53.834 26.100 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.112 -54.157 24.837 1.00 0.00 H new ATOM 560 N LYS A 37 -8.304 -51.334 26.467 1.00 0.00 N ATOM 561 CA LYS A 37 -8.404 -49.885 26.349 1.00 0.00 C ATOM 562 C LYS A 37 -7.466 -49.216 27.338 1.00 0.00 C ATOM 563 O LYS A 37 -6.954 -49.847 28.259 1.00 0.00 O ATOM 564 CB LYS A 37 -9.863 -49.420 26.591 1.00 0.00 C ATOM 565 CG LYS A 37 -10.865 -49.842 25.497 1.00 0.00 C ATOM 566 CD LYS A 37 -10.980 -48.806 24.377 1.00 0.00 C ATOM 567 CE LYS A 37 -9.773 -48.789 23.464 1.00 0.00 C ATOM 568 NZ LYS A 37 -9.554 -50.071 22.766 1.00 0.00 N ATOM 0 H LYS A 37 -8.474 -51.686 27.409 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.114 -49.596 25.339 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.202 -49.817 27.548 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.874 -48.333 26.675 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.555 -50.797 25.074 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.846 -49.996 25.947 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.873 -49.014 23.787 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -11.111 -47.817 24.816 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.895 -47.997 22.725 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.886 -48.545 24.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.294 -49.887 21.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -8.787 -50.594 23.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.427 -50.636 22.796 1.00 0.00 H new ATOM 582 N HIS A 38 -7.222 -47.926 27.134 1.00 0.00 N ATOM 583 CA HIS A 38 -6.337 -47.169 28.019 1.00 0.00 C ATOM 584 C HIS A 38 -7.154 -46.407 29.037 1.00 0.00 C ATOM 585 O HIS A 38 -8.202 -45.848 28.691 1.00 0.00 O ATOM 586 CB HIS A 38 -5.479 -46.153 27.217 1.00 0.00 C ATOM 587 CG HIS A 38 -4.211 -46.718 26.647 1.00 0.00 C ATOM 588 ND1 HIS A 38 -3.387 -46.021 25.793 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.599 -47.874 26.883 1.00 0.00 C ATOM 590 CE1 HIS A 38 -2.326 -46.751 25.534 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.421 -47.866 26.178 1.00 0.00 N ATOM 0 H HIS A 38 -7.621 -47.383 26.368 1.00 0.00 H new ATOM 0 HA HIS A 38 -5.678 -47.881 28.517 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.082 -45.753 26.402 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.228 -45.316 27.868 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -3.570 -45.089 25.421 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.962 -48.673 27.513 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -1.509 -46.465 24.888 1.00 0.00 H new ATOM 599 N VAL A 39 -6.710 -46.409 30.281 1.00 0.00 N ATOM 600 CA VAL A 39 -7.382 -45.624 31.303 1.00 0.00 C ATOM 601 C VAL A 39 -6.576 -44.401 31.611 1.00 0.00 C ATOM 602 O VAL A 39 -5.421 -44.491 32.036 1.00 0.00 O ATOM 603 CB VAL A 39 -7.608 -46.418 32.620 1.00 0.00 C ATOM 604 CG1 VAL A 39 -8.124 -45.494 33.718 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.583 -47.526 32.430 1.00 0.00 C ATOM 0 H VAL A 39 -5.900 -46.936 30.606 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.360 -45.357 30.903 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.646 -46.840 32.909 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.277 -46.066 34.633 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.395 -44.704 33.901 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.069 -45.050 33.406 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.716 -48.059 33.371 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.540 -47.117 32.106 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.208 -48.215 31.673 1.00 0.00 H new ATOM 615 N ARG A 40 -7.165 -43.275 31.381 1.00 0.00 N ATOM 616 CA ARG A 40 -6.555 -42.045 31.658 1.00 0.00 C ATOM 617 C ARG A 40 -7.026 -41.595 33.038 1.00 0.00 C ATOM 618 O ARG A 40 -8.196 -41.268 33.207 1.00 0.00 O ATOM 619 CB ARG A 40 -6.969 -41.014 30.608 1.00 0.00 C ATOM 620 CG ARG A 40 -6.306 -39.651 30.729 1.00 0.00 C ATOM 621 CD ARG A 40 -6.877 -38.691 29.703 1.00 0.00 C ATOM 622 NE ARG A 40 -6.129 -37.440 29.597 1.00 0.00 N ATOM 623 CZ ARG A 40 -6.492 -36.425 28.818 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.654 -36.461 28.188 1.00 0.00 N ATOM 625 NH2 ARG A 40 -5.713 -35.367 28.697 1.00 0.00 N ATOM 0 H ARG A 40 -8.103 -43.197 30.987 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.470 -42.142 31.637 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.749 -41.419 29.620 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -8.049 -40.879 30.663 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.458 -39.253 31.732 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -5.230 -39.749 30.585 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.893 -39.180 28.729 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -7.911 -38.466 29.963 1.00 0.00 H new ATOM 0 HE ARG A 40 -5.279 -37.339 30.153 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.270 -37.266 28.300 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.934 -35.684 27.590 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -4.828 -35.325 29.202 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -5.996 -34.591 28.098 1.00 0.00 H new ATOM 639 N PHE A 41 -6.130 -41.604 34.009 1.00 0.00 N ATOM 640 CA PHE A 41 -6.492 -41.194 35.357 1.00 0.00 C ATOM 641 C PHE A 41 -6.401 -39.686 35.448 1.00 0.00 C ATOM 642 O PHE A 41 -5.313 -39.121 35.405 1.00 0.00 O ATOM 643 CB PHE A 41 -5.576 -41.863 36.396 1.00 0.00 C ATOM 644 CG PHE A 41 -5.708 -43.372 36.483 1.00 0.00 C ATOM 645 CD1 PHE A 41 -4.971 -44.188 35.641 1.00 0.00 C ATOM 646 CD2 PHE A 41 -6.557 -43.966 37.411 1.00 0.00 C ATOM 647 CE1 PHE A 41 -5.066 -45.563 35.712 1.00 0.00 C ATOM 648 CE2 PHE A 41 -6.660 -45.329 37.489 1.00 0.00 C ATOM 649 CZ PHE A 41 -5.912 -46.140 36.640 1.00 0.00 C ATOM 0 H PHE A 41 -5.157 -41.887 33.893 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.513 -41.510 35.573 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.541 -41.616 36.160 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.790 -41.437 37.376 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -4.309 -43.740 34.915 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -7.140 -43.346 38.076 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -4.483 -46.184 35.047 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -7.325 -45.777 38.213 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.992 -47.215 36.706 1.00 0.00 H new ATOM 659 N ARG A 42 -7.557 -39.056 35.533 1.00 0.00 N ATOM 660 CA ARG A 42 -7.656 -37.613 35.581 1.00 0.00 C ATOM 661 C ARG A 42 -8.007 -37.171 36.982 1.00 0.00 C ATOM 662 O ARG A 42 -9.128 -37.323 37.430 1.00 0.00 O ATOM 663 CB ARG A 42 -8.721 -37.131 34.593 1.00 0.00 C ATOM 664 CG ARG A 42 -8.296 -37.271 33.127 1.00 0.00 C ATOM 665 CD ARG A 42 -9.445 -36.969 32.156 1.00 0.00 C ATOM 666 NE ARG A 42 -10.018 -35.638 32.355 1.00 0.00 N ATOM 667 CZ ARG A 42 -9.865 -34.587 31.518 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.071 -34.672 30.445 1.00 0.00 N ATOM 669 NH2 ARG A 42 -10.518 -33.458 31.768 1.00 0.00 N ATOM 0 H ARG A 42 -8.457 -39.535 35.571 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.696 -37.178 35.303 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -9.638 -37.697 34.754 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -8.951 -36.086 34.799 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.466 -36.594 32.926 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.932 -38.283 32.952 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -9.081 -37.054 31.132 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -10.226 -37.719 32.280 1.00 0.00 H new ATOM 0 HE ARG A 42 -10.579 -35.491 33.194 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.570 -35.539 30.248 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.966 -33.870 29.823 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.127 -33.391 32.584 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.411 -32.658 31.144 1.00 0.00 H new ATOM 683 N VAL A 43 -7.050 -36.577 37.662 1.00 0.00 N ATOM 684 CA VAL A 43 -7.261 -36.153 39.023 1.00 0.00 C ATOM 685 C VAL A 43 -7.335 -34.645 39.120 1.00 0.00 C ATOM 686 O VAL A 43 -6.473 -33.922 38.618 1.00 0.00 O ATOM 687 CB VAL A 43 -6.155 -36.692 39.985 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.768 -36.342 39.515 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.361 -36.170 41.400 1.00 0.00 C ATOM 0 H VAL A 43 -6.120 -36.378 37.292 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.215 -36.576 39.336 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.247 -37.778 39.983 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.035 -36.739 40.217 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.598 -36.775 38.529 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.666 -35.258 39.458 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.577 -36.560 42.049 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.320 -35.081 41.396 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.334 -36.495 41.770 1.00 0.00 H new ATOM 699 N PHE A 44 -8.409 -34.173 39.749 1.00 0.00 N ATOM 700 CA PHE A 44 -8.590 -32.759 39.964 1.00 0.00 C ATOM 701 C PHE A 44 -8.153 -32.394 41.403 1.00 0.00 C ATOM 702 O PHE A 44 -8.648 -32.970 42.393 1.00 0.00 O ATOM 703 CB PHE A 44 -10.060 -32.372 39.721 1.00 0.00 C ATOM 704 CG PHE A 44 -10.318 -30.877 39.783 1.00 0.00 C ATOM 705 CD1 PHE A 44 -10.009 -30.065 38.711 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.881 -30.297 40.915 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.245 -28.714 38.755 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.116 -28.944 40.964 1.00 0.00 C ATOM 709 CZ PHE A 44 -10.802 -28.145 39.880 1.00 0.00 C ATOM 0 H PHE A 44 -9.161 -34.757 40.115 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.972 -32.201 39.260 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.367 -32.744 38.744 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.685 -32.870 40.462 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.574 -30.500 37.823 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.136 -30.916 41.763 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.994 -28.095 37.906 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.547 -28.504 41.851 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.992 -27.082 39.915 1.00 0.00 H new ATOM 719 N LEU A 45 -7.238 -31.468 41.509 1.00 0.00 N ATOM 720 CA LEU A 45 -6.669 -31.080 42.792 1.00 0.00 C ATOM 721 C LEU A 45 -7.629 -30.274 43.665 1.00 0.00 C ATOM 722 O LEU A 45 -7.921 -30.666 44.786 1.00 0.00 O ATOM 723 CB LEU A 45 -5.376 -30.294 42.562 1.00 0.00 C ATOM 724 CG LEU A 45 -4.281 -31.051 41.799 1.00 0.00 C ATOM 725 CD1 LEU A 45 -3.085 -30.170 41.552 1.00 0.00 C ATOM 726 CD2 LEU A 45 -3.878 -32.271 42.564 1.00 0.00 C ATOM 0 H LEU A 45 -6.859 -30.955 40.713 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.462 -32.000 43.338 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.616 -29.383 42.014 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.978 -29.988 43.530 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.682 -31.352 40.831 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.325 -30.732 41.010 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.386 -29.305 40.962 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.677 -29.835 42.506 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.100 -32.803 42.016 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.497 -31.978 43.542 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.743 -32.922 42.692 1.00 0.00 H new ATOM 738 N LYS A 46 -8.134 -29.140 43.114 1.00 0.00 N ATOM 739 CA LYS A 46 -9.059 -28.233 43.843 1.00 0.00 C ATOM 740 C LYS A 46 -8.355 -27.494 45.001 1.00 0.00 C ATOM 741 O LYS A 46 -7.763 -28.116 45.889 1.00 0.00 O ATOM 742 CB LYS A 46 -10.292 -28.989 44.379 1.00 0.00 C ATOM 743 CG LYS A 46 -11.262 -28.103 45.150 1.00 0.00 C ATOM 744 CD LYS A 46 -12.463 -28.879 45.641 1.00 0.00 C ATOM 745 CE LYS A 46 -13.426 -27.984 46.400 1.00 0.00 C ATOM 746 NZ LYS A 46 -13.990 -26.904 45.541 1.00 0.00 N ATOM 0 H LYS A 46 -7.916 -28.832 42.166 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.392 -27.491 43.118 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.819 -29.448 43.542 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.958 -29.799 45.028 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -10.747 -27.654 46.000 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.594 -27.285 44.510 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.976 -29.333 44.793 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.133 -29.693 46.287 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.240 -28.588 46.802 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.910 -27.537 47.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.795 -26.460 46.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -13.258 -26.188 45.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -14.311 -27.310 44.639 1.00 0.00 H new ATOM 760 N GLY A 47 -8.434 -26.177 44.986 1.00 0.00 N ATOM 761 CA GLY A 47 -7.874 -25.391 46.062 1.00 0.00 C ATOM 762 C GLY A 47 -6.420 -25.020 45.825 1.00 0.00 C ATOM 763 O GLY A 47 -5.957 -25.016 44.683 1.00 0.00 O ATOM 0 H GLY A 47 -8.878 -25.634 44.245 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.461 -24.481 46.185 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.954 -25.950 46.994 1.00 0.00 H new ATOM 767 N ARG A 48 -5.694 -24.760 46.920 1.00 0.00 N ATOM 768 CA ARG A 48 -4.284 -24.343 46.833 1.00 0.00 C ATOM 769 C ARG A 48 -3.390 -25.498 46.426 1.00 0.00 C ATOM 770 O ARG A 48 -2.246 -25.298 46.046 1.00 0.00 O ATOM 771 CB ARG A 48 -3.812 -23.733 48.148 1.00 0.00 C ATOM 772 CG ARG A 48 -4.627 -22.537 48.603 1.00 0.00 C ATOM 773 CD ARG A 48 -4.569 -21.410 47.587 1.00 0.00 C ATOM 774 NE ARG A 48 -3.208 -20.947 47.365 1.00 0.00 N ATOM 775 CZ ARG A 48 -2.805 -20.268 46.284 1.00 0.00 C ATOM 776 NH1 ARG A 48 -3.690 -19.905 45.367 1.00 0.00 N ATOM 777 NH2 ARG A 48 -1.529 -19.930 46.135 1.00 0.00 N ATOM 0 H ARG A 48 -6.054 -24.830 47.872 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.215 -23.579 46.059 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -3.845 -24.498 48.924 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -2.770 -23.430 48.043 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.663 -22.838 48.757 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -4.252 -22.183 49.563 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.995 -21.750 46.643 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.183 -20.578 47.932 1.00 0.00 H new ATOM 0 HE ARG A 48 -2.513 -21.154 48.082 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.675 -20.143 45.486 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.387 -19.388 44.542 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -0.847 -20.188 46.848 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -1.232 -19.413 45.308 1.00 0.00 H new ATOM 791 N GLU A 49 -3.932 -26.706 46.514 1.00 0.00 N ATOM 792 CA GLU A 49 -3.217 -27.917 46.118 1.00 0.00 C ATOM 793 C GLU A 49 -2.873 -27.869 44.638 1.00 0.00 C ATOM 794 O GLU A 49 -1.967 -28.565 44.169 1.00 0.00 O ATOM 795 CB GLU A 49 -4.096 -29.127 46.419 1.00 0.00 C ATOM 796 CG GLU A 49 -4.284 -29.376 47.908 1.00 0.00 C ATOM 797 CD GLU A 49 -5.626 -29.992 48.245 1.00 0.00 C ATOM 798 OE1 GLU A 49 -5.878 -31.161 47.864 1.00 0.00 O ATOM 799 OE2 GLU A 49 -6.445 -29.310 48.887 1.00 0.00 O ATOM 0 H GLU A 49 -4.876 -26.876 46.860 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.285 -27.992 46.679 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.072 -28.983 45.955 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.653 -30.012 45.962 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.490 -30.033 48.263 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.180 -28.432 48.444 1.00 0.00 H new ATOM 806 N MET A 50 -3.598 -27.020 43.902 1.00 0.00 N ATOM 807 CA MET A 50 -3.394 -26.832 42.481 1.00 0.00 C ATOM 808 C MET A 50 -2.055 -26.161 42.186 1.00 0.00 C ATOM 809 O MET A 50 -1.591 -26.179 41.056 1.00 0.00 O ATOM 810 CB MET A 50 -4.534 -26.019 41.885 1.00 0.00 C ATOM 811 CG MET A 50 -5.876 -26.720 41.936 1.00 0.00 C ATOM 812 SD MET A 50 -7.241 -25.737 41.297 1.00 0.00 S ATOM 813 CE MET A 50 -6.759 -25.613 39.569 1.00 0.00 C ATOM 0 H MET A 50 -4.346 -26.444 44.289 1.00 0.00 H new ATOM 0 HA MET A 50 -3.379 -27.818 42.017 1.00 0.00 H new ATOM 0 HB2 MET A 50 -4.609 -25.071 42.418 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.297 -25.784 40.848 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.812 -27.647 41.366 1.00 0.00 H new ATOM 0 HG3 MET A 50 -6.092 -26.995 42.969 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.598 -25.238 38.983 1.00 0.00 H new ATOM 0 HE2 MET A 50 -5.916 -24.928 39.475 1.00 0.00 H new ATOM 0 HE3 MET A 50 -6.470 -26.597 39.200 1.00 0.00 H new ATOM 823 N ALA A 51 -1.460 -25.592 43.189 1.00 0.00 N ATOM 824 CA ALA A 51 -0.165 -24.963 43.028 1.00 0.00 C ATOM 825 C ALA A 51 0.954 -26.007 43.083 1.00 0.00 C ATOM 826 O ALA A 51 2.100 -25.720 42.758 1.00 0.00 O ATOM 827 CB ALA A 51 0.041 -23.891 44.089 1.00 0.00 C ATOM 0 H ALA A 51 -1.843 -25.545 44.133 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.133 -24.485 42.049 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.019 -23.428 43.954 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.736 -23.132 43.995 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.012 -24.344 45.079 1.00 0.00 H new ATOM 833 N THR A 52 0.599 -27.220 43.493 1.00 0.00 N ATOM 834 CA THR A 52 1.547 -28.300 43.611 1.00 0.00 C ATOM 835 C THR A 52 1.060 -29.543 42.878 1.00 0.00 C ATOM 836 O THR A 52 0.155 -30.252 43.338 1.00 0.00 O ATOM 837 CB THR A 52 1.802 -28.636 45.093 1.00 0.00 C ATOM 838 OG1 THR A 52 0.539 -28.904 45.753 1.00 0.00 O ATOM 839 CG2 THR A 52 2.526 -27.492 45.809 1.00 0.00 C ATOM 0 H THR A 52 -0.355 -27.473 43.750 1.00 0.00 H new ATOM 0 HA THR A 52 2.480 -27.972 43.153 1.00 0.00 H new ATOM 0 HB THR A 52 2.440 -29.519 45.137 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.079 -29.323 45.118 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.690 -27.762 46.852 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.486 -27.310 45.326 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.918 -26.589 45.759 1.00 0.00 H new ATOM 847 N PRO A 53 1.674 -29.834 41.741 1.00 0.00 N ATOM 848 CA PRO A 53 1.303 -30.982 40.906 1.00 0.00 C ATOM 849 C PRO A 53 1.647 -32.309 41.578 1.00 0.00 C ATOM 850 O PRO A 53 1.120 -33.359 41.195 1.00 0.00 O ATOM 851 CB PRO A 53 2.138 -30.782 39.631 1.00 0.00 C ATOM 852 CG PRO A 53 3.281 -29.906 40.046 1.00 0.00 C ATOM 853 CD PRO A 53 2.794 -29.054 41.174 1.00 0.00 C ATOM 0 HA PRO A 53 0.230 -31.028 40.717 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.494 -31.735 39.239 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.548 -30.314 38.843 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.134 -30.508 40.358 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.615 -29.288 39.213 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.577 -28.881 41.913 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.464 -28.076 40.824 1.00 0.00 H new ATOM 861 N GLU A 54 2.504 -32.251 42.595 1.00 0.00 N ATOM 862 CA GLU A 54 2.922 -33.440 43.317 1.00 0.00 C ATOM 863 C GLU A 54 1.743 -34.173 43.937 1.00 0.00 C ATOM 864 O GLU A 54 1.745 -35.399 44.034 1.00 0.00 O ATOM 865 CB GLU A 54 3.916 -33.081 44.406 1.00 0.00 C ATOM 866 CG GLU A 54 5.222 -32.535 43.877 1.00 0.00 C ATOM 867 CD GLU A 54 6.186 -32.175 44.981 1.00 0.00 C ATOM 868 OE1 GLU A 54 5.800 -31.393 45.873 1.00 0.00 O ATOM 869 OE2 GLU A 54 7.320 -32.693 44.974 1.00 0.00 O ATOM 0 H GLU A 54 2.922 -31.385 42.936 1.00 0.00 H new ATOM 0 HA GLU A 54 3.394 -34.102 42.591 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.465 -32.343 45.069 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.119 -33.967 45.007 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.683 -33.275 43.223 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.024 -31.652 43.270 1.00 0.00 H new ATOM 876 N ALA A 55 0.742 -33.415 44.360 1.00 0.00 N ATOM 877 CA ALA A 55 -0.444 -33.995 44.986 1.00 0.00 C ATOM 878 C ALA A 55 -1.148 -34.972 44.036 1.00 0.00 C ATOM 879 O ALA A 55 -1.590 -36.051 44.457 1.00 0.00 O ATOM 880 CB ALA A 55 -1.395 -32.892 45.406 1.00 0.00 C ATOM 0 H ALA A 55 0.724 -32.398 44.283 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.130 -34.553 45.868 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.277 -33.330 45.872 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.897 -32.234 46.118 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.695 -32.317 44.530 1.00 0.00 H new ATOM 886 N GLY A 56 -1.251 -34.600 42.761 1.00 0.00 N ATOM 887 CA GLY A 56 -1.853 -35.481 41.760 1.00 0.00 C ATOM 888 C GLY A 56 -0.992 -36.689 41.514 1.00 0.00 C ATOM 889 O GLY A 56 -1.496 -37.794 41.410 1.00 0.00 O ATOM 0 H GLY A 56 -0.929 -33.703 42.398 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.841 -35.797 42.096 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.993 -34.935 40.827 1.00 0.00 H new ATOM 893 N VAL A 57 0.299 -36.468 41.445 1.00 0.00 N ATOM 894 CA VAL A 57 1.257 -37.530 41.211 1.00 0.00 C ATOM 895 C VAL A 57 1.222 -38.560 42.333 1.00 0.00 C ATOM 896 O VAL A 57 1.198 -39.764 42.073 1.00 0.00 O ATOM 897 CB VAL A 57 2.678 -36.967 41.073 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.678 -38.079 40.825 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.734 -35.948 39.946 1.00 0.00 C ATOM 0 H VAL A 57 0.719 -35.545 41.549 1.00 0.00 H new ATOM 0 HA VAL A 57 0.978 -38.019 40.278 1.00 0.00 H new ATOM 0 HB VAL A 57 2.941 -36.473 42.008 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.678 -37.655 40.731 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.658 -38.779 41.660 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.418 -38.604 39.906 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.748 -35.557 39.859 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.448 -36.426 39.009 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.046 -35.130 40.161 1.00 0.00 H new ATOM 909 N ALA A 58 1.179 -38.083 43.581 1.00 0.00 N ATOM 910 CA ALA A 58 1.171 -38.955 44.754 1.00 0.00 C ATOM 911 C ALA A 58 -0.046 -39.868 44.756 1.00 0.00 C ATOM 912 O ALA A 58 0.061 -41.079 45.075 1.00 0.00 O ATOM 913 CB ALA A 58 1.219 -38.124 46.023 1.00 0.00 C ATOM 0 H ALA A 58 1.149 -37.088 43.803 1.00 0.00 H new ATOM 0 HA ALA A 58 2.058 -39.587 44.713 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.213 -38.784 46.891 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.129 -37.524 46.031 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.350 -37.467 46.061 1.00 0.00 H new ATOM 919 N LEU A 59 -1.216 -39.320 44.395 1.00 0.00 N ATOM 920 CA LEU A 59 -2.441 -40.112 44.305 1.00 0.00 C ATOM 921 C LEU A 59 -2.286 -41.180 43.236 1.00 0.00 C ATOM 922 O LEU A 59 -2.632 -42.355 43.445 1.00 0.00 O ATOM 923 CB LEU A 59 -3.619 -39.213 43.960 1.00 0.00 C ATOM 924 CG LEU A 59 -4.986 -39.928 43.774 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.538 -40.449 45.075 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.982 -39.020 43.097 1.00 0.00 C ATOM 0 H LEU A 59 -1.334 -38.334 44.162 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.625 -40.588 45.268 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.725 -38.467 44.748 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.384 -38.675 43.041 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.809 -40.790 43.131 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.494 -40.940 44.894 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.838 -41.165 45.507 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.682 -39.620 45.767 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.930 -39.544 42.979 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.134 -38.128 43.705 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.603 -38.730 42.117 1.00 0.00 H new ATOM 938 N LEU A 60 -1.730 -40.788 42.097 1.00 0.00 N ATOM 939 CA LEU A 60 -1.547 -41.681 40.983 1.00 0.00 C ATOM 940 C LEU A 60 -0.558 -42.785 41.308 1.00 0.00 C ATOM 941 O LEU A 60 -0.777 -43.924 40.918 1.00 0.00 O ATOM 942 CB LEU A 60 -1.124 -40.887 39.734 1.00 0.00 C ATOM 943 CG LEU A 60 -2.171 -39.891 39.212 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.654 -39.151 38.012 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.492 -40.579 38.876 1.00 0.00 C ATOM 0 H LEU A 60 -1.396 -39.839 41.929 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.499 -42.168 40.773 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.208 -40.342 39.962 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.886 -41.592 38.937 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.360 -39.176 40.013 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.413 -38.452 37.661 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.753 -38.602 38.284 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.421 -39.862 37.219 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.205 -39.840 38.511 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.324 -41.333 38.107 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.891 -41.057 39.771 1.00 0.00 H new ATOM 957 N GLU A 61 0.521 -42.447 42.006 1.00 0.00 N ATOM 958 CA GLU A 61 1.512 -43.450 42.401 1.00 0.00 C ATOM 959 C GLU A 61 0.880 -44.525 43.283 1.00 0.00 C ATOM 960 O GLU A 61 1.212 -45.703 43.172 1.00 0.00 O ATOM 961 CB GLU A 61 2.674 -42.800 43.135 1.00 0.00 C ATOM 962 CG GLU A 61 3.518 -41.895 42.278 1.00 0.00 C ATOM 963 CD GLU A 61 4.648 -41.246 43.046 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.408 -40.756 44.164 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.785 -41.232 42.541 1.00 0.00 O ATOM 0 H GLU A 61 0.733 -41.497 42.309 1.00 0.00 H new ATOM 0 HA GLU A 61 1.887 -43.920 41.492 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.283 -42.225 43.975 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.308 -43.582 43.552 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.931 -42.469 41.449 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.886 -41.119 41.845 1.00 0.00 H new ATOM 972 N LYS A 62 -0.038 -44.098 44.151 1.00 0.00 N ATOM 973 CA LYS A 62 -0.731 -45.015 45.046 1.00 0.00 C ATOM 974 C LYS A 62 -1.542 -46.008 44.219 1.00 0.00 C ATOM 975 O LYS A 62 -1.519 -47.223 44.458 1.00 0.00 O ATOM 976 CB LYS A 62 -1.662 -44.211 45.953 1.00 0.00 C ATOM 977 CG LYS A 62 -2.064 -44.917 47.237 1.00 0.00 C ATOM 978 CD LYS A 62 -2.864 -43.989 48.125 1.00 0.00 C ATOM 979 CE LYS A 62 -3.120 -44.608 49.487 1.00 0.00 C ATOM 980 NZ LYS A 62 -3.921 -45.847 49.404 1.00 0.00 N ATOM 0 H LYS A 62 -0.316 -43.122 44.250 1.00 0.00 H new ATOM 0 HA LYS A 62 -0.011 -45.561 45.655 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.174 -43.270 46.209 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.564 -43.961 45.394 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.654 -45.803 47.002 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.174 -45.258 47.766 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.328 -43.048 48.247 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.815 -43.755 47.646 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -2.167 -44.827 49.968 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.637 -43.886 50.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.829 -46.380 50.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.920 -45.605 49.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.578 -46.430 48.614 1.00 0.00 H new ATOM 994 N ILE A 63 -2.224 -45.462 43.214 1.00 0.00 N ATOM 995 CA ILE A 63 -3.051 -46.231 42.289 1.00 0.00 C ATOM 996 C ILE A 63 -2.187 -47.142 41.422 1.00 0.00 C ATOM 997 O ILE A 63 -2.514 -48.301 41.190 1.00 0.00 O ATOM 998 CB ILE A 63 -3.876 -45.295 41.387 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.711 -44.326 42.240 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.768 -46.098 40.462 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.319 -43.195 41.467 1.00 0.00 C ATOM 0 H ILE A 63 -2.217 -44.461 43.018 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.731 -46.843 42.882 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.189 -44.710 40.776 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.507 -44.885 42.731 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.079 -43.915 43.027 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.344 -45.420 39.832 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -4.154 -46.743 39.834 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.449 -46.709 41.054 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.891 -42.559 42.142 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.529 -42.608 40.998 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.980 -43.594 40.697 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.084 -46.600 40.943 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.152 -47.340 40.092 1.00 0.00 C ATOM 1015 C TRP A 64 0.330 -48.601 40.788 1.00 0.00 C ATOM 1016 O TRP A 64 0.459 -49.649 40.148 1.00 0.00 O ATOM 1017 CB TRP A 64 1.024 -46.437 39.679 1.00 0.00 C ATOM 1018 CG TRP A 64 2.146 -47.160 38.993 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.466 -47.172 39.380 1.00 0.00 C ATOM 1020 CD2 TRP A 64 2.072 -47.986 37.806 1.00 0.00 C ATOM 1021 NE1 TRP A 64 4.189 -47.932 38.510 1.00 0.00 N ATOM 1022 CE2 TRP A 64 3.368 -48.454 37.555 1.00 0.00 C ATOM 1023 CE3 TRP A 64 1.050 -48.373 36.954 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 3.677 -49.284 36.486 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 1.369 -49.198 35.898 1.00 0.00 C ATOM 1026 CH2 TRP A 64 2.663 -49.645 35.680 1.00 0.00 C ATOM 0 H TRP A 64 -0.803 -45.637 41.128 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.674 -47.648 39.186 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.652 -45.656 39.016 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.416 -45.942 40.567 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.868 -46.658 40.241 1.00 0.00 H new ATOM 0 HE1 TRP A 64 5.196 -48.087 38.565 1.00 0.00 H new ATOM 0 HE3 TRP A 64 0.036 -48.038 37.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 4.687 -49.625 36.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.587 -49.506 35.219 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.861 -50.298 34.843 1.00 0.00 H new ATOM 1037 N THR A 65 0.574 -48.503 42.077 1.00 0.00 N ATOM 1038 CA THR A 65 1.034 -49.635 42.854 1.00 0.00 C ATOM 1039 C THR A 65 -0.024 -50.766 42.877 1.00 0.00 C ATOM 1040 O THR A 65 0.303 -51.931 43.074 1.00 0.00 O ATOM 1041 CB THR A 65 1.382 -49.209 44.310 1.00 0.00 C ATOM 1042 OG1 THR A 65 2.248 -48.068 44.284 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.076 -50.338 45.062 1.00 0.00 C ATOM 0 H THR A 65 0.460 -47.643 42.613 1.00 0.00 H new ATOM 0 HA THR A 65 1.937 -50.013 42.374 1.00 0.00 H new ATOM 0 HB THR A 65 0.451 -48.966 44.822 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.742 -47.280 43.994 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.307 -50.012 46.076 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.419 -51.207 45.101 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.999 -50.604 44.547 1.00 0.00 H new ATOM 1051 N MET A 66 -1.288 -50.403 42.662 1.00 0.00 N ATOM 1052 CA MET A 66 -2.375 -51.358 42.678 1.00 0.00 C ATOM 1053 C MET A 66 -2.656 -51.942 41.289 1.00 0.00 C ATOM 1054 O MET A 66 -3.076 -53.096 41.168 1.00 0.00 O ATOM 1055 CB MET A 66 -3.654 -50.687 43.227 1.00 0.00 C ATOM 1056 CG MET A 66 -3.575 -50.309 44.688 1.00 0.00 C ATOM 1057 SD MET A 66 -5.064 -49.491 45.273 1.00 0.00 S ATOM 1058 CE MET A 66 -6.267 -50.823 45.127 1.00 0.00 C ATOM 0 H MET A 66 -1.577 -49.443 42.474 1.00 0.00 H new ATOM 0 HA MET A 66 -2.075 -52.181 43.327 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.861 -49.791 42.642 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.497 -51.363 43.083 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.400 -51.206 45.282 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.719 -49.652 44.844 1.00 0.00 H new ATOM 0 HE1 MET A 66 -7.142 -50.591 45.734 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.566 -50.930 44.084 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.822 -51.755 45.475 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.403 -51.158 40.246 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.722 -51.583 38.874 1.00 0.00 C ATOM 1070 C ILE A 67 -1.512 -52.140 38.113 1.00 0.00 C ATOM 1071 O ILE A 67 -1.670 -52.713 37.042 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.341 -50.421 38.037 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.350 -49.259 37.935 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.624 -49.962 38.643 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -2.811 -48.127 37.064 1.00 0.00 C ATOM 0 H ILE A 67 -1.982 -50.232 40.316 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.450 -52.385 38.994 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.552 -50.790 37.033 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.155 -48.875 38.936 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.404 -49.637 37.548 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.040 -49.151 38.044 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.331 -50.792 38.671 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.441 -49.607 39.657 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.050 -47.347 37.048 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -2.978 -48.492 36.051 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.741 -47.718 37.460 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.319 -51.989 38.686 1.00 0.00 N ATOM 1088 CA GLU A 68 0.928 -52.429 38.035 1.00 0.00 C ATOM 1089 C GLU A 68 0.980 -53.939 37.789 1.00 0.00 C ATOM 1090 O GLU A 68 1.830 -54.425 37.042 1.00 0.00 O ATOM 1091 CB GLU A 68 2.169 -51.954 38.827 1.00 0.00 C ATOM 1092 CG GLU A 68 2.201 -52.276 40.329 1.00 0.00 C ATOM 1093 CD GLU A 68 2.404 -53.750 40.630 1.00 0.00 C ATOM 1094 OE1 GLU A 68 3.528 -54.248 40.459 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.449 -54.413 41.089 1.00 0.00 O ATOM 0 H GLU A 68 -0.183 -51.564 39.603 1.00 0.00 H new ATOM 0 HA GLU A 68 0.940 -51.957 37.053 1.00 0.00 H new ATOM 0 HB2 GLU A 68 3.054 -52.394 38.367 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.253 -50.874 38.710 1.00 0.00 H new ATOM 0 HG2 GLU A 68 3.002 -51.704 40.798 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.266 -51.946 40.783 1.00 0.00 H new ATOM 1102 N ASN A 69 0.104 -54.673 38.441 1.00 0.00 N ATOM 1103 CA ASN A 69 0.039 -56.112 38.259 1.00 0.00 C ATOM 1104 C ASN A 69 -0.712 -56.487 36.976 1.00 0.00 C ATOM 1105 O ASN A 69 -0.517 -57.593 36.430 1.00 0.00 O ATOM 1106 CB ASN A 69 -0.587 -56.795 39.492 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.913 -56.179 39.946 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -2.680 -55.657 39.141 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -2.157 -56.245 41.238 1.00 0.00 N ATOM 0 H ASN A 69 -0.575 -54.299 39.104 1.00 0.00 H new ATOM 0 HA ASN A 69 1.061 -56.477 38.153 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.748 -57.849 39.267 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.123 -56.750 40.318 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -3.019 -55.851 41.615 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.484 -56.691 41.862 1.00 0.00 H new ATOM 1116 N GLU A 70 -1.556 -55.572 36.475 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.318 -55.819 35.247 1.00 0.00 C ATOM 1118 C GLU A 70 -1.980 -54.777 34.160 1.00 0.00 C ATOM 1119 O GLU A 70 -2.321 -54.956 32.985 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.815 -55.771 35.543 1.00 0.00 C ATOM 1121 CG GLU A 70 -4.295 -56.831 36.510 1.00 0.00 C ATOM 1122 CD GLU A 70 -4.033 -58.243 36.006 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -4.244 -58.517 34.803 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -3.610 -59.086 36.821 1.00 0.00 O ATOM 0 H GLU A 70 -1.726 -54.660 36.900 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.045 -56.807 34.878 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.062 -54.789 35.947 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.362 -55.877 34.606 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.798 -56.694 37.470 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.364 -56.703 36.683 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.311 -53.713 34.547 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.016 -52.619 33.640 1.00 0.00 C ATOM 1133 C ALA A 71 0.469 -52.283 33.610 1.00 0.00 C ATOM 1134 O ALA A 71 1.198 -52.546 34.562 1.00 0.00 O ATOM 1135 CB ALA A 71 -1.820 -51.380 34.039 1.00 0.00 C ATOM 0 H ALA A 71 -0.956 -53.579 35.494 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.301 -52.939 32.638 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.593 -50.563 33.354 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.885 -51.607 33.993 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.555 -51.086 35.055 1.00 0.00 H new ATOM 1141 N ASN A 72 0.895 -51.709 32.494 1.00 0.00 N ATOM 1142 CA ASN A 72 2.254 -51.246 32.315 1.00 0.00 C ATOM 1143 C ASN A 72 2.237 -49.736 32.122 1.00 0.00 C ATOM 1144 O ASN A 72 1.378 -49.199 31.414 1.00 0.00 O ATOM 1145 CB ASN A 72 2.951 -51.951 31.140 1.00 0.00 C ATOM 1146 CG ASN A 72 2.176 -51.848 29.820 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.312 -50.887 29.077 1.00 0.00 O ATOM 1148 ND2 ASN A 72 1.367 -52.861 29.536 1.00 0.00 N ATOM 0 H ASN A 72 0.297 -51.552 31.682 1.00 0.00 H new ATOM 0 HA ASN A 72 2.831 -51.494 33.206 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.943 -51.520 31.005 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.091 -53.003 31.389 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.829 -52.857 28.669 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.283 -53.644 30.184 1.00 0.00 H new ATOM 1155 N ARG A 73 3.148 -49.048 32.790 1.00 0.00 N ATOM 1156 CA ARG A 73 3.182 -47.616 32.737 1.00 0.00 C ATOM 1157 C ARG A 73 3.743 -47.152 31.402 1.00 0.00 C ATOM 1158 O ARG A 73 4.917 -47.349 31.116 1.00 0.00 O ATOM 1159 CB ARG A 73 4.068 -47.099 33.861 1.00 0.00 C ATOM 1160 CG ARG A 73 3.875 -45.639 34.174 1.00 0.00 C ATOM 1161 CD ARG A 73 4.905 -45.131 35.172 1.00 0.00 C ATOM 1162 NE ARG A 73 6.238 -44.978 34.562 1.00 0.00 N ATOM 1163 CZ ARG A 73 7.379 -45.429 35.091 1.00 0.00 C ATOM 1164 NH1 ARG A 73 7.356 -46.227 36.165 1.00 0.00 N ATOM 1165 NH2 ARG A 73 8.538 -45.094 34.533 1.00 0.00 N ATOM 0 H ARG A 73 3.871 -49.469 33.374 1.00 0.00 H new ATOM 0 HA ARG A 73 2.169 -47.229 32.849 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.872 -47.682 34.761 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.111 -47.267 33.594 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.944 -45.058 33.254 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.873 -45.483 34.575 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.578 -44.172 35.574 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.968 -45.823 36.012 1.00 0.00 H new ATOM 0 HE ARG A 73 6.294 -44.491 33.668 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.465 -46.494 36.583 1.00 0.00 H new ATOM 0 HH12 ARG A 73 8.230 -46.569 36.565 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.552 -44.496 33.707 1.00 0.00 H new ATOM 0 HH22 ARG A 73 9.413 -45.435 34.931 1.00 0.00 H new ATOM 1179 N ASP A 74 2.906 -46.539 30.585 1.00 0.00 N ATOM 1180 CA ASP A 74 3.365 -46.025 29.289 1.00 0.00 C ATOM 1181 C ASP A 74 4.245 -44.797 29.503 1.00 0.00 C ATOM 1182 O ASP A 74 5.253 -44.604 28.808 1.00 0.00 O ATOM 1183 CB ASP A 74 2.172 -45.667 28.395 1.00 0.00 C ATOM 1184 CG ASP A 74 2.607 -45.142 27.044 1.00 0.00 C ATOM 1185 OD1 ASP A 74 3.181 -45.919 26.264 1.00 0.00 O ATOM 1186 OD2 ASP A 74 2.356 -43.953 26.743 1.00 0.00 O ATOM 0 H ASP A 74 1.918 -46.382 30.783 1.00 0.00 H new ATOM 0 HA ASP A 74 3.946 -46.802 28.792 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.547 -46.549 28.256 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.558 -44.917 28.894 1.00 0.00 H new ATOM 1191 N LYS A 75 3.867 -43.979 30.480 1.00 0.00 N ATOM 1192 CA LYS A 75 4.609 -42.780 30.798 1.00 0.00 C ATOM 1193 C LYS A 75 4.289 -42.328 32.207 1.00 0.00 C ATOM 1194 O LYS A 75 3.260 -42.722 32.777 1.00 0.00 O ATOM 1195 CB LYS A 75 4.331 -41.653 29.790 1.00 0.00 C ATOM 1196 CG LYS A 75 5.288 -40.476 29.903 1.00 0.00 C ATOM 1197 CD LYS A 75 5.052 -39.466 28.793 1.00 0.00 C ATOM 1198 CE LYS A 75 6.042 -38.317 28.867 1.00 0.00 C ATOM 1199 NZ LYS A 75 5.848 -37.331 27.771 1.00 0.00 N ATOM 0 H LYS A 75 3.045 -44.132 31.064 1.00 0.00 H new ATOM 0 HA LYS A 75 5.671 -43.017 30.733 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.388 -42.060 28.780 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.311 -41.295 29.932 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.160 -39.992 30.871 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.316 -40.835 29.859 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.138 -39.960 27.825 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.036 -39.077 28.863 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.939 -37.813 29.828 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.057 -38.712 28.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.547 -36.566 27.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.972 -37.803 26.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.889 -36.933 27.828 1.00 0.00 H new ATOM 1213 N GLU A 76 5.163 -41.544 32.780 1.00 0.00 N ATOM 1214 CA GLU A 76 4.996 -41.046 34.132 1.00 0.00 C ATOM 1215 C GLU A 76 3.905 -39.977 34.184 1.00 0.00 C ATOM 1216 O GLU A 76 3.680 -39.261 33.196 1.00 0.00 O ATOM 1217 CB GLU A 76 6.345 -40.457 34.648 1.00 0.00 C ATOM 1218 CG GLU A 76 7.516 -41.455 34.697 1.00 0.00 C ATOM 1219 CD GLU A 76 8.044 -41.838 33.329 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.687 -40.992 32.689 1.00 0.00 O ATOM 1221 OE2 GLU A 76 7.825 -42.987 32.892 1.00 0.00 O ATOM 0 H GLU A 76 6.019 -41.227 32.324 1.00 0.00 H new ATOM 0 HA GLU A 76 4.695 -41.875 34.773 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.627 -39.621 34.008 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.189 -40.054 35.649 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.327 -41.022 35.282 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.193 -42.356 35.218 1.00 0.00 H new ATOM 1228 N PRO A 77 3.202 -39.846 35.340 1.00 0.00 N ATOM 1229 CA PRO A 77 2.135 -38.834 35.517 1.00 0.00 C ATOM 1230 C PRO A 77 2.624 -37.423 35.255 1.00 0.00 C ATOM 1231 O PRO A 77 3.684 -37.011 35.734 1.00 0.00 O ATOM 1232 CB PRO A 77 1.744 -38.984 37.011 1.00 0.00 C ATOM 1233 CG PRO A 77 2.863 -39.754 37.621 1.00 0.00 C ATOM 1234 CD PRO A 77 3.378 -40.654 36.548 1.00 0.00 C ATOM 0 HA PRO A 77 1.312 -38.991 34.819 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.626 -38.011 37.489 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.796 -39.510 37.121 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.646 -39.086 37.979 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.518 -40.329 38.480 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.423 -40.920 36.709 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.816 -41.587 36.497 1.00 0.00 H new ATOM 1242 N ASN A 78 1.840 -36.668 34.510 1.00 0.00 N ATOM 1243 CA ASN A 78 2.191 -35.306 34.159 1.00 0.00 C ATOM 1244 C ASN A 78 1.000 -34.391 34.376 1.00 0.00 C ATOM 1245 O ASN A 78 -0.143 -34.806 34.224 1.00 0.00 O ATOM 1246 CB ASN A 78 2.649 -35.222 32.704 1.00 0.00 C ATOM 1247 CG ASN A 78 3.172 -33.845 32.328 1.00 0.00 C ATOM 1248 OD1 ASN A 78 3.742 -33.150 33.153 1.00 0.00 O ATOM 1249 ND2 ASN A 78 2.959 -33.451 31.089 1.00 0.00 N ATOM 0 H ASN A 78 0.945 -36.980 34.132 1.00 0.00 H new ATOM 0 HA ASN A 78 3.013 -34.988 34.800 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.431 -35.962 32.531 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.816 -35.480 32.050 1.00 0.00 H new ATOM 0 HD21 ASN A 78 3.275 -32.530 30.785 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.478 -34.067 30.434 1.00 0.00 H new ATOM 1256 N PHE A 79 1.282 -33.150 34.715 1.00 0.00 N ATOM 1257 CA PHE A 79 0.248 -32.163 34.969 1.00 0.00 C ATOM 1258 C PHE A 79 -0.079 -31.403 33.700 1.00 0.00 C ATOM 1259 O PHE A 79 0.769 -30.722 33.146 1.00 0.00 O ATOM 1260 CB PHE A 79 0.709 -31.199 36.071 1.00 0.00 C ATOM 1261 CG PHE A 79 -0.223 -30.058 36.344 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -1.367 -30.250 37.107 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.038 -28.785 35.843 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -2.233 -29.199 37.369 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.811 -27.737 36.093 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.961 -27.935 36.861 1.00 0.00 C ATOM 0 H PHE A 79 2.232 -32.796 34.823 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.655 -32.673 35.303 1.00 0.00 H new ATOM 0 HB2 PHE A 79 0.847 -31.764 36.993 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.683 -30.795 35.795 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.585 -31.231 37.502 1.00 0.00 H new ATOM 0 HD2 PHE A 79 0.924 -28.620 35.248 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -3.117 -29.363 37.967 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.590 -26.757 35.696 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.633 -27.113 37.058 1.00 0.00 H new ATOM 1276 N GLU A 80 -1.304 -31.541 33.226 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.743 -30.812 32.061 1.00 0.00 C ATOM 1278 C GLU A 80 -3.031 -30.106 32.375 1.00 0.00 C ATOM 1279 O GLU A 80 -3.918 -30.671 33.025 1.00 0.00 O ATOM 1280 CB GLU A 80 -1.925 -31.744 30.845 1.00 0.00 C ATOM 1281 CG GLU A 80 -3.164 -32.616 30.937 1.00 0.00 C ATOM 1282 CD GLU A 80 -3.329 -33.500 29.723 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -3.454 -32.955 28.595 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -3.378 -34.746 29.887 1.00 0.00 O ATOM 0 H GLU A 80 -2.010 -32.154 33.634 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.977 -30.082 31.800 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.980 -31.141 29.939 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.046 -32.382 30.750 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.104 -33.237 31.831 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -4.045 -31.983 31.046 1.00 0.00 H new ATOM 1291 N GLY A 81 -3.162 -28.876 31.940 1.00 0.00 N ATOM 1292 CA GLY A 81 -4.344 -28.137 32.239 1.00 0.00 C ATOM 1293 C GLY A 81 -4.501 -27.903 33.739 1.00 0.00 C ATOM 1294 O GLY A 81 -3.756 -27.142 34.338 1.00 0.00 O ATOM 0 H GLY A 81 -2.467 -28.378 31.384 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.313 -27.178 31.723 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.214 -28.674 31.862 1.00 0.00 H new ATOM 1298 N ARG A 82 -5.478 -28.565 34.331 1.00 0.00 N ATOM 1299 CA ARG A 82 -5.714 -28.474 35.774 1.00 0.00 C ATOM 1300 C ARG A 82 -5.781 -29.872 36.389 1.00 0.00 C ATOM 1301 O ARG A 82 -6.258 -30.057 37.504 1.00 0.00 O ATOM 1302 CB ARG A 82 -7.002 -27.681 36.045 1.00 0.00 C ATOM 1303 CG ARG A 82 -6.866 -26.216 35.633 1.00 0.00 C ATOM 1304 CD ARG A 82 -8.147 -25.434 35.867 1.00 0.00 C ATOM 1305 NE ARG A 82 -7.999 -24.036 35.522 1.00 0.00 N ATOM 1306 CZ ARG A 82 -8.956 -23.103 35.644 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -10.168 -23.424 36.087 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -8.678 -21.855 35.333 1.00 0.00 N ATOM 0 H ARG A 82 -6.128 -29.177 33.838 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.884 -27.944 36.242 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.830 -28.136 35.501 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.248 -27.739 37.105 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.053 -25.756 36.195 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.596 -26.160 34.579 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.952 -25.870 35.275 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.439 -25.520 36.914 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.095 -23.736 35.157 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -10.380 -24.389 36.339 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.886 -22.705 36.175 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.745 -21.607 35.004 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.396 -21.136 35.421 1.00 0.00 H new ATOM 1322 N TYR A 83 -5.267 -30.857 35.650 1.00 0.00 N ATOM 1323 CA TYR A 83 -5.314 -32.260 36.062 1.00 0.00 C ATOM 1324 C TYR A 83 -3.933 -32.899 35.975 1.00 0.00 C ATOM 1325 O TYR A 83 -3.092 -32.493 35.177 1.00 0.00 O ATOM 1326 CB TYR A 83 -6.270 -33.055 35.150 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.739 -32.733 35.312 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -8.305 -31.615 34.735 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.566 -33.592 36.032 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.657 -31.355 34.866 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.921 -33.328 36.169 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.454 -32.211 35.583 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.802 -31.954 35.705 1.00 0.00 O ATOM 0 H TYR A 83 -4.808 -30.705 34.752 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.667 -32.287 37.093 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.988 -32.875 34.112 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.125 -34.119 35.340 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.684 -30.933 34.173 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.147 -34.476 36.490 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -10.085 -30.478 34.404 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.551 -33.999 36.734 1.00 0.00 H new ATOM 0 HH TYR A 83 -12.300 -32.507 35.067 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.703 -33.883 36.824 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.509 -34.705 36.754 1.00 0.00 C ATOM 1345 C VAL A 84 -2.905 -36.039 36.157 1.00 0.00 C ATOM 1346 O VAL A 84 -3.661 -36.788 36.738 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.871 -34.910 38.149 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.656 -35.819 38.058 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.458 -33.570 38.755 1.00 0.00 C ATOM 0 H VAL A 84 -4.338 -34.135 37.581 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.761 -34.208 36.136 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.618 -35.378 38.790 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.224 -35.949 39.050 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.956 -36.789 37.663 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.085 -35.371 37.395 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.012 -33.736 39.735 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.732 -33.084 38.103 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.336 -32.932 38.859 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.414 -36.306 34.982 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.828 -37.487 34.255 1.00 0.00 C ATOM 1361 C ASN A 85 -1.704 -38.481 34.087 1.00 0.00 C ATOM 1362 O ASN A 85 -0.563 -38.110 33.814 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.387 -37.074 32.890 1.00 0.00 C ATOM 1364 CG ASN A 85 -4.646 -36.220 32.993 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -5.437 -36.378 33.895 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -4.818 -35.304 32.056 1.00 0.00 N ATOM 0 H ASN A 85 -1.726 -35.727 34.500 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.603 -37.985 34.838 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.623 -36.520 32.344 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.609 -37.969 32.309 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -5.640 -34.700 32.078 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.129 -35.201 31.311 1.00 0.00 H new ATOM 1373 N MET A 86 -2.037 -39.735 34.280 1.00 0.00 N ATOM 1374 CA MET A 86 -1.128 -40.838 34.074 1.00 0.00 C ATOM 1375 C MET A 86 -1.727 -41.785 33.050 1.00 0.00 C ATOM 1376 O MET A 86 -2.888 -42.202 33.184 1.00 0.00 O ATOM 1377 CB MET A 86 -0.861 -41.571 35.398 1.00 0.00 C ATOM 1378 CG MET A 86 0.094 -42.751 35.262 1.00 0.00 C ATOM 1379 SD MET A 86 0.437 -43.558 36.837 1.00 0.00 S ATOM 1380 CE MET A 86 -1.183 -44.222 37.247 1.00 0.00 C ATOM 0 H MET A 86 -2.965 -40.023 34.591 1.00 0.00 H new ATOM 0 HA MET A 86 -0.175 -40.460 33.704 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.450 -40.864 36.119 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.808 -41.926 35.804 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.331 -43.479 34.571 1.00 0.00 H new ATOM 0 HG3 MET A 86 1.031 -42.406 34.824 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.084 -45.266 37.543 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.613 -43.651 38.070 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.836 -44.152 36.377 1.00 0.00 H new ATOM 1390 N LEU A 87 -0.947 -42.141 32.042 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.406 -43.016 31.008 1.00 0.00 C ATOM 1392 C LEU A 87 -0.836 -44.407 31.230 1.00 0.00 C ATOM 1393 O LEU A 87 0.392 -44.597 31.288 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.012 -42.455 29.617 1.00 0.00 C ATOM 1395 CG LEU A 87 -1.704 -43.085 28.375 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.145 -44.460 28.059 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.213 -43.161 28.590 1.00 0.00 C ATOM 0 H LEU A 87 0.017 -41.826 31.930 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.493 -43.083 31.040 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.220 -41.385 29.613 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.065 -42.571 29.499 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.499 -42.441 27.520 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.654 -44.867 27.185 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.078 -44.380 27.853 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.302 -45.121 28.911 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.684 -43.604 27.712 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.425 -43.776 29.465 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.609 -42.158 28.747 1.00 0.00 H new ATOM 1409 N VAL A 88 -1.720 -45.373 31.352 1.00 0.00 N ATOM 1410 CA VAL A 88 -1.318 -46.738 31.547 1.00 0.00 C ATOM 1411 C VAL A 88 -1.823 -47.606 30.416 1.00 0.00 C ATOM 1412 O VAL A 88 -2.884 -47.330 29.830 1.00 0.00 O ATOM 1413 CB VAL A 88 -1.798 -47.322 32.890 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.098 -46.633 34.065 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -3.320 -47.215 33.021 1.00 0.00 C ATOM 0 H VAL A 88 -2.729 -45.230 31.318 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.228 -46.735 31.561 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.533 -48.379 32.912 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.453 -47.062 35.002 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.021 -46.780 33.984 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.321 -45.566 34.047 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.633 -47.634 33.977 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.617 -46.168 32.969 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -3.795 -47.767 32.210 1.00 0.00 H new ATOM 1425 N THR A 89 -1.085 -48.623 30.103 1.00 0.00 N ATOM 1426 CA THR A 89 -1.464 -49.535 29.073 1.00 0.00 C ATOM 1427 C THR A 89 -1.666 -50.912 29.669 1.00 0.00 C ATOM 1428 O THR A 89 -0.898 -51.335 30.514 1.00 0.00 O ATOM 1429 CB THR A 89 -0.378 -49.591 27.976 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.082 -48.268 27.485 1.00 0.00 O ATOM 1431 CG2 THR A 89 -0.816 -50.456 26.800 1.00 0.00 C ATOM 0 H THR A 89 -0.199 -48.845 30.557 1.00 0.00 H new ATOM 0 HA THR A 89 -2.395 -49.193 28.621 1.00 0.00 H new ATOM 0 HB THR A 89 0.511 -50.028 28.431 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.914 -47.824 27.219 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.028 -50.473 26.047 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.008 -51.471 27.147 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.726 -50.043 26.364 1.00 0.00 H new ATOM 1439 N PRO A 90 -2.726 -51.606 29.269 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.008 -52.969 29.735 1.00 0.00 C ATOM 1441 C PRO A 90 -2.023 -53.976 29.148 1.00 0.00 C ATOM 1442 O PRO A 90 -1.409 -53.719 28.111 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.426 -53.200 29.211 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.460 -52.383 27.963 1.00 0.00 C ATOM 1445 CD PRO A 90 -3.744 -51.133 28.319 1.00 0.00 C ATOM 0 HA PRO A 90 -2.915 -53.091 30.814 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.615 -54.254 29.008 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.179 -52.873 29.928 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.971 -52.899 27.137 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.484 -52.179 27.650 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.295 -50.660 27.446 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.411 -50.399 28.771 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.860 -55.094 29.823 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.968 -56.115 29.345 1.00 0.00 C ATOM 1455 C LYS A 91 -1.568 -56.864 28.156 1.00 0.00 C ATOM 1456 O LYS A 91 -2.783 -57.106 28.103 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.623 -57.081 30.464 1.00 0.00 C ATOM 1458 CG LYS A 91 0.228 -56.492 31.569 1.00 0.00 C ATOM 1459 CD LYS A 91 0.528 -57.521 32.634 1.00 0.00 C ATOM 1460 CE LYS A 91 1.396 -56.948 33.738 1.00 0.00 C ATOM 1461 NZ LYS A 91 1.695 -57.957 34.791 1.00 0.00 N ATOM 0 H LYS A 91 -2.333 -55.313 30.700 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.053 -55.630 29.006 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.549 -57.458 30.899 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -0.100 -57.937 30.038 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.161 -56.114 31.151 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.288 -55.642 32.016 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.406 -57.888 33.059 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.031 -58.376 32.183 1.00 0.00 H new ATOM 0 HE2 LYS A 91 2.330 -56.581 33.312 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.893 -56.092 34.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.636 -57.771 35.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 0.980 -57.896 35.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.678 -58.910 34.374 1.00 0.00 H new ATOM 1475 N LYS A 92 -0.706 -57.193 27.212 1.00 0.00 N ATOM 1476 CA LYS A 92 -1.053 -57.906 25.997 1.00 0.00 C ATOM 1477 C LYS A 92 -2.042 -57.114 25.125 1.00 0.00 C ATOM 1478 O LYS A 92 -3.244 -57.086 25.387 1.00 0.00 O ATOM 1479 CB LYS A 92 -1.585 -59.313 26.321 1.00 0.00 C ATOM 1480 CG LYS A 92 -1.774 -60.195 25.097 1.00 0.00 C ATOM 1481 CD LYS A 92 -2.188 -61.606 25.479 1.00 0.00 C ATOM 1482 CE LYS A 92 -2.316 -62.481 24.238 1.00 0.00 C ATOM 1483 NZ LYS A 92 -2.619 -63.898 24.584 1.00 0.00 N ATOM 0 H LYS A 92 0.286 -56.964 27.272 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.141 -58.018 25.411 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.894 -59.803 27.007 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.539 -59.220 26.841 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -2.531 -59.757 24.447 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.846 -60.230 24.527 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -1.452 -62.035 26.159 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.138 -61.580 26.012 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -3.105 -62.088 23.597 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.389 -62.437 23.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -2.698 -64.459 23.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.854 -64.282 25.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -3.517 -63.943 25.107 1.00 0.00 H new ATOM 1497 N ALA A 93 -1.517 -56.514 24.084 1.00 0.00 N ATOM 1498 CA ALA A 93 -2.312 -55.674 23.177 1.00 0.00 C ATOM 1499 C ALA A 93 -1.516 -55.378 21.909 1.00 0.00 C ATOM 1500 O ALA A 93 -2.089 -55.172 20.832 1.00 0.00 O ATOM 1501 CB ALA A 93 -2.695 -54.367 23.869 1.00 0.00 C ATOM 0 H ALA A 93 -0.532 -56.584 23.830 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.222 -56.210 22.909 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -3.284 -53.753 23.187 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.283 -54.586 24.760 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -1.792 -53.828 24.154 1.00 0.00 H new ATOM 1507 N GLU A 94 -0.190 -55.367 22.059 1.00 0.00 N ATOM 1508 CA GLU A 94 0.739 -55.128 20.958 1.00 0.00 C ATOM 1509 C GLU A 94 0.637 -53.696 20.427 1.00 0.00 C ATOM 1510 O GLU A 94 1.187 -53.376 19.369 1.00 0.00 O ATOM 1511 CB GLU A 94 0.543 -56.151 19.840 1.00 0.00 C ATOM 1512 CG GLU A 94 1.028 -57.563 20.199 1.00 0.00 C ATOM 1513 CD GLU A 94 0.208 -58.219 21.295 1.00 0.00 C ATOM 1514 OE1 GLU A 94 -0.787 -58.886 20.977 1.00 0.00 O ATOM 1515 OE2 GLU A 94 0.564 -58.046 22.482 1.00 0.00 O ATOM 0 H GLU A 94 0.270 -55.525 22.955 1.00 0.00 H new ATOM 0 HA GLU A 94 1.748 -55.252 21.352 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.515 -56.195 19.582 1.00 0.00 H new ATOM 0 HB3 GLU A 94 1.074 -55.810 18.951 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.996 -58.188 19.307 1.00 0.00 H new ATOM 0 HG3 GLU A 94 2.070 -57.512 20.515 1.00 0.00 H new ATOM 1522 N GLY A 95 -0.043 -52.851 21.170 1.00 0.00 N ATOM 1523 CA GLY A 95 -0.129 -51.466 20.796 1.00 0.00 C ATOM 1524 C GLY A 95 0.949 -50.674 21.478 1.00 0.00 C ATOM 1525 O GLY A 95 0.755 -50.198 22.591 1.00 0.00 O ATOM 0 H GLY A 95 -0.538 -53.099 22.027 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.033 -51.368 19.715 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -1.108 -51.069 21.067 1.00 0.00 H new ATOM 1529 N HIS A 96 2.092 -50.562 20.824 1.00 0.00 N ATOM 1530 CA HIS A 96 3.253 -49.890 21.399 1.00 0.00 C ATOM 1531 C HIS A 96 3.852 -48.919 20.390 1.00 0.00 C ATOM 1532 O HIS A 96 3.440 -48.882 19.232 1.00 0.00 O ATOM 1533 CB HIS A 96 4.292 -50.921 21.809 1.00 0.00 C ATOM 1534 CG HIS A 96 3.854 -51.820 22.931 1.00 0.00 C ATOM 1535 ND1 HIS A 96 3.306 -53.070 22.732 1.00 0.00 N ATOM 1536 CD2 HIS A 96 3.897 -51.635 24.270 1.00 0.00 C ATOM 1537 CE1 HIS A 96 3.028 -53.609 23.892 1.00 0.00 C ATOM 1538 NE2 HIS A 96 3.376 -52.762 24.850 1.00 0.00 N ATOM 0 H HIS A 96 2.245 -50.930 19.885 1.00 0.00 H new ATOM 0 HA HIS A 96 2.938 -49.329 22.279 1.00 0.00 H new ATOM 0 HB2 HIS A 96 4.542 -51.534 20.943 1.00 0.00 H new ATOM 0 HB3 HIS A 96 5.204 -50.404 22.107 1.00 0.00 H new ATOM 0 HD2 HIS A 96 4.272 -50.763 24.785 1.00 0.00 H new ATOM 0 HE1 HIS A 96 2.588 -54.583 24.043 1.00 0.00 H new ATOM 0 HE2 HIS A 96 3.273 -52.922 25.852 1.00 0.00 H new ATOM 1546 N HIS A 97 4.788 -48.135 20.852 1.00 0.00 N ATOM 1547 CA HIS A 97 5.494 -47.187 20.003 1.00 0.00 C ATOM 1548 C HIS A 97 6.986 -47.461 20.061 1.00 0.00 C ATOM 1549 O HIS A 97 7.677 -47.008 20.968 1.00 0.00 O ATOM 1550 CB HIS A 97 5.174 -45.732 20.402 1.00 0.00 C ATOM 1551 CG HIS A 97 5.063 -45.474 21.892 1.00 0.00 C ATOM 1552 ND1 HIS A 97 6.097 -44.984 22.662 1.00 0.00 N ATOM 1553 CD2 HIS A 97 4.012 -45.634 22.745 1.00 0.00 C ATOM 1554 CE1 HIS A 97 5.684 -44.858 23.914 1.00 0.00 C ATOM 1555 NE2 HIS A 97 4.433 -45.243 23.986 1.00 0.00 N ATOM 0 H HIS A 97 5.090 -48.128 21.826 1.00 0.00 H new ATOM 0 HA HIS A 97 5.155 -47.317 18.975 1.00 0.00 H new ATOM 0 HB2 HIS A 97 5.950 -45.083 19.995 1.00 0.00 H new ATOM 0 HB3 HIS A 97 4.235 -45.442 19.930 1.00 0.00 H new ATOM 0 HD2 HIS A 97 3.029 -46.001 22.488 1.00 0.00 H new ATOM 0 HE1 HIS A 97 6.280 -44.497 24.740 1.00 0.00 H new ATOM 0 HE2 HIS A 97 3.864 -45.250 24.833 1.00 0.00 H new ATOM 1563 N HIS A 98 7.462 -48.265 19.117 1.00 0.00 N ATOM 1564 CA HIS A 98 8.855 -48.651 19.096 1.00 0.00 C ATOM 1565 C HIS A 98 9.625 -47.923 17.996 1.00 0.00 C ATOM 1566 O HIS A 98 10.640 -47.300 18.263 1.00 0.00 O ATOM 1567 CB HIS A 98 8.971 -50.164 18.915 1.00 0.00 C ATOM 1568 CG HIS A 98 10.330 -50.708 19.093 1.00 0.00 C ATOM 1569 ND1 HIS A 98 10.800 -51.148 20.310 1.00 0.00 N ATOM 1570 CD2 HIS A 98 11.337 -50.903 18.215 1.00 0.00 C ATOM 1571 CE1 HIS A 98 12.031 -51.583 20.168 1.00 0.00 C ATOM 1572 NE2 HIS A 98 12.378 -51.447 18.909 1.00 0.00 N ATOM 0 H HIS A 98 6.900 -48.658 18.361 1.00 0.00 H new ATOM 0 HA HIS A 98 9.299 -48.366 20.050 1.00 0.00 H new ATOM 0 HB2 HIS A 98 8.304 -50.652 19.625 1.00 0.00 H new ATOM 0 HB3 HIS A 98 8.619 -50.424 17.917 1.00 0.00 H new ATOM 0 HD2 HIS A 98 11.321 -50.672 17.160 1.00 0.00 H new ATOM 0 HE1 HIS A 98 12.653 -51.985 20.954 1.00 0.00 H new ATOM 0 HE2 HIS A 98 13.281 -51.707 18.513 1.00 0.00 H new ATOM 1580 N HIS A 99 9.124 -48.015 16.774 1.00 0.00 N ATOM 1581 CA HIS A 99 9.788 -47.402 15.614 1.00 0.00 C ATOM 1582 C HIS A 99 9.621 -45.878 15.597 1.00 0.00 C ATOM 1583 O HIS A 99 10.589 -45.135 15.755 1.00 0.00 O ATOM 1584 CB HIS A 99 9.255 -48.010 14.310 1.00 0.00 C ATOM 1585 CG HIS A 99 9.901 -47.469 13.063 1.00 0.00 C ATOM 1586 ND1 HIS A 99 9.303 -46.536 12.240 1.00 0.00 N ATOM 1587 CD2 HIS A 99 11.084 -47.755 12.499 1.00 0.00 C ATOM 1588 CE1 HIS A 99 10.094 -46.274 11.229 1.00 0.00 C ATOM 1589 NE2 HIS A 99 11.183 -46.992 11.350 1.00 0.00 N ATOM 0 H HIS A 99 8.259 -48.507 16.551 1.00 0.00 H new ATOM 0 HA HIS A 99 10.854 -47.614 15.699 1.00 0.00 H new ATOM 0 HB2 HIS A 99 9.400 -49.090 14.341 1.00 0.00 H new ATOM 0 HB3 HIS A 99 8.181 -47.834 14.254 1.00 0.00 H new ATOM 0 HD2 HIS A 99 11.821 -48.451 12.872 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.883 -45.581 10.428 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.973 -46.989 10.704 1.00 0.00 H new ATOM 1597 N HIS A 100 8.361 -45.438 15.404 1.00 0.00 N ATOM 1598 CA HIS A 100 8.006 -44.013 15.333 1.00 0.00 C ATOM 1599 C HIS A 100 8.586 -43.360 14.071 1.00 0.00 C ATOM 1600 O HIS A 100 7.856 -42.961 13.175 1.00 0.00 O ATOM 1601 CB HIS A 100 8.461 -43.249 16.598 1.00 0.00 C ATOM 1602 CG HIS A 100 7.926 -41.853 16.688 1.00 0.00 C ATOM 1603 ND1 HIS A 100 6.703 -41.544 17.261 1.00 0.00 N ATOM 1604 CD2 HIS A 100 8.447 -40.672 16.279 1.00 0.00 C ATOM 1605 CE1 HIS A 100 6.500 -40.230 17.197 1.00 0.00 C ATOM 1606 NE2 HIS A 100 7.540 -39.676 16.609 1.00 0.00 N ATOM 0 H HIS A 100 7.563 -46.064 15.293 1.00 0.00 H new ATOM 0 HA HIS A 100 6.919 -43.954 15.281 1.00 0.00 H new ATOM 0 HB2 HIS A 100 8.146 -43.806 17.480 1.00 0.00 H new ATOM 0 HB3 HIS A 100 9.550 -43.212 16.616 1.00 0.00 H new ATOM 0 HD2 HIS A 100 9.397 -40.531 15.785 1.00 0.00 H new ATOM 0 HE1 HIS A 100 5.630 -39.707 17.565 1.00 0.00 H new ATOM 0 HE2 HIS A 100 7.659 -38.680 16.427 1.00 0.00 H new ATOM 1614 N HIS A 101 9.912 -43.247 14.016 1.00 0.00 N ATOM 1615 CA HIS A 101 10.593 -42.639 12.860 1.00 0.00 C ATOM 1616 C HIS A 101 12.030 -43.127 12.769 1.00 0.00 C ATOM 1617 O HIS A 101 12.360 -43.851 11.807 1.00 0.00 O ATOM 1618 CB HIS A 101 10.567 -41.093 12.931 1.00 0.00 C ATOM 1619 CG HIS A 101 11.108 -40.414 11.704 1.00 0.00 C ATOM 1620 ND1 HIS A 101 10.349 -40.202 10.578 1.00 0.00 N ATOM 1621 CD2 HIS A 101 12.334 -39.905 11.429 1.00 0.00 C ATOM 1622 CE1 HIS A 101 11.076 -39.585 9.666 1.00 0.00 C ATOM 1623 NE2 HIS A 101 12.275 -39.396 10.152 1.00 0.00 N ATOM 1624 OXT HIS A 101 12.822 -42.809 13.680 1.00 0.00 O ATOM 0 H HIS A 101 10.540 -43.566 14.754 1.00 0.00 H new ATOM 0 HA HIS A 101 10.052 -42.947 11.965 1.00 0.00 H new ATOM 0 HB2 HIS A 101 9.540 -40.764 13.092 1.00 0.00 H new ATOM 0 HB3 HIS A 101 11.145 -40.770 13.797 1.00 0.00 H new ATOM 0 HD2 HIS A 101 13.192 -39.900 12.086 1.00 0.00 H new ATOM 0 HE1 HIS A 101 10.738 -39.287 8.685 1.00 0.00 H new ATOM 0 HE2 HIS A 101 13.046 -38.942 9.661 1.00 0.00 H new TER 1632 HIS A 101