USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 898 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 90 SER OG : rot 180:sc= 0.0144 USER MOD Set 1.2: A 116 CYS SG : rot 138:sc= -10.6! USER MOD Single : A 4 TYR OH : rot 180:sc= -0.106 USER MOD Single : A 5 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0431) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-2) USER MOD Single : A 16 THR OG1 : rot -106:sc= 0.0721 USER MOD Single : A 17 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0.607 K(o=0.61,f=0) USER MOD Single : A 25 THR OG1 : rot -67:sc= 0.468 USER MOD Single : A 26 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0153) USER MOD Single : A 28 GLN : amide:sc= -1.81! K(o=-1.8!,f=0) USER MOD Single : A 31 SER OG : rot -78:sc= 0.0328 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.0237 K(o=-0.024,f=-1.7) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot -55:sc= 0.0303 USER MOD Single : A 59 THR OG1 : rot 37:sc= 0.0413 USER MOD Single : A 61 HIS : no HE2:sc= -0.916 K(o=-0.92,f=-2.3!) USER MOD Single : A 62 TYR OH : rot -148:sc= -0.514 USER MOD Single : A 64 THR OG1 : rot 103:sc= 0.578 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -23:sc= 1.1 USER MOD Single : A 84 SER OG : rot -104:sc= 0.0791 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot -100:sc= 0.0682 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0.208 X(o=0.21,f=-0.035) USER MOD Single : A 111 ASN : amide:sc= 0 K(o=0,f=1.2) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -150:sc= 0.346 (180deg=-0.0257) USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 4 -8.171 -19.504 -13.129 1.00 0.00 N ATOM 2 CA TYR A 4 -8.695 -18.131 -13.109 1.00 0.00 C ATOM 3 C TYR A 4 -8.085 -17.424 -11.901 1.00 0.00 C ATOM 4 O TYR A 4 -8.281 -17.827 -10.755 1.00 0.00 O ATOM 5 CB TYR A 4 -10.226 -18.148 -13.056 1.00 0.00 C ATOM 6 CG TYR A 4 -10.860 -16.905 -13.662 1.00 0.00 C ATOM 7 CD1 TYR A 4 -10.963 -15.754 -12.945 1.00 0.00 C ATOM 8 CD2 TYR A 4 -11.348 -16.951 -14.934 1.00 0.00 C ATOM 9 CE1 TYR A 4 -11.557 -14.661 -13.490 1.00 0.00 C ATOM 10 CE2 TYR A 4 -11.937 -15.855 -15.481 1.00 0.00 C ATOM 11 CZ TYR A 4 -12.043 -14.710 -14.759 1.00 0.00 C ATOM 12 OH TYR A 4 -12.631 -13.606 -15.316 1.00 0.00 O ATOM 0 HA TYR A 4 -8.423 -17.592 -14.017 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -10.592 -19.029 -13.584 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -10.546 -18.242 -12.018 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -10.571 -15.709 -11.940 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -11.266 -17.861 -15.509 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -11.644 -13.751 -12.914 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -12.321 -15.895 -16.490 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.921 -13.815 -16.228 1.00 0.00 H new ATOM 22 N LYS A 5 -7.359 -16.343 -12.160 1.00 0.00 N ATOM 23 CA LYS A 5 -6.906 -15.479 -11.072 1.00 0.00 C ATOM 24 C LYS A 5 -7.985 -14.467 -10.684 1.00 0.00 C ATOM 25 O LYS A 5 -8.658 -13.880 -11.534 1.00 0.00 O ATOM 26 CB LYS A 5 -5.664 -14.730 -11.565 1.00 0.00 C ATOM 27 CG LYS A 5 -4.430 -15.630 -11.682 1.00 0.00 C ATOM 28 CD LYS A 5 -3.210 -14.832 -12.155 1.00 0.00 C ATOM 29 CE LYS A 5 -1.950 -15.696 -12.260 1.00 0.00 C ATOM 30 NZ LYS A 5 -2.075 -16.703 -13.328 1.00 0.00 N ATOM 0 H LYS A 5 -7.075 -16.046 -13.094 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.685 -16.084 -10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.876 -14.286 -12.537 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -5.445 -13.910 -10.881 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.217 -16.088 -10.716 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.632 -16.441 -12.382 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -3.425 -14.388 -13.127 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.027 -14.010 -11.463 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -1.087 -15.060 -12.457 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.769 -16.194 -11.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.165 -17.192 -13.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.807 -17.395 -13.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.341 -16.234 -14.218 1.00 0.00 H new ATOM 44 N THR A 6 -8.087 -14.216 -9.384 1.00 0.00 N ATOM 45 CA THR A 6 -8.868 -13.063 -8.913 1.00 0.00 C ATOM 46 C THR A 6 -7.832 -12.006 -8.493 1.00 0.00 C ATOM 47 O THR A 6 -6.792 -12.349 -7.924 1.00 0.00 O ATOM 48 CB THR A 6 -9.701 -13.602 -7.735 1.00 0.00 C ATOM 49 OG1 THR A 6 -10.598 -14.596 -8.215 1.00 0.00 O ATOM 50 CG2 THR A 6 -10.526 -12.536 -7.021 1.00 0.00 C ATOM 0 H THR A 6 -7.654 -14.775 -8.649 1.00 0.00 H new ATOM 0 HA THR A 6 -9.541 -12.609 -9.641 1.00 0.00 H new ATOM 0 HB THR A 6 -8.985 -13.999 -7.015 1.00 0.00 H new ATOM 0 HG1 THR A 6 -11.130 -14.944 -7.469 1.00 0.00 H new ATOM 0 HG21 THR A 6 -11.084 -12.994 -6.204 1.00 0.00 H new ATOM 0 HG22 THR A 6 -9.862 -11.769 -6.622 1.00 0.00 H new ATOM 0 HG23 THR A 6 -11.222 -12.082 -7.726 1.00 0.00 H new ATOM 58 N GLY A 7 -8.084 -10.726 -8.775 1.00 0.00 N ATOM 59 CA GLY A 7 -7.085 -9.705 -8.415 1.00 0.00 C ATOM 60 C GLY A 7 -7.599 -8.445 -7.735 1.00 0.00 C ATOM 61 O GLY A 7 -8.629 -8.400 -7.063 1.00 0.00 O ATOM 0 H GLY A 7 -8.928 -10.377 -9.230 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.349 -10.168 -7.758 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.560 -9.410 -9.323 1.00 0.00 H new ATOM 65 N LEU A 8 -6.762 -7.426 -7.902 1.00 0.00 N ATOM 66 CA LEU A 8 -6.953 -6.133 -7.246 1.00 0.00 C ATOM 67 C LEU A 8 -6.735 -5.004 -8.257 1.00 0.00 C ATOM 68 O LEU A 8 -5.807 -5.059 -9.064 1.00 0.00 O ATOM 69 CB LEU A 8 -5.896 -6.024 -6.129 1.00 0.00 C ATOM 70 CG LEU A 8 -6.460 -5.519 -4.801 1.00 0.00 C ATOM 71 CD1 LEU A 8 -5.302 -5.290 -3.830 1.00 0.00 C ATOM 72 CD2 LEU A 8 -7.278 -4.243 -4.988 1.00 0.00 C ATOM 0 H LEU A 8 -5.933 -7.471 -8.494 1.00 0.00 H new ATOM 0 HA LEU A 8 -7.962 -6.053 -6.841 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.442 -7.003 -5.973 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.102 -5.353 -6.456 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.137 -6.270 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.691 -4.929 -2.878 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.769 -6.227 -3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.619 -4.550 -4.246 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.663 -3.913 -4.023 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.645 -3.464 -5.412 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.111 -4.440 -5.663 1.00 0.00 H new ATOM 84 N LEU A 9 -7.522 -3.935 -8.171 1.00 0.00 N ATOM 85 CA LEU A 9 -7.164 -2.691 -8.815 1.00 0.00 C ATOM 86 C LEU A 9 -7.156 -1.594 -7.734 1.00 0.00 C ATOM 87 O LEU A 9 -8.075 -1.451 -6.927 1.00 0.00 O ATOM 88 CB LEU A 9 -8.180 -2.483 -9.934 1.00 0.00 C ATOM 89 CG LEU A 9 -8.167 -1.053 -10.449 1.00 0.00 C ATOM 90 CD1 LEU A 9 -6.817 -0.734 -11.079 1.00 0.00 C ATOM 91 CD2 LEU A 9 -9.287 -0.970 -11.458 1.00 0.00 C ATOM 0 H LEU A 9 -8.406 -3.912 -7.663 1.00 0.00 H new ATOM 0 HA LEU A 9 -6.172 -2.678 -9.267 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -7.962 -3.167 -10.754 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.177 -2.729 -9.570 1.00 0.00 H new ATOM 0 HG LEU A 9 -8.313 -0.326 -9.650 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -6.820 0.293 -11.444 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -6.031 -0.852 -10.334 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -6.634 -1.414 -11.911 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.333 0.039 -11.869 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -9.105 -1.682 -12.263 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.233 -1.207 -10.971 1.00 0.00 H new ATOM 103 N LEU A 10 -6.089 -0.811 -7.766 1.00 0.00 N ATOM 104 CA LEU A 10 -5.952 0.375 -6.902 1.00 0.00 C ATOM 105 C LEU A 10 -5.797 1.625 -7.773 1.00 0.00 C ATOM 106 O LEU A 10 -4.915 1.699 -8.624 1.00 0.00 O ATOM 107 CB LEU A 10 -4.775 0.257 -5.925 1.00 0.00 C ATOM 108 CG LEU A 10 -5.189 -0.447 -4.631 1.00 0.00 C ATOM 109 CD1 LEU A 10 -4.267 -1.605 -4.274 1.00 0.00 C ATOM 110 CD2 LEU A 10 -5.202 0.584 -3.499 1.00 0.00 C ATOM 0 H LEU A 10 -5.293 -0.969 -8.384 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.856 0.451 -6.298 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.963 -0.296 -6.397 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.392 1.251 -5.693 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.181 -0.874 -4.778 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.607 -2.068 -3.348 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.282 -2.343 -5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.251 -1.234 -4.142 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.495 0.099 -2.568 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.206 1.013 -3.386 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.914 1.375 -3.736 1.00 0.00 H new ATOM 122 N ILE A 11 -6.719 2.572 -7.624 1.00 0.00 N ATOM 123 CA ILE A 11 -6.865 3.633 -8.640 1.00 0.00 C ATOM 124 C ILE A 11 -6.940 5.043 -8.047 1.00 0.00 C ATOM 125 O ILE A 11 -7.614 5.291 -7.047 1.00 0.00 O ATOM 126 CB ILE A 11 -8.079 3.256 -9.503 1.00 0.00 C ATOM 127 CG1 ILE A 11 -8.176 4.085 -10.786 1.00 0.00 C ATOM 128 CG2 ILE A 11 -9.405 3.289 -8.722 1.00 0.00 C ATOM 129 CD1 ILE A 11 -9.080 3.385 -11.805 1.00 0.00 C ATOM 0 H ILE A 11 -7.364 2.636 -6.836 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.971 3.685 -9.261 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.907 2.221 -9.799 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.572 5.075 -10.558 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.182 4.229 -11.210 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.225 3.014 -9.385 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.356 2.583 -7.893 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.574 4.294 -8.334 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -9.139 3.986 -12.712 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.667 2.405 -12.045 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -10.078 3.264 -11.384 1.00 0.00 H new ATOM 141 N HIS A 12 -6.278 5.981 -8.718 1.00 0.00 N ATOM 142 CA HIS A 12 -6.409 7.400 -8.364 1.00 0.00 C ATOM 143 C HIS A 12 -7.283 8.102 -9.428 1.00 0.00 C ATOM 144 O HIS A 12 -7.017 7.960 -10.622 1.00 0.00 O ATOM 145 CB HIS A 12 -5.003 8.008 -8.317 1.00 0.00 C ATOM 146 CG HIS A 12 -4.936 9.532 -8.291 1.00 0.00 C ATOM 147 ND1 HIS A 12 -5.661 10.362 -7.443 1.00 0.00 N ATOM 148 CD2 HIS A 12 -4.199 10.290 -9.216 1.00 0.00 C ATOM 149 CE1 HIS A 12 -5.272 11.576 -7.960 1.00 0.00 C ATOM 150 NE2 HIS A 12 -4.383 11.635 -8.995 1.00 0.00 N ATOM 0 H HIS A 12 -5.652 5.793 -9.501 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.886 7.525 -7.392 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.493 7.626 -7.433 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.446 7.654 -9.184 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -3.575 9.874 -9.993 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.672 12.489 -7.544 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -3.974 12.442 -9.467 1.00 0.00 H new ATOM 158 N PRO A 13 -8.317 8.865 -9.043 1.00 0.00 N ATOM 159 CA PRO A 13 -9.312 9.394 -9.994 1.00 0.00 C ATOM 160 C PRO A 13 -8.901 10.320 -11.150 1.00 0.00 C ATOM 161 O PRO A 13 -9.762 10.681 -11.950 1.00 0.00 O ATOM 162 CB PRO A 13 -10.171 10.237 -9.057 1.00 0.00 C ATOM 163 CG PRO A 13 -10.218 9.432 -7.768 1.00 0.00 C ATOM 164 CD PRO A 13 -8.801 8.880 -7.652 1.00 0.00 C ATOM 0 HA PRO A 13 -9.718 8.541 -10.537 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.734 11.223 -8.895 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.169 10.394 -9.465 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.479 10.056 -6.913 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.959 8.634 -7.818 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.177 9.509 -7.018 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.795 7.881 -7.215 1.00 0.00 H new ATOM 172 N ALA A 14 -7.686 10.856 -11.169 1.00 0.00 N ATOM 173 CA ALA A 14 -7.445 12.047 -12.010 1.00 0.00 C ATOM 174 C ALA A 14 -7.638 11.872 -13.520 1.00 0.00 C ATOM 175 O ALA A 14 -8.381 12.644 -14.128 1.00 0.00 O ATOM 176 CB ALA A 14 -6.041 12.582 -11.749 1.00 0.00 C ATOM 0 H ALA A 14 -6.881 10.514 -10.644 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.223 12.748 -11.708 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.865 13.460 -12.370 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -5.945 12.856 -10.698 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.308 11.813 -11.992 1.00 0.00 H new ATOM 182 N VAL A 15 -7.039 10.853 -14.129 1.00 0.00 N ATOM 183 CA VAL A 15 -7.417 10.506 -15.512 1.00 0.00 C ATOM 184 C VAL A 15 -8.593 9.501 -15.489 1.00 0.00 C ATOM 185 O VAL A 15 -9.395 9.451 -16.421 1.00 0.00 O ATOM 186 CB VAL A 15 -6.202 9.991 -16.312 1.00 0.00 C ATOM 187 CG1 VAL A 15 -6.593 9.521 -17.718 1.00 0.00 C ATOM 188 CG2 VAL A 15 -5.149 11.095 -16.470 1.00 0.00 C ATOM 0 H VAL A 15 -6.315 10.267 -13.713 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.756 11.402 -16.032 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.801 9.150 -15.747 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.706 9.167 -18.243 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.317 8.710 -17.642 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.034 10.351 -18.269 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.301 10.711 -17.037 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.586 11.941 -17.000 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.811 11.419 -15.486 1.00 0.00 H new ATOM 198 N THR A 16 -8.683 8.688 -14.435 1.00 0.00 N ATOM 199 CA THR A 16 -9.620 7.559 -14.403 1.00 0.00 C ATOM 200 C THR A 16 -11.086 7.921 -14.088 1.00 0.00 C ATOM 201 O THR A 16 -11.945 7.038 -14.118 1.00 0.00 O ATOM 202 CB THR A 16 -9.089 6.529 -13.397 1.00 0.00 C ATOM 203 OG1 THR A 16 -9.126 7.066 -12.085 1.00 0.00 O ATOM 204 CG2 THR A 16 -7.657 6.077 -13.714 1.00 0.00 C ATOM 0 H THR A 16 -8.119 8.789 -13.591 1.00 0.00 H new ATOM 0 HA THR A 16 -9.661 7.157 -15.415 1.00 0.00 H new ATOM 0 HB THR A 16 -9.737 5.656 -13.470 1.00 0.00 H new ATOM 0 HG1 THR A 16 -8.216 7.290 -11.798 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.332 5.349 -12.971 1.00 0.00 H new ATOM 0 HG22 THR A 16 -7.630 5.622 -14.704 1.00 0.00 H new ATOM 0 HG23 THR A 16 -6.990 6.939 -13.693 1.00 0.00 H new ATOM 212 N THR A 17 -11.419 9.198 -13.874 1.00 0.00 N ATOM 213 CA THR A 17 -12.841 9.595 -13.813 1.00 0.00 C ATOM 214 C THR A 17 -13.485 9.668 -15.223 1.00 0.00 C ATOM 215 O THR A 17 -14.694 9.866 -15.350 1.00 0.00 O ATOM 216 CB THR A 17 -12.905 10.947 -13.081 1.00 0.00 C ATOM 217 OG1 THR A 17 -12.463 10.769 -11.743 1.00 0.00 O ATOM 218 CG2 THR A 17 -14.314 11.538 -13.030 1.00 0.00 C ATOM 0 H THR A 17 -10.751 9.958 -13.743 1.00 0.00 H new ATOM 0 HA THR A 17 -13.418 8.845 -13.272 1.00 0.00 H new ATOM 0 HB THR A 17 -12.270 11.636 -13.639 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.484 10.724 -11.725 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.290 12.491 -12.501 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.679 11.696 -14.045 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.979 10.850 -12.508 1.00 0.00 H new ATOM 226 N THR A 18 -12.719 9.363 -16.270 1.00 0.00 N ATOM 227 CA THR A 18 -13.311 9.036 -17.574 1.00 0.00 C ATOM 228 C THR A 18 -13.315 7.481 -17.628 1.00 0.00 C ATOM 229 O THR A 18 -12.557 6.846 -16.889 1.00 0.00 O ATOM 230 CB THR A 18 -12.416 9.738 -18.624 1.00 0.00 C ATOM 231 OG1 THR A 18 -12.185 11.085 -18.222 1.00 0.00 O ATOM 232 CG2 THR A 18 -13.025 9.810 -20.025 1.00 0.00 C ATOM 0 H THR A 18 -11.700 9.335 -16.246 1.00 0.00 H new ATOM 0 HA THR A 18 -14.331 9.373 -17.756 1.00 0.00 H new ATOM 0 HB THR A 18 -11.508 9.137 -18.674 1.00 0.00 H new ATOM 0 HG1 THR A 18 -11.617 11.531 -18.884 1.00 0.00 H new ATOM 0 HG21 THR A 18 -12.333 10.317 -20.697 1.00 0.00 H new ATOM 0 HG22 THR A 18 -13.214 8.801 -20.392 1.00 0.00 H new ATOM 0 HG23 THR A 18 -13.963 10.364 -19.986 1.00 0.00 H new ATOM 240 N PRO A 19 -13.978 6.812 -18.579 1.00 0.00 N ATOM 241 CA PRO A 19 -13.812 5.351 -18.728 1.00 0.00 C ATOM 242 C PRO A 19 -12.559 4.769 -19.400 1.00 0.00 C ATOM 243 O PRO A 19 -12.507 3.556 -19.592 1.00 0.00 O ATOM 244 CB PRO A 19 -15.066 4.962 -19.522 1.00 0.00 C ATOM 245 CG PRO A 19 -16.092 6.037 -19.175 1.00 0.00 C ATOM 246 CD PRO A 19 -15.254 7.309 -19.109 1.00 0.00 C ATOM 0 HA PRO A 19 -13.679 4.935 -17.730 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -14.865 4.937 -20.593 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -15.421 3.970 -19.241 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -16.873 6.108 -19.932 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -16.586 5.831 -18.226 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -15.136 7.770 -20.090 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -15.702 8.058 -18.456 1.00 0.00 H new ATOM 254 N GLU A 20 -11.574 5.556 -19.819 1.00 0.00 N ATOM 255 CA GLU A 20 -10.561 5.000 -20.734 1.00 0.00 C ATOM 256 C GLU A 20 -9.543 4.049 -20.087 1.00 0.00 C ATOM 257 O GLU A 20 -9.377 2.921 -20.554 1.00 0.00 O ATOM 258 CB GLU A 20 -9.838 6.197 -21.359 1.00 0.00 C ATOM 259 CG GLU A 20 -8.947 5.807 -22.543 1.00 0.00 C ATOM 260 CD GLU A 20 -8.251 7.028 -23.132 1.00 0.00 C ATOM 261 OE1 GLU A 20 -7.144 7.374 -22.668 1.00 0.00 O ATOM 262 OE2 GLU A 20 -8.811 7.647 -24.065 1.00 0.00 O ATOM 0 H GLU A 20 -11.449 6.535 -19.561 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.077 4.378 -21.465 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -10.576 6.927 -21.692 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.229 6.684 -20.598 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -8.202 5.081 -22.217 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -9.549 5.322 -23.311 1.00 0.00 H new ATOM 269 N LEU A 21 -8.904 4.450 -18.989 1.00 0.00 N ATOM 270 CA LEU A 21 -8.011 3.532 -18.260 1.00 0.00 C ATOM 271 C LEU A 21 -8.775 2.402 -17.557 1.00 0.00 C ATOM 272 O LEU A 21 -8.252 1.296 -17.409 1.00 0.00 O ATOM 273 CB LEU A 21 -7.184 4.325 -17.236 1.00 0.00 C ATOM 274 CG LEU A 21 -6.180 5.308 -17.860 1.00 0.00 C ATOM 275 CD1 LEU A 21 -5.557 6.177 -16.764 1.00 0.00 C ATOM 276 CD2 LEU A 21 -5.066 4.573 -18.609 1.00 0.00 C ATOM 0 H LEU A 21 -8.981 5.384 -18.586 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.353 3.064 -18.992 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -7.863 4.880 -16.589 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.642 3.623 -16.602 1.00 0.00 H new ATOM 0 HG LEU A 21 -6.723 5.930 -18.572 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.846 6.872 -17.211 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.341 6.737 -16.254 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.040 5.541 -16.045 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.375 5.299 -19.037 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.529 3.925 -17.917 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.500 3.971 -19.407 1.00 0.00 H new ATOM 288 N VAL A 22 -10.005 2.669 -17.114 1.00 0.00 N ATOM 289 CA VAL A 22 -10.812 1.622 -16.456 1.00 0.00 C ATOM 290 C VAL A 22 -11.207 0.526 -17.465 1.00 0.00 C ATOM 291 O VAL A 22 -11.038 -0.660 -17.186 1.00 0.00 O ATOM 292 CB VAL A 22 -12.045 2.239 -15.768 1.00 0.00 C ATOM 293 CG1 VAL A 22 -12.840 1.175 -15.002 1.00 0.00 C ATOM 294 CG2 VAL A 22 -11.657 3.348 -14.780 1.00 0.00 C ATOM 0 H VAL A 22 -10.462 3.577 -17.193 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.208 1.150 -15.681 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.656 2.664 -16.564 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.704 1.639 -14.527 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.177 0.404 -15.695 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.204 0.725 -14.239 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.557 3.755 -14.318 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.007 2.936 -14.008 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -11.132 4.141 -15.312 1.00 0.00 H new ATOM 304 N GLU A 23 -11.708 0.901 -18.642 1.00 0.00 N ATOM 305 CA GLU A 23 -12.013 -0.102 -19.681 1.00 0.00 C ATOM 306 C GLU A 23 -10.765 -0.827 -20.208 1.00 0.00 C ATOM 307 O GLU A 23 -10.839 -2.002 -20.556 1.00 0.00 O ATOM 308 CB GLU A 23 -12.723 0.574 -20.861 1.00 0.00 C ATOM 309 CG GLU A 23 -14.148 1.045 -20.539 1.00 0.00 C ATOM 310 CD GLU A 23 -15.096 -0.117 -20.266 1.00 0.00 C ATOM 311 OE1 GLU A 23 -15.563 -0.756 -21.235 1.00 0.00 O ATOM 312 OE2 GLU A 23 -15.381 -0.398 -19.083 1.00 0.00 O ATOM 0 H GLU A 23 -11.910 1.866 -18.903 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.653 -0.848 -19.211 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -12.132 1.430 -21.186 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -12.761 -0.123 -21.698 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.123 1.702 -19.670 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -14.530 1.634 -21.373 1.00 0.00 H new ATOM 319 N ASN A 24 -9.628 -0.143 -20.269 1.00 0.00 N ATOM 320 CA ASN A 24 -8.360 -0.775 -20.666 1.00 0.00 C ATOM 321 C ASN A 24 -7.872 -1.851 -19.687 1.00 0.00 C ATOM 322 O ASN A 24 -7.533 -2.955 -20.116 1.00 0.00 O ATOM 323 CB ASN A 24 -7.320 0.347 -20.749 1.00 0.00 C ATOM 324 CG ASN A 24 -7.001 0.762 -22.184 1.00 0.00 C ATOM 325 OD1 ASN A 24 -6.180 0.144 -22.860 1.00 0.00 O ATOM 326 ND2 ASN A 24 -7.639 1.810 -22.671 1.00 0.00 N ATOM 0 H ASN A 24 -9.551 0.850 -20.050 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.510 -1.288 -21.616 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.685 1.214 -20.199 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.403 0.021 -20.259 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.455 2.121 -23.625 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.316 2.308 -22.094 1.00 0.00 H new ATOM 333 N THR A 25 -7.820 -1.556 -18.386 1.00 0.00 N ATOM 334 CA THR A 25 -7.403 -2.591 -17.416 1.00 0.00 C ATOM 335 C THR A 25 -8.400 -3.763 -17.385 1.00 0.00 C ATOM 336 O THR A 25 -8.007 -4.934 -17.397 1.00 0.00 O ATOM 337 CB THR A 25 -7.113 -1.977 -16.033 1.00 0.00 C ATOM 338 OG1 THR A 25 -6.445 -2.943 -15.233 1.00 0.00 O ATOM 339 CG2 THR A 25 -8.342 -1.483 -15.264 1.00 0.00 C ATOM 0 H THR A 25 -8.050 -0.648 -17.983 1.00 0.00 H new ATOM 0 HA THR A 25 -6.458 -3.020 -17.749 1.00 0.00 H new ATOM 0 HB THR A 25 -6.505 -1.094 -16.229 1.00 0.00 H new ATOM 0 HG1 THR A 25 -7.055 -3.685 -15.039 1.00 0.00 H new ATOM 0 HG21 THR A 25 -8.029 -1.070 -14.305 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.848 -0.711 -15.844 1.00 0.00 H new ATOM 0 HG23 THR A 25 -9.024 -2.316 -15.095 1.00 0.00 H new ATOM 347 N LYS A 26 -9.694 -3.446 -17.423 1.00 0.00 N ATOM 348 CA LYS A 26 -10.716 -4.486 -17.566 1.00 0.00 C ATOM 349 C LYS A 26 -10.629 -5.219 -18.919 1.00 0.00 C ATOM 350 O LYS A 26 -10.982 -6.394 -18.978 1.00 0.00 O ATOM 351 CB LYS A 26 -12.113 -3.873 -17.378 1.00 0.00 C ATOM 352 CG LYS A 26 -12.336 -3.259 -15.986 1.00 0.00 C ATOM 353 CD LYS A 26 -12.216 -4.255 -14.824 1.00 0.00 C ATOM 354 CE LYS A 26 -13.237 -5.397 -14.865 1.00 0.00 C ATOM 355 NZ LYS A 26 -14.613 -4.895 -14.725 1.00 0.00 N ATOM 0 H LYS A 26 -10.057 -2.495 -17.358 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.534 -5.231 -16.792 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.267 -3.103 -18.134 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.864 -4.644 -17.550 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.613 -2.457 -15.837 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.326 -2.805 -15.958 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -11.212 -4.680 -14.827 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -12.330 -3.715 -13.884 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -13.140 -5.939 -15.806 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -13.024 -6.106 -14.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -15.272 -5.698 -14.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -14.689 -4.327 -13.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.853 -4.305 -15.547 1.00 0.00 H new ATOM 369 N ALA A 27 -10.176 -4.578 -20.004 1.00 0.00 N ATOM 370 CA ALA A 27 -10.047 -5.292 -21.287 1.00 0.00 C ATOM 371 C ALA A 27 -8.932 -6.344 -21.292 1.00 0.00 C ATOM 372 O ALA A 27 -9.141 -7.472 -21.743 1.00 0.00 O ATOM 373 CB ALA A 27 -9.847 -4.290 -22.428 1.00 0.00 C ATOM 0 H ALA A 27 -9.899 -3.596 -20.025 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.978 -5.839 -21.435 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -9.753 -4.827 -23.372 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.704 -3.618 -22.477 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.942 -3.710 -22.249 1.00 0.00 H new ATOM 379 N GLN A 28 -7.757 -5.986 -20.779 1.00 0.00 N ATOM 380 CA GLN A 28 -6.672 -6.968 -20.610 1.00 0.00 C ATOM 381 C GLN A 28 -7.115 -8.160 -19.754 1.00 0.00 C ATOM 382 O GLN A 28 -6.995 -9.311 -20.173 1.00 0.00 O ATOM 383 CB GLN A 28 -5.497 -6.322 -19.876 1.00 0.00 C ATOM 384 CG GLN A 28 -4.737 -5.254 -20.670 1.00 0.00 C ATOM 385 CD GLN A 28 -3.740 -4.567 -19.744 1.00 0.00 C ATOM 386 OE1 GLN A 28 -2.523 -4.659 -19.909 1.00 0.00 O ATOM 387 NE2 GLN A 28 -4.260 -3.902 -18.726 1.00 0.00 N ATOM 0 H GLN A 28 -7.527 -5.040 -20.475 1.00 0.00 H new ATOM 0 HA GLN A 28 -6.394 -7.305 -21.609 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.868 -5.871 -18.956 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.795 -7.105 -19.587 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -4.217 -5.710 -21.513 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.433 -4.524 -21.082 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.273 -3.845 -18.618 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.648 -3.446 -18.049 1.00 0.00 H new ATOM 396 N ALA A 29 -7.634 -7.876 -18.557 1.00 0.00 N ATOM 397 CA ALA A 29 -8.151 -8.960 -17.701 1.00 0.00 C ATOM 398 C ALA A 29 -9.263 -9.778 -18.383 1.00 0.00 C ATOM 399 O ALA A 29 -9.319 -10.998 -18.232 1.00 0.00 O ATOM 400 CB ALA A 29 -8.634 -8.358 -16.381 1.00 0.00 C ATOM 0 H ALA A 29 -7.709 -6.938 -18.163 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.341 -9.664 -17.512 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.019 -9.150 -15.739 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.803 -7.859 -15.883 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.425 -7.635 -16.579 1.00 0.00 H new ATOM 406 N ALA A 30 -10.161 -9.114 -19.113 1.00 0.00 N ATOM 407 CA ALA A 30 -11.369 -9.793 -19.619 1.00 0.00 C ATOM 408 C ALA A 30 -11.018 -10.806 -20.720 1.00 0.00 C ATOM 409 O ALA A 30 -11.474 -11.949 -20.665 1.00 0.00 O ATOM 410 CB ALA A 30 -12.379 -8.766 -20.137 1.00 0.00 C ATOM 0 H ALA A 30 -10.084 -8.129 -19.366 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.819 -10.342 -18.792 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.265 -9.282 -20.507 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.662 -8.094 -19.327 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.930 -8.190 -20.946 1.00 0.00 H new ATOM 416 N SER A 31 -10.247 -10.406 -21.735 1.00 0.00 N ATOM 417 CA SER A 31 -10.058 -11.277 -22.908 1.00 0.00 C ATOM 418 C SER A 31 -9.137 -12.471 -22.585 1.00 0.00 C ATOM 419 O SER A 31 -9.207 -13.514 -23.237 1.00 0.00 O ATOM 420 CB SER A 31 -9.483 -10.448 -24.061 1.00 0.00 C ATOM 421 OG SER A 31 -8.216 -9.903 -23.713 1.00 0.00 O ATOM 0 H SER A 31 -9.755 -9.513 -21.774 1.00 0.00 H new ATOM 0 HA SER A 31 -11.025 -11.687 -23.198 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.383 -11.073 -24.949 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.172 -9.643 -24.314 1.00 0.00 H new ATOM 0 HG SER A 31 -8.343 -9.122 -23.134 1.00 0.00 H new ATOM 427 N LYS A 32 -8.313 -12.342 -21.542 1.00 0.00 N ATOM 428 CA LYS A 32 -7.551 -13.471 -21.013 1.00 0.00 C ATOM 429 C LYS A 32 -8.431 -14.229 -20.009 1.00 0.00 C ATOM 430 O LYS A 32 -9.418 -14.863 -20.383 1.00 0.00 O ATOM 431 CB LYS A 32 -6.244 -12.911 -20.428 1.00 0.00 C ATOM 432 CG LYS A 32 -5.328 -12.285 -21.487 1.00 0.00 C ATOM 433 CD LYS A 32 -4.041 -11.742 -20.861 1.00 0.00 C ATOM 434 CE LYS A 32 -3.143 -11.089 -21.915 1.00 0.00 C ATOM 435 NZ LYS A 32 -1.917 -10.572 -21.290 1.00 0.00 N ATOM 0 H LYS A 32 -8.158 -11.464 -21.047 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.274 -14.200 -21.775 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.483 -12.161 -19.674 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.707 -13.713 -19.921 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.081 -13.030 -22.243 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.856 -11.478 -21.996 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.289 -11.013 -20.089 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.501 -12.553 -20.372 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.888 -11.816 -22.686 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.679 -10.277 -22.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.316 -10.131 -22.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.166 -9.864 -20.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.400 -11.355 -20.841 1.00 0.00 H new ATOM 449 N LYS A 33 -8.045 -14.198 -18.741 1.00 0.00 N ATOM 450 CA LYS A 33 -8.662 -15.086 -17.735 1.00 0.00 C ATOM 451 C LYS A 33 -8.529 -14.581 -16.288 1.00 0.00 C ATOM 452 O LYS A 33 -8.752 -15.311 -15.322 1.00 0.00 O ATOM 453 CB LYS A 33 -7.953 -16.438 -17.877 1.00 0.00 C ATOM 454 CG LYS A 33 -8.804 -17.655 -17.505 1.00 0.00 C ATOM 455 CD LYS A 33 -10.047 -17.738 -18.394 1.00 0.00 C ATOM 456 CE LYS A 33 -10.687 -19.126 -18.334 1.00 0.00 C ATOM 457 NZ LYS A 33 -11.875 -19.176 -19.199 1.00 0.00 N ATOM 0 H LYS A 33 -7.319 -13.581 -18.377 1.00 0.00 H new ATOM 0 HA LYS A 33 -9.735 -15.139 -17.920 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.617 -16.549 -18.908 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.061 -16.432 -17.250 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.213 -18.565 -17.612 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.103 -17.590 -16.459 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.772 -16.988 -18.078 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.775 -17.506 -19.424 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.966 -19.880 -18.650 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.966 -19.362 -17.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.301 -20.124 -19.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.567 -18.468 -18.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.599 -18.971 -20.180 1.00 0.00 H new ATOM 471 N VAL A 34 -8.223 -13.303 -16.155 1.00 0.00 N ATOM 472 CA VAL A 34 -8.258 -12.615 -14.851 1.00 0.00 C ATOM 473 C VAL A 34 -9.531 -11.758 -14.704 1.00 0.00 C ATOM 474 O VAL A 34 -10.062 -11.227 -15.679 1.00 0.00 O ATOM 475 CB VAL A 34 -7.009 -11.712 -14.711 1.00 0.00 C ATOM 476 CG1 VAL A 34 -6.812 -11.266 -13.259 1.00 0.00 C ATOM 477 CG2 VAL A 34 -5.705 -12.386 -15.158 1.00 0.00 C ATOM 0 H VAL A 34 -7.944 -12.706 -16.933 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.264 -13.371 -14.066 1.00 0.00 H new ATOM 0 HB VAL A 34 -7.208 -10.864 -15.367 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -5.927 -10.633 -13.190 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.686 -10.705 -12.929 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.682 -12.142 -12.624 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -4.874 -11.692 -15.031 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -5.530 -13.276 -14.554 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.783 -12.669 -16.208 1.00 0.00 H new ATOM 487 N LYS A 35 -9.971 -11.554 -13.463 1.00 0.00 N ATOM 488 CA LYS A 35 -10.974 -10.510 -13.177 1.00 0.00 C ATOM 489 C LYS A 35 -10.447 -9.638 -12.040 1.00 0.00 C ATOM 490 O LYS A 35 -9.965 -10.122 -11.015 1.00 0.00 O ATOM 491 CB LYS A 35 -12.325 -11.131 -12.817 1.00 0.00 C ATOM 492 CG LYS A 35 -13.509 -10.167 -12.662 1.00 0.00 C ATOM 493 CD LYS A 35 -14.789 -10.936 -12.325 1.00 0.00 C ATOM 494 CE LYS A 35 -15.974 -9.984 -12.154 1.00 0.00 C ATOM 495 NZ LYS A 35 -17.194 -10.741 -11.829 1.00 0.00 N ATOM 0 H LYS A 35 -9.660 -12.083 -12.648 1.00 0.00 H new ATOM 0 HA LYS A 35 -11.134 -9.898 -14.065 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.579 -11.861 -13.586 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.209 -11.680 -11.882 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.295 -9.443 -11.875 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -13.649 -9.603 -13.584 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -15.006 -11.653 -13.117 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.643 -11.508 -11.409 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.761 -9.266 -11.362 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -16.125 -9.413 -13.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.991 -10.083 -11.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.403 -11.409 -12.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.051 -11.267 -10.943 1.00 0.00 H new ATOM 509 N PHE A 36 -10.589 -8.336 -12.229 1.00 0.00 N ATOM 510 CA PHE A 36 -10.259 -7.375 -11.160 1.00 0.00 C ATOM 511 C PHE A 36 -11.514 -7.061 -10.338 1.00 0.00 C ATOM 512 O PHE A 36 -12.414 -6.330 -10.759 1.00 0.00 O ATOM 513 CB PHE A 36 -9.563 -6.091 -11.628 1.00 0.00 C ATOM 514 CG PHE A 36 -8.260 -6.309 -12.389 1.00 0.00 C ATOM 515 CD1 PHE A 36 -7.206 -6.938 -11.795 1.00 0.00 C ATOM 516 CD2 PHE A 36 -8.121 -5.817 -13.652 1.00 0.00 C ATOM 517 CE1 PHE A 36 -6.036 -7.092 -12.467 1.00 0.00 C ATOM 518 CE2 PHE A 36 -6.946 -5.967 -14.318 1.00 0.00 C ATOM 519 CZ PHE A 36 -5.909 -6.613 -13.731 1.00 0.00 C ATOM 0 H PHE A 36 -10.924 -7.914 -13.095 1.00 0.00 H new ATOM 0 HA PHE A 36 -9.514 -7.869 -10.536 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.250 -5.534 -12.265 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -9.359 -5.468 -10.758 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.302 -7.315 -10.787 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.947 -5.306 -14.125 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.205 -7.596 -11.995 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.838 -5.571 -15.317 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.982 -6.747 -14.269 1.00 0.00 H new ATOM 529 N VAL A 37 -11.588 -7.713 -9.187 1.00 0.00 N ATOM 530 CA VAL A 37 -12.822 -7.770 -8.387 1.00 0.00 C ATOM 531 C VAL A 37 -12.924 -6.720 -7.260 1.00 0.00 C ATOM 532 O VAL A 37 -14.007 -6.448 -6.739 1.00 0.00 O ATOM 533 CB VAL A 37 -12.888 -9.177 -7.763 1.00 0.00 C ATOM 534 CG1 VAL A 37 -13.006 -10.268 -8.831 1.00 0.00 C ATOM 535 CG2 VAL A 37 -11.749 -9.496 -6.786 1.00 0.00 C ATOM 0 H VAL A 37 -10.803 -8.218 -8.775 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.651 -7.549 -9.059 1.00 0.00 H new ATOM 0 HB VAL A 37 -13.799 -9.168 -7.164 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -13.050 -11.245 -8.350 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -13.913 -10.110 -9.414 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -12.139 -10.227 -9.490 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -11.876 -10.506 -6.396 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.793 -9.425 -7.306 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.767 -8.784 -5.961 1.00 0.00 H new ATOM 545 N ASP A 38 -11.779 -6.196 -6.848 1.00 0.00 N ATOM 546 CA ASP A 38 -11.668 -5.390 -5.618 1.00 0.00 C ATOM 547 C ASP A 38 -11.115 -4.010 -5.968 1.00 0.00 C ATOM 548 O ASP A 38 -10.069 -3.887 -6.607 1.00 0.00 O ATOM 549 CB ASP A 38 -10.882 -6.046 -4.466 1.00 0.00 C ATOM 550 CG ASP A 38 -11.797 -6.844 -3.540 1.00 0.00 C ATOM 551 OD1 ASP A 38 -12.418 -7.829 -3.993 1.00 0.00 O ATOM 552 OD2 ASP A 38 -11.900 -6.485 -2.347 1.00 0.00 O ATOM 0 H ASP A 38 -10.897 -6.311 -7.348 1.00 0.00 H new ATOM 0 HA ASP A 38 -12.678 -5.303 -5.218 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.116 -6.704 -4.877 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.366 -5.276 -3.893 1.00 0.00 H new ATOM 557 N GLN A 39 -11.876 -2.969 -5.644 1.00 0.00 N ATOM 558 CA GLN A 39 -11.473 -1.606 -6.033 1.00 0.00 C ATOM 559 C GLN A 39 -11.164 -0.794 -4.794 1.00 0.00 C ATOM 560 O GLN A 39 -11.985 -0.640 -3.893 1.00 0.00 O ATOM 561 CB GLN A 39 -12.574 -0.870 -6.812 1.00 0.00 C ATOM 562 CG GLN A 39 -12.249 0.599 -7.107 1.00 0.00 C ATOM 563 CD GLN A 39 -13.186 1.188 -8.156 1.00 0.00 C ATOM 564 OE1 GLN A 39 -14.289 1.642 -7.853 1.00 0.00 O ATOM 565 NE2 GLN A 39 -12.759 1.193 -9.406 1.00 0.00 N ATOM 0 H GLN A 39 -12.753 -3.030 -5.127 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.598 -1.707 -6.674 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.749 -1.390 -7.754 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.503 -0.920 -6.244 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.323 1.179 -6.187 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.219 0.681 -7.453 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.841 0.811 -9.633 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.347 1.579 -10.144 1.00 0.00 H new ATOM 574 N PHE A 40 -9.945 -0.267 -4.804 1.00 0.00 N ATOM 575 CA PHE A 40 -9.471 0.519 -3.659 1.00 0.00 C ATOM 576 C PHE A 40 -8.970 1.861 -4.197 1.00 0.00 C ATOM 577 O PHE A 40 -7.896 1.968 -4.787 1.00 0.00 O ATOM 578 CB PHE A 40 -8.404 -0.273 -2.884 1.00 0.00 C ATOM 579 CG PHE A 40 -8.865 -1.556 -2.193 1.00 0.00 C ATOM 580 CD1 PHE A 40 -10.161 -1.770 -1.837 1.00 0.00 C ATOM 581 CD2 PHE A 40 -7.959 -2.556 -2.028 1.00 0.00 C ATOM 582 CE1 PHE A 40 -10.568 -2.998 -1.425 1.00 0.00 C ATOM 583 CE2 PHE A 40 -8.362 -3.782 -1.600 1.00 0.00 C ATOM 584 CZ PHE A 40 -9.670 -4.009 -1.325 1.00 0.00 C ATOM 0 H PHE A 40 -9.277 -0.363 -5.569 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.268 0.717 -2.942 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.602 -0.529 -3.576 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.975 0.385 -2.128 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.871 -0.957 -1.883 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.915 -2.376 -2.238 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -11.605 -3.169 -1.177 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.640 -4.576 -1.479 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.996 -4.994 -1.027 1.00 0.00 H new ATOM 594 N LEU A 41 -9.786 2.894 -4.011 1.00 0.00 N ATOM 595 CA LEU A 41 -9.465 4.225 -4.546 1.00 0.00 C ATOM 596 C LEU A 41 -8.556 4.937 -3.534 1.00 0.00 C ATOM 597 O LEU A 41 -8.633 4.685 -2.332 1.00 0.00 O ATOM 598 CB LEU A 41 -10.831 4.895 -4.784 1.00 0.00 C ATOM 599 CG LEU A 41 -10.839 6.187 -5.619 1.00 0.00 C ATOM 600 CD1 LEU A 41 -12.229 6.358 -6.239 1.00 0.00 C ATOM 601 CD2 LEU A 41 -10.534 7.424 -4.771 1.00 0.00 C ATOM 0 H LEU A 41 -10.667 2.843 -3.500 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.910 4.232 -5.484 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.483 4.171 -5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.273 5.117 -3.813 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.065 6.099 -6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.252 7.270 -6.835 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -12.451 5.502 -6.877 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.975 6.423 -5.447 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -10.551 8.312 -5.403 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.285 7.522 -3.988 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -9.548 7.320 -4.317 1.00 0.00 H new ATOM 613 N ILE A 42 -7.671 5.818 -3.997 1.00 0.00 N ATOM 614 CA ILE A 42 -6.664 6.406 -3.094 1.00 0.00 C ATOM 615 C ILE A 42 -7.267 7.252 -1.953 1.00 0.00 C ATOM 616 O ILE A 42 -6.824 7.141 -0.808 1.00 0.00 O ATOM 617 CB ILE A 42 -5.616 7.128 -3.975 1.00 0.00 C ATOM 618 CG1 ILE A 42 -4.391 7.609 -3.198 1.00 0.00 C ATOM 619 CG2 ILE A 42 -6.153 8.351 -4.727 1.00 0.00 C ATOM 620 CD1 ILE A 42 -3.763 6.503 -2.356 1.00 0.00 C ATOM 0 H ILE A 42 -7.623 6.138 -4.964 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.159 5.621 -2.531 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.343 6.347 -4.685 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.649 7.994 -3.897 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.678 8.437 -2.549 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.352 8.795 -5.319 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.965 8.045 -5.387 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.524 9.084 -4.011 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.897 6.898 -1.825 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.494 6.134 -1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.449 5.685 -3.005 1.00 0.00 H new ATOM 632 N ASN A 43 -8.308 8.040 -2.223 1.00 0.00 N ATOM 633 CA ASN A 43 -8.979 8.781 -1.144 1.00 0.00 C ATOM 634 C ASN A 43 -9.940 7.909 -0.311 1.00 0.00 C ATOM 635 O ASN A 43 -10.108 8.163 0.883 1.00 0.00 O ATOM 636 CB ASN A 43 -9.723 9.966 -1.781 1.00 0.00 C ATOM 637 CG ASN A 43 -10.290 10.939 -0.745 1.00 0.00 C ATOM 638 OD1 ASN A 43 -9.554 11.630 -0.042 1.00 0.00 O ATOM 639 ND2 ASN A 43 -11.606 11.006 -0.640 1.00 0.00 N ATOM 0 H ASN A 43 -8.701 8.183 -3.154 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.224 9.127 -0.439 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.043 10.503 -2.442 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.536 9.587 -2.400 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.032 11.641 0.035 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.195 10.423 -1.234 1.00 0.00 H new ATOM 646 N LYS A 44 -10.554 6.876 -0.893 1.00 0.00 N ATOM 647 CA LYS A 44 -11.485 6.032 -0.132 1.00 0.00 C ATOM 648 C LYS A 44 -10.777 4.962 0.717 1.00 0.00 C ATOM 649 O LYS A 44 -11.299 4.582 1.764 1.00 0.00 O ATOM 650 CB LYS A 44 -12.476 5.371 -1.096 1.00 0.00 C ATOM 651 CG LYS A 44 -13.414 6.380 -1.771 1.00 0.00 C ATOM 652 CD LYS A 44 -14.405 5.676 -2.699 1.00 0.00 C ATOM 653 CE LYS A 44 -15.334 6.682 -3.379 1.00 0.00 C ATOM 654 NZ LYS A 44 -16.270 5.989 -4.276 1.00 0.00 N ATOM 0 H LYS A 44 -10.429 6.605 -1.868 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.011 6.681 0.568 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.923 4.828 -1.862 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.071 4.637 -0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.958 6.940 -1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.828 7.102 -2.340 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.861 5.110 -3.455 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.996 4.959 -2.129 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.889 7.241 -2.626 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.746 7.405 -3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.895 6.685 -4.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.736 5.475 -5.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.843 5.316 -3.727 1.00 0.00 H new ATOM 668 N LEU A 45 -9.606 4.470 0.307 1.00 0.00 N ATOM 669 CA LEU A 45 -8.876 3.498 1.143 1.00 0.00 C ATOM 670 C LEU A 45 -8.189 4.167 2.337 1.00 0.00 C ATOM 671 O LEU A 45 -8.227 3.665 3.462 1.00 0.00 O ATOM 672 CB LEU A 45 -7.823 2.813 0.258 1.00 0.00 C ATOM 673 CG LEU A 45 -7.515 1.341 0.589 1.00 0.00 C ATOM 674 CD1 LEU A 45 -6.785 1.185 1.926 1.00 0.00 C ATOM 675 CD2 LEU A 45 -8.775 0.467 0.577 1.00 0.00 C ATOM 0 H LEU A 45 -9.149 4.715 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.586 2.776 1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -8.156 2.869 -0.778 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.895 3.381 0.326 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.851 0.995 -0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.591 0.129 2.113 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.840 1.727 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -7.404 1.588 2.728 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.506 -0.562 0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.483 0.839 1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -9.233 0.502 -0.412 1.00 0.00 H new ATOM 687 N ASN A 46 -7.610 5.338 2.095 1.00 0.00 N ATOM 688 CA ASN A 46 -7.018 6.129 3.187 1.00 0.00 C ATOM 689 C ASN A 46 -8.069 6.720 4.149 1.00 0.00 C ATOM 690 O ASN A 46 -7.793 6.926 5.332 1.00 0.00 O ATOM 691 CB ASN A 46 -6.170 7.216 2.517 1.00 0.00 C ATOM 692 CG ASN A 46 -5.293 7.990 3.499 1.00 0.00 C ATOM 693 OD1 ASN A 46 -4.329 7.466 4.055 1.00 0.00 O ATOM 694 ND2 ASN A 46 -5.614 9.253 3.723 1.00 0.00 N ATOM 0 H ASN A 46 -7.534 5.762 1.170 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.408 5.490 3.826 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.536 6.756 1.759 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.829 7.914 2.001 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -5.058 9.814 4.368 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.418 9.666 3.250 1.00 0.00 H new ATOM 701 N ASP A 47 -9.275 6.975 3.648 1.00 0.00 N ATOM 702 CA ASP A 47 -10.383 7.417 4.516 1.00 0.00 C ATOM 703 C ASP A 47 -11.042 6.236 5.256 1.00 0.00 C ATOM 704 O ASP A 47 -11.354 6.364 6.441 1.00 0.00 O ATOM 705 CB ASP A 47 -11.408 8.241 3.713 1.00 0.00 C ATOM 706 CG ASP A 47 -12.517 8.818 4.589 1.00 0.00 C ATOM 707 OD1 ASP A 47 -12.289 9.855 5.247 1.00 0.00 O ATOM 708 OD2 ASP A 47 -13.622 8.232 4.624 1.00 0.00 O ATOM 0 H ASP A 47 -9.516 6.887 2.661 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.965 8.066 5.286 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.893 9.055 3.202 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -11.851 7.610 2.942 1.00 0.00 H new ATOM 713 N GLY A 48 -11.261 5.102 4.588 1.00 0.00 N ATOM 714 CA GLY A 48 -11.787 3.920 5.288 1.00 0.00 C ATOM 715 C GLY A 48 -13.200 3.464 4.888 1.00 0.00 C ATOM 716 O GLY A 48 -13.807 2.674 5.611 1.00 0.00 O ATOM 0 H GLY A 48 -11.089 4.973 3.591 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -11.100 3.090 5.122 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.784 4.127 6.358 1.00 0.00 H new ATOM 720 N SER A 49 -13.746 3.928 3.763 1.00 0.00 N ATOM 721 CA SER A 49 -15.104 3.500 3.350 1.00 0.00 C ATOM 722 C SER A 49 -15.210 2.054 2.811 1.00 0.00 C ATOM 723 O SER A 49 -16.312 1.552 2.582 1.00 0.00 O ATOM 724 CB SER A 49 -15.601 4.470 2.274 1.00 0.00 C ATOM 725 OG SER A 49 -15.639 5.799 2.779 1.00 0.00 O ATOM 0 H SER A 49 -13.291 4.584 3.128 1.00 0.00 H new ATOM 0 HA SER A 49 -15.715 3.515 4.253 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.946 4.424 1.404 1.00 0.00 H new ATOM 0 HB3 SER A 49 -16.595 4.173 1.940 1.00 0.00 H new ATOM 0 HG SER A 49 -15.957 6.406 2.079 1.00 0.00 H new ATOM 731 N ILE A 50 -14.077 1.389 2.606 1.00 0.00 N ATOM 732 CA ILE A 50 -14.028 0.103 1.892 1.00 0.00 C ATOM 733 C ILE A 50 -13.584 -1.003 2.841 1.00 0.00 C ATOM 734 O ILE A 50 -12.516 -0.917 3.450 1.00 0.00 O ATOM 735 CB ILE A 50 -13.108 0.111 0.662 1.00 0.00 C ATOM 736 CG1 ILE A 50 -13.413 1.344 -0.205 1.00 0.00 C ATOM 737 CG2 ILE A 50 -13.262 -1.230 -0.073 1.00 0.00 C ATOM 738 CD1 ILE A 50 -12.840 1.269 -1.620 1.00 0.00 C ATOM 0 H ILE A 50 -13.166 1.719 2.926 1.00 0.00 H new ATOM 0 HA ILE A 50 -15.040 -0.078 1.529 1.00 0.00 H new ATOM 0 HB ILE A 50 -12.059 0.200 0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.494 1.472 -0.268 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -13.016 2.230 0.290 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.615 -1.241 -0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.982 -2.045 0.595 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.299 -1.357 -0.386 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.099 2.176 -2.166 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.755 1.174 -1.569 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.256 0.404 -2.136 1.00 0.00 H new ATOM 750 N THR A 51 -14.417 -2.027 2.995 1.00 0.00 N ATOM 751 CA THR A 51 -14.132 -3.045 4.016 1.00 0.00 C ATOM 752 C THR A 51 -13.465 -4.247 3.347 1.00 0.00 C ATOM 753 O THR A 51 -13.941 -4.859 2.391 1.00 0.00 O ATOM 754 CB THR A 51 -15.343 -3.531 4.837 1.00 0.00 C ATOM 755 OG1 THR A 51 -15.891 -2.439 5.562 1.00 0.00 O ATOM 756 CG2 THR A 51 -14.902 -4.621 5.826 1.00 0.00 C ATOM 0 H THR A 51 -15.267 -2.178 2.451 1.00 0.00 H new ATOM 0 HA THR A 51 -13.479 -2.553 4.737 1.00 0.00 H new ATOM 0 HB THR A 51 -16.092 -3.940 4.159 1.00 0.00 H new ATOM 0 HG1 THR A 51 -16.662 -2.746 6.083 1.00 0.00 H new ATOM 0 HG21 THR A 51 -15.763 -4.959 6.402 1.00 0.00 H new ATOM 0 HG22 THR A 51 -14.480 -5.462 5.276 1.00 0.00 H new ATOM 0 HG23 THR A 51 -14.149 -4.216 6.502 1.00 0.00 H new ATOM 764 N LEU A 52 -12.267 -4.471 3.870 1.00 0.00 N ATOM 765 CA LEU A 52 -11.259 -5.267 3.177 1.00 0.00 C ATOM 766 C LEU A 52 -11.256 -6.720 3.663 1.00 0.00 C ATOM 767 O LEU A 52 -11.474 -7.036 4.834 1.00 0.00 O ATOM 768 CB LEU A 52 -9.955 -4.556 3.599 1.00 0.00 C ATOM 769 CG LEU A 52 -8.648 -5.128 3.042 1.00 0.00 C ATOM 770 CD1 LEU A 52 -8.629 -5.011 1.523 1.00 0.00 C ATOM 771 CD2 LEU A 52 -7.458 -4.365 3.631 1.00 0.00 C ATOM 0 H LEU A 52 -11.967 -4.111 4.776 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.417 -5.325 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.025 -3.511 3.298 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -9.896 -4.571 4.687 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.577 -6.180 3.318 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.695 -5.421 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.469 -5.566 1.105 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.710 -3.962 1.238 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.530 -4.775 3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.533 -3.311 3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.462 -4.466 4.716 1.00 0.00 H new ATOM 783 N GLU A 53 -10.890 -7.581 2.726 1.00 0.00 N ATOM 784 CA GLU A 53 -10.544 -8.975 3.035 1.00 0.00 C ATOM 785 C GLU A 53 -9.032 -9.166 2.822 1.00 0.00 C ATOM 786 O GLU A 53 -8.323 -8.280 2.341 1.00 0.00 O ATOM 787 CB GLU A 53 -11.353 -9.931 2.140 1.00 0.00 C ATOM 788 CG GLU A 53 -12.860 -9.861 2.415 1.00 0.00 C ATOM 789 CD GLU A 53 -13.624 -10.831 1.522 1.00 0.00 C ATOM 790 OE1 GLU A 53 -13.999 -10.443 0.395 1.00 0.00 O ATOM 791 OE2 GLU A 53 -13.854 -11.985 1.945 1.00 0.00 O ATOM 0 H GLU A 53 -10.822 -7.344 1.736 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.791 -9.202 4.072 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.167 -9.689 1.094 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.005 -10.952 2.298 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.053 -10.095 3.462 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.218 -8.846 2.244 1.00 0.00 H new ATOM 798 N ASN A 54 -8.521 -10.311 3.258 1.00 0.00 N ATOM 799 CA ASN A 54 -7.061 -10.480 3.388 1.00 0.00 C ATOM 800 C ASN A 54 -6.467 -11.611 2.544 1.00 0.00 C ATOM 801 O ASN A 54 -5.682 -12.417 3.047 1.00 0.00 O ATOM 802 CB ASN A 54 -6.784 -10.701 4.883 1.00 0.00 C ATOM 803 CG ASN A 54 -7.374 -11.972 5.508 1.00 0.00 C ATOM 804 OD1 ASN A 54 -8.077 -12.759 4.876 1.00 0.00 O ATOM 805 ND2 ASN A 54 -7.087 -12.184 6.779 1.00 0.00 N ATOM 0 H ASN A 54 -9.073 -11.126 3.525 1.00 0.00 H new ATOM 0 HA ASN A 54 -6.571 -9.587 3.000 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.704 -10.718 5.031 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -7.168 -9.841 5.432 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -7.450 -13.011 7.253 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -6.502 -11.521 7.287 1.00 0.00 H new ATOM 812 N ALA A 55 -6.872 -11.729 1.282 1.00 0.00 N ATOM 813 CA ALA A 55 -6.540 -12.975 0.562 1.00 0.00 C ATOM 814 C ALA A 55 -6.564 -12.989 -0.980 1.00 0.00 C ATOM 815 O ALA A 55 -5.520 -13.250 -1.581 1.00 0.00 O ATOM 816 CB ALA A 55 -7.453 -14.066 1.131 1.00 0.00 C ATOM 0 H ALA A 55 -7.398 -11.031 0.755 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.476 -13.131 0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.246 -15.011 0.630 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.268 -14.174 2.200 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.495 -13.790 0.969 1.00 0.00 H new ATOM 822 N LYS A 56 -7.738 -12.966 -1.620 1.00 0.00 N ATOM 823 CA LYS A 56 -7.836 -13.476 -3.010 1.00 0.00 C ATOM 824 C LYS A 56 -7.412 -12.537 -4.143 1.00 0.00 C ATOM 825 O LYS A 56 -7.937 -12.604 -5.257 1.00 0.00 O ATOM 826 CB LYS A 56 -9.237 -14.028 -3.321 1.00 0.00 C ATOM 827 CG LYS A 56 -9.509 -15.321 -2.558 1.00 0.00 C ATOM 828 CD LYS A 56 -10.477 -16.208 -3.346 1.00 0.00 C ATOM 829 CE LYS A 56 -10.716 -17.541 -2.636 1.00 0.00 C ATOM 830 NZ LYS A 56 -11.653 -18.369 -3.410 1.00 0.00 N ATOM 0 H LYS A 56 -8.610 -12.615 -1.224 1.00 0.00 H new ATOM 0 HA LYS A 56 -7.085 -14.266 -3.003 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -9.989 -13.284 -3.059 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -9.328 -14.210 -4.392 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -8.574 -15.854 -2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -9.930 -15.092 -1.579 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.426 -15.688 -3.476 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -10.075 -16.392 -4.343 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -9.771 -18.069 -2.511 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -11.116 -17.363 -1.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -11.807 -19.272 -2.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -12.559 -17.869 -3.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -11.256 -18.553 -4.353 1.00 0.00 H new ATOM 844 N TYR A 57 -6.468 -11.661 -3.874 1.00 0.00 N ATOM 845 CA TYR A 57 -6.147 -10.590 -4.833 1.00 0.00 C ATOM 846 C TYR A 57 -4.746 -10.756 -5.462 1.00 0.00 C ATOM 847 O TYR A 57 -4.143 -9.734 -5.793 1.00 0.00 O ATOM 848 CB TYR A 57 -6.317 -9.150 -4.338 1.00 0.00 C ATOM 849 CG TYR A 57 -7.322 -8.900 -3.223 1.00 0.00 C ATOM 850 CD1 TYR A 57 -8.625 -9.265 -3.372 1.00 0.00 C ATOM 851 CD2 TYR A 57 -6.929 -8.249 -2.095 1.00 0.00 C ATOM 852 CE1 TYR A 57 -9.525 -8.990 -2.393 1.00 0.00 C ATOM 853 CE2 TYR A 57 -7.835 -7.958 -1.126 1.00 0.00 C ATOM 854 CZ TYR A 57 -9.133 -8.326 -1.275 1.00 0.00 C ATOM 855 OH TYR A 57 -10.050 -8.010 -0.309 1.00 0.00 O ATOM 0 H TYR A 57 -5.910 -11.655 -3.020 1.00 0.00 H new ATOM 0 HA TYR A 57 -6.919 -10.731 -5.590 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.344 -8.795 -3.999 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.602 -8.534 -5.191 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.943 -9.774 -4.270 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -5.895 -7.963 -1.970 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.554 -9.300 -2.504 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.522 -7.433 -0.236 1.00 0.00 H new ATOM 0 HH TYR A 57 -10.782 -7.496 -0.709 1.00 0.00 H new ATOM 865 N GLU A 58 -4.144 -11.956 -5.471 1.00 0.00 N ATOM 866 CA GLU A 58 -2.696 -12.118 -5.787 1.00 0.00 C ATOM 867 C GLU A 58 -2.246 -11.671 -7.206 1.00 0.00 C ATOM 868 O GLU A 58 -1.250 -12.155 -7.750 1.00 0.00 O ATOM 869 CB GLU A 58 -2.292 -13.598 -5.632 1.00 0.00 C ATOM 870 CG GLU A 58 -2.694 -14.230 -4.295 1.00 0.00 C ATOM 871 CD GLU A 58 -2.227 -15.677 -4.222 1.00 0.00 C ATOM 872 OE1 GLU A 58 -1.003 -15.912 -4.127 1.00 0.00 O ATOM 873 OE2 GLU A 58 -3.082 -16.590 -4.257 1.00 0.00 O ATOM 0 H GLU A 58 -4.626 -12.831 -5.265 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.201 -11.453 -5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.744 -14.172 -6.441 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.211 -13.681 -5.748 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -2.260 -13.661 -3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -3.777 -14.186 -4.177 1.00 0.00 H new ATOM 880 N THR A 59 -2.956 -10.713 -7.788 1.00 0.00 N ATOM 881 CA THR A 59 -2.517 -10.036 -9.017 1.00 0.00 C ATOM 882 C THR A 59 -3.040 -8.610 -8.889 1.00 0.00 C ATOM 883 O THR A 59 -4.237 -8.357 -8.767 1.00 0.00 O ATOM 884 CB THR A 59 -2.936 -10.746 -10.318 1.00 0.00 C ATOM 885 OG1 THR A 59 -1.854 -11.534 -10.793 1.00 0.00 O ATOM 886 CG2 THR A 59 -3.401 -9.805 -11.425 1.00 0.00 C ATOM 0 H THR A 59 -3.850 -10.379 -7.429 1.00 0.00 H new ATOM 0 HA THR A 59 -1.431 -10.053 -9.106 1.00 0.00 H new ATOM 0 HB THR A 59 -3.797 -11.364 -10.064 1.00 0.00 H new ATOM 0 HG1 THR A 59 -1.380 -11.930 -10.033 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.677 -10.386 -12.305 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.265 -9.236 -11.080 1.00 0.00 H new ATOM 0 HG23 THR A 59 -2.594 -9.119 -11.682 1.00 0.00 H new ATOM 894 N VAL A 60 -2.095 -7.695 -8.812 1.00 0.00 N ATOM 895 CA VAL A 60 -2.403 -6.334 -8.378 1.00 0.00 C ATOM 896 C VAL A 60 -2.038 -5.383 -9.528 1.00 0.00 C ATOM 897 O VAL A 60 -0.955 -5.473 -10.108 1.00 0.00 O ATOM 898 CB VAL A 60 -1.552 -6.137 -7.111 1.00 0.00 C ATOM 899 CG1 VAL A 60 -1.407 -4.675 -6.707 1.00 0.00 C ATOM 900 CG2 VAL A 60 -2.097 -6.916 -5.918 1.00 0.00 C ATOM 0 H VAL A 60 -1.115 -7.859 -9.040 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.450 -6.141 -8.146 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.569 -6.524 -7.381 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.796 -4.605 -5.807 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.929 -4.120 -7.514 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.392 -4.252 -6.510 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.461 -6.743 -5.050 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.111 -6.582 -5.698 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.109 -7.980 -6.153 1.00 0.00 H new ATOM 910 N HIS A 61 -2.930 -4.442 -9.832 1.00 0.00 N ATOM 911 CA HIS A 61 -2.598 -3.350 -10.755 1.00 0.00 C ATOM 912 C HIS A 61 -2.818 -2.024 -10.021 1.00 0.00 C ATOM 913 O HIS A 61 -3.877 -1.826 -9.426 1.00 0.00 O ATOM 914 CB HIS A 61 -3.475 -3.514 -12.018 1.00 0.00 C ATOM 915 CG HIS A 61 -2.719 -4.287 -13.074 1.00 0.00 C ATOM 916 ND1 HIS A 61 -2.752 -5.669 -13.211 1.00 0.00 N ATOM 917 CD2 HIS A 61 -1.696 -3.732 -13.841 1.00 0.00 C ATOM 918 CE1 HIS A 61 -1.721 -5.809 -14.105 1.00 0.00 C ATOM 919 NE2 HIS A 61 -1.069 -4.709 -14.584 1.00 0.00 N ATOM 0 H HIS A 61 -3.879 -4.410 -9.459 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.557 -3.368 -11.079 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.398 -4.035 -11.765 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -3.758 -2.535 -12.405 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -3.358 -6.367 -12.779 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -1.432 -2.685 -13.852 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -1.423 -6.794 -14.432 1.00 0.00 H new ATOM 927 N TYR A 62 -1.884 -1.070 -10.120 1.00 0.00 N ATOM 928 CA TYR A 62 -2.204 0.305 -9.700 1.00 0.00 C ATOM 929 C TYR A 62 -2.356 1.133 -10.982 1.00 0.00 C ATOM 930 O TYR A 62 -1.584 1.008 -11.935 1.00 0.00 O ATOM 931 CB TYR A 62 -1.119 0.857 -8.750 1.00 0.00 C ATOM 932 CG TYR A 62 -1.614 1.764 -7.635 1.00 0.00 C ATOM 933 CD1 TYR A 62 -2.234 2.941 -7.917 1.00 0.00 C ATOM 934 CD2 TYR A 62 -1.369 1.431 -6.338 1.00 0.00 C ATOM 935 CE1 TYR A 62 -2.702 3.729 -6.914 1.00 0.00 C ATOM 936 CE2 TYR A 62 -1.817 2.231 -5.336 1.00 0.00 C ATOM 937 CZ TYR A 62 -2.499 3.369 -5.623 1.00 0.00 C ATOM 938 OH TYR A 62 -2.961 4.162 -4.611 1.00 0.00 O ATOM 0 H TYR A 62 -0.937 -1.211 -10.472 1.00 0.00 H new ATOM 0 HA TYR A 62 -3.131 0.346 -9.129 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.594 0.014 -8.301 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.389 1.408 -9.344 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.355 3.251 -8.944 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.819 0.531 -6.106 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.234 4.640 -7.145 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -1.630 1.961 -4.307 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.357 4.096 -3.842 1.00 0.00 H new ATOM 948 N LEU A 63 -3.312 2.051 -10.953 1.00 0.00 N ATOM 949 CA LEU A 63 -3.456 3.057 -12.004 1.00 0.00 C ATOM 950 C LEU A 63 -3.384 4.438 -11.354 1.00 0.00 C ATOM 951 O LEU A 63 -4.358 4.920 -10.775 1.00 0.00 O ATOM 952 CB LEU A 63 -4.831 2.815 -12.647 1.00 0.00 C ATOM 953 CG LEU A 63 -4.915 1.547 -13.507 1.00 0.00 C ATOM 954 CD1 LEU A 63 -6.338 1.420 -14.044 1.00 0.00 C ATOM 955 CD2 LEU A 63 -3.934 1.580 -14.683 1.00 0.00 C ATOM 0 H LEU A 63 -4.006 2.122 -10.209 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.675 2.996 -12.761 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.581 2.755 -11.859 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.086 3.676 -13.265 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.650 0.693 -12.883 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.416 0.523 -14.658 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.037 1.351 -13.210 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.579 2.295 -14.647 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.030 0.662 -15.263 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.158 2.436 -15.320 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.915 1.666 -14.305 1.00 0.00 H new ATOM 967 N THR A 64 -2.234 5.096 -11.477 1.00 0.00 N ATOM 968 CA THR A 64 -2.140 6.507 -11.073 1.00 0.00 C ATOM 969 C THR A 64 -1.333 7.258 -12.147 1.00 0.00 C ATOM 970 O THR A 64 -0.130 7.029 -12.275 1.00 0.00 O ATOM 971 CB THR A 64 -1.474 6.619 -9.697 1.00 0.00 C ATOM 972 OG1 THR A 64 -2.194 5.832 -8.767 1.00 0.00 O ATOM 973 CG2 THR A 64 -1.498 8.055 -9.182 1.00 0.00 C ATOM 0 H THR A 64 -1.371 4.693 -11.843 1.00 0.00 H new ATOM 0 HA THR A 64 -3.133 6.949 -10.990 1.00 0.00 H new ATOM 0 HB THR A 64 -0.442 6.283 -9.801 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.708 4.998 -8.599 1.00 0.00 H new ATOM 0 HG21 THR A 64 -1.018 8.099 -8.204 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.963 8.700 -9.879 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.531 8.393 -9.095 1.00 0.00 H new ATOM 981 N PRO A 65 -1.936 8.192 -12.893 1.00 0.00 N ATOM 982 CA PRO A 65 -1.196 9.094 -13.790 1.00 0.00 C ATOM 983 C PRO A 65 -0.001 9.810 -13.147 1.00 0.00 C ATOM 984 O PRO A 65 -0.082 10.322 -12.031 1.00 0.00 O ATOM 985 CB PRO A 65 -2.278 10.103 -14.190 1.00 0.00 C ATOM 986 CG PRO A 65 -3.589 9.328 -14.065 1.00 0.00 C ATOM 987 CD PRO A 65 -3.381 8.425 -12.859 1.00 0.00 C ATOM 0 HA PRO A 65 -0.736 8.546 -14.612 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.269 10.975 -13.536 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -2.126 10.465 -15.207 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -4.435 9.999 -13.918 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.795 8.748 -14.965 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -3.694 8.905 -11.932 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.945 7.496 -12.944 1.00 0.00 H new ATOM 1104 N PHE A 73 2.513 8.354 -3.016 1.00 0.00 N ATOM 1105 CA PHE A 73 2.011 7.083 -2.479 1.00 0.00 C ATOM 1106 C PHE A 73 2.654 6.749 -1.134 1.00 0.00 C ATOM 1107 O PHE A 73 3.752 6.190 -1.106 1.00 0.00 O ATOM 1108 CB PHE A 73 2.133 5.945 -3.500 1.00 0.00 C ATOM 1109 CG PHE A 73 1.362 4.698 -3.085 1.00 0.00 C ATOM 1110 CD1 PHE A 73 0.118 4.807 -2.537 1.00 0.00 C ATOM 1111 CD2 PHE A 73 1.902 3.462 -3.273 1.00 0.00 C ATOM 1112 CE1 PHE A 73 -0.578 3.704 -2.180 1.00 0.00 C ATOM 1113 CE2 PHE A 73 1.187 2.356 -2.944 1.00 0.00 C ATOM 1114 CZ PHE A 73 -0.034 2.479 -2.368 1.00 0.00 C ATOM 0 HA PHE A 73 0.945 7.203 -2.288 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.766 6.289 -4.467 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.185 5.690 -3.630 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.316 5.785 -2.387 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.896 3.362 -3.683 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.563 3.800 -1.747 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.592 1.375 -3.142 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.574 1.597 -2.058 1.00 0.00 H new ATOM 1124 N PRO A 74 2.058 7.163 -0.009 1.00 0.00 N ATOM 1125 CA PRO A 74 2.661 6.948 1.308 1.00 0.00 C ATOM 1126 C PRO A 74 2.974 5.473 1.587 1.00 0.00 C ATOM 1127 O PRO A 74 2.316 4.561 1.080 1.00 0.00 O ATOM 1128 CB PRO A 74 1.576 7.482 2.248 1.00 0.00 C ATOM 1129 CG PRO A 74 0.604 8.294 1.396 1.00 0.00 C ATOM 1130 CD PRO A 74 0.665 7.619 0.038 1.00 0.00 C ATOM 0 HA PRO A 74 3.627 7.440 1.417 1.00 0.00 H new ATOM 0 HB2 PRO A 74 1.059 6.661 2.745 1.00 0.00 H new ATOM 0 HB3 PRO A 74 2.015 8.103 3.029 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -0.405 8.273 1.809 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.902 9.341 1.337 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -0.039 6.790 -0.039 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.434 8.310 -0.773 1.00 0.00 H new ATOM 1138 N LYS A 75 4.015 5.248 2.381 1.00 0.00 N ATOM 1139 CA LYS A 75 4.466 3.870 2.659 1.00 0.00 C ATOM 1140 C LYS A 75 3.425 2.993 3.386 1.00 0.00 C ATOM 1141 O LYS A 75 3.353 1.782 3.161 1.00 0.00 O ATOM 1142 CB LYS A 75 5.765 3.894 3.480 1.00 0.00 C ATOM 1143 CG LYS A 75 6.918 4.606 2.763 1.00 0.00 C ATOM 1144 CD LYS A 75 8.210 4.521 3.580 1.00 0.00 C ATOM 1145 CE LYS A 75 9.362 5.238 2.873 1.00 0.00 C ATOM 1146 NZ LYS A 75 10.592 5.140 3.676 1.00 0.00 N ATOM 0 H LYS A 75 4.559 5.978 2.840 1.00 0.00 H new ATOM 0 HA LYS A 75 4.627 3.415 1.682 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.576 4.389 4.432 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.063 2.870 3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.074 4.156 1.782 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.657 5.651 2.597 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.051 4.964 4.563 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.473 3.476 3.741 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.525 4.797 1.890 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.105 6.285 2.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.367 5.631 3.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.436 5.581 4.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.843 4.139 3.806 1.00 0.00 H new ATOM 1160 N LYS A 76 2.635 3.593 4.276 1.00 0.00 N ATOM 1161 CA LYS A 76 1.614 2.831 5.024 1.00 0.00 C ATOM 1162 C LYS A 76 0.590 2.125 4.119 1.00 0.00 C ATOM 1163 O LYS A 76 0.109 1.043 4.459 1.00 0.00 O ATOM 1164 CB LYS A 76 0.877 3.764 5.995 1.00 0.00 C ATOM 1165 CG LYS A 76 1.792 4.327 7.089 1.00 0.00 C ATOM 1166 CD LYS A 76 1.014 5.217 8.059 1.00 0.00 C ATOM 1167 CE LYS A 76 1.928 5.774 9.151 1.00 0.00 C ATOM 1168 NZ LYS A 76 1.163 6.624 10.075 1.00 0.00 N ATOM 0 H LYS A 76 2.674 4.587 4.500 1.00 0.00 H new ATOM 0 HA LYS A 76 2.148 2.051 5.567 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.437 4.590 5.435 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.054 3.220 6.460 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.255 3.506 7.637 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.598 4.901 6.632 1.00 0.00 H new ATOM 0 HD2 LYS A 76 0.553 6.040 7.512 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.206 4.644 8.514 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.391 4.954 9.700 1.00 0.00 H new ATOM 0 HE3 LYS A 76 2.735 6.351 8.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.797 6.995 10.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 0.742 7.416 9.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 0.408 6.063 10.519 1.00 0.00 H new ATOM 1182 N LEU A 77 0.275 2.693 2.956 1.00 0.00 N ATOM 1183 CA LEU A 77 -0.666 2.009 2.051 1.00 0.00 C ATOM 1184 C LEU A 77 0.021 0.845 1.313 1.00 0.00 C ATOM 1185 O LEU A 77 -0.631 -0.165 1.057 1.00 0.00 O ATOM 1186 CB LEU A 77 -1.359 2.928 1.022 1.00 0.00 C ATOM 1187 CG LEU A 77 -2.362 3.924 1.613 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -1.698 5.017 2.454 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -3.195 4.596 0.519 1.00 0.00 C ATOM 0 H LEU A 77 0.636 3.587 2.622 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.451 1.634 2.708 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.593 3.484 0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.876 2.305 0.292 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.004 3.330 2.263 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.461 5.690 2.844 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.159 4.560 3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.000 5.580 1.834 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.896 5.296 0.974 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.535 5.134 -0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.748 3.837 -0.035 1.00 0.00 H new ATOM 1201 N ILE A 78 1.325 0.911 1.041 1.00 0.00 N ATOM 1202 CA ILE A 78 2.066 -0.252 0.539 1.00 0.00 C ATOM 1203 C ILE A 78 2.110 -1.393 1.582 1.00 0.00 C ATOM 1204 O ILE A 78 2.033 -2.559 1.194 1.00 0.00 O ATOM 1205 CB ILE A 78 3.455 0.289 0.141 1.00 0.00 C ATOM 1206 CG1 ILE A 78 3.438 1.321 -0.992 1.00 0.00 C ATOM 1207 CG2 ILE A 78 4.404 -0.851 -0.197 1.00 0.00 C ATOM 1208 CD1 ILE A 78 4.777 2.038 -1.185 1.00 0.00 C ATOM 0 H ILE A 78 1.890 1.752 1.158 1.00 0.00 H new ATOM 0 HA ILE A 78 1.584 -0.713 -0.323 1.00 0.00 H new ATOM 0 HB ILE A 78 3.815 0.823 1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 78 3.164 0.823 -1.922 1.00 0.00 H new ATOM 0 HG13 ILE A 78 2.665 2.061 -0.787 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.377 -0.445 -0.475 1.00 0.00 H new ATOM 0 HG22 ILE A 78 4.516 -1.500 0.671 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.000 -1.426 -1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 78 4.692 2.754 -2.003 1.00 0.00 H new ATOM 0 HD12 ILE A 78 5.043 2.564 -0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.550 1.307 -1.421 1.00 0.00 H new ATOM 1220 N SER A 79 2.196 -1.109 2.889 1.00 0.00 N ATOM 1221 CA SER A 79 2.086 -2.195 3.882 1.00 0.00 C ATOM 1222 C SER A 79 0.668 -2.797 3.961 1.00 0.00 C ATOM 1223 O SER A 79 0.519 -4.011 4.115 1.00 0.00 O ATOM 1224 CB SER A 79 2.568 -1.710 5.255 1.00 0.00 C ATOM 1225 OG SER A 79 1.727 -0.681 5.759 1.00 0.00 O ATOM 0 H SER A 79 2.336 -0.176 3.276 1.00 0.00 H new ATOM 0 HA SER A 79 2.735 -3.005 3.548 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.584 -2.546 5.954 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.591 -1.342 5.175 1.00 0.00 H new ATOM 0 HG SER A 79 1.259 -0.247 5.015 1.00 0.00 H new ATOM 1231 N VAL A 80 -0.373 -1.972 3.821 1.00 0.00 N ATOM 1232 CA VAL A 80 -1.753 -2.494 3.728 1.00 0.00 C ATOM 1233 C VAL A 80 -1.980 -3.294 2.426 1.00 0.00 C ATOM 1234 O VAL A 80 -2.677 -4.309 2.435 1.00 0.00 O ATOM 1235 CB VAL A 80 -2.773 -1.342 3.872 1.00 0.00 C ATOM 1236 CG1 VAL A 80 -4.221 -1.827 3.718 1.00 0.00 C ATOM 1237 CG2 VAL A 80 -2.656 -0.662 5.241 1.00 0.00 C ATOM 0 H VAL A 80 -0.297 -0.956 3.770 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.905 -3.191 4.552 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.537 -0.638 3.074 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -4.901 -0.982 3.827 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.352 -2.274 2.732 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.439 -2.570 4.485 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.387 0.144 5.311 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.845 -1.393 6.027 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.653 -0.253 5.360 1.00 0.00 H new ATOM 1247 N LEU A 81 -1.390 -2.856 1.313 1.00 0.00 N ATOM 1248 CA LEU A 81 -1.441 -3.605 0.056 1.00 0.00 C ATOM 1249 C LEU A 81 -0.815 -5.006 0.192 1.00 0.00 C ATOM 1250 O LEU A 81 -1.391 -5.993 -0.266 1.00 0.00 O ATOM 1251 CB LEU A 81 -0.669 -2.763 -0.978 1.00 0.00 C ATOM 1252 CG LEU A 81 -1.540 -2.012 -1.989 1.00 0.00 C ATOM 1253 CD1 LEU A 81 -2.264 -0.839 -1.332 1.00 0.00 C ATOM 1254 CD2 LEU A 81 -0.635 -1.475 -3.100 1.00 0.00 C ATOM 0 H LEU A 81 -0.868 -1.981 1.256 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.475 -3.768 -0.247 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.052 -2.039 -0.445 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.009 -3.419 -1.524 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.288 -2.698 -2.387 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.874 -0.326 -2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.903 -1.209 -0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.532 -0.144 -0.921 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.237 -0.936 -3.831 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.106 -0.800 -2.671 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.128 -2.306 -3.590 1.00 0.00 H new ATOM 1266 N ALA A 82 0.360 -5.095 0.816 1.00 0.00 N ATOM 1267 CA ALA A 82 1.002 -6.393 1.056 1.00 0.00 C ATOM 1268 C ALA A 82 0.242 -7.309 2.031 1.00 0.00 C ATOM 1269 O ALA A 82 0.344 -8.533 1.932 1.00 0.00 O ATOM 1270 CB ALA A 82 2.387 -6.079 1.624 1.00 0.00 C ATOM 0 H ALA A 82 0.885 -4.292 1.163 1.00 0.00 H new ATOM 0 HA ALA A 82 1.031 -6.945 0.116 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.918 -7.010 1.825 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.951 -5.488 0.902 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.281 -5.515 2.551 1.00 0.00 H new ATOM 1276 N ASP A 83 -0.488 -6.739 2.991 1.00 0.00 N ATOM 1277 CA ASP A 83 -1.101 -7.564 4.055 1.00 0.00 C ATOM 1278 C ASP A 83 -2.321 -8.405 3.621 1.00 0.00 C ATOM 1279 O ASP A 83 -2.792 -9.269 4.362 1.00 0.00 O ATOM 1280 CB ASP A 83 -1.436 -6.651 5.242 1.00 0.00 C ATOM 1281 CG ASP A 83 -1.832 -7.417 6.502 1.00 0.00 C ATOM 1282 OD1 ASP A 83 -0.940 -7.991 7.164 1.00 0.00 O ATOM 1283 OD2 ASP A 83 -3.036 -7.449 6.835 1.00 0.00 O ATOM 0 H ASP A 83 -0.671 -5.738 3.062 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.365 -8.317 4.336 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -0.573 -6.023 5.463 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.251 -5.984 4.960 1.00 0.00 H new ATOM 1288 N SER A 84 -2.822 -8.159 2.420 1.00 0.00 N ATOM 1289 CA SER A 84 -4.003 -8.865 1.909 1.00 0.00 C ATOM 1290 C SER A 84 -3.680 -9.902 0.817 1.00 0.00 C ATOM 1291 O SER A 84 -4.491 -10.165 -0.072 1.00 0.00 O ATOM 1292 CB SER A 84 -4.909 -7.774 1.343 1.00 0.00 C ATOM 1293 OG SER A 84 -5.428 -6.960 2.387 1.00 0.00 O ATOM 0 H SER A 84 -2.432 -7.474 1.773 1.00 0.00 H new ATOM 0 HA SER A 84 -4.465 -9.439 2.712 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.349 -7.158 0.639 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.729 -8.228 0.787 1.00 0.00 H new ATOM 0 HG SER A 84 -6.363 -7.201 2.556 1.00 0.00 H new ATOM 1299 N LEU A 85 -2.492 -10.489 0.881 1.00 0.00 N ATOM 1300 CA LEU A 85 -1.988 -11.318 -0.213 1.00 0.00 C ATOM 1301 C LEU A 85 -1.403 -12.619 0.347 1.00 0.00 C ATOM 1302 O LEU A 85 -1.052 -12.725 1.524 1.00 0.00 O ATOM 1303 CB LEU A 85 -0.869 -10.510 -0.883 1.00 0.00 C ATOM 1304 CG LEU A 85 -1.278 -9.171 -1.520 1.00 0.00 C ATOM 1305 CD1 LEU A 85 -0.043 -8.499 -2.124 1.00 0.00 C ATOM 1306 CD2 LEU A 85 -2.328 -9.357 -2.622 1.00 0.00 C ATOM 0 H LEU A 85 -1.858 -10.408 1.676 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.783 -11.572 -0.915 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.098 -10.312 -0.138 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.415 -11.131 -1.655 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.713 -8.551 -0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.330 -7.550 -2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.693 -8.320 -1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.388 -9.148 -2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.588 -8.386 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.923 -9.997 -3.406 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.220 -9.820 -2.200 1.00 0.00 H new ATOM 1318 N LYS A 86 -1.246 -13.600 -0.533 1.00 0.00 N ATOM 1319 CA LYS A 86 -0.497 -14.818 -0.188 1.00 0.00 C ATOM 1320 C LYS A 86 0.877 -14.763 -0.899 1.00 0.00 C ATOM 1321 O LYS A 86 1.131 -13.835 -1.668 1.00 0.00 O ATOM 1322 CB LYS A 86 -1.355 -16.018 -0.628 1.00 0.00 C ATOM 1323 CG LYS A 86 -2.633 -16.159 0.206 1.00 0.00 C ATOM 1324 CD LYS A 86 -3.462 -17.367 -0.238 1.00 0.00 C ATOM 1325 CE LYS A 86 -4.743 -17.490 0.590 1.00 0.00 C ATOM 1326 NZ LYS A 86 -5.522 -18.661 0.155 1.00 0.00 N ATOM 0 H LYS A 86 -1.620 -13.585 -1.482 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.302 -14.910 0.880 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.621 -15.905 -1.679 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.767 -16.932 -0.544 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.372 -16.263 1.259 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.231 -15.252 0.114 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.716 -17.270 -1.294 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.870 -18.276 -0.135 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -4.493 -17.583 1.647 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.342 -16.586 0.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -6.389 -18.733 0.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.775 -18.556 -0.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.953 -19.522 0.280 1.00 0.00 H new ATOM 1340 N PRO A 87 1.799 -15.711 -0.670 1.00 0.00 N ATOM 1341 CA PRO A 87 3.188 -15.591 -1.157 1.00 0.00 C ATOM 1342 C PRO A 87 3.424 -15.433 -2.672 1.00 0.00 C ATOM 1343 O PRO A 87 4.534 -15.092 -3.082 1.00 0.00 O ATOM 1344 CB PRO A 87 3.813 -16.895 -0.655 1.00 0.00 C ATOM 1345 CG PRO A 87 3.075 -17.194 0.644 1.00 0.00 C ATOM 1346 CD PRO A 87 1.648 -16.706 0.397 1.00 0.00 C ATOM 0 HA PRO A 87 3.614 -14.657 -0.791 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.686 -17.701 -1.378 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.884 -16.783 -0.487 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.095 -18.259 0.876 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.531 -16.676 1.487 1.00 0.00 H new ATOM 0 HD2 PRO A 87 0.993 -17.522 0.093 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.214 -16.267 1.295 1.00 0.00 H new ATOM 1354 N ASN A 88 2.411 -15.658 -3.510 1.00 0.00 N ATOM 1355 CA ASN A 88 2.529 -15.308 -4.943 1.00 0.00 C ATOM 1356 C ASN A 88 1.784 -13.995 -5.245 1.00 0.00 C ATOM 1357 O ASN A 88 1.069 -13.883 -6.244 1.00 0.00 O ATOM 1358 CB ASN A 88 2.020 -16.463 -5.836 1.00 0.00 C ATOM 1359 CG ASN A 88 2.722 -17.793 -5.557 1.00 0.00 C ATOM 1360 OD1 ASN A 88 2.177 -18.684 -4.907 1.00 0.00 O ATOM 1361 ND2 ASN A 88 3.941 -17.942 -6.042 1.00 0.00 N ATOM 0 H ASN A 88 1.518 -16.070 -3.240 1.00 0.00 H new ATOM 0 HA ASN A 88 3.583 -15.154 -5.173 1.00 0.00 H new ATOM 0 HB2 ASN A 88 0.948 -16.586 -5.684 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.165 -16.196 -6.883 1.00 0.00 H new ATOM 0 HD21 ASN A 88 4.451 -18.810 -5.881 1.00 0.00 H new ATOM 0 HD22 ASN A 88 4.372 -17.189 -6.578 1.00 0.00 H new ATOM 1368 N GLY A 89 1.995 -12.975 -4.412 1.00 0.00 N ATOM 1369 CA GLY A 89 1.472 -11.637 -4.711 1.00 0.00 C ATOM 1370 C GLY A 89 2.357 -10.989 -5.760 1.00 0.00 C ATOM 1371 O GLY A 89 3.572 -11.151 -5.716 1.00 0.00 O ATOM 0 H GLY A 89 2.516 -13.045 -3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.446 -11.705 -5.073 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.452 -11.029 -3.807 1.00 0.00 H new ATOM 1375 N SER A 90 1.783 -10.270 -6.711 1.00 0.00 N ATOM 1376 CA SER A 90 2.614 -9.687 -7.773 1.00 0.00 C ATOM 1377 C SER A 90 1.977 -8.353 -8.160 1.00 0.00 C ATOM 1378 O SER A 90 0.929 -8.281 -8.802 1.00 0.00 O ATOM 1379 CB SER A 90 2.747 -10.666 -8.937 1.00 0.00 C ATOM 1380 OG SER A 90 3.376 -10.043 -10.048 1.00 0.00 O ATOM 0 H SER A 90 0.784 -10.076 -6.778 1.00 0.00 H new ATOM 0 HA SER A 90 3.634 -9.499 -7.439 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.327 -11.534 -8.624 1.00 0.00 H new ATOM 0 HB3 SER A 90 1.761 -11.029 -9.228 1.00 0.00 H new ATOM 0 HG SER A 90 3.454 -10.686 -10.783 1.00 0.00 H new ATOM 1386 N LEU A 91 2.640 -7.292 -7.726 1.00 0.00 N ATOM 1387 CA LEU A 91 2.157 -5.932 -7.898 1.00 0.00 C ATOM 1388 C LEU A 91 2.708 -5.434 -9.231 1.00 0.00 C ATOM 1389 O LEU A 91 3.910 -5.513 -9.479 1.00 0.00 O ATOM 1390 CB LEU A 91 2.767 -5.212 -6.690 1.00 0.00 C ATOM 1391 CG LEU A 91 2.358 -3.751 -6.573 1.00 0.00 C ATOM 1392 CD1 LEU A 91 1.900 -3.434 -5.151 1.00 0.00 C ATOM 1393 CD2 LEU A 91 3.517 -2.812 -6.919 1.00 0.00 C ATOM 0 H LEU A 91 3.535 -7.352 -7.241 1.00 0.00 H new ATOM 0 HA LEU A 91 1.076 -5.794 -7.931 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.473 -5.736 -5.780 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.853 -5.271 -6.755 1.00 0.00 H new ATOM 0 HG LEU A 91 1.542 -3.594 -7.279 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.612 -2.385 -5.087 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.046 -4.061 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.715 -3.629 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.188 -1.777 -6.824 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.348 -2.992 -6.236 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.842 -2.997 -7.943 1.00 0.00 H new ATOM 1405 N ILE A 92 1.843 -4.886 -10.074 1.00 0.00 N ATOM 1406 CA ILE A 92 2.314 -4.199 -11.282 1.00 0.00 C ATOM 1407 C ILE A 92 2.197 -2.709 -11.057 1.00 0.00 C ATOM 1408 O ILE A 92 1.138 -2.099 -11.218 1.00 0.00 O ATOM 1409 CB ILE A 92 1.487 -4.630 -12.491 1.00 0.00 C ATOM 1410 CG1 ILE A 92 1.540 -6.141 -12.731 1.00 0.00 C ATOM 1411 CG2 ILE A 92 1.920 -3.882 -13.762 1.00 0.00 C ATOM 1412 CD1 ILE A 92 2.984 -6.620 -12.706 1.00 0.00 C ATOM 0 H ILE A 92 0.830 -4.899 -9.953 1.00 0.00 H new ATOM 0 HA ILE A 92 3.354 -4.459 -11.481 1.00 0.00 H new ATOM 0 HB ILE A 92 0.455 -4.368 -12.260 1.00 0.00 H new ATOM 0 HG12 ILE A 92 0.963 -6.660 -11.966 1.00 0.00 H new ATOM 0 HG13 ILE A 92 1.085 -6.381 -13.692 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.311 -4.212 -14.604 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.787 -2.810 -13.617 1.00 0.00 H new ATOM 0 HG23 ILE A 92 2.969 -4.092 -13.968 1.00 0.00 H new ATOM 0 HD11 ILE A 92 3.013 -7.696 -12.877 1.00 0.00 H new ATOM 0 HD12 ILE A 92 3.549 -6.112 -13.488 1.00 0.00 H new ATOM 0 HD13 ILE A 92 3.425 -6.395 -11.735 1.00 0.00 H new ATOM 1424 N GLY A 93 3.288 -2.174 -10.552 1.00 0.00 N ATOM 1425 CA GLY A 93 3.180 -0.860 -9.929 1.00 0.00 C ATOM 1426 C GLY A 93 4.306 0.158 -10.058 1.00 0.00 C ATOM 1427 O GLY A 93 4.307 0.956 -10.996 1.00 0.00 O ATOM 0 H GLY A 93 4.217 -2.596 -10.554 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.278 -0.392 -10.323 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.016 -1.023 -8.864 1.00 0.00 H new ATOM 1431 N LEU A 94 5.213 0.233 -9.085 1.00 0.00 N ATOM 1432 CA LEU A 94 5.723 1.564 -8.716 1.00 0.00 C ATOM 1433 C LEU A 94 7.230 1.645 -9.039 1.00 0.00 C ATOM 1434 O LEU A 94 7.859 0.661 -9.430 1.00 0.00 O ATOM 1435 CB LEU A 94 5.561 1.794 -7.193 1.00 0.00 C ATOM 1436 CG LEU A 94 4.287 1.470 -6.410 1.00 0.00 C ATOM 1437 CD1 LEU A 94 3.036 1.530 -7.228 1.00 0.00 C ATOM 1438 CD2 LEU A 94 4.397 0.184 -5.601 1.00 0.00 C ATOM 0 H LEU A 94 5.595 -0.555 -8.562 1.00 0.00 H new ATOM 0 HA LEU A 94 5.163 2.314 -9.274 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.364 1.234 -6.713 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.763 2.851 -7.022 1.00 0.00 H new ATOM 0 HG LEU A 94 4.193 2.281 -5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.179 1.288 -6.600 1.00 0.00 H new ATOM 0 HD12 LEU A 94 2.915 2.534 -7.635 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.101 0.812 -8.046 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.463 0.008 -5.068 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.595 -0.652 -6.272 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.213 0.274 -4.883 1.00 0.00 H new ATOM 1450 N SER A 95 7.792 2.853 -8.962 1.00 0.00 N ATOM 1451 CA SER A 95 9.053 3.134 -9.691 1.00 0.00 C ATOM 1452 C SER A 95 10.228 3.509 -8.765 1.00 0.00 C ATOM 1453 O SER A 95 10.697 2.659 -8.007 1.00 0.00 O ATOM 1454 CB SER A 95 8.795 4.137 -10.830 1.00 0.00 C ATOM 1455 OG SER A 95 9.905 4.147 -11.719 1.00 0.00 O ATOM 0 H SER A 95 7.418 3.635 -8.425 1.00 0.00 H new ATOM 0 HA SER A 95 9.389 2.206 -10.154 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.887 3.865 -11.369 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.636 5.134 -10.420 1.00 0.00 H new ATOM 0 HG SER A 95 10.476 4.918 -11.521 1.00 0.00 H new ATOM 1461 N ASP A 96 10.788 4.718 -8.884 1.00 0.00 N ATOM 1462 CA ASP A 96 12.183 4.932 -8.436 1.00 0.00 C ATOM 1463 C ASP A 96 12.390 4.987 -6.915 1.00 0.00 C ATOM 1464 O ASP A 96 13.201 4.219 -6.393 1.00 0.00 O ATOM 1465 CB ASP A 96 12.785 6.172 -9.122 1.00 0.00 C ATOM 1466 CG ASP A 96 12.821 6.045 -10.643 1.00 0.00 C ATOM 1467 OD1 ASP A 96 13.729 5.366 -11.171 1.00 0.00 O ATOM 1468 OD2 ASP A 96 11.942 6.625 -11.318 1.00 0.00 O ATOM 0 H ASP A 96 10.324 5.540 -9.271 1.00 0.00 H new ATOM 0 HA ASP A 96 12.719 4.035 -8.748 1.00 0.00 H new ATOM 0 HB2 ASP A 96 12.203 7.052 -8.849 1.00 0.00 H new ATOM 0 HB3 ASP A 96 13.797 6.332 -8.751 1.00 0.00 H new ATOM 1473 N ILE A 97 11.680 5.842 -6.178 1.00 0.00 N ATOM 1474 CA ILE A 97 11.723 5.757 -4.690 1.00 0.00 C ATOM 1475 C ILE A 97 11.202 4.385 -4.189 1.00 0.00 C ATOM 1476 O ILE A 97 11.581 3.826 -3.149 1.00 0.00 O ATOM 1477 CB ILE A 97 10.863 6.874 -4.047 1.00 0.00 C ATOM 1478 CG1 ILE A 97 10.922 8.207 -4.808 1.00 0.00 C ATOM 1479 CG2 ILE A 97 11.233 7.069 -2.570 1.00 0.00 C ATOM 1480 CD1 ILE A 97 12.300 8.875 -4.816 1.00 0.00 C ATOM 0 H ILE A 97 11.085 6.580 -6.554 1.00 0.00 H new ATOM 0 HA ILE A 97 12.765 5.878 -4.395 1.00 0.00 H new ATOM 0 HB ILE A 97 9.829 6.535 -4.111 1.00 0.00 H new ATOM 0 HG12 ILE A 97 10.609 8.037 -5.838 1.00 0.00 H new ATOM 0 HG13 ILE A 97 10.202 8.895 -4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 97 10.615 7.858 -2.141 1.00 0.00 H new ATOM 0 HG22 ILE A 97 11.063 6.140 -2.027 1.00 0.00 H new ATOM 0 HG23 ILE A 97 12.284 7.348 -2.492 1.00 0.00 H new ATOM 0 HD11 ILE A 97 12.248 9.809 -5.375 1.00 0.00 H new ATOM 0 HD12 ILE A 97 12.610 9.082 -3.792 1.00 0.00 H new ATOM 0 HD13 ILE A 97 13.024 8.210 -5.287 1.00 0.00 H new ATOM 1492 N TYR A 98 10.301 3.841 -4.994 1.00 0.00 N ATOM 1493 CA TYR A 98 9.581 2.638 -4.627 1.00 0.00 C ATOM 1494 C TYR A 98 10.452 1.369 -4.786 1.00 0.00 C ATOM 1495 O TYR A 98 10.076 0.296 -4.326 1.00 0.00 O ATOM 1496 CB TYR A 98 8.322 2.611 -5.472 1.00 0.00 C ATOM 1497 CG TYR A 98 7.457 3.847 -5.240 1.00 0.00 C ATOM 1498 CD1 TYR A 98 6.651 3.911 -4.145 1.00 0.00 C ATOM 1499 CD2 TYR A 98 7.540 4.914 -6.080 1.00 0.00 C ATOM 1500 CE1 TYR A 98 5.881 5.009 -3.929 1.00 0.00 C ATOM 1501 CE2 TYR A 98 6.772 6.012 -5.863 1.00 0.00 C ATOM 1502 CZ TYR A 98 5.938 6.058 -4.791 1.00 0.00 C ATOM 1503 OH TYR A 98 5.177 7.173 -4.560 1.00 0.00 O ATOM 0 H TYR A 98 10.053 4.218 -5.909 1.00 0.00 H new ATOM 0 HA TYR A 98 9.315 2.647 -3.570 1.00 0.00 H new ATOM 0 HB2 TYR A 98 8.593 2.550 -6.526 1.00 0.00 H new ATOM 0 HB3 TYR A 98 7.746 1.715 -5.238 1.00 0.00 H new ATOM 0 HD1 TYR A 98 6.624 3.087 -3.447 1.00 0.00 H new ATOM 0 HD2 TYR A 98 8.218 4.887 -6.920 1.00 0.00 H new ATOM 0 HE1 TYR A 98 5.224 5.048 -3.073 1.00 0.00 H new ATOM 0 HE2 TYR A 98 6.824 6.850 -6.543 1.00 0.00 H new ATOM 0 HH TYR A 98 5.336 7.830 -5.270 1.00 0.00 H new ATOM 1513 N LYS A 99 11.636 1.486 -5.399 1.00 0.00 N ATOM 1514 CA LYS A 99 12.593 0.371 -5.464 1.00 0.00 C ATOM 1515 C LYS A 99 13.092 -0.026 -4.062 1.00 0.00 C ATOM 1516 O LYS A 99 12.945 -1.173 -3.631 1.00 0.00 O ATOM 1517 CB LYS A 99 13.746 0.819 -6.380 1.00 0.00 C ATOM 1518 CG LYS A 99 14.732 -0.308 -6.696 1.00 0.00 C ATOM 1519 CD LYS A 99 15.907 0.204 -7.533 1.00 0.00 C ATOM 1520 CE LYS A 99 16.878 -0.929 -7.870 1.00 0.00 C ATOM 1521 NZ LYS A 99 17.996 -0.417 -8.679 1.00 0.00 N ATOM 0 H LYS A 99 11.956 2.340 -5.857 1.00 0.00 H new ATOM 0 HA LYS A 99 12.117 -0.522 -5.869 1.00 0.00 H new ATOM 0 HB2 LYS A 99 13.333 1.205 -7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 99 14.282 1.640 -5.905 1.00 0.00 H new ATOM 0 HG2 LYS A 99 15.105 -0.740 -5.767 1.00 0.00 H new ATOM 0 HG3 LYS A 99 14.218 -1.104 -7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 99 15.534 0.653 -8.453 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.433 0.987 -6.987 1.00 0.00 H new ATOM 0 HE2 LYS A 99 17.259 -1.376 -6.952 1.00 0.00 H new ATOM 0 HE3 LYS A 99 16.356 -1.715 -8.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 18.649 -1.196 -8.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 17.628 -0.011 -9.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 18.503 0.318 -8.145 1.00 0.00 H new ATOM 1535 N VAL A 100 13.649 0.939 -3.334 1.00 0.00 N ATOM 1536 CA VAL A 100 14.019 0.710 -1.923 1.00 0.00 C ATOM 1537 C VAL A 100 12.778 0.423 -1.052 1.00 0.00 C ATOM 1538 O VAL A 100 12.861 -0.338 -0.085 1.00 0.00 O ATOM 1539 CB VAL A 100 14.812 1.924 -1.393 1.00 0.00 C ATOM 1540 CG1 VAL A 100 15.249 1.726 0.064 1.00 0.00 C ATOM 1541 CG2 VAL A 100 16.071 2.189 -2.232 1.00 0.00 C ATOM 0 H VAL A 100 13.855 1.875 -3.682 1.00 0.00 H new ATOM 0 HA VAL A 100 14.653 -0.175 -1.867 1.00 0.00 H new ATOM 0 HB VAL A 100 14.135 2.775 -1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 100 15.804 2.602 0.400 1.00 0.00 H new ATOM 0 HG12 VAL A 100 14.369 1.591 0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 100 15.885 0.844 0.136 1.00 0.00 H new ATOM 0 HG21 VAL A 100 16.603 3.051 -1.828 1.00 0.00 H new ATOM 0 HG22 VAL A 100 16.721 1.314 -2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 100 15.785 2.390 -3.264 1.00 0.00 H new ATOM 1551 N ASP A 101 11.622 0.996 -1.392 1.00 0.00 N ATOM 1552 CA ASP A 101 10.378 0.634 -0.694 1.00 0.00 C ATOM 1553 C ASP A 101 10.004 -0.846 -0.889 1.00 0.00 C ATOM 1554 O ASP A 101 9.689 -1.527 0.083 1.00 0.00 O ATOM 1555 CB ASP A 101 9.268 1.525 -1.248 1.00 0.00 C ATOM 1556 CG ASP A 101 8.701 2.506 -0.231 1.00 0.00 C ATOM 1557 OD1 ASP A 101 8.034 2.061 0.728 1.00 0.00 O ATOM 1558 OD2 ASP A 101 8.914 3.727 -0.390 1.00 0.00 O ATOM 0 H ASP A 101 11.516 1.696 -2.127 1.00 0.00 H new ATOM 0 HA ASP A 101 10.516 0.781 0.377 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.655 2.083 -2.101 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.460 0.894 -1.620 1.00 0.00 H new ATOM 1563 N ALA A 102 10.061 -1.352 -2.125 1.00 0.00 N ATOM 1564 CA ALA A 102 9.857 -2.788 -2.389 1.00 0.00 C ATOM 1565 C ALA A 102 10.810 -3.660 -1.561 1.00 0.00 C ATOM 1566 O ALA A 102 10.412 -4.688 -1.016 1.00 0.00 O ATOM 1567 CB ALA A 102 10.168 -3.019 -3.868 1.00 0.00 C ATOM 0 H ALA A 102 10.246 -0.794 -2.959 1.00 0.00 H new ATOM 0 HA ALA A 102 8.835 -3.058 -2.125 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.029 -4.073 -4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.497 -2.416 -4.479 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.200 -2.733 -4.072 1.00 0.00 H new ATOM 1573 N LEU A 103 12.072 -3.240 -1.459 1.00 0.00 N ATOM 1574 CA LEU A 103 13.064 -4.015 -0.696 1.00 0.00 C ATOM 1575 C LEU A 103 12.725 -4.122 0.803 1.00 0.00 C ATOM 1576 O LEU A 103 12.841 -5.196 1.393 1.00 0.00 O ATOM 1577 CB LEU A 103 14.435 -3.351 -0.903 1.00 0.00 C ATOM 1578 CG LEU A 103 15.619 -4.147 -0.328 1.00 0.00 C ATOM 1579 CD1 LEU A 103 15.810 -5.483 -1.054 1.00 0.00 C ATOM 1580 CD2 LEU A 103 16.899 -3.315 -0.446 1.00 0.00 C ATOM 0 H LEU A 103 12.431 -2.385 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 103 13.066 -5.041 -1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 103 14.596 -3.204 -1.971 1.00 0.00 H new ATOM 0 HB3 LEU A 103 14.420 -2.363 -0.443 1.00 0.00 H new ATOM 0 HG LEU A 103 15.403 -4.361 0.719 1.00 0.00 H new ATOM 0 HD11 LEU A 103 16.656 -6.016 -0.619 1.00 0.00 H new ATOM 0 HD12 LEU A 103 14.908 -6.086 -0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 103 16.002 -5.299 -2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 103 17.738 -3.879 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 103 17.090 -3.087 -1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 103 16.782 -2.386 0.111 1.00 0.00 H new ATOM 1592 N ILE A 104 12.334 -3.011 1.427 1.00 0.00 N ATOM 1593 CA ILE A 104 12.097 -3.010 2.885 1.00 0.00 C ATOM 1594 C ILE A 104 10.720 -3.598 3.255 1.00 0.00 C ATOM 1595 O ILE A 104 10.591 -4.281 4.271 1.00 0.00 O ATOM 1596 CB ILE A 104 12.321 -1.581 3.428 1.00 0.00 C ATOM 1597 CG1 ILE A 104 13.785 -1.149 3.209 1.00 0.00 C ATOM 1598 CG2 ILE A 104 11.970 -1.481 4.921 1.00 0.00 C ATOM 1599 CD1 ILE A 104 14.034 0.325 3.532 1.00 0.00 C ATOM 0 H ILE A 104 12.175 -2.115 0.966 1.00 0.00 H new ATOM 0 HA ILE A 104 12.814 -3.673 3.368 1.00 0.00 H new ATOM 0 HB ILE A 104 11.658 -0.914 2.878 1.00 0.00 H new ATOM 0 HG12 ILE A 104 14.435 -1.765 3.830 1.00 0.00 H new ATOM 0 HG13 ILE A 104 14.062 -1.339 2.172 1.00 0.00 H new ATOM 0 HG21 ILE A 104 12.140 -0.462 5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 104 10.922 -1.744 5.067 1.00 0.00 H new ATOM 0 HG23 ILE A 104 12.598 -2.167 5.489 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.083 0.564 3.357 1.00 0.00 H new ATOM 0 HD12 ILE A 104 13.408 0.948 2.893 1.00 0.00 H new ATOM 0 HD13 ILE A 104 13.788 0.515 4.577 1.00 0.00 H new ATOM 1611 N ASN A 105 9.697 -3.378 2.431 1.00 0.00 N ATOM 1612 CA ASN A 105 8.365 -3.925 2.675 1.00 0.00 C ATOM 1613 C ASN A 105 8.254 -5.439 2.459 1.00 0.00 C ATOM 1614 O ASN A 105 7.276 -6.036 2.912 1.00 0.00 O ATOM 1615 CB ASN A 105 7.478 -3.164 1.676 1.00 0.00 C ATOM 1616 CG ASN A 105 6.841 -1.917 2.287 1.00 0.00 C ATOM 1617 OD1 ASN A 105 5.805 -1.984 2.947 1.00 0.00 O ATOM 1618 ND2 ASN A 105 7.448 -0.763 2.077 1.00 0.00 N ATOM 0 H ASN A 105 9.768 -2.819 1.581 1.00 0.00 H new ATOM 0 HA ASN A 105 8.079 -3.797 3.719 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.076 -2.876 0.811 1.00 0.00 H new ATOM 0 HB3 ASN A 105 6.693 -3.828 1.314 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.059 0.096 2.465 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.306 -0.731 1.527 1.00 0.00 H new ATOM 1625 N GLY A 106 9.215 -6.079 1.793 1.00 0.00 N ATOM 1626 CA GLY A 106 9.123 -7.533 1.606 1.00 0.00 C ATOM 1627 C GLY A 106 8.697 -7.917 0.189 1.00 0.00 C ATOM 1628 O GLY A 106 8.155 -9.001 -0.025 1.00 0.00 O ATOM 0 H GLY A 106 10.039 -5.637 1.386 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.090 -7.986 1.826 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.409 -7.943 2.320 1.00 0.00 H new ATOM 1632 N PHE A 107 9.010 -7.069 -0.785 1.00 0.00 N ATOM 1633 CA PHE A 107 8.782 -7.424 -2.189 1.00 0.00 C ATOM 1634 C PHE A 107 10.161 -7.712 -2.780 1.00 0.00 C ATOM 1635 O PHE A 107 11.189 -7.229 -2.300 1.00 0.00 O ATOM 1636 CB PHE A 107 8.135 -6.280 -2.996 1.00 0.00 C ATOM 1637 CG PHE A 107 6.737 -5.874 -2.549 1.00 0.00 C ATOM 1638 CD1 PHE A 107 6.561 -4.908 -1.607 1.00 0.00 C ATOM 1639 CD2 PHE A 107 5.647 -6.433 -3.150 1.00 0.00 C ATOM 1640 CE1 PHE A 107 5.309 -4.528 -1.243 1.00 0.00 C ATOM 1641 CE2 PHE A 107 4.395 -6.053 -2.784 1.00 0.00 C ATOM 1642 CZ PHE A 107 4.227 -5.104 -1.827 1.00 0.00 C ATOM 0 H PHE A 107 9.416 -6.145 -0.637 1.00 0.00 H new ATOM 0 HA PHE A 107 8.100 -8.273 -2.240 1.00 0.00 H new ATOM 0 HB2 PHE A 107 8.784 -5.406 -2.939 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.091 -6.577 -4.044 1.00 0.00 H new ATOM 0 HD1 PHE A 107 7.420 -4.442 -1.147 1.00 0.00 H new ATOM 0 HD2 PHE A 107 5.780 -7.180 -3.919 1.00 0.00 H new ATOM 0 HE1 PHE A 107 5.174 -3.767 -0.489 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.534 -6.505 -3.254 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.232 -4.807 -1.530 1.00 0.00 H new ATOM 1652 N GLU A 108 10.176 -8.442 -3.886 1.00 0.00 N ATOM 1653 CA GLU A 108 11.368 -8.432 -4.729 1.00 0.00 C ATOM 1654 C GLU A 108 10.906 -7.882 -6.070 1.00 0.00 C ATOM 1655 O GLU A 108 9.762 -8.059 -6.485 1.00 0.00 O ATOM 1656 CB GLU A 108 11.917 -9.856 -4.906 1.00 0.00 C ATOM 1657 CG GLU A 108 12.406 -10.468 -3.590 1.00 0.00 C ATOM 1658 CD GLU A 108 12.995 -11.855 -3.818 1.00 0.00 C ATOM 1659 OE1 GLU A 108 12.225 -12.840 -3.847 1.00 0.00 O ATOM 1660 OE2 GLU A 108 14.231 -11.968 -3.964 1.00 0.00 O ATOM 0 H GLU A 108 9.409 -9.029 -4.214 1.00 0.00 H new ATOM 0 HA GLU A 108 12.166 -7.833 -4.290 1.00 0.00 H new ATOM 0 HB2 GLU A 108 11.139 -10.491 -5.330 1.00 0.00 H new ATOM 0 HB3 GLU A 108 12.739 -9.838 -5.621 1.00 0.00 H new ATOM 0 HG2 GLU A 108 13.158 -9.819 -3.140 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.577 -10.532 -2.885 1.00 0.00 H new ATOM 1667 N ILE A 109 11.839 -7.294 -6.791 1.00 0.00 N ATOM 1668 CA ILE A 109 11.489 -6.625 -8.035 1.00 0.00 C ATOM 1669 C ILE A 109 11.910 -7.500 -9.214 1.00 0.00 C ATOM 1670 O ILE A 109 12.878 -8.260 -9.173 1.00 0.00 O ATOM 1671 CB ILE A 109 12.190 -5.262 -7.948 1.00 0.00 C ATOM 1672 CG1 ILE A 109 11.446 -4.313 -7.001 1.00 0.00 C ATOM 1673 CG2 ILE A 109 12.238 -4.532 -9.274 1.00 0.00 C ATOM 1674 CD1 ILE A 109 12.338 -3.231 -6.407 1.00 0.00 C ATOM 0 H ILE A 109 12.829 -7.263 -6.546 1.00 0.00 H new ATOM 0 HA ILE A 109 10.422 -6.466 -8.188 1.00 0.00 H new ATOM 0 HB ILE A 109 13.196 -5.498 -7.600 1.00 0.00 H new ATOM 0 HG12 ILE A 109 10.626 -3.841 -7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 109 11.002 -4.893 -6.192 1.00 0.00 H new ATOM 0 HG21 ILE A 109 12.746 -3.576 -9.145 1.00 0.00 H new ATOM 0 HG22 ILE A 109 12.780 -5.135 -10.002 1.00 0.00 H new ATOM 0 HG23 ILE A 109 11.223 -4.358 -9.631 1.00 0.00 H new ATOM 0 HD11 ILE A 109 11.748 -2.595 -5.747 1.00 0.00 H new ATOM 0 HD12 ILE A 109 13.144 -3.695 -5.839 1.00 0.00 H new ATOM 0 HD13 ILE A 109 12.761 -2.627 -7.210 1.00 0.00 H new ATOM 1686 N ILE A 110 11.118 -7.378 -10.267 1.00 0.00 N ATOM 1687 CA ILE A 110 11.344 -8.167 -11.484 1.00 0.00 C ATOM 1688 C ILE A 110 11.059 -7.249 -12.666 1.00 0.00 C ATOM 1689 O ILE A 110 9.990 -6.643 -12.791 1.00 0.00 O ATOM 1690 CB ILE A 110 10.527 -9.474 -11.493 1.00 0.00 C ATOM 1691 CG1 ILE A 110 10.714 -10.254 -12.805 1.00 0.00 C ATOM 1692 CG2 ILE A 110 9.032 -9.248 -11.206 1.00 0.00 C ATOM 1693 CD1 ILE A 110 10.215 -11.698 -12.714 1.00 0.00 C ATOM 0 H ILE A 110 10.317 -6.748 -10.312 1.00 0.00 H new ATOM 0 HA ILE A 110 12.376 -8.513 -11.540 1.00 0.00 H new ATOM 0 HB ILE A 110 10.922 -10.077 -10.676 1.00 0.00 H new ATOM 0 HG12 ILE A 110 10.182 -9.741 -13.606 1.00 0.00 H new ATOM 0 HG13 ILE A 110 11.770 -10.256 -13.074 1.00 0.00 H new ATOM 0 HG21 ILE A 110 8.509 -10.204 -11.226 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.915 -8.791 -10.223 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.611 -8.589 -11.965 1.00 0.00 H new ATOM 0 HD11 ILE A 110 10.373 -12.198 -13.669 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.764 -12.224 -11.933 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.152 -11.701 -12.474 1.00 0.00 H new ATOM 1705 N ASN A 111 12.079 -7.130 -13.507 1.00 0.00 N ATOM 1706 CA ASN A 111 12.053 -6.118 -14.564 1.00 0.00 C ATOM 1707 C ASN A 111 12.039 -6.771 -15.943 1.00 0.00 C ATOM 1708 O ASN A 111 13.029 -7.280 -16.474 1.00 0.00 O ATOM 1709 CB ASN A 111 13.230 -5.164 -14.428 1.00 0.00 C ATOM 1710 CG ASN A 111 13.158 -3.972 -15.384 1.00 0.00 C ATOM 1711 OD1 ASN A 111 12.239 -3.158 -15.333 1.00 0.00 O ATOM 1712 ND2 ASN A 111 14.132 -3.852 -16.268 1.00 0.00 N ATOM 0 H ASN A 111 12.920 -7.707 -13.483 1.00 0.00 H new ATOM 0 HA ASN A 111 11.135 -5.540 -14.456 1.00 0.00 H new ATOM 0 HB2 ASN A 111 13.274 -4.796 -13.403 1.00 0.00 H new ATOM 0 HB3 ASN A 111 14.155 -5.711 -14.610 1.00 0.00 H new ATOM 0 HD21 ASN A 111 14.131 -3.072 -16.926 1.00 0.00 H new ATOM 0 HD22 ASN A 111 14.885 -4.539 -16.293 1.00 0.00 H new ATOM 1719 N GLU A 112 10.829 -6.791 -16.446 1.00 0.00 N ATOM 1720 CA GLU A 112 10.477 -7.535 -17.665 1.00 0.00 C ATOM 1721 C GLU A 112 9.627 -6.577 -18.523 1.00 0.00 C ATOM 1722 O GLU A 112 9.367 -5.447 -18.098 1.00 0.00 O ATOM 1723 CB GLU A 112 9.694 -8.798 -17.259 1.00 0.00 C ATOM 1724 CG GLU A 112 10.561 -9.867 -16.581 1.00 0.00 C ATOM 1725 CD GLU A 112 11.593 -10.464 -17.531 1.00 0.00 C ATOM 1726 OE1 GLU A 112 11.210 -11.257 -18.418 1.00 0.00 O ATOM 1727 OE2 GLU A 112 12.795 -10.144 -17.395 1.00 0.00 O ATOM 0 H GLU A 112 10.043 -6.292 -16.029 1.00 0.00 H new ATOM 0 HA GLU A 112 11.348 -7.861 -18.234 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.888 -8.514 -16.583 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.229 -9.228 -18.146 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.071 -9.428 -15.724 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.921 -10.662 -16.198 1.00 0.00 H new ATOM 1734 N PRO A 113 9.118 -6.966 -19.700 1.00 0.00 N ATOM 1735 CA PRO A 113 8.226 -6.077 -20.471 1.00 0.00 C ATOM 1736 C PRO A 113 6.957 -5.531 -19.781 1.00 0.00 C ATOM 1737 O PRO A 113 6.286 -4.641 -20.304 1.00 0.00 O ATOM 1738 CB PRO A 113 7.923 -6.932 -21.698 1.00 0.00 C ATOM 1739 CG PRO A 113 9.202 -7.742 -21.907 1.00 0.00 C ATOM 1740 CD PRO A 113 9.694 -8.064 -20.495 1.00 0.00 C ATOM 0 HA PRO A 113 8.717 -5.123 -20.665 1.00 0.00 H new ATOM 0 HB2 PRO A 113 7.063 -7.580 -21.531 1.00 0.00 H new ATOM 0 HB3 PRO A 113 7.694 -6.316 -22.567 1.00 0.00 H new ATOM 0 HG2 PRO A 113 9.006 -8.652 -22.475 1.00 0.00 H new ATOM 0 HG3 PRO A 113 9.945 -7.172 -22.465 1.00 0.00 H new ATOM 0 HD2 PRO A 113 9.343 -9.039 -20.155 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.782 -8.079 -20.438 1.00 0.00 H new ATOM 1748 N ASP A 114 6.681 -6.020 -18.581 1.00 0.00 N ATOM 1749 CA ASP A 114 5.767 -5.336 -17.656 1.00 0.00 C ATOM 1750 C ASP A 114 6.422 -5.346 -16.273 1.00 0.00 C ATOM 1751 O ASP A 114 6.711 -6.393 -15.692 1.00 0.00 O ATOM 1752 CB ASP A 114 4.376 -5.959 -17.691 1.00 0.00 C ATOM 1753 CG ASP A 114 3.409 -5.388 -16.660 1.00 0.00 C ATOM 1754 OD1 ASP A 114 3.199 -4.154 -16.647 1.00 0.00 O ATOM 1755 OD2 ASP A 114 2.848 -6.172 -15.865 1.00 0.00 O ATOM 0 H ASP A 114 7.074 -6.888 -18.218 1.00 0.00 H new ATOM 0 HA ASP A 114 5.605 -4.299 -17.952 1.00 0.00 H new ATOM 0 HB2 ASP A 114 3.953 -5.820 -18.686 1.00 0.00 H new ATOM 0 HB3 ASP A 114 4.467 -7.033 -17.531 1.00 0.00 H new ATOM 1760 N TYR A 115 6.737 -4.146 -15.808 1.00 0.00 N ATOM 1761 CA TYR A 115 7.614 -3.993 -14.636 1.00 0.00 C ATOM 1762 C TYR A 115 6.814 -4.048 -13.332 1.00 0.00 C ATOM 1763 O TYR A 115 5.908 -3.228 -13.156 1.00 0.00 O ATOM 1764 CB TYR A 115 8.331 -2.643 -14.755 1.00 0.00 C ATOM 1765 CG TYR A 115 9.153 -2.266 -13.528 1.00 0.00 C ATOM 1766 CD1 TYR A 115 10.056 -3.136 -13.002 1.00 0.00 C ATOM 1767 CD2 TYR A 115 8.953 -1.062 -12.930 1.00 0.00 C ATOM 1768 CE1 TYR A 115 10.824 -2.768 -11.946 1.00 0.00 C ATOM 1769 CE2 TYR A 115 9.716 -0.693 -11.867 1.00 0.00 C ATOM 1770 CZ TYR A 115 10.666 -1.539 -11.386 1.00 0.00 C ATOM 1771 OH TYR A 115 11.420 -1.177 -10.300 1.00 0.00 O ATOM 0 H TYR A 115 6.408 -3.269 -16.212 1.00 0.00 H new ATOM 0 HA TYR A 115 8.333 -4.812 -14.612 1.00 0.00 H new ATOM 0 HB2 TYR A 115 8.987 -2.667 -15.625 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.590 -1.865 -14.936 1.00 0.00 H new ATOM 0 HD1 TYR A 115 10.162 -4.123 -13.426 1.00 0.00 H new ATOM 0 HD2 TYR A 115 8.187 -0.397 -13.300 1.00 0.00 H new ATOM 0 HE1 TYR A 115 11.561 -3.451 -11.550 1.00 0.00 H new ATOM 0 HE2 TYR A 115 9.568 0.272 -11.405 1.00 0.00 H new ATOM 0 HH TYR A 115 11.182 -0.267 -10.026 1.00 0.00 H new ATOM 1781 N CYS A 116 7.037 -5.069 -12.491 1.00 0.00 N ATOM 1782 CA CYS A 116 6.516 -5.033 -11.102 1.00 0.00 C ATOM 1783 C CYS A 116 7.405 -5.753 -10.081 1.00 0.00 C ATOM 1784 O CYS A 116 8.599 -5.972 -10.278 1.00 0.00 O ATOM 1785 CB CYS A 116 5.099 -5.655 -11.061 1.00 0.00 C ATOM 1786 SG CYS A 116 5.176 -7.375 -11.614 1.00 0.00 S ATOM 0 H CYS A 116 7.559 -5.912 -12.732 1.00 0.00 H new ATOM 0 HA CYS A 116 6.498 -3.981 -10.816 1.00 0.00 H new ATOM 0 HB2 CYS A 116 4.698 -5.605 -10.049 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.423 -5.087 -11.700 1.00 0.00 H new ATOM 0 HG CYS A 116 4.421 -8.110 -10.852 1.00 0.00 H new ATOM 1792 N TRP A 117 6.751 -6.115 -8.963 1.00 0.00 N ATOM 1793 CA TRP A 117 7.408 -6.673 -7.773 1.00 0.00 C ATOM 1794 C TRP A 117 6.530 -7.827 -7.296 1.00 0.00 C ATOM 1795 O TRP A 117 5.330 -7.626 -7.105 1.00 0.00 O ATOM 1796 CB TRP A 117 7.446 -5.699 -6.588 1.00 0.00 C ATOM 1797 CG TRP A 117 7.775 -4.273 -6.912 1.00 0.00 C ATOM 1798 CD1 TRP A 117 8.444 -3.791 -8.020 1.00 0.00 C ATOM 1799 CD2 TRP A 117 7.493 -3.191 -6.152 1.00 0.00 C ATOM 1800 NE1 TRP A 117 8.595 -2.414 -7.976 1.00 0.00 N ATOM 1801 CE2 TRP A 117 8.005 -2.076 -6.766 1.00 0.00 C ATOM 1802 CE3 TRP A 117 6.878 -3.126 -4.949 1.00 0.00 C ATOM 1803 CZ2 TRP A 117 8.039 -0.895 -6.098 1.00 0.00 C ATOM 1804 CZ3 TRP A 117 6.789 -1.921 -4.350 1.00 0.00 C ATOM 1805 CH2 TRP A 117 7.442 -0.843 -4.867 1.00 0.00 C ATOM 0 H TRP A 117 5.740 -6.026 -8.862 1.00 0.00 H new ATOM 0 HA TRP A 117 8.427 -6.937 -8.054 1.00 0.00 H new ATOM 0 HB2 TRP A 117 6.475 -5.722 -6.094 1.00 0.00 H new ATOM 0 HB3 TRP A 117 8.178 -6.064 -5.868 1.00 0.00 H new ATOM 0 HD1 TRP A 117 8.806 -4.413 -8.825 1.00 0.00 H new ATOM 0 HE1 TRP A 117 9.032 -1.800 -8.663 1.00 0.00 H new ATOM 0 HE3 TRP A 117 6.471 -4.011 -4.483 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 8.520 -0.026 -6.523 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.196 -1.810 -3.454 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.490 0.071 -4.294 1.00 0.00 H new ATOM 1816 N ILE A 118 7.076 -9.005 -7.039 1.00 0.00 N ATOM 1817 CA ILE A 118 6.277 -10.014 -6.328 1.00 0.00 C ATOM 1818 C ILE A 118 6.798 -10.112 -4.884 1.00 0.00 C ATOM 1819 O ILE A 118 7.996 -10.081 -4.606 1.00 0.00 O ATOM 1820 CB ILE A 118 6.218 -11.330 -7.133 1.00 0.00 C ATOM 1821 CG1 ILE A 118 5.983 -12.593 -6.293 1.00 0.00 C ATOM 1822 CG2 ILE A 118 7.431 -11.602 -8.016 1.00 0.00 C ATOM 1823 CD1 ILE A 118 5.091 -13.540 -7.082 1.00 0.00 C ATOM 0 H ILE A 118 8.023 -9.287 -7.294 1.00 0.00 H new ATOM 0 HA ILE A 118 5.228 -9.728 -6.246 1.00 0.00 H new ATOM 0 HB ILE A 118 5.347 -11.140 -7.760 1.00 0.00 H new ATOM 0 HG12 ILE A 118 6.933 -13.074 -6.059 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.514 -12.334 -5.344 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.295 -12.548 -8.540 1.00 0.00 H new ATOM 0 HG22 ILE A 118 7.540 -10.797 -8.743 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.327 -11.656 -7.397 1.00 0.00 H new ATOM 0 HD11 ILE A 118 4.914 -14.444 -6.499 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.139 -13.052 -7.293 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.580 -13.804 -8.020 1.00 0.00 H new ATOM 1835 N LYS A 119 5.850 -10.329 -3.979 1.00 0.00 N ATOM 1836 CA LYS A 119 6.156 -10.453 -2.547 1.00 0.00 C ATOM 1837 C LYS A 119 6.506 -11.908 -2.215 1.00 0.00 C ATOM 1838 O LYS A 119 5.641 -12.784 -2.224 1.00 0.00 O ATOM 1839 CB LYS A 119 4.931 -9.987 -1.745 1.00 0.00 C ATOM 1840 CG LYS A 119 5.219 -9.844 -0.247 1.00 0.00 C ATOM 1841 CD LYS A 119 3.933 -9.755 0.578 1.00 0.00 C ATOM 1842 CE LYS A 119 4.265 -9.676 2.071 1.00 0.00 C ATOM 1843 NZ LYS A 119 3.034 -9.665 2.876 1.00 0.00 N ATOM 0 H LYS A 119 4.860 -10.424 -4.206 1.00 0.00 H new ATOM 0 HA LYS A 119 7.014 -9.833 -2.287 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.589 -9.029 -2.137 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.118 -10.699 -1.887 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.809 -10.696 0.092 1.00 0.00 H new ATOM 0 HG3 LYS A 119 5.821 -8.951 -0.077 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.361 -8.877 0.279 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.307 -10.626 0.383 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.885 -10.526 2.357 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.846 -8.776 2.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.197 -9.128 3.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.268 -9.217 2.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 2.765 -10.641 3.113 1.00 0.00 H new ATOM 1857 N MET A 120 7.773 -12.157 -1.901 1.00 0.00 N ATOM 1858 CA MET A 120 8.169 -13.472 -1.364 1.00 0.00 C ATOM 1859 C MET A 120 8.661 -13.380 0.082 1.00 0.00 C ATOM 1860 O MET A 120 8.232 -14.132 0.956 1.00 0.00 O ATOM 1861 CB MET A 120 9.236 -14.118 -2.262 1.00 0.00 C ATOM 1862 CG MET A 120 8.719 -14.423 -3.669 1.00 0.00 C ATOM 1863 SD MET A 120 10.019 -15.225 -4.622 1.00 0.00 S ATOM 1864 CE MET A 120 9.166 -15.406 -6.198 1.00 0.00 C ATOM 0 H MET A 120 8.536 -11.487 -2.003 1.00 0.00 H new ATOM 0 HA MET A 120 7.281 -14.104 -1.360 1.00 0.00 H new ATOM 0 HB2 MET A 120 10.097 -13.453 -2.332 1.00 0.00 H new ATOM 0 HB3 MET A 120 9.584 -15.042 -1.799 1.00 0.00 H new ATOM 0 HG2 MET A 120 7.842 -15.068 -3.614 1.00 0.00 H new ATOM 0 HG3 MET A 120 8.407 -13.502 -4.162 1.00 0.00 H new ATOM 0 HE1 MET A 120 9.828 -15.889 -6.917 1.00 0.00 H new ATOM 0 HE2 MET A 120 8.273 -16.015 -6.060 1.00 0.00 H new ATOM 0 HE3 MET A 120 8.880 -14.423 -6.572 1.00 0.00 H new