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 Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot -94:sc= 0.785 USER MOD Single : A 12 HIS : no HD1:sc= -0.723 K(o=-0.72,f=-1.6) USER MOD Single : A 16 THR OG1 : rot -113:sc= -0.123 USER MOD Single : A 17 THR OG1 : rot 58:sc= 1.28 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 THR OG1 : rot 91:sc= -0.103 USER MOD Single : A 26 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.129) USER MOD Single : A 28 GLN : amide:sc= -1.08 K(o=-1.1,f=0) USER MOD Single : A 31 SER OG : rot -75:sc= 0.179 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+ -117:sc= 0 (180deg=-0.657) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.04 USER MOD Single : A 54 ASN : amide:sc=-0.00652 K(o=-0.0065,f=-1.3) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 15:sc= -0.132 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HE2:sc= -0.728 K(o=-0.73,f=-1.8!) USER MOD Single : A 62 TYR OH : rot -152:sc= -0.691 USER MOD Single : A 64 THR OG1 : rot 71:sc= 0.058 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 -24:sc= 1.07 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00645 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 90 SER OG : rot -60:sc= 0.571 USER MOD Single : A 95 SER OG : rot 180:sc= 0 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= -0.297 X(o=-0.3,f=-0.3) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 115 TYR OH : rot -136:sc= -0.163 USER MOD Single : A 116 CYS SG : rot 153:sc= -11.4! USER MOD Single : A 119 LYS NZ :NH3+ -152:sc= 0.0898 (180deg=0.00557) USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 4 -8.904 -19.445 -13.102 1.00 0.00 N ATOM 2 CA TYR A 4 -9.331 -18.065 -13.376 1.00 0.00 C ATOM 3 C TYR A 4 -9.078 -17.229 -12.122 1.00 0.00 C ATOM 4 O TYR A 4 -9.563 -17.534 -11.031 1.00 0.00 O ATOM 5 CB TYR A 4 -10.811 -18.051 -13.771 1.00 0.00 C ATOM 6 CG TYR A 4 -11.208 -16.804 -14.545 1.00 0.00 C ATOM 7 CD1 TYR A 4 -11.475 -15.639 -13.893 1.00 0.00 C ATOM 8 CD2 TYR A 4 -11.283 -16.849 -15.903 1.00 0.00 C ATOM 9 CE1 TYR A 4 -11.808 -14.527 -14.596 1.00 0.00 C ATOM 10 CE2 TYR A 4 -11.615 -15.734 -16.606 1.00 0.00 C ATOM 11 CZ TYR A 4 -11.880 -14.572 -15.952 1.00 0.00 C ATOM 12 OH TYR A 4 -12.201 -13.446 -16.661 1.00 0.00 O ATOM 0 HA TYR A 4 -8.766 -17.641 -14.206 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -11.028 -18.932 -14.376 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -11.422 -18.123 -12.871 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -11.422 -15.600 -12.815 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -11.078 -17.773 -16.423 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -12.016 -13.604 -14.076 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -11.668 -15.771 -17.684 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.207 -13.653 -17.619 1.00 0.00 H new ATOM 22 N LYS A 5 -8.251 -16.206 -12.275 1.00 0.00 N ATOM 23 CA LYS A 5 -7.685 -15.525 -11.109 1.00 0.00 C ATOM 24 C LYS A 5 -8.501 -14.292 -10.719 1.00 0.00 C ATOM 25 O LYS A 5 -8.964 -13.519 -11.558 1.00 0.00 O ATOM 26 CB LYS A 5 -6.253 -15.109 -11.470 1.00 0.00 C ATOM 27 CG LYS A 5 -5.302 -16.304 -11.599 1.00 0.00 C ATOM 28 CD LYS A 5 -3.882 -15.850 -11.934 1.00 0.00 C ATOM 29 CE LYS A 5 -2.940 -17.047 -12.072 1.00 0.00 C ATOM 30 NZ LYS A 5 -1.578 -16.593 -12.389 1.00 0.00 N ATOM 0 H LYS A 5 -7.957 -15.830 -13.177 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.699 -16.200 -10.253 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.266 -14.558 -12.410 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -5.874 -14.429 -10.707 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.295 -16.868 -10.666 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.664 -16.977 -12.376 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -3.889 -15.280 -12.863 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.516 -15.183 -11.153 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.933 -17.621 -11.145 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.300 -17.713 -12.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.950 -17.417 -12.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.588 -16.065 -13.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.232 -15.976 -11.627 1.00 0.00 H new ATOM 44 N THR A 6 -8.618 -14.095 -9.411 1.00 0.00 N ATOM 45 CA THR A 6 -9.104 -12.812 -8.876 1.00 0.00 C ATOM 46 C THR A 6 -7.879 -11.952 -8.556 1.00 0.00 C ATOM 47 O THR A 6 -6.863 -12.434 -8.054 1.00 0.00 O ATOM 48 CB THR A 6 -9.983 -12.996 -7.617 1.00 0.00 C ATOM 49 OG1 THR A 6 -9.826 -11.896 -6.729 1.00 0.00 O ATOM 50 CG2 THR A 6 -9.712 -14.284 -6.835 1.00 0.00 C ATOM 0 H THR A 6 -8.388 -14.792 -8.703 1.00 0.00 H new ATOM 0 HA THR A 6 -9.738 -12.329 -9.620 1.00 0.00 H new ATOM 0 HB THR A 6 -11.002 -13.057 -7.999 1.00 0.00 H new ATOM 0 HG1 THR A 6 -9.137 -12.108 -6.065 1.00 0.00 H new ATOM 0 HG21 THR A 6 -10.373 -14.330 -5.969 1.00 0.00 H new ATOM 0 HG22 THR A 6 -9.896 -15.145 -7.477 1.00 0.00 H new ATOM 0 HG23 THR A 6 -8.675 -14.295 -6.501 1.00 0.00 H new ATOM 58 N GLY A 7 -8.006 -10.658 -8.828 1.00 0.00 N ATOM 59 CA GLY A 7 -6.991 -9.718 -8.342 1.00 0.00 C ATOM 60 C GLY A 7 -7.552 -8.460 -7.685 1.00 0.00 C ATOM 61 O GLY A 7 -8.659 -8.423 -7.150 1.00 0.00 O ATOM 0 H GLY A 7 -8.770 -10.243 -9.362 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.352 -10.233 -7.624 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.357 -9.423 -9.179 1.00 0.00 H new ATOM 65 N LEU A 8 -6.695 -7.445 -7.667 1.00 0.00 N ATOM 66 CA LEU A 8 -6.993 -6.194 -6.978 1.00 0.00 C ATOM 67 C LEU A 8 -6.598 -5.079 -7.939 1.00 0.00 C ATOM 68 O LEU A 8 -5.552 -5.154 -8.590 1.00 0.00 O ATOM 69 CB LEU A 8 -6.083 -6.106 -5.745 1.00 0.00 C ATOM 70 CG LEU A 8 -6.797 -5.684 -4.464 1.00 0.00 C ATOM 71 CD1 LEU A 8 -5.696 -5.428 -3.432 1.00 0.00 C ATOM 72 CD2 LEU A 8 -7.697 -4.456 -4.645 1.00 0.00 C ATOM 0 H LEU A 8 -5.783 -7.464 -8.124 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.040 -6.126 -6.681 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.616 -7.077 -5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.281 -5.397 -5.950 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.479 -6.470 -4.142 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.146 -5.121 -2.488 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.121 -6.341 -3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.036 -4.639 -3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.173 -4.211 -3.696 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.096 -3.610 -4.978 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.463 -4.673 -5.390 1.00 0.00 H new ATOM 84 N LEU A 9 -7.391 -4.021 -8.016 1.00 0.00 N ATOM 85 CA LEU A 9 -6.989 -2.879 -8.821 1.00 0.00 C ATOM 86 C LEU A 9 -7.022 -1.659 -7.873 1.00 0.00 C ATOM 87 O LEU A 9 -7.999 -1.407 -7.168 1.00 0.00 O ATOM 88 CB LEU A 9 -7.972 -2.978 -9.998 1.00 0.00 C ATOM 89 CG LEU A 9 -7.721 -2.161 -11.266 1.00 0.00 C ATOM 90 CD1 LEU A 9 -9.047 -1.515 -11.628 1.00 0.00 C ATOM 91 CD2 LEU A 9 -6.663 -1.079 -11.146 1.00 0.00 C ATOM 0 H LEU A 9 -8.291 -3.929 -7.546 1.00 0.00 H new ATOM 0 HA LEU A 9 -5.989 -2.814 -9.249 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -8.024 -4.027 -10.291 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -8.958 -2.703 -9.623 1.00 0.00 H new ATOM 0 HG LEU A 9 -7.336 -2.844 -12.024 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.926 -0.916 -12.531 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.793 -2.290 -11.804 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -9.375 -0.875 -10.809 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.563 -0.560 -12.099 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.956 -0.367 -10.374 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -5.708 -1.532 -10.878 1.00 0.00 H new ATOM 103 N LEU A 10 -5.920 -0.914 -7.872 1.00 0.00 N ATOM 104 CA LEU A 10 -5.757 0.273 -7.001 1.00 0.00 C ATOM 105 C LEU A 10 -5.727 1.493 -7.927 1.00 0.00 C ATOM 106 O LEU A 10 -4.894 1.581 -8.828 1.00 0.00 O ATOM 107 CB LEU A 10 -4.461 0.290 -6.141 1.00 0.00 C ATOM 108 CG LEU A 10 -4.458 -0.409 -4.776 1.00 0.00 C ATOM 109 CD1 LEU A 10 -4.863 0.578 -3.677 1.00 0.00 C ATOM 110 CD2 LEU A 10 -5.272 -1.703 -4.753 1.00 0.00 C ATOM 0 H LEU A 10 -5.113 -1.104 -8.466 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.583 0.266 -6.290 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.665 -0.155 -6.739 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.191 1.333 -5.976 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.437 -0.733 -4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.857 0.071 -2.712 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.157 1.408 -3.655 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -5.864 0.959 -3.881 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.226 -2.144 -3.757 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.310 -1.485 -5.006 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -4.861 -2.404 -5.480 1.00 0.00 H new ATOM 122 N ILE A 11 -6.669 2.411 -7.738 1.00 0.00 N ATOM 123 CA ILE A 11 -6.832 3.517 -8.698 1.00 0.00 C ATOM 124 C ILE A 11 -6.748 4.857 -7.959 1.00 0.00 C ATOM 125 O ILE A 11 -7.355 5.033 -6.903 1.00 0.00 O ATOM 126 CB ILE A 11 -8.205 3.446 -9.409 1.00 0.00 C ATOM 127 CG1 ILE A 11 -8.674 2.022 -9.771 1.00 0.00 C ATOM 128 CG2 ILE A 11 -8.146 4.289 -10.685 1.00 0.00 C ATOM 129 CD1 ILE A 11 -10.124 1.992 -10.262 1.00 0.00 C ATOM 0 H ILE A 11 -7.320 2.421 -6.953 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.038 3.431 -9.440 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.934 3.829 -8.695 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.023 1.614 -10.544 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.576 1.377 -8.898 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.109 4.246 -11.194 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.917 5.323 -10.428 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.370 3.899 -11.343 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.405 0.967 -10.504 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.781 2.374 -9.480 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -10.220 2.614 -11.152 1.00 0.00 H new ATOM 141 N HIS A 12 -6.087 5.846 -8.556 1.00 0.00 N ATOM 142 CA HIS A 12 -6.321 7.235 -8.144 1.00 0.00 C ATOM 143 C HIS A 12 -7.312 7.853 -9.158 1.00 0.00 C ATOM 144 O HIS A 12 -7.089 7.749 -10.366 1.00 0.00 O ATOM 145 CB HIS A 12 -4.972 7.957 -8.154 1.00 0.00 C ATOM 146 CG HIS A 12 -5.021 9.477 -8.163 1.00 0.00 C ATOM 147 ND1 HIS A 12 -5.697 10.284 -7.256 1.00 0.00 N ATOM 148 CD2 HIS A 12 -4.429 10.246 -9.175 1.00 0.00 C ATOM 149 CE1 HIS A 12 -5.428 11.502 -7.831 1.00 0.00 C ATOM 150 NE2 HIS A 12 -4.666 11.583 -8.961 1.00 0.00 N ATOM 0 H HIS A 12 -5.405 5.723 -9.304 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.746 7.315 -7.143 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.407 7.638 -7.278 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.414 7.628 -9.031 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -3.866 9.845 -10.005 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.823 12.403 -7.386 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -4.361 12.399 -9.492 1.00 0.00 H new ATOM 158 N PRO A 13 -8.399 8.497 -8.718 1.00 0.00 N ATOM 159 CA PRO A 13 -9.485 8.920 -9.622 1.00 0.00 C ATOM 160 C PRO A 13 -9.240 9.905 -10.773 1.00 0.00 C ATOM 161 O PRO A 13 -10.181 10.189 -11.512 1.00 0.00 O ATOM 162 CB PRO A 13 -10.401 9.634 -8.632 1.00 0.00 C ATOM 163 CG PRO A 13 -10.298 8.811 -7.360 1.00 0.00 C ATOM 164 CD PRO A 13 -8.817 8.449 -7.306 1.00 0.00 C ATOM 0 HA PRO A 13 -9.803 8.035 -10.172 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.082 10.663 -8.466 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.427 9.674 -8.998 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.606 9.381 -6.484 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.929 7.923 -7.401 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.253 9.155 -6.696 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.661 7.460 -6.875 1.00 0.00 H new ATOM 172 N ALA A 14 -8.102 10.582 -10.840 1.00 0.00 N ATOM 173 CA ALA A 14 -8.056 11.822 -11.642 1.00 0.00 C ATOM 174 C ALA A 14 -8.387 11.711 -13.137 1.00 0.00 C ATOM 175 O ALA A 14 -9.246 12.450 -13.617 1.00 0.00 O ATOM 176 CB ALA A 14 -6.676 12.460 -11.499 1.00 0.00 C ATOM 0 H ALA A 14 -7.231 10.321 -10.378 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.862 12.428 -11.228 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -6.636 13.376 -12.089 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.491 12.695 -10.451 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.915 11.765 -11.855 1.00 0.00 H new ATOM 182 N VAL A 15 -7.775 10.787 -13.872 1.00 0.00 N ATOM 183 CA VAL A 15 -8.231 10.521 -15.249 1.00 0.00 C ATOM 184 C VAL A 15 -9.204 9.314 -15.311 1.00 0.00 C ATOM 185 O VAL A 15 -10.110 9.281 -16.143 1.00 0.00 O ATOM 186 CB VAL A 15 -7.032 10.324 -16.204 1.00 0.00 C ATOM 187 CG1 VAL A 15 -7.491 10.139 -17.656 1.00 0.00 C ATOM 188 CG2 VAL A 15 -6.078 11.527 -16.165 1.00 0.00 C ATOM 0 H VAL A 15 -6.986 10.221 -13.558 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.785 11.398 -15.583 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.517 9.427 -15.860 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.621 10.003 -18.298 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.134 9.261 -17.725 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.045 11.021 -17.978 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.247 11.354 -16.848 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.614 12.427 -16.466 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.695 11.655 -15.153 1.00 0.00 H new ATOM 198 N THR A 16 -9.052 8.348 -14.400 1.00 0.00 N ATOM 199 CA THR A 16 -10.022 7.251 -14.222 1.00 0.00 C ATOM 200 C THR A 16 -11.450 7.566 -13.730 1.00 0.00 C ATOM 201 O THR A 16 -12.269 6.647 -13.688 1.00 0.00 O ATOM 202 CB THR A 16 -9.374 6.230 -13.276 1.00 0.00 C ATOM 203 OG1 THR A 16 -8.991 6.870 -12.067 1.00 0.00 O ATOM 204 CG2 THR A 16 -8.153 5.550 -13.906 1.00 0.00 C ATOM 0 H THR A 16 -8.256 8.300 -13.764 1.00 0.00 H new ATOM 0 HA THR A 16 -10.214 6.899 -15.236 1.00 0.00 H new ATOM 0 HB THR A 16 -10.115 5.457 -13.073 1.00 0.00 H new ATOM 0 HG1 THR A 16 -8.014 6.874 -11.994 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.729 4.837 -13.199 1.00 0.00 H new ATOM 0 HG22 THR A 16 -8.456 5.026 -14.813 1.00 0.00 H new ATOM 0 HG23 THR A 16 -7.405 6.303 -14.154 1.00 0.00 H new ATOM 212 N THR A 17 -11.826 8.816 -13.462 1.00 0.00 N ATOM 213 CA THR A 17 -13.253 9.100 -13.208 1.00 0.00 C ATOM 214 C THR A 17 -14.084 9.116 -14.513 1.00 0.00 C ATOM 215 O THR A 17 -15.312 9.039 -14.452 1.00 0.00 O ATOM 216 CB THR A 17 -13.363 10.438 -12.453 1.00 0.00 C ATOM 217 OG1 THR A 17 -12.751 10.301 -11.179 1.00 0.00 O ATOM 218 CG2 THR A 17 -14.806 10.890 -12.218 1.00 0.00 C ATOM 0 H THR A 17 -11.201 9.621 -13.414 1.00 0.00 H new ATOM 0 HA THR A 17 -13.670 8.300 -12.596 1.00 0.00 H new ATOM 0 HB THR A 17 -12.872 11.184 -13.078 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.815 10.033 -11.293 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.807 11.839 -11.681 1.00 0.00 H new ATOM 0 HG22 THR A 17 -15.309 11.015 -13.177 1.00 0.00 H new ATOM 0 HG23 THR A 17 -15.331 10.139 -11.628 1.00 0.00 H new ATOM 226 N THR A 18 -13.453 9.094 -15.690 1.00 0.00 N ATOM 227 CA THR A 18 -14.199 8.755 -16.913 1.00 0.00 C ATOM 228 C THR A 18 -13.914 7.253 -17.209 1.00 0.00 C ATOM 229 O THR A 18 -13.001 6.673 -16.615 1.00 0.00 O ATOM 230 CB THR A 18 -13.558 9.735 -17.934 1.00 0.00 C ATOM 231 OG1 THR A 18 -13.761 11.069 -17.481 1.00 0.00 O ATOM 232 CG2 THR A 18 -14.045 9.697 -19.385 1.00 0.00 C ATOM 0 H THR A 18 -12.463 9.298 -15.826 1.00 0.00 H new ATOM 0 HA THR A 18 -15.284 8.857 -16.897 1.00 0.00 H new ATOM 0 HB THR A 18 -12.521 9.401 -17.967 1.00 0.00 H new ATOM 0 HG1 THR A 18 -13.358 11.696 -18.118 1.00 0.00 H new ATOM 0 HG21 THR A 18 -13.502 10.439 -19.971 1.00 0.00 H new ATOM 0 HG22 THR A 18 -13.869 8.705 -19.802 1.00 0.00 H new ATOM 0 HG23 THR A 18 -15.112 9.920 -19.417 1.00 0.00 H new ATOM 240 N PRO A 19 -14.628 6.571 -18.117 1.00 0.00 N ATOM 241 CA PRO A 19 -14.482 5.099 -18.240 1.00 0.00 C ATOM 242 C PRO A 19 -13.245 4.563 -18.982 1.00 0.00 C ATOM 243 O PRO A 19 -13.110 3.347 -19.110 1.00 0.00 O ATOM 244 CB PRO A 19 -15.791 4.640 -18.897 1.00 0.00 C ATOM 245 CG PRO A 19 -16.433 5.908 -19.449 1.00 0.00 C ATOM 246 CD PRO A 19 -16.002 6.974 -18.450 1.00 0.00 C ATOM 0 HA PRO A 19 -14.305 4.686 -17.247 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -15.600 3.918 -19.691 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -16.444 4.152 -18.173 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -16.081 6.133 -20.456 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -17.518 5.820 -19.503 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -16.037 7.973 -18.884 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -16.645 6.987 -17.570 1.00 0.00 H new ATOM 254 N GLU A 20 -12.380 5.403 -19.544 1.00 0.00 N ATOM 255 CA GLU A 20 -11.451 4.906 -20.577 1.00 0.00 C ATOM 256 C GLU A 20 -10.298 4.045 -20.037 1.00 0.00 C ATOM 257 O GLU A 20 -10.074 2.938 -20.532 1.00 0.00 O ATOM 258 CB GLU A 20 -10.880 6.084 -21.375 1.00 0.00 C ATOM 259 CG GLU A 20 -11.935 6.800 -22.225 1.00 0.00 C ATOM 260 CD GLU A 20 -11.334 7.991 -22.961 1.00 0.00 C ATOM 261 OE1 GLU A 20 -10.836 7.811 -24.093 1.00 0.00 O ATOM 262 OE2 GLU A 20 -11.357 9.112 -22.409 1.00 0.00 O ATOM 0 H GLU A 20 -12.296 6.394 -19.320 1.00 0.00 H new ATOM 0 HA GLU A 20 -12.044 4.251 -21.215 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -10.431 6.799 -20.686 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -10.082 5.723 -22.024 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -12.361 6.101 -22.945 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -12.752 7.138 -21.587 1.00 0.00 H new ATOM 269 N LEU A 21 -9.572 4.512 -19.019 1.00 0.00 N ATOM 270 CA LEU A 21 -8.486 3.696 -18.445 1.00 0.00 C ATOM 271 C LEU A 21 -9.010 2.464 -17.687 1.00 0.00 C ATOM 272 O LEU A 21 -8.366 1.413 -17.679 1.00 0.00 O ATOM 273 CB LEU A 21 -7.632 4.573 -17.516 1.00 0.00 C ATOM 274 CG LEU A 21 -6.827 5.662 -18.242 1.00 0.00 C ATOM 275 CD1 LEU A 21 -6.205 6.610 -17.214 1.00 0.00 C ATOM 276 CD2 LEU A 21 -5.719 5.060 -19.112 1.00 0.00 C ATOM 0 H LEU A 21 -9.705 5.424 -18.581 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.879 3.320 -19.269 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.284 5.047 -16.782 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.942 3.934 -16.964 1.00 0.00 H new ATOM 0 HG LEU A 21 -7.511 6.207 -18.893 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.634 7.382 -17.730 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.994 7.076 -16.624 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.543 6.048 -16.555 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -5.172 5.861 -19.609 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.035 4.488 -18.485 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -6.161 4.403 -19.861 1.00 0.00 H new ATOM 288 N VAL A 22 -10.183 2.584 -17.068 1.00 0.00 N ATOM 289 CA VAL A 22 -10.812 1.428 -16.402 1.00 0.00 C ATOM 290 C VAL A 22 -11.246 0.376 -17.442 1.00 0.00 C ATOM 291 O VAL A 22 -10.939 -0.802 -17.276 1.00 0.00 O ATOM 292 CB VAL A 22 -11.968 1.939 -15.517 1.00 0.00 C ATOM 293 CG1 VAL A 22 -12.932 0.833 -15.071 1.00 0.00 C ATOM 294 CG2 VAL A 22 -11.404 2.612 -14.258 1.00 0.00 C ATOM 0 H VAL A 22 -10.716 3.452 -17.010 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.101 0.919 -15.752 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.527 2.643 -16.133 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.719 1.264 -14.452 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.376 0.362 -15.948 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.387 0.085 -14.495 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.226 2.970 -13.638 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.812 1.891 -13.694 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -10.774 3.453 -14.546 1.00 0.00 H new ATOM 304 N GLU A 23 -11.926 0.774 -18.519 1.00 0.00 N ATOM 305 CA GLU A 23 -12.307 -0.191 -19.571 1.00 0.00 C ATOM 306 C GLU A 23 -11.110 -0.885 -20.243 1.00 0.00 C ATOM 307 O GLU A 23 -11.204 -2.060 -20.589 1.00 0.00 O ATOM 308 CB GLU A 23 -13.136 0.505 -20.657 1.00 0.00 C ATOM 309 CG GLU A 23 -14.564 0.817 -20.201 1.00 0.00 C ATOM 310 CD GLU A 23 -15.360 1.502 -21.305 1.00 0.00 C ATOM 311 OE1 GLU A 23 -14.957 2.600 -21.749 1.00 0.00 O ATOM 312 OE2 GLU A 23 -16.394 0.948 -21.735 1.00 0.00 O ATOM 0 H GLU A 23 -12.222 1.735 -18.691 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.888 -0.960 -19.063 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -12.641 1.432 -20.948 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -13.172 -0.129 -21.543 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -15.064 -0.106 -19.908 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -14.535 1.458 -19.320 1.00 0.00 H new ATOM 319 N ASN A 24 -9.994 -0.185 -20.433 1.00 0.00 N ATOM 320 CA ASN A 24 -8.789 -0.816 -21.008 1.00 0.00 C ATOM 321 C ASN A 24 -8.164 -1.859 -20.081 1.00 0.00 C ATOM 322 O ASN A 24 -7.839 -2.973 -20.492 1.00 0.00 O ATOM 323 CB ASN A 24 -7.764 0.287 -21.252 1.00 0.00 C ATOM 324 CG ASN A 24 -6.951 0.082 -22.527 1.00 0.00 C ATOM 325 OD1 ASN A 24 -7.370 0.450 -23.624 1.00 0.00 O ATOM 326 ND2 ASN A 24 -5.775 -0.506 -22.400 1.00 0.00 N ATOM 0 H ASN A 24 -9.890 0.804 -20.204 1.00 0.00 H new ATOM 0 HA ASN A 24 -9.079 -1.330 -21.925 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.279 1.246 -21.307 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.085 0.338 -20.401 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.192 -0.664 -23.222 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.450 -0.802 -21.480 1.00 0.00 H new ATOM 333 N THR A 25 -8.008 -1.481 -18.816 1.00 0.00 N ATOM 334 CA THR A 25 -7.535 -2.416 -17.795 1.00 0.00 C ATOM 335 C THR A 25 -8.460 -3.640 -17.663 1.00 0.00 C ATOM 336 O THR A 25 -8.002 -4.785 -17.671 1.00 0.00 O ATOM 337 CB THR A 25 -7.450 -1.568 -16.520 1.00 0.00 C ATOM 338 OG1 THR A 25 -6.521 -0.512 -16.725 1.00 0.00 O ATOM 339 CG2 THR A 25 -6.982 -2.395 -15.342 1.00 0.00 C ATOM 0 H THR A 25 -8.200 -0.540 -18.472 1.00 0.00 H new ATOM 0 HA THR A 25 -6.569 -2.858 -18.039 1.00 0.00 H new ATOM 0 HB THR A 25 -8.444 -1.177 -16.304 1.00 0.00 H new ATOM 0 HG1 THR A 25 -6.992 0.275 -17.070 1.00 0.00 H new ATOM 0 HG21 THR A 25 -6.932 -1.766 -14.453 1.00 0.00 H new ATOM 0 HG22 THR A 25 -7.683 -3.212 -15.170 1.00 0.00 H new ATOM 0 HG23 THR A 25 -5.994 -2.803 -15.554 1.00 0.00 H new ATOM 347 N LYS A 26 -9.768 -3.396 -17.609 1.00 0.00 N ATOM 348 CA LYS A 26 -10.752 -4.479 -17.708 1.00 0.00 C ATOM 349 C LYS A 26 -10.672 -5.247 -19.040 1.00 0.00 C ATOM 350 O LYS A 26 -10.992 -6.433 -19.060 1.00 0.00 O ATOM 351 CB LYS A 26 -12.168 -3.906 -17.529 1.00 0.00 C ATOM 352 CG LYS A 26 -12.418 -3.289 -16.144 1.00 0.00 C ATOM 353 CD LYS A 26 -12.368 -4.295 -14.988 1.00 0.00 C ATOM 354 CE LYS A 26 -13.493 -5.329 -15.063 1.00 0.00 C ATOM 355 NZ LYS A 26 -13.454 -6.199 -13.877 1.00 0.00 N ATOM 0 H LYS A 26 -10.172 -2.466 -17.498 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.522 -5.191 -16.916 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.341 -3.146 -18.291 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.895 -4.700 -17.699 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.675 -2.511 -15.966 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.394 -2.803 -16.146 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -11.406 -4.808 -14.998 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -12.434 -3.759 -14.041 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.458 -4.826 -15.124 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -13.388 -5.928 -15.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -14.401 -6.592 -13.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.781 -6.975 -14.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -13.152 -5.645 -13.050 1.00 0.00 H new ATOM 369 N ALA A 27 -10.263 -4.624 -20.154 1.00 0.00 N ATOM 370 CA ALA A 27 -10.162 -5.371 -21.422 1.00 0.00 C ATOM 371 C ALA A 27 -9.029 -6.408 -21.433 1.00 0.00 C ATOM 372 O ALA A 27 -9.232 -7.540 -21.876 1.00 0.00 O ATOM 373 CB ALA A 27 -10.015 -4.395 -22.591 1.00 0.00 C ATOM 0 H ALA A 27 -10.004 -3.639 -20.208 1.00 0.00 H new ATOM 0 HA ALA A 27 -11.087 -5.938 -21.529 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -9.941 -4.953 -23.524 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.885 -3.739 -22.629 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -9.115 -3.796 -22.454 1.00 0.00 H new ATOM 379 N GLN A 28 -7.852 -6.046 -20.925 1.00 0.00 N ATOM 380 CA GLN A 28 -6.778 -7.039 -20.730 1.00 0.00 C ATOM 381 C GLN A 28 -7.217 -8.159 -19.776 1.00 0.00 C ATOM 382 O GLN A 28 -7.150 -9.342 -20.112 1.00 0.00 O ATOM 383 CB GLN A 28 -5.564 -6.363 -20.090 1.00 0.00 C ATOM 384 CG GLN A 28 -4.847 -5.331 -20.971 1.00 0.00 C ATOM 385 CD GLN A 28 -3.851 -4.556 -20.119 1.00 0.00 C ATOM 386 OE1 GLN A 28 -2.636 -4.673 -20.266 1.00 0.00 O ATOM 387 NE2 GLN A 28 -4.372 -3.780 -19.185 1.00 0.00 N ATOM 0 H GLN A 28 -7.613 -5.095 -20.644 1.00 0.00 H new ATOM 0 HA GLN A 28 -6.540 -7.455 -21.709 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.885 -5.872 -19.171 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.848 -7.134 -19.806 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -4.332 -5.830 -21.792 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.571 -4.649 -21.417 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.385 -3.706 -19.090 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.761 -3.255 -18.559 1.00 0.00 H new ATOM 396 N ALA A 29 -7.678 -7.766 -18.587 1.00 0.00 N ATOM 397 CA ALA A 29 -8.231 -8.730 -17.615 1.00 0.00 C ATOM 398 C ALA A 29 -9.318 -9.662 -18.208 1.00 0.00 C ATOM 399 O ALA A 29 -9.402 -10.838 -17.853 1.00 0.00 O ATOM 400 CB ALA A 29 -8.790 -7.887 -16.464 1.00 0.00 C ATOM 0 H ALA A 29 -7.683 -6.797 -18.269 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.447 -9.412 -17.286 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.217 -8.544 -15.706 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.987 -7.296 -16.022 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.564 -7.220 -16.844 1.00 0.00 H new ATOM 406 N ALA A 30 -10.155 -9.137 -19.098 1.00 0.00 N ATOM 407 CA ALA A 30 -11.347 -9.881 -19.551 1.00 0.00 C ATOM 408 C ALA A 30 -11.101 -10.847 -20.724 1.00 0.00 C ATOM 409 O ALA A 30 -11.525 -12.001 -20.652 1.00 0.00 O ATOM 410 CB ALA A 30 -12.447 -8.887 -19.931 1.00 0.00 C ATOM 0 H ALA A 30 -10.042 -8.215 -19.520 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.644 -10.509 -18.711 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.330 -9.432 -20.266 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.704 -8.279 -19.063 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.092 -8.241 -20.734 1.00 0.00 H new ATOM 416 N SER A 31 -10.387 -10.433 -21.776 1.00 0.00 N ATOM 417 CA SER A 31 -9.956 -11.386 -22.817 1.00 0.00 C ATOM 418 C SER A 31 -9.097 -12.555 -22.302 1.00 0.00 C ATOM 419 O SER A 31 -9.170 -13.657 -22.847 1.00 0.00 O ATOM 420 CB SER A 31 -9.206 -10.615 -23.911 1.00 0.00 C ATOM 421 OG SER A 31 -8.032 -10.006 -23.388 1.00 0.00 O ATOM 0 H SER A 31 -10.098 -9.467 -21.933 1.00 0.00 H new ATOM 0 HA SER A 31 -10.860 -11.852 -23.209 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.939 -11.293 -24.721 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.858 -9.852 -24.336 1.00 0.00 H new ATOM 0 HG SER A 31 -8.280 -9.221 -22.856 1.00 0.00 H new ATOM 427 N LYS A 32 -8.265 -12.325 -21.291 1.00 0.00 N ATOM 428 CA LYS A 32 -7.273 -13.327 -20.888 1.00 0.00 C ATOM 429 C LYS A 32 -7.953 -14.295 -19.907 1.00 0.00 C ATOM 430 O LYS A 32 -8.835 -15.068 -20.280 1.00 0.00 O ATOM 431 CB LYS A 32 -6.050 -12.579 -20.325 1.00 0.00 C ATOM 432 CG LYS A 32 -5.332 -11.720 -21.376 1.00 0.00 C ATOM 433 CD LYS A 32 -4.157 -10.956 -20.759 1.00 0.00 C ATOM 434 CE LYS A 32 -3.484 -10.046 -21.789 1.00 0.00 C ATOM 435 NZ LYS A 32 -2.372 -9.311 -21.168 1.00 0.00 N ATOM 0 H LYS A 32 -8.254 -11.467 -20.740 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.905 -13.937 -21.713 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.369 -11.942 -19.500 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.346 -13.303 -19.914 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.971 -12.356 -22.184 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.037 -11.015 -21.816 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.510 -10.359 -19.918 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.428 -11.663 -20.364 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -3.115 -10.641 -22.624 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.212 -9.344 -22.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.923 -8.697 -21.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.734 -8.729 -20.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.671 -9.986 -20.802 1.00 0.00 H new ATOM 449 N LYS A 33 -7.497 -14.273 -18.669 1.00 0.00 N ATOM 450 CA LYS A 33 -7.902 -15.281 -17.673 1.00 0.00 C ATOM 451 C LYS A 33 -8.188 -14.664 -16.292 1.00 0.00 C ATOM 452 O LYS A 33 -8.723 -15.321 -15.401 1.00 0.00 O ATOM 453 CB LYS A 33 -6.811 -16.358 -17.556 1.00 0.00 C ATOM 454 CG LYS A 33 -7.325 -17.696 -17.021 1.00 0.00 C ATOM 455 CD LYS A 33 -8.361 -18.309 -17.967 1.00 0.00 C ATOM 456 CE LYS A 33 -8.949 -19.597 -17.388 1.00 0.00 C ATOM 457 NZ LYS A 33 -9.900 -20.193 -18.339 1.00 0.00 N ATOM 0 H LYS A 33 -6.845 -13.573 -18.316 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.833 -15.729 -18.020 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.362 -16.517 -18.537 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.021 -15.993 -16.899 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.490 -18.385 -16.896 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.769 -17.551 -16.036 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.161 -17.591 -18.148 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -7.897 -18.520 -18.931 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -8.149 -20.305 -17.170 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -9.452 -19.384 -16.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -10.293 -21.067 -17.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.671 -19.521 -18.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -9.409 -20.413 -19.229 1.00 0.00 H new ATOM 471 N VAL A 34 -7.787 -13.415 -16.105 1.00 0.00 N ATOM 472 CA VAL A 34 -7.805 -12.780 -14.784 1.00 0.00 C ATOM 473 C VAL A 34 -8.763 -11.588 -14.803 1.00 0.00 C ATOM 474 O VAL A 34 -8.451 -10.560 -15.394 1.00 0.00 O ATOM 475 CB VAL A 34 -6.382 -12.378 -14.358 1.00 0.00 C ATOM 476 CG1 VAL A 34 -5.594 -11.548 -15.379 1.00 0.00 C ATOM 477 CG2 VAL A 34 -6.460 -11.580 -13.060 1.00 0.00 C ATOM 0 H VAL A 34 -7.442 -12.813 -16.853 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.168 -13.489 -14.040 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.841 -13.318 -14.251 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.606 -11.320 -14.978 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -5.488 -12.114 -16.304 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.127 -10.619 -15.581 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.456 -11.291 -12.750 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -7.063 -10.686 -13.218 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.917 -12.193 -12.283 1.00 0.00 H new ATOM 487 N LYS A 35 -9.891 -11.694 -14.110 1.00 0.00 N ATOM 488 CA LYS A 35 -10.745 -10.502 -13.916 1.00 0.00 C ATOM 489 C LYS A 35 -10.463 -9.911 -12.536 1.00 0.00 C ATOM 490 O LYS A 35 -10.305 -10.617 -11.539 1.00 0.00 O ATOM 491 CB LYS A 35 -12.232 -10.861 -14.075 1.00 0.00 C ATOM 492 CG LYS A 35 -13.211 -9.696 -14.255 1.00 0.00 C ATOM 493 CD LYS A 35 -14.641 -10.220 -14.415 1.00 0.00 C ATOM 494 CE LYS A 35 -15.635 -9.071 -14.598 1.00 0.00 C ATOM 495 NZ LYS A 35 -16.999 -9.596 -14.757 1.00 0.00 N ATOM 0 H LYS A 35 -10.236 -12.553 -13.683 1.00 0.00 H new ATOM 0 HA LYS A 35 -10.512 -9.759 -14.678 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.331 -11.523 -14.935 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.539 -11.430 -13.198 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.155 -9.030 -13.394 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.932 -9.110 -15.130 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -14.692 -10.889 -15.274 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.916 -10.806 -13.538 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.593 -8.404 -13.737 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.361 -8.480 -15.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.663 -8.805 -14.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.038 -10.214 -15.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.262 -10.140 -13.911 1.00 0.00 H new ATOM 509 N PHE A 36 -10.420 -8.586 -12.504 1.00 0.00 N ATOM 510 CA PHE A 36 -10.162 -7.877 -11.238 1.00 0.00 C ATOM 511 C PHE A 36 -11.524 -7.654 -10.566 1.00 0.00 C ATOM 512 O PHE A 36 -12.538 -7.389 -11.215 1.00 0.00 O ATOM 513 CB PHE A 36 -9.372 -6.559 -11.406 1.00 0.00 C ATOM 514 CG PHE A 36 -8.078 -6.651 -12.217 1.00 0.00 C ATOM 515 CD1 PHE A 36 -7.191 -7.676 -12.048 1.00 0.00 C ATOM 516 CD2 PHE A 36 -7.786 -5.662 -13.109 1.00 0.00 C ATOM 517 CE1 PHE A 36 -6.074 -7.746 -12.820 1.00 0.00 C ATOM 518 CE2 PHE A 36 -6.662 -5.729 -13.867 1.00 0.00 C ATOM 519 CZ PHE A 36 -5.812 -6.777 -13.733 1.00 0.00 C ATOM 0 H PHE A 36 -10.556 -7.983 -13.315 1.00 0.00 H new ATOM 0 HA PHE A 36 -9.511 -8.487 -10.612 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.024 -5.826 -11.881 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -9.130 -6.175 -10.415 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.377 -8.432 -11.300 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.454 -4.819 -13.213 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.393 -8.576 -12.706 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.444 -4.946 -14.578 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.929 -6.840 -14.351 1.00 0.00 H new ATOM 529 N VAL A 37 -11.545 -7.831 -9.250 1.00 0.00 N ATOM 530 CA VAL A 37 -12.817 -8.062 -8.541 1.00 0.00 C ATOM 531 C VAL A 37 -13.133 -6.991 -7.489 1.00 0.00 C ATOM 532 O VAL A 37 -14.302 -6.713 -7.216 1.00 0.00 O ATOM 533 CB VAL A 37 -12.831 -9.459 -7.885 1.00 0.00 C ATOM 534 CG1 VAL A 37 -12.717 -10.575 -8.925 1.00 0.00 C ATOM 535 CG2 VAL A 37 -11.790 -9.648 -6.776 1.00 0.00 C ATOM 0 H VAL A 37 -10.718 -7.821 -8.654 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.597 -8.001 -9.300 1.00 0.00 H new ATOM 0 HB VAL A 37 -13.804 -9.526 -7.398 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -12.730 -11.543 -8.423 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -13.556 -10.514 -9.618 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -11.783 -10.465 -9.476 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -11.870 -10.657 -6.370 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.791 -9.499 -7.186 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.968 -8.923 -5.982 1.00 0.00 H new ATOM 545 N ASP A 38 -12.101 -6.400 -6.895 1.00 0.00 N ATOM 546 CA ASP A 38 -12.310 -5.373 -5.870 1.00 0.00 C ATOM 547 C ASP A 38 -11.628 -4.079 -6.315 1.00 0.00 C ATOM 548 O ASP A 38 -10.922 -4.009 -7.324 1.00 0.00 O ATOM 549 CB ASP A 38 -11.817 -5.823 -4.484 1.00 0.00 C ATOM 550 CG ASP A 38 -12.662 -6.949 -3.895 1.00 0.00 C ATOM 551 OD1 ASP A 38 -13.869 -6.732 -3.651 1.00 0.00 O ATOM 552 OD2 ASP A 38 -12.124 -8.053 -3.669 1.00 0.00 O ATOM 0 H ASP A 38 -11.123 -6.608 -7.099 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.381 -5.200 -5.765 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.781 -6.154 -4.561 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.830 -4.971 -3.804 1.00 0.00 H new ATOM 557 N GLN A 39 -11.926 -3.024 -5.572 1.00 0.00 N ATOM 558 CA GLN A 39 -11.542 -1.675 -5.999 1.00 0.00 C ATOM 559 C GLN A 39 -11.162 -0.869 -4.783 1.00 0.00 C ATOM 560 O GLN A 39 -11.955 -0.714 -3.854 1.00 0.00 O ATOM 561 CB GLN A 39 -12.701 -0.983 -6.722 1.00 0.00 C ATOM 562 CG GLN A 39 -12.461 0.503 -7.002 1.00 0.00 C ATOM 563 CD GLN A 39 -13.488 1.066 -7.977 1.00 0.00 C ATOM 564 OE1 GLN A 39 -13.314 1.019 -9.195 1.00 0.00 O ATOM 565 NE2 GLN A 39 -14.575 1.611 -7.458 1.00 0.00 N ATOM 0 H GLN A 39 -12.424 -3.067 -4.683 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.699 -1.748 -6.687 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.884 -1.495 -7.666 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.605 -1.088 -6.122 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.503 1.061 -6.067 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.459 0.639 -7.410 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -14.698 1.639 -6.446 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.291 2.004 -8.070 1.00 0.00 H new ATOM 574 N PHE A 40 -9.959 -0.321 -4.830 1.00 0.00 N ATOM 575 CA PHE A 40 -9.517 0.563 -3.746 1.00 0.00 C ATOM 576 C PHE A 40 -9.068 1.897 -4.347 1.00 0.00 C ATOM 577 O PHE A 40 -8.070 1.976 -5.065 1.00 0.00 O ATOM 578 CB PHE A 40 -8.384 -0.074 -2.933 1.00 0.00 C ATOM 579 CG PHE A 40 -8.671 -1.371 -2.180 1.00 0.00 C ATOM 580 CD1 PHE A 40 -9.928 -1.761 -1.837 1.00 0.00 C ATOM 581 CD2 PHE A 40 -7.617 -2.171 -1.860 1.00 0.00 C ATOM 582 CE1 PHE A 40 -10.140 -2.976 -1.269 1.00 0.00 C ATOM 583 CE2 PHE A 40 -7.825 -3.369 -1.256 1.00 0.00 C ATOM 584 CZ PHE A 40 -9.089 -3.786 -0.992 1.00 0.00 C ATOM 0 H PHE A 40 -9.283 -0.462 -5.580 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.349 0.730 -3.062 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.553 -0.262 -3.613 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -8.042 0.663 -2.206 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.763 -1.100 -2.018 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.611 -1.851 -2.088 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -11.145 -3.297 -1.038 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.984 -3.990 -0.986 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.257 -4.762 -0.562 1.00 0.00 H new ATOM 594 N LEU A 41 -9.808 2.959 -4.036 1.00 0.00 N ATOM 595 CA LEU A 41 -9.421 4.306 -4.484 1.00 0.00 C ATOM 596 C LEU A 41 -8.454 4.915 -3.461 1.00 0.00 C ATOM 597 O LEU A 41 -8.513 4.605 -2.271 1.00 0.00 O ATOM 598 CB LEU A 41 -10.675 5.187 -4.660 1.00 0.00 C ATOM 599 CG LEU A 41 -11.254 5.163 -6.084 1.00 0.00 C ATOM 600 CD1 LEU A 41 -11.675 3.759 -6.522 1.00 0.00 C ATOM 601 CD2 LEU A 41 -12.470 6.088 -6.158 1.00 0.00 C ATOM 0 H LEU A 41 -10.666 2.922 -3.485 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.919 4.247 -5.450 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.442 4.855 -3.960 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.426 6.215 -4.396 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.466 5.501 -6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.077 3.799 -7.534 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.810 3.096 -6.501 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.439 3.380 -5.843 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.880 6.070 -7.168 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.229 5.749 -5.453 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -12.169 7.105 -5.906 1.00 0.00 H new ATOM 613 N ILE A 42 -7.547 5.779 -3.914 1.00 0.00 N ATOM 614 CA ILE A 42 -6.541 6.353 -3.003 1.00 0.00 C ATOM 615 C ILE A 42 -7.147 7.210 -1.875 1.00 0.00 C ATOM 616 O ILE A 42 -6.706 7.112 -0.728 1.00 0.00 O ATOM 617 CB ILE A 42 -5.471 7.061 -3.867 1.00 0.00 C ATOM 618 CG1 ILE A 42 -4.230 7.474 -3.077 1.00 0.00 C ATOM 619 CG2 ILE A 42 -5.972 8.319 -4.581 1.00 0.00 C ATOM 620 CD1 ILE A 42 -3.629 6.315 -2.287 1.00 0.00 C ATOM 0 H ILE A 42 -7.482 6.095 -4.882 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.053 5.559 -2.438 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.221 6.296 -4.602 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.481 7.869 -3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.491 8.280 -2.392 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.160 8.754 -5.164 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.796 8.057 -5.245 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.317 9.043 -3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.750 6.662 -1.744 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.366 5.936 -1.580 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.341 5.518 -2.973 1.00 0.00 H new ATOM 632 N ASN A 43 -8.172 8.013 -2.162 1.00 0.00 N ATOM 633 CA ASN A 43 -8.813 8.802 -1.094 1.00 0.00 C ATOM 634 C ASN A 43 -9.807 7.980 -0.250 1.00 0.00 C ATOM 635 O ASN A 43 -9.957 8.243 0.942 1.00 0.00 O ATOM 636 CB ASN A 43 -9.547 10.004 -1.711 1.00 0.00 C ATOM 637 CG ASN A 43 -8.609 10.982 -2.418 1.00 0.00 C ATOM 638 OD1 ASN A 43 -8.389 10.904 -3.627 1.00 0.00 O ATOM 639 ND2 ASN A 43 -8.043 11.916 -1.674 1.00 0.00 N ATOM 0 H ASN A 43 -8.571 8.137 -3.092 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.018 9.133 -0.426 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -10.289 9.642 -2.423 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.089 10.533 -0.927 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.409 12.592 -2.099 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -8.240 11.961 -0.674 1.00 0.00 H new ATOM 646 N LYS A 44 -10.458 6.966 -0.825 1.00 0.00 N ATOM 647 CA LYS A 44 -11.399 6.144 -0.054 1.00 0.00 C ATOM 648 C LYS A 44 -10.701 5.085 0.812 1.00 0.00 C ATOM 649 O LYS A 44 -11.198 4.757 1.890 1.00 0.00 O ATOM 650 CB LYS A 44 -12.379 5.461 -1.015 1.00 0.00 C ATOM 651 CG LYS A 44 -13.340 6.456 -1.677 1.00 0.00 C ATOM 652 CD LYS A 44 -14.376 5.736 -2.545 1.00 0.00 C ATOM 653 CE LYS A 44 -15.424 6.692 -3.125 1.00 0.00 C ATOM 654 NZ LYS A 44 -14.822 7.658 -4.060 1.00 0.00 N ATOM 0 H LYS A 44 -10.356 6.696 -1.803 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.928 6.811 0.627 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.818 4.934 -1.787 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.954 4.712 -0.471 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.848 7.040 -0.909 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.775 7.158 -2.289 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.867 5.222 -3.361 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.876 4.972 -1.949 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.194 6.118 -3.640 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.916 7.229 -2.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.941 8.622 -3.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.808 7.451 -4.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.291 7.584 -4.985 1.00 0.00 H new ATOM 668 N LEU A 45 -9.565 4.541 0.376 1.00 0.00 N ATOM 669 CA LEU A 45 -8.848 3.561 1.217 1.00 0.00 C ATOM 670 C LEU A 45 -8.139 4.207 2.408 1.00 0.00 C ATOM 671 O LEU A 45 -8.172 3.703 3.531 1.00 0.00 O ATOM 672 CB LEU A 45 -7.763 2.880 0.373 1.00 0.00 C ATOM 673 CG LEU A 45 -7.221 1.577 0.987 1.00 0.00 C ATOM 674 CD1 LEU A 45 -8.298 0.487 1.055 1.00 0.00 C ATOM 675 CD2 LEU A 45 -6.031 1.077 0.169 1.00 0.00 C ATOM 0 H LEU A 45 -9.127 4.747 -0.522 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.596 2.861 1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -8.168 2.663 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.936 3.576 0.233 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.905 1.796 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.874 -0.416 1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -9.129 0.834 1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.657 0.267 0.050 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.650 0.154 0.607 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -6.348 0.888 -0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.245 1.832 0.172 1.00 0.00 H new ATOM 687 N ASN A 46 -7.539 5.359 2.145 1.00 0.00 N ATOM 688 CA ASN A 46 -6.888 6.134 3.211 1.00 0.00 C ATOM 689 C ASN A 46 -7.897 6.770 4.189 1.00 0.00 C ATOM 690 O ASN A 46 -7.573 7.009 5.352 1.00 0.00 O ATOM 691 CB ASN A 46 -6.015 7.186 2.521 1.00 0.00 C ATOM 692 CG ASN A 46 -5.064 7.906 3.472 1.00 0.00 C ATOM 693 OD1 ASN A 46 -5.394 8.939 4.055 1.00 0.00 O ATOM 694 ND2 ASN A 46 -3.866 7.374 3.640 1.00 0.00 N ATOM 0 H ASN A 46 -7.485 5.780 1.218 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.282 5.476 3.834 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.434 6.705 1.734 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.659 7.921 2.038 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -3.193 7.820 4.263 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -3.615 6.517 3.147 1.00 0.00 H new ATOM 701 N ASP A 47 -9.118 7.024 3.723 1.00 0.00 N ATOM 702 CA ASP A 47 -10.175 7.534 4.617 1.00 0.00 C ATOM 703 C ASP A 47 -10.890 6.401 5.376 1.00 0.00 C ATOM 704 O ASP A 47 -11.130 6.542 6.577 1.00 0.00 O ATOM 705 CB ASP A 47 -11.152 8.453 3.862 1.00 0.00 C ATOM 706 CG ASP A 47 -11.933 9.354 4.814 1.00 0.00 C ATOM 707 OD1 ASP A 47 -11.429 10.445 5.160 1.00 0.00 O ATOM 708 OD2 ASP A 47 -13.054 8.977 5.219 1.00 0.00 O ATOM 0 H ASP A 47 -9.404 6.891 2.753 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.692 8.146 5.379 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.598 9.068 3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -11.848 7.846 3.283 1.00 0.00 H new ATOM 713 N GLY A 48 -11.210 5.280 4.722 1.00 0.00 N ATOM 714 CA GLY A 48 -11.676 4.101 5.474 1.00 0.00 C ATOM 715 C GLY A 48 -13.010 3.466 5.045 1.00 0.00 C ATOM 716 O GLY A 48 -13.584 2.701 5.821 1.00 0.00 O ATOM 0 H GLY A 48 -11.160 5.160 3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -10.903 3.335 5.411 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.760 4.383 6.523 1.00 0.00 H new ATOM 720 N SER A 49 -13.545 3.770 3.863 1.00 0.00 N ATOM 721 CA SER A 49 -14.864 3.228 3.470 1.00 0.00 C ATOM 722 C SER A 49 -14.860 1.744 3.033 1.00 0.00 C ATOM 723 O SER A 49 -15.907 1.094 3.020 1.00 0.00 O ATOM 724 CB SER A 49 -15.404 4.106 2.336 1.00 0.00 C ATOM 725 OG SER A 49 -16.735 3.727 2.006 1.00 0.00 O ATOM 0 H SER A 49 -13.105 4.374 3.169 1.00 0.00 H new ATOM 0 HA SER A 49 -15.498 3.251 4.356 1.00 0.00 H new ATOM 0 HB2 SER A 49 -15.381 5.154 2.636 1.00 0.00 H new ATOM 0 HB3 SER A 49 -14.764 4.012 1.459 1.00 0.00 H new ATOM 0 HG SER A 49 -17.067 4.297 1.282 1.00 0.00 H new ATOM 731 N ILE A 50 -13.695 1.218 2.668 1.00 0.00 N ATOM 732 CA ILE A 50 -13.600 -0.083 1.987 1.00 0.00 C ATOM 733 C ILE A 50 -12.884 -1.086 2.873 1.00 0.00 C ATOM 734 O ILE A 50 -11.754 -0.844 3.299 1.00 0.00 O ATOM 735 CB ILE A 50 -12.843 -0.049 0.658 1.00 0.00 C ATOM 736 CG1 ILE A 50 -13.335 1.134 -0.188 1.00 0.00 C ATOM 737 CG2 ILE A 50 -12.967 -1.436 0.005 1.00 0.00 C ATOM 738 CD1 ILE A 50 -12.749 1.140 -1.590 1.00 0.00 C ATOM 0 H ILE A 50 -12.795 1.670 2.830 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.633 -0.364 1.783 1.00 0.00 H new ATOM 0 HB ILE A 50 -11.776 0.134 0.785 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.422 1.100 -0.254 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -13.075 2.066 0.313 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.435 -1.439 -0.946 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.535 -2.189 0.665 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.019 -1.665 -0.167 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.133 1.999 -2.141 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.663 1.203 -1.530 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.031 0.222 -2.106 1.00 0.00 H new ATOM 750 N THR A 51 -13.551 -2.191 3.179 1.00 0.00 N ATOM 751 CA THR A 51 -12.920 -3.149 4.085 1.00 0.00 C ATOM 752 C THR A 51 -12.270 -4.310 3.311 1.00 0.00 C ATOM 753 O THR A 51 -12.510 -4.606 2.140 1.00 0.00 O ATOM 754 CB THR A 51 -13.962 -3.645 5.110 1.00 0.00 C ATOM 755 OG1 THR A 51 -13.308 -4.375 6.138 1.00 0.00 O ATOM 756 CG2 THR A 51 -15.035 -4.545 4.485 1.00 0.00 C ATOM 0 H THR A 51 -14.479 -2.441 2.837 1.00 0.00 H new ATOM 0 HA THR A 51 -12.113 -2.654 4.625 1.00 0.00 H new ATOM 0 HB THR A 51 -14.458 -2.759 5.506 1.00 0.00 H new ATOM 0 HG1 THR A 51 -13.970 -4.688 6.789 1.00 0.00 H new ATOM 0 HG21 THR A 51 -15.738 -4.862 5.255 1.00 0.00 H new ATOM 0 HG22 THR A 51 -15.568 -3.992 3.712 1.00 0.00 H new ATOM 0 HG23 THR A 51 -14.562 -5.422 4.043 1.00 0.00 H new ATOM 764 N LEU A 52 -11.361 -4.894 4.070 1.00 0.00 N ATOM 765 CA LEU A 52 -10.264 -5.714 3.535 1.00 0.00 C ATOM 766 C LEU A 52 -10.434 -7.184 3.923 1.00 0.00 C ATOM 767 O LEU A 52 -10.417 -7.520 5.109 1.00 0.00 O ATOM 768 CB LEU A 52 -8.919 -5.253 4.140 1.00 0.00 C ATOM 769 CG LEU A 52 -8.288 -3.964 3.587 1.00 0.00 C ATOM 770 CD1 LEU A 52 -8.022 -4.090 2.089 1.00 0.00 C ATOM 771 CD2 LEU A 52 -9.116 -2.711 3.874 1.00 0.00 C ATOM 0 H LEU A 52 -11.354 -4.818 5.087 1.00 0.00 H new ATOM 0 HA LEU A 52 -10.278 -5.601 2.451 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -9.062 -5.123 5.213 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.199 -6.061 4.010 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.342 -3.841 4.115 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.576 -3.167 1.720 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.339 -4.920 1.909 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.961 -4.273 1.567 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.613 -1.839 3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.101 -2.814 3.419 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.225 -2.586 4.951 1.00 0.00 H new ATOM 783 N GLU A 53 -10.523 -8.074 2.937 1.00 0.00 N ATOM 784 CA GLU A 53 -10.284 -9.495 3.249 1.00 0.00 C ATOM 785 C GLU A 53 -8.829 -9.817 2.862 1.00 0.00 C ATOM 786 O GLU A 53 -8.086 -8.961 2.377 1.00 0.00 O ATOM 787 CB GLU A 53 -11.275 -10.378 2.474 1.00 0.00 C ATOM 788 CG GLU A 53 -12.726 -10.161 2.915 1.00 0.00 C ATOM 789 CD GLU A 53 -13.678 -11.064 2.142 1.00 0.00 C ATOM 790 OE1 GLU A 53 -14.152 -10.653 1.061 1.00 0.00 O ATOM 791 OE2 GLU A 53 -13.959 -12.188 2.612 1.00 0.00 O ATOM 0 H GLU A 53 -10.746 -7.862 1.964 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.436 -9.693 4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.188 -10.167 1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.009 -11.426 2.614 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -12.818 -10.360 3.983 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.004 -9.118 2.760 1.00 0.00 H new ATOM 798 N ASN A 54 -8.365 -10.995 3.279 1.00 0.00 N ATOM 799 CA ASN A 54 -6.907 -11.217 3.379 1.00 0.00 C ATOM 800 C ASN A 54 -6.292 -12.349 2.549 1.00 0.00 C ATOM 801 O ASN A 54 -5.594 -13.200 3.103 1.00 0.00 O ATOM 802 CB ASN A 54 -6.573 -11.361 4.871 1.00 0.00 C ATOM 803 CG ASN A 54 -7.276 -12.507 5.607 1.00 0.00 C ATOM 804 OD1 ASN A 54 -7.694 -13.508 5.027 1.00 0.00 O ATOM 805 ND2 ASN A 54 -7.409 -12.372 6.916 1.00 0.00 N ATOM 0 H ASN A 54 -8.946 -11.790 3.546 1.00 0.00 H new ATOM 0 HA ASN A 54 -6.439 -10.348 2.917 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.496 -11.497 4.971 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -6.824 -10.426 5.371 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -7.864 -13.105 7.461 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -7.057 -11.535 7.381 1.00 0.00 H new ATOM 812 N ALA A 55 -6.524 -12.408 1.241 1.00 0.00 N ATOM 813 CA ALA A 55 -6.102 -13.622 0.517 1.00 0.00 C ATOM 814 C ALA A 55 -5.936 -13.501 -1.010 1.00 0.00 C ATOM 815 O ALA A 55 -4.806 -13.443 -1.494 1.00 0.00 O ATOM 816 CB ALA A 55 -7.030 -14.781 0.887 1.00 0.00 C ATOM 0 H ALA A 55 -6.973 -11.683 0.681 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.082 -13.809 0.853 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.720 -15.680 0.353 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.978 -14.961 1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.054 -14.530 0.611 1.00 0.00 H new ATOM 822 N LYS A 56 -7.013 -13.692 -1.774 1.00 0.00 N ATOM 823 CA LYS A 56 -6.864 -14.063 -3.195 1.00 0.00 C ATOM 824 C LYS A 56 -7.036 -12.885 -4.150 1.00 0.00 C ATOM 825 O LYS A 56 -7.840 -12.912 -5.081 1.00 0.00 O ATOM 826 CB LYS A 56 -7.803 -15.219 -3.558 1.00 0.00 C ATOM 827 CG LYS A 56 -7.355 -16.492 -2.841 1.00 0.00 C ATOM 828 CD LYS A 56 -8.377 -17.621 -2.991 1.00 0.00 C ATOM 829 CE LYS A 56 -7.936 -18.868 -2.220 1.00 0.00 C ATOM 830 NZ LYS A 56 -8.932 -19.939 -2.373 1.00 0.00 N ATOM 0 H LYS A 56 -7.976 -13.601 -1.451 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.834 -14.398 -3.320 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -8.826 -14.972 -3.275 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -7.800 -15.377 -4.636 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -6.395 -16.816 -3.242 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.203 -16.278 -1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -9.348 -17.288 -2.625 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -8.501 -17.866 -4.046 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -6.967 -19.207 -2.587 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -7.810 -18.626 -1.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -8.622 -20.780 -1.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -9.848 -19.616 -2.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -9.031 -20.179 -3.380 1.00 0.00 H new ATOM 844 N TYR A 57 -6.215 -11.870 -3.950 1.00 0.00 N ATOM 845 CA TYR A 57 -6.105 -10.776 -4.927 1.00 0.00 C ATOM 846 C TYR A 57 -4.729 -10.755 -5.633 1.00 0.00 C ATOM 847 O TYR A 57 -4.278 -9.661 -5.971 1.00 0.00 O ATOM 848 CB TYR A 57 -6.343 -9.382 -4.338 1.00 0.00 C ATOM 849 CG TYR A 57 -7.414 -9.255 -3.261 1.00 0.00 C ATOM 850 CD1 TYR A 57 -8.689 -9.667 -3.496 1.00 0.00 C ATOM 851 CD2 TYR A 57 -7.101 -8.688 -2.062 1.00 0.00 C ATOM 852 CE1 TYR A 57 -9.643 -9.520 -2.538 1.00 0.00 C ATOM 853 CE2 TYR A 57 -8.059 -8.527 -1.111 1.00 0.00 C ATOM 854 CZ TYR A 57 -9.329 -8.941 -1.350 1.00 0.00 C ATOM 855 OH TYR A 57 -10.297 -8.766 -0.397 1.00 0.00 O ATOM 0 H TYR A 57 -5.615 -11.771 -3.131 1.00 0.00 H new ATOM 0 HA TYR A 57 -6.900 -10.993 -5.641 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.401 -9.026 -3.921 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.604 -8.710 -5.155 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.944 -10.112 -4.446 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.089 -8.366 -1.867 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.650 -9.864 -2.722 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.809 -8.070 -0.165 1.00 0.00 H new ATOM 0 HH TYR A 57 -11.079 -9.312 -0.621 1.00 0.00 H new ATOM 865 N GLU A 58 -3.975 -11.863 -5.663 1.00 0.00 N ATOM 866 CA GLU A 58 -2.512 -11.830 -5.960 1.00 0.00 C ATOM 867 C GLU A 58 -2.073 -11.298 -7.355 1.00 0.00 C ATOM 868 O GLU A 58 -0.992 -11.625 -7.851 1.00 0.00 O ATOM 869 CB GLU A 58 -1.912 -13.230 -5.728 1.00 0.00 C ATOM 870 CG GLU A 58 -2.590 -14.355 -6.521 1.00 0.00 C ATOM 871 CD GLU A 58 -1.899 -15.688 -6.275 1.00 0.00 C ATOM 872 OE1 GLU A 58 -2.184 -16.335 -5.244 1.00 0.00 O ATOM 873 OE2 GLU A 58 -1.066 -16.099 -7.112 1.00 0.00 O ATOM 0 H GLU A 58 -4.342 -12.798 -5.487 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.122 -11.084 -5.267 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.854 -13.205 -5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.972 -13.465 -4.665 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.639 -14.426 -6.233 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.567 -14.120 -7.585 1.00 0.00 H new ATOM 880 N THR A 59 -2.833 -10.360 -7.903 1.00 0.00 N ATOM 881 CA THR A 59 -2.356 -9.495 -8.995 1.00 0.00 C ATOM 882 C THR A 59 -2.825 -8.074 -8.698 1.00 0.00 C ATOM 883 O THR A 59 -4.013 -7.782 -8.567 1.00 0.00 O ATOM 884 CB THR A 59 -2.742 -9.928 -10.415 1.00 0.00 C ATOM 885 OG1 THR A 59 -2.073 -9.089 -11.347 1.00 0.00 O ATOM 886 CG2 THR A 59 -4.232 -9.906 -10.732 1.00 0.00 C ATOM 0 H THR A 59 -3.792 -10.171 -7.612 1.00 0.00 H new ATOM 0 HA THR A 59 -1.269 -9.571 -9.008 1.00 0.00 H new ATOM 0 HB THR A 59 -2.441 -10.973 -10.488 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.311 -9.358 -12.259 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.390 -10.230 -11.761 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.758 -10.579 -10.055 1.00 0.00 H new ATOM 0 HG23 THR A 59 -4.616 -8.893 -10.608 1.00 0.00 H new ATOM 894 N VAL A 60 -1.844 -7.218 -8.477 1.00 0.00 N ATOM 895 CA VAL A 60 -2.092 -5.920 -7.856 1.00 0.00 C ATOM 896 C VAL A 60 -1.699 -4.861 -8.896 1.00 0.00 C ATOM 897 O VAL A 60 -0.521 -4.587 -9.116 1.00 0.00 O ATOM 898 CB VAL A 60 -1.222 -5.900 -6.593 1.00 0.00 C ATOM 899 CG1 VAL A 60 -1.085 -4.513 -5.980 1.00 0.00 C ATOM 900 CG2 VAL A 60 -1.785 -6.837 -5.539 1.00 0.00 C ATOM 0 H VAL A 60 -0.868 -7.393 -8.716 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.125 -5.726 -7.566 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.233 -6.228 -6.912 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.458 -4.569 -5.090 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.628 -3.839 -6.704 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.071 -4.137 -5.706 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.153 -6.808 -4.651 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.795 -6.524 -5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.811 -7.853 -5.932 1.00 0.00 H new ATOM 910 N HIS A 61 -2.694 -4.285 -9.555 1.00 0.00 N ATOM 911 CA HIS A 61 -2.427 -3.263 -10.586 1.00 0.00 C ATOM 912 C HIS A 61 -2.596 -1.862 -9.977 1.00 0.00 C ATOM 913 O HIS A 61 -3.602 -1.592 -9.322 1.00 0.00 O ATOM 914 CB HIS A 61 -3.333 -3.508 -11.828 1.00 0.00 C ATOM 915 CG HIS A 61 -2.571 -4.324 -12.853 1.00 0.00 C ATOM 916 ND1 HIS A 61 -2.597 -5.710 -12.949 1.00 0.00 N ATOM 917 CD2 HIS A 61 -1.537 -3.789 -13.624 1.00 0.00 C ATOM 918 CE1 HIS A 61 -1.545 -5.872 -13.822 1.00 0.00 C ATOM 919 NE2 HIS A 61 -0.890 -4.783 -14.320 1.00 0.00 N ATOM 0 H HIS A 61 -3.681 -4.495 -9.406 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.397 -3.336 -10.936 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.241 -4.032 -11.532 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -3.641 -2.556 -12.261 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -3.208 -6.397 -12.508 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -1.281 -2.741 -13.668 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -1.237 -6.865 -14.114 1.00 0.00 H new ATOM 927 N TYR A 62 -1.654 -0.943 -10.243 1.00 0.00 N ATOM 928 CA TYR A 62 -1.818 0.450 -9.784 1.00 0.00 C ATOM 929 C TYR A 62 -1.928 1.371 -11.001 1.00 0.00 C ATOM 930 O TYR A 62 -0.967 1.614 -11.734 1.00 0.00 O ATOM 931 CB TYR A 62 -0.730 0.909 -8.791 1.00 0.00 C ATOM 932 CG TYR A 62 -1.257 1.798 -7.679 1.00 0.00 C ATOM 933 CD1 TYR A 62 -1.950 2.930 -7.975 1.00 0.00 C ATOM 934 CD2 TYR A 62 -0.982 1.494 -6.383 1.00 0.00 C ATOM 935 CE1 TYR A 62 -2.409 3.732 -6.980 1.00 0.00 C ATOM 936 CE2 TYR A 62 -1.430 2.303 -5.388 1.00 0.00 C ATOM 937 CZ TYR A 62 -2.148 3.417 -5.685 1.00 0.00 C ATOM 938 OH TYR A 62 -2.595 4.231 -4.681 1.00 0.00 O ATOM 0 H TYR A 62 -0.794 -1.128 -10.758 1.00 0.00 H new ATOM 0 HA TYR A 62 -2.743 0.505 -9.209 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.259 0.031 -8.350 1.00 0.00 H new ATOM 0 HB3 TYR A 62 0.045 1.446 -9.337 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.136 3.192 -9.006 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.408 0.611 -6.145 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.980 4.618 -7.218 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -1.215 2.060 -4.358 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.001 4.151 -3.906 1.00 0.00 H new ATOM 948 N LEU A 63 -3.131 1.895 -11.176 1.00 0.00 N ATOM 949 CA LEU A 63 -3.380 2.953 -12.155 1.00 0.00 C ATOM 950 C LEU A 63 -3.398 4.322 -11.469 1.00 0.00 C ATOM 951 O LEU A 63 -4.403 4.708 -10.870 1.00 0.00 O ATOM 952 CB LEU A 63 -4.769 2.656 -12.744 1.00 0.00 C ATOM 953 CG LEU A 63 -4.858 1.394 -13.608 1.00 0.00 C ATOM 954 CD1 LEU A 63 -6.312 1.248 -14.053 1.00 0.00 C ATOM 955 CD2 LEU A 63 -3.947 1.460 -14.837 1.00 0.00 C ATOM 0 H LEU A 63 -3.957 1.606 -10.652 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.604 2.976 -12.920 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.481 2.566 -11.924 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.081 3.510 -13.345 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.526 0.538 -13.020 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.415 0.357 -14.673 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.953 1.157 -13.176 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.606 2.126 -14.628 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.048 0.541 -15.415 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.232 2.311 -15.456 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.912 1.575 -14.517 1.00 0.00 H new ATOM 967 N THR A 64 -2.312 5.086 -11.587 1.00 0.00 N ATOM 968 CA THR A 64 -2.360 6.495 -11.156 1.00 0.00 C ATOM 969 C THR A 64 -1.985 7.373 -12.363 1.00 0.00 C ATOM 970 O THR A 64 -0.803 7.635 -12.589 1.00 0.00 O ATOM 971 CB THR A 64 -1.435 6.744 -9.961 1.00 0.00 C ATOM 972 OG1 THR A 64 -1.791 5.874 -8.898 1.00 0.00 O ATOM 973 CG2 THR A 64 -1.547 8.182 -9.449 1.00 0.00 C ATOM 0 H THR A 64 -1.416 4.774 -11.962 1.00 0.00 H new ATOM 0 HA THR A 64 -3.365 6.749 -10.818 1.00 0.00 H new ATOM 0 HB THR A 64 -0.413 6.564 -10.295 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.532 4.957 -9.126 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.876 8.320 -8.601 1.00 0.00 H new ATOM 0 HG22 THR A 64 -1.273 8.874 -10.245 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.572 8.378 -9.136 1.00 0.00 H new ATOM 981 N PRO A 65 -2.954 7.884 -13.132 1.00 0.00 N ATOM 982 CA PRO A 65 -2.684 8.887 -14.165 1.00 0.00 C ATOM 983 C PRO A 65 -2.542 10.308 -13.595 1.00 0.00 C ATOM 984 O PRO A 65 -3.525 11.032 -13.432 1.00 0.00 O ATOM 985 CB PRO A 65 -3.939 8.733 -15.026 1.00 0.00 C ATOM 986 CG PRO A 65 -5.052 8.403 -14.027 1.00 0.00 C ATOM 987 CD PRO A 65 -4.373 7.551 -12.960 1.00 0.00 C ATOM 0 HA PRO A 65 -1.742 8.744 -14.695 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -4.158 9.648 -15.576 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.819 7.939 -15.763 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -5.480 9.309 -13.597 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -5.867 7.861 -14.507 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.728 7.798 -11.959 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -4.560 6.488 -13.112 1.00 0.00 H new ATOM 1104 N PHE A 73 3.732 7.947 -2.727 1.00 0.00 N ATOM 1105 CA PHE A 73 2.684 7.101 -2.138 1.00 0.00 C ATOM 1106 C PHE A 73 3.031 6.898 -0.660 1.00 0.00 C ATOM 1107 O PHE A 73 4.216 6.804 -0.330 1.00 0.00 O ATOM 1108 CB PHE A 73 2.742 5.818 -2.988 1.00 0.00 C ATOM 1109 CG PHE A 73 1.835 4.648 -2.636 1.00 0.00 C ATOM 1110 CD1 PHE A 73 0.534 4.834 -2.284 1.00 0.00 C ATOM 1111 CD2 PHE A 73 2.313 3.381 -2.787 1.00 0.00 C ATOM 1112 CE1 PHE A 73 -0.268 3.766 -2.044 1.00 0.00 C ATOM 1113 CE2 PHE A 73 1.496 2.316 -2.589 1.00 0.00 C ATOM 1114 CZ PHE A 73 0.223 2.509 -2.168 1.00 0.00 C ATOM 0 HA PHE A 73 1.672 7.505 -2.151 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.529 6.099 -4.019 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.769 5.455 -2.963 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.138 5.835 -2.195 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.345 3.224 -3.065 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.297 3.918 -1.754 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.860 1.315 -2.767 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.401 1.660 -1.931 1.00 0.00 H new ATOM 1124 N PRO A 74 2.068 6.732 0.256 1.00 0.00 N ATOM 1125 CA PRO A 74 2.434 6.589 1.664 1.00 0.00 C ATOM 1126 C PRO A 74 2.850 5.150 1.972 1.00 0.00 C ATOM 1127 O PRO A 74 2.372 4.194 1.360 1.00 0.00 O ATOM 1128 CB PRO A 74 1.144 6.990 2.379 1.00 0.00 C ATOM 1129 CG PRO A 74 0.311 7.771 1.371 1.00 0.00 C ATOM 1130 CD PRO A 74 0.672 7.134 0.041 1.00 0.00 C ATOM 0 HA PRO A 74 3.289 7.193 1.970 1.00 0.00 H new ATOM 0 HB2 PRO A 74 0.605 6.109 2.727 1.00 0.00 H new ATOM 0 HB3 PRO A 74 1.361 7.599 3.257 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -0.755 7.686 1.580 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.555 8.833 1.386 1.00 0.00 H new ATOM 0 HD2 PRO A 74 0.034 6.281 -0.188 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.574 7.837 -0.787 1.00 0.00 H new ATOM 1138 N LYS A 75 3.754 4.998 2.935 1.00 0.00 N ATOM 1139 CA LYS A 75 4.207 3.650 3.325 1.00 0.00 C ATOM 1140 C LYS A 75 3.090 2.754 3.897 1.00 0.00 C ATOM 1141 O LYS A 75 3.034 1.553 3.622 1.00 0.00 O ATOM 1142 CB LYS A 75 5.380 3.735 4.312 1.00 0.00 C ATOM 1143 CG LYS A 75 6.625 4.381 3.690 1.00 0.00 C ATOM 1144 CD LYS A 75 7.816 4.426 4.654 1.00 0.00 C ATOM 1145 CE LYS A 75 8.385 3.036 4.953 1.00 0.00 C ATOM 1146 NZ LYS A 75 9.560 3.145 5.831 1.00 0.00 N ATOM 0 H LYS A 75 4.183 5.764 3.453 1.00 0.00 H new ATOM 0 HA LYS A 75 4.536 3.172 2.403 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.074 4.310 5.186 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.630 2.733 4.661 1.00 0.00 H new ATOM 0 HG2 LYS A 75 6.908 3.826 2.796 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.382 5.395 3.372 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.600 5.051 4.228 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.506 4.896 5.587 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.623 2.418 5.428 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.662 2.541 4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.937 2.195 6.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.291 3.718 5.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 9.284 3.599 6.725 1.00 0.00 H new ATOM 1160 N LYS A 76 2.210 3.332 4.718 1.00 0.00 N ATOM 1161 CA LYS A 76 1.117 2.557 5.337 1.00 0.00 C ATOM 1162 C LYS A 76 0.189 1.878 4.317 1.00 0.00 C ATOM 1163 O LYS A 76 -0.313 0.782 4.568 1.00 0.00 O ATOM 1164 CB LYS A 76 0.284 3.468 6.252 1.00 0.00 C ATOM 1165 CG LYS A 76 1.086 3.998 7.447 1.00 0.00 C ATOM 1166 CD LYS A 76 0.214 4.867 8.357 1.00 0.00 C ATOM 1167 CE LYS A 76 1.015 5.391 9.549 1.00 0.00 C ATOM 1168 NZ LYS A 76 0.159 6.221 10.413 1.00 0.00 N ATOM 0 H LYS A 76 2.226 4.320 4.971 1.00 0.00 H new ATOM 0 HA LYS A 76 1.594 1.762 5.910 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.096 4.309 5.672 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.582 2.916 6.617 1.00 0.00 H new ATOM 0 HG2 LYS A 76 1.490 3.161 8.017 1.00 0.00 H new ATOM 0 HG3 LYS A 76 1.935 4.580 7.089 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -0.188 5.705 7.788 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -0.637 4.286 8.713 1.00 0.00 H new ATOM 0 HE2 LYS A 76 1.419 4.555 10.120 1.00 0.00 H new ATOM 0 HE3 LYS A 76 1.864 5.976 9.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 0.715 6.571 11.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -0.206 7.028 9.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.637 5.651 10.763 1.00 0.00 H new ATOM 1182 N LEU A 77 -0.015 2.487 3.151 1.00 0.00 N ATOM 1183 CA LEU A 77 -0.854 1.834 2.128 1.00 0.00 C ATOM 1184 C LEU A 77 -0.100 0.701 1.411 1.00 0.00 C ATOM 1185 O LEU A 77 -0.722 -0.297 1.057 1.00 0.00 O ATOM 1186 CB LEU A 77 -1.433 2.815 1.092 1.00 0.00 C ATOM 1187 CG LEU A 77 -2.249 3.963 1.693 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -2.888 4.812 0.594 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -3.348 3.472 2.640 1.00 0.00 C ATOM 0 H LEU A 77 0.368 3.395 2.889 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.695 1.411 2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.613 3.235 0.510 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.065 2.260 0.399 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.545 4.564 2.269 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.462 5.621 1.046 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.108 5.232 -0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.550 4.190 -0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.895 4.327 3.037 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.034 2.823 2.096 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.898 2.916 3.462 1.00 0.00 H new ATOM 1201 N ILE A 78 1.224 0.775 1.263 1.00 0.00 N ATOM 1202 CA ILE A 78 2.010 -0.369 0.792 1.00 0.00 C ATOM 1203 C ILE A 78 1.955 -1.547 1.793 1.00 0.00 C ATOM 1204 O ILE A 78 1.928 -2.698 1.355 1.00 0.00 O ATOM 1205 CB ILE A 78 3.435 0.176 0.561 1.00 0.00 C ATOM 1206 CG1 ILE A 78 3.551 1.284 -0.490 1.00 0.00 C ATOM 1207 CG2 ILE A 78 4.393 -0.957 0.224 1.00 0.00 C ATOM 1208 CD1 ILE A 78 4.914 1.986 -0.491 1.00 0.00 C ATOM 0 H ILE A 78 1.774 1.611 1.461 1.00 0.00 H new ATOM 0 HA ILE A 78 1.613 -0.789 -0.132 1.00 0.00 H new ATOM 0 HB ILE A 78 3.707 0.643 1.507 1.00 0.00 H new ATOM 0 HG12 ILE A 78 3.370 0.858 -1.477 1.00 0.00 H new ATOM 0 HG13 ILE A 78 2.770 2.024 -0.314 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.393 -0.553 0.065 1.00 0.00 H new ATOM 0 HG22 ILE A 78 4.417 -1.670 1.048 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.056 -1.461 -0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 78 4.925 2.758 -1.260 1.00 0.00 H new ATOM 0 HD12 ILE A 78 5.089 2.442 0.484 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.698 1.258 -0.697 1.00 0.00 H new ATOM 1220 N SER A 79 1.908 -1.312 3.111 1.00 0.00 N ATOM 1221 CA SER A 79 1.719 -2.433 4.050 1.00 0.00 C ATOM 1222 C SER A 79 0.302 -3.035 3.987 1.00 0.00 C ATOM 1223 O SER A 79 0.142 -4.252 4.087 1.00 0.00 O ATOM 1224 CB SER A 79 2.082 -1.999 5.475 1.00 0.00 C ATOM 1225 OG SER A 79 1.201 -0.988 5.944 1.00 0.00 O ATOM 0 H SER A 79 1.994 -0.392 3.543 1.00 0.00 H new ATOM 0 HA SER A 79 2.396 -3.230 3.743 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.040 -2.860 6.142 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.107 -1.630 5.496 1.00 0.00 H new ATOM 0 HG SER A 79 0.806 -0.518 5.180 1.00 0.00 H new ATOM 1231 N VAL A 80 -0.726 -2.207 3.790 1.00 0.00 N ATOM 1232 CA VAL A 80 -2.094 -2.724 3.566 1.00 0.00 C ATOM 1233 C VAL A 80 -2.201 -3.489 2.227 1.00 0.00 C ATOM 1234 O VAL A 80 -2.869 -4.521 2.157 1.00 0.00 O ATOM 1235 CB VAL A 80 -3.123 -1.576 3.649 1.00 0.00 C ATOM 1236 CG1 VAL A 80 -4.550 -2.052 3.345 1.00 0.00 C ATOM 1237 CG2 VAL A 80 -3.133 -0.941 5.046 1.00 0.00 C ATOM 0 H VAL A 80 -0.649 -1.190 3.779 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.320 -3.439 4.357 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.816 -0.847 2.899 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.238 -1.209 3.416 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.588 -2.468 2.338 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.839 -2.818 4.065 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.867 -0.136 5.074 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -3.394 -1.696 5.787 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.145 -0.539 5.270 1.00 0.00 H new ATOM 1247 N LEU A 81 -1.545 -3.003 1.172 1.00 0.00 N ATOM 1248 CA LEU A 81 -1.489 -3.720 -0.104 1.00 0.00 C ATOM 1249 C LEU A 81 -0.836 -5.108 0.040 1.00 0.00 C ATOM 1250 O LEU A 81 -1.354 -6.096 -0.482 1.00 0.00 O ATOM 1251 CB LEU A 81 -0.676 -2.826 -1.059 1.00 0.00 C ATOM 1252 CG LEU A 81 -1.515 -2.058 -2.083 1.00 0.00 C ATOM 1253 CD1 LEU A 81 -2.186 -0.848 -1.437 1.00 0.00 C ATOM 1254 CD2 LEU A 81 -0.597 -1.562 -3.199 1.00 0.00 C ATOM 0 H LEU A 81 -1.044 -2.114 1.176 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.494 -3.906 -0.483 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.105 -2.111 -0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.044 -3.447 -1.592 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.284 -2.724 -2.475 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.777 -0.318 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.837 -1.181 -0.629 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.424 -0.180 -1.036 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.184 -1.013 -3.936 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.165 -0.905 -2.779 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.116 -2.414 -3.680 1.00 0.00 H new ATOM 1266 N ALA A 82 0.296 -5.186 0.738 1.00 0.00 N ATOM 1267 CA ALA A 82 0.972 -6.470 0.969 1.00 0.00 C ATOM 1268 C ALA A 82 0.192 -7.461 1.849 1.00 0.00 C ATOM 1269 O ALA A 82 0.376 -8.671 1.729 1.00 0.00 O ATOM 1270 CB ALA A 82 2.308 -6.142 1.639 1.00 0.00 C ATOM 0 H ALA A 82 0.766 -4.381 1.153 1.00 0.00 H new ATOM 0 HA ALA A 82 1.078 -6.971 0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.854 -7.065 1.834 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.898 -5.504 0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.125 -5.623 2.580 1.00 0.00 H new ATOM 1276 N ASP A 83 -0.624 -6.961 2.779 1.00 0.00 N ATOM 1277 CA ASP A 83 -1.186 -7.834 3.832 1.00 0.00 C ATOM 1278 C ASP A 83 -2.194 -8.888 3.352 1.00 0.00 C ATOM 1279 O ASP A 83 -2.309 -9.974 3.923 1.00 0.00 O ATOM 1280 CB ASP A 83 -1.782 -6.952 4.939 1.00 0.00 C ATOM 1281 CG ASP A 83 -2.177 -7.742 6.183 1.00 0.00 C ATOM 1282 OD1 ASP A 83 -1.286 -8.063 7.000 1.00 0.00 O ATOM 1283 OD2 ASP A 83 -3.380 -8.043 6.350 1.00 0.00 O ATOM 0 H ASP A 83 -0.910 -5.983 2.833 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.357 -8.431 4.211 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -1.057 -6.187 5.216 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.659 -6.434 4.551 1.00 0.00 H new ATOM 1288 N SER A 84 -2.931 -8.543 2.316 1.00 0.00 N ATOM 1289 CA SER A 84 -4.019 -9.396 1.819 1.00 0.00 C ATOM 1290 C SER A 84 -3.607 -10.369 0.703 1.00 0.00 C ATOM 1291 O SER A 84 -4.393 -10.669 -0.197 1.00 0.00 O ATOM 1292 CB SER A 84 -5.093 -8.438 1.305 1.00 0.00 C ATOM 1293 OG SER A 84 -4.586 -7.599 0.274 1.00 0.00 O ATOM 0 H SER A 84 -2.804 -7.677 1.793 1.00 0.00 H new ATOM 0 HA SER A 84 -4.361 -10.039 2.630 1.00 0.00 H new ATOM 0 HB2 SER A 84 -5.942 -9.008 0.928 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.461 -7.825 2.128 1.00 0.00 H new ATOM 0 HG SER A 84 -5.295 -6.998 -0.037 1.00 0.00 H new ATOM 1299 N LEU A 85 -2.373 -10.852 0.752 1.00 0.00 N ATOM 1300 CA LEU A 85 -1.795 -11.541 -0.401 1.00 0.00 C ATOM 1301 C LEU A 85 -1.091 -12.841 0.006 1.00 0.00 C ATOM 1302 O LEU A 85 -0.997 -13.207 1.181 1.00 0.00 O ATOM 1303 CB LEU A 85 -0.760 -10.578 -1.001 1.00 0.00 C ATOM 1304 CG LEU A 85 -1.285 -9.236 -1.540 1.00 0.00 C ATOM 1305 CD1 LEU A 85 -0.118 -8.465 -2.159 1.00 0.00 C ATOM 1306 CD2 LEU A 85 -2.368 -9.418 -2.609 1.00 0.00 C ATOM 0 H LEU A 85 -1.758 -10.783 1.563 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.581 -11.808 -1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.011 -10.367 -0.238 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.249 -11.093 -1.814 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.727 -8.694 -0.704 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.476 -7.511 -2.545 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.643 -8.286 -1.400 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.312 -9.048 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.704 -8.441 -2.956 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.960 -9.981 -3.449 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.211 -9.962 -2.184 1.00 0.00 H new ATOM 1318 N LYS A 86 -0.629 -13.556 -1.015 1.00 0.00 N ATOM 1319 CA LYS A 86 -0.110 -14.918 -0.837 1.00 0.00 C ATOM 1320 C LYS A 86 1.385 -14.874 -1.220 1.00 0.00 C ATOM 1321 O LYS A 86 1.858 -13.882 -1.779 1.00 0.00 O ATOM 1322 CB LYS A 86 -0.891 -15.870 -1.763 1.00 0.00 C ATOM 1323 CG LYS A 86 -2.390 -16.000 -1.446 1.00 0.00 C ATOM 1324 CD LYS A 86 -2.744 -17.064 -0.399 1.00 0.00 C ATOM 1325 CE LYS A 86 -2.274 -16.729 1.019 1.00 0.00 C ATOM 1326 NZ LYS A 86 -2.836 -17.692 1.978 1.00 0.00 N ATOM 0 H LYS A 86 -0.601 -13.219 -1.977 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.224 -15.275 0.187 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.781 -15.524 -2.791 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.436 -16.859 -1.709 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.757 -15.034 -1.098 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -2.922 -16.230 -2.369 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.825 -17.202 -0.388 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.304 -18.015 -0.700 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.185 -16.752 1.065 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.583 -15.718 1.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -2.511 -17.456 2.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.875 -17.650 1.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.520 -18.652 1.732 1.00 0.00 H new ATOM 1340 N PRO A 87 2.138 -15.965 -1.056 1.00 0.00 N ATOM 1341 CA PRO A 87 3.509 -16.047 -1.591 1.00 0.00 C ATOM 1342 C PRO A 87 3.757 -15.710 -3.081 1.00 0.00 C ATOM 1343 O PRO A 87 4.871 -15.304 -3.414 1.00 0.00 O ATOM 1344 CB PRO A 87 3.871 -17.496 -1.251 1.00 0.00 C ATOM 1345 CG PRO A 87 3.129 -17.774 0.058 1.00 0.00 C ATOM 1346 CD PRO A 87 1.827 -16.977 -0.034 1.00 0.00 C ATOM 0 HA PRO A 87 4.129 -15.265 -1.152 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.557 -18.180 -2.039 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.947 -17.620 -1.132 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.930 -18.839 0.178 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.721 -17.462 0.919 1.00 0.00 H new ATOM 0 HD2 PRO A 87 0.987 -17.606 -0.330 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.563 -16.521 0.920 1.00 0.00 H new ATOM 1354 N ASN A 88 2.782 -15.853 -3.984 1.00 0.00 N ATOM 1355 CA ASN A 88 2.945 -15.328 -5.357 1.00 0.00 C ATOM 1356 C ASN A 88 2.170 -14.010 -5.524 1.00 0.00 C ATOM 1357 O ASN A 88 1.412 -13.837 -6.478 1.00 0.00 O ATOM 1358 CB ASN A 88 2.518 -16.379 -6.406 1.00 0.00 C ATOM 1359 CG ASN A 88 3.256 -17.709 -6.255 1.00 0.00 C ATOM 1360 OD1 ASN A 88 2.697 -18.707 -5.801 1.00 0.00 O ATOM 1361 ND2 ASN A 88 4.522 -17.740 -6.629 1.00 0.00 N ATOM 0 H ASN A 88 1.891 -16.315 -3.803 1.00 0.00 H new ATOM 0 HA ASN A 88 4.001 -15.117 -5.524 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.445 -16.554 -6.321 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.698 -15.981 -7.405 1.00 0.00 H new ATOM 0 HD21 ASN A 88 5.058 -18.604 -6.544 1.00 0.00 H new ATOM 0 HD22 ASN A 88 4.964 -16.900 -7.003 1.00 0.00 H new ATOM 1368 N GLY A 89 2.382 -13.058 -4.613 1.00 0.00 N ATOM 1369 CA GLY A 89 1.796 -11.722 -4.774 1.00 0.00 C ATOM 1370 C GLY A 89 2.574 -10.964 -5.837 1.00 0.00 C ATOM 1371 O GLY A 89 3.785 -11.126 -5.938 1.00 0.00 O ATOM 0 H GLY A 89 2.944 -13.181 -3.771 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.748 -11.803 -5.061 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.827 -11.181 -3.828 1.00 0.00 H new ATOM 1375 N SER A 90 1.909 -10.162 -6.658 1.00 0.00 N ATOM 1376 CA SER A 90 2.627 -9.530 -7.771 1.00 0.00 C ATOM 1377 C SER A 90 2.042 -8.126 -7.963 1.00 0.00 C ATOM 1378 O SER A 90 0.937 -7.936 -8.468 1.00 0.00 O ATOM 1379 CB SER A 90 2.514 -10.401 -9.028 1.00 0.00 C ATOM 1380 OG SER A 90 1.163 -10.510 -9.463 1.00 0.00 O ATOM 0 H SER A 90 0.917 -9.936 -6.587 1.00 0.00 H new ATOM 0 HA SER A 90 3.692 -9.437 -7.561 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.121 -9.973 -9.825 1.00 0.00 H new ATOM 0 HB3 SER A 90 2.913 -11.394 -8.822 1.00 0.00 H new ATOM 0 HG SER A 90 0.623 -10.916 -8.753 1.00 0.00 H new ATOM 1386 N LEU A 91 2.817 -7.142 -7.538 1.00 0.00 N ATOM 1387 CA LEU A 91 2.439 -5.728 -7.610 1.00 0.00 C ATOM 1388 C LEU A 91 2.964 -5.300 -8.988 1.00 0.00 C ATOM 1389 O LEU A 91 4.138 -5.509 -9.295 1.00 0.00 O ATOM 1390 CB LEU A 91 3.167 -5.219 -6.349 1.00 0.00 C ATOM 1391 CG LEU A 91 3.416 -3.758 -5.970 1.00 0.00 C ATOM 1392 CD1 LEU A 91 4.005 -2.875 -7.062 1.00 0.00 C ATOM 1393 CD2 LEU A 91 2.222 -3.076 -5.313 1.00 0.00 C ATOM 0 H LEU A 91 3.738 -7.297 -7.128 1.00 0.00 H new ATOM 0 HA LEU A 91 1.405 -5.384 -7.580 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.628 -5.651 -5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.151 -5.687 -6.371 1.00 0.00 H new ATOM 0 HG LEU A 91 4.201 -3.859 -5.221 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.138 -1.863 -6.680 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.970 -3.275 -7.372 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.329 -2.854 -7.917 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.478 -2.044 -5.075 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.373 -3.091 -5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.959 -3.605 -4.397 1.00 0.00 H new ATOM 1405 N ILE A 92 2.128 -4.662 -9.804 1.00 0.00 N ATOM 1406 CA ILE A 92 2.598 -4.051 -11.057 1.00 0.00 C ATOM 1407 C ILE A 92 2.492 -2.544 -10.961 1.00 0.00 C ATOM 1408 O ILE A 92 1.436 -1.945 -11.184 1.00 0.00 O ATOM 1409 CB ILE A 92 1.736 -4.550 -12.220 1.00 0.00 C ATOM 1410 CG1 ILE A 92 1.728 -6.078 -12.340 1.00 0.00 C ATOM 1411 CG2 ILE A 92 2.161 -3.931 -13.562 1.00 0.00 C ATOM 1412 CD1 ILE A 92 3.152 -6.607 -12.406 1.00 0.00 C ATOM 0 H ILE A 92 1.129 -4.552 -9.628 1.00 0.00 H new ATOM 0 HA ILE A 92 3.638 -4.329 -11.227 1.00 0.00 H new ATOM 0 HB ILE A 92 0.722 -4.224 -11.987 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.209 -6.514 -11.486 1.00 0.00 H new ATOM 0 HG13 ILE A 92 1.179 -6.377 -13.233 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.522 -4.314 -14.358 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.065 -2.847 -13.509 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.198 -4.193 -13.771 1.00 0.00 H new ATOM 0 HD11 ILE A 92 3.133 -7.694 -12.491 1.00 0.00 H new ATOM 0 HD12 ILE A 92 3.657 -6.184 -13.274 1.00 0.00 H new ATOM 0 HD13 ILE A 92 3.688 -6.323 -11.500 1.00 0.00 H new ATOM 1424 N GLY A 93 3.581 -1.957 -10.515 1.00 0.00 N ATOM 1425 CA GLY A 93 3.525 -0.528 -10.209 1.00 0.00 C ATOM 1426 C GLY A 93 4.717 0.374 -10.476 1.00 0.00 C ATOM 1427 O GLY A 93 4.754 1.124 -11.451 1.00 0.00 O ATOM 0 H GLY A 93 4.480 -2.412 -10.359 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.681 -0.115 -10.762 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.286 -0.437 -9.149 1.00 0.00 H new ATOM 1431 N LEU A 94 5.610 0.427 -9.495 1.00 0.00 N ATOM 1432 CA LEU A 94 6.190 1.730 -9.123 1.00 0.00 C ATOM 1433 C LEU A 94 7.706 1.697 -9.413 1.00 0.00 C ATOM 1434 O LEU A 94 8.267 0.672 -9.798 1.00 0.00 O ATOM 1435 CB LEU A 94 5.898 1.992 -7.625 1.00 0.00 C ATOM 1436 CG LEU A 94 4.470 1.778 -7.077 1.00 0.00 C ATOM 1437 CD1 LEU A 94 4.473 0.641 -6.050 1.00 0.00 C ATOM 1438 CD2 LEU A 94 4.016 2.999 -6.305 1.00 0.00 C ATOM 0 H LEU A 94 5.943 -0.374 -8.958 1.00 0.00 H new ATOM 0 HA LEU A 94 5.750 2.541 -9.703 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.568 1.356 -7.046 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.177 3.024 -7.414 1.00 0.00 H new ATOM 0 HG LEU A 94 3.823 1.569 -7.929 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.463 0.494 -5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.818 -0.277 -6.525 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.140 0.896 -5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.008 2.835 -5.924 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.695 3.175 -5.471 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.018 3.867 -6.964 1.00 0.00 H new ATOM 1450 N SER A 95 8.366 2.849 -9.338 1.00 0.00 N ATOM 1451 CA SER A 95 9.637 3.030 -10.075 1.00 0.00 C ATOM 1452 C SER A 95 10.867 3.066 -9.146 1.00 0.00 C ATOM 1453 O SER A 95 11.056 2.153 -8.341 1.00 0.00 O ATOM 1454 CB SER A 95 9.520 4.225 -11.041 1.00 0.00 C ATOM 1455 OG SER A 95 10.577 4.182 -11.990 1.00 0.00 O ATOM 0 H SER A 95 8.063 3.657 -8.794 1.00 0.00 H new ATOM 0 HA SER A 95 9.815 2.149 -10.692 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.558 4.198 -11.553 1.00 0.00 H new ATOM 0 HB3 SER A 95 9.558 5.161 -10.483 1.00 0.00 H new ATOM 0 HG SER A 95 10.498 4.943 -12.603 1.00 0.00 H new ATOM 1461 N ASP A 96 11.759 4.046 -9.311 1.00 0.00 N ATOM 1462 CA ASP A 96 13.137 3.889 -8.809 1.00 0.00 C ATOM 1463 C ASP A 96 13.330 4.139 -7.312 1.00 0.00 C ATOM 1464 O ASP A 96 13.931 3.308 -6.632 1.00 0.00 O ATOM 1465 CB ASP A 96 14.101 4.767 -9.619 1.00 0.00 C ATOM 1466 CG ASP A 96 14.167 4.373 -11.093 1.00 0.00 C ATOM 1467 OD1 ASP A 96 14.827 3.363 -11.418 1.00 0.00 O ATOM 1468 OD2 ASP A 96 13.561 5.075 -11.932 1.00 0.00 O ATOM 0 H ASP A 96 11.566 4.934 -9.774 1.00 0.00 H new ATOM 0 HA ASP A 96 13.363 2.832 -8.948 1.00 0.00 H new ATOM 0 HB2 ASP A 96 13.789 5.809 -9.540 1.00 0.00 H new ATOM 0 HB3 ASP A 96 15.098 4.699 -9.185 1.00 0.00 H new ATOM 1473 N ILE A 97 12.832 5.246 -6.765 1.00 0.00 N ATOM 1474 CA ILE A 97 12.790 5.381 -5.295 1.00 0.00 C ATOM 1475 C ILE A 97 11.972 4.260 -4.608 1.00 0.00 C ATOM 1476 O ILE A 97 12.232 3.789 -3.491 1.00 0.00 O ATOM 1477 CB ILE A 97 12.248 6.788 -4.976 1.00 0.00 C ATOM 1478 CG1 ILE A 97 12.318 7.047 -3.477 1.00 0.00 C ATOM 1479 CG2 ILE A 97 10.805 7.050 -5.424 1.00 0.00 C ATOM 1480 CD1 ILE A 97 13.770 7.213 -3.033 1.00 0.00 C ATOM 0 H ILE A 97 12.462 6.041 -7.287 1.00 0.00 H new ATOM 0 HA ILE A 97 13.795 5.266 -4.888 1.00 0.00 H new ATOM 0 HB ILE A 97 12.887 7.461 -5.547 1.00 0.00 H new ATOM 0 HG12 ILE A 97 11.750 7.944 -3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 97 11.858 6.220 -2.937 1.00 0.00 H new ATOM 0 HG21 ILE A 97 10.519 8.066 -5.154 1.00 0.00 H new ATOM 0 HG22 ILE A 97 10.732 6.928 -6.505 1.00 0.00 H new ATOM 0 HG23 ILE A 97 10.137 6.342 -4.933 1.00 0.00 H new ATOM 0 HD11 ILE A 97 13.803 7.398 -1.959 1.00 0.00 H new ATOM 0 HD12 ILE A 97 14.327 6.304 -3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 97 14.218 8.056 -3.560 1.00 0.00 H new ATOM 1492 N TYR A 98 10.991 3.799 -5.359 1.00 0.00 N ATOM 1493 CA TYR A 98 10.070 2.780 -4.881 1.00 0.00 C ATOM 1494 C TYR A 98 10.748 1.381 -4.904 1.00 0.00 C ATOM 1495 O TYR A 98 10.277 0.463 -4.241 1.00 0.00 O ATOM 1496 CB TYR A 98 8.800 2.839 -5.730 1.00 0.00 C ATOM 1497 CG TYR A 98 8.213 4.249 -5.829 1.00 0.00 C ATOM 1498 CD1 TYR A 98 7.506 4.780 -4.790 1.00 0.00 C ATOM 1499 CD2 TYR A 98 8.481 5.020 -6.920 1.00 0.00 C ATOM 1500 CE1 TYR A 98 7.081 6.071 -4.845 1.00 0.00 C ATOM 1501 CE2 TYR A 98 8.041 6.303 -6.979 1.00 0.00 C ATOM 1502 CZ TYR A 98 7.362 6.833 -5.934 1.00 0.00 C ATOM 1503 OH TYR A 98 7.025 8.158 -5.955 1.00 0.00 O ATOM 0 H TYR A 98 10.808 4.116 -6.311 1.00 0.00 H new ATOM 0 HA TYR A 98 9.794 2.965 -3.843 1.00 0.00 H new ATOM 0 HB2 TYR A 98 9.022 2.472 -6.732 1.00 0.00 H new ATOM 0 HB3 TYR A 98 8.053 2.169 -5.304 1.00 0.00 H new ATOM 0 HD1 TYR A 98 7.284 4.175 -3.923 1.00 0.00 H new ATOM 0 HD2 TYR A 98 9.047 4.608 -7.743 1.00 0.00 H new ATOM 0 HE1 TYR A 98 6.520 6.490 -4.023 1.00 0.00 H new ATOM 0 HE2 TYR A 98 8.232 6.900 -7.858 1.00 0.00 H new ATOM 0 HH TYR A 98 7.300 8.552 -6.809 1.00 0.00 H new ATOM 1513 N LYS A 99 11.883 1.223 -5.602 1.00 0.00 N ATOM 1514 CA LYS A 99 12.755 0.039 -5.444 1.00 0.00 C ATOM 1515 C LYS A 99 13.251 -0.133 -3.996 1.00 0.00 C ATOM 1516 O LYS A 99 13.144 -1.220 -3.431 1.00 0.00 O ATOM 1517 CB LYS A 99 13.946 0.185 -6.401 1.00 0.00 C ATOM 1518 CG LYS A 99 14.916 -0.996 -6.300 1.00 0.00 C ATOM 1519 CD LYS A 99 16.087 -0.852 -7.275 1.00 0.00 C ATOM 1520 CE LYS A 99 17.040 -2.044 -7.169 1.00 0.00 C ATOM 1521 NZ LYS A 99 18.155 -1.890 -8.116 1.00 0.00 N ATOM 0 H LYS A 99 12.223 1.900 -6.285 1.00 0.00 H new ATOM 0 HA LYS A 99 12.176 -0.853 -5.683 1.00 0.00 H new ATOM 0 HB2 LYS A 99 13.580 0.266 -7.424 1.00 0.00 H new ATOM 0 HB3 LYS A 99 14.478 1.110 -6.178 1.00 0.00 H new ATOM 0 HG2 LYS A 99 15.297 -1.068 -5.281 1.00 0.00 H new ATOM 0 HG3 LYS A 99 14.382 -1.924 -6.507 1.00 0.00 H new ATOM 0 HD2 LYS A 99 15.708 -0.774 -8.294 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.628 0.070 -7.065 1.00 0.00 H new ATOM 0 HE2 LYS A 99 17.425 -2.121 -6.152 1.00 0.00 H new ATOM 0 HE3 LYS A 99 16.502 -2.969 -7.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 18.795 -2.706 -8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 17.782 -1.838 -9.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 18.677 -1.017 -7.899 1.00 0.00 H new ATOM 1535 N VAL A 100 13.805 0.920 -3.394 1.00 0.00 N ATOM 1536 CA VAL A 100 14.214 0.846 -1.975 1.00 0.00 C ATOM 1537 C VAL A 100 12.996 0.628 -1.054 1.00 0.00 C ATOM 1538 O VAL A 100 13.071 -0.117 -0.073 1.00 0.00 O ATOM 1539 CB VAL A 100 14.997 2.121 -1.588 1.00 0.00 C ATOM 1540 CG1 VAL A 100 15.472 2.069 -0.130 1.00 0.00 C ATOM 1541 CG2 VAL A 100 16.229 2.322 -2.481 1.00 0.00 C ATOM 0 H VAL A 100 13.981 1.817 -3.846 1.00 0.00 H new ATOM 0 HA VAL A 100 14.870 -0.014 -1.843 1.00 0.00 H new ATOM 0 HB VAL A 100 14.305 2.952 -1.723 1.00 0.00 H new ATOM 0 HG11 VAL A 100 16.019 2.982 0.107 1.00 0.00 H new ATOM 0 HG12 VAL A 100 14.610 1.981 0.531 1.00 0.00 H new ATOM 0 HG13 VAL A 100 16.126 1.208 0.009 1.00 0.00 H new ATOM 0 HG21 VAL A 100 16.754 3.228 -2.179 1.00 0.00 H new ATOM 0 HG22 VAL A 100 16.896 1.466 -2.379 1.00 0.00 H new ATOM 0 HG23 VAL A 100 15.914 2.415 -3.520 1.00 0.00 H new ATOM 1551 N ASP A 101 11.865 1.245 -1.390 1.00 0.00 N ATOM 1552 CA ASP A 101 10.599 0.942 -0.704 1.00 0.00 C ATOM 1553 C ASP A 101 10.176 -0.530 -0.833 1.00 0.00 C ATOM 1554 O ASP A 101 9.745 -1.145 0.142 1.00 0.00 O ATOM 1555 CB ASP A 101 9.533 1.828 -1.354 1.00 0.00 C ATOM 1556 CG ASP A 101 9.019 2.932 -0.438 1.00 0.00 C ATOM 1557 OD1 ASP A 101 8.164 2.645 0.427 1.00 0.00 O ATOM 1558 OD2 ASP A 101 9.469 4.090 -0.579 1.00 0.00 O ATOM 0 H ASP A 101 11.793 1.950 -2.123 1.00 0.00 H new ATOM 0 HA ASP A 101 10.721 1.131 0.363 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.947 2.279 -2.256 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.694 1.205 -1.665 1.00 0.00 H new ATOM 1563 N ALA A 102 10.294 -1.091 -2.037 1.00 0.00 N ATOM 1564 CA ALA A 102 9.995 -2.510 -2.256 1.00 0.00 C ATOM 1565 C ALA A 102 10.903 -3.418 -1.421 1.00 0.00 C ATOM 1566 O ALA A 102 10.455 -4.387 -0.810 1.00 0.00 O ATOM 1567 CB ALA A 102 10.250 -2.781 -3.734 1.00 0.00 C ATOM 0 H ALA A 102 10.593 -0.589 -2.873 1.00 0.00 H new ATOM 0 HA ALA A 102 8.967 -2.720 -1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.042 -3.828 -3.953 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.600 -2.148 -4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.291 -2.561 -3.970 1.00 0.00 H new ATOM 1573 N LEU A 103 12.191 -3.081 -1.402 1.00 0.00 N ATOM 1574 CA LEU A 103 13.183 -3.855 -0.639 1.00 0.00 C ATOM 1575 C LEU A 103 12.850 -3.921 0.859 1.00 0.00 C ATOM 1576 O LEU A 103 12.888 -4.997 1.458 1.00 0.00 O ATOM 1577 CB LEU A 103 14.557 -3.213 -0.903 1.00 0.00 C ATOM 1578 CG LEU A 103 15.771 -4.072 -0.509 1.00 0.00 C ATOM 1579 CD1 LEU A 103 17.010 -3.562 -1.252 1.00 0.00 C ATOM 1580 CD2 LEU A 103 16.063 -4.038 0.996 1.00 0.00 C ATOM 0 H LEU A 103 12.577 -2.281 -1.903 1.00 0.00 H new ATOM 0 HA LEU A 103 13.181 -4.894 -0.968 1.00 0.00 H new ATOM 0 HB2 LEU A 103 14.630 -2.975 -1.964 1.00 0.00 H new ATOM 0 HB3 LEU A 103 14.609 -2.269 -0.360 1.00 0.00 H new ATOM 0 HG LEU A 103 15.534 -5.101 -0.780 1.00 0.00 H new ATOM 0 HD11 LEU A 103 17.874 -4.167 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 103 16.845 -3.633 -2.327 1.00 0.00 H new ATOM 0 HD13 LEU A 103 17.194 -2.522 -0.981 1.00 0.00 H new ATOM 0 HD21 LEU A 103 16.930 -4.662 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 103 16.268 -3.013 1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 103 15.199 -4.415 1.543 1.00 0.00 H new ATOM 1592 N ILE A 104 12.531 -2.782 1.473 1.00 0.00 N ATOM 1593 CA ILE A 104 12.302 -2.759 2.932 1.00 0.00 C ATOM 1594 C ILE A 104 10.927 -3.347 3.312 1.00 0.00 C ATOM 1595 O ILE A 104 10.818 -4.029 4.333 1.00 0.00 O ATOM 1596 CB ILE A 104 12.549 -1.329 3.458 1.00 0.00 C ATOM 1597 CG1 ILE A 104 14.023 -0.938 3.252 1.00 0.00 C ATOM 1598 CG2 ILE A 104 12.180 -1.201 4.944 1.00 0.00 C ATOM 1599 CD1 ILE A 104 14.305 0.539 3.546 1.00 0.00 C ATOM 0 H ILE A 104 12.425 -1.882 1.005 1.00 0.00 H new ATOM 0 HA ILE A 104 13.016 -3.416 3.429 1.00 0.00 H new ATOM 0 HB ILE A 104 11.908 -0.652 2.892 1.00 0.00 H new ATOM 0 HG12 ILE A 104 14.649 -1.555 3.896 1.00 0.00 H new ATOM 0 HG13 ILE A 104 14.310 -1.158 2.224 1.00 0.00 H new ATOM 0 HG21 ILE A 104 12.367 -0.181 5.279 1.00 0.00 H new ATOM 0 HG22 ILE A 104 11.125 -1.439 5.079 1.00 0.00 H new ATOM 0 HG23 ILE A 104 12.786 -1.892 5.530 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.362 0.747 3.381 1.00 0.00 H new ATOM 0 HD12 ILE A 104 13.705 1.163 2.884 1.00 0.00 H new ATOM 0 HD13 ILE A 104 14.049 0.759 4.582 1.00 0.00 H new ATOM 1611 N ASN A 105 9.888 -3.147 2.498 1.00 0.00 N ATOM 1612 CA ASN A 105 8.572 -3.729 2.807 1.00 0.00 C ATOM 1613 C ASN A 105 8.501 -5.254 2.618 1.00 0.00 C ATOM 1614 O ASN A 105 7.608 -5.893 3.177 1.00 0.00 O ATOM 1615 CB ASN A 105 7.503 -3.045 1.933 1.00 0.00 C ATOM 1616 CG ASN A 105 6.116 -3.113 2.568 1.00 0.00 C ATOM 1617 OD1 ASN A 105 5.755 -2.295 3.415 1.00 0.00 O ATOM 1618 ND2 ASN A 105 5.314 -4.085 2.170 1.00 0.00 N ATOM 0 H ASN A 105 9.925 -2.600 1.638 1.00 0.00 H new ATOM 0 HA ASN A 105 8.390 -3.550 3.867 1.00 0.00 H new ATOM 0 HB2 ASN A 105 7.778 -2.002 1.773 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.477 -3.521 0.953 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.377 -4.168 2.565 1.00 0.00 H new ATOM 0 HD22 ASN A 105 5.632 -4.753 1.467 1.00 0.00 H new ATOM 1625 N GLY A 106 9.409 -5.849 1.849 1.00 0.00 N ATOM 1626 CA GLY A 106 9.345 -7.300 1.626 1.00 0.00 C ATOM 1627 C GLY A 106 8.801 -7.666 0.244 1.00 0.00 C ATOM 1628 O GLY A 106 8.184 -8.718 0.079 1.00 0.00 O ATOM 0 H GLY A 106 10.178 -5.371 1.380 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.342 -7.725 1.743 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.714 -7.753 2.391 1.00 0.00 H new ATOM 1632 N PHE A 107 9.087 -6.841 -0.759 1.00 0.00 N ATOM 1633 CA PHE A 107 8.828 -7.236 -2.149 1.00 0.00 C ATOM 1634 C PHE A 107 10.174 -7.544 -2.821 1.00 0.00 C ATOM 1635 O PHE A 107 11.240 -7.104 -2.390 1.00 0.00 O ATOM 1636 CB PHE A 107 8.076 -6.183 -2.975 1.00 0.00 C ATOM 1637 CG PHE A 107 6.674 -5.829 -2.504 1.00 0.00 C ATOM 1638 CD1 PHE A 107 5.603 -6.528 -2.974 1.00 0.00 C ATOM 1639 CD2 PHE A 107 6.471 -4.754 -1.694 1.00 0.00 C ATOM 1640 CE1 PHE A 107 4.345 -6.186 -2.593 1.00 0.00 C ATOM 1641 CE2 PHE A 107 5.213 -4.413 -1.316 1.00 0.00 C ATOM 1642 CZ PHE A 107 4.149 -5.134 -1.758 1.00 0.00 C ATOM 0 H PHE A 107 9.491 -5.911 -0.645 1.00 0.00 H new ATOM 0 HA PHE A 107 8.176 -8.109 -2.116 1.00 0.00 H new ATOM 0 HB2 PHE A 107 8.672 -5.271 -2.989 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.011 -6.538 -4.004 1.00 0.00 H new ATOM 0 HD1 PHE A 107 5.755 -7.356 -3.651 1.00 0.00 H new ATOM 0 HD2 PHE A 107 7.313 -4.171 -1.351 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.499 -6.752 -2.955 1.00 0.00 H new ATOM 0 HE2 PHE A 107 5.057 -3.567 -0.663 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.149 -4.870 -1.445 1.00 0.00 H new ATOM 1652 N GLU A 108 10.102 -8.299 -3.913 1.00 0.00 N ATOM 1653 CA GLU A 108 11.307 -8.694 -4.653 1.00 0.00 C ATOM 1654 C GLU A 108 11.133 -8.221 -6.098 1.00 0.00 C ATOM 1655 O GLU A 108 10.345 -8.767 -6.869 1.00 0.00 O ATOM 1656 CB GLU A 108 11.482 -10.216 -4.558 1.00 0.00 C ATOM 1657 CG GLU A 108 12.798 -10.693 -5.181 1.00 0.00 C ATOM 1658 CD GLU A 108 12.942 -12.205 -5.058 1.00 0.00 C ATOM 1659 OE1 GLU A 108 13.449 -12.679 -4.018 1.00 0.00 O ATOM 1660 OE2 GLU A 108 12.550 -12.925 -6.001 1.00 0.00 O ATOM 0 H GLU A 108 9.229 -8.650 -4.307 1.00 0.00 H new ATOM 0 HA GLU A 108 12.207 -8.240 -4.238 1.00 0.00 H new ATOM 0 HB2 GLU A 108 11.448 -10.518 -3.511 1.00 0.00 H new ATOM 0 HB3 GLU A 108 10.647 -10.707 -5.059 1.00 0.00 H new ATOM 0 HG2 GLU A 108 12.833 -10.405 -6.232 1.00 0.00 H new ATOM 0 HG3 GLU A 108 13.637 -10.203 -4.688 1.00 0.00 H new ATOM 1667 N ILE A 109 11.865 -7.170 -6.446 1.00 0.00 N ATOM 1668 CA ILE A 109 11.641 -6.467 -7.710 1.00 0.00 C ATOM 1669 C ILE A 109 12.186 -7.252 -8.910 1.00 0.00 C ATOM 1670 O ILE A 109 13.189 -7.965 -8.832 1.00 0.00 O ATOM 1671 CB ILE A 109 12.265 -5.079 -7.489 1.00 0.00 C ATOM 1672 CG1 ILE A 109 11.974 -4.022 -8.552 1.00 0.00 C ATOM 1673 CG2 ILE A 109 13.771 -5.178 -7.385 1.00 0.00 C ATOM 1674 CD1 ILE A 109 12.539 -2.667 -8.144 1.00 0.00 C ATOM 0 H ILE A 109 12.617 -6.784 -5.875 1.00 0.00 H new ATOM 0 HA ILE A 109 10.587 -6.364 -7.969 1.00 0.00 H new ATOM 0 HB ILE A 109 11.787 -4.749 -6.566 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.408 -4.329 -9.504 1.00 0.00 H new ATOM 0 HG13 ILE A 109 10.898 -3.940 -8.704 1.00 0.00 H new ATOM 0 HG21 ILE A 109 14.191 -4.184 -7.229 1.00 0.00 H new ATOM 0 HG22 ILE A 109 14.036 -5.820 -6.545 1.00 0.00 H new ATOM 0 HG23 ILE A 109 14.172 -5.601 -8.306 1.00 0.00 H new ATOM 0 HD11 ILE A 109 12.318 -1.932 -8.918 1.00 0.00 H new ATOM 0 HD12 ILE A 109 12.085 -2.352 -7.204 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.619 -2.746 -8.017 1.00 0.00 H new ATOM 1686 N ILE A 110 11.466 -7.136 -10.017 1.00 0.00 N ATOM 1687 CA ILE A 110 11.770 -7.941 -11.210 1.00 0.00 C ATOM 1688 C ILE A 110 11.270 -7.192 -12.445 1.00 0.00 C ATOM 1689 O ILE A 110 10.127 -6.734 -12.529 1.00 0.00 O ATOM 1690 CB ILE A 110 11.197 -9.370 -11.083 1.00 0.00 C ATOM 1691 CG1 ILE A 110 11.530 -10.258 -12.297 1.00 0.00 C ATOM 1692 CG2 ILE A 110 9.683 -9.374 -10.816 1.00 0.00 C ATOM 1693 CD1 ILE A 110 11.261 -11.743 -12.034 1.00 0.00 C ATOM 0 H ILE A 110 10.674 -6.502 -10.122 1.00 0.00 H new ATOM 0 HA ILE A 110 12.847 -8.075 -11.311 1.00 0.00 H new ATOM 0 HB ILE A 110 11.693 -9.802 -10.214 1.00 0.00 H new ATOM 0 HG12 ILE A 110 10.940 -9.932 -13.153 1.00 0.00 H new ATOM 0 HG13 ILE A 110 12.579 -10.124 -12.563 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.331 -10.402 -10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 110 9.476 -8.845 -9.885 1.00 0.00 H new ATOM 0 HG23 ILE A 110 9.167 -8.877 -11.638 1.00 0.00 H new ATOM 0 HD11 ILE A 110 11.513 -12.321 -12.923 1.00 0.00 H new ATOM 0 HD12 ILE A 110 11.871 -12.080 -11.196 1.00 0.00 H new ATOM 0 HD13 ILE A 110 10.207 -11.885 -11.796 1.00 0.00 H new ATOM 1705 N ASN A 111 12.177 -7.074 -13.404 1.00 0.00 N ATOM 1706 CA ASN A 111 11.880 -6.332 -14.633 1.00 0.00 C ATOM 1707 C ASN A 111 11.448 -7.313 -15.725 1.00 0.00 C ATOM 1708 O ASN A 111 12.249 -7.959 -16.403 1.00 0.00 O ATOM 1709 CB ASN A 111 13.093 -5.546 -15.130 1.00 0.00 C ATOM 1710 CG ASN A 111 13.635 -4.528 -14.126 1.00 0.00 C ATOM 1711 OD1 ASN A 111 14.262 -4.873 -13.125 1.00 0.00 O ATOM 1712 ND2 ASN A 111 13.407 -3.251 -14.385 1.00 0.00 N ATOM 0 H ASN A 111 13.114 -7.474 -13.362 1.00 0.00 H new ATOM 0 HA ASN A 111 11.082 -5.624 -14.409 1.00 0.00 H new ATOM 0 HB2 ASN A 111 13.888 -6.248 -15.384 1.00 0.00 H new ATOM 0 HB3 ASN A 111 12.823 -5.025 -16.049 1.00 0.00 H new ATOM 0 HD21 ASN A 111 13.753 -2.532 -13.750 1.00 0.00 H new ATOM 0 HD22 ASN A 111 12.885 -2.985 -15.220 1.00 0.00 H new ATOM 1719 N GLU A 112 10.142 -7.369 -15.884 1.00 0.00 N ATOM 1720 CA GLU A 112 9.523 -8.068 -17.024 1.00 0.00 C ATOM 1721 C GLU A 112 8.932 -7.008 -17.973 1.00 0.00 C ATOM 1722 O GLU A 112 8.914 -5.825 -17.625 1.00 0.00 O ATOM 1723 CB GLU A 112 8.418 -9.002 -16.495 1.00 0.00 C ATOM 1724 CG GLU A 112 8.930 -10.124 -15.582 1.00 0.00 C ATOM 1725 CD GLU A 112 9.892 -11.069 -16.295 1.00 0.00 C ATOM 1726 OE1 GLU A 112 9.427 -11.911 -17.094 1.00 0.00 O ATOM 1727 OE2 GLU A 112 11.116 -10.974 -16.060 1.00 0.00 O ATOM 0 H GLU A 112 9.474 -6.941 -15.243 1.00 0.00 H new ATOM 0 HA GLU A 112 10.256 -8.667 -17.564 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.686 -8.408 -15.947 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.897 -9.447 -17.343 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.431 -9.685 -14.719 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.082 -10.694 -15.202 1.00 0.00 H new ATOM 1734 N PRO A 113 8.410 -7.357 -19.161 1.00 0.00 N ATOM 1735 CA PRO A 113 7.898 -6.338 -20.099 1.00 0.00 C ATOM 1736 C PRO A 113 6.829 -5.341 -19.608 1.00 0.00 C ATOM 1737 O PRO A 113 6.634 -4.284 -20.207 1.00 0.00 O ATOM 1738 CB PRO A 113 7.460 -7.181 -21.294 1.00 0.00 C ATOM 1739 CG PRO A 113 8.450 -8.347 -21.293 1.00 0.00 C ATOM 1740 CD PRO A 113 8.727 -8.639 -19.816 1.00 0.00 C ATOM 0 HA PRO A 113 8.677 -5.605 -20.309 1.00 0.00 H new ATOM 0 HB2 PRO A 113 6.432 -7.527 -21.185 1.00 0.00 H new ATOM 0 HB3 PRO A 113 7.509 -6.614 -22.224 1.00 0.00 H new ATOM 0 HG2 PRO A 113 8.031 -9.219 -21.795 1.00 0.00 H new ATOM 0 HG3 PRO A 113 9.367 -8.085 -21.821 1.00 0.00 H new ATOM 0 HD2 PRO A 113 8.102 -9.450 -19.441 1.00 0.00 H new ATOM 0 HD3 PRO A 113 9.764 -8.932 -19.650 1.00 0.00 H new ATOM 1748 N ASP A 114 6.218 -5.629 -18.470 1.00 0.00 N ATOM 1749 CA ASP A 114 5.642 -4.567 -17.628 1.00 0.00 C ATOM 1750 C ASP A 114 6.187 -4.846 -16.225 1.00 0.00 C ATOM 1751 O ASP A 114 5.969 -5.920 -15.658 1.00 0.00 O ATOM 1752 CB ASP A 114 4.115 -4.574 -17.573 1.00 0.00 C ATOM 1753 CG ASP A 114 3.438 -4.635 -18.940 1.00 0.00 C ATOM 1754 OD1 ASP A 114 3.367 -3.593 -19.625 1.00 0.00 O ATOM 1755 OD2 ASP A 114 2.977 -5.729 -19.334 1.00 0.00 O ATOM 0 H ASP A 114 6.104 -6.574 -18.103 1.00 0.00 H new ATOM 0 HA ASP A 114 5.912 -3.593 -18.036 1.00 0.00 H new ATOM 0 HB2 ASP A 114 3.788 -5.428 -16.980 1.00 0.00 H new ATOM 0 HB3 ASP A 114 3.778 -3.677 -17.053 1.00 0.00 H new ATOM 1760 N TYR A 115 6.995 -3.932 -15.708 1.00 0.00 N ATOM 1761 CA TYR A 115 7.832 -4.255 -14.550 1.00 0.00 C ATOM 1762 C TYR A 115 7.045 -4.074 -13.249 1.00 0.00 C ATOM 1763 O TYR A 115 6.201 -3.178 -13.132 1.00 0.00 O ATOM 1764 CB TYR A 115 9.050 -3.327 -14.699 1.00 0.00 C ATOM 1765 CG TYR A 115 9.546 -2.617 -13.450 1.00 0.00 C ATOM 1766 CD1 TYR A 115 10.452 -3.190 -12.612 1.00 0.00 C ATOM 1767 CD2 TYR A 115 9.114 -1.350 -13.214 1.00 0.00 C ATOM 1768 CE1 TYR A 115 10.993 -2.459 -11.602 1.00 0.00 C ATOM 1769 CE2 TYR A 115 9.653 -0.622 -12.204 1.00 0.00 C ATOM 1770 CZ TYR A 115 10.609 -1.168 -11.411 1.00 0.00 C ATOM 1771 OH TYR A 115 11.151 -0.427 -10.395 1.00 0.00 O ATOM 0 H TYR A 115 7.092 -2.979 -16.059 1.00 0.00 H new ATOM 0 HA TYR A 115 8.156 -5.295 -14.508 1.00 0.00 H new ATOM 0 HB2 TYR A 115 9.874 -3.916 -15.102 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.807 -2.569 -15.443 1.00 0.00 H new ATOM 0 HD1 TYR A 115 10.740 -4.222 -12.749 1.00 0.00 H new ATOM 0 HD2 TYR A 115 8.339 -0.921 -13.832 1.00 0.00 H new ATOM 0 HE1 TYR A 115 11.730 -2.904 -10.949 1.00 0.00 H new ATOM 0 HE2 TYR A 115 9.321 0.391 -12.031 1.00 0.00 H new ATOM 0 HH TYR A 115 10.442 0.078 -9.944 1.00 0.00 H new ATOM 1781 N CYS A 116 7.251 -5.020 -12.328 1.00 0.00 N ATOM 1782 CA CYS A 116 6.736 -4.894 -10.952 1.00 0.00 C ATOM 1783 C CYS A 116 7.658 -5.567 -9.940 1.00 0.00 C ATOM 1784 O CYS A 116 8.851 -5.785 -10.155 1.00 0.00 O ATOM 1785 CB CYS A 116 5.345 -5.547 -10.845 1.00 0.00 C ATOM 1786 SG CYS A 116 5.413 -7.236 -11.484 1.00 0.00 S ATOM 0 H CYS A 116 7.769 -5.881 -12.505 1.00 0.00 H new ATOM 0 HA CYS A 116 6.679 -3.829 -10.728 1.00 0.00 H new ATOM 0 HB2 CYS A 116 5.015 -5.554 -9.806 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.615 -4.964 -11.407 1.00 0.00 H new ATOM 0 HG CYS A 116 4.500 -7.957 -10.904 1.00 0.00 H new ATOM 1792 N TRP A 117 7.012 -5.939 -8.830 1.00 0.00 N ATOM 1793 CA TRP A 117 7.677 -6.511 -7.658 1.00 0.00 C ATOM 1794 C TRP A 117 6.781 -7.664 -7.221 1.00 0.00 C ATOM 1795 O TRP A 117 5.577 -7.477 -7.042 1.00 0.00 O ATOM 1796 CB TRP A 117 7.702 -5.540 -6.473 1.00 0.00 C ATOM 1797 CG TRP A 117 8.093 -4.121 -6.781 1.00 0.00 C ATOM 1798 CD1 TRP A 117 8.807 -3.661 -7.869 1.00 0.00 C ATOM 1799 CD2 TRP A 117 7.771 -3.017 -6.060 1.00 0.00 C ATOM 1800 NE1 TRP A 117 8.971 -2.285 -7.843 1.00 0.00 N ATOM 1801 CE2 TRP A 117 8.317 -1.917 -6.678 1.00 0.00 C ATOM 1802 CE3 TRP A 117 7.072 -2.915 -4.908 1.00 0.00 C ATOM 1803 CZ2 TRP A 117 8.279 -0.707 -6.060 1.00 0.00 C ATOM 1804 CZ3 TRP A 117 6.950 -1.693 -4.345 1.00 0.00 C ATOM 1805 CH2 TRP A 117 7.600 -0.617 -4.874 1.00 0.00 C ATOM 0 H TRP A 117 6.002 -5.850 -8.720 1.00 0.00 H new ATOM 0 HA TRP A 117 8.701 -6.779 -7.917 1.00 0.00 H new ATOM 0 HB2 TRP A 117 6.712 -5.531 -6.018 1.00 0.00 H new ATOM 0 HB3 TRP A 117 8.393 -5.930 -5.726 1.00 0.00 H new ATOM 0 HD1 TRP A 117 9.193 -4.299 -8.650 1.00 0.00 H new ATOM 0 HE1 TRP A 117 9.454 -1.690 -8.516 1.00 0.00 H new ATOM 0 HE3 TRP A 117 6.624 -3.785 -4.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 8.768 0.155 -6.490 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.332 -1.567 -3.468 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.579 0.325 -4.347 1.00 0.00 H new ATOM 1816 N ILE A 118 7.333 -8.843 -7.005 1.00 0.00 N ATOM 1817 CA ILE A 118 6.531 -9.918 -6.412 1.00 0.00 C ATOM 1818 C ILE A 118 7.050 -10.180 -4.998 1.00 0.00 C ATOM 1819 O ILE A 118 8.249 -10.176 -4.722 1.00 0.00 O ATOM 1820 CB ILE A 118 6.436 -11.131 -7.361 1.00 0.00 C ATOM 1821 CG1 ILE A 118 6.209 -12.476 -6.659 1.00 0.00 C ATOM 1822 CG2 ILE A 118 7.626 -11.312 -8.296 1.00 0.00 C ATOM 1823 CD1 ILE A 118 5.333 -13.334 -7.562 1.00 0.00 C ATOM 0 H ILE A 118 8.300 -9.085 -7.220 1.00 0.00 H new ATOM 0 HA ILE A 118 5.486 -9.634 -6.292 1.00 0.00 H new ATOM 0 HB ILE A 118 5.554 -10.865 -7.944 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.161 -12.972 -6.468 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.728 -12.325 -5.692 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.466 -12.190 -8.923 1.00 0.00 H new ATOM 0 HG22 ILE A 118 7.730 -10.430 -8.927 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.534 -11.447 -7.708 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.155 -14.299 -7.087 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.381 -12.831 -7.730 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.835 -13.487 -8.517 1.00 0.00 H new ATOM 1835 N LYS A 119 6.108 -10.496 -4.122 1.00 0.00 N ATOM 1836 CA LYS A 119 6.437 -10.660 -2.699 1.00 0.00 C ATOM 1837 C LYS A 119 7.066 -12.040 -2.484 1.00 0.00 C ATOM 1838 O LYS A 119 6.562 -13.065 -2.949 1.00 0.00 O ATOM 1839 CB LYS A 119 5.133 -10.509 -1.898 1.00 0.00 C ATOM 1840 CG LYS A 119 5.332 -10.613 -0.384 1.00 0.00 C ATOM 1841 CD LYS A 119 4.005 -10.448 0.362 1.00 0.00 C ATOM 1842 CE LYS A 119 4.207 -10.552 1.873 1.00 0.00 C ATOM 1843 NZ LYS A 119 2.921 -10.403 2.571 1.00 0.00 N ATOM 0 H LYS A 119 5.126 -10.643 -4.356 1.00 0.00 H new ATOM 0 HA LYS A 119 7.154 -9.910 -2.366 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.682 -9.545 -2.132 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.428 -11.277 -2.218 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.773 -11.579 -0.138 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.035 -9.849 -0.054 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.564 -9.482 0.117 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.301 -11.213 0.033 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.654 -11.514 2.122 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.902 -9.782 2.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.084 -10.008 3.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.305 -9.763 2.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 2.463 -11.333 2.658 1.00 0.00 H new ATOM 1857 N MET A 120 8.154 -12.047 -1.720 1.00 0.00 N ATOM 1858 CA MET A 120 8.747 -13.307 -1.251 1.00 0.00 C ATOM 1859 C MET A 120 8.651 -13.413 0.278 1.00 0.00 C ATOM 1860 O MET A 120 8.544 -12.415 0.994 1.00 0.00 O ATOM 1861 CB MET A 120 10.203 -13.327 -1.743 1.00 0.00 C ATOM 1862 CG MET A 120 10.924 -14.656 -1.499 1.00 0.00 C ATOM 1863 SD MET A 120 10.024 -15.995 -2.301 1.00 0.00 S ATOM 1864 CE MET A 120 11.056 -17.385 -1.803 1.00 0.00 C ATOM 0 H MET A 120 8.643 -11.207 -1.412 1.00 0.00 H new ATOM 0 HA MET A 120 8.212 -14.170 -1.647 1.00 0.00 H new ATOM 0 HB2 MET A 120 10.218 -13.108 -2.811 1.00 0.00 H new ATOM 0 HB3 MET A 120 10.755 -12.529 -1.246 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.941 -14.605 -1.888 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.001 -14.847 -0.429 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.646 -18.308 -2.213 1.00 0.00 H new ATOM 0 HE2 MET A 120 12.069 -17.239 -2.179 1.00 0.00 H new ATOM 0 HE3 MET A 120 11.078 -17.450 -0.715 1.00 0.00 H new