USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1185 hydrogens (30 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 1 FME CE :methyl -134:sc= -0.105 (180deg=-1.75) USER MOD Set 1.2: C 42 THR OG1 : rot 73:sc= 0.736 USER MOD Set 2.1: A 42 THR OG1 : rot 71:sc= 0.727 USER MOD Set 2.2: C 1 FME CE :methyl -135:sc= -0.0899 (180deg=-1.65) USER MOD Set 3.1: A 1 FME CE :methyl -135:sc= -0.0621 (180deg=-2!) USER MOD Set 3.2: B 42 THR OG1 : rot 72:sc= 0.723 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 14 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00671) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -166:sc=-0.00493 (180deg=-0.107) USER MOD Single : A 37 THR OG1 : rot -165:sc= -0.599 USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.186 K(o=-0.19,f=-0.85) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc= 1.18 (180deg=1.16) USER MOD Single : A 50 HIS : no HD1:sc= -1.11 K(o=-1.1,f=-5.9!) USER MOD Single : A 52 ASN : amide:sc= -0.988 K(o=-0.99,f=-2.1) USER MOD Single : A 53 LYS NZ :NH3+ -138:sc= 1.3 (180deg=0.6) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.0449 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0902) USER MOD Single : B 37 THR OG1 : rot -166:sc= -0.924 USER MOD Single : B 39 GLN : amide:sc=-0.00182 K(o=-0.0018,f=-0.7) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.345 K(o=-0.35,f=-0.94) USER MOD Single : B 49 LYS NZ :NH3+ 167:sc= 1.28 (180deg=1.12) USER MOD Single : B 50 HIS : no HD1:sc= -1.8 K(o=-1.8,f=-6.3!) USER MOD Single : B 52 ASN : amide:sc= -0.429 K(o=-0.43,f=-1.2) USER MOD Single : B 53 LYS NZ :NH3+ -156:sc= 1.22 (180deg=0.721) USER MOD Single : C 5 THR OG1 : rot 180:sc= -0.101 USER MOD Single : C 14 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00449) USER MOD Single : C 24 THR OG1 : rot 86:sc= 0.00852 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0311) USER MOD Single : C 37 THR OG1 : rot -165:sc= -0.806 USER MOD Single : C 39 GLN : amide:sc= -0.0173 K(o=-0.017,f=-0.69) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 48 GLN : amide:sc= -0.408 K(o=-0.41,f=-1.2) USER MOD Single : C 49 LYS NZ :NH3+ -154:sc= 1.3 (180deg=1.03) USER MOD Single : C 50 HIS : no HD1:sc= -1.41 K(o=-1.4,f=-5.8!) USER MOD Single : C 52 ASN : amide:sc= -0.763 K(o=-0.76,f=-1.6) USER MOD Single : C 53 LYS NZ :NH3+ -168:sc= 1.3 (180deg=0.74) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 1.524 -11.712 12.741 1.00 0.00 N HETATM 2 CN FME A 1 2.694 -11.110 12.582 1.00 0.00 C HETATM 3 O1 FME A 1 3.748 -11.622 12.953 1.00 0.00 O HETATM 4 CA FME A 1 0.292 -11.090 12.282 1.00 0.00 C HETATM 5 CB FME A 1 -0.612 -12.124 11.599 1.00 0.00 C HETATM 6 CG FME A 1 -1.958 -11.567 11.160 1.00 0.00 C HETATM 7 SD FME A 1 -2.867 -12.686 10.074 1.00 0.00 S HETATM 8 CE FME A 1 -1.869 -12.603 8.586 1.00 0.00 C HETATM 9 C FME A 1 -0.444 -10.423 13.437 1.00 0.00 C HETATM 10 O FME A 1 -1.151 -11.078 14.202 1.00 0.00 O HETATM 0 HG3 FME A 1 -2.562 -11.356 12.042 1.00 0.00 H new HETATM 0 HG2 FME A 1 -1.802 -10.619 10.646 1.00 0.00 H new HETATM 0 HE3 FME A 1 -2.519 -12.495 7.718 1.00 0.00 H new HETATM 0 HE2 FME A 1 -1.197 -11.747 8.646 1.00 0.00 H new HETATM 0 HE1 FME A 1 -1.284 -13.517 8.489 1.00 0.00 H new HETATM 0 HCN FME A 1 2.722 -10.129 12.107 1.00 0.00 H new HETATM 0 HB3 FME A 1 -0.094 -12.527 10.728 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.779 -12.956 12.284 1.00 0.00 H new HETATM 0 HA FME A 1 0.553 -10.321 11.554 1.00 0.00 H new HETATM 0 H FME A 1 1.487 -12.626 13.192 1.00 0.00 H new ATOM 21 N VAL A 2 -0.253 -9.118 13.569 1.00 0.00 N ATOM 22 CA VAL A 2 -0.980 -8.329 14.555 1.00 0.00 C ATOM 23 C VAL A 2 -2.031 -7.481 13.837 1.00 0.00 C ATOM 24 O VAL A 2 -2.711 -6.641 14.426 1.00 0.00 O ATOM 25 CB VAL A 2 -0.019 -7.432 15.371 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.545 -6.307 14.512 1.00 0.00 C ATOM 27 CG2 VAL A 2 -0.702 -6.886 16.617 1.00 0.00 C ATOM 0 H VAL A 2 0.403 -8.580 13.002 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.471 -9.002 15.258 1.00 0.00 H new ATOM 0 HB VAL A 2 0.817 -8.050 15.697 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.217 -5.693 15.112 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.094 -6.731 13.672 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.272 -5.691 14.137 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.003 -6.259 17.170 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.569 -6.293 16.326 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.024 -7.714 17.248 1.00 0.00 H new ATOM 37 N ILE A 3 -2.150 -7.739 12.544 1.00 0.00 N ATOM 38 CA ILE A 3 -3.121 -7.064 11.705 1.00 0.00 C ATOM 39 C ILE A 3 -3.755 -8.074 10.761 1.00 0.00 C ATOM 40 O ILE A 3 -3.060 -8.887 10.157 1.00 0.00 O ATOM 41 CB ILE A 3 -2.483 -5.901 10.898 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.567 -5.105 10.166 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.440 -6.419 9.908 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.041 -3.878 9.453 1.00 0.00 C ATOM 0 H ILE A 3 -1.576 -8.422 12.050 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.883 -6.627 12.350 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.976 -5.241 11.602 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.056 -5.755 9.440 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.328 -4.799 10.884 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.012 -5.581 9.359 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.650 -6.939 10.450 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.913 -7.108 9.208 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.865 -3.364 8.957 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.578 -3.207 10.177 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.301 -4.178 8.711 1.00 0.00 H new ATOM 56 N ALA A 4 -5.071 -8.058 10.675 1.00 0.00 N ATOM 57 CA ALA A 4 -5.777 -8.963 9.788 1.00 0.00 C ATOM 58 C ALA A 4 -6.629 -8.178 8.804 1.00 0.00 C ATOM 59 O ALA A 4 -7.101 -7.079 9.103 1.00 0.00 O ATOM 60 CB ALA A 4 -6.629 -9.931 10.589 1.00 0.00 C ATOM 0 H ALA A 4 -5.672 -7.429 11.207 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.046 -9.541 9.222 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.152 -10.603 9.909 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -5.991 -10.512 11.255 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.356 -9.373 11.179 1.00 0.00 H new ATOM 66 N THR A 5 -6.814 -8.759 7.626 1.00 0.00 N ATOM 67 CA THR A 5 -7.528 -8.111 6.535 1.00 0.00 C ATOM 68 C THR A 5 -8.990 -7.863 6.899 1.00 0.00 C ATOM 69 O THR A 5 -9.649 -7.019 6.302 1.00 0.00 O ATOM 70 CB THR A 5 -7.454 -8.976 5.262 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.132 -9.519 5.127 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.790 -8.161 4.022 1.00 0.00 C ATOM 0 H THR A 5 -6.473 -9.693 7.400 1.00 0.00 H new ATOM 0 HA THR A 5 -7.050 -7.149 6.351 1.00 0.00 H new ATOM 0 HB THR A 5 -8.184 -9.780 5.355 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.086 -10.070 4.318 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.729 -8.799 3.140 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.800 -7.761 4.112 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.082 -7.338 3.924 1.00 0.00 H new ATOM 80 N ASP A 6 -9.470 -8.564 7.919 1.00 0.00 N ATOM 81 CA ASP A 6 -10.871 -8.480 8.316 1.00 0.00 C ATOM 82 C ASP A 6 -11.121 -7.260 9.192 1.00 0.00 C ATOM 83 O ASP A 6 -12.260 -6.979 9.568 1.00 0.00 O ATOM 84 CB ASP A 6 -11.291 -9.745 9.071 1.00 0.00 C ATOM 85 CG ASP A 6 -11.193 -10.994 8.220 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.102 -11.603 8.174 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.208 -11.379 7.597 1.00 0.00 O ATOM 0 H ASP A 6 -8.909 -9.198 8.488 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.467 -8.386 7.408 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.662 -9.862 9.954 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.316 -9.630 9.423 1.00 0.00 H new ATOM 92 N ASP A 7 -10.059 -6.538 9.529 1.00 0.00 N ATOM 93 CA ASP A 7 -10.196 -5.318 10.319 1.00 0.00 C ATOM 94 C ASP A 7 -10.056 -4.079 9.447 1.00 0.00 C ATOM 95 O ASP A 7 -10.421 -2.974 9.854 1.00 0.00 O ATOM 96 CB ASP A 7 -9.138 -5.275 11.425 1.00 0.00 C ATOM 97 CG ASP A 7 -9.324 -6.361 12.464 1.00 0.00 C ATOM 98 OD1 ASP A 7 -10.139 -6.167 13.391 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.653 -7.405 12.365 1.00 0.00 O ATOM 0 H ASP A 7 -9.100 -6.772 9.271 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.191 -5.326 10.764 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.149 -5.373 10.978 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.171 -4.302 11.915 1.00 0.00 H new ATOM 104 N LEU A 8 -9.527 -4.258 8.246 1.00 0.00 N ATOM 105 CA LEU A 8 -9.357 -3.140 7.324 1.00 0.00 C ATOM 106 C LEU A 8 -10.273 -3.291 6.126 1.00 0.00 C ATOM 107 O LEU A 8 -10.529 -2.331 5.397 1.00 0.00 O ATOM 108 CB LEU A 8 -7.904 -3.008 6.870 1.00 0.00 C ATOM 109 CG LEU A 8 -6.955 -2.407 7.908 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.642 -3.404 9.012 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.679 -1.928 7.241 1.00 0.00 C ATOM 0 H LEU A 8 -9.210 -5.158 7.887 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.626 -2.228 7.857 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.535 -3.995 6.591 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.874 -2.391 5.972 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.452 -1.552 8.365 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.965 -2.947 9.734 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.566 -3.694 9.513 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.170 -4.287 8.582 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.013 -1.503 7.992 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.186 -2.769 6.753 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.920 -1.168 6.498 1.00 0.00 H new ATOM 123 N GLU A 9 -10.771 -4.499 5.944 1.00 0.00 N ATOM 124 CA GLU A 9 -11.731 -4.787 4.903 1.00 0.00 C ATOM 125 C GLU A 9 -12.871 -5.601 5.489 1.00 0.00 C ATOM 126 O GLU A 9 -12.655 -6.531 6.264 1.00 0.00 O ATOM 127 CB GLU A 9 -11.088 -5.535 3.734 1.00 0.00 C ATOM 128 CG GLU A 9 -10.105 -4.689 2.939 1.00 0.00 C ATOM 129 CD GLU A 9 -9.554 -5.407 1.723 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.825 -6.612 1.558 1.00 0.00 O ATOM 131 OE2 GLU A 9 -8.853 -4.760 0.919 1.00 0.00 O ATOM 0 H GLU A 9 -10.520 -5.306 6.515 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.112 -3.844 4.512 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.571 -6.415 4.117 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.872 -5.891 3.066 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.599 -3.772 2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.279 -4.397 3.587 1.00 0.00 H new ATOM 138 N VAL A 10 -14.078 -5.229 5.130 1.00 0.00 N ATOM 139 CA VAL A 10 -15.267 -5.886 5.625 1.00 0.00 C ATOM 140 C VAL A 10 -16.148 -6.266 4.447 1.00 0.00 C ATOM 141 O VAL A 10 -16.243 -5.524 3.468 1.00 0.00 O ATOM 142 CB VAL A 10 -16.044 -4.974 6.612 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.437 -3.658 5.954 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.274 -5.686 7.162 1.00 0.00 C ATOM 0 H VAL A 10 -14.264 -4.461 4.485 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.975 -6.783 6.171 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.378 -4.749 7.445 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.980 -3.041 6.670 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.540 -3.132 5.628 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.073 -3.858 5.092 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.800 -5.025 7.851 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.937 -5.955 6.340 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.966 -6.589 7.690 1.00 0.00 H new ATOM 154 N ALA A 11 -16.779 -7.425 4.529 1.00 0.00 N ATOM 155 CA ALA A 11 -17.620 -7.908 3.452 1.00 0.00 C ATOM 156 C ALA A 11 -18.805 -6.981 3.246 1.00 0.00 C ATOM 157 O ALA A 11 -19.436 -6.538 4.208 1.00 0.00 O ATOM 158 CB ALA A 11 -18.081 -9.319 3.784 1.00 0.00 C ATOM 0 H ALA A 11 -16.723 -8.049 5.334 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.053 -7.926 2.521 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.715 -9.693 2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.213 -9.969 3.894 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.646 -9.307 4.716 1.00 0.00 H new ATOM 164 N CYS A 12 -19.081 -6.676 1.977 1.00 0.00 N ATOM 165 CA CYS A 12 -20.044 -5.656 1.591 1.00 0.00 C ATOM 166 C CYS A 12 -21.463 -5.915 2.099 1.00 0.00 C ATOM 167 O CYS A 12 -21.781 -7.010 2.548 1.00 0.00 O ATOM 168 CB CYS A 12 -20.081 -5.549 0.070 1.00 0.00 C ATOM 169 SG CYS A 12 -19.470 -3.975 -0.536 1.00 0.00 S ATOM 0 H CYS A 12 -18.635 -7.138 1.184 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.708 -4.728 2.054 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.485 -6.354 -0.360 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -21.105 -5.692 -0.274 1.00 0.00 H new ATOM 174 N PRO A 13 -22.337 -4.895 2.017 1.00 0.00 N ATOM 175 CA PRO A 13 -23.764 -5.038 2.321 1.00 0.00 C ATOM 176 C PRO A 13 -24.416 -6.268 1.673 1.00 0.00 C ATOM 177 O PRO A 13 -25.300 -6.891 2.259 1.00 0.00 O ATOM 178 CB PRO A 13 -24.355 -3.773 1.704 1.00 0.00 C ATOM 179 CG PRO A 13 -23.293 -2.744 1.834 1.00 0.00 C ATOM 180 CD PRO A 13 -21.988 -3.492 1.690 1.00 0.00 C ATOM 0 HA PRO A 13 -23.931 -5.168 3.390 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.623 -3.932 0.660 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.264 -3.469 2.224 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.393 -1.977 1.066 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.352 -2.239 2.798 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.589 -3.406 0.679 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.228 -3.102 2.367 1.00 0.00 H new ATOM 188 N LYS A 14 -23.966 -6.629 0.466 1.00 0.00 N ATOM 189 CA LYS A 14 -24.713 -7.584 -0.352 1.00 0.00 C ATOM 190 C LYS A 14 -23.845 -8.358 -1.362 1.00 0.00 C ATOM 191 O LYS A 14 -24.217 -9.454 -1.770 1.00 0.00 O ATOM 192 CB LYS A 14 -25.833 -6.833 -1.093 1.00 0.00 C ATOM 193 CG LYS A 14 -26.584 -7.663 -2.126 1.00 0.00 C ATOM 194 CD LYS A 14 -27.592 -6.808 -2.887 1.00 0.00 C ATOM 195 CE LYS A 14 -28.125 -7.528 -4.117 1.00 0.00 C ATOM 196 NZ LYS A 14 -28.870 -8.764 -3.765 1.00 0.00 N ATOM 0 H LYS A 14 -23.106 -6.281 0.043 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.120 -8.334 0.327 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.547 -6.459 -0.360 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.401 -5.964 -1.590 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.876 -8.106 -2.826 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.100 -8.486 -1.631 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.421 -6.550 -2.228 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.121 -5.872 -3.188 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.780 -6.857 -4.673 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.294 -7.782 -4.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.243 -9.203 -4.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.231 -9.430 -3.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.659 -8.525 -3.130 1.00 0.00 H new ATOM 210 N CYS A 15 -22.704 -7.821 -1.787 1.00 0.00 N ATOM 211 CA CYS A 15 -21.958 -8.474 -2.873 1.00 0.00 C ATOM 212 C CYS A 15 -20.568 -8.954 -2.486 1.00 0.00 C ATOM 213 O CYS A 15 -19.621 -8.825 -3.268 1.00 0.00 O ATOM 214 CB CYS A 15 -21.784 -7.446 -3.975 1.00 0.00 C ATOM 215 SG CYS A 15 -21.200 -5.834 -3.356 1.00 0.00 S ATOM 0 H CYS A 15 -22.283 -6.969 -1.417 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.528 -9.356 -3.165 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.075 -7.826 -4.710 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.735 -7.309 -4.490 1.00 0.00 H new ATOM 220 N GLU A 16 -20.459 -9.589 -1.347 1.00 0.00 N ATOM 221 CA GLU A 16 -19.171 -9.945 -0.797 1.00 0.00 C ATOM 222 C GLU A 16 -18.714 -11.311 -1.263 1.00 0.00 C ATOM 223 O GLU A 16 -17.934 -11.971 -0.579 1.00 0.00 O ATOM 224 CB GLU A 16 -19.262 -9.963 0.727 1.00 0.00 C ATOM 225 CG GLU A 16 -20.574 -9.441 1.292 1.00 0.00 C ATOM 226 CD GLU A 16 -21.665 -10.496 1.279 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.360 -10.631 0.253 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.822 -11.203 2.293 1.00 0.00 O ATOM 0 H GLU A 16 -21.254 -9.874 -0.775 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.450 -9.203 -1.141 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.114 -10.986 1.074 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.445 -9.367 1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.416 -9.097 2.314 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.899 -8.577 0.712 1.00 0.00 H new ATOM 235 N ARG A 17 -19.175 -11.742 -2.427 1.00 0.00 N ATOM 236 CA ARG A 17 -18.808 -13.043 -2.936 1.00 0.00 C ATOM 237 C ARG A 17 -18.773 -12.951 -4.465 1.00 0.00 C ATOM 238 O ARG A 17 -18.221 -13.815 -5.140 1.00 0.00 O ATOM 239 CB ARG A 17 -19.755 -14.160 -2.462 1.00 0.00 C ATOM 240 CG ARG A 17 -21.148 -14.140 -3.077 1.00 0.00 C ATOM 241 CD ARG A 17 -22.054 -13.116 -2.418 1.00 0.00 C ATOM 242 NE ARG A 17 -23.434 -13.257 -2.873 1.00 0.00 N ATOM 243 CZ ARG A 17 -24.495 -12.862 -2.174 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.339 -12.206 -1.030 1.00 0.00 N ATOM 245 NH2 ARG A 17 -25.717 -13.103 -2.636 1.00 0.00 N ATOM 0 H ARG A 17 -19.801 -11.209 -3.030 1.00 0.00 H new ATOM 0 HA ARG A 17 -17.828 -13.315 -2.545 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -19.293 -15.122 -2.682 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -19.854 -14.094 -1.378 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.070 -13.921 -4.142 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.596 -15.129 -2.988 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -22.012 -13.234 -1.335 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -21.695 -12.112 -2.643 1.00 0.00 H new ATOM 0 HE ARG A 17 -23.595 -13.685 -3.785 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.402 -12.002 -0.683 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.156 -11.906 -0.499 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -25.840 -13.590 -3.524 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -26.533 -12.802 -2.103 1.00 0.00 H new ATOM 259 N ALA A 18 -19.379 -11.873 -5.008 1.00 0.00 N ATOM 260 CA ALA A 18 -19.486 -11.701 -6.458 1.00 0.00 C ATOM 261 C ALA A 18 -18.760 -10.450 -6.935 1.00 0.00 C ATOM 262 O ALA A 18 -18.244 -10.411 -8.050 1.00 0.00 O ATOM 263 CB ALA A 18 -20.942 -11.638 -6.886 1.00 0.00 C ATOM 0 H ALA A 18 -19.796 -11.119 -4.462 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.011 -12.568 -6.918 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -20.998 -11.510 -7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.445 -12.563 -6.604 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.429 -10.796 -6.395 1.00 0.00 H new ATOM 269 N GLY A 19 -18.718 -9.430 -6.085 1.00 0.00 N ATOM 270 CA GLY A 19 -18.040 -8.204 -6.448 1.00 0.00 C ATOM 271 C GLY A 19 -18.931 -7.218 -7.178 1.00 0.00 C ATOM 272 O GLY A 19 -18.452 -6.202 -7.648 1.00 0.00 O ATOM 0 H GLY A 19 -19.140 -9.432 -5.156 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.650 -7.732 -5.546 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.183 -8.444 -7.078 1.00 0.00 H new ATOM 276 N GLU A 20 -20.234 -7.469 -7.158 1.00 0.00 N ATOM 277 CA GLU A 20 -21.202 -6.693 -7.950 1.00 0.00 C ATOM 278 C GLU A 20 -22.587 -6.932 -7.383 1.00 0.00 C ATOM 279 O GLU A 20 -22.781 -7.844 -6.582 1.00 0.00 O ATOM 280 CB GLU A 20 -21.214 -7.053 -9.450 1.00 0.00 C ATOM 281 CG GLU A 20 -19.895 -6.838 -10.177 1.00 0.00 C ATOM 282 CD GLU A 20 -19.590 -5.370 -10.420 1.00 0.00 C ATOM 283 OE1 GLU A 20 -19.695 -4.564 -9.468 1.00 0.00 O ATOM 284 OE2 GLU A 20 -19.240 -5.022 -11.570 1.00 0.00 O ATOM 0 H GLU A 20 -20.656 -8.210 -6.598 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.901 -5.648 -7.882 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -21.502 -8.099 -9.554 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.984 -6.460 -9.944 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -19.087 -7.281 -9.594 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -19.922 -7.362 -11.132 1.00 0.00 H new ATOM 291 N ILE A 21 -23.551 -6.155 -7.821 1.00 0.00 N ATOM 292 CA ILE A 21 -24.887 -6.232 -7.268 1.00 0.00 C ATOM 293 C ILE A 21 -25.920 -6.212 -8.378 1.00 0.00 C ATOM 294 O ILE A 21 -25.964 -5.278 -9.171 1.00 0.00 O ATOM 295 CB ILE A 21 -25.165 -5.077 -6.272 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.394 -5.305 -4.964 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.657 -4.941 -5.999 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.663 -4.269 -3.891 1.00 0.00 C ATOM 0 H ILE A 21 -23.436 -5.461 -8.560 1.00 0.00 H new ATOM 0 HA ILE A 21 -24.959 -7.172 -6.722 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.820 -4.146 -6.722 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.649 -6.290 -4.573 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.326 -5.315 -5.183 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.826 -4.124 -5.297 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.180 -4.732 -6.932 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.035 -5.870 -5.572 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -24.079 -4.506 -3.002 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -24.381 -3.283 -4.259 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -25.724 -4.273 -3.640 1.00 0.00 H new ATOM 310 N GLU A 22 -26.748 -7.245 -8.412 1.00 0.00 N ATOM 311 CA GLU A 22 -27.824 -7.342 -9.386 1.00 0.00 C ATOM 312 C GLU A 22 -27.283 -7.247 -10.818 1.00 0.00 C ATOM 313 O GLU A 22 -27.820 -6.518 -11.651 1.00 0.00 O ATOM 314 CB GLU A 22 -28.819 -6.211 -9.109 1.00 0.00 C ATOM 315 CG GLU A 22 -30.234 -6.495 -9.567 1.00 0.00 C ATOM 316 CD GLU A 22 -30.837 -7.692 -8.859 1.00 0.00 C ATOM 317 OE1 GLU A 22 -31.019 -7.631 -7.626 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.111 -8.707 -9.531 1.00 0.00 O ATOM 0 H GLU A 22 -26.694 -8.035 -7.769 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.318 -8.309 -9.293 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.831 -6.008 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.466 -5.305 -9.601 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.855 -5.618 -9.387 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.237 -6.672 -10.643 1.00 0.00 H new ATOM 325 N GLY A 23 -26.187 -7.955 -11.092 1.00 0.00 N ATOM 326 CA GLY A 23 -25.594 -7.922 -12.425 1.00 0.00 C ATOM 327 C GLY A 23 -24.998 -6.572 -12.757 1.00 0.00 C ATOM 328 O GLY A 23 -24.552 -6.317 -13.875 1.00 0.00 O ATOM 0 H GLY A 23 -25.700 -8.548 -10.420 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.819 -8.685 -12.494 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.355 -8.172 -13.165 1.00 0.00 H new ATOM 332 N THR A 24 -25.017 -5.719 -11.772 1.00 0.00 N ATOM 333 CA THR A 24 -24.696 -4.324 -11.929 1.00 0.00 C ATOM 334 C THR A 24 -23.510 -3.920 -11.041 1.00 0.00 C ATOM 335 O THR A 24 -23.384 -4.401 -9.912 1.00 0.00 O ATOM 336 CB THR A 24 -25.982 -3.570 -11.562 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.871 -3.549 -12.686 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.744 -2.155 -11.054 1.00 0.00 C ATOM 0 H THR A 24 -25.261 -5.977 -10.816 1.00 0.00 H new ATOM 0 HA THR A 24 -24.380 -4.089 -12.945 1.00 0.00 H new ATOM 0 HB THR A 24 -26.432 -4.115 -10.732 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.691 -3.068 -12.446 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.700 -1.688 -10.816 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.124 -2.189 -10.158 1.00 0.00 H new ATOM 0 HG23 THR A 24 -25.238 -1.573 -11.824 1.00 0.00 H new ATOM 346 N PRO A 25 -22.614 -3.048 -11.557 1.00 0.00 N ATOM 347 CA PRO A 25 -21.417 -2.612 -10.826 1.00 0.00 C ATOM 348 C PRO A 25 -21.773 -1.983 -9.483 1.00 0.00 C ATOM 349 O PRO A 25 -22.611 -1.081 -9.400 1.00 0.00 O ATOM 350 CB PRO A 25 -20.762 -1.585 -11.761 1.00 0.00 C ATOM 351 CG PRO A 25 -21.844 -1.183 -12.703 1.00 0.00 C ATOM 352 CD PRO A 25 -22.697 -2.410 -12.878 1.00 0.00 C ATOM 0 HA PRO A 25 -20.756 -3.445 -10.586 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.384 -0.728 -11.204 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.915 -2.018 -12.293 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.426 -0.354 -12.302 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.432 -0.852 -13.656 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.724 -2.156 -13.142 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.317 -3.059 -13.667 1.00 0.00 H new ATOM 360 N CYS A 26 -21.132 -2.473 -8.438 1.00 0.00 N ATOM 361 CA CYS A 26 -21.496 -2.118 -7.075 1.00 0.00 C ATOM 362 C CYS A 26 -20.928 -0.758 -6.634 1.00 0.00 C ATOM 363 O CYS A 26 -19.776 -0.436 -6.921 1.00 0.00 O ATOM 364 CB CYS A 26 -21.032 -3.214 -6.120 1.00 0.00 C ATOM 365 SG CYS A 26 -21.556 -2.939 -4.407 1.00 0.00 S ATOM 0 H CYS A 26 -20.350 -3.124 -8.507 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.582 -2.026 -7.046 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.420 -4.173 -6.462 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.945 -3.280 -6.154 1.00 0.00 H new ATOM 370 N PRO A 27 -21.764 0.032 -5.905 1.00 0.00 N ATOM 371 CA PRO A 27 -21.446 1.374 -5.381 1.00 0.00 C ATOM 372 C PRO A 27 -19.980 1.620 -5.013 1.00 0.00 C ATOM 373 O PRO A 27 -19.330 2.509 -5.560 1.00 0.00 O ATOM 374 CB PRO A 27 -22.292 1.416 -4.109 1.00 0.00 C ATOM 375 CG PRO A 27 -23.507 0.597 -4.399 1.00 0.00 C ATOM 376 CD PRO A 27 -23.159 -0.320 -5.562 1.00 0.00 C ATOM 0 HA PRO A 27 -21.644 2.134 -6.137 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.741 1.011 -3.260 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.563 2.440 -3.854 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.798 0.016 -3.524 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.352 1.237 -4.652 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.246 -1.369 -5.280 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.828 -0.161 -6.407 1.00 0.00 H new ATOM 384 N ALA A 28 -19.459 0.802 -4.108 1.00 0.00 N ATOM 385 CA ALA A 28 -18.197 1.116 -3.442 1.00 0.00 C ATOM 386 C ALA A 28 -17.191 -0.018 -3.576 1.00 0.00 C ATOM 387 O ALA A 28 -16.042 0.104 -3.162 1.00 0.00 O ATOM 388 CB ALA A 28 -18.439 1.441 -1.977 1.00 0.00 C ATOM 0 H ALA A 28 -19.885 -0.078 -3.818 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.773 1.991 -3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.490 1.673 -1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.105 2.301 -1.900 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.896 0.583 -1.485 1.00 0.00 H new ATOM 394 N CYS A 29 -17.629 -1.124 -4.146 1.00 0.00 N ATOM 395 CA CYS A 29 -16.746 -2.252 -4.376 1.00 0.00 C ATOM 396 C CYS A 29 -16.868 -2.688 -5.829 1.00 0.00 C ATOM 397 O CYS A 29 -17.684 -3.540 -6.163 1.00 0.00 O ATOM 398 CB CYS A 29 -17.088 -3.411 -3.414 1.00 0.00 C ATOM 399 SG CYS A 29 -18.685 -4.231 -3.730 1.00 0.00 S ATOM 0 H CYS A 29 -18.590 -1.266 -4.458 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.715 -1.958 -4.180 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.296 -4.157 -3.473 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -17.090 -3.028 -2.394 1.00 0.00 H new ATOM 404 N SER A 30 -16.083 -2.071 -6.701 1.00 0.00 N ATOM 405 CA SER A 30 -16.154 -2.344 -8.132 1.00 0.00 C ATOM 406 C SER A 30 -15.544 -3.702 -8.489 1.00 0.00 C ATOM 407 O SER A 30 -14.670 -3.797 -9.350 1.00 0.00 O ATOM 408 CB SER A 30 -15.430 -1.229 -8.884 1.00 0.00 C ATOM 409 OG SER A 30 -15.804 0.044 -8.381 1.00 0.00 O ATOM 0 H SER A 30 -15.385 -1.374 -6.442 1.00 0.00 H new ATOM 0 HA SER A 30 -17.204 -2.378 -8.423 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.352 -1.360 -8.788 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.665 -1.289 -9.947 1.00 0.00 H new ATOM 0 HG SER A 30 -15.328 0.744 -8.875 1.00 0.00 H new ATOM 415 N GLY A 31 -15.996 -4.746 -7.812 1.00 0.00 N ATOM 416 CA GLY A 31 -15.574 -6.084 -8.144 1.00 0.00 C ATOM 417 C GLY A 31 -14.493 -6.600 -7.234 1.00 0.00 C ATOM 418 O GLY A 31 -13.446 -7.041 -7.703 1.00 0.00 O ATOM 0 H GLY A 31 -16.652 -4.686 -7.033 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.433 -6.753 -8.095 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.215 -6.101 -9.173 1.00 0.00 H new ATOM 422 N LYS A 32 -14.722 -6.540 -5.925 1.00 0.00 N ATOM 423 CA LYS A 32 -13.789 -7.093 -4.961 1.00 0.00 C ATOM 424 C LYS A 32 -14.526 -8.031 -4.004 1.00 0.00 C ATOM 425 O LYS A 32 -14.024 -9.097 -3.653 1.00 0.00 O ATOM 426 CB LYS A 32 -13.124 -5.969 -4.160 1.00 0.00 C ATOM 427 CG LYS A 32 -12.098 -5.171 -4.948 1.00 0.00 C ATOM 428 CD LYS A 32 -11.497 -4.052 -4.110 1.00 0.00 C ATOM 429 CE LYS A 32 -12.343 -2.788 -4.148 1.00 0.00 C ATOM 430 NZ LYS A 32 -12.236 -2.092 -5.462 1.00 0.00 N ATOM 0 H LYS A 32 -15.550 -6.111 -5.511 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.022 -7.650 -5.499 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.896 -5.290 -3.797 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.639 -6.399 -3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.305 -5.835 -5.292 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.568 -4.749 -5.836 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.395 -4.388 -3.078 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.494 -3.827 -4.473 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.385 -3.042 -3.954 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -12.026 -2.114 -3.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.624 -1.131 -5.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.237 -2.039 -5.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.773 -2.620 -6.179 1.00 0.00 H new ATOM 444 N GLY A 33 -15.726 -7.617 -3.576 1.00 0.00 N ATOM 445 CA GLY A 33 -16.494 -8.380 -2.631 1.00 0.00 C ATOM 446 C GLY A 33 -16.589 -7.641 -1.317 1.00 0.00 C ATOM 447 O GLY A 33 -17.644 -7.590 -0.691 1.00 0.00 O ATOM 0 H GLY A 33 -16.172 -6.752 -3.881 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.493 -8.563 -3.027 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -16.030 -9.354 -2.476 1.00 0.00 H new ATOM 451 N VAL A 34 -15.501 -7.000 -0.933 1.00 0.00 N ATOM 452 CA VAL A 34 -15.433 -6.324 0.352 1.00 0.00 C ATOM 453 C VAL A 34 -15.283 -4.817 0.187 1.00 0.00 C ATOM 454 O VAL A 34 -15.019 -4.316 -0.912 1.00 0.00 O ATOM 455 CB VAL A 34 -14.244 -6.849 1.189 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.407 -8.330 1.490 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.927 -6.593 0.469 1.00 0.00 C ATOM 0 H VAL A 34 -14.651 -6.932 -1.492 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.370 -6.535 0.867 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.231 -6.308 2.135 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.559 -8.677 2.080 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.328 -8.488 2.051 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.452 -8.889 0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.102 -6.970 1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.933 -7.104 -0.494 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.801 -5.522 0.311 1.00 0.00 H new ATOM 467 N ILE A 35 -15.475 -4.112 1.289 1.00 0.00 N ATOM 468 CA ILE A 35 -15.217 -2.685 1.362 1.00 0.00 C ATOM 469 C ILE A 35 -14.304 -2.385 2.542 1.00 0.00 C ATOM 470 O ILE A 35 -14.184 -3.188 3.460 1.00 0.00 O ATOM 471 CB ILE A 35 -16.514 -1.857 1.498 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.470 -2.529 2.486 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.171 -1.665 0.141 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.687 -1.696 2.823 1.00 0.00 C ATOM 0 H ILE A 35 -15.816 -4.516 2.162 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.737 -2.398 0.427 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.261 -0.871 1.887 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.798 -3.481 2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.929 -2.753 3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.083 -1.079 0.258 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.485 -1.140 -0.524 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.417 -2.638 -0.285 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.316 -2.239 3.528 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.370 -0.754 3.270 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.253 -1.494 1.914 1.00 0.00 H new ATOM 486 N LEU A 36 -13.671 -1.230 2.510 1.00 0.00 N ATOM 487 CA LEU A 36 -12.656 -0.892 3.499 1.00 0.00 C ATOM 488 C LEU A 36 -13.252 -0.259 4.748 1.00 0.00 C ATOM 489 O LEU A 36 -14.403 0.174 4.759 1.00 0.00 O ATOM 490 CB LEU A 36 -11.631 0.067 2.890 1.00 0.00 C ATOM 491 CG LEU A 36 -10.954 -0.433 1.613 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.731 -0.007 0.374 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.524 0.060 1.548 1.00 0.00 C ATOM 0 H LEU A 36 -13.838 -0.506 1.811 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.175 -1.825 3.794 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.126 1.014 2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.862 0.272 3.634 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.944 -1.523 1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.225 -0.377 -0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.739 -0.419 0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.786 1.081 0.335 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.055 -0.304 0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.514 1.150 1.552 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.972 -0.311 2.411 1.00 0.00 H new ATOM 505 N THR A 37 -12.443 -0.212 5.797 1.00 0.00 N ATOM 506 CA THR A 37 -12.805 0.458 7.034 1.00 0.00 C ATOM 507 C THR A 37 -12.036 1.766 7.108 1.00 0.00 C ATOM 508 O THR A 37 -11.200 2.014 6.249 1.00 0.00 O ATOM 509 CB THR A 37 -12.458 -0.407 8.267 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.036 -0.589 8.359 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.128 -1.769 8.184 1.00 0.00 C ATOM 0 H THR A 37 -11.517 -0.638 5.812 1.00 0.00 H new ATOM 0 HA THR A 37 -13.881 0.633 7.040 1.00 0.00 H new ATOM 0 HB THR A 37 -12.823 0.113 9.153 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.839 -1.315 8.987 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.867 -2.357 9.064 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.210 -1.640 8.141 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.788 -2.287 7.287 1.00 0.00 H new ATOM 519 N ALA A 38 -12.298 2.598 8.107 1.00 0.00 N ATOM 520 CA ALA A 38 -11.639 3.901 8.197 1.00 0.00 C ATOM 521 C ALA A 38 -10.116 3.776 8.148 1.00 0.00 C ATOM 522 O ALA A 38 -9.445 4.552 7.462 1.00 0.00 O ATOM 523 CB ALA A 38 -12.076 4.634 9.449 1.00 0.00 C ATOM 0 H ALA A 38 -12.955 2.400 8.862 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.945 4.482 7.327 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.575 5.601 9.498 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.155 4.785 9.424 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.813 4.044 10.327 1.00 0.00 H new ATOM 529 N GLN A 39 -9.569 2.805 8.875 1.00 0.00 N ATOM 530 CA GLN A 39 -8.137 2.529 8.819 1.00 0.00 C ATOM 531 C GLN A 39 -7.714 2.148 7.405 1.00 0.00 C ATOM 532 O GLN A 39 -6.708 2.641 6.896 1.00 0.00 O ATOM 533 CB GLN A 39 -7.757 1.415 9.796 1.00 0.00 C ATOM 534 CG GLN A 39 -6.263 1.134 9.832 1.00 0.00 C ATOM 535 CD GLN A 39 -5.879 0.103 10.870 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.544 -0.041 11.893 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.796 -0.610 10.614 1.00 0.00 N ATOM 0 H GLN A 39 -10.093 2.199 9.507 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.612 3.439 9.108 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.093 1.688 10.796 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.285 0.502 9.520 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -5.940 0.790 8.850 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.729 2.062 10.036 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.276 -0.455 9.750 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.481 -1.315 11.280 1.00 0.00 H new ATOM 546 N GLY A 40 -8.500 1.287 6.766 1.00 0.00 N ATOM 547 CA GLY A 40 -8.202 0.874 5.408 1.00 0.00 C ATOM 548 C GLY A 40 -8.383 2.006 4.418 1.00 0.00 C ATOM 549 O GLY A 40 -7.696 2.071 3.404 1.00 0.00 O ATOM 0 H GLY A 40 -9.339 0.868 7.166 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.176 0.508 5.357 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.851 0.043 5.131 1.00 0.00 H new ATOM 553 N TYR A 41 -9.300 2.914 4.730 1.00 0.00 N ATOM 554 CA TYR A 41 -9.536 4.087 3.904 1.00 0.00 C ATOM 555 C TYR A 41 -8.359 5.044 3.965 1.00 0.00 C ATOM 556 O TYR A 41 -8.004 5.666 2.963 1.00 0.00 O ATOM 557 CB TYR A 41 -10.808 4.799 4.380 1.00 0.00 C ATOM 558 CG TYR A 41 -12.084 4.307 3.731 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.341 4.552 2.389 1.00 0.00 C ATOM 560 CD2 TYR A 41 -13.033 3.603 4.458 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.505 4.109 1.791 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.199 3.156 3.869 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.430 3.409 2.536 1.00 0.00 C ATOM 564 OH TYR A 41 -15.589 2.961 1.943 1.00 0.00 O ATOM 0 H TYR A 41 -9.895 2.857 5.556 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.658 3.763 2.870 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.895 4.678 5.460 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.705 5.867 4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.618 5.099 1.802 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.856 3.401 5.504 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.689 4.310 0.746 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.926 2.610 4.452 1.00 0.00 H new ATOM 0 HH TYR A 41 -16.133 2.485 2.605 1.00 0.00 H new ATOM 574 N THR A 42 -7.731 5.129 5.121 1.00 0.00 N ATOM 575 CA THR A 42 -6.537 5.943 5.275 1.00 0.00 C ATOM 576 C THR A 42 -5.364 5.311 4.528 1.00 0.00 C ATOM 577 O THR A 42 -4.509 6.004 3.971 1.00 0.00 O ATOM 578 CB THR A 42 -6.175 6.092 6.763 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.324 6.525 7.500 1.00 0.00 O ATOM 580 CG2 THR A 42 -5.039 7.085 6.954 1.00 0.00 C ATOM 0 H THR A 42 -8.026 4.645 5.969 1.00 0.00 H new ATOM 0 HA THR A 42 -6.741 6.929 4.857 1.00 0.00 H new ATOM 0 HB THR A 42 -5.846 5.121 7.133 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.972 5.792 7.557 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.805 7.170 8.015 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.158 6.738 6.414 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.339 8.060 6.570 1.00 0.00 H new ATOM 588 N LEU A 43 -5.370 3.987 4.467 1.00 0.00 N ATOM 589 CA LEU A 43 -4.277 3.246 3.860 1.00 0.00 C ATOM 590 C LEU A 43 -4.509 3.104 2.367 1.00 0.00 C ATOM 591 O LEU A 43 -3.596 2.757 1.626 1.00 0.00 O ATOM 592 CB LEU A 43 -4.138 1.853 4.501 1.00 0.00 C ATOM 593 CG LEU A 43 -3.057 1.698 5.591 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.142 2.820 6.612 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.211 0.354 6.285 1.00 0.00 C ATOM 0 H LEU A 43 -6.123 3.404 4.832 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.354 3.800 4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.100 1.580 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.929 1.133 3.710 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.080 1.749 5.110 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.368 2.684 7.367 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.997 3.778 6.113 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.122 2.804 7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.445 0.251 7.053 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.197 0.293 6.746 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.102 -0.447 5.554 1.00 0.00 H new ATOM 607 N LEU A 44 -5.723 3.406 1.911 1.00 0.00 N ATOM 608 CA LEU A 44 -6.047 3.241 0.510 1.00 0.00 C ATOM 609 C LEU A 44 -5.749 4.526 -0.249 1.00 0.00 C ATOM 610 O LEU A 44 -5.173 4.491 -1.321 1.00 0.00 O ATOM 611 CB LEU A 44 -7.513 2.777 0.328 1.00 0.00 C ATOM 612 CG LEU A 44 -8.585 3.846 0.046 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.525 4.326 -1.398 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.968 3.286 0.314 1.00 0.00 C ATOM 0 H LEU A 44 -6.485 3.761 2.489 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.418 2.455 0.091 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.536 2.059 -0.491 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.807 2.241 1.230 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.386 4.689 0.708 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.295 5.080 -1.563 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.545 4.759 -1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.693 3.483 -2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.716 4.052 0.111 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.144 2.426 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.039 2.977 1.357 1.00 0.00 H new ATOM 626 N ASP A 45 -6.109 5.670 0.304 1.00 0.00 N ATOM 627 CA ASP A 45 -5.856 6.922 -0.392 1.00 0.00 C ATOM 628 C ASP A 45 -4.364 7.228 -0.377 1.00 0.00 C ATOM 629 O ASP A 45 -3.856 7.977 -1.213 1.00 0.00 O ATOM 630 CB ASP A 45 -6.648 8.066 0.236 1.00 0.00 C ATOM 631 CG ASP A 45 -6.713 9.271 -0.677 1.00 0.00 C ATOM 632 OD1 ASP A 45 -7.486 9.229 -1.661 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.997 10.259 -0.425 1.00 0.00 O ATOM 0 H ASP A 45 -6.567 5.761 1.211 1.00 0.00 H new ATOM 0 HA ASP A 45 -6.186 6.819 -1.426 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.659 7.727 0.463 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -6.187 8.351 1.182 1.00 0.00 H new ATOM 638 N PHE A 46 -3.664 6.584 0.546 1.00 0.00 N ATOM 639 CA PHE A 46 -2.213 6.642 0.609 1.00 0.00 C ATOM 640 C PHE A 46 -1.603 5.787 -0.484 1.00 0.00 C ATOM 641 O PHE A 46 -0.674 6.221 -1.170 1.00 0.00 O ATOM 642 CB PHE A 46 -1.777 6.105 1.973 1.00 0.00 C ATOM 643 CG PHE A 46 -0.306 6.171 2.263 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.246 7.299 2.844 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.515 5.089 1.988 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.593 7.350 3.143 1.00 0.00 C ATOM 647 CE2 PHE A 46 1.864 5.137 2.280 1.00 0.00 C ATOM 648 CZ PHE A 46 2.402 6.268 2.859 1.00 0.00 C ATOM 0 H PHE A 46 -4.088 6.006 1.272 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.878 7.670 0.472 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.306 6.661 2.747 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -2.097 5.066 2.052 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.383 8.148 3.066 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.096 4.200 1.541 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.013 8.235 3.598 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.497 4.291 2.056 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.456 6.307 3.090 1.00 0.00 H new ATOM 658 N ILE A 47 -2.131 4.590 -0.688 1.00 0.00 N ATOM 659 CA ILE A 47 -1.555 3.742 -1.703 1.00 0.00 C ATOM 660 C ILE A 47 -2.048 4.132 -3.085 1.00 0.00 C ATOM 661 O ILE A 47 -1.409 3.846 -4.085 1.00 0.00 O ATOM 662 CB ILE A 47 -1.724 2.221 -1.445 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.178 1.757 -1.194 1.00 0.00 C ATOM 664 CG2 ILE A 47 -0.861 1.842 -0.253 1.00 0.00 C ATOM 665 CD1 ILE A 47 -4.184 2.043 -2.296 1.00 0.00 C ATOM 0 H ILE A 47 -2.927 4.200 -0.183 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.480 3.917 -1.651 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.415 1.716 -2.360 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.166 0.682 -1.014 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.533 2.229 -0.278 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.964 0.775 -0.053 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.182 2.071 -0.472 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.181 2.408 0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.164 1.670 -2.000 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.241 3.118 -2.466 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.869 1.547 -3.214 1.00 0.00 H new ATOM 677 N GLN A 48 -3.182 4.792 -3.146 1.00 0.00 N ATOM 678 CA GLN A 48 -3.583 5.442 -4.360 1.00 0.00 C ATOM 679 C GLN A 48 -2.500 6.436 -4.754 1.00 0.00 C ATOM 680 O GLN A 48 -1.800 6.239 -5.723 1.00 0.00 O ATOM 681 CB GLN A 48 -4.927 6.145 -4.163 1.00 0.00 C ATOM 682 CG GLN A 48 -6.096 5.189 -3.970 1.00 0.00 C ATOM 683 CD GLN A 48 -6.244 4.192 -5.104 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.918 4.481 -6.256 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.736 3.008 -4.781 1.00 0.00 N ATOM 0 H GLN A 48 -3.836 4.889 -2.370 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.708 4.709 -5.157 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.860 6.802 -3.296 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.126 6.778 -5.028 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.964 4.648 -3.033 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -7.017 5.765 -3.878 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.994 2.809 -3.814 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.858 2.293 -5.499 1.00 0.00 H new ATOM 694 N LYS A 49 -2.256 7.385 -3.884 1.00 0.00 N ATOM 695 CA LYS A 49 -1.479 8.578 -4.209 1.00 0.00 C ATOM 696 C LYS A 49 0.035 8.303 -4.247 1.00 0.00 C ATOM 697 O LYS A 49 0.828 9.209 -4.500 1.00 0.00 O ATOM 698 CB LYS A 49 -1.843 9.645 -3.170 1.00 0.00 C ATOM 699 CG LYS A 49 -1.218 11.014 -3.379 1.00 0.00 C ATOM 700 CD LYS A 49 -1.229 11.818 -2.082 1.00 0.00 C ATOM 701 CE LYS A 49 -2.604 11.822 -1.421 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.589 12.528 -0.110 1.00 0.00 N ATOM 0 H LYS A 49 -2.589 7.360 -2.920 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.725 8.922 -5.214 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.927 9.759 -3.159 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.551 9.280 -2.185 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.193 10.901 -3.733 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.765 11.554 -4.152 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.496 11.401 -1.391 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.924 12.844 -2.289 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.324 12.303 -2.084 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.940 10.795 -1.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.437 12.270 0.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.739 12.253 0.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.580 13.556 -0.269 1.00 0.00 H new ATOM 716 N HIS A 50 0.457 7.065 -3.977 1.00 0.00 N ATOM 717 CA HIS A 50 1.846 6.715 -4.301 1.00 0.00 C ATOM 718 C HIS A 50 1.979 5.580 -5.330 1.00 0.00 C ATOM 719 O HIS A 50 3.099 5.232 -5.714 1.00 0.00 O ATOM 720 CB HIS A 50 2.609 6.362 -3.017 1.00 0.00 C ATOM 721 CG HIS A 50 2.514 7.432 -1.975 1.00 0.00 C ATOM 722 ND1 HIS A 50 2.931 8.721 -2.190 1.00 0.00 N ATOM 723 CD2 HIS A 50 1.990 7.414 -0.732 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.666 9.450 -1.127 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.089 8.684 -0.223 1.00 0.00 N ATOM 0 H HIS A 50 -0.105 6.324 -3.559 1.00 0.00 H new ATOM 0 HA HIS A 50 2.283 7.596 -4.770 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.217 5.430 -2.611 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.658 6.188 -3.259 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.569 6.556 -0.229 1.00 0.00 H new ATOM 0 HE1 HIS A 50 2.885 10.502 -1.014 1.00 0.00 H new ATOM 0 HE2 HIS A 50 1.770 8.984 0.698 1.00 0.00 H new ATOM 734 N LEU A 51 0.864 5.003 -5.785 1.00 0.00 N ATOM 735 CA LEU A 51 0.922 3.992 -6.857 1.00 0.00 C ATOM 736 C LEU A 51 0.021 4.377 -8.031 1.00 0.00 C ATOM 737 O LEU A 51 0.475 4.474 -9.173 1.00 0.00 O ATOM 738 CB LEU A 51 0.504 2.582 -6.381 1.00 0.00 C ATOM 739 CG LEU A 51 1.357 1.916 -5.286 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.836 1.912 -5.656 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.119 2.587 -3.953 1.00 0.00 C ATOM 0 H LEU A 51 -0.074 5.209 -5.440 1.00 0.00 H new ATOM 0 HA LEU A 51 1.966 3.963 -7.167 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.522 2.641 -6.018 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.498 1.923 -7.249 1.00 0.00 H new ATOM 0 HG LEU A 51 1.049 0.874 -5.200 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.409 1.435 -4.861 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.977 1.361 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.181 2.938 -5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 51 1.729 2.105 -3.189 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.390 3.641 -4.022 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.066 2.500 -3.685 1.00 0.00 H new ATOM 753 N ASN A 52 -1.250 4.607 -7.736 1.00 0.00 N ATOM 754 CA ASN A 52 -2.284 4.712 -8.768 1.00 0.00 C ATOM 755 C ASN A 52 -2.830 6.137 -8.924 1.00 0.00 C ATOM 756 O ASN A 52 -3.535 6.445 -9.887 1.00 0.00 O ATOM 757 CB ASN A 52 -3.405 3.729 -8.437 1.00 0.00 C ATOM 758 CG ASN A 52 -3.152 2.351 -9.023 1.00 0.00 C ATOM 759 OD1 ASN A 52 -2.006 1.927 -9.174 1.00 0.00 O ATOM 760 ND2 ASN A 52 -4.217 1.638 -9.356 1.00 0.00 N ATOM 0 H ASN A 52 -1.597 4.726 -6.784 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.834 4.462 -9.729 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -3.507 3.648 -7.355 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -4.350 4.116 -8.819 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -4.103 0.705 -9.752 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.152 2.022 -9.217 1.00 0.00 H new ATOM 767 N LYS A 53 -2.503 6.989 -7.974 1.00 0.00 N ATOM 768 CA LYS A 53 -2.802 8.406 -8.038 1.00 0.00 C ATOM 769 C LYS A 53 -1.501 9.165 -8.279 1.00 0.00 C ATOM 770 O LYS A 53 -1.205 9.482 -9.451 1.00 0.00 O ATOM 771 CB LYS A 53 -3.400 8.889 -6.716 1.00 0.00 C ATOM 772 CG LYS A 53 -4.876 9.245 -6.752 1.00 0.00 C ATOM 773 CD LYS A 53 -5.203 10.198 -5.602 1.00 0.00 C ATOM 774 CE LYS A 53 -5.605 9.477 -4.326 1.00 0.00 C ATOM 775 NZ LYS A 53 -7.028 9.049 -4.338 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.773 9.415 -7.299 1.00 0.00 O ATOM 0 H LYS A 53 -2.014 6.713 -7.122 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.517 8.582 -8.842 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.251 8.113 -5.966 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.842 9.765 -6.384 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.125 9.711 -7.705 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.480 8.341 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.335 10.825 -5.400 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.012 10.862 -5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.967 8.603 -4.190 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.433 10.133 -3.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.454 9.234 -3.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.544 9.581 -5.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.083 8.032 -4.547 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 9.581 6.984 12.714 1.00 0.00 N HETATM 792 CN FME B 1 8.514 7.742 12.501 1.00 0.00 C HETATM 793 O1 FME B 1 8.464 8.918 12.855 1.00 0.00 O HETATM 794 CA FME B 1 9.630 5.607 12.243 1.00 0.00 C HETATM 795 CB FME B 1 10.962 5.330 11.537 1.00 0.00 C HETATM 796 CG FME B 1 11.125 3.888 11.080 1.00 0.00 C HETATM 797 SD FME B 1 12.533 3.652 9.976 1.00 0.00 S HETATM 798 CE FME B 1 11.971 4.533 8.522 1.00 0.00 C HETATM 799 C FME B 1 9.424 4.622 13.388 1.00 0.00 C HETATM 800 O FME B 1 10.354 4.301 14.127 1.00 0.00 O HETATM 0 HG3 FME B 1 11.244 3.247 11.954 1.00 0.00 H new HETATM 0 HG2 FME B 1 10.215 3.569 10.572 1.00 0.00 H new HETATM 0 HE3 FME B 1 12.160 3.929 7.635 1.00 0.00 H new HETATM 0 HE2 FME B 1 10.902 4.729 8.606 1.00 0.00 H new HETATM 0 HE1 FME B 1 12.508 5.478 8.439 1.00 0.00 H new HETATM 0 HCN FME B 1 7.652 7.307 11.995 1.00 0.00 H new HETATM 0 HB3 FME B 1 11.048 5.988 10.672 1.00 0.00 H new HETATM 0 HB2 FME B 1 11.780 5.582 12.212 1.00 0.00 H new HETATM 0 HA FME B 1 8.817 5.469 11.530 1.00 0.00 H new HETATM 0 H FME B 1 10.380 7.372 13.216 1.00 0.00 H new ATOM 811 N VAL B 2 8.193 4.154 13.530 1.00 0.00 N ATOM 812 CA VAL B 2 7.872 3.116 14.501 1.00 0.00 C ATOM 813 C VAL B 2 7.635 1.799 13.760 1.00 0.00 C ATOM 814 O VAL B 2 7.213 0.791 14.328 1.00 0.00 O ATOM 815 CB VAL B 2 6.631 3.500 15.342 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.363 3.462 14.499 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.507 2.610 16.571 1.00 0.00 C ATOM 0 H VAL B 2 7.396 4.478 12.983 1.00 0.00 H new ATOM 0 HA VAL B 2 8.708 3.003 15.191 1.00 0.00 H new ATOM 0 HB VAL B 2 6.765 4.525 15.688 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.507 3.736 15.116 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.455 4.166 13.672 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.218 2.456 14.105 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.627 2.901 17.144 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.409 1.570 16.259 1.00 0.00 H new ATOM 0 HG23 VAL B 2 7.397 2.720 17.191 1.00 0.00 H new ATOM 827 N ILE B 3 7.926 1.837 12.472 1.00 0.00 N ATOM 828 CA ILE B 3 7.811 0.673 11.619 1.00 0.00 C ATOM 829 C ILE B 3 8.993 0.630 10.664 1.00 0.00 C ATOM 830 O ILE B 3 9.347 1.642 10.063 1.00 0.00 O ATOM 831 CB ILE B 3 6.477 0.663 10.827 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.309 -0.666 10.085 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.404 1.836 9.850 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.973 -0.809 9.390 1.00 0.00 C ATOM 0 H ILE B 3 8.248 2.676 11.990 1.00 0.00 H new ATOM 0 HA ILE B 3 7.814 -0.214 12.253 1.00 0.00 H new ATOM 0 HB ILE B 3 5.660 0.772 11.540 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.105 -0.763 9.347 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.430 -1.485 10.794 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.458 1.801 9.310 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.473 2.774 10.401 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.229 1.771 9.141 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.926 -1.774 8.886 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.171 -0.745 10.126 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.857 -0.011 8.657 1.00 0.00 H new ATOM 846 N ALA B 4 9.629 -0.520 10.562 1.00 0.00 N ATOM 847 CA ALA B 4 10.760 -0.676 9.669 1.00 0.00 C ATOM 848 C ALA B 4 10.496 -1.797 8.680 1.00 0.00 C ATOM 849 O ALA B 4 9.797 -2.766 8.987 1.00 0.00 O ATOM 850 CB ALA B 4 12.028 -0.938 10.463 1.00 0.00 C ATOM 0 H ALA B 4 9.382 -1.360 11.086 1.00 0.00 H new ATOM 0 HA ALA B 4 10.897 0.248 9.108 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.869 -1.053 9.779 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.218 -0.099 11.133 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.909 -1.850 11.048 1.00 0.00 H new ATOM 856 N THR B 5 11.062 -1.647 7.488 1.00 0.00 N ATOM 857 CA THR B 5 10.841 -2.579 6.393 1.00 0.00 C ATOM 858 C THR B 5 11.356 -3.974 6.737 1.00 0.00 C ATOM 859 O THR B 5 10.947 -4.961 6.139 1.00 0.00 O ATOM 860 CB THR B 5 11.545 -2.076 5.118 1.00 0.00 C ATOM 861 OG1 THR B 5 11.370 -0.656 5.005 1.00 0.00 O ATOM 862 CG2 THR B 5 10.986 -2.752 3.875 1.00 0.00 C ATOM 0 H THR B 5 11.687 -0.875 7.255 1.00 0.00 H new ATOM 0 HA THR B 5 9.766 -2.639 6.222 1.00 0.00 H new ATOM 0 HB THR B 5 12.604 -2.321 5.194 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.819 -0.334 4.195 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.503 -2.376 2.992 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.133 -3.830 3.950 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.921 -2.536 3.791 1.00 0.00 H new ATOM 870 N ASP B 6 12.215 -4.048 7.744 1.00 0.00 N ATOM 871 CA ASP B 6 12.854 -5.302 8.122 1.00 0.00 C ATOM 872 C ASP B 6 11.929 -6.136 9.005 1.00 0.00 C ATOM 873 O ASP B 6 12.255 -7.264 9.374 1.00 0.00 O ATOM 874 CB ASP B 6 14.164 -5.025 8.868 1.00 0.00 C ATOM 875 CG ASP B 6 15.186 -4.293 8.020 1.00 0.00 C ATOM 876 OD1 ASP B 6 15.017 -3.077 7.789 1.00 0.00 O ATOM 877 OD2 ASP B 6 16.179 -4.923 7.598 1.00 0.00 O ATOM 0 H ASP B 6 12.487 -3.249 8.317 1.00 0.00 H new ATOM 0 HA ASP B 6 13.068 -5.861 7.211 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.950 -4.435 9.759 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.590 -5.970 9.206 1.00 0.00 H new ATOM 882 N ASP B 7 10.777 -5.574 9.357 1.00 0.00 N ATOM 883 CA ASP B 7 9.793 -6.301 10.151 1.00 0.00 C ATOM 884 C ASP B 7 8.632 -6.783 9.292 1.00 0.00 C ATOM 885 O ASP B 7 7.855 -7.645 9.709 1.00 0.00 O ATOM 886 CB ASP B 7 9.257 -5.410 11.276 1.00 0.00 C ATOM 887 CG ASP B 7 10.296 -5.119 12.338 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.481 -5.968 13.234 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.932 -4.045 12.281 1.00 0.00 O ATOM 0 H ASP B 7 10.503 -4.624 9.107 1.00 0.00 H new ATOM 0 HA ASP B 7 10.292 -7.171 10.578 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.904 -4.470 10.852 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.397 -5.894 11.738 1.00 0.00 H new ATOM 894 N LEU B 8 8.508 -6.232 8.093 1.00 0.00 N ATOM 895 CA LEU B 8 7.442 -6.636 7.184 1.00 0.00 C ATOM 896 C LEU B 8 8.012 -7.351 5.976 1.00 0.00 C ATOM 897 O LEU B 8 7.293 -8.032 5.242 1.00 0.00 O ATOM 898 CB LEU B 8 6.599 -5.438 6.746 1.00 0.00 C ATOM 899 CG LEU B 8 5.617 -4.921 7.799 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.339 -4.169 8.907 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.565 -4.037 7.151 1.00 0.00 C ATOM 0 H LEU B 8 9.127 -5.509 7.728 1.00 0.00 H new ATOM 0 HA LEU B 8 6.791 -7.325 7.723 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.268 -4.625 6.464 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.039 -5.714 5.852 1.00 0.00 H new ATOM 0 HG LEU B 8 5.123 -5.782 8.250 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.613 -3.815 9.639 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.051 -4.835 9.395 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.871 -3.318 8.482 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.873 -3.677 7.912 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.050 -3.188 6.670 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.016 -4.612 6.405 1.00 0.00 H new ATOM 913 N GLU B 9 9.310 -7.200 5.790 1.00 0.00 N ATOM 914 CA GLU B 9 10.025 -7.883 4.734 1.00 0.00 C ATOM 915 C GLU B 9 11.302 -8.480 5.300 1.00 0.00 C ATOM 916 O GLU B 9 12.017 -7.838 6.068 1.00 0.00 O ATOM 917 CB GLU B 9 10.347 -6.941 3.570 1.00 0.00 C ATOM 918 CG GLU B 9 9.120 -6.498 2.788 1.00 0.00 C ATOM 919 CD GLU B 9 9.466 -5.648 1.584 1.00 0.00 C ATOM 920 OE1 GLU B 9 10.650 -5.298 1.414 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.552 -5.336 0.795 1.00 0.00 O ATOM 0 H GLU B 9 9.897 -6.599 6.369 1.00 0.00 H new ATOM 0 HA GLU B 9 9.389 -8.677 4.342 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.858 -6.060 3.957 1.00 0.00 H new ATOM 0 HB3 GLU B 9 11.040 -7.439 2.892 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.568 -7.378 2.459 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.459 -5.935 3.447 1.00 0.00 H new ATOM 928 N VAL B 10 11.567 -9.712 4.932 1.00 0.00 N ATOM 929 CA VAL B 10 12.723 -10.434 5.420 1.00 0.00 C ATOM 930 C VAL B 10 13.486 -10.995 4.232 1.00 0.00 C ATOM 931 O VAL B 10 12.884 -11.403 3.238 1.00 0.00 O ATOM 932 CB VAL B 10 12.304 -11.569 6.392 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.351 -12.549 5.722 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.521 -12.301 6.939 1.00 0.00 C ATOM 0 H VAL B 10 10.987 -10.245 4.284 1.00 0.00 H new ATOM 0 HA VAL B 10 13.365 -9.752 5.978 1.00 0.00 H new ATOM 0 HB VAL B 10 11.780 -11.104 7.227 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.077 -13.331 6.430 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.454 -12.021 5.399 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.839 -12.997 4.857 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.196 -13.090 7.617 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.083 -12.739 6.114 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.156 -11.598 7.478 1.00 0.00 H new ATOM 944 N ALA B 11 14.804 -10.984 4.312 1.00 0.00 N ATOM 945 CA ALA B 11 15.631 -11.464 3.222 1.00 0.00 C ATOM 946 C ALA B 11 15.400 -12.949 2.997 1.00 0.00 C ATOM 947 O ALA B 11 15.348 -13.733 3.944 1.00 0.00 O ATOM 948 CB ALA B 11 17.091 -11.177 3.532 1.00 0.00 C ATOM 0 H ALA B 11 15.325 -10.647 5.122 1.00 0.00 H new ATOM 0 HA ALA B 11 15.360 -10.944 2.303 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.714 -11.537 2.714 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.233 -10.103 3.651 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.374 -11.685 4.454 1.00 0.00 H new ATOM 954 N CYS B 12 15.241 -13.312 1.726 1.00 0.00 N ATOM 955 CA CYS B 12 14.812 -14.640 1.318 1.00 0.00 C ATOM 956 C CYS B 12 15.756 -15.758 1.780 1.00 0.00 C ATOM 957 O CYS B 12 16.891 -15.498 2.166 1.00 0.00 O ATOM 958 CB CYS B 12 14.737 -14.672 -0.203 1.00 0.00 C ATOM 959 SG CYS B 12 13.156 -15.227 -0.859 1.00 0.00 S ATOM 0 H CYS B 12 15.410 -12.680 0.943 1.00 0.00 H new ATOM 0 HA CYS B 12 13.845 -14.824 1.786 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.945 -13.673 -0.586 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.523 -15.327 -0.579 1.00 0.00 H new ATOM 964 N PRO B 13 15.296 -17.026 1.712 1.00 0.00 N ATOM 965 CA PRO B 13 16.129 -18.200 2.005 1.00 0.00 C ATOM 966 C PRO B 13 17.527 -18.154 1.369 1.00 0.00 C ATOM 967 O PRO B 13 18.507 -18.595 1.970 1.00 0.00 O ATOM 968 CB PRO B 13 15.325 -19.332 1.369 1.00 0.00 C ATOM 969 CG PRO B 13 13.904 -18.927 1.521 1.00 0.00 C ATOM 970 CD PRO B 13 13.897 -17.419 1.410 1.00 0.00 C ATOM 0 HA PRO B 13 16.320 -18.291 3.074 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.588 -19.462 0.319 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.520 -20.282 1.866 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.283 -19.380 0.748 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.505 -19.251 2.482 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.598 -17.094 0.413 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.196 -16.971 2.115 1.00 0.00 H new ATOM 978 N LYS B 14 17.619 -17.583 0.166 1.00 0.00 N ATOM 979 CA LYS B 14 18.816 -17.763 -0.654 1.00 0.00 C ATOM 980 C LYS B 14 19.060 -16.629 -1.664 1.00 0.00 C ATOM 981 O LYS B 14 20.191 -16.416 -2.074 1.00 0.00 O ATOM 982 CB LYS B 14 18.715 -19.105 -1.397 1.00 0.00 C ATOM 983 CG LYS B 14 19.803 -19.339 -2.441 1.00 0.00 C ATOM 984 CD LYS B 14 19.567 -20.637 -3.210 1.00 0.00 C ATOM 985 CE LYS B 14 20.484 -20.751 -4.420 1.00 0.00 C ATOM 986 NZ LYS B 14 21.915 -20.814 -4.035 1.00 0.00 N ATOM 0 H LYS B 14 16.893 -17.003 -0.255 1.00 0.00 H new ATOM 0 HA LYS B 14 19.668 -17.748 0.026 1.00 0.00 H new ATOM 0 HB2 LYS B 14 18.752 -19.913 -0.666 1.00 0.00 H new ATOM 0 HB3 LYS B 14 17.743 -19.162 -1.886 1.00 0.00 H new ATOM 0 HG2 LYS B 14 19.827 -18.501 -3.138 1.00 0.00 H new ATOM 0 HG3 LYS B 14 20.777 -19.376 -1.952 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.731 -21.487 -2.548 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.528 -20.683 -3.536 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.223 -21.644 -4.989 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.324 -19.896 -5.077 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.502 -20.891 -4.890 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 22.173 -19.951 -3.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.075 -21.644 -3.429 1.00 0.00 H new ATOM 1000 N CYS B 15 18.028 -15.906 -2.095 1.00 0.00 N ATOM 1001 CA CYS B 15 18.228 -14.953 -3.193 1.00 0.00 C ATOM 1002 C CYS B 15 17.977 -13.494 -2.820 1.00 0.00 C ATOM 1003 O CYS B 15 17.405 -12.738 -3.613 1.00 0.00 O ATOM 1004 CB CYS B 15 17.229 -15.303 -4.273 1.00 0.00 C ATOM 1005 SG CYS B 15 15.527 -15.336 -3.669 1.00 0.00 S ATOM 0 H CYS B 15 17.080 -15.954 -1.721 1.00 0.00 H new ATOM 0 HA CYS B 15 19.272 -15.034 -3.495 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.308 -14.578 -5.083 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.480 -16.278 -4.692 1.00 0.00 H new ATOM 1010 N GLU B 16 18.479 -13.071 -1.684 1.00 0.00 N ATOM 1011 CA GLU B 16 18.143 -11.780 -1.120 1.00 0.00 C ATOM 1012 C GLU B 16 19.093 -10.692 -1.565 1.00 0.00 C ATOM 1013 O GLU B 16 19.264 -9.694 -0.870 1.00 0.00 O ATOM 1014 CB GLU B 16 18.205 -11.863 0.406 1.00 0.00 C ATOM 1015 CG GLU B 16 18.414 -13.261 0.965 1.00 0.00 C ATOM 1016 CD GLU B 16 19.873 -13.679 0.927 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.350 -14.089 -0.148 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.553 -13.588 1.970 1.00 0.00 O ATOM 0 H GLU B 16 19.135 -13.613 -1.121 1.00 0.00 H new ATOM 0 HA GLU B 16 17.141 -11.529 -1.469 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.014 -11.223 0.757 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.279 -11.459 0.815 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.054 -13.298 1.993 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.818 -13.972 0.393 1.00 0.00 H new ATOM 1025 N ARG B 17 19.708 -10.856 -2.720 1.00 0.00 N ATOM 1026 CA ARG B 17 20.647 -9.870 -3.200 1.00 0.00 C ATOM 1027 C ARG B 17 20.545 -9.839 -4.725 1.00 0.00 C ATOM 1028 O ARG B 17 21.031 -8.922 -5.376 1.00 0.00 O ATOM 1029 CB ARG B 17 22.090 -10.148 -2.743 1.00 0.00 C ATOM 1030 CG ARG B 17 22.745 -11.372 -3.365 1.00 0.00 C ATOM 1031 CD ARG B 17 22.322 -12.665 -2.685 1.00 0.00 C ATOM 1032 NE ARG B 17 23.099 -13.801 -3.172 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.222 -14.958 -2.526 1.00 0.00 C ATOM 1034 NH1 ARG B 17 22.575 -15.166 -1.387 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.984 -15.918 -3.032 1.00 0.00 N ATOM 0 H ARG B 17 19.574 -11.657 -3.337 1.00 0.00 H new ATOM 0 HA ARG B 17 20.393 -8.899 -2.776 1.00 0.00 H new ATOM 0 HB2 ARG B 17 22.700 -9.274 -2.971 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.094 -10.265 -1.659 1.00 0.00 H new ATOM 0 HG2 ARG B 17 22.488 -11.420 -4.423 1.00 0.00 H new ATOM 0 HG3 ARG B 17 23.829 -11.271 -3.305 1.00 0.00 H new ATOM 0 HD2 ARG B 17 22.450 -12.570 -1.607 1.00 0.00 H new ATOM 0 HD3 ARG B 17 21.262 -12.843 -2.865 1.00 0.00 H new ATOM 0 HE ARG B 17 23.579 -13.701 -4.066 1.00 0.00 H new ATOM 0 HH11 ARG B 17 21.977 -14.436 -0.999 1.00 0.00 H new ATOM 0 HH12 ARG B 17 22.675 -16.056 -0.899 1.00 0.00 H new ATOM 0 HH21 ARG B 17 24.474 -15.769 -3.914 1.00 0.00 H new ATOM 0 HH22 ARG B 17 24.080 -16.806 -2.539 1.00 0.00 H new ATOM 1049 N ALA B 18 19.879 -10.862 -5.284 1.00 0.00 N ATOM 1050 CA ALA B 18 19.784 -11.011 -6.733 1.00 0.00 C ATOM 1051 C ALA B 18 18.340 -10.971 -7.214 1.00 0.00 C ATOM 1052 O ALA B 18 18.048 -10.457 -8.293 1.00 0.00 O ATOM 1053 CB ALA B 18 20.444 -12.308 -7.178 1.00 0.00 C ATOM 0 H ALA B 18 19.403 -11.591 -4.753 1.00 0.00 H new ATOM 0 HA ALA B 18 20.308 -10.167 -7.181 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.364 -12.404 -8.261 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.495 -12.298 -6.891 1.00 0.00 H new ATOM 0 HB3 ALA B 18 19.945 -13.152 -6.701 1.00 0.00 H new ATOM 1059 N GLY B 19 17.433 -11.499 -6.402 1.00 0.00 N ATOM 1060 CA GLY B 19 16.040 -11.527 -6.790 1.00 0.00 C ATOM 1061 C GLY B 19 15.625 -12.812 -7.488 1.00 0.00 C ATOM 1062 O GLY B 19 14.499 -12.909 -7.939 1.00 0.00 O ATOM 0 H GLY B 19 17.637 -11.905 -5.489 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.422 -11.390 -5.902 1.00 0.00 H new ATOM 0 HA3 GLY B 19 15.839 -10.684 -7.451 1.00 0.00 H new ATOM 1066 N GLU B 20 16.490 -13.829 -7.463 1.00 0.00 N ATOM 1067 CA GLU B 20 16.276 -15.072 -8.237 1.00 0.00 C ATOM 1068 C GLU B 20 17.191 -16.150 -7.692 1.00 0.00 C ATOM 1069 O GLU B 20 18.094 -15.863 -6.908 1.00 0.00 O ATOM 1070 CB GLU B 20 16.535 -14.936 -9.755 1.00 0.00 C ATOM 1071 CG GLU B 20 15.710 -13.868 -10.457 1.00 0.00 C ATOM 1072 CD GLU B 20 14.249 -14.263 -10.622 1.00 0.00 C ATOM 1073 OE1 GLU B 20 13.651 -14.801 -9.662 1.00 0.00 O ATOM 1074 OE2 GLU B 20 13.694 -14.031 -11.719 1.00 0.00 O ATOM 0 H GLU B 20 17.351 -13.824 -6.916 1.00 0.00 H new ATOM 0 HA GLU B 20 15.221 -15.321 -8.123 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.592 -14.717 -9.909 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.336 -15.897 -10.229 1.00 0.00 H new ATOM 0 HG2 GLU B 20 15.768 -12.939 -9.890 1.00 0.00 H new ATOM 0 HG3 GLU B 20 16.141 -13.670 -11.438 1.00 0.00 H new ATOM 1081 N ILE B 21 16.993 -17.373 -8.138 1.00 0.00 N ATOM 1082 CA ILE B 21 17.722 -18.506 -7.600 1.00 0.00 C ATOM 1083 C ILE B 21 18.160 -19.421 -8.718 1.00 0.00 C ATOM 1084 O ILE B 21 17.335 -19.911 -9.481 1.00 0.00 O ATOM 1085 CB ILE B 21 16.879 -19.288 -6.562 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.775 -18.454 -5.289 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.480 -20.664 -6.272 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.051 -19.121 -4.145 1.00 0.00 C ATOM 0 H ILE B 21 16.330 -17.610 -8.876 1.00 0.00 H new ATOM 0 HA ILE B 21 18.603 -18.122 -7.086 1.00 0.00 H new ATOM 0 HB ILE B 21 15.883 -19.462 -6.968 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.781 -18.194 -4.960 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.266 -17.520 -5.526 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.862 -21.184 -5.540 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.518 -21.246 -7.193 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.489 -20.544 -5.876 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.030 -18.449 -3.287 1.00 0.00 H new ATOM 0 HD12 ILE B 21 15.030 -19.356 -4.448 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.569 -20.041 -3.873 1.00 0.00 H new ATOM 1100 N GLU B 22 19.463 -19.648 -8.796 1.00 0.00 N ATOM 1101 CA GLU B 22 20.033 -20.507 -9.822 1.00 0.00 C ATOM 1102 C GLU B 22 19.675 -19.997 -11.213 1.00 0.00 C ATOM 1103 O GLU B 22 19.275 -20.771 -12.078 1.00 0.00 O ATOM 1104 CB GLU B 22 19.487 -21.922 -9.631 1.00 0.00 C ATOM 1105 CG GLU B 22 20.463 -23.026 -10.001 1.00 0.00 C ATOM 1106 CD GLU B 22 21.799 -22.878 -9.297 1.00 0.00 C ATOM 1107 OE1 GLU B 22 21.810 -22.639 -8.071 1.00 0.00 O ATOM 1108 OE2 GLU B 22 22.846 -22.971 -9.967 1.00 0.00 O ATOM 0 H GLU B 22 20.149 -19.246 -8.157 1.00 0.00 H new ATOM 0 HA GLU B 22 21.119 -20.507 -9.731 1.00 0.00 H new ATOM 0 HB2 GLU B 22 19.193 -22.048 -8.589 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.585 -22.035 -10.232 1.00 0.00 H new ATOM 0 HG2 GLU B 22 20.027 -23.992 -9.748 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.621 -23.021 -11.079 1.00 0.00 H new ATOM 1115 N GLY B 23 19.767 -18.684 -11.417 1.00 0.00 N ATOM 1116 CA GLY B 23 19.420 -18.115 -12.712 1.00 0.00 C ATOM 1117 C GLY B 23 17.950 -18.252 -13.025 1.00 0.00 C ATOM 1118 O GLY B 23 17.484 -17.920 -14.114 1.00 0.00 O ATOM 0 H GLY B 23 20.073 -18.009 -10.716 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.695 -17.060 -12.728 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.002 -18.608 -13.490 1.00 0.00 H new ATOM 1122 N THR B 24 17.241 -18.747 -12.051 1.00 0.00 N ATOM 1123 CA THR B 24 15.885 -19.190 -12.223 1.00 0.00 C ATOM 1124 C THR B 24 14.933 -18.406 -11.315 1.00 0.00 C ATOM 1125 O THR B 24 15.275 -18.091 -10.172 1.00 0.00 O ATOM 1126 CB THR B 24 15.880 -20.699 -11.914 1.00 0.00 C ATOM 1127 OG1 THR B 24 16.258 -21.445 -13.081 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.546 -21.195 -11.382 1.00 0.00 C ATOM 0 H THR B 24 17.593 -18.856 -11.100 1.00 0.00 H new ATOM 0 HA THR B 24 15.530 -19.013 -13.238 1.00 0.00 H new ATOM 0 HB THR B 24 16.611 -20.859 -11.121 1.00 0.00 H new ATOM 0 HG1 THR B 24 16.253 -22.403 -12.873 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.608 -22.265 -11.184 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.304 -20.669 -10.459 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.767 -21.007 -12.121 1.00 0.00 H new ATOM 1136 N PRO B 25 13.740 -18.055 -11.831 1.00 0.00 N ATOM 1137 CA PRO B 25 12.759 -17.247 -11.096 1.00 0.00 C ATOM 1138 C PRO B 25 12.377 -17.872 -9.758 1.00 0.00 C ATOM 1139 O PRO B 25 11.982 -19.040 -9.681 1.00 0.00 O ATOM 1140 CB PRO B 25 11.552 -17.180 -12.041 1.00 0.00 C ATOM 1141 CG PRO B 25 11.755 -18.306 -12.996 1.00 0.00 C ATOM 1142 CD PRO B 25 13.241 -18.423 -13.165 1.00 0.00 C ATOM 0 HA PRO B 25 13.155 -16.264 -10.839 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.615 -17.288 -11.495 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.509 -16.223 -12.561 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.330 -19.232 -12.608 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.266 -18.106 -13.949 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.540 -19.433 -13.446 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.616 -17.753 -13.938 1.00 0.00 H new ATOM 1150 N CYS B 26 12.495 -17.077 -8.710 1.00 0.00 N ATOM 1151 CA CYS B 26 12.381 -17.570 -7.349 1.00 0.00 C ATOM 1152 C CYS B 26 10.928 -17.742 -6.883 1.00 0.00 C ATOM 1153 O CYS B 26 10.080 -16.882 -7.122 1.00 0.00 O ATOM 1154 CB CYS B 26 13.130 -16.637 -6.408 1.00 0.00 C ATOM 1155 SG CYS B 26 13.085 -17.166 -4.671 1.00 0.00 S ATOM 0 H CYS B 26 12.672 -16.075 -8.777 1.00 0.00 H new ATOM 0 HA CYS B 26 12.826 -18.565 -7.330 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.169 -16.566 -6.731 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.703 -15.637 -6.486 1.00 0.00 H new ATOM 1160 N PRO B 27 10.667 -18.871 -6.176 1.00 0.00 N ATOM 1161 CA PRO B 27 9.354 -19.272 -5.642 1.00 0.00 C ATOM 1162 C PRO B 27 8.409 -18.134 -5.235 1.00 0.00 C ATOM 1163 O PRO B 27 7.291 -18.035 -5.732 1.00 0.00 O ATOM 1164 CB PRO B 27 9.760 -20.046 -4.391 1.00 0.00 C ATOM 1165 CG PRO B 27 11.070 -20.687 -4.711 1.00 0.00 C ATOM 1166 CD PRO B 27 11.674 -19.908 -5.867 1.00 0.00 C ATOM 0 HA PRO B 27 8.784 -19.806 -6.403 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.851 -19.380 -3.533 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.011 -20.795 -4.136 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.731 -20.667 -3.845 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.931 -21.734 -4.982 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.630 -19.464 -5.590 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.858 -20.552 -6.727 1.00 0.00 H new ATOM 1174 N ALA B 28 8.876 -17.273 -4.338 1.00 0.00 N ATOM 1175 CA ALA B 28 7.986 -16.336 -3.654 1.00 0.00 C ATOM 1176 C ALA B 28 8.468 -14.899 -3.786 1.00 0.00 C ATOM 1177 O ALA B 28 7.795 -13.962 -3.365 1.00 0.00 O ATOM 1178 CB ALA B 28 7.852 -16.716 -2.188 1.00 0.00 C ATOM 0 H ALA B 28 9.857 -17.202 -4.067 1.00 0.00 H new ATOM 0 HA ALA B 28 7.009 -16.399 -4.132 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.187 -16.011 -1.689 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.440 -17.722 -2.109 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.833 -16.688 -1.714 1.00 0.00 H new ATOM 1184 N CYS B 29 9.642 -14.729 -4.361 1.00 0.00 N ATOM 1185 CA CYS B 29 10.186 -13.402 -4.575 1.00 0.00 C ATOM 1186 C CYS B 29 10.637 -13.271 -6.024 1.00 0.00 C ATOM 1187 O CYS B 29 11.793 -13.532 -6.344 1.00 0.00 O ATOM 1188 CB CYS B 29 11.354 -13.135 -3.609 1.00 0.00 C ATOM 1189 SG CYS B 29 12.809 -14.186 -3.872 1.00 0.00 S ATOM 0 H CYS B 29 10.237 -15.491 -4.688 1.00 0.00 H new ATOM 0 HA CYS B 29 9.415 -12.658 -4.375 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.654 -12.091 -3.703 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.002 -13.274 -2.587 1.00 0.00 H new ATOM 1194 N SER B 30 9.718 -12.892 -6.900 1.00 0.00 N ATOM 1195 CA SER B 30 10.001 -12.808 -8.328 1.00 0.00 C ATOM 1196 C SER B 30 10.863 -11.589 -8.670 1.00 0.00 C ATOM 1197 O SER B 30 10.497 -10.765 -9.509 1.00 0.00 O ATOM 1198 CB SER B 30 8.684 -12.760 -9.097 1.00 0.00 C ATOM 1199 OG SER B 30 7.810 -13.792 -8.665 1.00 0.00 O ATOM 0 H SER B 30 8.764 -12.636 -6.646 1.00 0.00 H new ATOM 0 HA SER B 30 10.569 -13.692 -8.617 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.208 -11.790 -8.952 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.877 -12.864 -10.165 1.00 0.00 H new ATOM 0 HG SER B 30 6.971 -13.743 -9.169 1.00 0.00 H new ATOM 1205 N GLY B 31 11.999 -11.476 -8.004 1.00 0.00 N ATOM 1206 CA GLY B 31 12.952 -10.450 -8.339 1.00 0.00 C ATOM 1207 C GLY B 31 12.893 -9.260 -7.414 1.00 0.00 C ATOM 1208 O GLY B 31 12.819 -8.124 -7.874 1.00 0.00 O ATOM 0 H GLY B 31 12.277 -12.083 -7.232 1.00 0.00 H new ATOM 0 HA2 GLY B 31 13.956 -10.873 -8.313 1.00 0.00 H new ATOM 0 HA3 GLY B 31 12.773 -10.117 -9.361 1.00 0.00 H new ATOM 1212 N LYS B 32 12.927 -9.498 -6.109 1.00 0.00 N ATOM 1213 CA LYS B 32 12.962 -8.416 -5.140 1.00 0.00 C ATOM 1214 C LYS B 32 14.151 -8.598 -4.193 1.00 0.00 C ATOM 1215 O LYS B 32 14.812 -7.632 -3.818 1.00 0.00 O ATOM 1216 CB LYS B 32 11.665 -8.389 -4.328 1.00 0.00 C ATOM 1217 CG LYS B 32 10.463 -7.877 -5.105 1.00 0.00 C ATOM 1218 CD LYS B 32 9.205 -7.887 -4.251 1.00 0.00 C ATOM 1219 CE LYS B 32 8.524 -9.244 -4.258 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.833 -9.505 -5.547 1.00 0.00 N ATOM 0 H LYS B 32 12.931 -10.432 -5.699 1.00 0.00 H new ATOM 0 HA LYS B 32 13.068 -7.474 -5.677 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.451 -9.396 -3.969 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.811 -7.762 -3.449 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.659 -6.863 -5.455 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.309 -8.495 -5.989 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.460 -7.614 -3.227 1.00 0.00 H new ATOM 0 HD3 LYS B 32 8.511 -7.131 -4.619 1.00 0.00 H new ATOM 0 HE2 LYS B 32 9.264 -10.024 -4.077 1.00 0.00 H new ATOM 0 HE3 LYS B 32 7.803 -9.294 -3.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.216 -10.336 -5.448 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 7.260 -8.677 -5.807 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 8.539 -9.684 -6.289 1.00 0.00 H new ATOM 1234 N GLY B 33 14.406 -9.852 -3.798 1.00 0.00 N ATOM 1235 CA GLY B 33 15.455 -10.149 -2.862 1.00 0.00 C ATOM 1236 C GLY B 33 14.870 -10.617 -1.550 1.00 0.00 C ATOM 1237 O GLY B 33 15.351 -11.570 -0.944 1.00 0.00 O ATOM 0 H GLY B 33 13.888 -10.668 -4.124 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.110 -10.919 -3.271 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.068 -9.263 -2.699 1.00 0.00 H new ATOM 1241 N VAL B 34 13.774 -9.994 -1.150 1.00 0.00 N ATOM 1242 CA VAL B 34 13.163 -10.285 0.135 1.00 0.00 C ATOM 1243 C VAL B 34 11.780 -10.906 -0.026 1.00 0.00 C ATOM 1244 O VAL B 34 11.210 -10.918 -1.123 1.00 0.00 O ATOM 1245 CB VAL B 34 13.034 -9.000 0.984 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.402 -8.400 1.276 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.148 -7.981 0.281 1.00 0.00 C ATOM 0 H VAL B 34 13.289 -9.283 -1.698 1.00 0.00 H new ATOM 0 HA VAL B 34 13.814 -10.999 0.639 1.00 0.00 H new ATOM 0 HB VAL B 34 12.570 -9.269 1.933 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.283 -7.497 1.875 1.00 0.00 H new ATOM 0 HG12 VAL B 34 15.006 -9.122 1.825 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.898 -8.151 0.338 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.069 -7.083 0.894 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.584 -7.724 -0.684 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.155 -8.405 0.129 1.00 0.00 H new ATOM 1257 N ILE B 35 11.269 -11.436 1.072 1.00 0.00 N ATOM 1258 CA ILE B 35 9.903 -11.924 1.150 1.00 0.00 C ATOM 1259 C ILE B 35 9.199 -11.291 2.341 1.00 0.00 C ATOM 1260 O ILE B 35 9.844 -10.793 3.257 1.00 0.00 O ATOM 1261 CB ILE B 35 9.830 -13.460 1.269 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.885 -13.966 2.254 1.00 0.00 C ATOM 1263 CG2 ILE B 35 9.997 -14.109 -0.095 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.767 -15.440 2.579 1.00 0.00 C ATOM 0 H ILE B 35 11.794 -11.540 1.940 1.00 0.00 H new ATOM 0 HA ILE B 35 9.407 -11.643 0.221 1.00 0.00 H new ATOM 0 HB ILE B 35 8.848 -13.736 1.652 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.875 -13.774 1.841 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.809 -13.393 3.178 1.00 0.00 H new ATOM 0 HG21 ILE B 35 9.943 -15.193 0.009 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.203 -13.768 -0.760 1.00 0.00 H new ATOM 0 HG23 ILE B 35 10.965 -13.833 -0.513 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.550 -15.721 3.283 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.791 -15.638 3.023 1.00 0.00 H new ATOM 0 HD13 ILE B 35 10.874 -16.024 1.665 1.00 0.00 H new ATOM 1276 N LEU B 36 7.880 -11.313 2.321 1.00 0.00 N ATOM 1277 CA LEU B 36 7.094 -10.601 3.319 1.00 0.00 C ATOM 1278 C LEU B 36 6.851 -11.431 4.571 1.00 0.00 C ATOM 1279 O LEU B 36 7.056 -12.647 4.588 1.00 0.00 O ATOM 1280 CB LEU B 36 5.748 -10.174 2.725 1.00 0.00 C ATOM 1281 CG LEU B 36 5.842 -9.323 1.457 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.845 -10.192 0.207 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.709 -8.320 1.413 1.00 0.00 C ATOM 0 H LEU B 36 7.327 -11.815 1.626 1.00 0.00 H new ATOM 0 HA LEU B 36 7.673 -9.724 3.609 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.166 -11.068 2.502 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.196 -9.614 3.480 1.00 0.00 H new ATOM 0 HG LEU B 36 6.787 -8.780 1.482 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.913 -9.558 -0.677 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.700 -10.867 0.235 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.924 -10.774 0.166 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.788 -7.721 0.506 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.755 -8.848 1.417 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.767 -7.668 2.284 1.00 0.00 H new ATOM 1295 N THR B 37 6.412 -10.748 5.618 1.00 0.00 N ATOM 1296 CA THR B 37 6.019 -11.391 6.858 1.00 0.00 C ATOM 1297 C THR B 37 4.503 -11.377 6.943 1.00 0.00 C ATOM 1298 O THR B 37 3.865 -10.776 6.090 1.00 0.00 O ATOM 1299 CB THR B 37 6.604 -10.658 8.084 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.061 -9.331 8.173 1.00 0.00 O ATOM 1301 CG2 THR B 37 8.118 -10.570 7.993 1.00 0.00 C ATOM 0 H THR B 37 6.319 -9.732 5.629 1.00 0.00 H new ATOM 0 HA THR B 37 6.403 -12.411 6.863 1.00 0.00 H new ATOM 0 HB THR B 37 6.335 -11.227 8.974 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.589 -8.803 8.808 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.505 -10.049 8.869 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.539 -11.575 7.952 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.397 -10.023 7.093 1.00 0.00 H new ATOM 1309 N ALA B 38 3.920 -12.017 7.946 1.00 0.00 N ATOM 1310 CA ALA B 38 2.464 -12.099 8.041 1.00 0.00 C ATOM 1311 C ALA B 38 1.815 -10.715 8.019 1.00 0.00 C ATOM 1312 O ALA B 38 0.798 -10.509 7.349 1.00 0.00 O ATOM 1313 CB ALA B 38 2.053 -12.868 9.280 1.00 0.00 C ATOM 0 H ALA B 38 4.424 -12.484 8.700 1.00 0.00 H new ATOM 0 HA ALA B 38 2.107 -12.638 7.164 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.965 -12.918 9.333 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.461 -13.878 9.234 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.436 -12.362 10.166 1.00 0.00 H new ATOM 1319 N GLN B 39 2.395 -9.766 8.753 1.00 0.00 N ATOM 1320 CA GLN B 39 1.927 -8.384 8.714 1.00 0.00 C ATOM 1321 C GLN B 39 2.038 -7.815 7.301 1.00 0.00 C ATOM 1322 O GLN B 39 1.113 -7.169 6.811 1.00 0.00 O ATOM 1323 CB GLN B 39 2.714 -7.510 9.692 1.00 0.00 C ATOM 1324 CG GLN B 39 2.216 -6.072 9.744 1.00 0.00 C ATOM 1325 CD GLN B 39 2.944 -5.226 10.768 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.416 -5.728 11.785 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.028 -3.933 10.508 1.00 0.00 N ATOM 0 H GLN B 39 3.185 -9.929 9.378 1.00 0.00 H new ATOM 0 HA GLN B 39 0.879 -8.381 9.013 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.652 -7.946 10.689 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.766 -7.514 9.407 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.331 -5.619 8.759 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.150 -6.071 9.973 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.622 -3.558 9.651 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.499 -3.310 11.164 1.00 0.00 H new ATOM 1336 N GLY B 40 3.163 -8.079 6.646 1.00 0.00 N ATOM 1337 CA GLY B 40 3.362 -7.604 5.290 1.00 0.00 C ATOM 1338 C GLY B 40 2.458 -8.313 4.303 1.00 0.00 C ATOM 1339 O GLY B 40 2.049 -7.736 3.301 1.00 0.00 O ATOM 0 H GLY B 40 3.941 -8.614 7.031 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.172 -6.531 5.250 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.402 -7.755 5.002 1.00 0.00 H new ATOM 1343 N TYR B 41 2.129 -9.562 4.602 1.00 0.00 N ATOM 1344 CA TYR B 41 1.221 -10.339 3.773 1.00 0.00 C ATOM 1345 C TYR B 41 -0.195 -9.795 3.854 1.00 0.00 C ATOM 1346 O TYR B 41 -0.928 -9.806 2.864 1.00 0.00 O ATOM 1347 CB TYR B 41 1.236 -11.804 4.228 1.00 0.00 C ATOM 1348 CG TYR B 41 2.300 -12.656 3.569 1.00 0.00 C ATOM 1349 CD1 TYR B 41 2.232 -12.961 2.218 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.363 -13.165 4.301 1.00 0.00 C ATOM 1351 CE1 TYR B 41 3.196 -13.746 1.613 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.332 -13.950 3.706 1.00 0.00 C ATOM 1353 CZ TYR B 41 4.243 -14.237 2.361 1.00 0.00 C ATOM 1354 OH TYR B 41 5.207 -15.017 1.765 1.00 0.00 O ATOM 0 H TYR B 41 2.481 -10.061 5.419 1.00 0.00 H new ATOM 0 HA TYR B 41 1.556 -10.269 2.738 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.382 -11.834 5.308 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.259 -12.244 4.026 1.00 0.00 H new ATOM 0 HD1 TYR B 41 1.412 -12.579 1.628 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.434 -12.944 5.356 1.00 0.00 H new ATOM 0 HE1 TYR B 41 3.128 -13.973 0.559 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.154 -14.336 4.291 1.00 0.00 H new ATOM 0 HH TYR B 41 5.874 -15.280 2.433 1.00 0.00 H new ATOM 1364 N THR B 42 -0.568 -9.291 5.016 1.00 0.00 N ATOM 1365 CA THR B 42 -1.864 -8.657 5.183 1.00 0.00 C ATOM 1366 C THR B 42 -1.899 -7.318 4.447 1.00 0.00 C ATOM 1367 O THR B 42 -2.927 -6.913 3.898 1.00 0.00 O ATOM 1368 CB THR B 42 -2.162 -8.429 6.674 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.974 -9.652 7.395 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.583 -7.928 6.878 1.00 0.00 C ATOM 0 H THR B 42 0.007 -9.308 5.858 1.00 0.00 H new ATOM 0 HA THR B 42 -2.623 -9.317 4.764 1.00 0.00 H new ATOM 0 HB THR B 42 -1.475 -7.670 7.049 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.017 -9.854 7.453 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.766 -7.775 7.942 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.716 -6.985 6.348 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.287 -8.664 6.491 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.748 -6.669 4.385 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.649 -5.346 3.792 1.00 0.00 C ATOM 1380 C LEU B 43 -0.425 -5.461 2.295 1.00 0.00 C ATOM 1381 O LEU B 43 -0.595 -4.490 1.566 1.00 0.00 O ATOM 1382 CB LEU B 43 0.497 -4.540 4.431 1.00 0.00 C ATOM 1383 CG LEU B 43 0.106 -3.539 5.536 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.815 -4.182 6.559 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.356 -3.011 6.222 1.00 0.00 C ATOM 0 H LEU B 43 0.134 -7.039 4.740 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.585 -4.820 3.977 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.217 -5.244 4.849 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.009 -3.992 3.641 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.430 -2.711 5.071 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.073 -3.452 7.326 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.723 -4.526 6.065 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.310 -5.030 7.021 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.072 -2.304 7.002 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.905 -3.841 6.667 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.988 -2.509 5.490 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.081 -6.657 1.823 1.00 0.00 N ATOM 1398 CA LEU B 44 0.213 -6.839 0.416 1.00 0.00 C ATOM 1399 C LEU B 44 -1.058 -7.209 -0.337 1.00 0.00 C ATOM 1400 O LEU B 44 -1.325 -6.679 -1.399 1.00 0.00 O ATOM 1401 CB LEU B 44 1.341 -7.881 0.214 1.00 0.00 C ATOM 1402 CG LEU B 44 0.937 -9.339 -0.076 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.480 -9.510 -1.520 1.00 0.00 C ATOM 1404 CD2 LEU B 44 2.107 -10.270 0.176 1.00 0.00 C ATOM 0 H LEU B 44 -0.001 -7.501 2.391 1.00 0.00 H new ATOM 0 HA LEU B 44 0.581 -5.899 0.004 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.968 -7.539 -0.609 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.962 -7.879 1.110 1.00 0.00 H new ATOM 0 HG LEU B 44 0.111 -9.587 0.591 1.00 0.00 H new ATOM 0 HD11 LEU B 44 0.202 -10.550 -1.693 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.381 -8.868 -1.708 1.00 0.00 H new ATOM 0 HD13 LEU B 44 1.292 -9.235 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.807 -11.297 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.937 -9.995 -0.475 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.419 -10.188 1.217 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.863 -8.097 0.215 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.082 -8.498 -0.470 1.00 0.00 C ATOM 1418 C ASP B 45 -4.091 -7.361 -0.429 1.00 0.00 C ATOM 1419 O ASP B 45 -5.016 -7.298 -1.240 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.662 -9.764 0.153 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.681 -10.425 -0.748 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.296 -10.871 -1.850 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -5.859 -10.527 -0.356 1.00 0.00 O ATOM 0 H ASP B 45 -1.703 -8.547 1.116 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.846 -8.720 -1.511 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.855 -10.466 0.364 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.128 -9.518 1.107 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.868 -6.437 0.496 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.637 -5.205 0.572 1.00 0.00 C ATOM 1430 C PHE B 46 -4.208 -4.246 -0.517 1.00 0.00 C ATOM 1431 O PHE B 46 -5.050 -3.655 -1.195 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.375 -4.570 1.937 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.167 -3.331 2.247 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.418 -3.424 2.833 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.648 -2.074 1.981 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.134 -2.289 3.151 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.362 -0.934 2.290 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.606 -1.042 2.876 1.00 0.00 C ATOM 0 H PHE B 46 -3.149 -6.522 1.214 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.697 -5.423 0.441 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.582 -5.313 2.707 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.315 -4.327 2.006 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.838 -4.397 3.043 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.672 -1.985 1.526 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.106 -2.375 3.614 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -4.948 0.040 2.074 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.167 -0.152 3.120 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.908 -4.107 -0.727 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.465 -3.174 -1.733 1.00 0.00 C ATOM 1450 C ILE B 47 -2.567 -3.778 -3.121 1.00 0.00 C ATOM 1451 O ILE B 47 -2.650 -3.068 -4.111 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.061 -2.568 -1.480 1.00 0.00 C ATOM 1453 CG1 ILE B 47 0.069 -3.599 -1.247 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -1.153 -1.642 -0.280 1.00 0.00 C ATOM 1455 CD1 ILE B 47 0.318 -4.601 -2.361 1.00 0.00 C ATOM 0 H ILE B 47 -2.171 -4.610 -0.232 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.151 -2.330 -1.663 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.784 -2.042 -2.394 1.00 0.00 H new ATOM 0 HG12 ILE B 47 0.995 -3.054 -1.066 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.158 -4.152 -0.336 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -0.175 -1.203 -0.083 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.871 -0.849 -0.487 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.479 -2.208 0.592 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.133 -5.267 -2.076 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -0.585 -5.186 -2.533 1.00 0.00 H new ATOM 0 HD13 ILE B 47 0.586 -4.070 -3.275 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.572 -5.090 -3.199 1.00 0.00 N ATOM 1468 CA GLN B 48 -2.947 -5.746 -4.418 1.00 0.00 C ATOM 1469 C GLN B 48 -4.344 -5.291 -4.798 1.00 0.00 C ATOM 1470 O GLN B 48 -4.526 -4.569 -5.753 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.901 -7.264 -4.239 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.494 -7.821 -4.089 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.588 -7.448 -5.246 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.039 -7.293 -6.384 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.697 -7.296 -4.962 1.00 0.00 N ATOM 0 H GLN B 48 -2.321 -5.716 -2.433 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.249 -5.485 -5.213 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.485 -7.535 -3.359 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.379 -7.737 -5.097 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.059 -7.452 -3.160 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.545 -8.907 -4.009 1.00 0.00 H new ATOM 0 HE21 GLN B 48 1.028 -7.434 -4.007 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.355 -7.041 -5.698 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.286 -5.569 -3.929 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.706 -5.480 -4.247 1.00 0.00 C ATOM 1486 C LYS B 49 -7.218 -4.031 -4.249 1.00 0.00 C ATOM 1487 O LYS B 49 -8.398 -3.788 -4.491 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.453 -6.357 -3.231 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.954 -6.467 -3.426 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.639 -6.887 -2.130 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.979 -8.111 -1.500 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.613 -8.481 -0.207 1.00 0.00 N ATOM 0 H LYS B 49 -5.096 -5.866 -2.972 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.884 -5.839 -5.261 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.028 -7.360 -3.264 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.264 -5.963 -2.232 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.353 -5.509 -3.760 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.171 -7.193 -4.209 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.614 -6.058 -1.423 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.688 -7.104 -2.329 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -9.043 -8.953 -2.189 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.920 -7.910 -1.340 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -9.293 -9.429 0.078 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.343 -7.790 0.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -10.647 -8.483 -0.316 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.351 -3.056 -3.967 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.732 -1.670 -4.267 1.00 0.00 C ATOM 1508 C HIS B 50 -5.821 -0.979 -5.294 1.00 0.00 C ATOM 1509 O HIS B 50 -6.068 0.173 -5.649 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.786 -0.849 -2.973 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.660 -1.477 -1.932 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -8.986 -1.755 -2.145 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.374 -1.946 -0.700 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.478 -2.370 -1.091 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.521 -2.505 -0.195 1.00 0.00 N ATOM 0 H HIS B 50 -5.428 -3.185 -3.553 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.719 -1.720 -4.726 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.777 -0.736 -2.576 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.155 0.152 -3.197 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.417 -1.892 -0.202 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.497 -2.708 -0.979 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -8.617 -2.949 0.718 1.00 0.00 H new ATOM 1524 N LEU B 51 -4.779 -1.658 -5.776 1.00 0.00 N ATOM 1525 CA LEU B 51 -3.945 -1.089 -6.848 1.00 0.00 C ATOM 1526 C LEU B 51 -3.845 -2.046 -8.034 1.00 0.00 C ATOM 1527 O LEU B 51 -4.179 -1.689 -9.165 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.507 -0.756 -6.388 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.339 0.302 -5.281 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.070 1.597 -5.631 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.792 -0.252 -3.953 1.00 0.00 C ATOM 0 H LEU B 51 -4.493 -2.582 -5.453 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.443 -0.163 -7.137 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.042 -1.680 -6.043 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -1.944 -0.422 -7.260 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.280 0.548 -5.201 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.931 2.322 -4.829 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.668 2.002 -6.560 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.133 1.392 -5.755 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.667 0.507 -3.181 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -3.842 -0.536 -4.016 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.194 -1.128 -3.701 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.393 -3.262 -7.763 1.00 0.00 N ATOM 1544 CA ASN B 52 -2.991 -4.200 -8.812 1.00 0.00 C ATOM 1545 C ASN B 52 -3.958 -5.381 -8.963 1.00 0.00 C ATOM 1546 O ASN B 52 -3.868 -6.156 -9.915 1.00 0.00 O ATOM 1547 CB ASN B 52 -1.575 -4.689 -8.513 1.00 0.00 C ATOM 1548 CG ASN B 52 -0.522 -3.825 -9.181 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.741 -2.638 -9.422 1.00 0.00 O ATOM 1550 ND2 ASN B 52 0.625 -4.407 -9.491 1.00 0.00 N ATOM 0 H ASN B 52 -3.293 -3.629 -6.816 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.017 -3.674 -9.766 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -1.412 -4.691 -7.435 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -1.468 -5.719 -8.853 1.00 0.00 H new ATOM 0 HD21 ASN B 52 1.363 -3.869 -9.945 1.00 0.00 H new ATOM 0 HD22 ASN B 52 0.771 -5.393 -9.276 1.00 0.00 H new ATOM 1557 N LYS B 53 -4.856 -5.521 -8.012 1.00 0.00 N ATOM 1558 CA LYS B 53 -5.945 -6.475 -8.082 1.00 0.00 C ATOM 1559 C LYS B 53 -7.246 -5.709 -8.302 1.00 0.00 C ATOM 1560 O LYS B 53 -7.704 -5.637 -9.459 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.059 -7.256 -6.772 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.642 -8.714 -6.840 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.292 -9.491 -5.696 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.462 -9.472 -4.425 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.365 -10.475 -4.453 1.00 0.00 N ATOM 1566 OXT LYS B 53 -7.788 -5.162 -7.318 1.00 0.00 O ATOM 0 H LYS B 53 -4.851 -4.968 -7.155 1.00 0.00 H new ATOM 0 HA LYS B 53 -5.756 -7.172 -8.898 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.450 -6.757 -6.018 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.093 -7.208 -6.430 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.938 -9.142 -7.797 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.557 -8.795 -6.777 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.275 -9.069 -5.489 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.448 -10.524 -6.007 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -5.039 -8.477 -4.285 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -6.108 -9.667 -3.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -4.094 -10.720 -3.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -4.689 -11.330 -4.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -3.543 -10.077 -4.951 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.759 4.587 12.941 1.00 0.00 N HETATM 1582 CN FME C 1 -10.894 3.285 12.754 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.887 2.671 13.139 1.00 0.00 O HETATM 1584 CA FME C 1 -9.589 5.302 12.456 1.00 0.00 C HETATM 1585 CB FME C 1 -10.008 6.602 11.757 1.00 0.00 C HETATM 1586 CG FME C 1 -8.836 7.459 11.310 1.00 0.00 C HETATM 1587 SD FME C 1 -9.324 8.831 10.244 1.00 0.00 S HETATM 1588 CE FME C 1 -9.849 7.947 8.773 1.00 0.00 C HETATM 1589 C FME C 1 -8.624 5.602 13.596 1.00 0.00 C HETATM 1590 O FME C 1 -8.821 6.541 14.367 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.327 7.854 12.189 1.00 0.00 H new HETATM 0 HG2 FME C 1 -8.118 6.833 10.780 1.00 0.00 H new HETATM 0 HE3 FME C 1 -9.438 8.435 7.889 1.00 0.00 H new HETATM 0 HE2 FME C 1 -9.490 6.919 8.819 1.00 0.00 H new HETATM 0 HE1 FME C 1 -10.938 7.949 8.716 1.00 0.00 H new HETATM 0 HCN FME C 1 -10.101 2.740 12.243 1.00 0.00 H new HETATM 0 HB3 FME C 1 -10.620 6.357 10.889 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.634 7.183 12.434 1.00 0.00 H new HETATM 0 HA FME C 1 -9.077 4.665 11.734 1.00 0.00 H new HETATM 0 H FME C 1 -11.489 5.100 13.435 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.586 4.789 13.703 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.530 5.020 14.679 1.00 0.00 C ATOM 1603 C VAL C 2 -5.287 5.532 13.950 1.00 0.00 C ATOM 1604 O VAL C 2 -4.238 5.785 14.539 1.00 0.00 O ATOM 1605 CB VAL C 2 -6.212 3.730 15.475 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.530 2.689 14.596 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -5.380 4.039 16.711 1.00 0.00 C ATOM 0 H VAL C 2 -7.451 3.960 13.124 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.863 5.767 15.399 1.00 0.00 H new ATOM 0 HB VAL C 2 -7.159 3.307 15.809 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -5.321 1.796 15.185 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -6.185 2.430 13.764 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.596 3.096 14.209 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -5.172 3.115 17.250 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -4.441 4.503 16.411 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.931 4.721 17.359 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.452 5.709 12.649 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.393 6.213 11.796 1.00 0.00 C ATOM 1619 C ILE C 3 -4.957 7.276 10.864 1.00 0.00 C ATOM 1620 O ILE C 3 -6.017 7.090 10.274 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.722 5.082 10.973 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.496 5.620 10.229 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.709 4.454 9.991 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.712 4.552 9.499 1.00 0.00 C ATOM 0 H ILE C 3 -6.323 5.507 12.157 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.624 6.648 12.434 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.399 4.306 11.667 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.819 6.375 9.512 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.839 6.118 10.942 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.210 3.665 9.428 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.550 4.032 10.541 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.072 5.217 9.302 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.859 5.007 8.996 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.358 3.808 10.213 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.354 4.070 8.761 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.279 8.405 10.774 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.717 9.476 9.898 1.00 0.00 C ATOM 1638 C ALA C 4 -3.623 9.830 8.908 1.00 0.00 C ATOM 1639 O ALA C 4 -2.431 9.703 9.201 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.123 10.692 10.715 1.00 0.00 C ATOM 0 H ALA C 4 -3.425 8.604 11.295 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.587 9.136 9.336 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.449 11.488 10.045 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.940 10.424 11.385 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.271 11.037 11.301 1.00 0.00 H new ATOM 1646 N THR C 5 -4.047 10.269 7.729 1.00 0.00 N ATOM 1647 CA THR C 5 -3.141 10.578 6.632 1.00 0.00 C ATOM 1648 C THR C 5 -2.190 11.718 6.998 1.00 0.00 C ATOM 1649 O THR C 5 -1.137 11.877 6.391 1.00 0.00 O ATOM 1650 CB THR C 5 -3.941 10.966 5.374 1.00 0.00 C ATOM 1651 OG1 THR C 5 -5.090 10.117 5.256 1.00 0.00 O ATOM 1652 CG2 THR C 5 -3.090 10.837 4.119 1.00 0.00 C ATOM 0 H THR C 5 -5.031 10.421 7.507 1.00 0.00 H new ATOM 0 HA THR C 5 -2.550 9.685 6.431 1.00 0.00 H new ATOM 0 HB THR C 5 -4.251 12.006 5.475 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.600 10.365 4.457 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.682 11.118 3.248 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.225 11.495 4.197 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.753 9.806 4.012 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.543 12.473 8.030 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.767 13.641 8.428 1.00 0.00 C ATOM 1662 C ASP C 6 -0.567 13.240 9.279 1.00 0.00 C ATOM 1663 O ASP C 6 0.267 14.077 9.624 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.646 14.627 9.204 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.743 15.236 8.351 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.782 14.571 8.141 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.576 16.386 7.889 1.00 0.00 O ATOM 0 H ASP C 6 -3.364 12.297 8.609 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.401 14.123 7.521 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -3.096 14.114 10.054 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -2.021 15.424 9.607 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.473 11.959 9.613 1.00 0.00 N ATOM 1673 CA ASP C 7 0.660 11.463 10.385 1.00 0.00 C ATOM 1674 C ASP C 7 1.647 10.723 9.488 1.00 0.00 C ATOM 1675 O ASP C 7 2.794 10.484 9.874 1.00 0.00 O ATOM 1676 CB ASP C 7 0.183 10.516 11.493 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.717 11.190 12.510 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.193 11.839 13.439 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.955 11.058 12.395 1.00 0.00 O ATOM 0 H ASP C 7 -1.162 11.249 9.364 1.00 0.00 H new ATOM 0 HA ASP C 7 1.158 12.324 10.831 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.352 9.680 11.042 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.051 10.100 12.005 1.00 0.00 H new ATOM 1684 N LEU C 8 1.209 10.361 8.290 1.00 0.00 N ATOM 1685 CA LEU C 8 2.077 9.660 7.350 1.00 0.00 C ATOM 1686 C LEU C 8 2.388 10.533 6.150 1.00 0.00 C ATOM 1687 O LEU C 8 3.336 10.275 5.404 1.00 0.00 O ATOM 1688 CB LEU C 8 1.456 8.336 6.899 1.00 0.00 C ATOM 1689 CG LEU C 8 1.514 7.209 7.933 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.507 7.432 9.051 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.281 5.868 7.264 1.00 0.00 C ATOM 0 H LEU C 8 0.265 10.539 7.946 1.00 0.00 H new ATOM 0 HA LEU C 8 3.010 9.436 7.868 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.413 8.513 6.634 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.963 8.004 5.993 1.00 0.00 H new ATOM 0 HG LEU C 8 2.509 7.210 8.378 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.573 6.614 9.769 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.724 8.375 9.553 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.499 7.467 8.633 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.325 5.076 8.012 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.300 5.864 6.789 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.050 5.699 6.510 1.00 0.00 H new ATOM 1703 N GLU C 9 1.593 11.574 5.984 1.00 0.00 N ATOM 1704 CA GLU C 9 1.810 12.554 4.942 1.00 0.00 C ATOM 1705 C GLU C 9 1.689 13.950 5.530 1.00 0.00 C ATOM 1706 O GLU C 9 0.760 14.246 6.284 1.00 0.00 O ATOM 1707 CB GLU C 9 0.823 12.375 3.785 1.00 0.00 C ATOM 1708 CG GLU C 9 1.053 11.107 2.976 1.00 0.00 C ATOM 1709 CD GLU C 9 0.139 10.998 1.771 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.762 11.846 1.615 1.00 0.00 O ATOM 1711 OE2 GLU C 9 0.328 10.064 0.966 1.00 0.00 O ATOM 0 H GLU C 9 0.779 11.762 6.569 1.00 0.00 H new ATOM 0 HA GLU C 9 2.813 12.411 4.539 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.192 12.362 4.183 1.00 0.00 H new ATOM 0 HB3 GLU C 9 0.894 13.237 3.121 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.090 11.079 2.642 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.902 10.240 3.619 1.00 0.00 H new ATOM 1718 N VAL C 10 2.630 14.797 5.182 1.00 0.00 N ATOM 1719 CA VAL C 10 2.682 16.149 5.689 1.00 0.00 C ATOM 1720 C VAL C 10 2.773 17.109 4.517 1.00 0.00 C ATOM 1721 O VAL C 10 3.417 16.810 3.510 1.00 0.00 O ATOM 1722 CB VAL C 10 3.883 16.347 6.649 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.201 16.015 5.965 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.907 17.765 7.200 1.00 0.00 C ATOM 0 H VAL C 10 3.385 14.566 4.536 1.00 0.00 H new ATOM 0 HA VAL C 10 1.776 16.348 6.261 1.00 0.00 H new ATOM 0 HB VAL C 10 3.757 15.656 7.482 1.00 0.00 H new ATOM 0 HG11 VAL C 10 6.022 16.164 6.666 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.189 14.976 5.637 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.337 16.667 5.102 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.758 17.880 7.871 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.995 18.474 6.377 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.985 17.958 7.748 1.00 0.00 H new ATOM 1734 N ALA C 11 2.108 18.242 4.628 1.00 0.00 N ATOM 1735 CA ALA C 11 2.104 19.219 3.558 1.00 0.00 C ATOM 1736 C ALA C 11 3.505 19.763 3.333 1.00 0.00 C ATOM 1737 O ALA C 11 4.218 20.089 4.280 1.00 0.00 O ATOM 1738 CB ALA C 11 1.131 20.333 3.909 1.00 0.00 C ATOM 0 H ALA C 11 1.564 18.508 5.448 1.00 0.00 H new ATOM 0 HA ALA C 11 1.782 18.748 2.629 1.00 0.00 H new ATOM 0 HB1 ALA C 11 1.121 21.073 3.109 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.131 19.917 4.031 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.442 20.808 4.839 1.00 0.00 H new ATOM 1744 N CYS C 12 3.891 19.826 2.058 1.00 0.00 N ATOM 1745 CA CYS C 12 5.253 20.129 1.644 1.00 0.00 C ATOM 1746 C CYS C 12 5.758 21.489 2.142 1.00 0.00 C ATOM 1747 O CYS C 12 4.978 22.322 2.589 1.00 0.00 O ATOM 1748 CB CYS C 12 5.303 20.121 0.119 1.00 0.00 C ATOM 1749 SG CYS C 12 6.555 19.032 -0.580 1.00 0.00 S ATOM 0 H CYS C 12 3.255 19.665 1.277 1.00 0.00 H new ATOM 0 HA CYS C 12 5.900 19.370 2.084 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.326 19.823 -0.263 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.486 21.137 -0.231 1.00 0.00 H new ATOM 1754 N PRO C 13 7.080 21.733 2.041 1.00 0.00 N ATOM 1755 CA PRO C 13 7.679 23.036 2.350 1.00 0.00 C ATOM 1756 C PRO C 13 6.947 24.226 1.716 1.00 0.00 C ATOM 1757 O PRO C 13 6.880 25.303 2.304 1.00 0.00 O ATOM 1758 CB PRO C 13 9.067 22.912 1.726 1.00 0.00 C ATOM 1759 CG PRO C 13 9.420 21.475 1.844 1.00 0.00 C ATOM 1760 CD PRO C 13 8.116 20.730 1.689 1.00 0.00 C ATOM 0 HA PRO C 13 7.654 23.237 3.421 1.00 0.00 H new ATOM 0 HB2 PRO C 13 9.060 23.231 0.684 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.790 23.539 2.247 1.00 0.00 H new ATOM 0 HG2 PRO C 13 10.135 21.181 1.075 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.883 21.262 2.808 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.985 20.363 0.671 1.00 0.00 H new ATOM 0 HD3 PRO C 13 8.072 19.863 2.348 1.00 0.00 H new ATOM 1768 N LYS C 14 6.387 24.024 0.520 1.00 0.00 N ATOM 1769 CA LYS C 14 5.934 25.158 -0.282 1.00 0.00 C ATOM 1770 C LYS C 14 4.816 24.813 -1.278 1.00 0.00 C ATOM 1771 O LYS C 14 4.051 25.690 -1.667 1.00 0.00 O ATOM 1772 CB LYS C 14 7.137 25.754 -1.028 1.00 0.00 C ATOM 1773 CG LYS C 14 6.778 26.826 -2.048 1.00 0.00 C ATOM 1774 CD LYS C 14 8.004 27.280 -2.824 1.00 0.00 C ATOM 1775 CE LYS C 14 7.620 28.147 -4.013 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.957 29.411 -3.594 1.00 0.00 N ATOM 0 H LYS C 14 6.240 23.108 0.096 1.00 0.00 H new ATOM 0 HA LYS C 14 5.502 25.882 0.409 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.826 26.180 -0.299 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.668 24.950 -1.537 1.00 0.00 H new ATOM 0 HG2 LYS C 14 6.030 26.438 -2.739 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.330 27.680 -1.540 1.00 0.00 H new ATOM 0 HD2 LYS C 14 8.668 27.839 -2.164 1.00 0.00 H new ATOM 0 HD3 LYS C 14 8.559 26.409 -3.172 1.00 0.00 H new ATOM 0 HE2 LYS C 14 8.512 28.382 -4.593 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.952 27.588 -4.668 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.728 29.978 -4.435 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 6.082 29.189 -3.077 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 7.597 29.950 -2.976 1.00 0.00 H new ATOM 1790 N CYS C 15 4.698 23.563 -1.716 1.00 0.00 N ATOM 1791 CA CYS C 15 3.735 23.276 -2.792 1.00 0.00 C ATOM 1792 C CYS C 15 2.613 22.323 -2.402 1.00 0.00 C ATOM 1793 O CYS C 15 2.221 21.458 -3.195 1.00 0.00 O ATOM 1794 CB CYS C 15 4.484 22.631 -3.941 1.00 0.00 C ATOM 1795 SG CYS C 15 5.551 21.271 -3.410 1.00 0.00 S ATOM 0 H CYS C 15 5.226 22.762 -1.368 1.00 0.00 H new ATOM 0 HA CYS C 15 3.276 24.231 -3.047 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.767 22.259 -4.672 1.00 0.00 H new ATOM 0 HB3 CYS C 15 5.089 23.386 -4.443 1.00 0.00 H new ATOM 1800 N GLU C 16 2.029 22.539 -1.257 1.00 0.00 N ATOM 1801 CA GLU C 16 1.069 21.613 -0.698 1.00 0.00 C ATOM 1802 C GLU C 16 -0.349 21.923 -1.130 1.00 0.00 C ATOM 1803 O GLU C 16 -1.295 21.590 -0.419 1.00 0.00 O ATOM 1804 CB GLU C 16 1.133 21.685 0.825 1.00 0.00 C ATOM 1805 CG GLU C 16 2.273 22.526 1.375 1.00 0.00 C ATOM 1806 CD GLU C 16 1.947 24.007 1.384 1.00 0.00 C ATOM 1807 OE1 GLU C 16 2.093 24.662 0.332 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.541 24.524 2.442 1.00 0.00 O ATOM 0 H GLU C 16 2.202 23.362 -0.680 1.00 0.00 H new ATOM 0 HA GLU C 16 1.326 20.618 -1.062 1.00 0.00 H new ATOM 0 HB2 GLU C 16 0.191 22.088 1.196 1.00 0.00 H new ATOM 0 HB3 GLU C 16 1.224 20.673 1.219 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.504 22.201 2.390 1.00 0.00 H new ATOM 0 HG3 GLU C 16 3.167 22.357 0.775 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.518 22.543 -2.289 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.842 22.874 -2.767 1.00 0.00 C ATOM 1817 C ARG C 17 -1.817 22.800 -4.297 1.00 0.00 C ATOM 1818 O ARG C 17 -2.859 22.759 -4.951 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.331 24.250 -2.275 1.00 0.00 C ATOM 1820 CG ARG C 17 -1.627 25.453 -2.886 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.294 25.744 -2.220 1.00 0.00 C ATOM 1822 NE ARG C 17 0.258 27.022 -2.663 1.00 0.00 N ATOM 1823 CZ ARG C 17 1.221 27.680 -2.019 1.00 0.00 C ATOM 1824 NH1 ARG C 17 1.752 27.171 -0.916 1.00 0.00 N ATOM 1825 NH2 ARG C 17 1.647 28.850 -2.479 1.00 0.00 N ATOM 0 H ARG C 17 0.243 22.823 -2.908 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.557 22.158 -2.361 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -3.398 24.332 -2.482 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.212 24.293 -1.192 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -1.467 25.276 -3.950 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -2.271 26.329 -2.802 1.00 0.00 H new ATOM 0 HD2 ARG C 17 -0.422 25.757 -1.138 1.00 0.00 H new ATOM 0 HD3 ARG C 17 0.410 24.944 -2.448 1.00 0.00 H new ATOM 0 HE ARG C 17 -0.116 27.436 -3.517 1.00 0.00 H new ATOM 0 HH11 ARG C 17 1.423 26.274 -0.559 1.00 0.00 H new ATOM 0 HH12 ARG C 17 2.489 27.677 -0.425 1.00 0.00 H new ATOM 0 HH21 ARG C 17 1.237 29.245 -3.325 1.00 0.00 H new ATOM 0 HH22 ARG C 17 2.384 29.354 -1.986 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.590 22.783 -4.863 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.417 22.779 -6.317 1.00 0.00 C ATOM 1841 C ALA C 18 0.270 21.510 -6.803 1.00 0.00 C ATOM 1842 O ALA C 18 -0.036 21.007 -7.883 1.00 0.00 O ATOM 1843 CB ALA C 18 0.377 23.993 -6.768 1.00 0.00 C ATOM 0 H ALA C 18 0.282 22.772 -4.334 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.414 22.816 -6.756 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.493 23.970 -7.852 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.152 24.901 -6.479 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.360 23.980 -6.297 1.00 0.00 H new ATOM 1849 N GLY C 19 1.182 20.977 -5.999 1.00 0.00 N ATOM 1850 CA GLY C 19 1.885 19.778 -6.399 1.00 0.00 C ATOM 1851 C GLY C 19 3.191 20.054 -7.120 1.00 0.00 C ATOM 1852 O GLY C 19 3.836 19.129 -7.577 1.00 0.00 O ATOM 0 H GLY C 19 1.444 21.351 -5.087 1.00 0.00 H new ATOM 0 HA2 GLY C 19 2.088 19.173 -5.515 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.239 19.187 -7.048 1.00 0.00 H new ATOM 1856 N GLU C 20 3.627 21.311 -7.102 1.00 0.00 N ATOM 1857 CA GLU C 20 4.786 21.758 -7.894 1.00 0.00 C ATOM 1858 C GLU C 20 5.267 23.079 -7.339 1.00 0.00 C ATOM 1859 O GLU C 20 4.570 23.714 -6.548 1.00 0.00 O ATOM 1860 CB GLU C 20 4.502 21.941 -9.402 1.00 0.00 C ATOM 1861 CG GLU C 20 4.020 20.692 -10.123 1.00 0.00 C ATOM 1862 CD GLU C 20 5.125 19.666 -10.317 1.00 0.00 C ATOM 1863 OE1 GLU C 20 5.886 19.404 -9.357 1.00 0.00 O ATOM 1864 OE2 GLU C 20 5.235 19.119 -11.436 1.00 0.00 O ATOM 0 H GLU C 20 3.196 22.049 -6.545 1.00 0.00 H new ATOM 0 HA GLU C 20 5.533 20.969 -7.813 1.00 0.00 H new ATOM 0 HB2 GLU C 20 3.753 22.723 -9.523 1.00 0.00 H new ATOM 0 HB3 GLU C 20 5.412 22.294 -9.887 1.00 0.00 H new ATOM 0 HG2 GLU C 20 3.206 20.241 -9.556 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.614 20.972 -11.095 1.00 0.00 H new ATOM 1871 N ILE C 21 6.419 23.521 -7.785 1.00 0.00 N ATOM 1872 CA ILE C 21 7.032 24.709 -7.233 1.00 0.00 C ATOM 1873 C ILE C 21 7.587 25.577 -8.338 1.00 0.00 C ATOM 1874 O ILE C 21 8.410 25.133 -9.130 1.00 0.00 O ATOM 1875 CB ILE C 21 8.144 24.359 -6.221 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.501 23.825 -4.940 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.030 25.565 -5.933 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.463 23.556 -3.810 1.00 0.00 C ATOM 0 H ILE C 21 6.953 23.075 -8.531 1.00 0.00 H new ATOM 0 HA ILE C 21 6.258 25.261 -6.700 1.00 0.00 H new ATOM 0 HB ILE C 21 8.787 23.589 -6.648 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.755 24.543 -4.599 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.972 22.902 -5.174 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.803 25.286 -5.217 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.497 25.903 -6.858 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.424 26.370 -5.518 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.914 23.181 -2.946 1.00 0.00 H new ATOM 0 HD12 ILE C 21 9.196 22.813 -4.125 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.975 24.480 -3.541 1.00 0.00 H new ATOM 1890 N GLU C 22 7.127 26.816 -8.368 1.00 0.00 N ATOM 1891 CA GLU C 22 7.574 27.780 -9.353 1.00 0.00 C ATOM 1892 C GLU C 22 7.364 27.248 -10.777 1.00 0.00 C ATOM 1893 O GLU C 22 8.271 27.291 -11.605 1.00 0.00 O ATOM 1894 CB GLU C 22 9.048 28.080 -9.090 1.00 0.00 C ATOM 1895 CG GLU C 22 9.489 29.453 -9.550 1.00 0.00 C ATOM 1896 CD GLU C 22 8.719 30.547 -8.841 1.00 0.00 C ATOM 1897 OE1 GLU C 22 8.865 30.676 -7.606 1.00 0.00 O ATOM 1898 OE2 GLU C 22 7.928 31.249 -9.500 1.00 0.00 O ATOM 0 H GLU C 22 6.436 27.179 -7.712 1.00 0.00 H new ATOM 0 HA GLU C 22 6.990 28.696 -9.268 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.242 27.986 -8.021 1.00 0.00 H new ATOM 0 HB3 GLU C 22 9.656 27.327 -9.592 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.556 29.576 -9.362 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.343 29.542 -10.626 1.00 0.00 H new ATOM 1905 N GLY C 23 6.178 26.696 -11.045 1.00 0.00 N ATOM 1906 CA GLY C 23 5.884 26.173 -12.377 1.00 0.00 C ATOM 1907 C GLY C 23 6.761 24.994 -12.732 1.00 0.00 C ATOM 1908 O GLY C 23 6.812 24.546 -13.877 1.00 0.00 O ATOM 0 H GLY C 23 5.420 26.601 -10.370 1.00 0.00 H new ATOM 0 HA2 GLY C 23 4.837 25.873 -12.425 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.023 26.963 -13.115 1.00 0.00 H new ATOM 1912 N THR C 24 7.441 24.516 -11.728 1.00 0.00 N ATOM 1913 CA THR C 24 8.510 23.558 -11.885 1.00 0.00 C ATOM 1914 C THR C 24 8.296 22.328 -10.998 1.00 0.00 C ATOM 1915 O THR C 24 7.845 22.449 -9.855 1.00 0.00 O ATOM 1916 CB THR C 24 9.816 24.303 -11.549 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.259 25.042 -12.696 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.932 23.393 -11.052 1.00 0.00 C ATOM 0 H THR C 24 7.268 24.783 -10.759 1.00 0.00 H new ATOM 0 HA THR C 24 8.546 23.171 -12.904 1.00 0.00 H new ATOM 0 HB THR C 24 9.585 24.978 -10.725 1.00 0.00 H new ATOM 0 HG1 THR C 24 9.822 25.919 -12.709 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.819 23.989 -10.836 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.608 22.882 -10.145 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.169 22.655 -11.819 1.00 0.00 H new ATOM 1926 N PRO C 25 8.597 21.125 -11.533 1.00 0.00 N ATOM 1927 CA PRO C 25 8.395 19.861 -10.818 1.00 0.00 C ATOM 1928 C PRO C 25 9.141 19.836 -9.487 1.00 0.00 C ATOM 1929 O PRO C 25 10.349 20.078 -9.422 1.00 0.00 O ATOM 1930 CB PRO C 25 8.942 18.794 -11.779 1.00 0.00 C ATOM 1931 CG PRO C 25 9.815 19.548 -12.722 1.00 0.00 C ATOM 1932 CD PRO C 25 9.177 20.901 -12.866 1.00 0.00 C ATOM 0 HA PRO C 25 7.348 19.700 -10.561 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.505 18.029 -11.243 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.135 18.285 -12.307 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.830 19.632 -12.335 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.882 19.041 -13.685 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.907 21.668 -13.125 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.416 20.909 -13.646 1.00 0.00 H new ATOM 1940 N CYS C 26 8.408 19.545 -8.431 1.00 0.00 N ATOM 1941 CA CYS C 26 8.923 19.670 -7.077 1.00 0.00 C ATOM 1942 C CYS C 26 9.804 18.484 -6.650 1.00 0.00 C ATOM 1943 O CYS C 26 9.487 17.328 -6.925 1.00 0.00 O ATOM 1944 CB CYS C 26 7.761 19.852 -6.105 1.00 0.00 C ATOM 1945 SG CYS C 26 8.278 20.038 -4.372 1.00 0.00 S ATOM 0 H CYS C 26 7.444 19.217 -8.483 1.00 0.00 H new ATOM 0 HA CYS C 26 9.569 20.548 -7.057 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.187 20.731 -6.400 1.00 0.00 H new ATOM 0 HB3 CYS C 26 7.094 18.994 -6.186 1.00 0.00 H new ATOM 1950 N PRO C 27 10.920 18.802 -5.940 1.00 0.00 N ATOM 1951 CA PRO C 27 11.924 17.849 -5.430 1.00 0.00 C ATOM 1952 C PRO C 27 11.405 16.453 -5.062 1.00 0.00 C ATOM 1953 O PRO C 27 11.837 15.451 -5.625 1.00 0.00 O ATOM 1954 CB PRO C 27 12.396 18.554 -4.159 1.00 0.00 C ATOM 1955 CG PRO C 27 12.298 20.017 -4.443 1.00 0.00 C ATOM 1956 CD PRO C 27 11.327 20.183 -5.602 1.00 0.00 C ATOM 0 HA PRO C 27 12.672 17.641 -6.195 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.775 18.279 -3.306 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.419 18.271 -3.913 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.945 20.557 -3.564 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.276 20.426 -4.698 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.469 20.792 -5.318 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.801 20.677 -6.450 1.00 0.00 H new ATOM 1964 N ALA C 28 10.446 16.407 -4.148 1.00 0.00 N ATOM 1965 CA ALA C 28 10.087 15.150 -3.488 1.00 0.00 C ATOM 1966 C ALA C 28 8.599 14.850 -3.619 1.00 0.00 C ATOM 1967 O ALA C 28 8.128 13.783 -3.231 1.00 0.00 O ATOM 1968 CB ALA C 28 10.497 15.195 -2.024 1.00 0.00 C ATOM 0 H ALA C 28 9.904 17.216 -3.845 1.00 0.00 H new ATOM 0 HA ALA C 28 10.626 14.344 -3.985 1.00 0.00 H new ATOM 0 HB1 ALA C 28 10.226 14.256 -1.541 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.575 15.342 -1.952 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.984 16.019 -1.528 1.00 0.00 H new ATOM 1974 N CYS C 29 7.860 15.797 -4.165 1.00 0.00 N ATOM 1975 CA CYS C 29 6.435 15.621 -4.363 1.00 0.00 C ATOM 1976 C CYS C 29 6.090 15.955 -5.804 1.00 0.00 C ATOM 1977 O CYS C 29 5.733 17.088 -6.115 1.00 0.00 O ATOM 1978 CB CYS C 29 5.640 16.513 -3.386 1.00 0.00 C ATOM 1979 SG CYS C 29 5.842 18.300 -3.651 1.00 0.00 S ATOM 0 H CYS C 29 8.224 16.697 -4.479 1.00 0.00 H new ATOM 0 HA CYS C 29 6.163 14.585 -4.161 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.582 16.265 -3.468 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.945 16.274 -2.367 1.00 0.00 H new ATOM 1984 N SER C 30 6.225 14.978 -6.690 1.00 0.00 N ATOM 1985 CA SER C 30 6.013 15.193 -8.115 1.00 0.00 C ATOM 1986 C SER C 30 4.525 15.334 -8.453 1.00 0.00 C ATOM 1987 O SER C 30 3.991 14.606 -9.293 1.00 0.00 O ATOM 1988 CB SER C 30 6.624 14.025 -8.892 1.00 0.00 C ATOM 1989 OG SER C 30 7.896 13.676 -8.363 1.00 0.00 O ATOM 0 H SER C 30 6.482 14.022 -6.445 1.00 0.00 H new ATOM 0 HA SER C 30 6.499 16.126 -8.400 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.958 13.164 -8.846 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.724 14.295 -9.943 1.00 0.00 H new ATOM 0 HG SER C 30 8.268 12.926 -8.873 1.00 0.00 H new ATOM 1995 N GLY C 31 3.857 16.255 -7.777 1.00 0.00 N ATOM 1996 CA GLY C 31 2.487 16.563 -8.096 1.00 0.00 C ATOM 1997 C GLY C 31 1.507 15.888 -7.173 1.00 0.00 C ATOM 1998 O GLY C 31 0.594 15.204 -7.632 1.00 0.00 O ATOM 0 H GLY C 31 4.247 16.797 -7.006 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.341 17.642 -8.047 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.281 16.260 -9.122 1.00 0.00 H new ATOM 2002 N LYS C 32 1.685 16.056 -5.868 1.00 0.00 N ATOM 2003 CA LYS C 32 0.742 15.534 -4.895 1.00 0.00 C ATOM 2004 C LYS C 32 0.319 16.643 -3.933 1.00 0.00 C ATOM 2005 O LYS C 32 -0.850 16.755 -3.574 1.00 0.00 O ATOM 2006 CB LYS C 32 1.376 14.385 -4.106 1.00 0.00 C ATOM 2007 CG LYS C 32 1.533 13.103 -4.908 1.00 0.00 C ATOM 2008 CD LYS C 32 2.169 12.001 -4.077 1.00 0.00 C ATOM 2009 CE LYS C 32 3.682 12.127 -4.025 1.00 0.00 C ATOM 2010 NZ LYS C 32 4.321 11.690 -5.295 1.00 0.00 N ATOM 0 H LYS C 32 2.478 16.552 -5.461 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.135 15.161 -5.424 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.356 14.700 -3.747 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.765 14.180 -3.227 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.557 12.774 -5.265 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.146 13.296 -5.788 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.768 12.034 -3.064 1.00 0.00 H new ATOM 0 HD3 LYS C 32 1.900 11.031 -4.495 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.953 13.163 -3.821 1.00 0.00 H new ATOM 0 HE3 LYS C 32 4.068 11.528 -3.200 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 5.354 11.679 -5.178 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 3.990 10.735 -5.539 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 4.066 12.350 -6.057 1.00 0.00 H new ATOM 2024 N GLY C 33 1.288 17.467 -3.511 1.00 0.00 N ATOM 2025 CA GLY C 33 1.027 18.507 -2.554 1.00 0.00 C ATOM 2026 C GLY C 33 1.730 18.213 -1.250 1.00 0.00 C ATOM 2027 O GLY C 33 2.318 19.096 -0.632 1.00 0.00 O ATOM 0 H GLY C 33 2.256 17.419 -3.829 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.365 19.465 -2.948 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.046 18.592 -2.384 1.00 0.00 H new ATOM 2031 N VAL C 34 1.740 16.948 -0.870 1.00 0.00 N ATOM 2032 CA VAL C 34 2.303 16.546 0.409 1.00 0.00 C ATOM 2033 C VAL C 34 3.532 15.665 0.228 1.00 0.00 C ATOM 2034 O VAL C 34 3.828 15.204 -0.880 1.00 0.00 O ATOM 2035 CB VAL C 34 1.261 15.775 1.251 1.00 0.00 C ATOM 2036 CG1 VAL C 34 0.061 16.653 1.570 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.817 14.513 0.528 1.00 0.00 C ATOM 0 H VAL C 34 1.365 16.181 -1.428 1.00 0.00 H new ATOM 0 HA VAL C 34 2.593 17.460 0.927 1.00 0.00 H new ATOM 0 HB VAL C 34 1.733 15.489 2.191 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.657 16.086 2.163 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.389 17.526 2.134 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.410 16.976 0.642 1.00 0.00 H new ATOM 0 HG21 VAL C 34 0.084 13.984 1.137 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.369 14.780 -0.429 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.680 13.869 0.358 1.00 0.00 H new ATOM 2047 N ILE C 35 4.250 15.469 1.321 1.00 0.00 N ATOM 2048 CA ILE C 35 5.355 14.530 1.375 1.00 0.00 C ATOM 2049 C ILE C 35 5.169 13.582 2.550 1.00 0.00 C ATOM 2050 O ILE C 35 4.425 13.875 3.482 1.00 0.00 O ATOM 2051 CB ILE C 35 6.725 15.231 1.493 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.648 16.380 2.500 1.00 0.00 C ATOM 2053 CG2 ILE C 35 7.192 15.726 0.132 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.986 17.014 2.814 1.00 0.00 C ATOM 0 H ILE C 35 4.081 15.960 2.199 1.00 0.00 H new ATOM 0 HA ILE C 35 5.351 13.977 0.436 1.00 0.00 H new ATOM 0 HB ILE C 35 7.457 14.509 1.856 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.977 17.146 2.111 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.207 16.010 3.425 1.00 0.00 H new ATOM 0 HG21 ILE C 35 8.159 16.217 0.236 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.286 14.881 -0.550 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.466 16.435 -0.266 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.847 17.820 3.535 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.655 16.263 3.234 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.421 17.417 1.899 1.00 0.00 H new ATOM 2066 N LEU C 36 5.842 12.450 2.500 1.00 0.00 N ATOM 2067 CA LEU C 36 5.634 11.395 3.482 1.00 0.00 C ATOM 2068 C LEU C 36 6.498 11.583 4.720 1.00 0.00 C ATOM 2069 O LEU C 36 7.452 12.361 4.722 1.00 0.00 O ATOM 2070 CB LEU C 36 5.935 10.028 2.862 1.00 0.00 C ATOM 2071 CG LEU C 36 5.144 9.702 1.593 1.00 0.00 C ATOM 2072 CD1 LEU C 36 5.886 10.163 0.347 1.00 0.00 C ATOM 2073 CD2 LEU C 36 4.846 8.219 1.528 1.00 0.00 C ATOM 0 H LEU C 36 6.540 12.233 1.789 1.00 0.00 H new ATOM 0 HA LEU C 36 4.589 11.447 3.788 1.00 0.00 H new ATOM 0 HB2 LEU C 36 6.999 9.977 2.631 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.733 9.257 3.605 1.00 0.00 H new ATOM 0 HG LEU C 36 4.199 10.244 1.631 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.299 9.917 -0.538 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.039 11.241 0.393 1.00 0.00 H new ATOM 0 HD13 LEU C 36 6.852 9.661 0.292 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.283 8.000 0.621 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.782 7.660 1.518 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.259 7.927 2.399 1.00 0.00 H new ATOM 2085 N THR C 37 6.144 10.851 5.768 1.00 0.00 N ATOM 2086 CA THR C 37 6.918 10.820 6.997 1.00 0.00 C ATOM 2087 C THR C 37 7.666 9.499 7.054 1.00 0.00 C ATOM 2088 O THR C 37 7.465 8.664 6.183 1.00 0.00 O ATOM 2089 CB THR C 37 6.006 10.940 8.237 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.134 9.803 8.318 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.169 12.208 8.180 1.00 0.00 C ATOM 0 H THR C 37 5.311 10.262 5.788 1.00 0.00 H new ATOM 0 HA THR C 37 7.609 11.663 7.003 1.00 0.00 H new ATOM 0 HB THR C 37 6.645 10.980 9.119 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.408 9.992 8.949 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.536 12.266 9.066 1.00 0.00 H new ATOM 0 HG22 THR C 37 5.826 13.077 8.146 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.543 12.191 7.288 1.00 0.00 H new ATOM 2099 N ALA C 38 8.509 9.290 8.055 1.00 0.00 N ATOM 2100 CA ALA C 38 9.317 8.073 8.112 1.00 0.00 C ATOM 2101 C ALA C 38 8.450 6.814 8.080 1.00 0.00 C ATOM 2102 O ALA C 38 8.779 5.847 7.386 1.00 0.00 O ATOM 2103 CB ALA C 38 10.214 8.084 9.334 1.00 0.00 C ATOM 0 H ALA C 38 8.653 9.936 8.831 1.00 0.00 H new ATOM 0 HA ALA C 38 9.947 8.054 7.222 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.807 7.170 9.358 1.00 0.00 H new ATOM 0 HB2 ALA C 38 10.879 8.947 9.290 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.602 8.143 10.234 1.00 0.00 H new ATOM 2109 N GLN C 39 7.346 6.825 8.822 1.00 0.00 N ATOM 2110 CA GLN C 39 6.387 5.724 8.772 1.00 0.00 C ATOM 2111 C GLN C 39 5.819 5.566 7.365 1.00 0.00 C ATOM 2112 O GLN C 39 5.709 4.452 6.855 1.00 0.00 O ATOM 2113 CB GLN C 39 5.247 5.947 9.766 1.00 0.00 C ATOM 2114 CG GLN C 39 4.245 4.802 9.794 1.00 0.00 C ATOM 2115 CD GLN C 39 3.163 4.991 10.834 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.382 5.623 11.866 1.00 0.00 O ATOM 2117 NE2 GLN C 39 1.993 4.432 10.575 1.00 0.00 N ATOM 0 H GLN C 39 7.094 7.579 9.461 1.00 0.00 H new ATOM 0 HA GLN C 39 6.916 4.811 9.045 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.664 6.081 10.764 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.727 6.871 9.512 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.784 4.705 8.811 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.773 3.869 9.992 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.855 3.916 9.706 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.228 4.516 11.245 1.00 0.00 H new ATOM 2126 N GLY C 40 5.477 6.687 6.736 1.00 0.00 N ATOM 2127 CA GLY C 40 4.946 6.650 5.387 1.00 0.00 C ATOM 2128 C GLY C 40 5.997 6.237 4.377 1.00 0.00 C ATOM 2129 O GLY C 40 5.687 5.613 3.369 1.00 0.00 O ATOM 0 H GLY C 40 5.559 7.621 7.138 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.109 5.953 5.345 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.556 7.633 5.123 1.00 0.00 H new ATOM 2133 N TYR C 41 7.250 6.568 4.667 1.00 0.00 N ATOM 2134 CA TYR C 41 8.363 6.181 3.815 1.00 0.00 C ATOM 2135 C TYR C 41 8.592 4.681 3.867 1.00 0.00 C ATOM 2136 O TYR C 41 8.926 4.065 2.856 1.00 0.00 O ATOM 2137 CB TYR C 41 9.637 6.913 4.264 1.00 0.00 C ATOM 2138 CG TYR C 41 9.831 8.273 3.630 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.136 8.391 2.282 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.719 9.433 4.380 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.317 9.630 1.698 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.899 10.676 3.805 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.197 10.769 2.464 1.00 0.00 C ATOM 2144 OH TYR C 41 10.370 12.004 1.885 1.00 0.00 O ATOM 0 H TYR C 41 7.519 7.106 5.491 1.00 0.00 H new ATOM 0 HA TYR C 41 8.122 6.457 2.789 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.611 7.031 5.347 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.501 6.290 4.031 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.234 7.500 1.679 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.487 9.364 5.433 1.00 0.00 H new ATOM 0 HE1 TYR C 41 10.551 9.705 0.646 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.806 11.570 4.404 1.00 0.00 H new ATOM 0 HH TYR C 41 10.251 12.702 2.562 1.00 0.00 H new ATOM 2154 N THR C 42 8.369 4.090 5.026 1.00 0.00 N ATOM 2155 CA THR C 42 8.475 2.647 5.170 1.00 0.00 C ATOM 2156 C THR C 42 7.326 1.957 4.438 1.00 0.00 C ATOM 2157 O THR C 42 7.481 0.869 3.877 1.00 0.00 O ATOM 2158 CB THR C 42 8.443 2.251 6.656 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.407 3.023 7.383 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.736 0.770 6.832 1.00 0.00 C ATOM 0 H THR C 42 8.114 4.584 5.881 1.00 0.00 H new ATOM 0 HA THR C 42 9.423 2.330 4.736 1.00 0.00 H new ATOM 0 HB THR C 42 7.444 2.452 7.043 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.091 3.947 7.465 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.707 0.517 7.892 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.987 0.185 6.299 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.725 0.545 6.432 1.00 0.00 H new ATOM 2168 N LEU C 43 6.189 2.632 4.396 1.00 0.00 N ATOM 2169 CA LEU C 43 4.988 2.066 3.804 1.00 0.00 C ATOM 2170 C LEU C 43 4.962 2.346 2.313 1.00 0.00 C ATOM 2171 O LEU C 43 4.189 1.739 1.580 1.00 0.00 O ATOM 2172 CB LEU C 43 3.724 2.646 4.464 1.00 0.00 C ATOM 2173 CG LEU C 43 3.060 1.781 5.555 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.085 1.280 6.559 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.986 2.584 6.269 1.00 0.00 C ATOM 0 H LEU C 43 6.072 3.575 4.766 1.00 0.00 H new ATOM 0 HA LEU C 43 5.002 0.989 3.970 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.980 3.611 4.902 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.987 2.835 3.683 1.00 0.00 H new ATOM 0 HG LEU C 43 2.606 0.915 5.073 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.587 0.673 7.315 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.833 0.677 6.045 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.571 2.130 7.038 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.521 1.967 7.038 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.436 3.463 6.731 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.229 2.899 5.551 1.00 0.00 H new ATOM 2187 N LEU C 44 5.832 3.239 1.850 1.00 0.00 N ATOM 2188 CA LEU C 44 5.832 3.612 0.451 1.00 0.00 C ATOM 2189 C LEU C 44 6.783 2.715 -0.328 1.00 0.00 C ATOM 2190 O LEU C 44 6.448 2.244 -1.400 1.00 0.00 O ATOM 2191 CB LEU C 44 6.164 5.114 0.277 1.00 0.00 C ATOM 2192 CG LEU C 44 7.623 5.506 -0.028 1.00 0.00 C ATOM 2193 CD1 LEU C 44 7.985 5.217 -1.480 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.841 6.981 0.239 1.00 0.00 C ATOM 0 H LEU C 44 6.535 3.709 2.420 1.00 0.00 H new ATOM 0 HA LEU C 44 4.832 3.465 0.044 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.540 5.502 -0.528 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.864 5.629 1.190 1.00 0.00 H new ATOM 0 HG LEU C 44 8.260 4.909 0.624 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.020 5.505 -1.661 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.864 4.152 -1.680 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.329 5.787 -2.139 1.00 0.00 H new ATOM 0 HD21 LEU C 44 8.876 7.242 0.019 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.176 7.568 -0.395 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.627 7.197 1.286 1.00 0.00 H new ATOM 2206 N ASP C 45 7.959 2.444 0.208 1.00 0.00 N ATOM 2207 CA ASP C 45 8.903 1.596 -0.504 1.00 0.00 C ATOM 2208 C ASP C 45 8.411 0.155 -0.490 1.00 0.00 C ATOM 2209 O ASP C 45 8.786 -0.658 -1.336 1.00 0.00 O ATOM 2210 CB ASP C 45 10.300 1.698 0.106 1.00 0.00 C ATOM 2211 CG ASP C 45 11.357 1.130 -0.816 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.691 1.801 -1.818 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.860 0.023 -0.547 1.00 0.00 O ATOM 0 H ASP C 45 8.280 2.788 1.113 1.00 0.00 H new ATOM 0 HA ASP C 45 8.969 1.937 -1.537 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.528 2.742 0.321 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.322 1.165 1.056 1.00 0.00 H new ATOM 2218 N PHE C 46 7.515 -0.126 0.444 1.00 0.00 N ATOM 2219 CA PHE C 46 6.836 -1.410 0.510 1.00 0.00 C ATOM 2220 C PHE C 46 5.779 -1.501 -0.567 1.00 0.00 C ATOM 2221 O PHE C 46 5.678 -2.518 -1.257 1.00 0.00 O ATOM 2222 CB PHE C 46 6.171 -1.524 1.882 1.00 0.00 C ATOM 2223 CG PHE C 46 5.497 -2.835 2.173 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.208 -3.883 2.733 1.00 0.00 C ATOM 2225 CD2 PHE C 46 4.146 -3.005 1.916 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.585 -5.078 3.030 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.519 -4.200 2.206 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.239 -5.236 2.766 1.00 0.00 C ATOM 0 H PHE C 46 7.239 0.529 1.176 1.00 0.00 H new ATOM 0 HA PHE C 46 7.554 -2.216 0.360 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.927 -1.347 2.647 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.432 -0.728 1.974 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.261 -3.764 2.940 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.578 -2.194 1.484 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.149 -5.888 3.468 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.467 -4.324 1.995 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.749 -6.170 2.998 1.00 0.00 H new ATOM 2238 N ILE C 47 5.008 -0.441 -0.755 1.00 0.00 N ATOM 2239 CA ILE C 47 3.973 -0.506 -1.755 1.00 0.00 C ATOM 2240 C ILE C 47 4.538 -0.273 -3.144 1.00 0.00 C ATOM 2241 O ILE C 47 3.958 -0.682 -4.138 1.00 0.00 O ATOM 2242 CB ILE C 47 2.748 0.407 -1.477 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.082 1.896 -1.222 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.001 -0.154 -0.280 1.00 0.00 C ATOM 2245 CD1 ILE C 47 3.821 2.627 -2.329 1.00 0.00 C ATOM 0 H ILE C 47 5.079 0.440 -0.246 1.00 0.00 H new ATOM 0 HA ILE C 47 3.583 -1.522 -1.701 1.00 0.00 H new ATOM 0 HB ILE C 47 2.146 0.401 -2.386 1.00 0.00 H new ATOM 0 HG12 ILE C 47 2.149 2.426 -1.028 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.680 1.960 -0.313 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.135 0.472 -0.066 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.670 -1.169 -0.501 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.662 -0.169 0.587 1.00 0.00 H new ATOM 0 HD11 ILE C 47 3.995 3.660 -2.029 1.00 0.00 H new ATOM 0 HD12 ILE C 47 4.777 2.137 -2.514 1.00 0.00 H new ATOM 0 HD13 ILE C 47 3.222 2.610 -3.239 1.00 0.00 H new ATOM 2257 N GLN C 48 5.680 0.375 -3.220 1.00 0.00 N ATOM 2258 CA GLN C 48 6.425 0.400 -4.445 1.00 0.00 C ATOM 2259 C GLN C 48 6.727 -1.033 -4.859 1.00 0.00 C ATOM 2260 O GLN C 48 6.184 -1.530 -5.821 1.00 0.00 O ATOM 2261 CB GLN C 48 7.716 1.197 -4.260 1.00 0.00 C ATOM 2262 CG GLN C 48 7.495 2.690 -4.068 1.00 0.00 C ATOM 2263 CD GLN C 48 6.647 3.312 -5.161 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.653 2.867 -6.307 1.00 0.00 O ATOM 2265 NE2 GLN C 48 5.912 4.352 -4.808 1.00 0.00 N ATOM 0 H GLN C 48 6.106 0.888 -2.448 1.00 0.00 H new ATOM 0 HA GLN C 48 5.843 0.887 -5.227 1.00 0.00 H new ATOM 0 HB2 GLN C 48 8.253 0.805 -3.396 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.355 1.043 -5.130 1.00 0.00 H new ATOM 0 HG2 GLN C 48 7.015 2.859 -3.104 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.461 3.193 -4.036 1.00 0.00 H new ATOM 0 HE21 GLN C 48 5.936 4.690 -3.846 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.321 4.816 -5.498 1.00 0.00 H new ATOM 2274 N LYS C 49 7.448 -1.731 -4.013 1.00 0.00 N ATOM 2275 CA LYS C 49 8.076 -3.003 -4.365 1.00 0.00 C ATOM 2276 C LYS C 49 7.072 -4.172 -4.379 1.00 0.00 C ATOM 2277 O LYS C 49 7.447 -5.312 -4.651 1.00 0.00 O ATOM 2278 CB LYS C 49 9.217 -3.228 -3.362 1.00 0.00 C ATOM 2279 CG LYS C 49 10.052 -4.477 -3.577 1.00 0.00 C ATOM 2280 CD LYS C 49 10.754 -4.891 -2.289 1.00 0.00 C ATOM 2281 CE LYS C 49 11.478 -3.725 -1.627 1.00 0.00 C ATOM 2282 NZ LYS C 49 12.136 -4.129 -0.357 1.00 0.00 N ATOM 0 H LYS C 49 7.622 -1.438 -3.052 1.00 0.00 H new ATOM 0 HA LYS C 49 8.465 -2.963 -5.382 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.879 -2.362 -3.394 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.791 -3.267 -2.359 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.415 -5.290 -3.926 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.792 -4.295 -4.357 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.022 -5.303 -1.595 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.469 -5.684 -2.506 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.226 -3.326 -2.312 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.768 -2.923 -1.428 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 12.226 -3.301 0.266 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.562 -4.857 0.115 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 13.081 -4.512 -0.562 1.00 0.00 H new ATOM 2296 N HIS C 50 5.796 -3.912 -4.076 1.00 0.00 N ATOM 2297 CA HIS C 50 4.778 -4.930 -4.377 1.00 0.00 C ATOM 2298 C HIS C 50 3.712 -4.464 -5.383 1.00 0.00 C ATOM 2299 O HIS C 50 2.825 -5.243 -5.736 1.00 0.00 O ATOM 2300 CB HIS C 50 4.106 -5.402 -3.081 1.00 0.00 C ATOM 2301 CG HIS C 50 5.094 -5.857 -2.055 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.999 -6.858 -2.293 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.361 -5.401 -0.811 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.782 -7.001 -1.246 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.423 -6.127 -0.328 1.00 0.00 N ATOM 0 H HIS C 50 5.453 -3.054 -3.645 1.00 0.00 H new ATOM 0 HA HIS C 50 5.306 -5.757 -4.852 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.508 -4.589 -2.669 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.421 -6.219 -3.308 1.00 0.00 H new ATOM 0 HD2 HIS C 50 4.837 -4.612 -0.292 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.586 -7.716 -1.154 1.00 0.00 H new ATOM 0 HE2 HIS C 50 6.859 -6.009 0.586 1.00 0.00 H new ATOM 2314 N LEU C 51 3.782 -3.216 -5.846 1.00 0.00 N ATOM 2315 CA LEU C 51 2.871 -2.755 -6.906 1.00 0.00 C ATOM 2316 C LEU C 51 3.656 -2.178 -8.084 1.00 0.00 C ATOM 2317 O LEU C 51 3.559 -2.664 -9.209 1.00 0.00 O ATOM 2318 CB LEU C 51 1.871 -1.678 -6.423 1.00 0.00 C ATOM 2319 CG LEU C 51 0.876 -2.078 -5.315 1.00 0.00 C ATOM 2320 CD1 LEU C 51 0.112 -3.347 -5.684 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.593 -2.222 -3.993 1.00 0.00 C ATOM 0 H LEU C 51 4.444 -2.514 -5.515 1.00 0.00 H new ATOM 0 HA LEU C 51 2.307 -3.637 -7.210 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.444 -0.822 -6.068 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.296 -1.341 -7.286 1.00 0.00 H new ATOM 0 HG LEU C 51 0.138 -1.283 -5.213 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -0.581 -3.601 -4.882 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.446 -3.181 -6.606 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.816 -4.167 -5.829 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.878 -2.505 -3.220 1.00 0.00 H new ATOM 0 HD22 LEU C 51 2.360 -2.992 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU C 51 2.059 -1.273 -3.727 1.00 0.00 H new ATOM 2333 N ASN C 52 4.463 -1.165 -7.801 1.00 0.00 N ATOM 2334 CA ASN C 52 5.063 -0.331 -8.842 1.00 0.00 C ATOM 2335 C ASN C 52 6.568 -0.574 -9.018 1.00 0.00 C ATOM 2336 O ASN C 52 7.175 -0.112 -9.985 1.00 0.00 O ATOM 2337 CB ASN C 52 4.783 1.131 -8.511 1.00 0.00 C ATOM 2338 CG ASN C 52 3.470 1.611 -9.106 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.518 0.844 -9.246 1.00 0.00 O ATOM 2340 ND2 ASN C 52 3.407 2.882 -9.462 1.00 0.00 N ATOM 0 H ASN C 52 4.721 -0.896 -6.851 1.00 0.00 H new ATOM 0 HA ASN C 52 4.610 -0.601 -9.796 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.758 1.259 -7.429 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.598 1.750 -8.886 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.549 3.256 -9.868 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.216 3.489 -9.331 1.00 0.00 H new ATOM 2347 N LYS C 53 7.158 -1.285 -8.081 1.00 0.00 N ATOM 2348 CA LYS C 53 8.541 -1.721 -8.164 1.00 0.00 C ATOM 2349 C LYS C 53 8.568 -3.224 -8.406 1.00 0.00 C ATOM 2350 O LYS C 53 8.904 -3.640 -9.531 1.00 0.00 O ATOM 2351 CB LYS C 53 9.270 -1.443 -6.853 1.00 0.00 C ATOM 2352 CG LYS C 53 10.309 -0.340 -6.896 1.00 0.00 C ATOM 2353 CD LYS C 53 11.327 -0.561 -5.777 1.00 0.00 C ATOM 2354 CE LYS C 53 10.934 0.114 -4.472 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.299 1.554 -4.447 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.221 -3.981 -7.477 1.00 0.00 O ATOM 0 H LYS C 53 6.686 -1.582 -7.227 1.00 0.00 H new ATOM 0 HA LYS C 53 9.030 -1.181 -8.975 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.530 -1.189 -6.094 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.757 -2.362 -6.528 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.811 -0.335 -7.864 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.829 0.632 -6.780 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.443 -1.631 -5.605 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.298 -0.183 -6.097 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.859 0.012 -4.323 1.00 0.00 H new ATOM 0 HE3 LYS C 53 11.421 -0.396 -3.641 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.201 1.920 -3.479 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.283 1.668 -4.762 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 10.668 2.083 -5.083 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -20.569 -3.624 -2.582 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 13.685 -15.948 -3.017 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.946 19.926 -2.702 1.00 0.00 ZN