USER MOD reduce.3.24.130724 H: found=0, std=0, add=1186, rem=0, adj=34 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 32 LYS NZ :NH3+ 166:sc= 0.57 (180deg=1.14) USER MOD Set 1.2: C 50 HIS : no HD1:sc= -4.49! C(o=-3.9!,f=-4.3!) USER MOD Set 2.1: B 1 FME CE :methyl -156:sc= -1.38 (180deg=-0.269) USER MOD Set 2.2: C 42 THR OG1 : rot -115:sc= -0.46 USER MOD Set 3.1: A 1 FME CE :methyl -151:sc= -1.55 (180deg=-0.333) USER MOD Set 3.2: B 42 THR OG1 : rot 59:sc= -0.497 USER MOD Set 4.1: A 50 HIS : no HD1:sc= -4.34! C(o=-3.8!,f=-4.2!) USER MOD Set 4.2: C 32 LYS NZ :NH3+ 172:sc= 0.507 (180deg=1.22) USER MOD Set 5.1: A 42 THR OG1 : rot 59:sc= -0.626 USER MOD Set 5.2: C 1 FME CE :methyl -151:sc= -1.67 (180deg=-0.262) USER MOD Set 6.1: A 32 LYS NZ :NH3+ 171:sc= 0.443 (180deg=1.18) USER MOD Set 6.2: B 50 HIS : no HD1:sc= -4.47! C(o=-4!,f=-4.4!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00248 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 84:sc= 0.0311 USER MOD Single : A 30 SER OG : rot -61:sc= 0.198 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0602 USER MOD Single : A 39 GLN : amide:sc= -0.0031 X(o=-0.0031,f=-0.5) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.06 K(o=-0.06,f=-0.6) USER MOD Single : A 49 LYS NZ :NH3+ -157:sc= 1.16 (180deg=0.711) USER MOD Single : A 52 ASN : amide:sc= -2.34! C(o=-2.3!,f=-3.3!) USER MOD Single : A 53 LYS NZ :NH3+ -159:sc= 0.966 (180deg=0.287) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.00214 USER MOD Single : B 14 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0406) USER MOD Single : B 15 CYS SG : rot -141:sc= -3.7! USER MOD Single : B 24 THR OG1 : rot 84:sc= 0.241 USER MOD Single : B 30 SER OG : rot -59:sc= 0.111 USER MOD Single : B 37 THR OG1 : rot 180:sc= -0.0993 USER MOD Single : B 39 GLN :FLIP amide:sc= -0.692 F(o=-1.6!,f=-0.69) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.0415 K(o=-0.041,f=-0.69) USER MOD Single : B 49 LYS NZ :NH3+ -154:sc= 1.17 (180deg=0.436) USER MOD Single : B 52 ASN : amide:sc= -2.43! C(o=-2.4!,f=-3.4!) USER MOD Single : B 53 LYS NZ :NH3+ -149:sc= 1.16 (180deg=0.459) USER MOD Single : C 5 THR OG1 : rot 180:sc=0.000966 USER MOD Single : C 14 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00783) USER MOD Single : C 24 THR OG1 : rot 83:sc= 0.0907 USER MOD Single : C 30 SER OG : rot -60:sc= 0.316 USER MOD Single : C 37 THR OG1 : rot 180:sc= -0.0875 USER MOD Single : C 39 GLN : amide:sc= -0.0147 X(o=-0.015,f=-0.5) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 48 GLN : amide:sc= -0.0845 K(o=-0.084,f=-0.62) USER MOD Single : C 49 LYS NZ :NH3+ -154:sc= 1.12 (180deg=0.471) USER MOD Single : C 52 ASN : amide:sc= -2.45! C(o=-2.4!,f=-3!) USER MOD Single : C 53 LYS NZ :NH3+ -163:sc= 1.05 (180deg=0.479) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 1.499 -11.764 14.296 1.00 0.00 N HETATM 2 CN FME A 1 2.518 -10.939 14.489 1.00 0.00 C HETATM 3 O1 FME A 1 3.497 -11.257 15.163 1.00 0.00 O HETATM 4 CA FME A 1 0.353 -11.383 13.482 1.00 0.00 C HETATM 5 CB FME A 1 -0.366 -12.627 12.969 1.00 0.00 C HETATM 6 CG FME A 1 -1.384 -12.334 11.882 1.00 0.00 C HETATM 7 SD FME A 1 -0.620 -11.622 10.414 1.00 0.00 S HETATM 8 CE FME A 1 -1.918 -11.870 9.208 1.00 0.00 C HETATM 9 C FME A 1 -0.609 -10.522 14.292 1.00 0.00 C HETATM 10 O FME A 1 -1.295 -11.014 15.188 1.00 0.00 O HETATM 0 HG3 FME A 1 -1.900 -13.255 11.611 1.00 0.00 H new HETATM 0 HG2 FME A 1 -2.138 -11.648 12.267 1.00 0.00 H new HETATM 0 HE3 FME A 1 -1.478 -11.980 8.217 1.00 0.00 H new HETATM 0 HE2 FME A 1 -2.479 -12.770 9.458 1.00 0.00 H new HETATM 0 HE1 FME A 1 -2.589 -11.011 9.214 1.00 0.00 H new HETATM 0 HCN FME A 1 2.488 -9.948 14.037 1.00 0.00 H new HETATM 0 HB3 FME A 1 0.372 -13.331 12.584 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.868 -13.117 13.803 1.00 0.00 H new HETATM 0 HA FME A 1 0.710 -10.804 12.630 1.00 0.00 H new HETATM 0 H FME A 1 1.518 -12.688 14.728 1.00 0.00 H new ATOM 21 N VAL A 2 -0.649 -9.237 13.978 1.00 0.00 N ATOM 22 CA VAL A 2 -1.477 -8.297 14.723 1.00 0.00 C ATOM 23 C VAL A 2 -2.640 -7.779 13.873 1.00 0.00 C ATOM 24 O VAL A 2 -3.682 -7.384 14.400 1.00 0.00 O ATOM 25 CB VAL A 2 -0.628 -7.111 15.236 1.00 0.00 C ATOM 26 CG1 VAL A 2 -0.037 -6.329 14.073 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.444 -6.200 16.145 1.00 0.00 C ATOM 0 H VAL A 2 -0.119 -8.819 13.213 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.892 -8.832 15.577 1.00 0.00 H new ATOM 0 HB VAL A 2 0.193 -7.518 15.826 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.556 -5.499 14.457 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.599 -6.985 13.479 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.842 -5.941 13.449 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.819 -5.376 16.489 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.296 -5.804 15.593 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.801 -6.768 17.004 1.00 0.00 H new ATOM 37 N ILE A 3 -2.473 -7.803 12.558 1.00 0.00 N ATOM 38 CA ILE A 3 -3.476 -7.242 11.668 1.00 0.00 C ATOM 39 C ILE A 3 -3.955 -8.278 10.660 1.00 0.00 C ATOM 40 O ILE A 3 -3.169 -9.074 10.152 1.00 0.00 O ATOM 41 CB ILE A 3 -2.941 -5.990 10.923 1.00 0.00 C ATOM 42 CG1 ILE A 3 -4.074 -5.290 10.167 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.808 -6.361 9.966 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.660 -3.983 9.526 1.00 0.00 C ATOM 0 H ILE A 3 -1.660 -8.201 12.088 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.319 -6.938 12.288 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.541 -5.301 11.667 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.452 -5.960 9.395 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.897 -5.102 10.856 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.453 -5.465 9.458 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.988 -6.808 10.528 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.174 -7.075 9.228 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.514 -3.545 9.009 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.310 -3.295 10.296 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.858 -4.166 8.811 1.00 0.00 H new ATOM 56 N ALA A 4 -5.254 -8.289 10.415 1.00 0.00 N ATOM 57 CA ALA A 4 -5.827 -9.117 9.373 1.00 0.00 C ATOM 58 C ALA A 4 -6.559 -8.238 8.371 1.00 0.00 C ATOM 59 O ALA A 4 -6.913 -7.096 8.676 1.00 0.00 O ATOM 60 CB ALA A 4 -6.764 -10.153 9.976 1.00 0.00 C ATOM 0 H ALA A 4 -5.934 -7.729 10.929 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.030 -9.649 8.854 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.187 -10.768 9.181 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.209 -10.786 10.668 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.568 -9.648 10.511 1.00 0.00 H new ATOM 66 N THR A 5 -6.789 -8.768 7.177 1.00 0.00 N ATOM 67 CA THR A 5 -7.425 -8.012 6.106 1.00 0.00 C ATOM 68 C THR A 5 -8.877 -7.687 6.460 1.00 0.00 C ATOM 69 O THR A 5 -9.510 -6.839 5.831 1.00 0.00 O ATOM 70 CB THR A 5 -7.374 -8.800 4.781 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.087 -9.417 4.634 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.629 -7.884 3.590 1.00 0.00 C ATOM 0 H THR A 5 -6.543 -9.725 6.925 1.00 0.00 H new ATOM 0 HA THR A 5 -6.877 -7.078 5.983 1.00 0.00 H new ATOM 0 HB THR A 5 -8.153 -9.562 4.809 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.059 -9.918 3.792 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.587 -8.465 2.669 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.614 -7.427 3.687 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.868 -7.104 3.562 1.00 0.00 H new ATOM 80 N ASP A 6 -9.385 -8.346 7.495 1.00 0.00 N ATOM 81 CA ASP A 6 -10.758 -8.141 7.940 1.00 0.00 C ATOM 82 C ASP A 6 -10.858 -6.931 8.860 1.00 0.00 C ATOM 83 O ASP A 6 -11.951 -6.555 9.285 1.00 0.00 O ATOM 84 CB ASP A 6 -11.287 -9.384 8.664 1.00 0.00 C ATOM 85 CG ASP A 6 -11.531 -10.554 7.732 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.592 -11.352 7.514 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.665 -10.692 7.224 1.00 0.00 O ATOM 0 H ASP A 6 -8.864 -9.030 8.044 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.368 -7.960 7.055 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.573 -9.681 9.432 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.217 -9.132 9.173 1.00 0.00 H new ATOM 92 N ASP A 7 -9.715 -6.323 9.176 1.00 0.00 N ATOM 93 CA ASP A 7 -9.704 -5.115 9.999 1.00 0.00 C ATOM 94 C ASP A 7 -9.513 -3.877 9.133 1.00 0.00 C ATOM 95 O ASP A 7 -9.607 -2.750 9.616 1.00 0.00 O ATOM 96 CB ASP A 7 -8.566 -5.169 11.029 1.00 0.00 C ATOM 97 CG ASP A 7 -8.674 -6.330 11.999 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.396 -6.202 13.007 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.003 -7.363 11.779 1.00 0.00 O ATOM 0 H ASP A 7 -8.794 -6.643 8.878 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.663 -5.061 10.514 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.614 -5.235 10.502 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -8.554 -4.236 11.593 1.00 0.00 H new ATOM 104 N LEU A 8 -9.242 -4.090 7.852 1.00 0.00 N ATOM 105 CA LEU A 8 -9.087 -2.985 6.912 1.00 0.00 C ATOM 106 C LEU A 8 -10.194 -3.015 5.869 1.00 0.00 C ATOM 107 O LEU A 8 -10.509 -1.999 5.243 1.00 0.00 O ATOM 108 CB LEU A 8 -7.722 -3.052 6.226 1.00 0.00 C ATOM 109 CG LEU A 8 -6.519 -2.863 7.148 1.00 0.00 C ATOM 110 CD1 LEU A 8 -5.225 -3.019 6.367 1.00 0.00 C ATOM 111 CD2 LEU A 8 -6.568 -1.502 7.821 1.00 0.00 C ATOM 0 H LEU A 8 -9.125 -5.016 7.440 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.154 -2.051 7.470 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.630 -4.018 5.729 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.687 -2.289 5.448 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.555 -3.630 7.921 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.377 -2.882 7.037 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.183 -4.016 5.928 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.186 -2.272 5.575 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.702 -1.387 8.473 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.556 -0.720 7.062 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.481 -1.421 8.411 1.00 0.00 H new ATOM 123 N GLU A 9 -10.801 -4.183 5.725 1.00 0.00 N ATOM 124 CA GLU A 9 -11.876 -4.387 4.773 1.00 0.00 C ATOM 125 C GLU A 9 -12.871 -5.386 5.337 1.00 0.00 C ATOM 126 O GLU A 9 -12.495 -6.343 6.014 1.00 0.00 O ATOM 127 CB GLU A 9 -11.354 -4.853 3.403 1.00 0.00 C ATOM 128 CG GLU A 9 -10.661 -3.749 2.617 1.00 0.00 C ATOM 129 CD GLU A 9 -10.432 -4.093 1.156 1.00 0.00 C ATOM 130 OE1 GLU A 9 -11.346 -3.863 0.331 1.00 0.00 O ATOM 131 OE2 GLU A 9 -9.323 -4.553 0.816 1.00 0.00 O ATOM 0 H GLU A 9 -10.561 -5.014 6.265 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.372 -3.430 4.613 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.657 -5.678 3.549 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.187 -5.239 2.816 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -11.260 -2.841 2.678 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.701 -3.530 3.084 1.00 0.00 H new ATOM 138 N VAL A 10 -14.131 -5.151 5.049 1.00 0.00 N ATOM 139 CA VAL A 10 -15.223 -5.926 5.605 1.00 0.00 C ATOM 140 C VAL A 10 -16.179 -6.310 4.485 1.00 0.00 C ATOM 141 O VAL A 10 -16.312 -5.579 3.504 1.00 0.00 O ATOM 142 CB VAL A 10 -15.962 -5.115 6.701 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.439 -3.776 6.159 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.126 -5.902 7.287 1.00 0.00 C ATOM 0 H VAL A 10 -14.432 -4.410 4.416 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.828 -6.830 6.068 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.250 -4.926 7.504 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.954 -3.227 6.947 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.582 -3.197 5.814 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.123 -3.943 5.327 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.621 -5.304 8.052 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.837 -6.142 6.497 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.754 -6.825 7.733 1.00 0.00 H new ATOM 154 N ALA A 11 -16.829 -7.457 4.614 1.00 0.00 N ATOM 155 CA ALA A 11 -17.710 -7.950 3.570 1.00 0.00 C ATOM 156 C ALA A 11 -18.892 -7.011 3.359 1.00 0.00 C ATOM 157 O ALA A 11 -19.554 -6.595 4.312 1.00 0.00 O ATOM 158 CB ALA A 11 -18.184 -9.349 3.932 1.00 0.00 C ATOM 0 H ALA A 11 -16.762 -8.063 5.432 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.159 -7.991 2.631 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.846 -9.723 3.151 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.324 -10.012 4.026 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.723 -9.317 4.879 1.00 0.00 H new ATOM 164 N CYS A 12 -19.135 -6.675 2.093 1.00 0.00 N ATOM 165 CA CYS A 12 -20.071 -5.632 1.704 1.00 0.00 C ATOM 166 C CYS A 12 -21.535 -5.977 2.009 1.00 0.00 C ATOM 167 O CYS A 12 -21.863 -7.147 2.141 1.00 0.00 O ATOM 168 CB CYS A 12 -19.865 -5.357 0.210 1.00 0.00 C ATOM 169 SG CYS A 12 -21.186 -4.429 -0.597 1.00 0.00 S ATOM 0 H CYS A 12 -18.679 -7.128 1.301 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.865 -4.741 2.298 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.931 -4.810 0.084 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -19.748 -6.311 -0.305 1.00 0.00 H new ATOM 174 N PRO A 13 -22.426 -4.963 2.145 1.00 0.00 N ATOM 175 CA PRO A 13 -23.857 -5.164 2.408 1.00 0.00 C ATOM 176 C PRO A 13 -24.483 -6.376 1.708 1.00 0.00 C ATOM 177 O PRO A 13 -25.331 -7.069 2.276 1.00 0.00 O ATOM 178 CB PRO A 13 -24.463 -3.893 1.827 1.00 0.00 C ATOM 179 CG PRO A 13 -23.453 -2.828 2.070 1.00 0.00 C ATOM 180 CD PRO A 13 -22.104 -3.517 2.094 1.00 0.00 C ATOM 0 HA PRO A 13 -24.032 -5.352 3.467 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.667 -4.006 0.762 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.411 -3.653 2.309 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.489 -2.072 1.286 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.646 -2.318 3.014 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.518 -3.272 1.208 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.517 -3.210 2.960 1.00 0.00 H new ATOM 188 N LYS A 14 -24.060 -6.637 0.476 1.00 0.00 N ATOM 189 CA LYS A 14 -24.771 -7.590 -0.359 1.00 0.00 C ATOM 190 C LYS A 14 -23.869 -8.432 -1.266 1.00 0.00 C ATOM 191 O LYS A 14 -24.226 -9.563 -1.587 1.00 0.00 O ATOM 192 CB LYS A 14 -25.793 -6.845 -1.220 1.00 0.00 C ATOM 193 CG LYS A 14 -26.524 -7.741 -2.208 1.00 0.00 C ATOM 194 CD LYS A 14 -27.304 -6.933 -3.234 1.00 0.00 C ATOM 195 CE LYS A 14 -27.877 -7.823 -4.326 1.00 0.00 C ATOM 196 NZ LYS A 14 -28.965 -8.712 -3.829 1.00 0.00 N ATOM 0 H LYS A 14 -23.242 -6.209 0.042 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.254 -8.288 0.324 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.523 -6.365 -0.569 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.285 -6.052 -1.768 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.805 -8.380 -2.720 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.206 -8.397 -1.668 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.113 -6.397 -2.738 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -26.651 -6.182 -3.680 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.262 -7.200 -5.133 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.079 -8.433 -4.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.320 -9.297 -4.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.594 -9.328 -3.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.741 -8.132 -3.450 1.00 0.00 H new ATOM 210 N CYS A 15 -22.726 -7.920 -1.708 1.00 0.00 N ATOM 211 CA CYS A 15 -22.036 -8.590 -2.813 1.00 0.00 C ATOM 212 C CYS A 15 -20.646 -9.121 -2.470 1.00 0.00 C ATOM 213 O CYS A 15 -19.720 -9.066 -3.286 1.00 0.00 O ATOM 214 CB CYS A 15 -21.931 -7.575 -3.945 1.00 0.00 C ATOM 215 SG CYS A 15 -21.029 -6.063 -3.491 1.00 0.00 S ATOM 0 H CYS A 15 -22.271 -7.083 -1.342 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.615 -9.474 -3.082 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.434 -8.042 -4.795 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.935 -7.304 -4.272 1.00 0.00 H new ATOM 220 N GLU A 16 -20.548 -9.747 -1.320 1.00 0.00 N ATOM 221 CA GLU A 16 -19.291 -10.273 -0.818 1.00 0.00 C ATOM 222 C GLU A 16 -19.105 -11.707 -1.265 1.00 0.00 C ATOM 223 O GLU A 16 -18.398 -12.478 -0.620 1.00 0.00 O ATOM 224 CB GLU A 16 -19.294 -10.264 0.712 1.00 0.00 C ATOM 225 CG GLU A 16 -20.492 -9.582 1.341 1.00 0.00 C ATOM 226 CD GLU A 16 -21.687 -10.512 1.406 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.382 -10.656 0.383 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.909 -11.135 2.462 1.00 0.00 O ATOM 0 H GLU A 16 -21.341 -9.909 -0.699 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.487 -9.647 -1.206 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.252 -11.294 1.067 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.387 -9.769 1.060 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.235 -9.246 2.346 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.751 -8.694 0.765 1.00 0.00 H new ATOM 235 N ARG A 17 -19.743 -12.078 -2.363 1.00 0.00 N ATOM 236 CA ARG A 17 -19.743 -13.461 -2.792 1.00 0.00 C ATOM 237 C ARG A 17 -19.768 -13.479 -4.323 1.00 0.00 C ATOM 238 O ARG A 17 -19.652 -14.525 -4.956 1.00 0.00 O ATOM 239 CB ARG A 17 -20.936 -14.241 -2.205 1.00 0.00 C ATOM 240 CG ARG A 17 -22.246 -14.116 -2.980 1.00 0.00 C ATOM 241 CD ARG A 17 -22.860 -12.724 -2.891 1.00 0.00 C ATOM 242 NE ARG A 17 -23.258 -12.365 -1.530 1.00 0.00 N ATOM 243 CZ ARG A 17 -24.447 -12.636 -0.996 1.00 0.00 C ATOM 244 NH1 ARG A 17 -25.319 -13.399 -1.642 1.00 0.00 N ATOM 245 NH2 ARG A 17 -24.747 -12.149 0.201 1.00 0.00 N ATOM 0 H ARG A 17 -20.264 -11.443 -2.968 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.845 -13.958 -2.425 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.666 -15.296 -2.149 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -21.104 -13.900 -1.183 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -22.067 -14.362 -4.027 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.959 -14.847 -2.598 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -22.142 -11.991 -3.260 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.731 -12.674 -3.544 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.578 -11.873 -0.950 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -25.081 -13.784 -2.556 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -26.227 -13.601 -1.225 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -24.070 -11.574 0.702 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -25.655 -12.350 0.620 1.00 0.00 H new ATOM 259 N ALA A 18 -19.943 -12.286 -4.905 1.00 0.00 N ATOM 260 CA ALA A 18 -20.148 -12.171 -6.349 1.00 0.00 C ATOM 261 C ALA A 18 -19.306 -11.072 -6.983 1.00 0.00 C ATOM 262 O ALA A 18 -18.763 -11.244 -8.074 1.00 0.00 O ATOM 263 CB ALA A 18 -21.620 -11.941 -6.653 1.00 0.00 C ATOM 0 H ALA A 18 -19.946 -11.398 -4.403 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.822 -13.113 -6.789 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.760 -11.857 -7.731 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.205 -12.780 -6.275 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.952 -11.021 -6.171 1.00 0.00 H new ATOM 269 N GLY A 19 -19.194 -9.943 -6.298 1.00 0.00 N ATOM 270 CA GLY A 19 -18.460 -8.821 -6.851 1.00 0.00 C ATOM 271 C GLY A 19 -19.344 -7.882 -7.652 1.00 0.00 C ATOM 272 O GLY A 19 -18.851 -7.021 -8.374 1.00 0.00 O ATOM 0 H GLY A 19 -19.596 -9.783 -5.374 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.987 -8.266 -6.041 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.660 -9.195 -7.490 1.00 0.00 H new ATOM 276 N GLU A 20 -20.651 -8.016 -7.478 1.00 0.00 N ATOM 277 CA GLU A 20 -21.614 -7.221 -8.234 1.00 0.00 C ATOM 278 C GLU A 20 -22.897 -7.055 -7.445 1.00 0.00 C ATOM 279 O GLU A 20 -23.167 -7.806 -6.513 1.00 0.00 O ATOM 280 CB GLU A 20 -21.956 -7.865 -9.583 1.00 0.00 C ATOM 281 CG GLU A 20 -22.303 -9.344 -9.483 1.00 0.00 C ATOM 282 CD GLU A 20 -22.989 -9.881 -10.724 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.229 -9.769 -10.819 1.00 0.00 O ATOM 284 OE2 GLU A 20 -22.295 -10.433 -11.605 1.00 0.00 O ATOM 0 H GLU A 20 -21.072 -8.670 -6.818 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.149 -6.252 -8.414 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.797 -7.333 -10.027 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.109 -7.744 -10.259 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.391 -9.913 -9.305 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.951 -9.501 -8.621 1.00 0.00 H new ATOM 291 N ILE A 21 -23.687 -6.086 -7.845 1.00 0.00 N ATOM 292 CA ILE A 21 -24.998 -5.872 -7.273 1.00 0.00 C ATOM 293 C ILE A 21 -25.930 -5.500 -8.406 1.00 0.00 C ATOM 294 O ILE A 21 -25.681 -4.532 -9.117 1.00 0.00 O ATOM 295 CB ILE A 21 -25.019 -4.783 -6.160 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.319 -5.307 -4.893 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.450 -4.358 -5.849 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.421 -4.391 -3.677 1.00 0.00 C ATOM 0 H ILE A 21 -23.439 -5.422 -8.578 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.317 -6.790 -6.779 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.478 -3.908 -6.519 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.744 -6.277 -4.636 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.265 -5.471 -5.119 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.442 -3.597 -5.069 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.912 -3.951 -6.748 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.020 -5.222 -5.507 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.898 -4.845 -2.835 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -23.968 -3.427 -3.909 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -25.470 -4.246 -3.418 1.00 0.00 H new ATOM 310 N GLU A 22 -26.979 -6.293 -8.578 1.00 0.00 N ATOM 311 CA GLU A 22 -27.896 -6.131 -9.700 1.00 0.00 C ATOM 312 C GLU A 22 -27.157 -6.241 -11.032 1.00 0.00 C ATOM 313 O GLU A 22 -27.390 -5.448 -11.943 1.00 0.00 O ATOM 314 CB GLU A 22 -28.560 -4.762 -9.597 1.00 0.00 C ATOM 315 CG GLU A 22 -29.943 -4.683 -10.214 1.00 0.00 C ATOM 316 CD GLU A 22 -30.714 -3.470 -9.743 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.228 -2.336 -9.936 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.815 -3.644 -9.182 1.00 0.00 O ATOM 0 H GLU A 22 -27.218 -7.061 -7.950 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.645 -6.922 -9.661 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.629 -4.485 -8.545 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -27.919 -4.024 -10.079 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -29.853 -4.654 -11.300 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.502 -5.585 -9.965 1.00 0.00 H new ATOM 325 N GLY A 23 -26.252 -7.212 -11.146 1.00 0.00 N ATOM 326 CA GLY A 23 -25.441 -7.339 -12.348 1.00 0.00 C ATOM 327 C GLY A 23 -24.635 -6.103 -12.641 1.00 0.00 C ATOM 328 O GLY A 23 -24.048 -5.958 -13.714 1.00 0.00 O ATOM 0 H GLY A 23 -26.066 -7.913 -10.428 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.767 -8.189 -12.238 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.090 -7.554 -13.197 1.00 0.00 H new ATOM 332 N THR A 24 -24.600 -5.226 -11.675 1.00 0.00 N ATOM 333 CA THR A 24 -24.062 -3.909 -11.848 1.00 0.00 C ATOM 334 C THR A 24 -22.864 -3.673 -10.920 1.00 0.00 C ATOM 335 O THR A 24 -22.817 -4.206 -9.805 1.00 0.00 O ATOM 336 CB THR A 24 -25.226 -2.956 -11.547 1.00 0.00 C ATOM 337 OG1 THR A 24 -25.993 -2.735 -12.734 1.00 0.00 O ATOM 338 CG2 THR A 24 -24.797 -1.628 -10.945 1.00 0.00 C ATOM 0 H THR A 24 -24.949 -5.411 -10.735 1.00 0.00 H new ATOM 0 HA THR A 24 -23.676 -3.752 -12.855 1.00 0.00 H new ATOM 0 HB THR A 24 -25.835 -3.447 -10.787 1.00 0.00 H new ATOM 0 HG1 THR A 24 -26.641 -3.462 -12.845 1.00 0.00 H new ATOM 0 HG21 THR A 24 -25.676 -1.011 -10.761 1.00 0.00 H new ATOM 0 HG22 THR A 24 -24.276 -1.806 -10.004 1.00 0.00 H new ATOM 0 HG23 THR A 24 -24.131 -1.113 -11.637 1.00 0.00 H new ATOM 346 N PRO A 25 -21.856 -2.904 -11.394 1.00 0.00 N ATOM 347 CA PRO A 25 -20.677 -2.551 -10.595 1.00 0.00 C ATOM 348 C PRO A 25 -21.080 -1.881 -9.289 1.00 0.00 C ATOM 349 O PRO A 25 -21.812 -0.891 -9.277 1.00 0.00 O ATOM 350 CB PRO A 25 -19.889 -1.587 -11.493 1.00 0.00 C ATOM 351 CG PRO A 25 -20.873 -1.135 -12.514 1.00 0.00 C ATOM 352 CD PRO A 25 -21.791 -2.303 -12.734 1.00 0.00 C ATOM 0 HA PRO A 25 -20.091 -3.424 -10.308 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.495 -0.746 -10.922 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.037 -2.084 -11.957 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -21.426 -0.262 -12.167 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -20.374 -0.849 -13.440 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -22.773 -1.988 -13.087 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -21.395 -2.999 -13.473 1.00 0.00 H new ATOM 360 N CYS A 26 -20.580 -2.433 -8.199 1.00 0.00 N ATOM 361 CA CYS A 26 -21.081 -2.118 -6.874 1.00 0.00 C ATOM 362 C CYS A 26 -20.486 -0.819 -6.308 1.00 0.00 C ATOM 363 O CYS A 26 -19.293 -0.564 -6.460 1.00 0.00 O ATOM 364 CB CYS A 26 -20.778 -3.284 -5.949 1.00 0.00 C ATOM 365 SG CYS A 26 -21.566 -3.149 -4.321 1.00 0.00 S ATOM 0 H CYS A 26 -19.817 -3.110 -8.207 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.156 -1.957 -6.948 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.105 -4.208 -6.425 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.699 -3.359 -5.815 1.00 0.00 H new ATOM 370 N PRO A 27 -21.338 -0.014 -5.616 1.00 0.00 N ATOM 371 CA PRO A 27 -21.007 1.298 -5.030 1.00 0.00 C ATOM 372 C PRO A 27 -19.556 1.487 -4.573 1.00 0.00 C ATOM 373 O PRO A 27 -18.853 2.379 -5.044 1.00 0.00 O ATOM 374 CB PRO A 27 -21.922 1.329 -3.807 1.00 0.00 C ATOM 375 CG PRO A 27 -23.141 0.551 -4.185 1.00 0.00 C ATOM 376 CD PRO A 27 -22.767 -0.312 -5.382 1.00 0.00 C ATOM 0 HA PRO A 27 -21.137 2.087 -5.771 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.430 0.887 -2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.180 2.353 -3.539 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.476 -0.068 -3.353 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.964 1.221 -4.435 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.924 -1.370 -5.174 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.373 -0.066 -6.254 1.00 0.00 H new ATOM 384 N ALA A 28 -19.114 0.626 -3.666 1.00 0.00 N ATOM 385 CA ALA A 28 -17.850 0.839 -2.964 1.00 0.00 C ATOM 386 C ALA A 28 -16.916 -0.351 -3.116 1.00 0.00 C ATOM 387 O ALA A 28 -15.790 -0.334 -2.631 1.00 0.00 O ATOM 388 CB ALA A 28 -18.102 1.124 -1.492 1.00 0.00 C ATOM 0 H ALA A 28 -19.608 -0.225 -3.398 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.364 1.704 -3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.151 1.280 -0.984 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.717 2.019 -1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.620 0.277 -1.041 1.00 0.00 H new ATOM 394 N CYS A 29 -17.400 -1.401 -3.750 1.00 0.00 N ATOM 395 CA CYS A 29 -16.563 -2.554 -4.030 1.00 0.00 C ATOM 396 C CYS A 29 -16.738 -2.963 -5.489 1.00 0.00 C ATOM 397 O CYS A 29 -17.682 -3.673 -5.838 1.00 0.00 O ATOM 398 CB CYS A 29 -16.897 -3.708 -3.055 1.00 0.00 C ATOM 399 SG CYS A 29 -18.427 -4.621 -3.405 1.00 0.00 S ATOM 0 H CYS A 29 -18.362 -1.481 -4.080 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.514 -2.300 -3.876 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.066 -4.414 -3.059 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.963 -3.299 -2.047 1.00 0.00 H new ATOM 404 N SER A 30 -15.851 -2.487 -6.352 1.00 0.00 N ATOM 405 CA SER A 30 -15.954 -2.745 -7.782 1.00 0.00 C ATOM 406 C SER A 30 -15.484 -4.159 -8.131 1.00 0.00 C ATOM 407 O SER A 30 -14.620 -4.347 -8.986 1.00 0.00 O ATOM 408 CB SER A 30 -15.129 -1.705 -8.554 1.00 0.00 C ATOM 409 OG SER A 30 -15.356 -1.790 -9.949 1.00 0.00 O ATOM 0 H SER A 30 -15.048 -1.917 -6.085 1.00 0.00 H new ATOM 0 HA SER A 30 -17.002 -2.665 -8.069 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.384 -0.705 -8.204 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.069 -1.855 -8.348 1.00 0.00 H new ATOM 0 HG SER A 30 -15.082 -2.674 -10.272 1.00 0.00 H new ATOM 415 N GLY A 31 -16.055 -5.149 -7.455 1.00 0.00 N ATOM 416 CA GLY A 31 -15.775 -6.528 -7.786 1.00 0.00 C ATOM 417 C GLY A 31 -14.694 -7.142 -6.924 1.00 0.00 C ATOM 418 O GLY A 31 -13.850 -7.885 -7.421 1.00 0.00 O ATOM 0 H GLY A 31 -16.708 -5.018 -6.682 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.689 -7.112 -7.682 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.475 -6.590 -8.832 1.00 0.00 H new ATOM 422 N LYS A 32 -14.720 -6.862 -5.624 1.00 0.00 N ATOM 423 CA LYS A 32 -13.751 -7.439 -4.702 1.00 0.00 C ATOM 424 C LYS A 32 -14.457 -8.424 -3.776 1.00 0.00 C ATOM 425 O LYS A 32 -13.953 -9.506 -3.490 1.00 0.00 O ATOM 426 CB LYS A 32 -13.118 -6.348 -3.838 1.00 0.00 C ATOM 427 CG LYS A 32 -12.441 -5.237 -4.622 1.00 0.00 C ATOM 428 CD LYS A 32 -11.850 -4.194 -3.685 1.00 0.00 C ATOM 429 CE LYS A 32 -12.924 -3.504 -2.862 1.00 0.00 C ATOM 430 NZ LYS A 32 -12.347 -2.600 -1.836 1.00 0.00 N ATOM 0 H LYS A 32 -15.401 -6.240 -5.187 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.979 -7.941 -5.285 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.890 -5.910 -3.205 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.384 -6.807 -3.175 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.654 -5.656 -5.249 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.163 -4.765 -5.289 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.131 -4.670 -3.019 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.303 -3.451 -4.266 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.575 -2.932 -3.523 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.545 -4.255 -2.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -13.107 -2.038 -1.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.873 -3.165 -1.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.657 -1.963 -2.283 1.00 0.00 H new ATOM 444 N GLY A 33 -15.634 -8.013 -3.296 1.00 0.00 N ATOM 445 CA GLY A 33 -16.367 -8.774 -2.322 1.00 0.00 C ATOM 446 C GLY A 33 -16.493 -7.984 -1.036 1.00 0.00 C ATOM 447 O GLY A 33 -17.552 -7.944 -0.415 1.00 0.00 O ATOM 0 H GLY A 33 -16.090 -7.146 -3.580 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.357 -9.017 -2.708 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.859 -9.719 -2.130 1.00 0.00 H new ATOM 451 N VAL A 34 -15.425 -7.280 -0.683 1.00 0.00 N ATOM 452 CA VAL A 34 -15.387 -6.518 0.557 1.00 0.00 C ATOM 453 C VAL A 34 -15.300 -5.010 0.304 1.00 0.00 C ATOM 454 O VAL A 34 -15.007 -4.565 -0.810 1.00 0.00 O ATOM 455 CB VAL A 34 -14.186 -6.950 1.428 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.335 -8.397 1.878 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.880 -6.765 0.671 1.00 0.00 C ATOM 0 H VAL A 34 -14.572 -7.221 -1.240 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.320 -6.728 1.080 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.167 -6.315 2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.478 -8.678 2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.249 -8.504 2.463 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.386 -9.046 1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.047 -7.075 1.302 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.895 -7.372 -0.234 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.761 -5.715 0.402 1.00 0.00 H new ATOM 467 N ILE A 35 -15.596 -4.245 1.345 1.00 0.00 N ATOM 468 CA ILE A 35 -15.460 -2.792 1.335 1.00 0.00 C ATOM 469 C ILE A 35 -14.550 -2.345 2.470 1.00 0.00 C ATOM 470 O ILE A 35 -14.340 -3.084 3.424 1.00 0.00 O ATOM 471 CB ILE A 35 -16.827 -2.092 1.488 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.602 -2.695 2.660 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.627 -2.192 0.199 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.891 -1.972 2.985 1.00 0.00 C ATOM 0 H ILE A 35 -15.941 -4.617 2.230 1.00 0.00 H new ATOM 0 HA ILE A 35 -15.030 -2.512 0.373 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.657 -1.036 1.697 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.829 -3.737 2.434 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.964 -2.693 3.544 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.587 -1.693 0.327 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -17.075 -1.714 -0.610 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.793 -3.241 -0.045 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.380 -2.461 3.827 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.672 -0.936 3.245 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.551 -1.997 2.118 1.00 0.00 H new ATOM 486 N LEU A 36 -14.022 -1.135 2.373 1.00 0.00 N ATOM 487 CA LEU A 36 -13.035 -0.662 3.336 1.00 0.00 C ATOM 488 C LEU A 36 -13.675 -0.004 4.543 1.00 0.00 C ATOM 489 O LEU A 36 -14.814 0.462 4.494 1.00 0.00 O ATOM 490 CB LEU A 36 -12.083 0.348 2.694 1.00 0.00 C ATOM 491 CG LEU A 36 -11.325 -0.152 1.474 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.989 0.331 0.196 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.881 0.297 1.543 1.00 0.00 C ATOM 0 H LEU A 36 -14.258 -0.464 1.642 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.488 -1.546 3.663 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.656 1.230 2.408 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.360 0.667 3.444 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.346 -1.242 1.467 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.432 -0.037 -0.665 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -13.012 -0.043 0.153 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.001 1.421 0.182 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.345 -0.065 0.666 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.839 1.386 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.417 -0.106 2.443 1.00 0.00 H new ATOM 505 N THR A 37 -12.909 0.031 5.618 1.00 0.00 N ATOM 506 CA THR A 37 -13.259 0.794 6.796 1.00 0.00 C ATOM 507 C THR A 37 -12.350 2.020 6.848 1.00 0.00 C ATOM 508 O THR A 37 -11.455 2.143 6.016 1.00 0.00 O ATOM 509 CB THR A 37 -13.109 -0.051 8.084 1.00 0.00 C ATOM 510 OG1 THR A 37 -13.484 0.716 9.233 1.00 0.00 O ATOM 511 CG2 THR A 37 -11.684 -0.562 8.243 1.00 0.00 C ATOM 0 H THR A 37 -12.025 -0.471 5.696 1.00 0.00 H new ATOM 0 HA THR A 37 -14.304 1.097 6.738 1.00 0.00 H new ATOM 0 HB THR A 37 -13.774 -0.910 7.998 1.00 0.00 H new ATOM 0 HG1 THR A 37 -13.385 0.167 10.039 1.00 0.00 H new ATOM 0 HG21 THR A 37 -11.609 -1.152 9.156 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.423 -1.184 7.387 1.00 0.00 H new ATOM 0 HG23 THR A 37 -10.998 0.284 8.300 1.00 0.00 H new ATOM 519 N ALA A 38 -12.563 2.907 7.809 1.00 0.00 N ATOM 520 CA ALA A 38 -11.837 4.175 7.867 1.00 0.00 C ATOM 521 C ALA A 38 -10.328 3.967 7.874 1.00 0.00 C ATOM 522 O ALA A 38 -9.605 4.628 7.126 1.00 0.00 O ATOM 523 CB ALA A 38 -12.275 4.976 9.081 1.00 0.00 C ATOM 0 H ALA A 38 -13.235 2.774 8.564 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.080 4.737 6.965 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.727 5.918 9.113 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.344 5.180 9.016 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.069 4.406 9.987 1.00 0.00 H new ATOM 529 N GLN A 39 -9.854 3.046 8.704 1.00 0.00 N ATOM 530 CA GLN A 39 -8.433 2.727 8.746 1.00 0.00 C ATOM 531 C GLN A 39 -7.944 2.278 7.369 1.00 0.00 C ATOM 532 O GLN A 39 -6.880 2.690 6.906 1.00 0.00 O ATOM 533 CB GLN A 39 -8.163 1.629 9.767 1.00 0.00 C ATOM 534 CG GLN A 39 -6.687 1.440 10.060 1.00 0.00 C ATOM 535 CD GLN A 39 -6.429 0.382 11.107 1.00 0.00 C ATOM 536 OE1 GLN A 39 -7.211 0.204 12.038 1.00 0.00 O ATOM 537 NE2 GLN A 39 -5.340 -0.346 10.939 1.00 0.00 N ATOM 0 H GLN A 39 -10.429 2.510 9.354 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.892 3.627 9.039 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.684 1.867 10.694 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.578 0.690 9.400 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.171 1.167 9.140 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.263 2.387 10.395 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.720 -0.161 10.150 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -5.119 -1.093 11.598 1.00 0.00 H new ATOM 546 N GLY A 40 -8.741 1.434 6.721 1.00 0.00 N ATOM 547 CA GLY A 40 -8.408 0.964 5.392 1.00 0.00 C ATOM 548 C GLY A 40 -8.488 2.073 4.363 1.00 0.00 C ATOM 549 O GLY A 40 -7.764 2.066 3.372 1.00 0.00 O ATOM 0 H GLY A 40 -9.615 1.067 7.096 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.402 0.545 5.397 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.087 0.159 5.111 1.00 0.00 H new ATOM 553 N TYR A 41 -9.357 3.040 4.612 1.00 0.00 N ATOM 554 CA TYR A 41 -9.497 4.187 3.729 1.00 0.00 C ATOM 555 C TYR A 41 -8.279 5.092 3.807 1.00 0.00 C ATOM 556 O TYR A 41 -7.873 5.683 2.805 1.00 0.00 O ATOM 557 CB TYR A 41 -10.758 4.972 4.098 1.00 0.00 C ATOM 558 CG TYR A 41 -11.981 4.595 3.292 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.232 5.189 2.062 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.881 3.646 3.754 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.345 4.848 1.318 1.00 0.00 C ATOM 562 CE2 TYR A 41 -13.995 3.297 3.016 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.221 3.900 1.799 1.00 0.00 C ATOM 564 OH TYR A 41 -15.326 3.551 1.055 1.00 0.00 O ATOM 0 H TYR A 41 -9.978 3.053 5.421 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.581 3.823 2.705 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.972 4.818 5.156 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.562 6.036 3.964 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.545 5.930 1.681 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.707 3.171 4.708 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.527 5.322 0.365 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.685 2.556 3.391 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.841 2.869 1.534 1.00 0.00 H new ATOM 574 N THR A 42 -7.675 5.174 4.977 1.00 0.00 N ATOM 575 CA THR A 42 -6.444 5.934 5.139 1.00 0.00 C ATOM 576 C THR A 42 -5.282 5.231 4.447 1.00 0.00 C ATOM 577 O THR A 42 -4.382 5.871 3.897 1.00 0.00 O ATOM 578 CB THR A 42 -6.112 6.128 6.626 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.179 6.830 7.255 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.812 6.896 6.811 1.00 0.00 C ATOM 0 H THR A 42 -8.013 4.726 5.829 1.00 0.00 H new ATOM 0 HA THR A 42 -6.595 6.911 4.680 1.00 0.00 H new ATOM 0 HB THR A 42 -5.987 5.146 7.082 1.00 0.00 H new ATOM 0 HG1 THR A 42 -8.011 6.324 7.148 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.608 7.015 7.875 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.995 6.346 6.344 1.00 0.00 H new ATOM 0 HG23 THR A 42 -4.900 7.878 6.346 1.00 0.00 H new ATOM 588 N LEU A 43 -5.336 3.908 4.423 1.00 0.00 N ATOM 589 CA LEU A 43 -4.263 3.125 3.843 1.00 0.00 C ATOM 590 C LEU A 43 -4.479 2.975 2.342 1.00 0.00 C ATOM 591 O LEU A 43 -3.550 2.640 1.616 1.00 0.00 O ATOM 592 CB LEU A 43 -4.170 1.741 4.511 1.00 0.00 C ATOM 593 CG LEU A 43 -3.121 1.584 5.637 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.208 2.732 6.631 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.333 0.260 6.357 1.00 0.00 C ATOM 0 H LEU A 43 -6.109 3.359 4.798 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.323 3.648 4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.149 1.494 4.921 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.953 1.004 3.738 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.129 1.600 5.185 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.459 2.595 7.411 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.026 3.675 6.115 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.201 2.750 7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.592 0.154 7.149 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.333 0.237 6.790 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.226 -0.561 5.648 1.00 0.00 H new ATOM 607 N LEU A 44 -5.691 3.258 1.858 1.00 0.00 N ATOM 608 CA LEU A 44 -5.962 3.146 0.434 1.00 0.00 C ATOM 609 C LEU A 44 -5.514 4.416 -0.284 1.00 0.00 C ATOM 610 O LEU A 44 -4.908 4.349 -1.345 1.00 0.00 O ATOM 611 CB LEU A 44 -7.458 2.825 0.163 1.00 0.00 C ATOM 612 CG LEU A 44 -8.429 4.008 -0.043 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.287 4.623 -1.432 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.866 3.553 0.144 1.00 0.00 C ATOM 0 H LEU A 44 -6.484 3.561 2.424 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.387 2.310 0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.508 2.194 -0.724 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.828 2.231 0.998 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.174 4.762 0.701 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.987 5.452 -1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.269 4.989 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.503 3.868 -2.188 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.538 4.399 -0.005 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.098 2.773 -0.582 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.995 3.160 1.153 1.00 0.00 H new ATOM 626 N ASP A 45 -5.780 5.570 0.316 1.00 0.00 N ATOM 627 CA ASP A 45 -5.451 6.848 -0.309 1.00 0.00 C ATOM 628 C ASP A 45 -3.949 7.059 -0.340 1.00 0.00 C ATOM 629 O ASP A 45 -3.418 7.743 -1.218 1.00 0.00 O ATOM 630 CB ASP A 45 -6.120 7.993 0.452 1.00 0.00 C ATOM 631 CG ASP A 45 -5.765 9.350 -0.116 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.468 9.809 -1.037 1.00 0.00 O ATOM 633 OD2 ASP A 45 -4.780 9.958 0.350 1.00 0.00 O ATOM 0 H ASP A 45 -6.221 5.649 1.232 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.821 6.834 -1.334 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.202 7.862 0.423 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.822 7.952 1.500 1.00 0.00 H new ATOM 638 N PHE A 46 -3.263 6.418 0.585 1.00 0.00 N ATOM 639 CA PHE A 46 -1.817 6.475 0.632 1.00 0.00 C ATOM 640 C PHE A 46 -1.231 5.616 -0.465 1.00 0.00 C ATOM 641 O PHE A 46 -0.283 6.014 -1.141 1.00 0.00 O ATOM 642 CB PHE A 46 -1.355 5.947 1.989 1.00 0.00 C ATOM 643 CG PHE A 46 0.119 6.052 2.241 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.667 7.224 2.731 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.954 4.971 2.005 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.021 7.318 2.979 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.308 5.061 2.253 1.00 0.00 C ATOM 648 CZ PHE A 46 2.841 6.236 2.740 1.00 0.00 C ATOM 0 H PHE A 46 -3.687 5.849 1.318 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.484 7.503 0.492 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.882 6.492 2.772 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.649 4.901 2.074 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.028 8.074 2.921 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.540 4.049 1.623 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.438 8.238 3.360 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.950 4.213 2.066 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.901 6.308 2.934 1.00 0.00 H new ATOM 658 N ILE A 47 -1.820 4.459 -0.680 1.00 0.00 N ATOM 659 CA ILE A 47 -1.290 3.554 -1.669 1.00 0.00 C ATOM 660 C ILE A 47 -1.725 3.971 -3.074 1.00 0.00 C ATOM 661 O ILE A 47 -1.032 3.709 -4.052 1.00 0.00 O ATOM 662 CB ILE A 47 -1.682 2.095 -1.375 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.202 1.933 -1.409 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.129 1.694 -0.017 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.687 0.550 -1.034 1.00 0.00 C ATOM 0 H ILE A 47 -2.652 4.129 -0.191 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.203 3.611 -1.619 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.259 1.444 -2.140 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.649 2.659 -0.730 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.559 2.172 -2.411 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.403 0.661 0.197 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.043 1.787 -0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.543 2.346 0.752 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.775 0.520 -1.083 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.272 -0.181 -1.728 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.363 0.313 -0.020 1.00 0.00 H new ATOM 677 N GLN A 48 -2.869 4.638 -3.160 1.00 0.00 N ATOM 678 CA GLN A 48 -3.254 5.339 -4.368 1.00 0.00 C ATOM 679 C GLN A 48 -2.157 6.318 -4.755 1.00 0.00 C ATOM 680 O GLN A 48 -1.493 6.154 -5.760 1.00 0.00 O ATOM 681 CB GLN A 48 -4.559 6.107 -4.138 1.00 0.00 C ATOM 682 CG GLN A 48 -5.786 5.223 -3.989 1.00 0.00 C ATOM 683 CD GLN A 48 -6.042 4.355 -5.205 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.727 4.732 -6.336 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.621 3.188 -4.980 1.00 0.00 N ATOM 0 H GLN A 48 -3.546 4.705 -2.400 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.402 4.614 -5.168 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.454 6.718 -3.241 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.717 6.790 -4.972 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.663 4.585 -3.114 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.659 5.850 -3.807 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.865 2.915 -4.028 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.823 2.561 -5.758 1.00 0.00 H new ATOM 694 N LYS A 49 -1.894 7.240 -3.855 1.00 0.00 N ATOM 695 CA LYS A 49 -1.094 8.429 -4.126 1.00 0.00 C ATOM 696 C LYS A 49 0.417 8.138 -4.124 1.00 0.00 C ATOM 697 O LYS A 49 1.237 9.040 -4.285 1.00 0.00 O ATOM 698 CB LYS A 49 -1.546 9.509 -3.115 1.00 0.00 C ATOM 699 CG LYS A 49 -0.580 10.646 -2.830 1.00 0.00 C ATOM 700 CD LYS A 49 -1.309 11.861 -2.257 1.00 0.00 C ATOM 701 CE LYS A 49 -2.283 11.492 -1.139 1.00 0.00 C ATOM 702 NZ LYS A 49 -1.614 11.295 0.176 1.00 0.00 N ATOM 0 H LYS A 49 -2.233 7.190 -2.894 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.264 8.797 -5.138 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.478 9.942 -3.478 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.771 9.013 -2.171 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.182 10.311 -2.127 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.065 10.928 -3.748 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.577 12.572 -1.875 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.854 12.363 -3.057 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.033 12.277 -1.044 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.811 10.578 -1.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.207 10.692 0.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.691 10.839 0.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.476 12.217 0.637 1.00 0.00 H new ATOM 716 N HIS A 50 0.812 6.877 -3.926 1.00 0.00 N ATOM 717 CA HIS A 50 2.199 6.530 -4.269 1.00 0.00 C ATOM 718 C HIS A 50 2.338 5.493 -5.387 1.00 0.00 C ATOM 719 O HIS A 50 3.459 5.170 -5.778 1.00 0.00 O ATOM 720 CB HIS A 50 2.935 6.043 -3.024 1.00 0.00 C ATOM 721 CG HIS A 50 2.882 7.041 -1.924 1.00 0.00 C ATOM 722 ND1 HIS A 50 3.287 8.339 -2.089 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.386 6.959 -0.673 1.00 0.00 C ATOM 724 CE1 HIS A 50 3.039 9.013 -0.993 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.488 8.205 -0.113 1.00 0.00 N ATOM 0 H HIS A 50 0.237 6.121 -3.555 1.00 0.00 H new ATOM 0 HA HIS A 50 2.646 7.447 -4.654 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.494 5.105 -2.685 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.975 5.834 -3.275 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.983 6.075 -0.200 1.00 0.00 H new ATOM 0 HE1 HIS A 50 3.252 10.060 -0.838 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.188 8.463 0.827 1.00 0.00 H new ATOM 734 N LEU A 51 1.237 4.974 -5.910 1.00 0.00 N ATOM 735 CA LEU A 51 1.321 4.062 -7.059 1.00 0.00 C ATOM 736 C LEU A 51 0.513 4.589 -8.238 1.00 0.00 C ATOM 737 O LEU A 51 1.008 4.685 -9.360 1.00 0.00 O ATOM 738 CB LEU A 51 0.813 2.650 -6.724 1.00 0.00 C ATOM 739 CG LEU A 51 1.687 1.790 -5.789 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.127 1.717 -6.279 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.634 2.305 -4.368 1.00 0.00 C ATOM 0 H LEU A 51 0.292 5.158 -5.573 1.00 0.00 H new ATOM 0 HA LEU A 51 2.378 4.006 -7.319 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.174 2.745 -6.271 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.684 2.107 -7.660 1.00 0.00 H new ATOM 0 HG LEU A 51 1.278 0.780 -5.803 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.713 1.103 -5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.150 1.275 -7.275 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.549 2.721 -6.318 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.259 1.680 -3.731 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.999 3.332 -4.339 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.605 2.275 -4.008 1.00 0.00 H new ATOM 753 N ASN A 52 -0.730 4.935 -7.961 1.00 0.00 N ATOM 754 CA ASN A 52 -1.710 5.227 -8.994 1.00 0.00 C ATOM 755 C ASN A 52 -2.127 6.697 -9.008 1.00 0.00 C ATOM 756 O ASN A 52 -2.672 7.184 -9.997 1.00 0.00 O ATOM 757 CB ASN A 52 -2.925 4.328 -8.786 1.00 0.00 C ATOM 758 CG ASN A 52 -2.944 3.158 -9.759 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.406 2.068 -9.432 1.00 0.00 O ATOM 760 ND2 ASN A 52 -2.468 3.380 -10.977 1.00 0.00 N ATOM 0 H ASN A 52 -1.091 5.022 -7.011 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.253 5.028 -9.963 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.924 3.949 -7.764 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.835 4.915 -8.908 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -2.479 2.634 -11.673 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -2.091 4.297 -11.218 1.00 0.00 H new ATOM 767 N LYS A 53 -1.877 7.394 -7.920 1.00 0.00 N ATOM 768 CA LYS A 53 -2.115 8.821 -7.846 1.00 0.00 C ATOM 769 C LYS A 53 -0.779 9.556 -7.808 1.00 0.00 C ATOM 770 O LYS A 53 -0.306 9.980 -8.885 1.00 0.00 O ATOM 771 CB LYS A 53 -2.937 9.162 -6.598 1.00 0.00 C ATOM 772 CG LYS A 53 -4.379 9.525 -6.885 1.00 0.00 C ATOM 773 CD LYS A 53 -4.991 10.283 -5.715 1.00 0.00 C ATOM 774 CE LYS A 53 -5.479 9.362 -4.613 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.263 10.111 -3.594 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.191 9.677 -6.720 1.00 0.00 O ATOM 0 H LYS A 53 -1.503 6.988 -7.062 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.677 9.134 -8.726 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.917 8.309 -5.919 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.461 9.994 -6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.432 10.135 -7.787 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.955 8.620 -7.078 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.251 10.972 -5.307 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.824 10.887 -6.074 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -6.096 8.572 -5.042 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.627 8.878 -4.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.280 9.572 -2.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.822 11.038 -3.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.236 10.247 -3.935 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 9.479 6.925 14.348 1.00 0.00 N HETATM 792 CN FME B 1 8.259 7.380 14.590 1.00 0.00 C HETATM 793 O1 FME B 1 8.056 8.328 15.350 1.00 0.00 O HETATM 794 CA FME B 1 9.704 5.789 13.465 1.00 0.00 C HETATM 795 CB FME B 1 11.131 5.820 12.928 1.00 0.00 C HETATM 796 CG FME B 1 11.388 4.803 11.834 1.00 0.00 C HETATM 797 SD FME B 1 10.379 5.107 10.375 1.00 0.00 S HETATM 798 CE FME B 1 11.255 4.129 9.159 1.00 0.00 C HETATM 799 C FME B 1 9.463 4.489 14.221 1.00 0.00 C HETATM 800 O FME B 1 10.281 4.079 15.044 1.00 0.00 O HETATM 0 HG3 FME B 1 12.442 4.828 11.557 1.00 0.00 H new HETATM 0 HG2 FME B 1 11.182 3.802 12.214 1.00 0.00 H new HETATM 0 HE3 FME B 1 11.049 4.518 8.162 1.00 0.00 H new HETATM 0 HE2 FME B 1 12.326 4.180 9.354 1.00 0.00 H new HETATM 0 HE1 FME B 1 10.924 3.092 9.219 1.00 0.00 H new HETATM 0 HCN FME B 1 7.410 6.902 14.102 1.00 0.00 H new HETATM 0 HB3 FME B 1 11.344 6.817 12.543 1.00 0.00 H new HETATM 0 HB2 FME B 1 11.824 5.640 13.750 1.00 0.00 H new HETATM 0 HA FME B 1 9.009 5.848 12.628 1.00 0.00 H new HETATM 0 H FME B 1 10.278 7.380 14.789 1.00 0.00 H new ATOM 811 N VAL B 2 8.338 3.851 13.953 1.00 0.00 N ATOM 812 CA VAL B 2 7.952 2.653 14.686 1.00 0.00 C ATOM 813 C VAL B 2 8.093 1.395 13.825 1.00 0.00 C ATOM 814 O VAL B 2 8.285 0.293 14.339 1.00 0.00 O ATOM 815 CB VAL B 2 6.500 2.781 15.206 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.526 2.928 14.046 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.123 1.600 16.090 1.00 0.00 C ATOM 0 H VAL B 2 7.674 4.140 13.234 1.00 0.00 H new ATOM 0 HA VAL B 2 8.628 2.556 15.535 1.00 0.00 H new ATOM 0 HB VAL B 2 6.440 3.681 15.818 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.511 3.017 14.432 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.775 3.821 13.473 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.594 2.052 13.401 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.097 1.720 16.439 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.206 0.676 15.518 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.795 1.558 16.947 1.00 0.00 H new ATOM 827 N ILE B 3 8.024 1.566 12.513 1.00 0.00 N ATOM 828 CA ILE B 3 8.041 0.428 11.609 1.00 0.00 C ATOM 829 C ILE B 3 9.173 0.547 10.597 1.00 0.00 C ATOM 830 O ILE B 3 9.468 1.635 10.108 1.00 0.00 O ATOM 831 CB ILE B 3 6.686 0.271 10.869 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.647 -1.047 10.090 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.430 1.455 9.936 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.305 -1.337 9.455 1.00 0.00 C ATOM 0 H ILE B 3 7.956 2.475 12.054 1.00 0.00 H new ATOM 0 HA ILE B 3 8.207 -0.461 12.217 1.00 0.00 H new ATOM 0 HB ILE B 3 5.893 0.254 11.617 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.410 -1.022 9.312 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.905 -1.865 10.763 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.474 1.320 9.430 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.406 2.377 10.517 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.227 1.514 9.195 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.353 -2.286 8.921 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.541 -1.395 10.230 1.00 0.00 H new ATOM 0 HD13 ILE B 3 5.053 -0.539 8.756 1.00 0.00 H new ATOM 846 N ALA B 4 9.831 -0.568 10.328 1.00 0.00 N ATOM 847 CA ALA B 4 10.824 -0.632 9.274 1.00 0.00 C ATOM 848 C ALA B 4 10.425 -1.697 8.266 1.00 0.00 C ATOM 849 O ALA B 4 9.632 -2.587 8.575 1.00 0.00 O ATOM 850 CB ALA B 4 12.198 -0.928 9.852 1.00 0.00 C ATOM 0 H ALA B 4 9.693 -1.445 10.830 1.00 0.00 H new ATOM 0 HA ALA B 4 10.873 0.333 8.770 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.930 -0.972 9.046 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.476 -0.140 10.552 1.00 0.00 H new ATOM 0 HB3 ALA B 4 12.175 -1.885 10.374 1.00 0.00 H new ATOM 856 N THR B 5 10.977 -1.603 7.062 1.00 0.00 N ATOM 857 CA THR B 5 10.642 -2.527 5.987 1.00 0.00 C ATOM 858 C THR B 5 11.067 -3.955 6.334 1.00 0.00 C ATOM 859 O THR B 5 10.604 -4.917 5.725 1.00 0.00 O ATOM 860 CB THR B 5 11.312 -2.090 4.670 1.00 0.00 C ATOM 861 OG1 THR B 5 11.225 -0.665 4.537 1.00 0.00 O ATOM 862 CG2 THR B 5 10.644 -2.749 3.471 1.00 0.00 C ATOM 0 H THR B 5 11.662 -0.892 6.806 1.00 0.00 H new ATOM 0 HA THR B 5 9.560 -2.509 5.860 1.00 0.00 H new ATOM 0 HB THR B 5 12.357 -2.400 4.699 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.653 -0.388 3.700 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.137 -2.423 2.555 1.00 0.00 H new ATOM 0 HG22 THR B 5 10.724 -3.832 3.560 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.592 -2.464 3.438 1.00 0.00 H new ATOM 870 N ASP B 6 11.911 -4.086 7.351 1.00 0.00 N ATOM 871 CA ASP B 6 12.421 -5.385 7.766 1.00 0.00 C ATOM 872 C ASP B 6 11.434 -6.086 8.692 1.00 0.00 C ATOM 873 O ASP B 6 11.650 -7.230 9.095 1.00 0.00 O ATOM 874 CB ASP B 6 13.775 -5.234 8.465 1.00 0.00 C ATOM 875 CG ASP B 6 14.879 -4.813 7.514 1.00 0.00 C ATOM 876 OD1 ASP B 6 15.072 -3.591 7.319 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.568 -5.699 6.965 1.00 0.00 O ATOM 0 H ASP B 6 12.257 -3.303 7.905 1.00 0.00 H new ATOM 0 HA ASP B 6 12.551 -5.994 6.872 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.687 -4.497 9.263 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.045 -6.180 8.933 1.00 0.00 H new ATOM 882 N ASP B 7 10.347 -5.397 9.035 1.00 0.00 N ATOM 883 CA ASP B 7 9.301 -5.996 9.858 1.00 0.00 C ATOM 884 C ASP B 7 8.116 -6.415 8.997 1.00 0.00 C ATOM 885 O ASP B 7 7.159 -7.013 9.485 1.00 0.00 O ATOM 886 CB ASP B 7 8.812 -5.002 10.924 1.00 0.00 C ATOM 887 CG ASP B 7 9.898 -4.550 11.883 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.361 -5.376 12.697 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.268 -3.352 11.854 1.00 0.00 O ATOM 0 H ASP B 7 10.169 -4.432 8.758 1.00 0.00 H new ATOM 0 HA ASP B 7 9.726 -6.873 10.346 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.392 -4.128 10.427 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.005 -5.463 11.494 1.00 0.00 H new ATOM 894 N LEU B 8 8.185 -6.096 7.711 1.00 0.00 N ATOM 895 CA LEU B 8 7.144 -6.492 6.766 1.00 0.00 C ATOM 896 C LEU B 8 7.717 -7.427 5.714 1.00 0.00 C ATOM 897 O LEU B 8 6.990 -8.198 5.081 1.00 0.00 O ATOM 898 CB LEU B 8 6.535 -5.265 6.091 1.00 0.00 C ATOM 899 CG LEU B 8 5.768 -4.325 7.018 1.00 0.00 C ATOM 900 CD1 LEU B 8 5.267 -3.115 6.247 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.607 -5.052 7.673 1.00 0.00 C ATOM 0 H LEU B 8 8.950 -5.564 7.296 1.00 0.00 H new ATOM 0 HA LEU B 8 6.361 -7.012 7.318 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.334 -4.702 5.609 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.861 -5.601 5.303 1.00 0.00 H new ATOM 0 HG LEU B 8 6.446 -3.983 7.800 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.722 -2.454 6.921 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.115 -2.579 5.820 1.00 0.00 H new ATOM 0 HD13 LEU B 8 4.604 -3.443 5.446 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.072 -4.366 8.330 1.00 0.00 H new ATOM 0 HD22 LEU B 8 3.928 -5.421 6.904 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.986 -5.892 8.256 1.00 0.00 H new ATOM 913 N GLU B 9 9.030 -7.373 5.568 1.00 0.00 N ATOM 914 CA GLU B 9 9.741 -8.192 4.609 1.00 0.00 C ATOM 915 C GLU B 9 11.101 -8.567 5.177 1.00 0.00 C ATOM 916 O GLU B 9 11.715 -7.797 5.912 1.00 0.00 O ATOM 917 CB GLU B 9 9.888 -7.495 3.245 1.00 0.00 C ATOM 918 CG GLU B 9 8.581 -7.424 2.464 1.00 0.00 C ATOM 919 CD GLU B 9 8.760 -7.050 1.006 1.00 0.00 C ATOM 920 OE1 GLU B 9 8.997 -7.956 0.173 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.616 -5.853 0.669 1.00 0.00 O ATOM 0 H GLU B 9 9.632 -6.757 6.114 1.00 0.00 H new ATOM 0 HA GLU B 9 9.157 -9.096 4.434 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.267 -6.485 3.399 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.631 -8.027 2.650 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.080 -8.390 2.523 1.00 0.00 H new ATOM 0 HG3 GLU B 9 7.924 -6.695 2.939 1.00 0.00 H new ATOM 928 N VAL B 10 11.545 -9.757 4.845 1.00 0.00 N ATOM 929 CA VAL B 10 12.771 -10.311 5.381 1.00 0.00 C ATOM 930 C VAL B 10 13.577 -10.927 4.245 1.00 0.00 C ATOM 931 O VAL B 10 13.007 -11.398 3.263 1.00 0.00 O ATOM 932 CB VAL B 10 12.458 -11.373 6.469 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.541 -12.459 5.925 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.735 -11.983 7.031 1.00 0.00 C ATOM 0 H VAL B 10 11.064 -10.374 4.191 1.00 0.00 H new ATOM 0 HA VAL B 10 13.354 -9.517 5.848 1.00 0.00 H new ATOM 0 HB VAL B 10 11.941 -10.865 7.283 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.338 -13.190 6.708 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.604 -12.012 5.594 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.024 -12.954 5.083 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.481 -12.723 7.790 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.293 -12.464 6.228 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.347 -11.199 7.478 1.00 0.00 H new ATOM 944 N ALA B 11 14.893 -10.916 4.368 1.00 0.00 N ATOM 945 CA ALA B 11 15.758 -11.417 3.312 1.00 0.00 C ATOM 946 C ALA B 11 15.531 -12.908 3.070 1.00 0.00 C ATOM 947 O ALA B 11 15.514 -13.712 4.004 1.00 0.00 O ATOM 948 CB ALA B 11 17.206 -11.134 3.684 1.00 0.00 C ATOM 0 H ALA B 11 15.387 -10.566 5.189 1.00 0.00 H new ATOM 0 HA ALA B 11 15.519 -10.906 2.380 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.863 -11.506 2.898 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.349 -10.059 3.798 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.445 -11.633 4.623 1.00 0.00 H new ATOM 954 N CYS B 12 15.348 -13.256 1.791 1.00 0.00 N ATOM 955 CA CYS B 12 14.907 -14.582 1.357 1.00 0.00 C ATOM 956 C CYS B 12 15.942 -15.674 1.666 1.00 0.00 C ATOM 957 O CYS B 12 17.116 -15.364 1.830 1.00 0.00 O ATOM 958 CB CYS B 12 14.633 -14.494 -0.159 1.00 0.00 C ATOM 959 SG CYS B 12 14.202 -16.044 -0.984 1.00 0.00 S ATOM 0 H CYS B 12 15.506 -12.611 1.017 1.00 0.00 H new ATOM 0 HA CYS B 12 14.008 -14.866 1.903 1.00 0.00 H new ATOM 0 HB2 CYS B 12 13.822 -13.783 -0.320 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.518 -14.083 -0.644 1.00 0.00 H new ATOM 964 N PRO B 13 15.524 -16.958 1.769 1.00 0.00 N ATOM 965 CA PRO B 13 16.429 -18.091 2.014 1.00 0.00 C ATOM 966 C PRO B 13 17.792 -17.992 1.311 1.00 0.00 C ATOM 967 O PRO B 13 18.825 -18.328 1.891 1.00 0.00 O ATOM 968 CB PRO B 13 15.641 -19.259 1.429 1.00 0.00 C ATOM 969 CG PRO B 13 14.212 -18.930 1.693 1.00 0.00 C ATOM 970 CD PRO B 13 14.118 -17.417 1.699 1.00 0.00 C ATOM 0 HA PRO B 13 16.686 -18.164 3.071 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.830 -19.367 0.361 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.923 -20.201 1.900 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.567 -19.357 0.925 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.888 -19.344 2.648 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.624 -17.047 0.801 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.541 -17.059 2.551 1.00 0.00 H new ATOM 978 N LYS B 14 17.794 -17.503 0.072 1.00 0.00 N ATOM 979 CA LYS B 14 18.979 -17.638 -0.772 1.00 0.00 C ATOM 980 C LYS B 14 19.264 -16.424 -1.668 1.00 0.00 C ATOM 981 O LYS B 14 20.415 -16.167 -1.990 1.00 0.00 O ATOM 982 CB LYS B 14 18.841 -18.891 -1.643 1.00 0.00 C ATOM 983 CG LYS B 14 19.988 -19.097 -2.622 1.00 0.00 C ATOM 984 CD LYS B 14 19.680 -20.206 -3.617 1.00 0.00 C ATOM 985 CE LYS B 14 20.762 -20.314 -4.680 1.00 0.00 C ATOM 986 NZ LYS B 14 22.061 -20.741 -4.104 1.00 0.00 N ATOM 0 H LYS B 14 17.007 -17.020 -0.362 1.00 0.00 H new ATOM 0 HA LYS B 14 19.827 -17.715 -0.091 1.00 0.00 H new ATOM 0 HB2 LYS B 14 18.769 -19.765 -0.995 1.00 0.00 H new ATOM 0 HB3 LYS B 14 17.907 -18.831 -2.202 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.181 -18.168 -3.159 1.00 0.00 H new ATOM 0 HG3 LYS B 14 20.897 -19.342 -2.073 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.590 -21.156 -3.089 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.718 -20.013 -4.093 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.451 -21.027 -5.444 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.883 -19.350 -5.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.750 -20.885 -4.870 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 22.412 -20.007 -3.456 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 21.933 -21.631 -3.582 1.00 0.00 H new ATOM 1000 N CYS B 15 18.250 -15.673 -2.099 1.00 0.00 N ATOM 1001 CA CYS B 15 18.507 -14.677 -3.148 1.00 0.00 C ATOM 1002 C CYS B 15 18.272 -13.236 -2.726 1.00 0.00 C ATOM 1003 O CYS B 15 17.731 -12.436 -3.497 1.00 0.00 O ATOM 1004 CB CYS B 15 17.587 -14.958 -4.317 1.00 0.00 C ATOM 1005 SG CYS B 15 15.846 -15.040 -3.839 1.00 0.00 S ATOM 0 H CYS B 15 17.289 -15.725 -1.761 1.00 0.00 H new ATOM 0 HA CYS B 15 19.564 -14.772 -3.396 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.716 -14.180 -5.069 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.876 -15.901 -4.781 1.00 0.00 H new ATOM 0 HG CYS B 15 15.260 -15.996 -4.497 1.00 0.00 H new ATOM 1010 N GLU B 16 18.769 -12.870 -1.570 1.00 0.00 N ATOM 1011 CA GLU B 16 18.574 -11.535 -1.040 1.00 0.00 C ATOM 1012 C GLU B 16 19.699 -10.632 -1.488 1.00 0.00 C ATOM 1013 O GLU B 16 19.993 -9.625 -0.848 1.00 0.00 O ATOM 1014 CB GLU B 16 18.566 -11.573 0.490 1.00 0.00 C ATOM 1015 CG GLU B 16 18.586 -12.965 1.094 1.00 0.00 C ATOM 1016 CD GLU B 16 19.984 -13.548 1.119 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.415 -14.097 0.091 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.667 -13.435 2.157 1.00 0.00 O ATOM 0 H GLU B 16 19.319 -13.484 -0.969 1.00 0.00 H new ATOM 0 HA GLU B 16 17.621 -11.155 -1.408 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.431 -11.021 0.857 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.679 -11.050 0.847 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.190 -12.926 2.109 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.930 -13.619 0.520 1.00 0.00 H new ATOM 1025 N ARG B 17 20.323 -10.977 -2.604 1.00 0.00 N ATOM 1026 CA ARG B 17 21.518 -10.293 -3.038 1.00 0.00 C ATOM 1027 C ARG B 17 21.511 -10.273 -4.568 1.00 0.00 C ATOM 1028 O ARG B 17 22.264 -9.535 -5.201 1.00 0.00 O ATOM 1029 CB ARG B 17 22.795 -10.970 -2.500 1.00 0.00 C ATOM 1030 CG ARG B 17 23.292 -12.167 -3.309 1.00 0.00 C ATOM 1031 CD ARG B 17 22.379 -13.380 -3.195 1.00 0.00 C ATOM 1032 NE ARG B 17 22.320 -13.915 -1.836 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.168 -14.816 -1.345 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.201 -15.237 -2.068 1.00 0.00 N ATOM 1035 NH2 ARG B 17 22.972 -15.298 -0.125 1.00 0.00 N ATOM 0 H ARG B 17 20.016 -11.728 -3.222 1.00 0.00 H new ATOM 0 HA ARG B 17 21.523 -9.277 -2.642 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.590 -10.226 -2.458 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.609 -11.296 -1.477 1.00 0.00 H new ATOM 0 HG2 ARG B 17 23.378 -11.880 -4.357 1.00 0.00 H new ATOM 0 HG3 ARG B 17 24.292 -12.438 -2.970 1.00 0.00 H new ATOM 0 HD2 ARG B 17 21.375 -13.105 -3.517 1.00 0.00 H new ATOM 0 HD3 ARG B 17 22.729 -14.158 -3.873 1.00 0.00 H new ATOM 0 HE ARG B 17 21.579 -13.575 -1.223 1.00 0.00 H new ATOM 0 HH11 ARG B 17 24.349 -14.869 -3.008 1.00 0.00 H new ATOM 0 HH12 ARG B 17 24.845 -15.928 -1.683 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.177 -14.978 0.428 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.616 -15.989 0.260 1.00 0.00 H new ATOM 1049 N ALA B 18 20.632 -11.109 -5.150 1.00 0.00 N ATOM 1050 CA ALA B 18 20.636 -11.321 -6.596 1.00 0.00 C ATOM 1051 C ALA B 18 19.270 -11.100 -7.240 1.00 0.00 C ATOM 1052 O ALA B 18 19.173 -10.501 -8.307 1.00 0.00 O ATOM 1053 CB ALA B 18 21.141 -12.720 -6.917 1.00 0.00 C ATOM 0 H ALA B 18 19.922 -11.639 -4.644 1.00 0.00 H new ATOM 0 HA ALA B 18 21.307 -10.574 -7.019 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.140 -12.868 -7.997 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.155 -12.837 -6.535 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.490 -13.458 -6.449 1.00 0.00 H new ATOM 1059 N GLY B 19 18.216 -11.578 -6.590 1.00 0.00 N ATOM 1060 CA GLY B 19 16.889 -11.476 -7.174 1.00 0.00 C ATOM 1061 C GLY B 19 16.514 -12.700 -7.994 1.00 0.00 C ATOM 1062 O GLY B 19 15.531 -12.684 -8.727 1.00 0.00 O ATOM 0 H GLY B 19 18.253 -12.031 -5.677 1.00 0.00 H new ATOM 0 HA2 GLY B 19 16.156 -11.338 -6.379 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.842 -10.591 -7.808 1.00 0.00 H new ATOM 1066 N GLU B 20 17.266 -13.778 -7.815 1.00 0.00 N ATOM 1067 CA GLU B 20 17.046 -15.013 -8.565 1.00 0.00 C ATOM 1068 C GLU B 20 17.542 -16.202 -7.773 1.00 0.00 C ATOM 1069 O GLU B 20 18.294 -16.055 -6.815 1.00 0.00 O ATOM 1070 CB GLU B 20 17.760 -15.011 -9.920 1.00 0.00 C ATOM 1071 CG GLU B 20 19.197 -14.523 -9.853 1.00 0.00 C ATOM 1072 CD GLU B 20 19.986 -14.862 -11.100 1.00 0.00 C ATOM 1073 OE1 GLU B 20 19.827 -14.168 -12.117 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.790 -15.819 -11.057 1.00 0.00 O ATOM 0 H GLU B 20 18.040 -13.824 -7.152 1.00 0.00 H new ATOM 0 HA GLU B 20 15.972 -15.081 -8.738 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.748 -16.021 -10.329 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.203 -14.380 -10.613 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.204 -13.443 -9.706 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.687 -14.966 -8.986 1.00 0.00 H new ATOM 1081 N ILE B 21 17.125 -17.375 -8.194 1.00 0.00 N ATOM 1082 CA ILE B 21 17.602 -18.618 -7.628 1.00 0.00 C ATOM 1083 C ILE B 21 17.710 -19.620 -8.755 1.00 0.00 C ATOM 1084 O ILE B 21 16.723 -19.893 -9.433 1.00 0.00 O ATOM 1085 CB ILE B 21 16.692 -19.154 -6.488 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.849 -18.258 -5.248 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.023 -20.609 -6.164 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.126 -18.740 -4.003 1.00 0.00 C ATOM 0 H ILE B 21 16.442 -17.495 -8.942 1.00 0.00 H new ATOM 0 HA ILE B 21 18.573 -18.447 -7.164 1.00 0.00 H new ATOM 0 HB ILE B 21 15.653 -19.125 -6.815 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.911 -18.166 -5.019 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.488 -17.259 -5.494 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.372 -20.960 -5.363 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.870 -21.223 -7.051 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.063 -20.683 -5.846 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.300 -18.039 -3.187 1.00 0.00 H new ATOM 0 HD12 ILE B 21 15.057 -18.803 -4.205 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.501 -19.724 -3.722 1.00 0.00 H new ATOM 1100 N GLU B 22 18.912 -20.138 -8.957 1.00 0.00 N ATOM 1101 CA GLU B 22 19.205 -20.975 -10.115 1.00 0.00 C ATOM 1102 C GLU B 22 18.904 -20.226 -11.409 1.00 0.00 C ATOM 1103 O GLU B 22 18.287 -20.779 -12.319 1.00 0.00 O ATOM 1104 CB GLU B 22 18.353 -22.240 -10.053 1.00 0.00 C ATOM 1105 CG GLU B 22 19.020 -23.465 -10.653 1.00 0.00 C ATOM 1106 CD GLU B 22 18.369 -24.753 -10.204 1.00 0.00 C ATOM 1107 OE1 GLU B 22 17.171 -24.955 -10.482 1.00 0.00 O ATOM 1108 OE2 GLU B 22 19.059 -25.577 -9.565 1.00 0.00 O ATOM 0 H GLU B 22 19.705 -19.994 -8.332 1.00 0.00 H new ATOM 0 HA GLU B 22 20.263 -21.236 -10.100 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.105 -22.448 -9.012 1.00 0.00 H new ATOM 0 HB3 GLU B 22 17.413 -22.059 -10.575 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.981 -23.401 -11.740 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.073 -23.476 -10.372 1.00 0.00 H new ATOM 1115 N GLY B 23 19.305 -18.954 -11.484 1.00 0.00 N ATOM 1116 CA GLY B 23 19.001 -18.147 -12.658 1.00 0.00 C ATOM 1117 C GLY B 23 17.524 -18.065 -12.940 1.00 0.00 C ATOM 1118 O GLY B 23 17.095 -17.628 -14.005 1.00 0.00 O ATOM 0 H GLY B 23 19.832 -18.471 -10.756 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.396 -17.141 -12.515 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.510 -18.568 -13.525 1.00 0.00 H new ATOM 1122 N THR B 24 16.761 -18.488 -11.972 1.00 0.00 N ATOM 1123 CA THR B 24 15.361 -18.737 -12.139 1.00 0.00 C ATOM 1124 C THR B 24 14.538 -17.874 -11.182 1.00 0.00 C ATOM 1125 O THR B 24 14.964 -17.610 -10.051 1.00 0.00 O ATOM 1126 CB THR B 24 15.163 -20.242 -11.889 1.00 0.00 C ATOM 1127 OG1 THR B 24 15.411 -20.975 -13.096 1.00 0.00 O ATOM 1128 CG2 THR B 24 13.796 -20.591 -11.320 1.00 0.00 C ATOM 0 H THR B 24 17.103 -18.672 -11.029 1.00 0.00 H new ATOM 0 HA THR B 24 15.018 -18.472 -13.139 1.00 0.00 H new ATOM 0 HB THR B 24 15.886 -20.530 -11.126 1.00 0.00 H new ATOM 0 HG1 THR B 24 16.373 -21.135 -13.190 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.729 -21.669 -11.170 1.00 0.00 H new ATOM 0 HG22 THR B 24 13.658 -20.082 -10.366 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.020 -20.273 -12.016 1.00 0.00 H new ATOM 1136 N PRO B 25 13.368 -17.393 -11.645 1.00 0.00 N ATOM 1137 CA PRO B 25 12.470 -16.558 -10.841 1.00 0.00 C ATOM 1138 C PRO B 25 12.092 -17.241 -9.529 1.00 0.00 C ATOM 1139 O PRO B 25 11.525 -18.335 -9.512 1.00 0.00 O ATOM 1140 CB PRO B 25 11.242 -16.356 -11.741 1.00 0.00 C ATOM 1141 CG PRO B 25 11.346 -17.426 -12.773 1.00 0.00 C ATOM 1142 CD PRO B 25 12.818 -17.633 -12.988 1.00 0.00 C ATOM 0 HA PRO B 25 12.933 -15.616 -10.548 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.316 -16.444 -11.172 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.244 -15.366 -12.196 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.865 -18.344 -12.436 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.852 -17.129 -13.698 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.039 -18.639 -13.344 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.223 -16.938 -13.724 1.00 0.00 H new ATOM 1150 N CYS B 26 12.410 -16.570 -8.432 1.00 0.00 N ATOM 1151 CA CYS B 26 12.351 -17.168 -7.109 1.00 0.00 C ATOM 1152 C CYS B 26 10.920 -17.289 -6.563 1.00 0.00 C ATOM 1153 O CYS B 26 10.120 -16.366 -6.696 1.00 0.00 O ATOM 1154 CB CYS B 26 13.216 -16.341 -6.166 1.00 0.00 C ATOM 1155 SG CYS B 26 13.276 -16.961 -4.453 1.00 0.00 S ATOM 0 H CYS B 26 12.716 -15.597 -8.435 1.00 0.00 H new ATOM 0 HA CYS B 26 12.727 -18.188 -7.183 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.231 -16.306 -6.562 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.842 -15.317 -6.155 1.00 0.00 H new ATOM 1160 N PRO B 27 10.630 -18.439 -5.904 1.00 0.00 N ATOM 1161 CA PRO B 27 9.325 -18.802 -5.320 1.00 0.00 C ATOM 1162 C PRO B 27 8.439 -17.636 -4.859 1.00 0.00 C ATOM 1163 O PRO B 27 7.331 -17.448 -5.356 1.00 0.00 O ATOM 1164 CB PRO B 27 9.758 -19.610 -4.099 1.00 0.00 C ATOM 1165 CG PRO B 27 11.033 -20.289 -4.486 1.00 0.00 C ATOM 1166 CD PRO B 27 11.589 -19.543 -5.689 1.00 0.00 C ATOM 0 HA PRO B 27 8.703 -19.303 -6.061 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.907 -18.962 -3.235 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.996 -20.339 -3.823 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.744 -20.273 -3.660 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.853 -21.336 -4.731 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.593 -19.166 -5.495 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.655 -20.190 -6.564 1.00 0.00 H new ATOM 1174 N ALA B 28 8.953 -16.841 -3.932 1.00 0.00 N ATOM 1175 CA ALA B 28 8.123 -15.871 -3.218 1.00 0.00 C ATOM 1176 C ALA B 28 8.629 -14.449 -3.411 1.00 0.00 C ATOM 1177 O ALA B 28 7.980 -13.481 -3.022 1.00 0.00 O ATOM 1178 CB ALA B 28 8.071 -16.220 -1.737 1.00 0.00 C ATOM 0 H ALA B 28 9.935 -16.845 -3.655 1.00 0.00 H new ATOM 0 HA ALA B 28 7.117 -15.920 -3.634 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.451 -15.492 -1.213 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.646 -17.216 -1.613 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.079 -16.202 -1.323 1.00 0.00 H new ATOM 1184 N CYS B 29 9.801 -14.326 -4.001 1.00 0.00 N ATOM 1185 CA CYS B 29 10.385 -13.021 -4.251 1.00 0.00 C ATOM 1186 C CYS B 29 10.849 -12.943 -5.698 1.00 0.00 C ATOM 1187 O CYS B 29 11.946 -13.400 -6.029 1.00 0.00 O ATOM 1188 CB CYS B 29 11.548 -12.773 -3.275 1.00 0.00 C ATOM 1189 SG CYS B 29 12.912 -13.953 -3.427 1.00 0.00 S ATOM 0 H CYS B 29 10.369 -15.113 -4.317 1.00 0.00 H new ATOM 0 HA CYS B 29 9.639 -12.243 -4.088 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.934 -11.766 -3.436 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.165 -12.808 -2.255 1.00 0.00 H new ATOM 1194 N SER B 30 10.012 -12.382 -6.562 1.00 0.00 N ATOM 1195 CA SER B 30 10.284 -12.350 -7.991 1.00 0.00 C ATOM 1196 C SER B 30 11.272 -11.235 -8.342 1.00 0.00 C ATOM 1197 O SER B 30 10.998 -10.388 -9.193 1.00 0.00 O ATOM 1198 CB SER B 30 8.963 -12.163 -8.751 1.00 0.00 C ATOM 1199 OG SER B 30 9.127 -12.356 -10.145 1.00 0.00 O ATOM 0 H SER B 30 9.133 -11.940 -6.294 1.00 0.00 H new ATOM 0 HA SER B 30 10.742 -13.294 -8.285 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.222 -12.867 -8.371 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.576 -11.161 -8.566 1.00 0.00 H new ATOM 0 HG SER B 30 9.786 -11.717 -10.488 1.00 0.00 H new ATOM 1205 N GLY B 31 12.415 -11.238 -7.673 1.00 0.00 N ATOM 1206 CA GLY B 31 13.461 -10.295 -7.994 1.00 0.00 C ATOM 1207 C GLY B 31 13.423 -9.059 -7.126 1.00 0.00 C ATOM 1208 O GLY B 31 13.543 -7.942 -7.625 1.00 0.00 O ATOM 0 H GLY B 31 12.635 -11.880 -6.911 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.430 -10.782 -7.882 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.371 -10.002 -9.040 1.00 0.00 H new ATOM 1212 N LYS B 32 13.261 -9.246 -5.821 1.00 0.00 N ATOM 1213 CA LYS B 32 13.287 -8.134 -4.883 1.00 0.00 C ATOM 1214 C LYS B 32 14.510 -8.264 -3.979 1.00 0.00 C ATOM 1215 O LYS B 32 15.218 -7.293 -3.719 1.00 0.00 O ATOM 1216 CB LYS B 32 12.037 -8.146 -4.003 1.00 0.00 C ATOM 1217 CG LYS B 32 10.724 -8.110 -4.768 1.00 0.00 C ATOM 1218 CD LYS B 32 9.536 -8.152 -3.817 1.00 0.00 C ATOM 1219 CE LYS B 32 9.500 -9.448 -3.023 1.00 0.00 C ATOM 1220 NZ LYS B 32 8.447 -9.440 -1.979 1.00 0.00 N ATOM 0 H LYS B 32 13.110 -10.158 -5.390 1.00 0.00 H new ATOM 0 HA LYS B 32 13.324 -7.204 -5.451 1.00 0.00 H new ATOM 0 HB2 LYS B 32 12.055 -9.041 -3.381 1.00 0.00 H new ATOM 0 HB3 LYS B 32 12.074 -7.289 -3.330 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.677 -7.205 -5.374 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.675 -8.956 -5.454 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.588 -7.306 -3.132 1.00 0.00 H new ATOM 0 HD3 LYS B 32 8.611 -8.046 -4.384 1.00 0.00 H new ATOM 0 HE2 LYS B 32 9.328 -10.283 -3.702 1.00 0.00 H new ATOM 0 HE3 LYS B 32 10.471 -9.612 -2.555 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 8.299 -10.408 -1.628 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 8.743 -8.828 -1.192 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.560 -9.079 -2.384 1.00 0.00 H new ATOM 1234 N GLY B 33 14.746 -9.492 -3.505 1.00 0.00 N ATOM 1235 CA GLY B 33 15.774 -9.753 -2.533 1.00 0.00 C ATOM 1236 C GLY B 33 15.159 -10.275 -1.252 1.00 0.00 C ATOM 1237 O GLY B 33 15.656 -11.225 -0.649 1.00 0.00 O ATOM 0 H GLY B 33 14.224 -10.319 -3.793 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.483 -10.481 -2.928 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.334 -8.840 -2.331 1.00 0.00 H new ATOM 1241 N VAL B 34 14.017 -9.709 -0.886 1.00 0.00 N ATOM 1242 CA VAL B 34 13.339 -10.075 0.350 1.00 0.00 C ATOM 1243 C VAL B 34 11.995 -10.760 0.088 1.00 0.00 C ATOM 1244 O VAL B 34 11.461 -10.717 -1.023 1.00 0.00 O ATOM 1245 CB VAL B 34 13.106 -8.830 1.236 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.431 -8.237 1.695 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.289 -7.785 0.490 1.00 0.00 C ATOM 0 H VAL B 34 13.539 -8.991 -1.430 1.00 0.00 H new ATOM 0 HA VAL B 34 13.990 -10.780 0.867 1.00 0.00 H new ATOM 0 HB VAL B 34 12.546 -9.143 2.117 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.242 -7.362 2.317 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.982 -8.980 2.272 1.00 0.00 H new ATOM 0 HG13 VAL B 34 15.019 -7.944 0.825 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.136 -6.917 1.131 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.822 -7.481 -0.411 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.323 -8.207 0.215 1.00 0.00 H new ATOM 1257 N ILE B 35 11.490 -11.419 1.121 1.00 0.00 N ATOM 1258 CA ILE B 35 10.170 -12.045 1.104 1.00 0.00 C ATOM 1259 C ILE B 35 9.328 -11.506 2.254 1.00 0.00 C ATOM 1260 O ILE B 35 9.863 -10.976 3.220 1.00 0.00 O ATOM 1261 CB ILE B 35 10.266 -13.579 1.235 1.00 0.00 C ATOM 1262 CG1 ILE B 35 11.184 -13.949 2.400 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.760 -14.198 -0.063 1.00 0.00 C ATOM 1264 CD1 ILE B 35 11.223 -15.427 2.709 1.00 0.00 C ATOM 0 H ILE B 35 11.987 -11.537 2.004 1.00 0.00 H new ATOM 0 HA ILE B 35 9.706 -11.806 0.147 1.00 0.00 H new ATOM 0 HB ILE B 35 9.272 -13.977 1.438 1.00 0.00 H new ATOM 0 HG12 ILE B 35 12.195 -13.609 2.174 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.858 -13.411 3.290 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.821 -15.280 0.050 1.00 0.00 H new ATOM 0 HG22 ILE B 35 10.067 -13.956 -0.869 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.747 -13.802 -0.302 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.896 -15.606 3.547 1.00 0.00 H new ATOM 0 HD12 ILE B 35 10.222 -15.771 2.968 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.579 -15.972 1.835 1.00 0.00 H new ATOM 1276 N LEU B 36 8.016 -11.653 2.156 1.00 0.00 N ATOM 1277 CA LEU B 36 7.115 -11.046 3.129 1.00 0.00 C ATOM 1278 C LEU B 36 6.873 -11.938 4.333 1.00 0.00 C ATOM 1279 O LEU B 36 7.044 -13.156 4.277 1.00 0.00 O ATOM 1280 CB LEU B 36 5.762 -10.721 2.494 1.00 0.00 C ATOM 1281 CG LEU B 36 5.811 -9.795 1.289 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.720 -10.590 -0.004 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.703 -8.767 1.380 1.00 0.00 C ATOM 0 H LEU B 36 7.552 -12.183 1.419 1.00 0.00 H new ATOM 0 HA LEU B 36 7.607 -10.132 3.463 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.287 -11.655 2.194 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.123 -10.268 3.253 1.00 0.00 H new ATOM 0 HG LEU B 36 6.766 -9.270 1.286 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.757 -9.908 -0.854 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.556 -11.287 -0.062 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.782 -11.145 -0.025 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.746 -8.108 0.513 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.738 -9.273 1.404 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.826 -8.179 2.289 1.00 0.00 H new ATOM 1295 N THR B 37 6.468 -11.297 5.417 1.00 0.00 N ATOM 1296 CA THR B 37 5.991 -11.982 6.601 1.00 0.00 C ATOM 1297 C THR B 37 4.476 -11.798 6.676 1.00 0.00 C ATOM 1298 O THR B 37 3.918 -11.047 5.878 1.00 0.00 O ATOM 1299 CB THR B 37 6.677 -11.434 7.878 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.221 -12.133 9.042 1.00 0.00 O ATOM 1301 CG2 THR B 37 6.412 -9.945 8.046 1.00 0.00 C ATOM 0 H THR B 37 6.462 -10.280 5.498 1.00 0.00 H new ATOM 0 HA THR B 37 6.237 -13.042 6.539 1.00 0.00 H new ATOM 0 HB THR B 37 7.750 -11.591 7.764 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.668 -11.772 9.836 1.00 0.00 H new ATOM 0 HG21 THR B 37 6.905 -9.587 8.950 1.00 0.00 H new ATOM 0 HG22 THR B 37 6.802 -9.406 7.182 1.00 0.00 H new ATOM 0 HG23 THR B 37 5.339 -9.773 8.126 1.00 0.00 H new ATOM 1309 N ALA B 38 3.819 -12.459 7.618 1.00 0.00 N ATOM 1310 CA ALA B 38 2.353 -12.466 7.687 1.00 0.00 C ATOM 1311 C ALA B 38 1.764 -11.057 7.706 1.00 0.00 C ATOM 1312 O ALA B 38 0.805 -10.780 6.983 1.00 0.00 O ATOM 1313 CB ALA B 38 1.886 -13.260 8.895 1.00 0.00 C ATOM 0 H ALA B 38 4.275 -13.002 8.351 1.00 0.00 H new ATOM 0 HA ALA B 38 1.988 -12.948 6.780 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.797 -13.257 8.934 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.243 -14.287 8.816 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.283 -12.807 9.804 1.00 0.00 H new ATOM 1319 N GLN B 39 2.330 -10.174 8.525 1.00 0.00 N ATOM 1320 CA GLN B 39 1.871 -8.785 8.579 1.00 0.00 C ATOM 1321 C GLN B 39 1.994 -8.122 7.206 1.00 0.00 C ATOM 1322 O GLN B 39 1.086 -7.425 6.755 1.00 0.00 O ATOM 1323 CB GLN B 39 2.673 -7.992 9.613 1.00 0.00 C ATOM 1324 CG GLN B 39 1.929 -6.777 10.144 1.00 0.00 C ATOM 1325 CD GLN B 39 2.719 -5.999 11.178 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.287 -4.878 10.774 1.00 0.00 O flip ATOM 1327 NE2 GLN B 39 2.757 -6.369 12.348 1.00 0.00 N flip ATOM 0 H GLN B 39 3.101 -10.391 9.156 1.00 0.00 H new ATOM 0 HA GLN B 39 0.822 -8.788 8.875 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.927 -8.647 10.446 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.612 -7.668 9.164 1.00 0.00 H new ATOM 0 HG2 GLN B 39 1.683 -6.117 9.312 1.00 0.00 H new ATOM 0 HG3 GLN B 39 0.986 -7.100 10.584 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.306 -7.242 12.622 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.240 -5.804 13.046 1.00 0.00 H new ATOM 1336 N GLY B 40 3.121 -8.359 6.546 1.00 0.00 N ATOM 1337 CA GLY B 40 3.333 -7.835 5.214 1.00 0.00 C ATOM 1338 C GLY B 40 2.416 -8.486 4.198 1.00 0.00 C ATOM 1339 O GLY B 40 2.042 -7.870 3.205 1.00 0.00 O ATOM 0 H GLY B 40 3.896 -8.909 6.915 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.165 -6.758 5.217 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.371 -7.995 4.922 1.00 0.00 H new ATOM 1343 N TYR B 41 2.040 -9.730 4.454 1.00 0.00 N ATOM 1344 CA TYR B 41 1.115 -10.439 3.585 1.00 0.00 C ATOM 1345 C TYR B 41 -0.292 -9.869 3.690 1.00 0.00 C ATOM 1346 O TYR B 41 -1.029 -9.842 2.702 1.00 0.00 O ATOM 1347 CB TYR B 41 1.102 -11.926 3.944 1.00 0.00 C ATOM 1348 CG TYR B 41 2.048 -12.771 3.122 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.660 -13.285 1.891 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.326 -13.057 3.577 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.522 -14.060 1.138 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.193 -13.829 2.830 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.787 -14.329 1.613 1.00 0.00 C ATOM 1354 OH TYR B 41 4.653 -15.096 0.868 1.00 0.00 O ATOM 0 H TYR B 41 2.362 -10.269 5.258 1.00 0.00 H new ATOM 0 HA TYR B 41 1.454 -10.314 2.557 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.357 -12.036 4.998 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.089 -12.309 3.820 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.669 -13.076 1.516 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.649 -12.669 4.532 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.206 -14.452 0.183 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.186 -14.040 3.199 1.00 0.00 H new ATOM 0 HH TYR B 41 5.503 -15.188 1.347 1.00 0.00 H new ATOM 1364 N THR B 42 -0.659 -9.394 4.868 1.00 0.00 N ATOM 1365 CA THR B 42 -1.928 -8.701 5.035 1.00 0.00 C ATOM 1366 C THR B 42 -1.893 -7.337 4.350 1.00 0.00 C ATOM 1367 O THR B 42 -2.897 -6.867 3.808 1.00 0.00 O ATOM 1368 CB THR B 42 -2.256 -8.520 6.524 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.341 -9.801 7.144 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.564 -7.768 6.719 1.00 0.00 C ATOM 0 H THR B 42 -0.102 -9.474 5.719 1.00 0.00 H new ATOM 0 HA THR B 42 -2.704 -9.311 4.572 1.00 0.00 H new ATOM 0 HB THR B 42 -1.461 -7.932 6.982 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.490 -10.275 7.035 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.765 -7.658 7.785 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.489 -6.782 6.260 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.377 -8.324 6.252 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.715 -6.735 4.322 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.560 -5.403 3.761 1.00 0.00 C ATOM 1380 C LEU B 43 -0.338 -5.481 2.255 1.00 0.00 C ATOM 1381 O LEU B 43 -0.541 -4.498 1.553 1.00 0.00 O ATOM 1382 CB LEU B 43 0.606 -4.657 4.440 1.00 0.00 C ATOM 1383 CG LEU B 43 0.229 -3.674 5.571 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.725 -4.323 6.563 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.485 -3.206 6.289 1.00 0.00 C ATOM 0 H LEU B 43 0.146 -7.147 4.681 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.478 -4.845 3.948 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.294 -5.398 4.847 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.149 -4.104 3.674 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.274 -2.816 5.125 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.974 -3.609 7.348 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.636 -4.627 6.047 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.250 -5.198 7.006 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.212 -2.513 7.085 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.001 -4.065 6.717 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.143 -2.703 5.580 1.00 0.00 H new ATOM 1397 N LEU B 44 0.044 -6.652 1.739 1.00 0.00 N ATOM 1398 CA LEU B 44 0.244 -6.794 0.303 1.00 0.00 C ATOM 1399 C LEU B 44 -1.092 -7.032 -0.392 1.00 0.00 C ATOM 1400 O LEU B 44 -1.354 -6.465 -1.442 1.00 0.00 O ATOM 1401 CB LEU B 44 1.270 -7.910 -0.032 1.00 0.00 C ATOM 1402 CG LEU B 44 0.743 -9.354 -0.186 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.099 -9.572 -1.552 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.872 -10.353 -0.006 1.00 0.00 C ATOM 0 H LEU B 44 0.217 -7.497 2.284 1.00 0.00 H new ATOM 0 HA LEU B 44 0.667 -5.862 -0.073 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.771 -7.636 -0.961 1.00 0.00 H new ATOM 0 HB3 LEU B 44 2.029 -7.913 0.751 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.012 -9.506 0.585 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.260 -10.598 -1.625 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.738 -8.885 -1.673 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.835 -9.389 -2.335 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.483 -11.365 -0.118 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.640 -10.174 -0.759 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.305 -10.238 0.988 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.947 -7.849 0.213 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.226 -8.206 -0.396 1.00 0.00 C ATOM 1418 C ASP B 45 -4.166 -7.015 -0.406 1.00 0.00 C ATOM 1419 O ASP B 45 -5.037 -6.893 -1.271 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.862 -9.368 0.367 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.219 -9.759 -0.183 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.258 -10.513 -1.175 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.249 -9.314 0.372 1.00 0.00 O ATOM 0 H ASP B 45 -1.779 -8.277 1.124 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.045 -8.511 -1.427 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.197 -10.230 0.327 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.966 -9.094 1.417 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.948 -6.108 0.525 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.718 -4.884 0.588 1.00 0.00 C ATOM 1430 C PHE B 46 -4.275 -3.935 -0.503 1.00 0.00 C ATOM 1431 O PHE B 46 -5.100 -3.311 -1.171 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.476 -4.234 1.949 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.302 -3.014 2.227 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.589 -3.135 2.722 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.786 -1.748 2.010 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.346 -2.014 2.992 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.538 -0.624 2.281 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.820 -0.759 2.773 1.00 0.00 C ATOM 0 H PHE B 46 -3.239 -6.198 1.253 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.776 -5.107 0.452 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.673 -4.972 2.727 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.422 -3.965 2.024 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -7.004 -4.116 2.898 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.783 -1.639 1.624 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.350 -2.120 3.375 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.125 0.359 2.109 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.411 0.119 2.987 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.980 -3.858 -0.720 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.468 -2.931 -1.699 1.00 0.00 C ATOM 1450 C ILE B 47 -2.615 -3.498 -3.110 1.00 0.00 C ATOM 1451 O ILE B 47 -2.740 -2.754 -4.078 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.007 -2.542 -1.407 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.100 -3.771 -1.472 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.926 -1.887 -0.036 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.340 -3.502 -1.097 1.00 0.00 C ATOM 0 H ILE B 47 -2.275 -4.417 -0.240 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.063 -2.020 -1.633 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.665 -1.835 -2.163 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.499 -4.538 -0.808 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.130 -4.177 -2.483 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.107 -1.610 0.174 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.551 -0.994 -0.022 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.276 -2.587 0.723 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.914 -4.426 -1.170 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.760 -2.760 -1.776 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.386 -3.126 -0.075 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.618 -4.819 -3.214 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.033 -5.490 -4.428 1.00 0.00 C ATOM 1469 C GLN B 48 -4.430 -5.026 -4.807 1.00 0.00 C ATOM 1470 O GLN B 48 -4.621 -4.358 -5.803 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.040 -7.007 -4.218 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.657 -7.623 -4.085 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.776 -7.364 -5.291 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.257 -7.241 -6.417 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.523 -7.281 -5.062 1.00 0.00 N ATOM 0 H GLN B 48 -2.334 -5.448 -2.463 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.333 -5.246 -5.227 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.615 -7.236 -3.321 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.556 -7.476 -5.056 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.171 -7.224 -3.195 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.757 -8.699 -3.939 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.882 -7.389 -4.113 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.167 -7.109 -5.834 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.359 -5.273 -3.910 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.789 -5.174 -4.178 1.00 0.00 C ATOM 1486 C LYS B 49 -7.298 -3.721 -4.154 1.00 0.00 C ATOM 1487 O LYS B 49 -8.490 -3.467 -4.320 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.494 -6.125 -3.183 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.959 -5.855 -2.881 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.644 -7.095 -2.310 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.830 -7.760 -1.201 1.00 0.00 C ATOM 1492 NZ LYS B 49 -8.943 -7.058 0.105 1.00 0.00 N ATOM 0 H LYS B 49 -5.144 -5.554 -2.953 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.023 -5.489 -5.195 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.411 -7.141 -3.570 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -6.945 -6.097 -2.242 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.041 -5.032 -2.171 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.469 -5.542 -3.792 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.623 -6.817 -1.920 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -9.813 -7.814 -3.112 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -9.163 -8.791 -1.083 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.782 -7.795 -1.499 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.092 -7.243 0.674 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.035 -6.035 -0.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.782 -7.404 0.614 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.409 -2.750 -3.937 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.804 -1.368 -4.253 1.00 0.00 C ATOM 1508 C HIS B 50 -5.979 -0.712 -5.364 1.00 0.00 C ATOM 1509 O HIS B 50 -6.248 0.431 -5.725 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.740 -0.505 -2.994 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.570 -1.062 -1.894 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -8.898 -1.351 -2.049 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.242 -1.467 -0.650 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.353 -1.911 -0.957 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.370 -2.000 -0.085 1.00 0.00 N ATOM 0 H HIS B 50 -5.467 -2.875 -3.567 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.825 -1.433 -4.630 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.705 -0.424 -2.662 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.079 0.504 -3.229 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.270 -1.386 -0.186 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.368 -2.245 -0.797 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -8.437 -2.398 0.852 1.00 0.00 H new ATOM 1524 N LEU B 51 -4.989 -1.401 -5.910 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.255 -0.859 -7.059 1.00 0.00 C ATOM 1526 C LEU B 51 -4.320 -1.812 -8.247 1.00 0.00 C ATOM 1527 O LEU B 51 -4.718 -1.435 -9.349 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.775 -0.591 -6.736 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.460 0.582 -5.786 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.122 1.873 -6.252 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.870 0.260 -4.365 1.00 0.00 C ATOM 0 H LEU B 51 -4.675 -2.317 -5.590 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.738 0.087 -7.305 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.355 -1.498 -6.303 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.251 -0.414 -7.675 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.381 0.732 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.878 2.678 -5.559 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.759 2.129 -7.247 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.203 1.737 -6.284 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.636 1.105 -3.718 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -3.942 0.063 -4.331 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.328 -0.621 -4.021 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.948 -3.052 -7.991 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.708 -4.035 -9.039 1.00 0.00 C ATOM 1545 C ASN B 52 -4.766 -5.135 -9.064 1.00 0.00 C ATOM 1546 O ASN B 52 -4.902 -5.853 -10.057 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.321 -4.638 -8.838 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.296 -4.053 -9.795 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.120 -3.920 -9.461 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.725 -3.715 -11.005 1.00 0.00 N ATOM 0 H ASN B 52 -3.802 -3.411 -7.047 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.767 -3.527 -10.001 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -1.997 -4.465 -7.812 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.372 -5.718 -8.979 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -1.072 -3.332 -11.689 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -2.707 -3.838 -11.251 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.495 -5.280 -7.978 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.611 -6.197 -7.910 1.00 0.00 C ATOM 1559 C LYS B 53 -7.912 -5.407 -7.846 1.00 0.00 C ATOM 1560 O LYS B 53 -8.543 -5.220 -8.907 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.487 -7.097 -6.680 1.00 0.00 C ATOM 1562 CG LYS B 53 -6.080 -8.519 -6.993 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.441 -9.446 -5.841 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.411 -9.424 -4.728 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.677 -10.497 -3.735 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.282 -4.955 -6.751 1.00 0.00 O ATOM 0 H LYS B 53 -5.329 -4.763 -7.115 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.610 -6.826 -8.801 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.756 -6.663 -5.998 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.443 -7.111 -6.156 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -6.576 -8.853 -7.904 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -5.007 -8.563 -7.180 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.412 -9.157 -5.438 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.542 -10.464 -6.217 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.413 -9.552 -5.148 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.426 -8.453 -4.233 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -5.362 -10.185 -2.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.696 -10.701 -3.709 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.159 -11.357 -4.006 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.704 4.435 14.393 1.00 0.00 N HETATM 1582 CN FME C 1 -10.494 3.144 14.581 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.245 2.458 15.273 1.00 0.00 O HETATM 1584 CA FME C 1 -9.808 5.238 13.577 1.00 0.00 C HETATM 1585 CB FME C 1 -10.529 6.492 13.085 1.00 0.00 C HETATM 1586 CG FME C 1 -9.775 7.237 12.004 1.00 0.00 C HETATM 1587 SD FME C 1 -9.515 6.223 10.539 1.00 0.00 S HETATM 1588 CE FME C 1 -9.150 7.482 9.323 1.00 0.00 C HETATM 1589 C FME C 1 -8.578 5.629 14.387 1.00 0.00 C HETATM 1590 O FME C 1 -8.666 6.434 15.313 1.00 0.00 O HETATM 0 HG3 FME C 1 -10.329 8.135 11.729 1.00 0.00 H new HETATM 0 HG2 FME C 1 -8.811 7.564 12.394 1.00 0.00 H new HETATM 0 HE3 FME C 1 -9.463 7.138 8.337 1.00 0.00 H new HETATM 0 HE2 FME C 1 -9.686 8.397 9.575 1.00 0.00 H new HETATM 0 HE1 FME C 1 -8.078 7.680 9.315 1.00 0.00 H new HETATM 0 HCN FME C 1 -9.631 2.674 14.110 1.00 0.00 H new HETATM 0 HB3 FME C 1 -11.511 6.211 12.704 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.694 7.161 13.929 1.00 0.00 H new HETATM 0 HA FME C 1 -9.494 4.651 12.714 1.00 0.00 H new HETATM 0 H FME C 1 -11.512 4.878 14.830 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.442 5.042 14.048 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.212 5.279 14.793 1.00 0.00 C ATOM 1603 C VAL C 2 -5.181 6.027 13.944 1.00 0.00 C ATOM 1604 O VAL C 2 -4.284 6.685 14.473 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.612 3.943 15.292 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.254 3.044 14.118 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.402 4.181 16.186 1.00 0.00 C ATOM 0 H VAL C 2 -7.344 4.398 13.263 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.463 5.900 15.652 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.369 3.437 15.891 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.834 2.110 14.490 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -6.151 2.832 13.535 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.521 3.545 13.486 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.003 3.223 16.521 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.636 4.718 15.626 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -4.700 4.772 17.052 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.322 5.943 12.630 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.345 6.537 11.732 1.00 0.00 C ATOM 1619 C ILE C 3 -5.021 7.468 10.734 1.00 0.00 C ATOM 1620 O ILE C 3 -6.110 7.180 10.243 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.533 5.452 10.978 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.376 6.089 10.200 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.429 4.645 10.039 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.458 5.081 9.544 1.00 0.00 C ATOM 0 H ILE C 3 -6.098 5.473 12.165 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.654 7.117 12.343 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.119 4.768 11.719 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.784 6.748 9.434 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.792 6.711 10.878 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.832 3.892 9.524 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.213 4.154 10.616 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.882 5.312 9.306 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.664 5.605 9.012 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.021 4.437 10.307 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.028 4.474 8.840 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.391 8.603 10.480 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.836 9.507 9.438 1.00 0.00 C ATOM 1638 C ALA C 4 -3.717 9.709 8.432 1.00 0.00 C ATOM 1639 O ALA C 4 -2.548 9.457 8.734 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.272 10.835 10.032 1.00 0.00 C ATOM 0 H ALA C 4 -3.564 8.920 10.986 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.696 9.071 8.930 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.602 11.500 9.234 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -6.093 10.670 10.730 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.434 11.290 10.560 1.00 0.00 H new ATOM 1646 N THR C 5 -4.071 10.170 7.239 1.00 0.00 N ATOM 1647 CA THR C 5 -3.104 10.346 6.165 1.00 0.00 C ATOM 1648 C THR C 5 -2.084 11.430 6.516 1.00 0.00 C ATOM 1649 O THR C 5 -1.025 11.527 5.899 1.00 0.00 O ATOM 1650 CB THR C 5 -3.815 10.703 4.846 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.982 9.884 4.695 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.894 10.488 3.653 1.00 0.00 C ATOM 0 H THR C 5 -5.026 10.430 6.991 1.00 0.00 H new ATOM 0 HA THR C 5 -2.575 9.401 6.037 1.00 0.00 H new ATOM 0 HB THR C 5 -4.096 11.755 4.882 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.436 10.112 3.857 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.421 10.748 2.735 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.012 11.120 3.756 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.589 9.442 3.613 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.392 12.208 7.548 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.526 13.298 7.976 1.00 0.00 C ATOM 1662 C ASP C 6 -0.415 12.783 8.884 1.00 0.00 C ATOM 1663 O ASP C 6 0.460 13.543 9.303 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.335 14.373 8.710 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.276 15.131 7.794 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.423 14.669 7.596 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -2.880 16.200 7.279 1.00 0.00 O ATOM 0 H ASP C 6 -3.240 12.102 8.105 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.077 13.737 7.085 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.911 13.905 9.508 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.650 15.077 9.182 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.455 11.493 9.207 1.00 0.00 N ATOM 1673 CA ASP C 7 0.601 10.884 10.011 1.00 0.00 C ATOM 1674 C ASP C 7 1.541 10.064 9.136 1.00 0.00 C ATOM 1675 O ASP C 7 2.532 9.516 9.615 1.00 0.00 O ATOM 1676 CB ASP C 7 0.001 9.977 11.095 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.899 10.718 12.067 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.395 11.584 12.813 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -2.114 10.428 12.102 1.00 0.00 O ATOM 0 H ASP C 7 -1.200 10.854 8.928 1.00 0.00 H new ATOM 0 HA ASP C 7 1.163 11.689 10.485 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.569 9.180 10.618 1.00 0.00 H new ATOM 0 HB3 ASP C 7 0.810 9.501 11.650 1.00 0.00 H new ATOM 1684 N LEU C 8 1.224 9.980 7.851 1.00 0.00 N ATOM 1685 CA LEU C 8 2.085 9.290 6.895 1.00 0.00 C ATOM 1686 C LEU C 8 2.599 10.266 5.850 1.00 0.00 C ATOM 1687 O LEU C 8 3.625 10.032 5.208 1.00 0.00 O ATOM 1688 CB LEU C 8 1.330 8.149 6.216 1.00 0.00 C ATOM 1689 CG LEU C 8 0.902 7.009 7.137 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.112 5.970 6.361 1.00 0.00 C ATOM 1691 CD2 LEU C 8 2.116 6.370 7.793 1.00 0.00 C ATOM 0 H LEU C 8 0.378 10.380 7.445 1.00 0.00 H new ATOM 0 HA LEU C 8 2.933 8.872 7.438 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.441 8.559 5.736 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.959 7.739 5.426 1.00 0.00 H new ATOM 0 HG LEU C 8 0.263 7.419 7.919 1.00 0.00 H new ATOM 0 HD11 LEU C 8 -0.186 5.164 7.032 1.00 0.00 H new ATOM 0 HD12 LEU C 8 -0.777 6.434 5.933 1.00 0.00 H new ATOM 0 HD13 LEU C 8 0.731 5.566 5.560 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.792 5.559 8.446 1.00 0.00 H new ATOM 0 HD22 LEU C 8 2.779 5.974 7.024 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.648 7.118 8.380 1.00 0.00 H new ATOM 1703 N GLU C 9 1.890 11.376 5.723 1.00 0.00 N ATOM 1704 CA GLU C 9 2.242 12.419 4.780 1.00 0.00 C ATOM 1705 C GLU C 9 1.886 13.776 5.370 1.00 0.00 C ATOM 1706 O GLU C 9 0.911 13.909 6.108 1.00 0.00 O ATOM 1707 CB GLU C 9 1.564 12.217 3.414 1.00 0.00 C ATOM 1708 CG GLU C 9 2.155 11.061 2.615 1.00 0.00 C ATOM 1709 CD GLU C 9 1.754 11.057 1.151 1.00 0.00 C ATOM 1710 OE1 GLU C 9 2.440 11.714 0.334 1.00 0.00 O ATOM 1711 OE2 GLU C 9 0.781 10.356 0.797 1.00 0.00 O ATOM 0 H GLU C 9 1.054 11.577 6.272 1.00 0.00 H new ATOM 0 HA GLU C 9 3.317 12.371 4.604 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.500 12.038 3.567 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.652 13.135 2.833 1.00 0.00 H new ATOM 0 HG2 GLU C 9 3.242 11.103 2.684 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.843 10.121 3.070 1.00 0.00 H new ATOM 1718 N VAL C 10 2.692 14.764 5.052 1.00 0.00 N ATOM 1719 CA VAL C 10 2.558 16.093 5.611 1.00 0.00 C ATOM 1720 C VAL C 10 2.676 17.121 4.493 1.00 0.00 C ATOM 1721 O VAL C 10 3.372 16.890 3.506 1.00 0.00 O ATOM 1722 CB VAL C 10 3.642 16.333 6.694 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.037 16.080 6.138 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.546 17.736 7.274 1.00 0.00 C ATOM 0 H VAL C 10 3.465 14.668 4.393 1.00 0.00 H new ATOM 0 HA VAL C 10 1.581 16.192 6.085 1.00 0.00 H new ATOM 0 HB VAL C 10 3.460 15.622 7.500 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.777 16.256 6.919 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.110 15.048 5.794 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.224 16.755 5.303 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.320 17.871 8.030 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.684 18.469 6.479 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.566 17.875 7.730 1.00 0.00 H new ATOM 1734 N ALA C 11 1.992 18.246 4.635 1.00 0.00 N ATOM 1735 CA ALA C 11 1.978 19.263 3.596 1.00 0.00 C ATOM 1736 C ALA C 11 3.374 19.840 3.370 1.00 0.00 C ATOM 1737 O ALA C 11 4.064 20.222 4.316 1.00 0.00 O ATOM 1738 CB ALA C 11 0.993 20.355 3.985 1.00 0.00 C ATOM 0 H ALA C 11 1.439 18.477 5.460 1.00 0.00 H new ATOM 0 HA ALA C 11 1.662 18.810 2.656 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.976 21.122 3.211 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.003 19.925 4.092 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.299 20.801 4.931 1.00 0.00 H new ATOM 1744 N CYS C 12 3.773 19.889 2.097 1.00 0.00 N ATOM 1745 CA CYS C 12 5.143 20.182 1.695 1.00 0.00 C ATOM 1746 C CYS C 12 5.573 21.629 1.999 1.00 0.00 C ATOM 1747 O CYS C 12 4.719 22.496 2.152 1.00 0.00 O ATOM 1748 CB CYS C 12 5.265 19.861 0.197 1.00 0.00 C ATOM 1749 SG CYS C 12 6.781 20.440 -0.582 1.00 0.00 S ATOM 0 H CYS C 12 3.144 19.724 1.311 1.00 0.00 H new ATOM 0 HA CYS C 12 5.822 19.563 2.281 1.00 0.00 H new ATOM 0 HB2 CYS C 12 5.196 18.781 0.065 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.415 20.301 -0.324 1.00 0.00 H new ATOM 1754 N PRO C 13 6.900 21.902 2.115 1.00 0.00 N ATOM 1755 CA PRO C 13 7.440 23.246 2.363 1.00 0.00 C ATOM 1756 C PRO C 13 6.674 24.381 1.671 1.00 0.00 C ATOM 1757 O PRO C 13 6.449 25.441 2.260 1.00 0.00 O ATOM 1758 CB PRO C 13 8.839 23.141 1.759 1.00 0.00 C ATOM 1759 CG PRO C 13 9.265 21.736 2.007 1.00 0.00 C ATOM 1760 CD PRO C 13 7.997 20.906 2.050 1.00 0.00 C ATOM 0 HA PRO C 13 7.389 23.500 3.422 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.826 23.366 0.693 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.524 23.849 2.226 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.931 21.387 1.218 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.813 21.656 2.946 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.907 20.274 1.167 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.985 20.246 2.917 1.00 0.00 H new ATOM 1768 N LYS C 14 6.250 24.144 0.431 1.00 0.00 N ATOM 1769 CA LYS C 14 5.751 25.230 -0.402 1.00 0.00 C ATOM 1770 C LYS C 14 4.566 24.846 -1.299 1.00 0.00 C ATOM 1771 O LYS C 14 3.752 25.700 -1.629 1.00 0.00 O ATOM 1772 CB LYS C 14 6.893 25.768 -1.271 1.00 0.00 C ATOM 1773 CG LYS C 14 6.467 26.865 -2.237 1.00 0.00 C ATOM 1774 CD LYS C 14 7.568 27.195 -3.236 1.00 0.00 C ATOM 1775 CE LYS C 14 7.086 28.190 -4.280 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.861 29.538 -3.700 1.00 0.00 N ATOM 0 H LYS C 14 6.242 23.225 -0.011 1.00 0.00 H new ATOM 0 HA LYS C 14 5.378 25.992 0.283 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.680 26.153 -0.622 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.324 24.944 -1.839 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.572 26.550 -2.773 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.204 27.762 -1.676 1.00 0.00 H new ATOM 0 HD2 LYS C 14 8.429 27.606 -2.709 1.00 0.00 H new ATOM 0 HD3 LYS C 14 7.902 26.281 -3.728 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.821 28.258 -5.082 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.160 27.828 -4.726 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.582 30.198 -4.454 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 6.105 29.487 -2.987 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 7.737 29.874 -3.252 1.00 0.00 H new ATOM 1790 N CYS C 15 4.443 23.588 -1.716 1.00 0.00 N ATOM 1791 CA CYS C 15 3.477 23.296 -2.779 1.00 0.00 C ATOM 1792 C CYS C 15 2.320 22.392 -2.378 1.00 0.00 C ATOM 1793 O CYS C 15 1.875 21.558 -3.172 1.00 0.00 O ATOM 1794 CB CYS C 15 4.219 22.616 -3.916 1.00 0.00 C ATOM 1795 SG CYS C 15 5.325 21.295 -3.371 1.00 0.00 S ATOM 0 H CYS C 15 4.968 22.790 -1.359 1.00 0.00 H new ATOM 0 HA CYS C 15 3.036 24.255 -3.052 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.493 22.204 -4.617 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.799 23.363 -4.459 1.00 0.00 H new ATOM 1800 N GLU C 16 1.750 22.641 -1.224 1.00 0.00 N ATOM 1801 CA GLU C 16 0.672 21.818 -0.711 1.00 0.00 C ATOM 1802 C GLU C 16 -0.667 22.366 -1.156 1.00 0.00 C ATOM 1803 O GLU C 16 -1.693 22.118 -0.527 1.00 0.00 O ATOM 1804 CB GLU C 16 0.707 21.812 0.819 1.00 0.00 C ATOM 1805 CG GLU C 16 1.903 22.513 1.435 1.00 0.00 C ATOM 1806 CD GLU C 16 1.706 24.014 1.510 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.874 24.687 0.478 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.364 24.525 2.598 1.00 0.00 O ATOM 0 H GLU C 16 2.015 23.414 -0.614 1.00 0.00 H new ATOM 0 HA GLU C 16 0.801 20.806 -1.096 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.203 22.284 1.190 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.693 20.778 1.164 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.077 22.120 2.437 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.794 22.293 0.847 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.671 23.104 -2.253 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.859 23.810 -2.670 1.00 0.00 C ATOM 1817 C ARG C 17 -1.871 23.837 -4.200 1.00 0.00 C ATOM 1818 O ARG C 17 -2.869 24.187 -4.824 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.910 25.237 -2.087 1.00 0.00 C ATOM 1820 CG ARG C 17 -1.151 26.297 -2.883 1.00 0.00 C ATOM 1821 CD ARG C 17 0.361 26.130 -2.802 1.00 0.00 C ATOM 1822 NE ARG C 17 0.878 26.310 -1.446 1.00 0.00 N ATOM 1823 CZ ARG C 17 1.269 27.480 -0.937 1.00 0.00 C ATOM 1824 NH1 ARG C 17 1.099 28.605 -1.620 1.00 0.00 N ATOM 1825 NH2 ARG C 17 1.823 27.514 0.267 1.00 0.00 N ATOM 0 H ARG C 17 0.135 23.226 -2.866 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.744 23.297 -2.293 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.953 25.543 -2.010 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.509 25.212 -1.074 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -1.461 26.251 -3.927 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -1.423 27.286 -2.513 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.632 25.137 -3.161 1.00 0.00 H new ATOM 0 HD3 ARG C 17 0.838 26.850 -3.467 1.00 0.00 H new ATOM 0 HE ARG C 17 0.944 25.486 -0.849 1.00 0.00 H new ATOM 0 HH11 ARG C 17 0.666 28.581 -2.543 1.00 0.00 H new ATOM 0 HH12 ARG C 17 1.401 29.494 -1.222 1.00 0.00 H new ATOM 0 HH21 ARG C 17 1.947 26.651 0.796 1.00 0.00 H new ATOM 0 HH22 ARG C 17 2.125 28.403 0.664 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.724 23.461 -4.792 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.545 23.594 -6.237 1.00 0.00 C ATOM 1841 C ALA C 18 -0.049 22.312 -6.901 1.00 0.00 C ATOM 1842 O ALA C 18 -0.502 21.955 -7.983 1.00 0.00 O ATOM 1843 CB ALA C 18 0.404 24.744 -6.544 1.00 0.00 C ATOM 0 H ALA C 18 0.077 23.070 -4.297 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.529 23.803 -6.656 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.530 24.834 -7.623 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.009 25.672 -6.148 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.372 24.551 -6.081 1.00 0.00 H new ATOM 1849 N GLY C 19 0.876 21.617 -6.247 1.00 0.00 N ATOM 1850 CA GLY C 19 1.449 20.423 -6.842 1.00 0.00 C ATOM 1851 C GLY C 19 2.701 20.720 -7.643 1.00 0.00 C ATOM 1852 O GLY C 19 3.199 19.867 -8.373 1.00 0.00 O ATOM 0 H GLY C 19 1.237 21.856 -5.323 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.686 19.706 -6.056 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.709 19.953 -7.490 1.00 0.00 H new ATOM 1856 N GLU C 20 3.241 21.912 -7.456 1.00 0.00 N ATOM 1857 CA GLU C 20 4.408 22.354 -8.205 1.00 0.00 C ATOM 1858 C GLU C 20 5.195 23.355 -7.396 1.00 0.00 C ATOM 1859 O GLU C 20 4.704 23.892 -6.407 1.00 0.00 O ATOM 1860 CB GLU C 20 4.032 23.007 -9.541 1.00 0.00 C ATOM 1861 CG GLU C 20 2.870 23.980 -9.442 1.00 0.00 C ATOM 1862 CD GLU C 20 2.738 24.851 -10.672 1.00 0.00 C ATOM 1863 OE1 GLU C 20 3.392 25.913 -10.722 1.00 0.00 O ATOM 1864 OE2 GLU C 20 1.976 24.487 -11.593 1.00 0.00 O ATOM 0 H GLU C 20 2.888 22.596 -6.787 1.00 0.00 H new ATOM 0 HA GLU C 20 5.003 21.464 -8.409 1.00 0.00 H new ATOM 0 HB2 GLU C 20 4.902 23.533 -9.935 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.780 22.226 -10.258 1.00 0.00 H new ATOM 0 HG2 GLU C 20 1.945 23.423 -9.294 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.004 24.613 -8.565 1.00 0.00 H new ATOM 1871 N ILE C 21 6.406 23.599 -7.833 1.00 0.00 N ATOM 1872 CA ILE C 21 7.239 24.632 -7.270 1.00 0.00 C ATOM 1873 C ILE C 21 8.030 25.239 -8.405 1.00 0.00 C ATOM 1874 O ILE C 21 8.726 24.525 -9.121 1.00 0.00 O ATOM 1875 CB ILE C 21 8.178 24.109 -6.147 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.351 23.796 -4.889 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.275 25.123 -5.842 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.158 23.434 -3.656 1.00 0.00 C ATOM 0 H ILE C 21 6.844 23.082 -8.595 1.00 0.00 H new ATOM 0 HA ILE C 21 6.608 25.379 -6.789 1.00 0.00 H new ATOM 0 HB ILE C 21 8.663 23.194 -6.486 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.732 24.662 -4.656 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.674 22.972 -5.115 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.920 24.735 -5.053 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.867 25.300 -6.740 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.824 26.060 -5.514 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.482 23.232 -2.825 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.757 22.547 -3.861 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.816 24.263 -3.395 1.00 0.00 H new ATOM 1890 N GLU C 22 7.890 26.543 -8.577 1.00 0.00 N ATOM 1891 CA GLU C 22 8.477 27.238 -9.715 1.00 0.00 C ATOM 1892 C GLU C 22 7.967 26.652 -11.030 1.00 0.00 C ATOM 1893 O GLU C 22 8.747 26.434 -11.956 1.00 0.00 O ATOM 1894 CB GLU C 22 9.995 27.095 -9.649 1.00 0.00 C ATOM 1895 CG GLU C 22 10.760 28.284 -10.196 1.00 0.00 C ATOM 1896 CD GLU C 22 12.211 28.263 -9.779 1.00 0.00 C ATOM 1897 OE1 GLU C 22 12.937 27.333 -10.181 1.00 0.00 O ATOM 1898 OE2 GLU C 22 12.632 29.176 -9.038 1.00 0.00 O ATOM 0 H GLU C 22 7.371 27.147 -7.939 1.00 0.00 H new ATOM 0 HA GLU C 22 8.193 28.290 -9.675 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.288 26.936 -8.611 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.288 26.203 -10.203 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.695 28.287 -11.284 1.00 0.00 H new ATOM 0 HG3 GLU C 22 10.296 29.206 -9.846 1.00 0.00 H new ATOM 1905 N GLY C 23 6.665 26.373 -11.112 1.00 0.00 N ATOM 1906 CA GLY C 23 6.118 25.733 -12.302 1.00 0.00 C ATOM 1907 C GLY C 23 6.811 24.432 -12.633 1.00 0.00 C ATOM 1908 O GLY C 23 6.705 23.911 -13.743 1.00 0.00 O ATOM 0 H GLY C 23 5.983 26.577 -10.381 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.055 25.546 -12.153 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.207 26.413 -13.149 1.00 0.00 H new ATOM 1912 N THR C 24 7.531 23.936 -11.663 1.00 0.00 N ATOM 1913 CA THR C 24 8.432 22.835 -11.850 1.00 0.00 C ATOM 1914 C THR C 24 8.087 21.669 -10.915 1.00 0.00 C ATOM 1915 O THR C 24 7.631 21.884 -9.785 1.00 0.00 O ATOM 1916 CB THR C 24 9.839 23.395 -11.588 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.370 23.959 -12.792 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.810 22.377 -11.009 1.00 0.00 C ATOM 0 H THR C 24 7.506 24.292 -10.707 1.00 0.00 H new ATOM 0 HA THR C 24 8.363 22.424 -12.857 1.00 0.00 H new ATOM 0 HB THR C 24 9.726 24.167 -10.827 1.00 0.00 H new ATOM 0 HG1 THR C 24 10.037 24.874 -12.899 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.780 22.848 -10.852 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.427 22.010 -10.057 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.919 21.543 -11.702 1.00 0.00 H new ATOM 1926 N PRO C 25 8.264 20.420 -11.401 1.00 0.00 N ATOM 1927 CA PRO C 25 8.015 19.208 -10.613 1.00 0.00 C ATOM 1928 C PRO C 25 8.808 19.215 -9.314 1.00 0.00 C ATOM 1929 O PRO C 25 10.038 19.300 -9.308 1.00 0.00 O ATOM 1930 CB PRO C 25 8.465 18.065 -11.533 1.00 0.00 C ATOM 1931 CG PRO C 25 9.319 18.718 -12.564 1.00 0.00 C ATOM 1932 CD PRO C 25 8.740 20.092 -12.752 1.00 0.00 C ATOM 0 HA PRO C 25 6.971 19.117 -10.313 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.022 17.308 -10.980 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.610 17.564 -11.987 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.358 18.771 -12.237 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.307 18.156 -13.498 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.487 20.803 -13.104 1.00 0.00 H new ATOM 0 HD3 PRO C 25 7.929 20.095 -13.481 1.00 0.00 H new ATOM 1940 N CYS C 26 8.084 19.116 -8.218 1.00 0.00 N ATOM 1941 CA CYS C 26 8.636 19.378 -6.907 1.00 0.00 C ATOM 1942 C CYS C 26 9.432 18.192 -6.344 1.00 0.00 C ATOM 1943 O CYS C 26 9.005 17.043 -6.452 1.00 0.00 O ATOM 1944 CB CYS C 26 7.499 19.749 -5.974 1.00 0.00 C ATOM 1945 SG CYS C 26 8.043 20.305 -4.337 1.00 0.00 S ATOM 0 H CYS C 26 7.099 18.852 -8.212 1.00 0.00 H new ATOM 0 HA CYS C 26 9.346 20.200 -6.994 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.906 20.538 -6.436 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.844 18.886 -5.855 1.00 0.00 H new ATOM 1950 N PRO C 27 10.585 18.504 -5.697 1.00 0.00 N ATOM 1951 CA PRO C 27 11.556 17.545 -5.138 1.00 0.00 C ATOM 1952 C PRO C 27 10.995 16.193 -4.681 1.00 0.00 C ATOM 1953 O PRO C 27 11.402 15.140 -5.171 1.00 0.00 O ATOM 1954 CB PRO C 27 12.062 18.308 -3.917 1.00 0.00 C ATOM 1955 CG PRO C 27 11.997 19.759 -4.275 1.00 0.00 C ATOM 1956 CD PRO C 27 11.068 19.883 -5.472 1.00 0.00 C ATOM 0 HA PRO C 27 12.286 17.262 -5.896 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.447 18.095 -3.043 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.082 18.014 -3.669 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.624 20.346 -3.436 1.00 0.00 H new ATOM 0 HG3 PRO C 27 12.989 20.141 -4.516 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.243 20.566 -5.268 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.593 20.269 -6.346 1.00 0.00 H new ATOM 1964 N ALA C 28 10.048 16.235 -3.753 1.00 0.00 N ATOM 1965 CA ALA C 28 9.616 15.027 -3.052 1.00 0.00 C ATOM 1966 C ALA C 28 8.120 14.787 -3.214 1.00 0.00 C ATOM 1967 O ALA C 28 7.586 13.765 -2.788 1.00 0.00 O ATOM 1968 CB ALA C 28 9.982 15.122 -1.579 1.00 0.00 C ATOM 0 H ALA C 28 9.565 17.087 -3.467 1.00 0.00 H new ATOM 0 HA ALA C 28 10.134 14.177 -3.497 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.657 14.218 -1.064 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.062 15.228 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.490 15.988 -1.137 1.00 0.00 H new ATOM 1974 N CYS C 29 7.438 15.747 -3.808 1.00 0.00 N ATOM 1975 CA CYS C 29 6.017 15.605 -4.067 1.00 0.00 C ATOM 1976 C CYS C 29 5.732 15.973 -5.523 1.00 0.00 C ATOM 1977 O CYS C 29 5.576 17.146 -5.857 1.00 0.00 O ATOM 1978 CB CYS C 29 5.207 16.472 -3.074 1.00 0.00 C ATOM 1979 SG CYS C 29 5.215 18.260 -3.404 1.00 0.00 S ATOM 0 H CYS C 29 7.842 16.630 -4.119 1.00 0.00 H new ATOM 0 HA CYS C 29 5.707 14.571 -3.915 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.174 16.125 -3.076 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.598 16.304 -2.070 1.00 0.00 H new ATOM 1984 N SER C 30 5.701 14.976 -6.401 1.00 0.00 N ATOM 1985 CA SER C 30 5.512 15.222 -7.827 1.00 0.00 C ATOM 1986 C SER C 30 4.045 15.510 -8.154 1.00 0.00 C ATOM 1987 O SER C 30 3.447 14.856 -9.007 1.00 0.00 O ATOM 1988 CB SER C 30 6.014 14.021 -8.638 1.00 0.00 C ATOM 1989 OG SER C 30 5.960 14.280 -10.031 1.00 0.00 O ATOM 0 H SER C 30 5.804 13.992 -6.152 1.00 0.00 H new ATOM 0 HA SER C 30 6.092 16.104 -8.098 1.00 0.00 H new ATOM 0 HB2 SER C 30 7.039 13.787 -8.349 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.409 13.144 -8.405 1.00 0.00 H new ATOM 0 HG SER C 30 5.034 14.466 -10.294 1.00 0.00 H new ATOM 1995 N GLY C 31 3.473 16.484 -7.462 1.00 0.00 N ATOM 1996 CA GLY C 31 2.128 16.913 -7.765 1.00 0.00 C ATOM 1997 C GLY C 31 1.086 16.245 -6.896 1.00 0.00 C ATOM 1998 O GLY C 31 0.053 15.797 -7.392 1.00 0.00 O ATOM 0 H GLY C 31 3.920 16.985 -6.694 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.060 17.994 -7.639 1.00 0.00 H new ATOM 0 HA3 GLY C 31 1.911 16.700 -8.812 1.00 0.00 H new ATOM 2002 N LYS C 32 1.342 16.176 -5.595 1.00 0.00 N ATOM 2003 CA LYS C 32 0.378 15.624 -4.657 1.00 0.00 C ATOM 2004 C LYS C 32 -0.116 16.733 -3.734 1.00 0.00 C ATOM 2005 O LYS C 32 -1.304 16.858 -3.470 1.00 0.00 O ATOM 2006 CB LYS C 32 1.024 14.541 -3.796 1.00 0.00 C ATOM 2007 CG LYS C 32 1.634 13.393 -4.579 1.00 0.00 C ATOM 2008 CD LYS C 32 2.253 12.368 -3.642 1.00 0.00 C ATOM 2009 CE LYS C 32 3.416 12.951 -2.858 1.00 0.00 C ATOM 2010 NZ LYS C 32 3.942 12.000 -1.847 1.00 0.00 N ATOM 0 H LYS C 32 2.211 16.496 -5.167 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.447 15.194 -5.224 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.800 14.998 -3.182 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.273 14.141 -3.115 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.868 12.917 -5.191 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.394 13.775 -5.260 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.494 12.003 -2.950 1.00 0.00 H new ATOM 0 HD3 LYS C 32 2.597 11.509 -4.219 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.215 13.226 -3.547 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.095 13.866 -2.361 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 4.815 12.383 -1.431 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 3.233 11.862 -1.099 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 4.147 11.088 -2.302 1.00 0.00 H new ATOM 2024 N GLY C 33 0.837 17.536 -3.247 1.00 0.00 N ATOM 2025 CA GLY C 33 0.555 18.543 -2.258 1.00 0.00 C ATOM 2026 C GLY C 33 1.320 18.252 -0.984 1.00 0.00 C ATOM 2027 O GLY C 33 1.893 19.149 -0.366 1.00 0.00 O ATOM 0 H GLY C 33 1.815 17.495 -3.535 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.831 19.526 -2.640 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.515 18.570 -2.051 1.00 0.00 H new ATOM 2031 N VAL C 34 1.403 16.975 -0.640 1.00 0.00 N ATOM 2032 CA VAL C 34 2.060 16.552 0.587 1.00 0.00 C ATOM 2033 C VAL C 34 3.324 15.733 0.310 1.00 0.00 C ATOM 2034 O VAL C 34 3.553 15.265 -0.809 1.00 0.00 O ATOM 2035 CB VAL C 34 1.101 15.714 1.463 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.078 16.554 1.932 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.610 14.492 0.701 1.00 0.00 C ATOM 0 H VAL C 34 1.021 16.211 -1.197 1.00 0.00 H new ATOM 0 HA VAL C 34 2.345 17.461 1.116 1.00 0.00 H new ATOM 0 HB VAL C 34 1.653 15.378 2.341 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.739 15.943 2.547 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.287 17.397 2.519 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.628 16.925 1.067 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.064 13.915 1.334 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.080 14.811 -0.196 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.462 13.873 0.418 1.00 0.00 H new ATOM 2047 N ILE C 35 4.150 15.607 1.339 1.00 0.00 N ATOM 2048 CA ILE C 35 5.346 14.774 1.307 1.00 0.00 C ATOM 2049 C ILE C 35 5.300 13.757 2.439 1.00 0.00 C ATOM 2050 O ILE C 35 4.567 13.934 3.402 1.00 0.00 O ATOM 2051 CB ILE C 35 6.632 15.615 1.446 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.508 16.580 2.626 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.918 16.369 0.157 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.778 17.337 2.941 1.00 0.00 C ATOM 0 H ILE C 35 4.008 16.085 2.229 1.00 0.00 H new ATOM 0 HA ILE C 35 5.365 14.268 0.342 1.00 0.00 H new ATOM 0 HB ILE C 35 7.470 14.944 1.638 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.714 17.296 2.414 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.204 16.019 3.510 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.829 16.957 0.274 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.047 15.658 -0.659 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.084 17.033 -0.069 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.606 17.999 3.790 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.571 16.631 3.187 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.074 17.928 2.074 1.00 0.00 H new ATOM 2066 N LEU C 36 6.086 12.698 2.323 1.00 0.00 N ATOM 2067 CA LEU C 36 6.015 11.597 3.276 1.00 0.00 C ATOM 2068 C LEU C 36 6.910 11.814 4.481 1.00 0.00 C ATOM 2069 O LEU C 36 7.877 12.573 4.437 1.00 0.00 O ATOM 2070 CB LEU C 36 6.411 10.277 2.614 1.00 0.00 C ATOM 2071 CG LEU C 36 5.579 9.877 1.403 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.304 10.219 0.111 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.245 8.401 1.474 1.00 0.00 C ATOM 0 H LEU C 36 6.778 12.576 1.583 1.00 0.00 H new ATOM 0 HA LEU C 36 4.979 11.557 3.613 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.456 10.342 2.310 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.344 9.483 3.358 1.00 0.00 H new ATOM 0 HG LEU C 36 4.647 10.442 1.412 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.690 9.924 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.488 11.293 0.070 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.254 9.686 0.075 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.650 8.120 0.605 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.167 7.819 1.485 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.678 8.200 2.383 1.00 0.00 H new ATOM 2085 N THR C 37 6.566 11.122 5.553 1.00 0.00 N ATOM 2086 CA THR C 37 7.413 11.035 6.724 1.00 0.00 C ATOM 2087 C THR C 37 8.022 9.636 6.766 1.00 0.00 C ATOM 2088 O THR C 37 7.653 8.790 5.954 1.00 0.00 O ATOM 2089 CB THR C 37 6.620 11.321 8.024 1.00 0.00 C ATOM 2090 OG1 THR C 37 7.482 11.240 9.167 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.461 10.349 8.187 1.00 0.00 C ATOM 0 H THR C 37 5.690 10.605 5.634 1.00 0.00 H new ATOM 0 HA THR C 37 8.197 11.790 6.659 1.00 0.00 H new ATOM 0 HB THR C 37 6.217 12.331 7.949 1.00 0.00 H new ATOM 0 HG1 THR C 37 6.966 11.425 9.979 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.924 10.575 9.108 1.00 0.00 H new ATOM 0 HG22 THR C 37 4.783 10.445 7.339 1.00 0.00 H new ATOM 0 HG23 THR C 37 5.845 9.330 8.231 1.00 0.00 H new ATOM 2099 N ALA C 38 8.932 9.392 7.696 1.00 0.00 N ATOM 2100 CA ALA C 38 9.676 8.132 7.746 1.00 0.00 C ATOM 2101 C ALA C 38 8.751 6.921 7.759 1.00 0.00 C ATOM 2102 O ALA C 38 8.969 5.964 7.014 1.00 0.00 O ATOM 2103 CB ALA C 38 10.596 8.113 8.952 1.00 0.00 C ATOM 0 H ALA C 38 9.178 10.052 8.434 1.00 0.00 H new ATOM 0 HA ALA C 38 10.276 8.069 6.838 1.00 0.00 H new ATOM 0 HB1 ALA C 38 11.143 7.171 8.977 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.302 8.941 8.884 1.00 0.00 H new ATOM 0 HB3 ALA C 38 10.005 8.214 9.862 1.00 0.00 H new ATOM 2109 N GLN C 39 7.724 6.961 8.597 1.00 0.00 N ATOM 2110 CA GLN C 39 6.747 5.882 8.652 1.00 0.00 C ATOM 2111 C GLN C 39 6.109 5.658 7.278 1.00 0.00 C ATOM 2112 O GLN C 39 5.985 4.525 6.811 1.00 0.00 O ATOM 2113 CB GLN C 39 5.665 6.198 9.678 1.00 0.00 C ATOM 2114 CG GLN C 39 4.770 5.011 9.984 1.00 0.00 C ATOM 2115 CD GLN C 39 3.728 5.318 11.035 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.965 6.093 11.959 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.555 4.732 10.880 1.00 0.00 N ATOM 0 H GLN C 39 7.546 7.727 9.247 1.00 0.00 H new ATOM 0 HA GLN C 39 7.265 4.970 8.950 1.00 0.00 H new ATOM 0 HB2 GLN C 39 6.136 6.538 10.601 1.00 0.00 H new ATOM 0 HB3 GLN C 39 5.053 7.022 9.310 1.00 0.00 H new ATOM 0 HG2 GLN C 39 4.273 4.691 9.068 1.00 0.00 H new ATOM 0 HG3 GLN C 39 5.384 4.176 10.321 1.00 0.00 H new ATOM 0 HE21 GLN C 39 2.402 4.095 10.098 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.801 4.916 11.542 1.00 0.00 H new ATOM 2126 N GLY C 40 5.714 6.753 6.637 1.00 0.00 N ATOM 2127 CA GLY C 40 5.142 6.684 5.309 1.00 0.00 C ATOM 2128 C GLY C 40 6.153 6.239 4.272 1.00 0.00 C ATOM 2129 O GLY C 40 5.795 5.628 3.270 1.00 0.00 O ATOM 0 H GLY C 40 5.782 7.696 7.020 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.300 5.992 5.314 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.748 7.662 5.034 1.00 0.00 H new ATOM 2133 N TYR C 41 7.422 6.532 4.518 1.00 0.00 N ATOM 2134 CA TYR C 41 8.487 6.101 3.628 1.00 0.00 C ATOM 2135 C TYR C 41 8.688 4.596 3.704 1.00 0.00 C ATOM 2136 O TYR C 41 9.002 3.957 2.700 1.00 0.00 O ATOM 2137 CB TYR C 41 9.789 6.824 3.986 1.00 0.00 C ATOM 2138 CG TYR C 41 10.047 8.081 3.184 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.667 8.020 1.941 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.677 9.329 3.667 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.908 9.164 1.205 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.914 10.479 2.936 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.529 10.391 1.706 1.00 0.00 C ATOM 2144 OH TYR C 41 10.762 11.533 0.975 1.00 0.00 O ATOM 0 H TYR C 41 7.738 7.067 5.327 1.00 0.00 H new ATOM 0 HA TYR C 41 8.203 6.353 2.606 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.768 7.081 5.045 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.623 6.138 3.841 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.966 7.061 1.544 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.195 9.403 4.631 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.391 9.097 0.241 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.618 11.441 3.327 1.00 0.00 H new ATOM 0 HH TYR C 41 10.433 12.312 1.471 1.00 0.00 H new ATOM 2154 N THR C 42 8.477 4.025 4.878 1.00 0.00 N ATOM 2155 CA THR C 42 8.511 2.577 5.022 1.00 0.00 C ATOM 2156 C THR C 42 7.304 1.934 4.340 1.00 0.00 C ATOM 2157 O THR C 42 7.394 0.837 3.782 1.00 0.00 O ATOM 2158 CB THR C 42 8.533 2.178 6.505 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.704 2.719 7.113 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.517 0.668 6.677 1.00 0.00 C ATOM 0 H THR C 42 8.282 4.536 5.739 1.00 0.00 H new ATOM 0 HA THR C 42 9.422 2.219 4.543 1.00 0.00 H new ATOM 0 HB THR C 42 7.638 2.576 6.984 1.00 0.00 H new ATOM 0 HG1 THR C 42 10.290 1.988 7.402 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.533 0.423 7.739 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.614 0.260 6.224 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.393 0.237 6.192 1.00 0.00 H new ATOM 2168 N LEU C 43 6.191 2.652 4.331 1.00 0.00 N ATOM 2169 CA LEU C 43 4.962 2.127 3.766 1.00 0.00 C ATOM 2170 C LEU C 43 4.911 2.385 2.262 1.00 0.00 C ATOM 2171 O LEU C 43 4.157 1.731 1.552 1.00 0.00 O ATOM 2172 CB LEU C 43 3.736 2.750 4.462 1.00 0.00 C ATOM 2173 CG LEU C 43 3.080 1.909 5.580 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.127 1.393 6.558 1.00 0.00 C ATOM 2175 CD2 LEU C 43 2.049 2.747 6.317 1.00 0.00 C ATOM 0 H LEU C 43 6.116 3.597 4.708 1.00 0.00 H new ATOM 0 HA LEU C 43 4.941 1.050 3.932 1.00 0.00 H new ATOM 0 HB2 LEU C 43 4.034 3.709 4.886 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.981 2.958 3.703 1.00 0.00 H new ATOM 0 HG LEU C 43 2.588 1.051 5.122 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.640 0.804 7.335 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.845 0.769 6.026 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.646 2.236 7.013 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.590 2.149 7.104 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.535 3.617 6.759 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.281 3.077 5.617 1.00 0.00 H new ATOM 2187 N LEU C 44 5.735 3.307 1.760 1.00 0.00 N ATOM 2188 CA LEU C 44 5.750 3.578 0.327 1.00 0.00 C ATOM 2189 C LEU C 44 6.620 2.552 -0.392 1.00 0.00 C ATOM 2190 O LEU C 44 6.254 2.059 -1.450 1.00 0.00 O ATOM 2191 CB LEU C 44 6.201 5.029 0.013 1.00 0.00 C ATOM 2192 CG LEU C 44 7.714 5.297 -0.149 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.215 4.867 -1.524 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.018 6.770 0.048 1.00 0.00 C ATOM 0 H LEU C 44 6.386 3.866 2.312 1.00 0.00 H new ATOM 0 HA LEU C 44 4.729 3.486 -0.044 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.706 5.341 -0.906 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.831 5.674 0.810 1.00 0.00 H new ATOM 0 HG LEU C 44 8.228 4.709 0.611 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.283 5.070 -1.602 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.038 3.800 -1.658 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.682 5.423 -2.296 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.088 6.940 -0.070 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.474 7.356 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.710 7.074 1.048 1.00 0.00 H new ATOM 2206 N ASP C 45 7.757 2.208 0.203 1.00 0.00 N ATOM 2207 CA ASP C 45 8.700 1.289 -0.430 1.00 0.00 C ATOM 2208 C ASP C 45 8.141 -0.121 -0.459 1.00 0.00 C ATOM 2209 O ASP C 45 8.467 -0.921 -1.339 1.00 0.00 O ATOM 2210 CB ASP C 45 10.029 1.306 0.323 1.00 0.00 C ATOM 2211 CG ASP C 45 11.045 0.356 -0.277 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.685 0.737 -1.276 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.201 -0.771 0.242 1.00 0.00 O ATOM 0 H ASP C 45 8.049 2.549 1.119 1.00 0.00 H new ATOM 0 HA ASP C 45 8.863 1.616 -1.457 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.434 2.318 0.317 1.00 0.00 H new ATOM 0 HB3 ASP C 45 9.856 1.038 1.365 1.00 0.00 H new ATOM 2218 N PHE C 46 7.254 -0.404 0.473 1.00 0.00 N ATOM 2219 CA PHE C 46 6.585 -1.686 0.520 1.00 0.00 C ATOM 2220 C PHE C 46 5.536 -1.763 -0.567 1.00 0.00 C ATOM 2221 O PHE C 46 5.407 -2.779 -1.249 1.00 0.00 O ATOM 2222 CB PHE C 46 5.911 -1.830 1.883 1.00 0.00 C ATOM 2223 CG PHE C 46 5.269 -3.160 2.137 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.016 -4.223 2.613 1.00 0.00 C ATOM 2225 CD2 PHE C 46 3.911 -3.340 1.922 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.424 -5.443 2.862 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.316 -4.558 2.171 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.073 -5.609 2.645 1.00 0.00 C ATOM 0 H PHE C 46 6.979 0.242 1.213 1.00 0.00 H new ATOM 0 HA PHE C 46 7.310 -2.485 0.368 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.654 -1.648 2.660 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.152 -1.053 1.980 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.074 -4.096 2.791 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.314 -2.518 1.556 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.018 -6.268 3.227 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.259 -4.689 1.995 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.607 -6.562 2.846 1.00 0.00 H new ATOM 2238 N ILE C 47 4.819 -0.679 -0.764 1.00 0.00 N ATOM 2239 CA ILE C 47 3.759 -0.685 -1.741 1.00 0.00 C ATOM 2240 C ILE C 47 4.320 -0.506 -3.152 1.00 0.00 C ATOM 2241 O ILE C 47 3.738 -0.974 -4.126 1.00 0.00 O ATOM 2242 CB ILE C 47 2.694 0.381 -1.427 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.308 1.781 -1.464 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.089 0.097 -0.061 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.357 2.888 -1.070 1.00 0.00 C ATOM 0 H ILE C 47 4.949 0.203 -0.269 1.00 0.00 H new ATOM 0 HA ILE C 47 3.269 -1.657 -1.692 1.00 0.00 H new ATOM 0 HB ILE C 47 1.910 0.340 -2.183 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.170 1.805 -0.798 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.677 1.976 -2.471 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.334 0.850 0.166 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.627 -0.890 -0.066 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.872 0.128 0.697 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.873 3.847 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.506 2.896 -1.750 1.00 0.00 H new ATOM 0 HD13 ILE C 47 2.006 2.721 -0.052 1.00 0.00 H new ATOM 2257 N GLN C 48 5.468 0.156 -3.250 1.00 0.00 N ATOM 2258 CA GLN C 48 6.251 0.151 -4.469 1.00 0.00 C ATOM 2259 C GLN C 48 6.546 -1.283 -4.875 1.00 0.00 C ATOM 2260 O GLN C 48 6.060 -1.766 -5.878 1.00 0.00 O ATOM 2261 CB GLN C 48 7.572 0.897 -4.251 1.00 0.00 C ATOM 2262 CG GLN C 48 7.421 2.401 -4.104 1.00 0.00 C ATOM 2263 CD GLN C 48 6.766 3.049 -5.309 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.912 2.585 -6.441 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.037 4.124 -5.069 1.00 0.00 N ATOM 0 H GLN C 48 5.874 0.704 -2.492 1.00 0.00 H new ATOM 0 HA GLN C 48 5.685 0.649 -5.256 1.00 0.00 H new ATOM 0 HB2 GLN C 48 8.056 0.503 -3.357 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.236 0.690 -5.090 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.828 2.616 -3.215 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.404 2.846 -3.948 1.00 0.00 H new ATOM 0 HE21 GLN C 48 5.943 4.474 -4.116 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.568 4.604 -5.837 1.00 0.00 H new ATOM 2274 N LYS C 49 7.228 -1.979 -3.991 1.00 0.00 N ATOM 2275 CA LYS C 49 7.861 -3.259 -4.284 1.00 0.00 C ATOM 2276 C LYS C 49 6.862 -4.429 -4.276 1.00 0.00 C ATOM 2277 O LYS C 49 7.238 -5.584 -4.465 1.00 0.00 O ATOM 2278 CB LYS C 49 9.041 -3.408 -3.295 1.00 0.00 C ATOM 2279 CG LYS C 49 9.547 -4.813 -3.019 1.00 0.00 C ATOM 2280 CD LYS C 49 10.967 -4.788 -2.452 1.00 0.00 C ATOM 2281 CE LYS C 49 11.136 -3.767 -1.327 1.00 0.00 C ATOM 2282 NZ LYS C 49 10.608 -4.247 -0.019 1.00 0.00 N ATOM 0 H LYS C 49 7.364 -1.670 -3.028 1.00 0.00 H new ATOM 0 HA LYS C 49 8.247 -3.285 -5.303 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.875 -2.818 -3.674 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.743 -2.965 -2.345 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.880 -5.311 -2.315 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.531 -5.396 -3.940 1.00 0.00 H new ATOM 0 HD2 LYS C 49 11.222 -5.780 -2.078 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.670 -4.559 -3.253 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.193 -3.526 -1.219 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.625 -2.844 -1.602 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 10.339 -3.431 0.567 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 9.774 -4.847 -0.180 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 11.342 -4.798 0.470 1.00 0.00 H new ATOM 2296 N HIS C 50 5.574 -4.149 -4.051 1.00 0.00 N ATOM 2297 CA HIS C 50 4.579 -5.182 -4.378 1.00 0.00 C ATOM 2298 C HIS C 50 3.593 -4.785 -5.479 1.00 0.00 C ATOM 2299 O HIS C 50 2.755 -5.600 -5.865 1.00 0.00 O ATOM 2300 CB HIS C 50 3.807 -5.577 -3.122 1.00 0.00 C ATOM 2301 CG HIS C 50 4.709 -6.033 -2.031 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.623 -7.038 -2.207 1.00 0.00 N ATOM 2303 CD2 HIS C 50 4.900 -5.567 -0.782 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.339 -7.169 -1.118 1.00 0.00 C ATOM 2305 NE2 HIS C 50 5.928 -6.286 -0.231 1.00 0.00 N ATOM 0 H HIS C 50 5.209 -3.276 -3.669 1.00 0.00 H new ATOM 0 HA HIS C 50 5.148 -6.026 -4.769 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.220 -4.726 -2.775 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.102 -6.372 -3.365 1.00 0.00 H new ATOM 0 HD2 HIS C 50 4.346 -4.773 -0.303 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.135 -7.884 -0.971 1.00 0.00 H new ATOM 0 HE2 HIS C 50 6.310 -6.159 0.706 1.00 0.00 H new ATOM 2314 N LEU C 51 3.677 -3.570 -5.998 1.00 0.00 N ATOM 2315 CA LEU C 51 2.829 -3.186 -7.134 1.00 0.00 C ATOM 2316 C LEU C 51 3.673 -2.740 -8.319 1.00 0.00 C ATOM 2317 O LEU C 51 3.516 -3.227 -9.441 1.00 0.00 O ATOM 2318 CB LEU C 51 1.859 -2.045 -6.781 1.00 0.00 C ATOM 2319 CG LEU C 51 0.694 -2.377 -5.828 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.096 -3.588 -6.308 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.188 -2.590 -4.413 1.00 0.00 C ATOM 0 H LEU C 51 4.307 -2.841 -5.665 1.00 0.00 H new ATOM 0 HA LEU C 51 2.253 -4.075 -7.392 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.438 -1.235 -6.337 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.436 -1.662 -7.710 1.00 0.00 H new ATOM 0 HG LEU C 51 0.022 -1.519 -5.830 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -0.909 -3.792 -5.611 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.508 -3.385 -7.297 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.563 -4.455 -6.360 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.344 -2.822 -3.764 1.00 0.00 H new ATOM 0 HD22 LEU C 51 1.897 -3.417 -4.396 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.679 -1.684 -4.059 1.00 0.00 H new ATOM 2333 N ASN C 52 4.580 -1.820 -8.049 1.00 0.00 N ATOM 2334 CA ASN C 52 5.306 -1.106 -9.087 1.00 0.00 C ATOM 2335 C ASN C 52 6.788 -1.476 -9.130 1.00 0.00 C ATOM 2336 O ASN C 52 7.466 -1.234 -10.131 1.00 0.00 O ATOM 2337 CB ASN C 52 5.141 0.393 -8.858 1.00 0.00 C ATOM 2338 CG ASN C 52 4.118 1.011 -9.801 1.00 0.00 C ATOM 2339 OD1 ASN C 52 3.433 1.972 -9.451 1.00 0.00 O ATOM 2340 ND2 ASN C 52 4.022 0.484 -11.015 1.00 0.00 N ATOM 0 H ASN C 52 4.836 -1.545 -7.101 1.00 0.00 H new ATOM 0 HA ASN C 52 4.888 -1.394 -10.052 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.835 0.569 -7.827 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.103 0.887 -8.994 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.366 0.875 -11.690 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.605 -0.313 -11.273 1.00 0.00 H new ATOM 2347 N LYS C 53 7.290 -2.045 -8.055 1.00 0.00 N ATOM 2348 CA LYS C 53 8.654 -2.530 -8.004 1.00 0.00 C ATOM 2349 C LYS C 53 8.660 -4.054 -7.973 1.00 0.00 C ATOM 2350 O LYS C 53 8.867 -4.667 -9.042 1.00 0.00 O ATOM 2351 CB LYS C 53 9.369 -1.988 -6.768 1.00 0.00 C ATOM 2352 CG LYS C 53 10.386 -0.910 -7.068 1.00 0.00 C ATOM 2353 CD LYS C 53 11.380 -0.782 -5.926 1.00 0.00 C ATOM 2354 CE LYS C 53 10.865 0.091 -4.799 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.925 0.333 -3.788 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.452 -4.629 -6.892 1.00 0.00 O ATOM 0 H LYS C 53 6.765 -2.185 -7.192 1.00 0.00 H new ATOM 0 HA LYS C 53 9.180 -2.183 -8.893 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.626 -1.590 -6.077 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.868 -2.813 -6.259 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.914 -1.147 -7.992 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.879 0.042 -7.225 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.610 -1.774 -5.536 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.313 -0.365 -6.306 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.517 1.042 -5.201 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.008 -0.388 -4.325 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.492 0.675 -2.906 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.436 -0.554 -3.602 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.591 1.047 -4.147 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -20.450 -4.174 -2.789 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 14.064 -15.505 -3.234 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.626 19.774 -2.802 1.00 0.00 ZN