USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1185 hydrogens (30 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 1 FME CE :methyl -130:sc= -0.206 (180deg=-1.87) USER MOD Set 1.2: C 42 THR OG1 : rot 69:sc= 0.772 USER MOD Set 2.1: A 42 THR OG1 : rot 72:sc= 0.821 USER MOD Set 2.2: C 1 FME CE :methyl -129:sc= -0.193 (180deg=-2.06) USER MOD Set 3.1: A 1 FME CE :methyl -131:sc= -0.21 (180deg=-1.64) USER MOD Set 3.2: B 42 THR OG1 : rot 71:sc= 0.839 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00188 USER MOD Single : A 14 LYS NZ :NH3+ -168:sc= -0.0542 (180deg=-0.306) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -121:sc= -0.225! (180deg=-2.06) USER MOD Single : A 37 THR OG1 : rot -160:sc= -0.0126 USER MOD Single : A 39 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.55) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0.132 K(o=0.13,f=-0.78) USER MOD Single : A 49 LYS NZ :NH3+ -157:sc= 0.952 (180deg=0.573) USER MOD Single : A 50 HIS : +bothHN:sc= -0.668 K(o=-0.67,f=-12!) USER MOD Single : A 52 ASN :FLIP amide:sc= -0.636 F(o=-1.7,f=-0.64) USER MOD Single : A 53 LYS NZ :NH3+ -177:sc= 1.19 (180deg=1.16) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.101 USER MOD Single : B 14 LYS NZ :NH3+ -171:sc= -0.0134 (180deg=-0.14) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 142:sc= -0.167 (180deg=-2.22) USER MOD Single : B 37 THR OG1 : rot -163:sc= -0.309 USER MOD Single : B 39 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.57) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= 0.217 K(o=0.22,f=-0.73) USER MOD Single : B 49 LYS NZ :NH3+ -152:sc= 1.11 (180deg=0.433) USER MOD Single : B 50 HIS : +bothHN:sc= -0.588 K(o=-0.59,f=-11!) USER MOD Single : B 52 ASN :FLIP amide:sc= -0.813 F(o=-1.9,f=-0.81) USER MOD Single : B 53 LYS NZ :NH3+ 169:sc= 1.19 (180deg=1.14) USER MOD Single : C 5 THR OG1 : rot 180:sc=-0.00553 USER MOD Single : C 14 LYS NZ :NH3+ -167:sc= -0.0511 (180deg=-0.195) USER MOD Single : C 24 THR OG1 : rot 86:sc= 0.139 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ -101:sc=-0.000427 (180deg=-1.97) USER MOD Single : C 37 THR OG1 : rot -161:sc= -0.219 USER MOD Single : C 39 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.56) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 48 GLN : amide:sc= 0.144 K(o=0.14,f=-0.79) USER MOD Single : C 49 LYS NZ :NH3+ -156:sc= 0.81 (180deg=0.417) USER MOD Single : C 50 HIS : +bothHN:sc= -0.683 K(o=-0.68,f=-12!) USER MOD Single : C 52 ASN :FLIP amide:sc= -0.747 F(o=-1.6,f=-0.75) USER MOD Single : C 53 LYS NZ :NH3+ -144:sc= 1.09 (180deg=0.877) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 1.331 -11.600 12.712 1.00 0.00 N HETATM 2 CN FME A 1 2.396 -10.841 12.892 1.00 0.00 C HETATM 3 O1 FME A 1 3.483 -11.301 13.238 1.00 0.00 O HETATM 4 CA FME A 1 0.077 -11.009 12.278 1.00 0.00 C HETATM 5 CB FME A 1 -0.821 -12.051 11.607 1.00 0.00 C HETATM 6 CG FME A 1 -2.162 -11.487 11.164 1.00 0.00 C HETATM 7 SD FME A 1 -3.040 -12.561 10.014 1.00 0.00 S HETATM 8 CE FME A 1 -1.929 -12.521 8.607 1.00 0.00 C HETATM 9 C FME A 1 -0.649 -10.352 13.444 1.00 0.00 C HETATM 10 O FME A 1 -1.373 -11.003 14.196 1.00 0.00 O HETATM 0 HG3 FME A 1 -2.786 -11.319 12.042 1.00 0.00 H new HETATM 0 HG2 FME A 1 -2.003 -10.516 10.695 1.00 0.00 H new HETATM 0 HE3 FME A 1 -2.497 -12.311 7.701 1.00 0.00 H new HETATM 0 HE2 FME A 1 -1.182 -11.742 8.756 1.00 0.00 H new HETATM 0 HE1 FME A 1 -1.432 -13.486 8.508 1.00 0.00 H new HETATM 0 HCN FME A 1 2.309 -9.767 12.728 1.00 0.00 H new HETATM 0 HB3 FME A 1 -0.304 -12.464 10.741 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.991 -12.875 12.300 1.00 0.00 H new HETATM 0 HA FME A 1 0.312 -10.239 11.543 1.00 0.00 H new HETATM 0 H FME A 1 1.389 -12.605 12.878 1.00 0.00 H new ATOM 21 N VAL A 2 -0.428 -9.056 13.593 1.00 0.00 N ATOM 22 CA VAL A 2 -1.143 -8.260 14.581 1.00 0.00 C ATOM 23 C VAL A 2 -2.165 -7.390 13.869 1.00 0.00 C ATOM 24 O VAL A 2 -2.836 -6.547 14.464 1.00 0.00 O ATOM 25 CB VAL A 2 -0.174 -7.384 15.397 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.812 -8.263 16.144 1.00 0.00 C ATOM 27 CG2 VAL A 2 0.561 -6.398 14.497 1.00 0.00 C ATOM 0 H VAL A 2 0.246 -8.528 13.038 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.647 -8.931 15.277 1.00 0.00 H new ATOM 0 HB VAL A 2 -0.752 -6.808 16.119 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.494 -7.637 16.719 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.270 -8.925 16.820 1.00 0.00 H new ATOM 0 HG13 VAL A 2 1.381 -8.859 15.431 1.00 0.00 H new ATOM 0 HG21 VAL A 2 1.239 -5.792 15.098 1.00 0.00 H new ATOM 0 HG22 VAL A 2 1.132 -6.946 13.747 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.162 -5.750 14.001 1.00 0.00 H new ATOM 37 N ILE A 3 -2.264 -7.631 12.574 1.00 0.00 N ATOM 38 CA ILE A 3 -3.203 -6.946 11.718 1.00 0.00 C ATOM 39 C ILE A 3 -3.808 -7.952 10.750 1.00 0.00 C ATOM 40 O ILE A 3 -3.089 -8.738 10.139 1.00 0.00 O ATOM 41 CB ILE A 3 -2.525 -5.791 10.937 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.558 -5.035 10.098 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.392 -6.317 10.056 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.001 -3.806 9.413 1.00 0.00 C ATOM 0 H ILE A 3 -1.687 -8.316 12.086 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.984 -6.504 12.337 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.093 -5.098 11.659 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -3.964 -5.709 9.343 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.388 -4.738 10.740 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.933 -5.487 9.519 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.642 -6.804 10.680 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.791 -7.036 9.340 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.790 -3.322 8.837 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.621 -3.112 10.163 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.191 -4.098 8.745 1.00 0.00 H new ATOM 56 N ALA A 4 -5.121 -7.966 10.653 1.00 0.00 N ATOM 57 CA ALA A 4 -5.793 -8.881 9.754 1.00 0.00 C ATOM 58 C ALA A 4 -6.637 -8.112 8.755 1.00 0.00 C ATOM 59 O ALA A 4 -7.143 -7.028 9.055 1.00 0.00 O ATOM 60 CB ALA A 4 -6.647 -9.859 10.540 1.00 0.00 C ATOM 0 H ALA A 4 -5.743 -7.356 11.184 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.042 -9.448 9.203 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.146 -10.541 9.852 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.014 -10.429 11.220 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.394 -9.310 11.113 1.00 0.00 H new ATOM 66 N THR A 5 -6.776 -8.682 7.564 1.00 0.00 N ATOM 67 CA THR A 5 -7.550 -8.070 6.493 1.00 0.00 C ATOM 68 C THR A 5 -9.015 -7.918 6.902 1.00 0.00 C ATOM 69 O THR A 5 -9.757 -7.147 6.308 1.00 0.00 O ATOM 70 CB THR A 5 -7.460 -8.912 5.200 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.104 -9.320 4.973 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.947 -8.121 3.994 1.00 0.00 C ATOM 0 H THR A 5 -6.357 -9.578 7.315 1.00 0.00 H new ATOM 0 HA THR A 5 -7.129 -7.083 6.303 1.00 0.00 H new ATOM 0 HB THR A 5 -8.097 -9.787 5.328 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.056 -9.854 4.153 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.872 -8.739 3.099 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.986 -7.828 4.146 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.333 -7.229 3.872 1.00 0.00 H new ATOM 80 N ASP A 6 -9.400 -8.617 7.965 1.00 0.00 N ATOM 81 CA ASP A 6 -10.782 -8.627 8.425 1.00 0.00 C ATOM 82 C ASP A 6 -11.082 -7.392 9.267 1.00 0.00 C ATOM 83 O ASP A 6 -12.230 -7.151 9.641 1.00 0.00 O ATOM 84 CB ASP A 6 -11.053 -9.885 9.260 1.00 0.00 C ATOM 85 CG ASP A 6 -10.866 -11.171 8.479 1.00 0.00 C ATOM 86 OD1 ASP A 6 -9.706 -11.586 8.273 1.00 0.00 O ATOM 87 OD2 ASP A 6 -11.879 -11.781 8.079 1.00 0.00 O ATOM 0 H ASP A 6 -8.768 -9.187 8.527 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.429 -8.624 7.548 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.387 -9.891 10.123 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.072 -9.846 9.644 1.00 0.00 H new ATOM 92 N ASP A 7 -10.046 -6.621 9.579 1.00 0.00 N ATOM 93 CA ASP A 7 -10.219 -5.384 10.336 1.00 0.00 C ATOM 94 C ASP A 7 -10.117 -4.167 9.427 1.00 0.00 C ATOM 95 O ASP A 7 -10.510 -3.061 9.803 1.00 0.00 O ATOM 96 CB ASP A 7 -9.149 -5.268 11.430 1.00 0.00 C ATOM 97 CG ASP A 7 -9.225 -6.366 12.467 1.00 0.00 C ATOM 98 OD1 ASP A 7 -8.591 -7.424 12.267 1.00 0.00 O ATOM 99 OD2 ASP A 7 -9.893 -6.165 13.502 1.00 0.00 O ATOM 0 H ASP A 7 -9.081 -6.828 9.321 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.210 -5.415 10.788 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.163 -5.285 10.966 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.251 -4.303 11.926 1.00 0.00 H new ATOM 104 N LEU A 8 -9.586 -4.363 8.229 1.00 0.00 N ATOM 105 CA LEU A 8 -9.407 -3.252 7.300 1.00 0.00 C ATOM 106 C LEU A 8 -10.325 -3.391 6.102 1.00 0.00 C ATOM 107 O LEU A 8 -10.563 -2.425 5.376 1.00 0.00 O ATOM 108 CB LEU A 8 -7.952 -3.134 6.850 1.00 0.00 C ATOM 109 CG LEU A 8 -7.003 -2.541 7.892 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.690 -3.548 8.988 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.728 -2.052 7.233 1.00 0.00 C ATOM 0 H LEU A 8 -9.274 -5.269 7.878 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.672 -2.336 7.829 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.591 -4.124 6.573 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.913 -2.518 5.952 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.502 -1.689 8.355 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.013 -3.097 9.714 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.614 -3.842 9.487 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.219 -4.428 8.550 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.065 -1.633 7.990 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.232 -2.886 6.737 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.970 -1.285 6.498 1.00 0.00 H new ATOM 123 N GLU A 9 -10.847 -4.590 5.919 1.00 0.00 N ATOM 124 CA GLU A 9 -11.842 -4.848 4.899 1.00 0.00 C ATOM 125 C GLU A 9 -12.890 -5.800 5.457 1.00 0.00 C ATOM 126 O GLU A 9 -12.576 -6.744 6.181 1.00 0.00 O ATOM 127 CB GLU A 9 -11.234 -5.403 3.600 1.00 0.00 C ATOM 128 CG GLU A 9 -10.372 -4.392 2.850 1.00 0.00 C ATOM 129 CD GLU A 9 -10.633 -4.366 1.352 1.00 0.00 C ATOM 130 OE1 GLU A 9 -10.096 -5.225 0.621 1.00 0.00 O ATOM 131 OE2 GLU A 9 -11.364 -3.465 0.881 1.00 0.00 O ATOM 0 H GLU A 9 -10.593 -5.409 6.472 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.305 -3.898 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.630 -6.279 3.836 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.039 -5.738 2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.552 -3.398 3.260 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.321 -4.623 3.024 1.00 0.00 H new ATOM 138 N VAL A 10 -14.128 -5.526 5.125 1.00 0.00 N ATOM 139 CA VAL A 10 -15.257 -6.277 5.627 1.00 0.00 C ATOM 140 C VAL A 10 -16.170 -6.602 4.456 1.00 0.00 C ATOM 141 O VAL A 10 -16.227 -5.847 3.488 1.00 0.00 O ATOM 142 CB VAL A 10 -16.019 -5.472 6.712 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.496 -4.133 6.166 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.190 -6.267 7.271 1.00 0.00 C ATOM 0 H VAL A 10 -14.385 -4.768 4.492 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.909 -7.198 6.094 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.321 -5.281 7.527 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.027 -3.590 6.948 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.638 -3.548 5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.166 -4.302 5.323 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.703 -5.675 8.029 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.885 -6.506 6.466 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.822 -7.190 7.719 1.00 0.00 H new ATOM 154 N ALA A 11 -16.860 -7.726 4.519 1.00 0.00 N ATOM 155 CA ALA A 11 -17.695 -8.155 3.414 1.00 0.00 C ATOM 156 C ALA A 11 -18.844 -7.181 3.184 1.00 0.00 C ATOM 157 O ALA A 11 -19.497 -6.729 4.130 1.00 0.00 O ATOM 158 CB ALA A 11 -18.205 -9.559 3.694 1.00 0.00 C ATOM 0 H ALA A 11 -16.859 -8.356 5.321 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.104 -8.168 2.498 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.834 -9.889 2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.360 -10.239 3.801 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.788 -9.557 4.615 1.00 0.00 H new ATOM 164 N CYS A 12 -19.064 -6.851 1.906 1.00 0.00 N ATOM 165 CA CYS A 12 -19.990 -5.805 1.477 1.00 0.00 C ATOM 166 C CYS A 12 -21.450 -6.090 1.850 1.00 0.00 C ATOM 167 O CYS A 12 -21.782 -7.193 2.270 1.00 0.00 O ATOM 168 CB CYS A 12 -19.897 -5.701 -0.049 1.00 0.00 C ATOM 169 SG CYS A 12 -19.573 -4.049 -0.690 1.00 0.00 S ATOM 0 H CYS A 12 -18.593 -7.314 1.129 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.705 -4.883 1.984 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.107 -6.368 -0.395 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.831 -6.063 -0.479 1.00 0.00 H new ATOM 174 N PRO A 13 -22.341 -5.090 1.676 1.00 0.00 N ATOM 175 CA PRO A 13 -23.790 -5.261 1.864 1.00 0.00 C ATOM 176 C PRO A 13 -24.360 -6.508 1.178 1.00 0.00 C ATOM 177 O PRO A 13 -25.182 -7.226 1.747 1.00 0.00 O ATOM 178 CB PRO A 13 -24.351 -4.010 1.189 1.00 0.00 C ATOM 179 CG PRO A 13 -23.326 -2.962 1.419 1.00 0.00 C ATOM 180 CD PRO A 13 -22.004 -3.684 1.344 1.00 0.00 C ATOM 0 HA PRO A 13 -24.045 -5.387 2.916 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.515 -4.175 0.124 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.311 -3.725 1.619 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.390 -2.176 0.666 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.460 -2.485 2.390 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.562 -3.604 0.351 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.283 -3.270 2.049 1.00 0.00 H new ATOM 188 N LYS A 14 -23.895 -6.775 -0.043 1.00 0.00 N ATOM 189 CA LYS A 14 -24.553 -7.757 -0.901 1.00 0.00 C ATOM 190 C LYS A 14 -23.584 -8.516 -1.815 1.00 0.00 C ATOM 191 O LYS A 14 -23.861 -9.648 -2.204 1.00 0.00 O ATOM 192 CB LYS A 14 -25.596 -7.045 -1.771 1.00 0.00 C ATOM 193 CG LYS A 14 -26.378 -7.978 -2.688 1.00 0.00 C ATOM 194 CD LYS A 14 -26.690 -7.311 -4.024 1.00 0.00 C ATOM 195 CE LYS A 14 -27.511 -8.221 -4.926 1.00 0.00 C ATOM 196 NZ LYS A 14 -26.883 -9.560 -5.090 1.00 0.00 N ATOM 0 H LYS A 14 -23.075 -6.330 -0.455 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.014 -8.492 -0.241 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.296 -6.518 -1.123 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.095 -6.291 -2.378 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.803 -8.888 -2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.307 -8.274 -2.202 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.235 -6.383 -3.850 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -25.759 -7.045 -4.525 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.511 -8.339 -4.508 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.627 -7.753 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -27.356 -10.073 -5.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -25.875 -9.445 -5.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -26.979 -10.099 -4.206 1.00 0.00 H new ATOM 210 N CYS A 15 -22.455 -7.917 -2.188 1.00 0.00 N ATOM 211 CA CYS A 15 -21.649 -8.522 -3.251 1.00 0.00 C ATOM 212 C CYS A 15 -20.279 -9.003 -2.813 1.00 0.00 C ATOM 213 O CYS A 15 -19.314 -8.880 -3.569 1.00 0.00 O ATOM 214 CB CYS A 15 -21.415 -7.462 -4.318 1.00 0.00 C ATOM 215 SG CYS A 15 -20.609 -5.967 -3.687 1.00 0.00 S ATOM 0 H CYS A 15 -22.087 -7.052 -1.792 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.206 -9.393 -3.596 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -20.803 -7.887 -5.113 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.372 -7.189 -4.764 1.00 0.00 H new ATOM 220 N GLU A 16 -20.206 -9.637 -1.668 1.00 0.00 N ATOM 221 CA GLU A 16 -18.948 -10.133 -1.135 1.00 0.00 C ATOM 222 C GLU A 16 -18.710 -11.540 -1.632 1.00 0.00 C ATOM 223 O GLU A 16 -18.021 -12.334 -0.998 1.00 0.00 O ATOM 224 CB GLU A 16 -19.023 -10.167 0.396 1.00 0.00 C ATOM 225 CG GLU A 16 -20.276 -9.537 0.982 1.00 0.00 C ATOM 226 CD GLU A 16 -21.460 -10.486 0.943 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.081 -10.612 -0.126 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.765 -11.119 1.974 1.00 0.00 O ATOM 0 H GLU A 16 -21.014 -9.827 -1.075 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.139 -9.479 -1.459 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.965 -11.204 0.727 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.151 -9.654 0.801 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.084 -9.239 2.013 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.519 -8.630 0.428 1.00 0.00 H new ATOM 235 N ARG A 17 -19.276 -11.836 -2.784 1.00 0.00 N ATOM 236 CA ARG A 17 -19.389 -13.188 -3.253 1.00 0.00 C ATOM 237 C ARG A 17 -19.282 -13.161 -4.776 1.00 0.00 C ATOM 238 O ARG A 17 -18.966 -14.163 -5.415 1.00 0.00 O ATOM 239 CB ARG A 17 -20.732 -13.776 -2.813 1.00 0.00 C ATOM 240 CG ARG A 17 -21.930 -13.028 -3.386 1.00 0.00 C ATOM 241 CD ARG A 17 -23.218 -13.369 -2.656 1.00 0.00 C ATOM 242 NE ARG A 17 -23.248 -12.810 -1.306 1.00 0.00 N ATOM 243 CZ ARG A 17 -24.088 -13.204 -0.352 1.00 0.00 C ATOM 244 NH1 ARG A 17 -25.005 -14.131 -0.605 1.00 0.00 N ATOM 245 NH2 ARG A 17 -24.022 -12.649 0.850 1.00 0.00 N ATOM 0 H ARG A 17 -19.669 -11.140 -3.417 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.598 -13.812 -2.837 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.783 -14.820 -3.121 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.789 -13.761 -1.725 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.751 -11.955 -3.323 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.037 -13.271 -4.443 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -24.068 -12.990 -3.224 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.328 -14.452 -2.602 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.583 -12.071 -1.081 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -25.068 -14.545 -1.535 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.646 -14.429 0.131 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -23.330 -11.924 1.040 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -24.663 -12.947 1.585 1.00 0.00 H new ATOM 259 N ALA A 18 -19.559 -11.975 -5.346 1.00 0.00 N ATOM 260 CA ALA A 18 -19.660 -11.834 -6.796 1.00 0.00 C ATOM 261 C ALA A 18 -18.899 -10.621 -7.323 1.00 0.00 C ATOM 262 O ALA A 18 -18.357 -10.651 -8.425 1.00 0.00 O ATOM 263 CB ALA A 18 -21.121 -11.753 -7.203 1.00 0.00 C ATOM 0 H ALA A 18 -19.714 -11.112 -4.824 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.198 -12.715 -7.241 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.192 -11.648 -8.286 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.636 -12.662 -6.892 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.585 -10.891 -6.724 1.00 0.00 H new ATOM 269 N GLY A 19 -18.851 -9.557 -6.527 1.00 0.00 N ATOM 270 CA GLY A 19 -18.163 -8.352 -6.949 1.00 0.00 C ATOM 271 C GLY A 19 -19.040 -7.416 -7.763 1.00 0.00 C ATOM 272 O GLY A 19 -18.535 -6.555 -8.475 1.00 0.00 O ATOM 0 H GLY A 19 -19.275 -9.508 -5.601 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.797 -7.823 -6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.290 -8.628 -7.541 1.00 0.00 H new ATOM 276 N GLU A 20 -20.353 -7.535 -7.612 1.00 0.00 N ATOM 277 CA GLU A 20 -21.278 -6.751 -8.424 1.00 0.00 C ATOM 278 C GLU A 20 -22.543 -6.413 -7.649 1.00 0.00 C ATOM 279 O GLU A 20 -22.875 -7.064 -6.664 1.00 0.00 O ATOM 280 CB GLU A 20 -21.658 -7.506 -9.699 1.00 0.00 C ATOM 281 CG GLU A 20 -22.246 -8.881 -9.428 1.00 0.00 C ATOM 282 CD GLU A 20 -23.363 -9.242 -10.381 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.534 -8.940 -10.060 1.00 0.00 O ATOM 284 OE2 GLU A 20 -23.083 -9.840 -11.441 1.00 0.00 O ATOM 0 H GLU A 20 -20.800 -8.161 -6.941 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.768 -5.825 -8.690 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.379 -6.914 -10.263 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -20.774 -7.613 -10.327 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.457 -9.629 -9.502 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.623 -8.914 -8.406 1.00 0.00 H new ATOM 291 N ILE A 21 -23.236 -5.391 -8.104 1.00 0.00 N ATOM 292 CA ILE A 21 -24.531 -5.026 -7.566 1.00 0.00 C ATOM 293 C ILE A 21 -25.498 -4.913 -8.728 1.00 0.00 C ATOM 294 O ILE A 21 -25.420 -3.967 -9.508 1.00 0.00 O ATOM 295 CB ILE A 21 -24.509 -3.684 -6.788 1.00 0.00 C ATOM 296 CG1 ILE A 21 -23.624 -3.777 -5.539 1.00 0.00 C ATOM 297 CG2 ILE A 21 -25.923 -3.265 -6.399 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.127 -4.742 -4.484 1.00 0.00 C ATOM 0 H ILE A 21 -22.916 -4.787 -8.861 1.00 0.00 H new ATOM 0 HA ILE A 21 -24.833 -5.795 -6.855 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.086 -2.927 -7.448 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -22.621 -4.079 -5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.538 -2.785 -5.095 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -25.886 -2.322 -5.854 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.526 -3.141 -7.298 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.369 -4.032 -5.766 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.441 -4.745 -3.637 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.117 -4.431 -4.149 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.185 -5.745 -4.907 1.00 0.00 H new ATOM 310 N GLU A 22 -26.377 -5.894 -8.852 1.00 0.00 N ATOM 311 CA GLU A 22 -27.341 -5.927 -9.947 1.00 0.00 C ATOM 312 C GLU A 22 -26.639 -5.972 -11.299 1.00 0.00 C ATOM 313 O GLU A 22 -26.931 -5.163 -12.183 1.00 0.00 O ATOM 314 CB GLU A 22 -28.213 -4.681 -9.877 1.00 0.00 C ATOM 315 CG GLU A 22 -29.593 -4.864 -10.475 1.00 0.00 C ATOM 316 CD GLU A 22 -30.332 -6.042 -9.870 1.00 0.00 C ATOM 317 OE1 GLU A 22 -31.010 -5.861 -8.836 1.00 0.00 O ATOM 318 OE2 GLU A 22 -30.229 -7.159 -10.420 1.00 0.00 O ATOM 0 H GLU A 22 -26.445 -6.682 -8.207 1.00 0.00 H new ATOM 0 HA GLU A 22 -27.949 -6.826 -9.846 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.316 -4.380 -8.835 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -27.708 -3.866 -10.396 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.176 -3.956 -10.323 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -29.504 -5.008 -11.552 1.00 0.00 H new ATOM 325 N GLY A 23 -25.692 -6.889 -11.460 1.00 0.00 N ATOM 326 CA GLY A 23 -24.948 -6.963 -12.701 1.00 0.00 C ATOM 327 C GLY A 23 -24.104 -5.739 -12.949 1.00 0.00 C ATOM 328 O GLY A 23 -23.428 -5.629 -13.971 1.00 0.00 O ATOM 0 H GLY A 23 -25.428 -7.579 -10.757 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.306 -7.844 -12.683 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -25.644 -7.093 -13.530 1.00 0.00 H new ATOM 332 N THR A 24 -24.131 -4.832 -12.003 1.00 0.00 N ATOM 333 CA THR A 24 -23.592 -3.510 -12.184 1.00 0.00 C ATOM 334 C THR A 24 -22.466 -3.236 -11.172 1.00 0.00 C ATOM 335 O THR A 24 -22.492 -3.759 -10.058 1.00 0.00 O ATOM 336 CB THR A 24 -24.789 -2.558 -12.029 1.00 0.00 C ATOM 337 OG1 THR A 24 -25.480 -2.462 -13.279 1.00 0.00 O ATOM 338 CG2 THR A 24 -24.421 -1.177 -11.516 1.00 0.00 C ATOM 0 H THR A 24 -24.531 -4.994 -11.079 1.00 0.00 H new ATOM 0 HA THR A 24 -23.127 -3.376 -13.161 1.00 0.00 H new ATOM 0 HB THR A 24 -25.436 -2.987 -11.264 1.00 0.00 H new ATOM 0 HG1 THR A 24 -26.245 -1.857 -13.184 1.00 0.00 H new ATOM 0 HG21 THR A 24 -25.321 -0.567 -11.435 1.00 0.00 H new ATOM 0 HG22 THR A 24 -23.953 -1.266 -10.535 1.00 0.00 H new ATOM 0 HG23 THR A 24 -23.724 -0.705 -12.209 1.00 0.00 H new ATOM 346 N PRO A 25 -21.435 -2.455 -11.569 1.00 0.00 N ATOM 347 CA PRO A 25 -20.270 -2.165 -10.716 1.00 0.00 C ATOM 348 C PRO A 25 -20.667 -1.596 -9.352 1.00 0.00 C ATOM 349 O PRO A 25 -21.451 -0.652 -9.257 1.00 0.00 O ATOM 350 CB PRO A 25 -19.464 -1.138 -11.527 1.00 0.00 C ATOM 351 CG PRO A 25 -20.424 -0.617 -12.542 1.00 0.00 C ATOM 352 CD PRO A 25 -21.319 -1.778 -12.870 1.00 0.00 C ATOM 0 HA PRO A 25 -19.706 -3.069 -10.485 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.089 -0.337 -10.890 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.598 -1.600 -12.002 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -20.997 0.223 -12.148 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -19.903 -0.259 -13.430 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -22.288 -1.452 -13.247 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -20.883 -2.427 -13.630 1.00 0.00 H new ATOM 360 N CYS A 26 -20.110 -2.188 -8.301 1.00 0.00 N ATOM 361 CA CYS A 26 -20.525 -1.897 -6.937 1.00 0.00 C ATOM 362 C CYS A 26 -19.863 -0.641 -6.356 1.00 0.00 C ATOM 363 O CYS A 26 -18.643 -0.497 -6.407 1.00 0.00 O ATOM 364 CB CYS A 26 -20.212 -3.103 -6.058 1.00 0.00 C ATOM 365 SG CYS A 26 -20.622 -2.877 -4.294 1.00 0.00 S ATOM 0 H CYS A 26 -19.363 -2.879 -8.371 1.00 0.00 H new ATOM 0 HA CYS A 26 -21.596 -1.697 -6.958 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -20.759 -3.966 -6.438 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.151 -3.335 -6.145 1.00 0.00 H new ATOM 370 N PRO A 27 -20.695 0.228 -5.734 1.00 0.00 N ATOM 371 CA PRO A 27 -20.316 1.526 -5.142 1.00 0.00 C ATOM 372 C PRO A 27 -18.892 1.638 -4.586 1.00 0.00 C ATOM 373 O PRO A 27 -18.083 2.429 -5.067 1.00 0.00 O ATOM 374 CB PRO A 27 -21.309 1.633 -3.984 1.00 0.00 C ATOM 375 CG PRO A 27 -22.549 0.936 -4.442 1.00 0.00 C ATOM 376 CD PRO A 27 -22.150 0.015 -5.582 1.00 0.00 C ATOM 0 HA PRO A 27 -20.340 2.306 -5.903 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -20.910 1.168 -3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -21.514 2.675 -3.740 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -22.995 0.367 -3.626 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.296 1.657 -4.773 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.377 -1.026 -5.350 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -22.686 0.262 -6.499 1.00 0.00 H new ATOM 384 N ALA A 28 -18.589 0.832 -3.576 1.00 0.00 N ATOM 385 CA ALA A 28 -17.410 1.069 -2.747 1.00 0.00 C ATOM 386 C ALA A 28 -16.412 -0.083 -2.793 1.00 0.00 C ATOM 387 O ALA A 28 -15.345 -0.013 -2.189 1.00 0.00 O ATOM 388 CB ALA A 28 -17.836 1.343 -1.313 1.00 0.00 C ATOM 0 H ALA A 28 -19.138 0.014 -3.311 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.898 1.941 -3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -16.953 1.519 -0.699 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.478 2.223 -1.286 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.382 0.483 -0.925 1.00 0.00 H new ATOM 394 N CYS A 29 -16.745 -1.152 -3.502 1.00 0.00 N ATOM 395 CA CYS A 29 -15.800 -2.260 -3.579 1.00 0.00 C ATOM 396 C CYS A 29 -15.426 -2.612 -5.007 1.00 0.00 C ATOM 397 O CYS A 29 -14.613 -3.505 -5.206 1.00 0.00 O ATOM 398 CB CYS A 29 -16.355 -3.504 -2.878 1.00 0.00 C ATOM 399 SG CYS A 29 -17.821 -4.247 -3.665 1.00 0.00 S ATOM 0 H CYS A 29 -17.620 -1.277 -4.011 1.00 0.00 H new ATOM 0 HA CYS A 29 -14.897 -1.924 -3.070 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.568 -4.256 -2.830 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.608 -3.241 -1.851 1.00 0.00 H new ATOM 404 N SER A 30 -16.026 -1.915 -5.969 1.00 0.00 N ATOM 405 CA SER A 30 -15.629 -1.974 -7.387 1.00 0.00 C ATOM 406 C SER A 30 -15.263 -3.383 -7.895 1.00 0.00 C ATOM 407 O SER A 30 -14.417 -3.524 -8.783 1.00 0.00 O ATOM 408 CB SER A 30 -14.454 -1.020 -7.601 1.00 0.00 C ATOM 409 OG SER A 30 -14.765 0.271 -7.106 1.00 0.00 O ATOM 0 H SER A 30 -16.809 -1.286 -5.792 1.00 0.00 H new ATOM 0 HA SER A 30 -16.501 -1.678 -7.970 1.00 0.00 H new ATOM 0 HB2 SER A 30 -13.568 -1.406 -7.096 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.215 -0.961 -8.663 1.00 0.00 H new ATOM 0 HG SER A 30 -14.002 0.869 -7.249 1.00 0.00 H new ATOM 415 N GLY A 31 -15.899 -4.413 -7.345 1.00 0.00 N ATOM 416 CA GLY A 31 -15.668 -5.763 -7.831 1.00 0.00 C ATOM 417 C GLY A 31 -14.637 -6.553 -7.032 1.00 0.00 C ATOM 418 O GLY A 31 -14.008 -7.459 -7.574 1.00 0.00 O ATOM 0 H GLY A 31 -16.566 -4.339 -6.577 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.613 -6.307 -7.820 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.342 -5.711 -8.870 1.00 0.00 H new ATOM 422 N LYS A 32 -14.453 -6.237 -5.747 1.00 0.00 N ATOM 423 CA LYS A 32 -13.546 -7.017 -4.901 1.00 0.00 C ATOM 424 C LYS A 32 -14.339 -8.002 -4.036 1.00 0.00 C ATOM 425 O LYS A 32 -13.890 -9.108 -3.766 1.00 0.00 O ATOM 426 CB LYS A 32 -12.734 -6.099 -3.981 1.00 0.00 C ATOM 427 CG LYS A 32 -11.983 -5.001 -4.714 1.00 0.00 C ATOM 428 CD LYS A 32 -11.094 -4.183 -3.782 1.00 0.00 C ATOM 429 CE LYS A 32 -11.858 -3.593 -2.602 1.00 0.00 C ATOM 430 NZ LYS A 32 -11.915 -4.526 -1.440 1.00 0.00 N ATOM 0 H LYS A 32 -14.913 -5.458 -5.275 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.868 -7.563 -5.557 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.406 -5.643 -3.254 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.020 -6.702 -3.420 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.371 -5.445 -5.499 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.698 -4.339 -5.203 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.289 -4.815 -3.408 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.629 -3.376 -4.347 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.383 -2.661 -2.294 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -12.872 -3.345 -2.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.908 -4.730 -1.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.427 -5.412 -1.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.450 -4.088 -0.620 1.00 0.00 H new ATOM 444 N GLY A 33 -15.525 -7.570 -3.597 1.00 0.00 N ATOM 445 CA GLY A 33 -16.340 -8.363 -2.704 1.00 0.00 C ATOM 446 C GLY A 33 -16.421 -7.731 -1.327 1.00 0.00 C ATOM 447 O GLY A 33 -17.494 -7.650 -0.732 1.00 0.00 O ATOM 0 H GLY A 33 -15.933 -6.671 -3.853 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.343 -8.467 -3.119 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.923 -9.367 -2.622 1.00 0.00 H new ATOM 451 N VAL A 34 -15.304 -7.194 -0.865 1.00 0.00 N ATOM 452 CA VAL A 34 -15.235 -6.593 0.463 1.00 0.00 C ATOM 453 C VAL A 34 -15.035 -5.081 0.377 1.00 0.00 C ATOM 454 O VAL A 34 -14.641 -4.559 -0.670 1.00 0.00 O ATOM 455 CB VAL A 34 -14.092 -7.212 1.301 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.374 -8.674 1.614 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.759 -7.077 0.581 1.00 0.00 C ATOM 0 H VAL A 34 -14.429 -7.160 -1.389 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.186 -6.798 0.954 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.036 -6.664 2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.555 -9.084 2.204 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.303 -8.753 2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.467 -9.234 0.683 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.970 -7.519 1.190 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.810 -7.593 -0.378 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.540 -6.022 0.415 1.00 0.00 H new ATOM 467 N ILE A 35 -15.316 -4.390 1.477 1.00 0.00 N ATOM 468 CA ILE A 35 -15.148 -2.943 1.563 1.00 0.00 C ATOM 469 C ILE A 35 -14.253 -2.580 2.737 1.00 0.00 C ATOM 470 O ILE A 35 -14.111 -3.352 3.675 1.00 0.00 O ATOM 471 CB ILE A 35 -16.492 -2.202 1.724 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.373 -2.910 2.758 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.201 -2.082 0.387 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.683 -2.207 3.034 1.00 0.00 C ATOM 0 H ILE A 35 -15.667 -4.817 2.334 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.692 -2.630 0.624 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.292 -1.194 2.086 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.582 -3.922 2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.818 -3.002 3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.146 -1.557 0.522 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.573 -1.526 -0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.393 -3.077 -0.014 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.249 -2.770 3.776 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.485 -1.204 3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.261 -2.139 2.112 1.00 0.00 H new ATOM 486 N LEU A 36 -13.672 -1.397 2.683 1.00 0.00 N ATOM 487 CA LEU A 36 -12.671 -0.992 3.660 1.00 0.00 C ATOM 488 C LEU A 36 -13.288 -0.345 4.892 1.00 0.00 C ATOM 489 O LEU A 36 -14.450 0.065 4.890 1.00 0.00 O ATOM 490 CB LEU A 36 -11.679 -0.014 3.027 1.00 0.00 C ATOM 491 CG LEU A 36 -11.054 -0.481 1.714 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.839 0.040 0.518 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.604 -0.052 1.640 1.00 0.00 C ATOM 0 H LEU A 36 -13.875 -0.695 1.971 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.158 -1.900 3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.189 0.933 2.852 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.880 0.182 3.742 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.093 -1.570 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.372 -0.308 -0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.864 -0.329 0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.844 1.130 0.533 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.172 -0.392 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.543 1.035 1.696 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.052 -0.490 2.472 1.00 0.00 H new ATOM 505 N THR A 37 -12.478 -0.256 5.938 1.00 0.00 N ATOM 506 CA THR A 37 -12.847 0.432 7.164 1.00 0.00 C ATOM 507 C THR A 37 -12.096 1.755 7.221 1.00 0.00 C ATOM 508 O THR A 37 -11.326 2.043 6.315 1.00 0.00 O ATOM 509 CB THR A 37 -12.481 -0.412 8.403 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.061 -0.622 8.451 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.182 -1.759 8.368 1.00 0.00 C ATOM 0 H THR A 37 -11.542 -0.662 5.958 1.00 0.00 H new ATOM 0 HA THR A 37 -13.924 0.598 7.167 1.00 0.00 H new ATOM 0 HB THR A 37 -12.806 0.132 9.290 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.863 -1.391 9.026 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.908 -2.335 9.252 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.261 -1.607 8.354 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.881 -2.303 7.473 1.00 0.00 H new ATOM 519 N ALA A 38 -12.294 2.551 8.264 1.00 0.00 N ATOM 520 CA ALA A 38 -11.619 3.845 8.357 1.00 0.00 C ATOM 521 C ALA A 38 -10.104 3.682 8.304 1.00 0.00 C ATOM 522 O ALA A 38 -9.414 4.428 7.603 1.00 0.00 O ATOM 523 CB ALA A 38 -12.035 4.578 9.615 1.00 0.00 C ATOM 0 H ALA A 38 -12.907 2.331 9.049 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.921 4.442 7.496 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.521 5.538 9.664 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.112 4.744 9.600 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.772 3.981 10.488 1.00 0.00 H new ATOM 529 N GLN A 39 -9.588 2.707 9.045 1.00 0.00 N ATOM 530 CA GLN A 39 -8.166 2.388 8.997 1.00 0.00 C ATOM 531 C GLN A 39 -7.752 1.985 7.584 1.00 0.00 C ATOM 532 O GLN A 39 -6.725 2.438 7.077 1.00 0.00 O ATOM 533 CB GLN A 39 -7.829 1.264 9.976 1.00 0.00 C ATOM 534 CG GLN A 39 -6.345 0.945 10.033 1.00 0.00 C ATOM 535 CD GLN A 39 -6.024 -0.184 10.986 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.716 -0.392 11.978 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.962 -0.917 10.693 1.00 0.00 N ATOM 0 H GLN A 39 -10.131 2.126 9.684 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.613 3.282 9.286 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.172 1.543 10.972 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.376 0.366 9.690 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -5.996 0.682 9.034 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.798 1.837 10.337 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.414 -0.710 9.858 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.691 -1.689 11.302 1.00 0.00 H new ATOM 546 N GLY A 40 -8.568 1.151 6.946 1.00 0.00 N ATOM 547 CA GLY A 40 -8.271 0.713 5.596 1.00 0.00 C ATOM 548 C GLY A 40 -8.398 1.842 4.594 1.00 0.00 C ATOM 549 O GLY A 40 -7.684 1.882 3.597 1.00 0.00 O ATOM 0 H GLY A 40 -9.429 0.772 7.340 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.260 0.308 5.560 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.948 -0.095 5.320 1.00 0.00 H new ATOM 553 N TYR A 41 -9.299 2.772 4.876 1.00 0.00 N ATOM 554 CA TYR A 41 -9.499 3.936 4.027 1.00 0.00 C ATOM 555 C TYR A 41 -8.321 4.891 4.109 1.00 0.00 C ATOM 556 O TYR A 41 -7.972 5.535 3.120 1.00 0.00 O ATOM 557 CB TYR A 41 -10.787 4.656 4.445 1.00 0.00 C ATOM 558 CG TYR A 41 -12.003 4.273 3.627 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.306 4.936 2.444 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.848 3.253 4.039 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.417 4.590 1.697 1.00 0.00 C ATOM 562 CE2 TYR A 41 -13.959 2.901 3.298 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.239 3.571 2.129 1.00 0.00 C ATOM 564 OH TYR A 41 -15.346 3.220 1.389 1.00 0.00 O ATOM 0 H TYR A 41 -9.908 2.741 5.694 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.582 3.598 2.994 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.986 4.441 5.495 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.632 5.732 4.364 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.664 5.734 2.103 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.633 2.724 4.956 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.640 5.115 0.780 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.605 2.104 3.634 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.816 2.483 1.833 1.00 0.00 H new ATOM 574 N THR A 42 -7.688 4.957 5.266 1.00 0.00 N ATOM 575 CA THR A 42 -6.490 5.766 5.424 1.00 0.00 C ATOM 576 C THR A 42 -5.329 5.135 4.664 1.00 0.00 C ATOM 577 O THR A 42 -4.469 5.824 4.109 1.00 0.00 O ATOM 578 CB THR A 42 -6.112 5.894 6.911 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.258 6.301 7.667 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.986 6.898 7.105 1.00 0.00 C ATOM 0 H THR A 42 -7.981 4.462 6.109 1.00 0.00 H new ATOM 0 HA THR A 42 -6.695 6.759 5.023 1.00 0.00 H new ATOM 0 HB THR A 42 -5.767 4.921 7.262 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.889 5.554 7.733 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.740 6.968 8.164 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.107 6.571 6.549 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.303 7.875 6.741 1.00 0.00 H new ATOM 588 N LEU A 43 -5.351 3.814 4.592 1.00 0.00 N ATOM 589 CA LEU A 43 -4.276 3.074 3.964 1.00 0.00 C ATOM 590 C LEU A 43 -4.523 2.953 2.473 1.00 0.00 C ATOM 591 O LEU A 43 -3.597 2.681 1.719 1.00 0.00 O ATOM 592 CB LEU A 43 -4.134 1.675 4.584 1.00 0.00 C ATOM 593 CG LEU A 43 -3.055 1.510 5.672 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.220 2.553 6.765 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.128 0.115 6.269 1.00 0.00 C ATOM 0 H LEU A 43 -6.104 3.234 4.962 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.348 3.621 4.131 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.096 1.393 5.012 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.921 0.967 3.783 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.079 1.652 5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.446 2.414 7.520 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.131 3.550 6.333 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.201 2.444 7.227 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.362 0.007 7.037 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.111 -0.040 6.713 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.963 -0.625 5.486 1.00 0.00 H new ATOM 607 N LEU A 44 -5.756 3.188 2.026 1.00 0.00 N ATOM 608 CA LEU A 44 -6.072 3.018 0.620 1.00 0.00 C ATOM 609 C LEU A 44 -5.706 4.280 -0.150 1.00 0.00 C ATOM 610 O LEU A 44 -5.100 4.205 -1.210 1.00 0.00 O ATOM 611 CB LEU A 44 -7.558 2.622 0.423 1.00 0.00 C ATOM 612 CG LEU A 44 -8.590 3.749 0.210 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.536 4.292 -1.216 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.994 3.245 0.490 1.00 0.00 C ATOM 0 H LEU A 44 -6.536 3.491 2.610 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.477 2.197 0.220 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.613 1.953 -0.436 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.868 2.047 1.296 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.339 4.551 0.904 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.276 5.084 -1.332 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.542 4.692 -1.416 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.752 3.488 -1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.708 4.053 0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.226 2.421 -0.185 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.057 2.898 1.521 1.00 0.00 H new ATOM 626 N ASP A 45 -6.043 5.442 0.399 1.00 0.00 N ATOM 627 CA ASP A 45 -5.776 6.704 -0.283 1.00 0.00 C ATOM 628 C ASP A 45 -4.286 7.004 -0.272 1.00 0.00 C ATOM 629 O ASP A 45 -3.771 7.719 -1.134 1.00 0.00 O ATOM 630 CB ASP A 45 -6.553 7.841 0.380 1.00 0.00 C ATOM 631 CG ASP A 45 -6.479 9.133 -0.408 1.00 0.00 C ATOM 632 OD1 ASP A 45 -7.103 9.205 -1.485 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.819 10.091 0.048 1.00 0.00 O ATOM 0 H ASP A 45 -6.498 5.537 1.307 1.00 0.00 H new ATOM 0 HA ASP A 45 -6.105 6.617 -1.318 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.597 7.547 0.491 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -6.160 8.008 1.383 1.00 0.00 H new ATOM 638 N PHE A 46 -3.591 6.400 0.678 1.00 0.00 N ATOM 639 CA PHE A 46 -2.145 6.506 0.756 1.00 0.00 C ATOM 640 C PHE A 46 -1.495 5.647 -0.311 1.00 0.00 C ATOM 641 O PHE A 46 -0.539 6.068 -0.967 1.00 0.00 O ATOM 642 CB PHE A 46 -1.703 6.017 2.134 1.00 0.00 C ATOM 643 CG PHE A 46 -0.236 6.140 2.421 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.275 7.297 2.981 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.626 5.088 2.156 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.620 7.404 3.272 1.00 0.00 C ATOM 647 CE2 PHE A 46 1.973 5.191 2.441 1.00 0.00 C ATOM 648 CZ PHE A 46 2.469 6.350 3.000 1.00 0.00 C ATOM 0 H PHE A 46 -4.010 5.827 1.411 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.845 7.542 0.600 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.252 6.575 2.892 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.990 4.971 2.239 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.385 8.125 3.193 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.240 4.178 1.722 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.008 8.311 3.712 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.636 4.366 2.227 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.522 6.433 3.225 1.00 0.00 H new ATOM 658 N ILE A 47 -2.023 4.459 -0.514 1.00 0.00 N ATOM 659 CA ILE A 47 -1.441 3.566 -1.489 1.00 0.00 C ATOM 660 C ILE A 47 -1.883 3.947 -2.900 1.00 0.00 C ATOM 661 O ILE A 47 -1.148 3.747 -3.864 1.00 0.00 O ATOM 662 CB ILE A 47 -1.767 2.091 -1.183 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.282 1.867 -1.157 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.144 1.703 0.147 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.699 0.457 -0.798 1.00 0.00 C ATOM 0 H ILE A 47 -2.841 4.095 -0.025 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.358 3.673 -1.428 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.351 1.462 -1.969 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.727 2.558 -0.441 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.691 2.116 -2.136 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.373 0.660 0.366 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.063 1.834 0.094 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.548 2.337 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.787 0.387 -0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.287 -0.241 -1.527 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.324 0.208 0.195 1.00 0.00 H new ATOM 677 N GLN A 48 -3.075 4.523 -3.009 1.00 0.00 N ATOM 678 CA GLN A 48 -3.513 5.155 -4.239 1.00 0.00 C ATOM 679 C GLN A 48 -2.489 6.185 -4.686 1.00 0.00 C ATOM 680 O GLN A 48 -1.864 6.046 -5.721 1.00 0.00 O ATOM 681 CB GLN A 48 -4.860 5.854 -4.032 1.00 0.00 C ATOM 682 CG GLN A 48 -6.039 4.907 -3.892 1.00 0.00 C ATOM 683 CD GLN A 48 -6.201 3.998 -5.091 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.854 4.361 -6.213 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.731 2.811 -4.860 1.00 0.00 N ATOM 0 H GLN A 48 -3.757 4.563 -2.252 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.620 4.383 -5.001 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.800 6.476 -3.139 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.043 6.522 -4.874 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.909 4.300 -2.996 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.952 5.487 -3.754 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.005 2.550 -3.913 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.866 2.155 -5.629 1.00 0.00 H new ATOM 694 N LYS A 49 -2.245 7.148 -3.822 1.00 0.00 N ATOM 695 CA LYS A 49 -1.553 8.375 -4.192 1.00 0.00 C ATOM 696 C LYS A 49 -0.041 8.185 -4.335 1.00 0.00 C ATOM 697 O LYS A 49 0.666 9.122 -4.686 1.00 0.00 O ATOM 698 CB LYS A 49 -1.857 9.424 -3.122 1.00 0.00 C ATOM 699 CG LYS A 49 -1.947 10.853 -3.634 1.00 0.00 C ATOM 700 CD LYS A 49 -2.480 11.793 -2.561 1.00 0.00 C ATOM 701 CE LYS A 49 -3.804 11.289 -2.004 1.00 0.00 C ATOM 702 NZ LYS A 49 -4.426 12.243 -1.051 1.00 0.00 N ATOM 0 H LYS A 49 -2.519 7.106 -2.841 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.910 8.694 -5.171 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.800 9.167 -2.639 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.083 9.376 -2.356 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.962 11.188 -3.957 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.598 10.888 -4.507 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.752 11.881 -1.755 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.613 12.790 -2.980 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -4.493 11.104 -2.828 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.643 10.335 -1.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.078 11.731 -0.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.684 12.699 -0.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.952 12.968 -1.579 1.00 0.00 H new ATOM 716 N HIS A 50 0.479 6.994 -4.055 1.00 0.00 N ATOM 717 CA HIS A 50 1.885 6.752 -4.395 1.00 0.00 C ATOM 718 C HIS A 50 2.077 5.643 -5.435 1.00 0.00 C ATOM 719 O HIS A 50 3.205 5.384 -5.853 1.00 0.00 O ATOM 720 CB HIS A 50 2.685 6.416 -3.132 1.00 0.00 C ATOM 721 CG HIS A 50 2.605 7.475 -2.075 1.00 0.00 C ATOM 722 ND1 HIS A 50 1.651 7.468 -1.083 1.00 0.00 N ATOM 723 CD2 HIS A 50 3.349 8.587 -1.869 1.00 0.00 C ATOM 724 CE1 HIS A 50 1.807 8.524 -0.314 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.829 9.221 -0.764 1.00 0.00 N ATOM 0 H HIS A 50 -0.016 6.217 -3.618 1.00 0.00 H new ATOM 0 HA HIS A 50 2.254 7.675 -4.843 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.321 5.475 -2.720 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.730 6.262 -3.403 1.00 0.00 H new ATOM 0 HD1 HIS A 50 0.933 6.754 -0.962 1.00 0.00 H new ATOM 0 HD2 HIS A 50 4.191 8.915 -2.460 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.199 8.776 0.542 1.00 0.00 H new ATOM 0 HE2 HIS A 50 3.179 10.090 -0.359 1.00 0.00 H new ATOM 734 N LEU A 51 1.001 5.000 -5.872 1.00 0.00 N ATOM 735 CA LEU A 51 1.116 3.983 -6.925 1.00 0.00 C ATOM 736 C LEU A 51 0.278 4.343 -8.139 1.00 0.00 C ATOM 737 O LEU A 51 0.647 4.049 -9.274 1.00 0.00 O ATOM 738 CB LEU A 51 0.662 2.598 -6.446 1.00 0.00 C ATOM 739 CG LEU A 51 1.601 1.848 -5.493 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.006 1.760 -6.066 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.625 2.498 -4.127 1.00 0.00 C ATOM 0 H LEU A 51 0.054 5.156 -5.526 1.00 0.00 H new ATOM 0 HA LEU A 51 2.174 3.952 -7.187 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.303 2.710 -5.952 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.500 1.972 -7.324 1.00 0.00 H new ATOM 0 HG LEU A 51 1.215 0.835 -5.381 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.650 1.223 -5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.978 1.229 -7.017 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.399 2.765 -6.223 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.299 1.945 -3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.973 3.527 -4.220 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.621 2.491 -3.703 1.00 0.00 H new ATOM 753 N ASN A 52 -0.857 4.963 -7.889 1.00 0.00 N ATOM 754 CA ASN A 52 -1.889 5.115 -8.900 1.00 0.00 C ATOM 755 C ASN A 52 -2.402 6.550 -8.994 1.00 0.00 C ATOM 756 O ASN A 52 -2.854 6.984 -10.052 1.00 0.00 O ATOM 757 CB ASN A 52 -3.037 4.161 -8.571 1.00 0.00 C ATOM 758 CG ASN A 52 -2.994 2.889 -9.403 1.00 0.00 C ATOM 759 OD1 ASN A 52 -1.799 2.448 -9.769 1.00 0.00 O flip ATOM 760 ND2 ASN A 52 -4.030 2.309 -9.723 1.00 0.00 N flip ATOM 0 H ASN A 52 -1.092 5.374 -6.986 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.458 4.874 -9.872 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.997 3.901 -7.513 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.987 4.669 -8.739 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -4.933 2.676 -9.424 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -3.986 1.461 -10.288 1.00 0.00 H new ATOM 767 N LYS A 53 -2.344 7.279 -7.894 1.00 0.00 N ATOM 768 CA LYS A 53 -2.793 8.655 -7.870 1.00 0.00 C ATOM 769 C LYS A 53 -1.617 9.611 -7.706 1.00 0.00 C ATOM 770 O LYS A 53 -0.900 9.846 -8.700 1.00 0.00 O ATOM 771 CB LYS A 53 -3.809 8.852 -6.742 1.00 0.00 C ATOM 772 CG LYS A 53 -5.249 8.698 -7.191 1.00 0.00 C ATOM 773 CD LYS A 53 -6.202 9.467 -6.289 1.00 0.00 C ATOM 774 CE LYS A 53 -6.179 8.961 -4.859 1.00 0.00 C ATOM 775 NZ LYS A 53 -7.162 9.689 -4.015 1.00 0.00 N ATOM 776 OXT LYS A 53 -1.417 10.126 -6.594 1.00 0.00 O ATOM 0 H LYS A 53 -1.988 6.936 -7.002 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.274 8.879 -8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.605 8.132 -5.950 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -3.675 9.845 -6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.351 9.054 -8.216 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.520 7.642 -7.191 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.937 10.524 -6.302 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -7.215 9.388 -6.683 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -6.403 7.894 -4.844 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.179 9.083 -4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.088 9.357 -3.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.963 10.709 -4.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.123 9.511 -4.369 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 9.404 6.707 12.869 1.00 0.00 N HETATM 792 CN FME B 1 8.222 7.267 13.070 1.00 0.00 C HETATM 793 O1 FME B 1 8.102 8.430 13.444 1.00 0.00 O HETATM 794 CA FME B 1 9.498 5.340 12.391 1.00 0.00 C HETATM 795 CB FME B 1 10.841 5.096 11.700 1.00 0.00 C HETATM 796 CG FME B 1 11.018 3.665 11.216 1.00 0.00 C HETATM 797 SD FME B 1 12.399 3.470 10.072 1.00 0.00 S HETATM 798 CE FME B 1 11.816 4.434 8.677 1.00 0.00 C HETATM 799 C FME B 1 9.293 4.345 13.528 1.00 0.00 C HETATM 800 O FME B 1 10.227 3.995 14.249 1.00 0.00 O HETATM 0 HG3 FME B 1 11.172 3.013 12.076 1.00 0.00 H new HETATM 0 HG2 FME B 1 10.100 3.337 10.728 1.00 0.00 H new HETATM 0 HE3 FME B 1 11.913 3.847 7.763 1.00 0.00 H new HETATM 0 HE2 FME B 1 10.770 4.699 8.829 1.00 0.00 H new HETATM 0 HE1 FME B 1 12.411 5.343 8.589 1.00 0.00 H new HETATM 0 HCN FME B 1 7.323 6.675 12.897 1.00 0.00 H new HETATM 0 HB3 FME B 1 10.933 5.773 10.851 1.00 0.00 H new HETATM 0 HB2 FME B 1 11.647 5.341 12.392 1.00 0.00 H new HETATM 0 HA FME B 1 8.703 5.188 11.661 1.00 0.00 H new HETATM 0 H FME B 1 10.255 7.240 13.051 1.00 0.00 H new ATOM 811 N VAL B 2 8.054 3.902 13.680 1.00 0.00 N ATOM 812 CA VAL B 2 7.715 2.872 14.653 1.00 0.00 C ATOM 813 C VAL B 2 7.458 1.567 13.918 1.00 0.00 C ATOM 814 O VAL B 2 7.032 0.564 14.493 1.00 0.00 O ATOM 815 CB VAL B 2 6.476 3.266 15.483 1.00 0.00 C ATOM 816 CG1 VAL B 2 6.747 4.555 16.239 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.246 3.413 14.596 1.00 0.00 C ATOM 0 H VAL B 2 7.260 4.242 13.138 1.00 0.00 H new ATOM 0 HA VAL B 2 8.549 2.755 15.345 1.00 0.00 H new ATOM 0 HB VAL B 2 6.275 2.471 16.201 1.00 0.00 H new ATOM 0 HG11 VAL B 2 5.867 4.826 16.823 1.00 0.00 H new ATOM 0 HG12 VAL B 2 7.596 4.413 16.907 1.00 0.00 H new ATOM 0 HG13 VAL B 2 6.972 5.352 15.530 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.388 3.691 15.207 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.426 4.187 13.850 1.00 0.00 H new ATOM 0 HG23 VAL B 2 5.043 2.466 14.095 1.00 0.00 H new ATOM 827 N ILE B 3 7.738 1.617 12.629 1.00 0.00 N ATOM 828 CA ILE B 3 7.612 0.475 11.753 1.00 0.00 C ATOM 829 C ILE B 3 8.787 0.470 10.788 1.00 0.00 C ATOM 830 O ILE B 3 9.112 1.496 10.195 1.00 0.00 O ATOM 831 CB ILE B 3 6.277 0.500 10.968 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.139 -0.760 10.110 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.175 1.757 10.104 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.798 -0.883 9.422 1.00 0.00 C ATOM 0 H ILE B 3 8.062 2.462 12.159 1.00 0.00 H new ATOM 0 HA ILE B 3 7.614 -0.432 12.357 1.00 0.00 H new ATOM 0 HB ILE B 3 5.458 0.520 11.687 1.00 0.00 H new ATOM 0 HG12 ILE B 3 6.926 -0.763 9.356 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.296 -1.636 10.739 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.229 1.751 9.563 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.223 2.641 10.740 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.000 1.777 9.392 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.774 -1.800 8.833 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.006 -0.912 10.171 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.646 -0.026 8.766 1.00 0.00 H new ATOM 846 N ALA B 4 9.454 -0.657 10.675 1.00 0.00 N ATOM 847 CA ALA B 4 10.583 -0.767 9.775 1.00 0.00 C ATOM 848 C ALA B 4 10.347 -1.873 8.765 1.00 0.00 C ATOM 849 O ALA B 4 9.662 -2.859 9.048 1.00 0.00 O ATOM 850 CB ALA B 4 11.859 -1.016 10.559 1.00 0.00 C ATOM 0 H ALA B 4 9.236 -1.508 11.193 1.00 0.00 H new ATOM 0 HA ALA B 4 10.692 0.172 9.233 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.700 -1.097 9.870 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.031 -0.188 11.246 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.763 -1.943 11.125 1.00 0.00 H new ATOM 856 N THR B 5 10.923 -1.695 7.584 1.00 0.00 N ATOM 857 CA THR B 5 10.783 -2.644 6.493 1.00 0.00 C ATOM 858 C THR B 5 11.396 -3.991 6.866 1.00 0.00 C ATOM 859 O THR B 5 11.114 -5.007 6.241 1.00 0.00 O ATOM 860 CB THR B 5 11.462 -2.097 5.221 1.00 0.00 C ATOM 861 OG1 THR B 5 11.149 -0.706 5.074 1.00 0.00 O ATOM 862 CG2 THR B 5 11.002 -2.851 3.980 1.00 0.00 C ATOM 0 H THR B 5 11.501 -0.886 7.357 1.00 0.00 H new ATOM 0 HA THR B 5 9.720 -2.786 6.300 1.00 0.00 H new ATOM 0 HB THR B 5 12.539 -2.232 5.325 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.581 -0.357 4.267 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.499 -2.441 3.100 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.255 -3.906 4.081 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.923 -2.745 3.869 1.00 0.00 H new ATOM 870 N ASP B 6 12.184 -3.996 7.937 1.00 0.00 N ATOM 871 CA ASP B 6 12.881 -5.195 8.385 1.00 0.00 C ATOM 872 C ASP B 6 11.948 -6.089 9.191 1.00 0.00 C ATOM 873 O ASP B 6 12.293 -7.222 9.522 1.00 0.00 O ATOM 874 CB ASP B 6 14.089 -4.825 9.256 1.00 0.00 C ATOM 875 CG ASP B 6 15.142 -4.023 8.518 1.00 0.00 C ATOM 876 OD1 ASP B 6 15.025 -2.782 8.470 1.00 0.00 O ATOM 877 OD2 ASP B 6 16.102 -4.628 7.995 1.00 0.00 O ATOM 0 H ASP B 6 12.356 -3.174 8.515 1.00 0.00 H new ATOM 0 HA ASP B 6 13.222 -5.730 7.499 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.744 -4.252 10.117 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.543 -5.738 9.641 1.00 0.00 H new ATOM 882 N ASP B 7 10.770 -5.572 9.519 1.00 0.00 N ATOM 883 CA ASP B 7 9.784 -6.344 10.269 1.00 0.00 C ATOM 884 C ASP B 7 8.672 -6.841 9.354 1.00 0.00 C ATOM 885 O ASP B 7 7.884 -7.710 9.734 1.00 0.00 O ATOM 886 CB ASP B 7 9.160 -5.487 11.378 1.00 0.00 C ATOM 887 CG ASP B 7 10.167 -4.969 12.386 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.827 -3.948 12.104 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.276 -5.558 13.482 1.00 0.00 O ATOM 0 H ASP B 7 10.474 -4.626 9.279 1.00 0.00 H new ATOM 0 HA ASP B 7 10.301 -7.197 10.708 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.645 -4.640 10.924 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.406 -6.076 11.900 1.00 0.00 H new ATOM 894 N LEU B 8 8.601 -6.289 8.150 1.00 0.00 N ATOM 895 CA LEU B 8 7.554 -6.672 7.209 1.00 0.00 C ATOM 896 C LEU B 8 8.139 -7.375 5.998 1.00 0.00 C ATOM 897 O LEU B 8 7.427 -8.054 5.260 1.00 0.00 O ATOM 898 CB LEU B 8 6.722 -5.465 6.777 1.00 0.00 C ATOM 899 CG LEU B 8 5.728 -4.961 7.825 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.436 -4.200 8.935 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.665 -4.094 7.175 1.00 0.00 C ATOM 0 H LEU B 8 9.248 -5.581 7.803 1.00 0.00 H new ATOM 0 HA LEU B 8 6.893 -7.369 7.724 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.398 -4.650 6.517 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.173 -5.725 5.872 1.00 0.00 H new ATOM 0 HG LEU B 8 5.243 -5.828 8.273 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.703 -3.855 9.664 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.154 -4.857 9.426 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.959 -3.342 8.512 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.966 -3.744 7.935 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.138 -3.237 6.695 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.127 -4.677 6.428 1.00 0.00 H new ATOM 913 N GLU B 9 9.440 -7.218 5.815 1.00 0.00 N ATOM 914 CA GLU B 9 10.161 -7.928 4.779 1.00 0.00 C ATOM 915 C GLU B 9 11.512 -8.372 5.320 1.00 0.00 C ATOM 916 O GLU B 9 12.191 -7.638 6.040 1.00 0.00 O ATOM 917 CB GLU B 9 10.331 -7.096 3.497 1.00 0.00 C ATOM 918 CG GLU B 9 9.021 -6.849 2.751 1.00 0.00 C ATOM 919 CD GLU B 9 9.135 -7.052 1.250 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.639 -6.150 0.547 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.703 -8.115 0.747 1.00 0.00 O ATOM 0 H GLU B 9 10.021 -6.597 6.379 1.00 0.00 H new ATOM 0 HA GLU B 9 9.570 -8.800 4.499 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.780 -6.136 3.753 1.00 0.00 H new ATOM 0 HB3 GLU B 9 11.028 -7.607 2.832 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.256 -7.519 3.144 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.685 -5.831 2.948 1.00 0.00 H new ATOM 928 N VAL B 10 11.882 -9.581 4.973 1.00 0.00 N ATOM 929 CA VAL B 10 13.093 -10.198 5.465 1.00 0.00 C ATOM 930 C VAL B 10 13.836 -10.794 4.282 1.00 0.00 C ATOM 931 O VAL B 10 13.217 -11.203 3.303 1.00 0.00 O ATOM 932 CB VAL B 10 12.768 -11.286 6.521 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.845 -12.350 5.947 1.00 0.00 C ATOM 934 CG2 VAL B 10 14.039 -11.917 7.071 1.00 0.00 C ATOM 0 H VAL B 10 11.347 -10.171 4.335 1.00 0.00 H new ATOM 0 HA VAL B 10 13.718 -9.451 5.955 1.00 0.00 H new ATOM 0 HB VAL B 10 12.250 -10.798 7.346 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.635 -13.099 6.710 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.912 -11.887 5.626 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.326 -12.827 5.093 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.779 -12.676 7.809 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.598 -12.379 6.257 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.652 -11.149 7.542 1.00 0.00 H new ATOM 944 N ALA B 11 15.155 -10.812 4.345 1.00 0.00 N ATOM 945 CA ALA B 11 15.952 -11.292 3.236 1.00 0.00 C ATOM 946 C ALA B 11 15.707 -12.775 2.989 1.00 0.00 C ATOM 947 O ALA B 11 15.672 -13.578 3.921 1.00 0.00 O ATOM 948 CB ALA B 11 17.421 -11.013 3.516 1.00 0.00 C ATOM 0 H ALA B 11 15.694 -10.500 5.152 1.00 0.00 H new ATOM 0 HA ALA B 11 15.659 -10.764 2.329 1.00 0.00 H new ATOM 0 HB1 ALA B 11 18.025 -11.373 2.683 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.571 -9.940 3.636 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.721 -11.526 4.430 1.00 0.00 H new ATOM 954 N CYS B 12 15.526 -13.114 1.715 1.00 0.00 N ATOM 955 CA CYS B 12 15.101 -14.435 1.275 1.00 0.00 C ATOM 956 C CYS B 12 16.067 -15.564 1.640 1.00 0.00 C ATOM 957 O CYS B 12 17.181 -15.318 2.087 1.00 0.00 O ATOM 958 CB CYS B 12 14.981 -14.396 -0.243 1.00 0.00 C ATOM 959 SG CYS B 12 13.319 -14.634 -0.884 1.00 0.00 S ATOM 0 H CYS B 12 15.675 -12.462 0.945 1.00 0.00 H new ATOM 0 HA CYS B 12 14.161 -14.652 1.782 1.00 0.00 H new ATOM 0 HB2 CYS B 12 15.356 -13.436 -0.597 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.629 -15.165 -0.663 1.00 0.00 H new ATOM 964 N PRO B 13 15.640 -16.829 1.421 1.00 0.00 N ATOM 965 CA PRO B 13 16.504 -18.009 1.570 1.00 0.00 C ATOM 966 C PRO B 13 17.869 -17.862 0.891 1.00 0.00 C ATOM 967 O PRO B 13 18.900 -18.219 1.459 1.00 0.00 O ATOM 968 CB PRO B 13 15.697 -19.092 0.853 1.00 0.00 C ATOM 969 CG PRO B 13 14.278 -18.728 1.090 1.00 0.00 C ATOM 970 CD PRO B 13 14.250 -17.219 1.075 1.00 0.00 C ATOM 0 HA PRO B 13 16.736 -18.206 2.617 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.926 -19.116 -0.212 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.923 -20.082 1.250 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.631 -19.142 0.317 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.925 -19.119 2.044 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.960 -16.835 0.097 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.534 -16.826 1.797 1.00 0.00 H new ATOM 978 N LYS B 14 17.866 -17.309 -0.321 1.00 0.00 N ATOM 979 CA LYS B 14 19.049 -17.363 -1.175 1.00 0.00 C ATOM 980 C LYS B 14 19.219 -16.121 -2.054 1.00 0.00 C ATOM 981 O LYS B 14 20.339 -15.771 -2.417 1.00 0.00 O ATOM 982 CB LYS B 14 18.962 -18.596 -2.083 1.00 0.00 C ATOM 983 CG LYS B 14 20.147 -18.758 -3.030 1.00 0.00 C ATOM 984 CD LYS B 14 19.711 -19.354 -4.365 1.00 0.00 C ATOM 985 CE LYS B 14 20.896 -19.632 -5.282 1.00 0.00 C ATOM 986 NZ LYS B 14 21.736 -18.425 -5.504 1.00 0.00 N ATOM 0 H LYS B 14 17.067 -16.824 -0.729 1.00 0.00 H new ATOM 0 HA LYS B 14 19.912 -17.414 -0.511 1.00 0.00 H new ATOM 0 HB2 LYS B 14 18.884 -19.487 -1.461 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.046 -18.537 -2.671 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.617 -17.789 -3.198 1.00 0.00 H new ATOM 0 HG3 LYS B 14 20.898 -19.401 -2.570 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.165 -20.281 -4.187 1.00 0.00 H new ATOM 0 HD3 LYS B 14 19.023 -18.669 -4.860 1.00 0.00 H new ATOM 0 HE2 LYS B 14 21.509 -20.423 -4.850 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.531 -19.999 -6.241 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.435 -18.621 -6.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 21.132 -17.631 -5.797 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.229 -18.178 -4.622 1.00 0.00 H new ATOM 1000 N CYS B 15 18.129 -15.447 -2.420 1.00 0.00 N ATOM 1001 CA CYS B 15 18.236 -14.446 -3.481 1.00 0.00 C ATOM 1002 C CYS B 15 17.975 -13.015 -3.033 1.00 0.00 C ATOM 1003 O CYS B 15 17.404 -12.222 -3.786 1.00 0.00 O ATOM 1004 CB CYS B 15 17.184 -14.795 -4.528 1.00 0.00 C ATOM 1005 SG CYS B 15 15.477 -14.650 -3.922 1.00 0.00 S ATOM 0 H CYS B 15 17.199 -15.567 -2.018 1.00 0.00 H new ATOM 0 HA CYS B 15 19.262 -14.476 -3.847 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.311 -14.141 -5.391 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.352 -15.815 -4.874 1.00 0.00 H new ATOM 1010 N GLU B 16 18.489 -12.650 -1.880 1.00 0.00 N ATOM 1011 CA GLU B 16 18.279 -11.320 -1.329 1.00 0.00 C ATOM 1012 C GLU B 16 19.374 -10.393 -1.805 1.00 0.00 C ATOM 1013 O GLU B 16 19.722 -9.420 -1.136 1.00 0.00 O ATOM 1014 CB GLU B 16 18.333 -11.383 0.200 1.00 0.00 C ATOM 1015 CG GLU B 16 18.439 -12.784 0.777 1.00 0.00 C ATOM 1016 CD GLU B 16 19.866 -13.294 0.763 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.279 -13.864 -0.263 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.588 -13.106 1.765 1.00 0.00 O ATOM 0 H GLU B 16 19.062 -13.259 -1.296 1.00 0.00 H new ATOM 0 HA GLU B 16 17.307 -10.952 -1.657 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.186 -10.798 0.544 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.438 -10.907 0.601 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.063 -12.785 1.800 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.806 -13.461 0.204 1.00 0.00 H new ATOM 1025 N ARG B 17 19.912 -10.697 -2.972 1.00 0.00 N ATOM 1026 CA ARG B 17 21.134 -10.095 -3.435 1.00 0.00 C ATOM 1027 C ARG B 17 21.051 -9.983 -4.960 1.00 0.00 C ATOM 1028 O ARG B 17 21.733 -9.175 -5.585 1.00 0.00 O ATOM 1029 CB ARG B 17 22.323 -10.961 -3.012 1.00 0.00 C ATOM 1030 CG ARG B 17 22.304 -12.354 -3.625 1.00 0.00 C ATOM 1031 CD ARG B 17 23.248 -13.299 -2.907 1.00 0.00 C ATOM 1032 NE ARG B 17 22.755 -13.664 -1.582 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.515 -14.163 -0.612 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.811 -14.370 -0.811 1.00 0.00 N ATOM 1035 NH2 ARG B 17 22.970 -14.462 0.555 1.00 0.00 N ATOM 0 H ARG B 17 19.507 -11.371 -3.622 1.00 0.00 H new ATOM 0 HA ARG B 17 21.272 -9.104 -3.002 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.248 -10.459 -3.297 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.330 -11.050 -1.926 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.291 -12.754 -3.587 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.583 -12.292 -4.677 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.382 -14.201 -3.505 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.228 -12.830 -2.813 1.00 0.00 H new ATOM 0 HE ARG B 17 21.763 -13.527 -1.388 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.231 -14.146 -1.713 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.387 -14.753 -0.062 1.00 0.00 H new ATOM 0 HH21 ARG B 17 21.973 -14.309 0.706 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.547 -14.845 1.304 1.00 0.00 H new ATOM 1049 N ALA B 18 20.181 -10.820 -5.544 1.00 0.00 N ATOM 1050 CA ALA B 18 20.107 -10.956 -6.998 1.00 0.00 C ATOM 1051 C ALA B 18 18.673 -10.923 -7.520 1.00 0.00 C ATOM 1052 O ALA B 18 18.415 -10.420 -8.611 1.00 0.00 O ATOM 1053 CB ALA B 18 20.796 -12.238 -7.440 1.00 0.00 C ATOM 0 H ALA B 18 19.524 -11.408 -5.031 1.00 0.00 H new ATOM 0 HA ALA B 18 20.622 -10.096 -7.425 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.735 -12.329 -8.524 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.843 -12.212 -7.137 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.305 -13.093 -6.976 1.00 0.00 H new ATOM 1059 N GLY B 19 17.739 -11.450 -6.735 1.00 0.00 N ATOM 1060 CA GLY B 19 16.351 -11.471 -7.157 1.00 0.00 C ATOM 1061 C GLY B 19 15.995 -12.679 -8.010 1.00 0.00 C ATOM 1062 O GLY B 19 15.012 -12.650 -8.745 1.00 0.00 O ATOM 0 H GLY B 19 17.917 -11.861 -5.819 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.711 -11.458 -6.275 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.137 -10.563 -7.720 1.00 0.00 H new ATOM 1066 N GLU B 20 16.750 -13.761 -7.871 1.00 0.00 N ATOM 1067 CA GLU B 20 16.517 -14.957 -8.679 1.00 0.00 C ATOM 1068 C GLU B 20 16.839 -16.218 -7.902 1.00 0.00 C ATOM 1069 O GLU B 20 17.563 -16.188 -6.914 1.00 0.00 O ATOM 1070 CB GLU B 20 17.360 -14.960 -9.955 1.00 0.00 C ATOM 1071 CG GLU B 20 18.839 -14.726 -9.703 1.00 0.00 C ATOM 1072 CD GLU B 20 19.715 -15.401 -10.735 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.006 -14.782 -11.777 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.122 -16.559 -10.497 1.00 0.00 O ATOM 0 H GLU B 20 17.525 -13.838 -7.212 1.00 0.00 H new ATOM 0 HA GLU B 20 15.460 -14.939 -8.943 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.233 -15.916 -10.463 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.988 -14.189 -10.629 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.040 -13.655 -9.705 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.099 -15.097 -8.712 1.00 0.00 H new ATOM 1081 N ILE B 21 16.305 -17.321 -8.370 1.00 0.00 N ATOM 1082 CA ILE B 21 16.644 -18.624 -7.850 1.00 0.00 C ATOM 1083 C ILE B 21 17.031 -19.498 -9.021 1.00 0.00 C ATOM 1084 O ILE B 21 16.178 -19.891 -9.811 1.00 0.00 O ATOM 1085 CB ILE B 21 15.479 -19.286 -7.076 1.00 0.00 C ATOM 1086 CG1 ILE B 21 15.124 -18.484 -5.820 1.00 0.00 C ATOM 1087 CG2 ILE B 21 15.830 -20.724 -6.703 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.236 -18.411 -4.794 1.00 0.00 C ATOM 0 H ILE B 21 15.620 -17.340 -9.126 1.00 0.00 H new ATOM 0 HA ILE B 21 17.463 -18.509 -7.140 1.00 0.00 H new ATOM 0 HB ILE B 21 14.607 -19.297 -7.731 1.00 0.00 H new ATOM 0 HG12 ILE B 21 14.850 -17.471 -6.115 1.00 0.00 H new ATOM 0 HG13 ILE B 21 14.245 -18.929 -5.355 1.00 0.00 H new ATOM 0 HG21 ILE B 21 14.998 -21.172 -6.159 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.023 -21.298 -7.609 1.00 0.00 H new ATOM 0 HG23 ILE B 21 16.720 -20.730 -6.074 1.00 0.00 H new ATOM 0 HD11 ILE B 21 15.902 -17.826 -3.937 1.00 0.00 H new ATOM 0 HD12 ILE B 21 16.496 -19.418 -4.467 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.111 -17.937 -5.239 1.00 0.00 H new ATOM 1100 N GLU B 22 18.321 -19.764 -9.141 1.00 0.00 N ATOM 1101 CA GLU B 22 18.842 -20.557 -10.243 1.00 0.00 C ATOM 1102 C GLU B 22 18.490 -19.910 -11.594 1.00 0.00 C ATOM 1103 O GLU B 22 17.870 -20.539 -12.450 1.00 0.00 O ATOM 1104 CB GLU B 22 18.255 -21.972 -10.153 1.00 0.00 C ATOM 1105 CG GLU B 22 19.038 -23.020 -10.913 1.00 0.00 C ATOM 1106 CD GLU B 22 20.429 -23.219 -10.349 1.00 0.00 C ATOM 1107 OE1 GLU B 22 20.569 -23.922 -9.331 1.00 0.00 O ATOM 1108 OE2 GLU B 22 21.391 -22.666 -10.919 1.00 0.00 O ATOM 0 H GLU B 22 19.031 -19.440 -8.484 1.00 0.00 H new ATOM 0 HA GLU B 22 19.929 -20.606 -10.174 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.202 -22.265 -9.104 1.00 0.00 H new ATOM 0 HB3 GLU B 22 17.233 -21.954 -10.531 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.498 -23.966 -10.884 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.111 -22.727 -11.960 1.00 0.00 H new ATOM 1115 N GLY B 23 18.851 -18.636 -11.769 1.00 0.00 N ATOM 1116 CA GLY B 23 18.566 -17.936 -13.020 1.00 0.00 C ATOM 1117 C GLY B 23 17.085 -17.814 -13.312 1.00 0.00 C ATOM 1118 O GLY B 23 16.677 -17.400 -14.399 1.00 0.00 O ATOM 0 H GLY B 23 19.335 -18.075 -11.068 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.005 -16.939 -12.979 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.050 -18.464 -13.842 1.00 0.00 H new ATOM 1122 N THR B 24 16.300 -18.154 -12.328 1.00 0.00 N ATOM 1123 CA THR B 24 14.882 -18.360 -12.494 1.00 0.00 C ATOM 1124 C THR B 24 14.071 -17.543 -11.477 1.00 0.00 C ATOM 1125 O THR B 24 14.527 -17.312 -10.356 1.00 0.00 O ATOM 1126 CB THR B 24 14.658 -19.879 -12.358 1.00 0.00 C ATOM 1127 OG1 THR B 24 14.886 -20.507 -13.626 1.00 0.00 O ATOM 1128 CG2 THR B 24 13.288 -20.260 -11.820 1.00 0.00 C ATOM 0 H THR B 24 16.629 -18.299 -11.373 1.00 0.00 H new ATOM 0 HA THR B 24 14.534 -18.011 -13.466 1.00 0.00 H new ATOM 0 HB THR B 24 15.373 -20.235 -11.616 1.00 0.00 H new ATOM 0 HG1 THR B 24 14.746 -21.473 -13.542 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.212 -21.345 -11.755 1.00 0.00 H new ATOM 0 HG22 THR B 24 13.153 -19.827 -10.829 1.00 0.00 H new ATOM 0 HG23 THR B 24 12.516 -19.881 -12.490 1.00 0.00 H new ATOM 1136 N PRO B 25 12.872 -17.059 -11.881 1.00 0.00 N ATOM 1137 CA PRO B 25 12.008 -16.228 -11.028 1.00 0.00 C ATOM 1138 C PRO B 25 11.722 -16.881 -9.681 1.00 0.00 C ATOM 1139 O PRO B 25 11.329 -18.044 -9.601 1.00 0.00 O ATOM 1140 CB PRO B 25 10.718 -16.070 -11.849 1.00 0.00 C ATOM 1141 CG PRO B 25 10.788 -17.149 -12.875 1.00 0.00 C ATOM 1142 CD PRO B 25 12.249 -17.293 -13.191 1.00 0.00 C ATOM 0 HA PRO B 25 12.478 -15.276 -10.782 1.00 0.00 H new ATOM 0 HB2 PRO B 25 9.833 -16.177 -11.221 1.00 0.00 H new ATOM 0 HB3 PRO B 25 10.662 -15.085 -12.313 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.373 -18.082 -12.495 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.216 -16.885 -13.765 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.485 -18.282 -13.584 1.00 0.00 H new ATOM 0 HD3 PRO B 25 12.579 -16.567 -13.935 1.00 0.00 H new ATOM 1150 N CYS B 26 11.915 -16.110 -8.623 1.00 0.00 N ATOM 1151 CA CYS B 26 11.909 -16.649 -7.276 1.00 0.00 C ATOM 1152 C CYS B 26 10.506 -16.730 -6.666 1.00 0.00 C ATOM 1153 O CYS B 26 9.760 -15.752 -6.683 1.00 0.00 O ATOM 1154 CB CYS B 26 12.818 -15.813 -6.393 1.00 0.00 C ATOM 1155 SG CYS B 26 12.869 -16.388 -4.672 1.00 0.00 S ATOM 0 H CYS B 26 12.078 -15.104 -8.674 1.00 0.00 H new ATOM 0 HA CYS B 26 12.278 -17.673 -7.337 1.00 0.00 H new ATOM 0 HB2 CYS B 26 13.827 -15.828 -6.804 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.481 -14.777 -6.413 1.00 0.00 H new ATOM 1160 N PRO B 27 10.186 -17.905 -6.072 1.00 0.00 N ATOM 1161 CA PRO B 27 8.885 -18.250 -5.473 1.00 0.00 C ATOM 1162 C PRO B 27 8.071 -17.088 -4.888 1.00 0.00 C ATOM 1163 O PRO B 27 6.992 -16.763 -5.379 1.00 0.00 O ATOM 1164 CB PRO B 27 9.308 -19.182 -4.341 1.00 0.00 C ATOM 1165 CG PRO B 27 10.531 -19.889 -4.824 1.00 0.00 C ATOM 1166 CD PRO B 27 11.105 -19.059 -5.960 1.00 0.00 C ATOM 0 HA PRO B 27 8.217 -18.654 -6.233 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.516 -18.620 -3.431 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.516 -19.892 -4.103 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.258 -19.996 -4.019 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.285 -20.894 -5.167 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.123 -18.737 -5.742 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.143 -19.628 -6.889 1.00 0.00 H new ATOM 1174 N ALA B 28 8.615 -16.451 -3.857 1.00 0.00 N ATOM 1175 CA ALA B 28 7.821 -15.554 -3.018 1.00 0.00 C ATOM 1176 C ALA B 28 8.355 -14.128 -3.013 1.00 0.00 C ATOM 1177 O ALA B 28 7.802 -13.256 -2.348 1.00 0.00 O ATOM 1178 CB ALA B 28 7.752 -16.091 -1.597 1.00 0.00 C ATOM 0 H ALA B 28 9.593 -16.536 -3.582 1.00 0.00 H new ATOM 0 HA ALA B 28 6.820 -15.519 -3.448 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.158 -15.415 -0.981 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.289 -17.078 -1.603 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.759 -16.165 -1.187 1.00 0.00 H new ATOM 1184 N CYS B 29 9.440 -13.884 -3.730 1.00 0.00 N ATOM 1185 CA CYS B 29 9.955 -12.524 -3.775 1.00 0.00 C ATOM 1186 C CYS B 29 10.046 -11.985 -5.193 1.00 0.00 C ATOM 1187 O CYS B 29 10.419 -10.835 -5.370 1.00 0.00 O ATOM 1188 CB CYS B 29 11.337 -12.443 -3.106 1.00 0.00 C ATOM 1189 SG CYS B 29 12.664 -13.365 -3.945 1.00 0.00 S ATOM 0 H CYS B 29 9.963 -14.576 -4.268 1.00 0.00 H new ATOM 0 HA CYS B 29 9.245 -11.905 -3.227 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.630 -11.395 -3.042 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.250 -12.813 -2.084 1.00 0.00 H new ATOM 1194 N SER B 30 9.701 -12.821 -6.175 1.00 0.00 N ATOM 1195 CA SER B 30 9.559 -12.415 -7.587 1.00 0.00 C ATOM 1196 C SER B 30 10.593 -11.378 -8.065 1.00 0.00 C ATOM 1197 O SER B 30 10.289 -10.543 -8.913 1.00 0.00 O ATOM 1198 CB SER B 30 8.141 -11.883 -7.815 1.00 0.00 C ATOM 1199 OG SER B 30 7.174 -12.846 -7.426 1.00 0.00 O ATOM 0 H SER B 30 9.509 -13.810 -6.017 1.00 0.00 H new ATOM 0 HA SER B 30 9.749 -13.308 -8.183 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.996 -10.965 -7.246 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.007 -11.630 -8.867 1.00 0.00 H new ATOM 0 HG SER B 30 6.275 -12.487 -7.578 1.00 0.00 H new ATOM 1205 N GLY B 31 11.809 -11.436 -7.529 1.00 0.00 N ATOM 1206 CA GLY B 31 12.863 -10.556 -8.002 1.00 0.00 C ATOM 1207 C GLY B 31 13.034 -9.281 -7.183 1.00 0.00 C ATOM 1208 O GLY B 31 13.508 -8.275 -7.710 1.00 0.00 O ATOM 0 H GLY B 31 12.082 -12.072 -6.780 1.00 0.00 H new ATOM 0 HA2 GLY B 31 13.805 -11.104 -8.000 1.00 0.00 H new ATOM 0 HA3 GLY B 31 12.655 -10.284 -9.037 1.00 0.00 H new ATOM 1212 N LYS B 32 12.671 -9.305 -5.899 1.00 0.00 N ATOM 1213 CA LYS B 32 12.884 -8.145 -5.027 1.00 0.00 C ATOM 1214 C LYS B 32 14.126 -8.352 -4.158 1.00 0.00 C ATOM 1215 O LYS B 32 14.849 -7.408 -3.850 1.00 0.00 O ATOM 1216 CB LYS B 32 11.682 -7.925 -4.106 1.00 0.00 C ATOM 1217 CG LYS B 32 10.357 -7.814 -4.837 1.00 0.00 C ATOM 1218 CD LYS B 32 9.203 -7.474 -3.899 1.00 0.00 C ATOM 1219 CE LYS B 32 9.075 -8.452 -2.739 1.00 0.00 C ATOM 1220 NZ LYS B 32 9.911 -8.058 -1.573 1.00 0.00 N ATOM 0 H LYS B 32 12.233 -10.105 -5.442 1.00 0.00 H new ATOM 0 HA LYS B 32 13.016 -7.273 -5.668 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.626 -8.750 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.843 -7.016 -3.526 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.433 -7.047 -5.608 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.145 -8.755 -5.344 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.346 -6.468 -3.505 1.00 0.00 H new ATOM 0 HD3 LYS B 32 8.272 -7.466 -4.465 1.00 0.00 H new ATOM 0 HE2 LYS B 32 8.031 -8.512 -2.431 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.367 -9.448 -3.072 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 9.398 -8.264 -0.692 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 10.802 -8.594 -1.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 10.118 -7.040 -1.623 1.00 0.00 H new ATOM 1234 N GLY B 33 14.347 -9.603 -3.747 1.00 0.00 N ATOM 1235 CA GLY B 33 15.440 -9.930 -2.861 1.00 0.00 C ATOM 1236 C GLY B 33 14.934 -10.342 -1.492 1.00 0.00 C ATOM 1237 O GLY B 33 15.414 -11.310 -0.908 1.00 0.00 O ATOM 0 H GLY B 33 13.775 -10.401 -4.021 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.031 -10.739 -3.291 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.102 -9.069 -2.763 1.00 0.00 H new ATOM 1241 N VAL B 34 13.908 -9.657 -1.016 1.00 0.00 N ATOM 1242 CA VAL B 34 13.352 -9.925 0.306 1.00 0.00 C ATOM 1243 C VAL B 34 11.944 -10.510 0.205 1.00 0.00 C ATOM 1244 O VAL B 34 11.297 -10.411 -0.843 1.00 0.00 O ATOM 1245 CB VAL B 34 13.310 -8.641 1.165 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.715 -8.155 1.487 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.526 -7.546 0.460 1.00 0.00 C ATOM 0 H VAL B 34 13.439 -8.908 -1.525 1.00 0.00 H new ATOM 0 HA VAL B 34 14.006 -10.653 0.786 1.00 0.00 H new ATOM 0 HB VAL B 34 12.806 -8.883 2.101 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.657 -7.250 2.092 1.00 0.00 H new ATOM 0 HG12 VAL B 34 15.250 -8.928 2.039 1.00 0.00 H new ATOM 0 HG13 VAL B 34 15.246 -7.938 0.560 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.510 -6.652 1.083 1.00 0.00 H new ATOM 0 HG22 VAL B 34 13.001 -7.315 -0.494 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.505 -7.885 0.285 1.00 0.00 H new ATOM 1257 N ILE B 35 11.483 -11.115 1.293 1.00 0.00 N ATOM 1258 CA ILE B 35 10.144 -11.689 1.367 1.00 0.00 C ATOM 1259 C ILE B 35 9.379 -11.107 2.543 1.00 0.00 C ATOM 1260 O ILE B 35 9.974 -10.605 3.487 1.00 0.00 O ATOM 1261 CB ILE B 35 10.165 -13.226 1.512 1.00 0.00 C ATOM 1262 CG1 ILE B 35 11.230 -13.655 2.528 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.390 -13.887 0.165 1.00 0.00 C ATOM 1264 CD1 ILE B 35 11.269 -15.146 2.789 1.00 0.00 C ATOM 0 H ILE B 35 12.027 -11.222 2.149 1.00 0.00 H new ATOM 0 HA ILE B 35 9.652 -11.437 0.427 1.00 0.00 H new ATOM 0 HB ILE B 35 9.195 -13.554 1.885 1.00 0.00 H new ATOM 0 HG12 ILE B 35 12.208 -13.334 2.171 1.00 0.00 H new ATOM 0 HG13 ILE B 35 11.049 -13.137 3.470 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.402 -14.970 0.289 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.586 -13.608 -0.516 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.344 -13.559 -0.247 1.00 0.00 H new ATOM 0 HD11 ILE B 35 12.048 -15.367 3.518 1.00 0.00 H new ATOM 0 HD12 ILE B 35 10.305 -15.473 3.178 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.482 -15.673 1.859 1.00 0.00 H new ATOM 1276 N LEU B 36 8.063 -11.195 2.481 1.00 0.00 N ATOM 1277 CA LEU B 36 7.210 -10.545 3.465 1.00 0.00 C ATOM 1278 C LEU B 36 6.954 -11.424 4.679 1.00 0.00 C ATOM 1279 O LEU B 36 7.167 -12.635 4.653 1.00 0.00 O ATOM 1280 CB LEU B 36 5.868 -10.166 2.835 1.00 0.00 C ATOM 1281 CG LEU B 36 5.962 -9.375 1.533 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.905 -10.298 0.323 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.866 -8.333 1.474 1.00 0.00 C ATOM 0 H LEU B 36 7.559 -11.710 1.759 1.00 0.00 H new ATOM 0 HA LEU B 36 7.738 -9.651 3.798 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.302 -11.079 2.647 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.298 -9.581 3.557 1.00 0.00 H new ATOM 0 HG LEU B 36 6.925 -8.865 1.510 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.974 -9.706 -0.590 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.736 -11.002 0.363 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.964 -10.848 0.329 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.944 -7.775 0.541 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.894 -8.824 1.523 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.970 -7.648 2.315 1.00 0.00 H new ATOM 1295 N THR B 37 6.478 -10.784 5.738 1.00 0.00 N ATOM 1296 CA THR B 37 6.071 -11.468 6.951 1.00 0.00 C ATOM 1297 C THR B 37 4.549 -11.482 7.011 1.00 0.00 C ATOM 1298 O THR B 37 3.914 -10.924 6.130 1.00 0.00 O ATOM 1299 CB THR B 37 6.624 -10.750 8.198 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.114 -9.409 8.257 1.00 0.00 O ATOM 1301 CG2 THR B 37 8.142 -10.703 8.174 1.00 0.00 C ATOM 0 H THR B 37 6.364 -9.771 5.777 1.00 0.00 H new ATOM 0 HA THR B 37 6.465 -12.484 6.938 1.00 0.00 H new ATOM 0 HB THR B 37 6.304 -11.310 9.077 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.663 -8.877 8.870 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.504 -10.191 9.065 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.537 -11.719 8.153 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.475 -10.166 7.286 1.00 0.00 H new ATOM 1309 N ALA B 38 3.961 -12.101 8.027 1.00 0.00 N ATOM 1310 CA ALA B 38 2.503 -12.159 8.133 1.00 0.00 C ATOM 1311 C ALA B 38 1.887 -10.764 8.115 1.00 0.00 C ATOM 1312 O ALA B 38 0.893 -10.524 7.422 1.00 0.00 O ATOM 1313 CB ALA B 38 2.086 -12.911 9.383 1.00 0.00 C ATOM 0 H ALA B 38 4.462 -12.566 8.784 1.00 0.00 H new ATOM 0 HA ALA B 38 2.129 -12.699 7.263 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.998 -12.943 9.443 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.477 -13.928 9.343 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.483 -12.404 10.262 1.00 0.00 H new ATOM 1319 N GLN B 39 2.475 -9.845 8.873 1.00 0.00 N ATOM 1320 CA GLN B 39 2.040 -8.455 8.856 1.00 0.00 C ATOM 1321 C GLN B 39 2.178 -7.866 7.454 1.00 0.00 C ATOM 1322 O GLN B 39 1.272 -7.193 6.962 1.00 0.00 O ATOM 1323 CB GLN B 39 2.850 -7.625 9.849 1.00 0.00 C ATOM 1324 CG GLN B 39 2.382 -6.184 9.951 1.00 0.00 C ATOM 1325 CD GLN B 39 3.218 -5.363 10.907 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.774 -5.883 11.870 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.305 -4.071 10.647 1.00 0.00 N ATOM 0 H GLN B 39 3.252 -10.038 9.505 1.00 0.00 H new ATOM 0 HA GLN B 39 0.990 -8.427 9.148 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.791 -8.089 10.833 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.899 -7.639 9.553 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.413 -5.726 8.963 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.342 -6.167 10.278 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.826 -3.681 9.835 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.851 -3.463 11.258 1.00 0.00 H new ATOM 1336 N GLY B 40 3.307 -8.141 6.808 1.00 0.00 N ATOM 1337 CA GLY B 40 3.536 -7.637 5.468 1.00 0.00 C ATOM 1338 C GLY B 40 2.622 -8.293 4.451 1.00 0.00 C ATOM 1339 O GLY B 40 2.229 -7.675 3.467 1.00 0.00 O ATOM 0 H GLY B 40 4.067 -8.704 7.190 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.379 -6.558 5.454 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.575 -7.811 5.188 1.00 0.00 H new ATOM 1343 N TYR B 41 2.269 -9.544 4.707 1.00 0.00 N ATOM 1344 CA TYR B 41 1.364 -10.285 3.843 1.00 0.00 C ATOM 1345 C TYR B 41 -0.053 -9.748 3.934 1.00 0.00 C ATOM 1346 O TYR B 41 -0.784 -9.746 2.943 1.00 0.00 O ATOM 1347 CB TYR B 41 1.386 -11.768 4.232 1.00 0.00 C ATOM 1348 CG TYR B 41 2.319 -12.619 3.396 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.882 -13.211 2.218 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.633 -12.836 3.787 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.728 -13.994 1.454 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.484 -13.617 3.030 1.00 0.00 C ATOM 1353 CZ TYR B 41 4.029 -14.193 1.865 1.00 0.00 C ATOM 1354 OH TYR B 41 4.875 -14.976 1.112 1.00 0.00 O ATOM 0 H TYR B 41 2.600 -10.071 5.515 1.00 0.00 H new ATOM 0 HA TYR B 41 1.701 -10.167 2.813 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.677 -11.852 5.279 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.376 -12.168 4.149 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.864 -13.057 1.893 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.996 -12.386 4.699 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.372 -14.447 0.541 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.503 -13.775 3.351 1.00 0.00 H new ATOM 0 HH TYR B 41 5.755 -15.013 1.541 1.00 0.00 H new ATOM 1364 N THR B 42 -0.429 -9.260 5.101 1.00 0.00 N ATOM 1365 CA THR B 42 -1.730 -8.635 5.272 1.00 0.00 C ATOM 1366 C THR B 42 -1.764 -7.297 4.542 1.00 0.00 C ATOM 1367 O THR B 42 -2.791 -6.887 3.995 1.00 0.00 O ATOM 1368 CB THR B 42 -2.031 -8.405 6.764 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.815 -9.619 7.494 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.464 -7.935 6.965 1.00 0.00 C ATOM 0 H THR B 42 0.145 -9.283 5.944 1.00 0.00 H new ATOM 0 HA THR B 42 -2.486 -9.301 4.856 1.00 0.00 H new ATOM 0 HB THR B 42 -1.360 -7.630 7.133 1.00 0.00 H new ATOM 0 HG1 THR B 42 -0.854 -9.808 7.538 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.650 -7.780 8.028 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.618 -6.998 6.429 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.151 -8.689 6.582 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.610 -6.652 4.485 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.510 -5.340 3.881 1.00 0.00 C ATOM 1380 C LEU B 43 -0.282 -5.467 2.386 1.00 0.00 C ATOM 1381 O LEU B 43 -0.509 -4.517 1.651 1.00 0.00 O ATOM 1382 CB LEU B 43 0.633 -4.529 4.514 1.00 0.00 C ATOM 1383 CG LEU B 43 0.238 -3.533 5.621 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.581 -4.217 6.702 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.482 -2.908 6.228 1.00 0.00 C ATOM 0 H LEU B 43 0.269 -7.019 4.851 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.448 -4.814 4.059 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.359 -5.229 4.928 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.138 -3.976 3.722 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.374 -2.751 5.173 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.847 -3.492 7.471 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.489 -4.630 6.264 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.005 -5.021 7.148 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.192 -2.206 7.009 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.109 -3.689 6.657 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.039 -2.380 5.454 1.00 0.00 H new ATOM 1397 N LEU B 44 0.126 -6.646 1.918 1.00 0.00 N ATOM 1398 CA LEU B 44 0.430 -6.812 0.507 1.00 0.00 C ATOM 1399 C LEU B 44 -0.844 -7.115 -0.270 1.00 0.00 C ATOM 1400 O LEU B 44 -1.081 -6.535 -1.321 1.00 0.00 O ATOM 1401 CB LEU B 44 1.521 -7.893 0.291 1.00 0.00 C ATOM 1402 CG LEU B 44 1.065 -9.348 0.056 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.564 -9.552 -1.370 1.00 0.00 C ATOM 1404 CD2 LEU B 44 2.210 -10.312 0.314 1.00 0.00 C ATOM 0 H LEU B 44 0.250 -7.483 2.487 1.00 0.00 H new ATOM 0 HA LEU B 44 0.839 -5.878 0.123 1.00 0.00 H new ATOM 0 HB2 LEU B 44 2.125 -7.591 -0.564 1.00 0.00 H new ATOM 0 HB3 LEU B 44 2.175 -7.885 1.163 1.00 0.00 H new ATOM 0 HG LEU B 44 0.248 -9.546 0.750 1.00 0.00 H new ATOM 0 HD11 LEU B 44 0.251 -10.588 -1.501 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.282 -8.891 -1.556 1.00 0.00 H new ATOM 0 HD13 LEU B 44 1.365 -9.323 -2.073 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.871 -11.334 0.144 1.00 0.00 H new ATOM 0 HD22 LEU B 44 3.035 -10.086 -0.362 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.547 -10.209 1.345 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.683 -7.998 0.261 1.00 0.00 N ATOM 1417 CA ASP B 45 -2.912 -8.381 -0.428 1.00 0.00 C ATOM 1418 C ASP B 45 -3.911 -7.236 -0.395 1.00 0.00 C ATOM 1419 O ASP B 45 -4.788 -7.127 -1.255 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.517 -9.631 0.214 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.761 -10.117 -0.506 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.629 -10.659 -1.622 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -5.874 -9.971 0.045 1.00 0.00 O ATOM 0 H ASP B 45 -1.537 -8.459 1.159 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.672 -8.607 -1.467 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.772 -10.427 0.221 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.765 -9.417 1.254 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.735 -6.351 0.572 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.548 -5.154 0.674 1.00 0.00 C ATOM 1430 C PHE B 46 -4.131 -4.143 -0.376 1.00 0.00 C ATOM 1431 O PHE B 46 -4.973 -3.512 -1.018 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.343 -4.552 2.062 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.189 -3.354 2.374 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.446 -3.507 2.933 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.716 -2.073 2.134 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.216 -2.406 3.246 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.484 -0.969 2.441 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.734 -1.136 2.998 1.00 0.00 C ATOM 0 H PHE B 46 -3.029 -6.442 1.303 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.596 -5.409 0.516 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.544 -5.322 2.807 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.295 -4.273 2.167 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.828 -4.499 3.126 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.735 -1.938 1.702 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.194 -2.537 3.684 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.107 0.024 2.245 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.337 -0.273 3.240 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.837 -4.006 -0.577 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.354 -3.038 -1.534 1.00 0.00 C ATOM 1450 C ILE B 47 -2.462 -3.584 -2.957 1.00 0.00 C ATOM 1451 O ILE B 47 -2.649 -2.829 -3.908 1.00 0.00 O ATOM 1452 CB ILE B 47 -0.912 -2.591 -1.218 1.00 0.00 C ATOM 1453 CG1 ILE B 47 0.034 -3.793 -1.203 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.891 -1.876 0.123 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.468 -3.459 -0.845 1.00 0.00 C ATOM 0 H ILE B 47 -2.113 -4.543 -0.099 1.00 0.00 H new ATOM 0 HA ILE B 47 -2.988 -2.155 -1.458 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.570 -1.907 -1.995 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.343 -4.527 -0.491 1.00 0.00 H new ATOM 0 HG13 ILE B 47 0.018 -4.264 -2.186 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.127 -1.558 0.350 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.543 -1.003 0.080 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.242 -2.553 0.902 1.00 0.00 H new ATOM 0 HD11 ILE B 47 2.068 -4.369 -0.858 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.868 -2.750 -1.570 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.501 -3.017 0.151 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.371 -4.902 -3.091 1.00 0.00 N ATOM 1468 CA GLN B 48 -2.698 -5.572 -4.335 1.00 0.00 C ATOM 1469 C GLN B 48 -4.104 -5.193 -4.778 1.00 0.00 C ATOM 1470 O GLN B 48 -4.290 -4.557 -5.798 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.619 -7.091 -4.163 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.207 -7.635 -4.024 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.328 -7.295 -5.209 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -0.804 -7.160 -6.335 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.964 -7.161 -4.964 1.00 0.00 N ATOM 0 H GLN B 48 -2.070 -5.528 -2.344 1.00 0.00 H new ATOM 0 HA GLN B 48 -1.978 -5.259 -5.091 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.193 -7.375 -3.281 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.096 -7.567 -5.020 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -0.756 -7.234 -3.116 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.250 -8.718 -3.908 1.00 0.00 H new ATOM 0 HE21 GLN B 48 1.318 -7.281 -4.015 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.607 -6.937 -5.724 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.063 -5.480 -3.921 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.476 -5.486 -4.289 1.00 0.00 C ATOM 1486 C LYS B 49 -7.069 -4.079 -4.399 1.00 0.00 C ATOM 1487 O LYS B 49 -8.236 -3.925 -4.746 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.226 -6.293 -3.228 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.416 -7.081 -3.750 1.00 0.00 C ATOM 1490 CD LYS B 49 -8.944 -8.044 -2.692 1.00 0.00 C ATOM 1491 CE LYS B 49 -7.833 -8.939 -2.160 1.00 0.00 C ATOM 1492 NZ LYS B 49 -8.328 -9.973 -1.213 1.00 0.00 N ATOM 0 H LYS B 49 -4.890 -5.717 -2.944 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.578 -5.934 -5.278 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.528 -6.985 -2.757 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.572 -5.612 -2.451 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.208 -6.394 -4.049 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -8.125 -7.638 -4.640 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.385 -7.480 -1.870 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -9.737 -8.658 -3.119 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.335 -9.428 -2.997 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.085 -8.323 -1.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -7.571 -10.223 -0.545 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.145 -9.600 -0.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -8.615 -10.820 -1.743 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.294 -3.041 -4.093 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.784 -1.695 -4.401 1.00 0.00 C ATOM 1508 C HIS B 50 -5.918 -0.948 -5.421 1.00 0.00 C ATOM 1509 O HIS B 50 -6.246 0.176 -5.790 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.894 -0.865 -3.117 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.771 -1.488 -2.073 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -7.289 -2.327 -1.095 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -9.106 -1.401 -1.864 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -8.281 -2.732 -0.331 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -9.397 -2.187 -0.772 1.00 0.00 N ATOM 0 H HIS B 50 -5.374 -3.093 -3.656 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.766 -1.826 -4.855 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.897 -0.719 -2.702 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.284 0.122 -3.365 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -6.311 -2.594 -0.980 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -9.810 -0.824 -2.445 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -8.195 -3.398 0.515 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -10.324 -2.325 -0.370 1.00 0.00 H new ATOM 1524 N LEU B 51 -4.826 -1.552 -5.880 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.008 -0.923 -6.928 1.00 0.00 C ATOM 1526 C LEU B 51 -3.904 -1.805 -8.160 1.00 0.00 C ATOM 1527 O LEU B 51 -3.882 -1.320 -9.289 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.579 -0.632 -6.448 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.398 0.539 -5.471 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.024 1.812 -6.019 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.969 0.206 -4.111 1.00 0.00 C ATOM 0 H LEU B 51 -4.487 -2.457 -5.555 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.514 0.011 -7.172 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.191 -1.533 -5.973 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -1.959 -0.441 -7.324 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.328 0.711 -5.356 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.880 2.624 -5.306 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.550 2.072 -6.966 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.091 1.654 -6.179 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.827 1.053 -3.439 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.034 -0.007 -4.206 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.458 -0.668 -3.706 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.829 -3.100 -7.932 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.443 -4.047 -8.966 1.00 0.00 C ATOM 1545 C ASN B 52 -4.440 -5.195 -9.094 1.00 0.00 C ATOM 1546 O ASN B 52 -4.607 -5.765 -10.172 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.051 -4.584 -8.633 1.00 0.00 C ATOM 1548 CG ASN B 52 -0.950 -3.908 -9.440 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.168 -2.659 -9.829 1.00 0.00 O flip ATOM 1550 ND2 ASN B 52 0.090 -4.509 -9.712 1.00 0.00 N flip ATOM 0 H ASN B 52 -4.033 -3.528 -7.029 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.434 -3.532 -9.927 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -1.856 -4.441 -7.570 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.026 -5.657 -8.821 1.00 0.00 H new ATOM 0 HD21 ASN B 52 0.222 -5.470 -9.395 1.00 0.00 H new ATOM 0 HD22 ASN B 52 0.820 -4.046 -10.254 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.098 -5.535 -8.001 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.077 -6.602 -8.002 1.00 0.00 C ATOM 1559 C LYS B 53 -7.482 -6.041 -7.824 1.00 0.00 C ATOM 1560 O LYS B 53 -8.046 -5.521 -8.809 1.00 0.00 O ATOM 1561 CB LYS B 53 -5.758 -7.606 -6.892 1.00 0.00 C ATOM 1562 CG LYS B 53 -4.904 -8.772 -7.354 1.00 0.00 C ATOM 1563 CD LYS B 53 -5.103 -9.993 -6.472 1.00 0.00 C ATOM 1564 CE LYS B 53 -4.725 -9.731 -5.025 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.854 -10.960 -4.199 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.018 -6.126 -6.709 1.00 0.00 O ATOM 0 H LYS B 53 -4.969 -5.083 -7.096 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.034 -7.114 -8.963 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.244 -7.088 -6.082 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -6.692 -7.991 -6.482 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.155 -9.022 -8.385 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -3.853 -8.482 -7.343 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -6.146 -10.307 -6.521 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -4.503 -10.818 -6.857 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -3.700 -9.364 -4.976 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.364 -8.948 -4.617 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -4.416 -10.801 -3.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -5.860 -11.190 -4.073 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -4.375 -11.751 -4.676 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.422 4.467 13.004 1.00 0.00 N HETATM 1582 CN FME C 1 -10.349 3.153 13.118 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.305 2.476 13.486 1.00 0.00 O HETATM 1584 CA FME C 1 -9.284 5.236 12.533 1.00 0.00 C HETATM 1585 CB FME C 1 -9.747 6.537 11.875 1.00 0.00 C HETATM 1586 CG FME C 1 -8.605 7.421 11.406 1.00 0.00 C HETATM 1587 SD FME C 1 -9.141 8.736 10.293 1.00 0.00 S HETATM 1588 CE FME C 1 -9.681 7.776 8.878 1.00 0.00 C HETATM 1589 C FME C 1 -8.311 5.531 13.670 1.00 0.00 C HETATM 1590 O FME C 1 -8.476 6.494 14.416 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.116 7.864 12.274 1.00 0.00 H new HETATM 0 HG2 FME C 1 -7.861 6.806 10.900 1.00 0.00 H new HETATM 0 HE3 FME C 1 -9.213 8.166 7.974 1.00 0.00 H new HETATM 0 HE2 FME C 1 -9.393 6.734 9.014 1.00 0.00 H new HETATM 0 HE1 FME C 1 -10.765 7.844 8.784 1.00 0.00 H new HETATM 0 HCN FME C 1 -9.410 2.654 12.878 1.00 0.00 H new HETATM 0 HB3 FME C 1 -10.383 6.297 11.023 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.360 7.095 12.583 1.00 0.00 H new HETATM 0 HA FME C 1 -8.761 4.637 11.788 1.00 0.00 H new HETATM 0 H FME C 1 -11.288 4.947 13.250 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.303 4.683 13.796 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.235 4.898 14.763 1.00 0.00 C ATOM 1603 C VAL C 2 -4.984 5.346 14.028 1.00 0.00 C ATOM 1604 O VAL C 2 -3.895 5.446 14.597 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.940 3.624 15.577 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -7.180 3.198 16.343 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -5.454 2.498 14.672 1.00 0.00 C ATOM 0 H VAL C 2 -7.201 3.835 13.238 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.555 5.668 15.465 1.00 0.00 H new ATOM 0 HB VAL C 2 -5.145 3.846 16.289 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -6.962 2.296 16.916 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -7.480 3.996 17.022 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -7.989 2.995 15.642 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -5.253 1.610 15.272 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -6.221 2.270 13.932 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -4.540 2.808 14.165 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.175 5.609 12.750 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.126 6.090 11.879 1.00 0.00 C ATOM 1619 C ILE C 3 -4.715 7.124 10.931 1.00 0.00 C ATOM 1620 O ILE C 3 -5.766 6.895 10.335 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.478 4.936 11.073 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.327 5.466 10.212 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.517 4.223 10.208 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.551 4.379 9.501 1.00 0.00 C ATOM 0 H ILE C 3 -6.075 5.493 12.284 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.342 6.539 12.489 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.075 4.210 11.780 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.727 6.158 9.471 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.644 6.034 10.843 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.037 3.417 9.652 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.298 3.809 10.845 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.958 4.934 9.509 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.752 4.829 8.911 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.120 3.699 10.236 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.220 3.825 8.843 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.079 8.271 10.832 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.556 9.315 9.950 1.00 0.00 C ATOM 1638 C ALA C 4 -3.489 9.681 8.934 1.00 0.00 C ATOM 1639 O ALA C 4 -2.291 9.594 9.210 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.975 10.535 10.754 1.00 0.00 C ATOM 0 H ALA C 4 -3.232 8.505 11.350 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.427 8.944 9.410 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.331 11.312 10.077 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.773 10.260 11.443 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.121 10.909 11.319 1.00 0.00 H new ATOM 1646 N THR C 5 -3.944 10.089 7.755 1.00 0.00 N ATOM 1647 CA THR C 5 -3.062 10.469 6.661 1.00 0.00 C ATOM 1648 C THR C 5 -2.193 11.663 7.047 1.00 0.00 C ATOM 1649 O THR C 5 -1.171 11.922 6.426 1.00 0.00 O ATOM 1650 CB THR C 5 -3.887 10.824 5.409 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.974 9.899 5.275 1.00 0.00 O ATOM 1652 CG2 THR C 5 -3.027 10.782 4.152 1.00 0.00 C ATOM 0 H THR C 5 -4.936 10.165 7.532 1.00 0.00 H new ATOM 0 HA THR C 5 -2.415 9.619 6.444 1.00 0.00 H new ATOM 0 HB THR C 5 -4.270 11.837 5.528 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.500 10.125 4.480 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.637 11.037 3.285 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.211 11.499 4.245 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.617 9.780 4.025 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.583 12.347 8.117 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.893 13.552 8.560 1.00 0.00 C ATOM 1662 C ASP C 6 -0.646 13.196 9.357 1.00 0.00 C ATOM 1663 O ASP C 6 0.160 14.065 9.685 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.820 14.413 9.428 1.00 0.00 C ATOM 1665 CG ASP C 6 -4.015 14.962 8.672 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -5.007 14.223 8.489 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.976 16.143 8.265 1.00 0.00 O ATOM 0 H ASP C 6 -3.380 12.084 8.697 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.601 14.116 7.674 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -3.174 13.818 10.270 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -2.249 15.244 9.843 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.490 11.914 9.674 1.00 0.00 N ATOM 1673 CA ASP C 7 0.685 11.450 10.406 1.00 0.00 C ATOM 1674 C ASP C 7 1.665 10.743 9.479 1.00 0.00 C ATOM 1675 O ASP C 7 2.819 10.509 9.841 1.00 0.00 O ATOM 1676 CB ASP C 7 0.278 10.482 11.523 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.588 11.122 12.587 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -1.819 11.199 12.393 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -0.045 11.525 13.637 1.00 0.00 O ATOM 0 H ASP C 7 -1.159 11.181 9.437 1.00 0.00 H new ATOM 0 HA ASP C 7 1.167 12.328 10.837 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.259 9.640 11.086 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.177 10.079 11.990 1.00 0.00 H new ATOM 1684 N LEU C 8 1.209 10.396 8.282 1.00 0.00 N ATOM 1685 CA LEU C 8 2.061 9.690 7.328 1.00 0.00 C ATOM 1686 C LEU C 8 2.368 10.560 6.125 1.00 0.00 C ATOM 1687 O LEU C 8 3.311 10.294 5.380 1.00 0.00 O ATOM 1688 CB LEU C 8 1.428 8.371 6.887 1.00 0.00 C ATOM 1689 CG LEU C 8 1.497 7.248 7.923 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.489 7.468 9.041 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.278 5.901 7.259 1.00 0.00 C ATOM 0 H LEU C 8 0.264 10.588 7.949 1.00 0.00 H new ATOM 0 HA LEU C 8 2.999 9.461 7.834 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.383 8.552 6.637 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.921 8.035 5.974 1.00 0.00 H new ATOM 0 HG LEU C 8 2.492 7.258 8.367 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.562 6.654 9.762 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.699 8.414 9.540 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.518 7.494 8.623 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.330 5.112 8.010 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.297 5.885 6.783 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.049 5.737 6.506 1.00 0.00 H new ATOM 1703 N GLU C 9 1.575 11.602 5.956 1.00 0.00 N ATOM 1704 CA GLU C 9 1.819 12.597 4.935 1.00 0.00 C ATOM 1705 C GLU C 9 1.523 13.974 5.504 1.00 0.00 C ATOM 1706 O GLU C 9 0.564 14.167 6.251 1.00 0.00 O ATOM 1707 CB GLU C 9 1.006 12.348 3.653 1.00 0.00 C ATOM 1708 CG GLU C 9 1.447 11.106 2.885 1.00 0.00 C ATOM 1709 CD GLU C 9 1.568 11.333 1.386 1.00 0.00 C ATOM 1710 OE1 GLU C 9 0.542 11.296 0.677 1.00 0.00 O ATOM 1711 OE2 GLU C 9 2.703 11.530 0.893 1.00 0.00 O ATOM 0 H GLU C 9 0.746 11.780 6.523 1.00 0.00 H new ATOM 0 HA GLU C 9 2.867 12.530 4.645 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.048 12.249 3.914 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.093 13.218 3.002 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.409 10.771 3.273 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.733 10.303 3.067 1.00 0.00 H new ATOM 1718 N VAL C 10 2.367 14.914 5.158 1.00 0.00 N ATOM 1719 CA VAL C 10 2.282 16.264 5.663 1.00 0.00 C ATOM 1720 C VAL C 10 2.419 17.219 4.492 1.00 0.00 C ATOM 1721 O VAL C 10 3.086 16.903 3.509 1.00 0.00 O ATOM 1722 CB VAL C 10 3.382 16.529 6.721 1.00 0.00 C ATOM 1723 CG1 VAL C 10 4.769 16.284 6.144 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.276 17.940 7.282 1.00 0.00 C ATOM 0 H VAL C 10 3.141 14.763 4.511 1.00 0.00 H new ATOM 0 HA VAL C 10 1.320 16.414 6.154 1.00 0.00 H new ATOM 0 HB VAL C 10 3.227 15.827 7.540 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.521 16.478 6.909 1.00 0.00 H new ATOM 0 HG12 VAL C 10 4.847 15.249 5.812 1.00 0.00 H new ATOM 0 HG13 VAL C 10 4.933 16.950 5.297 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.061 18.097 8.022 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.390 18.662 6.474 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.302 18.072 7.753 1.00 0.00 H new ATOM 1734 N ALA C 11 1.772 18.365 4.572 1.00 0.00 N ATOM 1735 CA ALA C 11 1.785 19.307 3.472 1.00 0.00 C ATOM 1736 C ALA C 11 3.188 19.845 3.233 1.00 0.00 C ATOM 1737 O ALA C 11 3.904 20.199 4.175 1.00 0.00 O ATOM 1738 CB ALA C 11 0.812 20.432 3.767 1.00 0.00 C ATOM 0 H ALA C 11 1.233 18.665 5.384 1.00 0.00 H new ATOM 0 HA ALA C 11 1.474 18.798 2.560 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.818 21.144 2.942 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.191 20.023 3.886 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.109 20.938 4.685 1.00 0.00 H new ATOM 1744 N CYS C 12 3.565 19.889 1.956 1.00 0.00 N ATOM 1745 CA CYS C 12 4.916 20.203 1.509 1.00 0.00 C ATOM 1746 C CYS C 12 5.405 21.598 1.906 1.00 0.00 C ATOM 1747 O CYS C 12 4.631 22.422 2.382 1.00 0.00 O ATOM 1748 CB CYS C 12 4.925 20.122 -0.014 1.00 0.00 C ATOM 1749 SG CYS C 12 5.964 18.824 -0.703 1.00 0.00 S ATOM 0 H CYS C 12 2.922 19.702 1.187 1.00 0.00 H new ATOM 0 HA CYS C 12 5.585 19.489 1.990 1.00 0.00 H new ATOM 0 HB2 CYS C 12 3.903 19.970 -0.360 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.257 21.081 -0.411 1.00 0.00 H new ATOM 1754 N PRO C 13 6.711 21.875 1.685 1.00 0.00 N ATOM 1755 CA PRO C 13 7.296 23.211 1.874 1.00 0.00 C ATOM 1756 C PRO C 13 6.475 24.342 1.243 1.00 0.00 C ATOM 1757 O PRO C 13 6.288 25.397 1.843 1.00 0.00 O ATOM 1758 CB PRO C 13 8.630 23.084 1.135 1.00 0.00 C ATOM 1759 CG PRO C 13 9.033 21.666 1.318 1.00 0.00 C ATOM 1760 CD PRO C 13 7.743 20.882 1.295 1.00 0.00 C ATOM 0 HA PRO C 13 7.359 23.473 2.930 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.522 23.331 0.079 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.376 23.763 1.547 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.705 21.342 0.523 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.562 21.526 2.260 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.545 20.468 0.306 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.773 20.044 1.991 1.00 0.00 H new ATOM 1768 N LYS C 14 5.967 24.096 0.036 1.00 0.00 N ATOM 1769 CA LYS C 14 5.419 25.169 -0.790 1.00 0.00 C ATOM 1770 C LYS C 14 4.258 24.712 -1.675 1.00 0.00 C ATOM 1771 O LYS C 14 3.382 25.505 -2.008 1.00 0.00 O ATOM 1772 CB LYS C 14 6.528 25.731 -1.691 1.00 0.00 C ATOM 1773 CG LYS C 14 6.060 26.803 -2.672 1.00 0.00 C ATOM 1774 CD LYS C 14 6.687 26.595 -4.046 1.00 0.00 C ATOM 1775 CE LYS C 14 6.288 27.684 -5.033 1.00 0.00 C ATOM 1776 NZ LYS C 14 4.825 27.943 -5.043 1.00 0.00 N ATOM 0 H LYS C 14 5.924 23.170 -0.389 1.00 0.00 H new ATOM 0 HA LYS C 14 5.034 25.927 -0.108 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.314 26.149 -1.062 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.973 24.910 -2.253 1.00 0.00 H new ATOM 0 HG2 LYS C 14 4.974 26.775 -2.756 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.325 27.790 -2.292 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.772 26.576 -3.949 1.00 0.00 H new ATOM 0 HD3 LYS C 14 6.385 25.624 -4.438 1.00 0.00 H new ATOM 0 HE2 LYS C 14 6.814 28.605 -4.783 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.608 27.396 -6.034 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 4.581 28.522 -5.872 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 4.313 27.039 -5.089 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 4.556 28.449 -4.175 1.00 0.00 H new ATOM 1790 N CYS C 15 4.242 23.447 -2.085 1.00 0.00 N ATOM 1791 CA CYS C 15 3.345 23.067 -3.173 1.00 0.00 C ATOM 1792 C CYS C 15 2.247 22.085 -2.768 1.00 0.00 C ATOM 1793 O CYS C 15 1.867 21.212 -3.551 1.00 0.00 O ATOM 1794 CB CYS C 15 4.219 22.408 -4.237 1.00 0.00 C ATOM 1795 SG CYS C 15 4.774 20.728 -3.806 1.00 0.00 S ATOM 0 H CYS C 15 4.814 22.695 -1.700 1.00 0.00 H new ATOM 0 HA CYS C 15 2.830 23.964 -3.518 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.663 22.366 -5.174 1.00 0.00 H new ATOM 0 HB3 CYS C 15 5.094 23.034 -4.413 1.00 0.00 H new ATOM 1800 N GLU C 16 1.661 22.303 -1.608 1.00 0.00 N ATOM 1801 CA GLU C 16 0.627 21.424 -1.080 1.00 0.00 C ATOM 1802 C GLU C 16 -0.731 21.901 -1.535 1.00 0.00 C ATOM 1803 O GLU C 16 -1.743 21.673 -0.874 1.00 0.00 O ATOM 1804 CB GLU C 16 0.656 21.457 0.451 1.00 0.00 C ATOM 1805 CG GLU C 16 1.807 22.244 1.051 1.00 0.00 C ATOM 1806 CD GLU C 16 1.514 23.730 1.090 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.748 24.403 0.070 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.031 24.224 2.130 1.00 0.00 O ATOM 0 H GLU C 16 1.885 23.093 -1.002 1.00 0.00 H new ATOM 0 HA GLU C 16 0.810 20.412 -1.441 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.282 21.883 0.809 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.703 20.433 0.821 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.004 21.886 2.061 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.711 22.067 0.468 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.749 22.557 -2.674 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.893 23.320 -3.102 1.00 0.00 C ATOM 1817 C ARG C 17 -1.973 23.228 -4.624 1.00 0.00 C ATOM 1818 O ARG C 17 -3.012 23.481 -5.231 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.733 24.776 -2.653 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.515 25.459 -3.261 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.161 26.742 -2.530 1.00 0.00 C ATOM 1822 NE ARG C 17 0.384 26.484 -1.197 1.00 0.00 N ATOM 1823 CZ ARG C 17 0.452 27.394 -0.230 1.00 0.00 C ATOM 1824 NH1 ARG C 17 0.031 28.635 -0.448 1.00 0.00 N ATOM 1825 NH2 ARG C 17 0.956 27.061 0.950 1.00 0.00 N ATOM 0 H ARG C 17 0.033 22.574 -3.329 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.810 22.929 -2.661 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.629 25.334 -2.925 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.655 24.808 -1.566 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.336 24.778 -3.231 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.709 25.681 -4.310 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.567 27.304 -3.116 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -1.050 27.366 -2.443 1.00 0.00 H new ATOM 0 HE ARG C 17 0.734 25.547 -0.997 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -0.346 28.893 -1.360 1.00 0.00 H new ATOM 0 HH12 ARG C 17 0.085 29.330 0.297 1.00 0.00 H new ATOM 0 HH21 ARG C 17 1.289 26.111 1.112 1.00 0.00 H new ATOM 0 HH22 ARG C 17 1.011 27.755 1.695 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.837 22.850 -5.225 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.692 22.882 -6.676 1.00 0.00 C ATOM 1841 C ALA C 18 -0.020 21.630 -7.227 1.00 0.00 C ATOM 1842 O ALA C 18 -0.365 21.164 -8.310 1.00 0.00 O ATOM 1843 CB ALA C 18 0.083 24.121 -7.098 1.00 0.00 C ATOM 0 H ALA C 18 -0.011 22.520 -4.726 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.697 22.916 -7.096 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.185 24.134 -8.183 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.452 25.013 -6.773 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.072 24.105 -6.641 1.00 0.00 H new ATOM 1849 N GLY C 19 0.924 21.076 -6.471 1.00 0.00 N ATOM 1850 CA GLY C 19 1.637 19.897 -6.926 1.00 0.00 C ATOM 1851 C GLY C 19 2.863 20.212 -7.771 1.00 0.00 C ATOM 1852 O GLY C 19 3.348 19.354 -8.503 1.00 0.00 O ATOM 0 H GLY C 19 1.207 21.422 -5.554 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.945 19.312 -6.059 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.957 19.273 -7.506 1.00 0.00 H new ATOM 1856 N GLU C 20 3.410 21.413 -7.623 1.00 0.00 N ATOM 1857 CA GLU C 20 4.548 21.833 -8.441 1.00 0.00 C ATOM 1858 C GLU C 20 5.482 22.744 -7.668 1.00 0.00 C ATOM 1859 O GLU C 20 5.096 23.355 -6.679 1.00 0.00 O ATOM 1860 CB GLU C 20 4.103 22.569 -9.706 1.00 0.00 C ATOM 1861 CG GLU C 20 3.146 23.718 -9.437 1.00 0.00 C ATOM 1862 CD GLU C 20 3.323 24.857 -10.417 1.00 0.00 C ATOM 1863 OE1 GLU C 20 2.683 24.836 -11.486 1.00 0.00 O ATOM 1864 OE2 GLU C 20 4.113 25.782 -10.116 1.00 0.00 O ATOM 0 H GLU C 20 3.089 22.110 -6.951 1.00 0.00 H new ATOM 0 HA GLU C 20 5.070 20.917 -8.720 1.00 0.00 H new ATOM 0 HB2 GLU C 20 4.983 22.954 -10.221 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.624 21.859 -10.380 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.120 23.353 -9.490 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.301 24.087 -8.423 1.00 0.00 H new ATOM 1871 N ILE C 21 6.703 22.834 -8.138 1.00 0.00 N ATOM 1872 CA ILE C 21 7.665 23.776 -7.613 1.00 0.00 C ATOM 1873 C ILE C 21 8.210 24.570 -8.779 1.00 0.00 C ATOM 1874 O ILE C 21 8.978 24.044 -9.579 1.00 0.00 O ATOM 1875 CB ILE C 21 8.838 23.093 -6.869 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.349 22.358 -5.615 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.904 24.116 -6.495 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.768 23.263 -4.552 1.00 0.00 C ATOM 0 H ILE C 21 7.060 22.255 -8.898 1.00 0.00 H new ATOM 0 HA ILE C 21 7.160 24.410 -6.884 1.00 0.00 H new ATOM 0 HB ILE C 21 9.276 22.358 -7.545 1.00 0.00 H new ATOM 0 HG12 ILE C 21 7.594 21.628 -5.907 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.182 21.801 -5.186 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.720 23.617 -5.973 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.287 24.589 -7.399 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.468 24.875 -5.845 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.447 22.664 -3.700 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.525 23.977 -4.228 1.00 0.00 H new ATOM 0 HD13 ILE C 21 6.913 23.801 -4.960 1.00 0.00 H new ATOM 1890 N GLU C 22 7.780 25.816 -8.889 1.00 0.00 N ATOM 1891 CA GLU C 22 8.194 26.673 -9.989 1.00 0.00 C ATOM 1892 C GLU C 22 7.800 26.055 -11.343 1.00 0.00 C ATOM 1893 O GLU C 22 8.651 25.849 -12.209 1.00 0.00 O ATOM 1894 CB GLU C 22 9.714 26.872 -9.912 1.00 0.00 C ATOM 1895 CG GLU C 22 10.232 28.057 -10.698 1.00 0.00 C ATOM 1896 CD GLU C 22 9.694 29.368 -10.180 1.00 0.00 C ATOM 1897 OE1 GLU C 22 10.235 29.883 -9.180 1.00 0.00 O ATOM 1898 OE2 GLU C 22 8.733 29.893 -10.772 1.00 0.00 O ATOM 0 H GLU C 22 7.142 26.258 -8.228 1.00 0.00 H new ATOM 0 HA GLU C 22 7.691 27.636 -9.907 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.000 26.992 -8.867 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.205 25.969 -10.275 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.321 28.071 -10.654 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.957 27.943 -11.746 1.00 0.00 H new ATOM 1905 N GLY C 23 6.518 25.718 -11.516 1.00 0.00 N ATOM 1906 CA GLY C 23 6.057 25.133 -12.777 1.00 0.00 C ATOM 1907 C GLY C 23 6.706 23.801 -13.086 1.00 0.00 C ATOM 1908 O GLY C 23 6.560 23.247 -14.177 1.00 0.00 O ATOM 0 H GLY C 23 5.792 25.838 -10.810 1.00 0.00 H new ATOM 0 HA2 GLY C 23 4.976 25.003 -12.736 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.264 25.829 -13.590 1.00 0.00 H new ATOM 1912 N THR C 24 7.404 23.298 -12.107 1.00 0.00 N ATOM 1913 CA THR C 24 8.316 22.196 -12.279 1.00 0.00 C ATOM 1914 C THR C 24 8.013 21.072 -11.281 1.00 0.00 C ATOM 1915 O THR C 24 7.591 21.335 -10.154 1.00 0.00 O ATOM 1916 CB THR C 24 9.727 22.783 -12.096 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.141 23.425 -13.309 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.767 21.763 -11.655 1.00 0.00 C ATOM 0 H THR C 24 7.356 23.646 -11.150 1.00 0.00 H new ATOM 0 HA THR C 24 8.221 21.738 -13.264 1.00 0.00 H new ATOM 0 HB THR C 24 9.660 23.508 -11.285 1.00 0.00 H new ATOM 0 HG1 THR C 24 9.805 24.346 -13.323 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.735 22.253 -11.548 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.471 21.332 -10.699 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.841 20.973 -12.402 1.00 0.00 H new ATOM 1926 N PRO C 25 8.184 19.801 -11.704 1.00 0.00 N ATOM 1927 CA PRO C 25 7.899 18.627 -10.866 1.00 0.00 C ATOM 1928 C PRO C 25 8.633 18.674 -9.529 1.00 0.00 C ATOM 1929 O PRO C 25 9.843 18.895 -9.469 1.00 0.00 O ATOM 1930 CB PRO C 25 8.376 17.442 -11.717 1.00 0.00 C ATOM 1931 CG PRO C 25 9.274 18.048 -12.739 1.00 0.00 C ATOM 1932 CD PRO C 25 8.684 19.397 -13.026 1.00 0.00 C ATOM 0 HA PRO C 25 6.844 18.566 -10.600 1.00 0.00 H new ATOM 0 HB2 PRO C 25 8.905 16.707 -11.111 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.537 16.926 -12.183 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.294 18.135 -12.365 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.316 17.436 -13.640 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.428 20.094 -13.411 1.00 0.00 H new ATOM 0 HD3 PRO C 25 7.885 19.344 -13.765 1.00 0.00 H new ATOM 1940 N CYS C 26 7.884 18.450 -8.460 1.00 0.00 N ATOM 1941 CA CYS C 26 8.376 18.686 -7.114 1.00 0.00 C ATOM 1942 C CYS C 26 9.160 17.501 -6.535 1.00 0.00 C ATOM 1943 O CYS C 26 8.697 16.362 -6.582 1.00 0.00 O ATOM 1944 CB CYS C 26 7.207 19.042 -6.212 1.00 0.00 C ATOM 1945 SG CYS C 26 7.681 19.325 -4.483 1.00 0.00 S ATOM 0 H CYS C 26 6.926 18.102 -8.501 1.00 0.00 H new ATOM 0 HA CYS C 26 9.083 19.514 -7.167 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.721 19.938 -6.598 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.471 18.239 -6.251 1.00 0.00 H new ATOM 1950 N PRO C 27 10.336 17.808 -5.933 1.00 0.00 N ATOM 1951 CA PRO C 27 11.295 16.844 -5.356 1.00 0.00 C ATOM 1952 C PRO C 27 10.704 15.550 -4.785 1.00 0.00 C ATOM 1953 O PRO C 27 10.964 14.456 -5.286 1.00 0.00 O ATOM 1954 CB PRO C 27 11.894 17.659 -4.212 1.00 0.00 C ATOM 1955 CG PRO C 27 11.878 19.082 -4.664 1.00 0.00 C ATOM 1956 CD PRO C 27 10.864 19.181 -5.791 1.00 0.00 C ATOM 0 HA PRO C 27 11.974 16.482 -6.128 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.313 17.534 -3.298 1.00 0.00 H new ATOM 0 HB3 PRO C 27 12.910 17.332 -3.991 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.606 19.744 -3.842 1.00 0.00 H new ATOM 0 HG3 PRO C 27 12.866 19.388 -5.007 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.071 19.889 -5.551 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.329 19.525 -6.715 1.00 0.00 H new ATOM 1964 N ALA C 28 9.889 15.693 -3.746 1.00 0.00 N ATOM 1965 CA ALA C 28 9.518 14.554 -2.908 1.00 0.00 C ATOM 1966 C ALA C 28 8.017 14.293 -2.897 1.00 0.00 C ATOM 1967 O ALA C 28 7.550 13.359 -2.249 1.00 0.00 O ATOM 1968 CB ALA C 28 10.024 14.766 -1.490 1.00 0.00 C ATOM 0 H ALA C 28 9.473 16.580 -3.463 1.00 0.00 H new ATOM 0 HA ALA C 28 9.989 13.671 -3.341 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.743 13.913 -0.872 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.110 14.864 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.582 15.673 -1.078 1.00 0.00 H new ATOM 1974 N CYS C 29 7.249 15.112 -3.599 1.00 0.00 N ATOM 1975 CA CYS C 29 5.812 14.861 -3.636 1.00 0.00 C ATOM 1976 C CYS C 29 5.289 14.674 -5.051 1.00 0.00 C ATOM 1977 O CYS C 29 4.109 14.417 -5.225 1.00 0.00 O ATOM 1978 CB CYS C 29 5.039 15.995 -2.946 1.00 0.00 C ATOM 1979 SG CYS C 29 5.137 17.623 -3.765 1.00 0.00 S ATOM 0 H CYS C 29 7.574 15.921 -4.129 1.00 0.00 H new ATOM 0 HA CYS C 29 5.649 13.929 -3.096 1.00 0.00 H new ATOM 0 HB2 CYS C 29 3.990 15.706 -2.875 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.411 16.097 -1.927 1.00 0.00 H new ATOM 1984 N SER C 30 6.174 14.809 -6.038 1.00 0.00 N ATOM 1985 CA SER C 30 5.893 14.473 -7.448 1.00 0.00 C ATOM 1986 C SER C 30 4.485 14.883 -7.931 1.00 0.00 C ATOM 1987 O SER C 30 3.916 14.236 -8.811 1.00 0.00 O ATOM 1988 CB SER C 30 6.089 12.970 -7.647 1.00 0.00 C ATOM 1989 OG SER C 30 7.364 12.559 -7.177 1.00 0.00 O ATOM 0 H SER C 30 7.120 15.159 -5.887 1.00 0.00 H new ATOM 0 HA SER C 30 6.593 15.051 -8.052 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.308 12.424 -7.117 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.990 12.723 -8.704 1.00 0.00 H new ATOM 0 HG SER C 30 7.467 11.594 -7.313 1.00 0.00 H new ATOM 1995 N GLY C 31 3.930 15.952 -7.367 1.00 0.00 N ATOM 1996 CA GLY C 31 2.640 16.436 -7.820 1.00 0.00 C ATOM 1997 C GLY C 31 1.460 15.904 -7.018 1.00 0.00 C ATOM 1998 O GLY C 31 0.374 15.732 -7.567 1.00 0.00 O ATOM 0 H GLY C 31 4.349 16.489 -6.608 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.636 17.525 -7.773 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.508 16.161 -8.866 1.00 0.00 H new ATOM 2002 N LYS C 32 1.655 15.641 -5.723 1.00 0.00 N ATOM 2003 CA LYS C 32 0.553 15.230 -4.852 1.00 0.00 C ATOM 2004 C LYS C 32 0.113 16.396 -3.964 1.00 0.00 C ATOM 2005 O LYS C 32 -1.067 16.549 -3.659 1.00 0.00 O ATOM 2006 CB LYS C 32 0.970 14.065 -3.948 1.00 0.00 C ATOM 2007 CG LYS C 32 1.532 12.868 -4.695 1.00 0.00 C ATOM 2008 CD LYS C 32 1.821 11.691 -3.767 1.00 0.00 C ATOM 2009 CE LYS C 32 2.749 12.055 -2.616 1.00 0.00 C ATOM 2010 NZ LYS C 32 2.005 12.550 -1.425 1.00 0.00 N ATOM 0 H LYS C 32 2.560 15.705 -5.258 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.270 14.915 -5.494 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.717 14.420 -3.238 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.106 13.743 -3.367 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.824 12.557 -5.464 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.450 13.159 -5.206 1.00 0.00 H new ATOM 0 HD2 LYS C 32 0.881 11.314 -3.363 1.00 0.00 H new ATOM 0 HD3 LYS C 32 2.267 10.881 -4.344 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.338 11.181 -2.337 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.451 12.820 -2.947 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 2.056 13.588 -1.391 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.010 12.254 -1.489 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 2.429 12.154 -0.562 1.00 0.00 H new ATOM 2024 N GLY C 33 1.084 17.204 -3.534 1.00 0.00 N ATOM 2025 CA GLY C 33 0.818 18.291 -2.623 1.00 0.00 C ATOM 2026 C GLY C 33 1.437 18.033 -1.262 1.00 0.00 C ATOM 2027 O GLY C 33 2.038 18.921 -0.663 1.00 0.00 O ATOM 0 H GLY C 33 2.062 17.116 -3.810 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.214 19.219 -3.035 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.259 18.424 -2.516 1.00 0.00 H new ATOM 2031 N VAL C 34 1.369 16.790 -0.814 1.00 0.00 N ATOM 2032 CA VAL C 34 1.886 16.422 0.498 1.00 0.00 C ATOM 2033 C VAL C 34 3.099 15.501 0.378 1.00 0.00 C ATOM 2034 O VAL C 34 3.335 14.906 -0.678 1.00 0.00 O ATOM 2035 CB VAL C 34 0.801 15.729 1.354 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.324 16.692 1.693 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.246 14.508 0.638 1.00 0.00 C ATOM 0 H VAL C 34 0.961 16.016 -1.339 1.00 0.00 H new ATOM 0 HA VAL C 34 2.190 17.346 0.990 1.00 0.00 H new ATOM 0 HB VAL C 34 1.269 15.405 2.284 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -1.073 16.179 2.295 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.076 17.536 2.254 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.784 17.053 0.773 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.516 14.037 1.259 1.00 0.00 H new ATOM 0 HG22 VAL C 34 -0.197 14.812 -0.310 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.052 13.798 0.451 1.00 0.00 H new ATOM 2047 N ILE C 35 3.862 15.397 1.460 1.00 0.00 N ATOM 2048 CA ILE C 35 5.037 14.536 1.518 1.00 0.00 C ATOM 2049 C ILE C 35 4.933 13.573 2.688 1.00 0.00 C ATOM 2050 O ILE C 35 4.209 13.825 3.641 1.00 0.00 O ATOM 2051 CB ILE C 35 6.349 15.334 1.658 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.183 16.457 2.689 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.790 15.882 0.313 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.447 17.249 2.946 1.00 0.00 C ATOM 0 H ILE C 35 3.683 15.909 2.324 1.00 0.00 H new ATOM 0 HA ILE C 35 5.064 13.991 0.574 1.00 0.00 H new ATOM 0 HB ILE C 35 7.130 14.662 2.014 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.403 17.138 2.347 1.00 0.00 H new ATOM 0 HG13 ILE C 35 5.840 16.025 3.629 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.717 16.442 0.435 1.00 0.00 H new ATOM 0 HG22 ILE C 35 6.952 15.057 -0.381 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.017 16.542 -0.082 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.247 18.024 3.686 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.224 16.582 3.319 1.00 0.00 H new ATOM 0 HD13 ILE C 35 7.781 17.712 2.018 1.00 0.00 H new ATOM 2066 N LEU C 36 5.677 12.486 2.616 1.00 0.00 N ATOM 2067 CA LEU C 36 5.555 11.413 3.593 1.00 0.00 C ATOM 2068 C LEU C 36 6.448 11.624 4.807 1.00 0.00 C ATOM 2069 O LEU C 36 7.378 12.431 4.791 1.00 0.00 O ATOM 2070 CB LEU C 36 5.899 10.070 2.946 1.00 0.00 C ATOM 2071 CG LEU C 36 5.154 9.763 1.648 1.00 0.00 C ATOM 2072 CD1 LEU C 36 5.967 10.194 0.434 1.00 0.00 C ATOM 2073 CD2 LEU C 36 4.810 8.291 1.576 1.00 0.00 C ATOM 0 H LEU C 36 6.375 12.319 1.891 1.00 0.00 H new ATOM 0 HA LEU C 36 4.520 11.416 3.935 1.00 0.00 H new ATOM 0 HB2 LEU C 36 6.970 10.045 2.746 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.690 9.276 3.663 1.00 0.00 H new ATOM 0 HG LEU C 36 4.226 10.334 1.642 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.413 9.963 -0.476 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.154 11.267 0.483 1.00 0.00 H new ATOM 0 HD13 LEU C 36 6.917 9.661 0.425 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.279 8.086 0.646 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.726 7.701 1.608 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.176 8.024 2.422 1.00 0.00 H new ATOM 2085 N THR C 37 6.147 10.873 5.855 1.00 0.00 N ATOM 2086 CA THR C 37 6.952 10.849 7.064 1.00 0.00 C ATOM 2087 C THR C 37 7.732 9.542 7.101 1.00 0.00 C ATOM 2088 O THR C 37 7.574 8.728 6.203 1.00 0.00 O ATOM 2089 CB THR C 37 6.059 10.945 8.317 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.167 9.821 8.370 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.243 12.226 8.311 1.00 0.00 C ATOM 0 H THR C 37 5.333 10.260 5.890 1.00 0.00 H new ATOM 0 HA THR C 37 7.631 11.702 7.059 1.00 0.00 H new ATOM 0 HB THR C 37 6.709 10.947 9.192 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.418 10.025 8.969 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.623 12.267 9.206 1.00 0.00 H new ATOM 0 HG22 THR C 37 5.914 13.085 8.295 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.606 12.247 7.427 1.00 0.00 H new ATOM 2099 N ALA C 38 8.561 9.327 8.115 1.00 0.00 N ATOM 2100 CA ALA C 38 9.347 8.096 8.199 1.00 0.00 C ATOM 2101 C ALA C 38 8.451 6.865 8.165 1.00 0.00 C ATOM 2102 O ALA C 38 8.737 5.898 7.452 1.00 0.00 O ATOM 2103 CB ALA C 38 10.211 8.094 9.447 1.00 0.00 C ATOM 0 H ALA C 38 8.708 9.980 8.885 1.00 0.00 H new ATOM 0 HA ALA C 38 10.000 8.059 7.327 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.787 7.170 9.489 1.00 0.00 H new ATOM 0 HB2 ALA C 38 10.892 8.945 9.420 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.575 8.166 10.330 1.00 0.00 H new ATOM 2109 N GLN C 39 7.367 6.900 8.930 1.00 0.00 N ATOM 2110 CA GLN C 39 6.383 5.825 8.902 1.00 0.00 C ATOM 2111 C GLN C 39 5.805 5.662 7.499 1.00 0.00 C ATOM 2112 O GLN C 39 5.707 4.548 6.985 1.00 0.00 O ATOM 2113 CB GLN C 39 5.261 6.103 9.898 1.00 0.00 C ATOM 2114 CG GLN C 39 4.261 4.965 10.011 1.00 0.00 C ATOM 2115 CD GLN C 39 3.130 5.282 10.961 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.295 6.053 11.907 1.00 0.00 O ATOM 2117 NE2 GLN C 39 1.979 4.677 10.723 1.00 0.00 N ATOM 0 H GLN C 39 7.147 7.659 9.576 1.00 0.00 H new ATOM 0 HA GLN C 39 6.883 4.899 9.184 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.695 6.295 10.879 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.736 7.010 9.599 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.852 4.745 9.025 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.775 4.066 10.350 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.890 4.046 9.926 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.180 4.841 11.336 1.00 0.00 H new ATOM 2126 N GLY C 40 5.449 6.780 6.873 1.00 0.00 N ATOM 2127 CA GLY C 40 4.895 6.737 5.535 1.00 0.00 C ATOM 2128 C GLY C 40 5.920 6.292 4.512 1.00 0.00 C ATOM 2129 O GLY C 40 5.586 5.653 3.519 1.00 0.00 O ATOM 0 H GLY C 40 5.535 7.715 7.271 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.044 6.056 5.516 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.519 7.724 5.266 1.00 0.00 H new ATOM 2133 N TYR C 41 7.178 6.617 4.769 1.00 0.00 N ATOM 2134 CA TYR C 41 8.272 6.223 3.898 1.00 0.00 C ATOM 2135 C TYR C 41 8.538 4.731 3.972 1.00 0.00 C ATOM 2136 O TYR C 41 8.955 4.123 2.986 1.00 0.00 O ATOM 2137 CB TYR C 41 9.536 6.996 4.286 1.00 0.00 C ATOM 2138 CG TYR C 41 9.777 8.236 3.453 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.462 8.164 2.248 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.317 9.477 3.870 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.681 9.294 1.483 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.532 10.611 3.112 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.213 10.515 1.920 1.00 0.00 C ATOM 2144 OH TYR C 41 10.425 11.643 1.161 1.00 0.00 O ATOM 0 H TYR C 41 7.467 7.159 5.583 1.00 0.00 H new ATOM 0 HA TYR C 41 7.990 6.459 2.872 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.467 7.283 5.335 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.397 6.335 4.193 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.830 7.209 1.902 1.00 0.00 H new ATOM 0 HD2 TYR C 41 8.781 9.557 4.804 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.216 9.221 0.548 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.167 11.569 3.453 1.00 0.00 H new ATOM 0 HH TYR C 41 10.031 12.419 1.611 1.00 0.00 H new ATOM 2154 N THR C 42 8.289 4.138 5.124 1.00 0.00 N ATOM 2155 CA THR C 42 8.400 2.695 5.270 1.00 0.00 C ATOM 2156 C THR C 42 7.261 2.006 4.526 1.00 0.00 C ATOM 2157 O THR C 42 7.424 0.925 3.952 1.00 0.00 O ATOM 2158 CB THR C 42 8.356 2.293 6.755 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.298 3.078 7.496 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.671 0.815 6.930 1.00 0.00 C ATOM 0 H THR C 42 8.009 4.630 5.972 1.00 0.00 H new ATOM 0 HA THR C 42 9.355 2.382 4.848 1.00 0.00 H new ATOM 0 HB THR C 42 7.349 2.476 7.130 1.00 0.00 H new ATOM 0 HG1 THR C 42 8.991 4.008 7.533 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.633 0.558 7.989 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.938 0.220 6.385 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.668 0.607 6.542 1.00 0.00 H new ATOM 2168 N LEU C 43 6.120 2.676 4.485 1.00 0.00 N ATOM 2169 CA LEU C 43 4.934 2.109 3.879 1.00 0.00 C ATOM 2170 C LEU C 43 4.921 2.386 2.387 1.00 0.00 C ATOM 2171 O LEU C 43 4.219 1.713 1.644 1.00 0.00 O ATOM 2172 CB LEU C 43 3.660 2.678 4.524 1.00 0.00 C ATOM 2173 CG LEU C 43 3.004 1.824 5.624 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.014 1.444 6.693 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.845 2.580 6.249 1.00 0.00 C ATOM 0 H LEU C 43 5.994 3.614 4.866 1.00 0.00 H new ATOM 0 HA LEU C 43 4.955 1.032 4.044 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.899 3.654 4.947 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.924 2.843 3.737 1.00 0.00 H new ATOM 0 HG LEU C 43 2.630 0.908 5.167 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.525 0.841 7.458 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.823 0.870 6.241 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.420 2.348 7.148 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.388 1.967 7.026 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.210 3.509 6.687 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.104 2.807 5.483 1.00 0.00 H new ATOM 2187 N LEU C 44 5.721 3.348 1.927 1.00 0.00 N ATOM 2188 CA LEU C 44 5.702 3.712 0.522 1.00 0.00 C ATOM 2189 C LEU C 44 6.600 2.773 -0.276 1.00 0.00 C ATOM 2190 O LEU C 44 6.214 2.297 -1.334 1.00 0.00 O ATOM 2191 CB LEU C 44 6.089 5.200 0.324 1.00 0.00 C ATOM 2192 CG LEU C 44 7.575 5.539 0.085 1.00 0.00 C ATOM 2193 CD1 LEU C 44 7.998 5.226 -1.347 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.836 7.009 0.361 1.00 0.00 C ATOM 0 H LEU C 44 6.378 3.878 2.500 1.00 0.00 H new ATOM 0 HA LEU C 44 4.686 3.601 0.144 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.519 5.583 -0.523 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.759 5.750 1.205 1.00 0.00 H new ATOM 0 HG LEU C 44 8.159 4.922 0.768 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.050 5.477 -1.479 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.851 4.164 -1.546 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.395 5.812 -2.041 1.00 0.00 H new ATOM 0 HD21 LEU C 44 8.889 7.230 0.187 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.223 7.618 -0.303 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.584 7.235 1.397 1.00 0.00 H new ATOM 2206 N ASP C 45 7.788 2.483 0.245 1.00 0.00 N ATOM 2207 CA ASP C 45 8.734 1.627 -0.465 1.00 0.00 C ATOM 2208 C ASP C 45 8.249 0.187 -0.452 1.00 0.00 C ATOM 2209 O ASP C 45 8.591 -0.611 -1.326 1.00 0.00 O ATOM 2210 CB ASP C 45 10.123 1.726 0.165 1.00 0.00 C ATOM 2211 CG ASP C 45 11.168 0.932 -0.597 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.440 1.272 -1.762 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.735 -0.026 -0.028 1.00 0.00 O ATOM 0 H ASP C 45 8.117 2.824 1.148 1.00 0.00 H new ATOM 0 HA ASP C 45 8.800 1.965 -1.499 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.426 2.772 0.206 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.078 1.367 1.193 1.00 0.00 H new ATOM 2218 N PHE C 46 7.402 -0.121 0.515 1.00 0.00 N ATOM 2219 CA PHE C 46 6.778 -1.426 0.602 1.00 0.00 C ATOM 2220 C PHE C 46 5.685 -1.557 -0.442 1.00 0.00 C ATOM 2221 O PHE C 46 5.560 -2.591 -1.102 1.00 0.00 O ATOM 2222 CB PHE C 46 6.166 -1.569 1.994 1.00 0.00 C ATOM 2223 CG PHE C 46 5.552 -2.904 2.296 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.314 -3.923 2.838 1.00 0.00 C ATOM 2225 CD2 PHE C 46 4.203 -3.129 2.062 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.745 -5.142 3.144 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.631 -4.347 2.361 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.402 -5.354 2.903 1.00 0.00 C ATOM 0 H PHE C 46 7.130 0.524 1.257 1.00 0.00 H new ATOM 0 HA PHE C 46 7.522 -2.203 0.426 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.940 -1.369 2.735 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.402 -0.801 2.116 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.366 -3.763 3.024 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.595 -2.342 1.641 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.349 -5.929 3.571 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.581 -4.512 2.171 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.955 -6.309 3.139 1.00 0.00 H new ATOM 2238 N ILE C 47 4.913 -0.506 -0.623 1.00 0.00 N ATOM 2239 CA ILE C 47 3.828 -0.560 -1.575 1.00 0.00 C ATOM 2240 C ILE C 47 4.347 -0.354 -2.999 1.00 0.00 C ATOM 2241 O ILE C 47 3.779 -0.874 -3.956 1.00 0.00 O ATOM 2242 CB ILE C 47 2.717 0.455 -1.236 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.276 1.879 -1.209 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.101 0.097 0.107 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.268 2.939 -0.821 1.00 0.00 C ATOM 0 H ILE C 47 5.015 0.382 -0.131 1.00 0.00 H new ATOM 0 HA ILE C 47 3.385 -1.554 -1.513 1.00 0.00 H new ATOM 0 HB ILE C 47 1.947 0.413 -2.007 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.111 1.915 -0.509 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.676 2.118 -2.195 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.315 0.813 0.349 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.676 -0.905 0.057 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.870 0.127 0.879 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.748 3.917 -0.827 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.443 2.935 -1.534 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.885 2.729 0.178 1.00 0.00 H new ATOM 2257 N GLN C 48 5.443 0.385 -3.125 1.00 0.00 N ATOM 2258 CA GLN C 48 6.176 0.461 -4.373 1.00 0.00 C ATOM 2259 C GLN C 48 6.552 -0.935 -4.843 1.00 0.00 C ATOM 2260 O GLN C 48 6.095 -1.397 -5.873 1.00 0.00 O ATOM 2261 CB GLN C 48 7.452 1.287 -4.196 1.00 0.00 C ATOM 2262 CG GLN C 48 7.215 2.779 -4.035 1.00 0.00 C ATOM 2263 CD GLN C 48 6.481 3.385 -5.213 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.598 2.914 -6.343 1.00 0.00 O ATOM 2265 NE2 GLN C 48 5.731 4.442 -4.957 1.00 0.00 N ATOM 0 H GLN C 48 5.842 0.942 -2.369 1.00 0.00 H new ATOM 0 HA GLN C 48 5.537 0.940 -5.115 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.990 0.920 -3.322 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.098 1.125 -5.059 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.641 2.955 -3.125 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.173 3.284 -3.911 1.00 0.00 H new ATOM 0 HE21 GLN C 48 5.662 4.800 -4.004 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.221 4.900 -5.712 1.00 0.00 H new ATOM 2274 N LYS C 49 7.287 -1.632 -4.001 1.00 0.00 N ATOM 2275 CA LYS C 49 7.999 -2.843 -4.392 1.00 0.00 C ATOM 2276 C LYS C 49 7.083 -4.061 -4.512 1.00 0.00 C ATOM 2277 O LYS C 49 7.537 -5.139 -4.875 1.00 0.00 O ATOM 2278 CB LYS C 49 9.084 -3.099 -3.348 1.00 0.00 C ATOM 2279 CG LYS C 49 10.352 -3.734 -3.893 1.00 0.00 C ATOM 2280 CD LYS C 49 11.458 -3.735 -2.847 1.00 0.00 C ATOM 2281 CE LYS C 49 11.680 -2.338 -2.283 1.00 0.00 C ATOM 2282 NZ LYS C 49 12.868 -2.264 -1.397 1.00 0.00 N ATOM 0 H LYS C 49 7.411 -1.378 -3.021 1.00 0.00 H new ATOM 0 HA LYS C 49 8.427 -2.691 -5.383 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.343 -2.153 -2.873 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.676 -3.745 -2.570 1.00 0.00 H new ATOM 0 HG2 LYS C 49 10.144 -4.757 -4.208 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.684 -3.190 -4.777 1.00 0.00 H new ATOM 0 HD2 LYS C 49 11.199 -4.420 -2.039 1.00 0.00 H new ATOM 0 HD3 LYS C 49 12.383 -4.102 -3.292 1.00 0.00 H new ATOM 0 HE2 LYS C 49 11.800 -1.633 -3.105 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.795 -2.030 -1.725 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 12.761 -1.466 -0.739 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 12.954 -3.149 -0.857 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 13.723 -2.125 -1.973 1.00 0.00 H new ATOM 2296 N HIS C 50 5.799 -3.923 -4.196 1.00 0.00 N ATOM 2297 CA HIS C 50 4.884 -5.025 -4.513 1.00 0.00 C ATOM 2298 C HIS C 50 3.799 -4.640 -5.525 1.00 0.00 C ATOM 2299 O HIS C 50 3.001 -5.489 -5.916 1.00 0.00 O ATOM 2300 CB HIS C 50 4.228 -5.552 -3.231 1.00 0.00 C ATOM 2301 CG HIS C 50 5.212 -6.008 -2.197 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.701 -5.178 -1.212 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.809 -7.208 -1.999 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.553 -5.839 -0.458 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.640 -7.073 -0.910 1.00 0.00 N ATOM 0 H HIS C 50 5.381 -3.109 -3.746 1.00 0.00 H new ATOM 0 HA HIS C 50 5.489 -5.804 -4.976 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.602 -4.768 -2.804 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.569 -6.383 -3.485 1.00 0.00 H new ATOM 0 HD1 HIS C 50 5.442 -4.200 -1.086 1.00 0.00 H new ATOM 0 HD2 HIS C 50 5.661 -8.103 -2.586 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.090 -5.437 0.389 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.227 -7.809 -0.517 1.00 0.00 H new ATOM 2314 N LEU C 51 3.762 -3.383 -5.958 1.00 0.00 N ATOM 2315 CA LEU C 51 2.796 -2.974 -6.988 1.00 0.00 C ATOM 2316 C LEU C 51 3.492 -2.416 -8.219 1.00 0.00 C ATOM 2317 O LEU C 51 3.038 -2.602 -9.346 1.00 0.00 O ATOM 2318 CB LEU C 51 1.835 -1.891 -6.479 1.00 0.00 C ATOM 2319 CG LEU C 51 0.743 -2.335 -5.499 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.046 -3.506 -6.056 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.330 -2.684 -4.150 1.00 0.00 C ATOM 0 H LEU C 51 4.374 -2.639 -5.623 1.00 0.00 H new ATOM 0 HA LEU C 51 2.240 -3.877 -7.241 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.426 -1.112 -5.997 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.350 -1.435 -7.342 1.00 0.00 H new ATOM 0 HG LEU C 51 0.060 -1.496 -5.365 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -0.814 -3.801 -5.341 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.517 -3.214 -6.994 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.626 -4.346 -6.234 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.532 -2.995 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU C 51 2.047 -3.497 -4.264 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.835 -1.811 -3.736 1.00 0.00 H new ATOM 2333 N ASN C 52 4.579 -1.713 -7.992 1.00 0.00 N ATOM 2334 CA ASN C 52 5.190 -0.884 -9.018 1.00 0.00 C ATOM 2335 C ASN C 52 6.684 -1.152 -9.162 1.00 0.00 C ATOM 2336 O ASN C 52 7.253 -0.963 -10.238 1.00 0.00 O ATOM 2337 CB ASN C 52 4.954 0.584 -8.667 1.00 0.00 C ATOM 2338 CG ASN C 52 3.826 1.209 -9.473 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.841 0.408 -9.862 1.00 0.00 O flip ATOM 2340 ND2 ASN C 52 3.841 2.409 -9.746 1.00 0.00 N flip ATOM 0 H ASN C 52 5.066 -1.697 -7.096 1.00 0.00 H new ATOM 0 HA ASN C 52 4.729 -1.128 -9.975 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.724 0.666 -7.605 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.872 1.146 -8.839 1.00 0.00 H new ATOM 0 HD21 ASN C 52 4.614 2.994 -9.430 1.00 0.00 H new ATOM 0 HD22 ASN C 52 3.080 2.818 -10.288 1.00 0.00 H new ATOM 2347 N LYS C 53 7.319 -1.579 -8.088 1.00 0.00 N ATOM 2348 CA LYS C 53 8.734 -1.877 -8.113 1.00 0.00 C ATOM 2349 C LYS C 53 8.963 -3.377 -7.993 1.00 0.00 C ATOM 2350 O LYS C 53 8.780 -4.085 -9.006 1.00 0.00 O ATOM 2351 CB LYS C 53 9.448 -1.120 -6.988 1.00 0.00 C ATOM 2352 CG LYS C 53 10.036 0.207 -7.433 1.00 0.00 C ATOM 2353 CD LYS C 53 11.201 0.633 -6.552 1.00 0.00 C ATOM 2354 CE LYS C 53 10.780 0.872 -5.113 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.928 1.322 -4.283 1.00 0.00 N ATOM 2356 OXT LYS C 53 9.317 -3.845 -6.897 1.00 0.00 O ATOM 0 H LYS C 53 6.872 -1.727 -7.183 1.00 0.00 H new ATOM 0 HA LYS C 53 9.150 -1.549 -9.066 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.744 -0.943 -6.175 1.00 0.00 H new ATOM 0 HB3 LYS C 53 10.245 -1.746 -6.588 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.372 0.127 -8.467 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.262 0.974 -7.408 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.974 -0.135 -6.579 1.00 0.00 H new ATOM 0 HD3 LYS C 53 11.643 1.544 -6.955 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.990 1.622 -5.083 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.364 -0.045 -4.696 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.845 0.919 -3.328 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.817 1.002 -4.718 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 11.927 2.360 -4.222 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -19.830 -4.282 -2.983 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 13.702 -15.336 -3.073 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.266 19.506 -2.910 1.00 0.00 ZN