USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 36 THR OG1 : rot -72:sc= 0.284 USER MOD Set 1.2: A 74 MET CE :methyl 173:sc= -0.144 (180deg=-0.24) USER MOD Set 2.1: A 12 GLN : amide:sc= -0.0075 X(o=-0.019,f=-0.019) USER MOD Set 2.2: A 14 TYR OH : rot 30:sc= -0.0113 USER MOD Single : A 1 MET CE :methyl -141:sc= 0 (180deg=-0.0731) USER MOD Single : A 1 MET N :NH3+ -130:sc= -0.0525 (180deg=-0.642) USER MOD Single : A 8 LYS NZ :NH3+ -124:sc= 0.0412 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0159 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -124:sc= 0.0202 USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.56 USER MOD Single : A 29 LYS NZ :NH3+ 136:sc= -2.7! (180deg=-3.96!) USER MOD Single : A 30 GLN : amide:sc= -0.568 K(o=-0.57,f=-1.4) USER MOD Single : A 33 LYS NZ :NH3+ 142:sc= -3.29! (180deg=-5.74!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -6.34! X(o=-6.3!,f=-6.1) USER MOD Single : A 44 LYS NZ :NH3+ 157:sc= -0.17 (180deg=-0.686) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 151:sc= -0.374 (180deg=-1.53!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -2.5! C(o=-2.5!,f=-7.3!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 143:sc= -0.157 (180deg=-2.05!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0.256 K(o=0.26,f=-4.7!) USER MOD Single : A 70 THR OG1 : rot -166:sc= -0.375 USER MOD Single : A 71 LYS NZ :NH3+ 133:sc= -0.279 (180deg=-2.39!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -178:sc= 0 (180deg=-0.00827) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.560 0.190 -0.105 1.00 0.00 N ATOM 2 CA MET A 1 2.746 0.102 -1.549 1.00 0.00 C ATOM 3 C MET A 1 2.996 -1.340 -1.978 1.00 0.00 C ATOM 4 O MET A 1 3.376 -2.182 -1.165 1.00 0.00 O ATOM 5 CB MET A 1 3.914 0.988 -1.989 1.00 0.00 C ATOM 6 CG MET A 1 3.716 2.460 -1.666 1.00 0.00 C ATOM 7 SD MET A 1 2.512 3.252 -2.751 1.00 0.00 S ATOM 8 CE MET A 1 3.489 3.475 -4.235 1.00 0.00 C ATOM 0 H1 MET A 1 1.697 0.732 0.101 1.00 0.00 H new ATOM 0 H2 MET A 1 2.471 -0.767 0.292 1.00 0.00 H new ATOM 0 H3 MET A 1 3.379 0.667 0.322 1.00 0.00 H new ATOM 0 HA MET A 1 1.833 0.452 -2.030 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.827 0.638 -1.506 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.059 0.877 -3.064 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.388 2.560 -0.631 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.671 2.978 -1.750 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.251 4.439 -4.686 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.549 3.445 -3.981 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.263 2.678 -4.943 1.00 0.00 H new ATOM 18 N ALA A 2 2.781 -1.617 -3.260 1.00 0.00 N ATOM 19 CA ALA A 2 2.984 -2.957 -3.797 1.00 0.00 C ATOM 20 C ALA A 2 4.429 -3.155 -4.242 1.00 0.00 C ATOM 21 O ALA A 2 4.914 -2.463 -5.138 1.00 0.00 O ATOM 22 CB ALA A 2 2.033 -3.211 -4.956 1.00 0.00 C ATOM 0 H ALA A 2 2.466 -0.931 -3.946 1.00 0.00 H new ATOM 0 HA ALA A 2 2.773 -3.676 -3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.196 -4.215 -5.347 1.00 0.00 H new ATOM 0 HB2 ALA A 2 1.004 -3.119 -4.609 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.217 -2.481 -5.744 1.00 0.00 H new ATOM 28 N LEU A 3 5.112 -4.105 -3.612 1.00 0.00 N ATOM 29 CA LEU A 3 6.503 -4.394 -3.943 1.00 0.00 C ATOM 30 C LEU A 3 6.594 -5.475 -5.016 1.00 0.00 C ATOM 31 O LEU A 3 6.224 -6.630 -4.801 1.00 0.00 O ATOM 32 CB LEU A 3 7.265 -4.836 -2.692 1.00 0.00 C ATOM 33 CG LEU A 3 7.968 -3.727 -1.908 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.729 -4.309 -0.728 1.00 0.00 C ATOM 35 CD2 LEU A 3 8.905 -2.944 -2.816 1.00 0.00 C ATOM 0 H LEU A 3 4.725 -4.688 -2.870 1.00 0.00 H new ATOM 0 HA LEU A 3 6.955 -3.482 -4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.566 -5.339 -2.024 1.00 0.00 H new ATOM 0 HB3 LEU A 3 8.011 -5.574 -2.987 1.00 0.00 H new ATOM 0 HG LEU A 3 7.211 -3.043 -1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.223 -3.506 -0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.034 -4.825 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.477 -5.015 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.397 -2.159 -2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 3 9.657 -3.616 -3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 3 8.334 -2.495 -3.628 1.00 0.00 H new ATOM 47 N PRO A 4 7.099 -5.095 -6.198 1.00 0.00 N ATOM 48 CA PRO A 4 7.253 -6.018 -7.327 1.00 0.00 C ATOM 49 C PRO A 4 8.344 -7.055 -7.083 1.00 0.00 C ATOM 50 O PRO A 4 9.261 -6.831 -6.292 1.00 0.00 O ATOM 51 CB PRO A 4 7.640 -5.098 -8.488 1.00 0.00 C ATOM 52 CG PRO A 4 8.270 -3.914 -7.839 1.00 0.00 C ATOM 53 CD PRO A 4 7.560 -3.735 -6.525 1.00 0.00 C ATOM 0 HA PRO A 4 6.347 -6.596 -7.507 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.333 -5.591 -9.170 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.767 -4.811 -9.074 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.337 -4.074 -7.687 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.166 -3.026 -8.463 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.227 -3.342 -5.758 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.726 -3.038 -6.610 1.00 0.00 H new ATOM 61 N ILE A 5 8.239 -8.189 -7.768 1.00 0.00 N ATOM 62 CA ILE A 5 9.219 -9.259 -7.626 1.00 0.00 C ATOM 63 C ILE A 5 9.391 -10.023 -8.935 1.00 0.00 C ATOM 64 O ILE A 5 8.414 -10.460 -9.544 1.00 0.00 O ATOM 65 CB ILE A 5 8.815 -10.249 -6.517 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.041 -9.623 -5.139 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.600 -11.545 -6.652 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.640 -10.580 -4.132 1.00 0.00 C ATOM 0 H ILE A 5 7.486 -8.390 -8.426 1.00 0.00 H new ATOM 0 HA ILE A 5 10.164 -8.788 -7.355 1.00 0.00 H new ATOM 0 HB ILE A 5 7.754 -10.478 -6.622 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.699 -8.760 -5.244 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.090 -9.254 -4.756 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.303 -12.234 -5.861 1.00 0.00 H new ATOM 0 HG22 ILE A 5 9.394 -11.996 -7.623 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.666 -11.335 -6.569 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.773 -10.069 -3.178 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.973 -11.431 -3.998 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.607 -10.930 -4.493 1.00 0.00 H new ATOM 80 N ILE A 6 10.640 -10.182 -9.360 1.00 0.00 N ATOM 81 CA ILE A 6 10.941 -10.896 -10.595 1.00 0.00 C ATOM 82 C ILE A 6 11.302 -12.350 -10.315 1.00 0.00 C ATOM 83 O ILE A 6 12.129 -12.641 -9.451 1.00 0.00 O ATOM 84 CB ILE A 6 12.098 -10.230 -11.363 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.688 -8.835 -11.839 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.519 -11.095 -12.541 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.810 -7.823 -11.783 1.00 0.00 C ATOM 0 H ILE A 6 11.459 -9.826 -8.868 1.00 0.00 H new ATOM 0 HA ILE A 6 10.040 -10.859 -11.208 1.00 0.00 H new ATOM 0 HB ILE A 6 12.949 -10.128 -10.690 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.322 -8.903 -12.863 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.859 -8.480 -11.227 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.337 -10.611 -13.074 1.00 0.00 H new ATOM 0 HG22 ILE A 6 12.848 -12.069 -12.178 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.674 -11.226 -13.217 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.447 -6.857 -12.135 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.162 -7.726 -10.756 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.631 -8.155 -12.418 1.00 0.00 H new ATOM 99 N VAL A 7 10.677 -13.262 -11.053 1.00 0.00 N ATOM 100 CA VAL A 7 10.934 -14.688 -10.887 1.00 0.00 C ATOM 101 C VAL A 7 11.632 -15.267 -12.112 1.00 0.00 C ATOM 102 O VAL A 7 11.366 -14.859 -13.243 1.00 0.00 O ATOM 103 CB VAL A 7 9.630 -15.468 -10.636 1.00 0.00 C ATOM 104 CG1 VAL A 7 8.904 -15.731 -11.946 1.00 0.00 C ATOM 105 CG2 VAL A 7 9.921 -16.771 -9.907 1.00 0.00 C ATOM 0 H VAL A 7 9.989 -13.039 -11.772 1.00 0.00 H new ATOM 0 HA VAL A 7 11.584 -14.793 -10.019 1.00 0.00 H new ATOM 0 HB VAL A 7 8.981 -14.862 -10.004 1.00 0.00 H new ATOM 0 HG11 VAL A 7 7.985 -16.283 -11.748 1.00 0.00 H new ATOM 0 HG12 VAL A 7 8.661 -14.782 -12.424 1.00 0.00 H new ATOM 0 HG13 VAL A 7 9.544 -16.317 -12.606 1.00 0.00 H new ATOM 0 HG21 VAL A 7 8.988 -17.309 -9.738 1.00 0.00 H new ATOM 0 HG22 VAL A 7 10.590 -17.384 -10.511 1.00 0.00 H new ATOM 0 HG23 VAL A 7 10.394 -16.554 -8.949 1.00 0.00 H new ATOM 115 N LYS A 8 12.526 -16.222 -11.880 1.00 0.00 N ATOM 116 CA LYS A 8 13.263 -16.860 -12.965 1.00 0.00 C ATOM 117 C LYS A 8 13.018 -18.366 -12.976 1.00 0.00 C ATOM 118 O LYS A 8 13.313 -19.059 -12.002 1.00 0.00 O ATOM 119 CB LYS A 8 14.760 -16.577 -12.828 1.00 0.00 C ATOM 120 CG LYS A 8 15.462 -16.359 -14.157 1.00 0.00 C ATOM 121 CD LYS A 8 16.733 -15.544 -13.989 1.00 0.00 C ATOM 122 CE LYS A 8 16.455 -14.052 -14.085 1.00 0.00 C ATOM 123 NZ LYS A 8 17.646 -13.295 -14.561 1.00 0.00 N ATOM 0 H LYS A 8 12.758 -16.571 -10.950 1.00 0.00 H new ATOM 0 HA LYS A 8 12.906 -16.444 -13.907 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.899 -15.694 -12.204 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.233 -17.411 -12.309 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.703 -17.323 -14.604 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.789 -15.848 -14.845 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.186 -15.769 -13.024 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.454 -15.831 -14.754 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.621 -13.881 -14.765 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.152 -13.675 -13.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.886 -12.556 -13.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 18.451 -13.945 -14.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.434 -12.855 -15.479 1.00 0.00 H new ATOM 137 N TRP A 9 12.479 -18.865 -14.082 1.00 0.00 N ATOM 138 CA TRP A 9 12.197 -20.289 -14.220 1.00 0.00 C ATOM 139 C TRP A 9 12.388 -20.745 -15.662 1.00 0.00 C ATOM 140 O TRP A 9 11.760 -20.216 -16.578 1.00 0.00 O ATOM 141 CB TRP A 9 10.770 -20.594 -13.760 1.00 0.00 C ATOM 142 CG TRP A 9 10.329 -21.990 -14.079 1.00 0.00 C ATOM 143 CD1 TRP A 9 9.156 -22.364 -14.671 1.00 0.00 C ATOM 144 CD2 TRP A 9 11.053 -23.198 -13.821 1.00 0.00 C ATOM 145 NE1 TRP A 9 9.108 -23.731 -14.797 1.00 0.00 N ATOM 146 CE2 TRP A 9 10.260 -24.266 -14.284 1.00 0.00 C ATOM 147 CE3 TRP A 9 12.295 -23.481 -13.247 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.670 -25.593 -14.188 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.700 -24.799 -13.152 1.00 0.00 C ATOM 150 CH2 TRP A 9 11.890 -25.841 -13.621 1.00 0.00 C ATOM 0 H TRP A 9 12.228 -18.305 -14.897 1.00 0.00 H new ATOM 0 HA TRP A 9 12.899 -20.836 -13.590 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.701 -20.436 -12.684 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.086 -19.888 -14.230 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.380 -21.685 -14.993 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.339 -24.262 -15.206 1.00 0.00 H new ATOM 0 HE3 TRP A 9 12.927 -22.684 -12.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 10.047 -26.398 -14.548 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.657 -25.029 -12.709 1.00 0.00 H new ATOM 0 HH2 TRP A 9 12.235 -26.860 -13.533 1.00 0.00 H new ATOM 161 N GLY A 10 13.258 -21.732 -15.856 1.00 0.00 N ATOM 162 CA GLY A 10 13.515 -22.242 -17.190 1.00 0.00 C ATOM 163 C GLY A 10 13.956 -21.156 -18.152 1.00 0.00 C ATOM 164 O GLY A 10 13.621 -21.191 -19.335 1.00 0.00 O ATOM 0 H GLY A 10 13.789 -22.187 -15.113 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.285 -23.012 -17.139 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.613 -22.718 -17.574 1.00 0.00 H new ATOM 168 N GLY A 11 14.710 -20.187 -17.642 1.00 0.00 N ATOM 169 CA GLY A 11 15.184 -19.098 -18.477 1.00 0.00 C ATOM 170 C GLY A 11 14.123 -18.041 -18.707 1.00 0.00 C ATOM 171 O GLY A 11 14.369 -17.045 -19.388 1.00 0.00 O ATOM 0 H GLY A 11 15.001 -20.136 -16.666 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.055 -18.639 -18.010 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.510 -19.496 -19.438 1.00 0.00 H new ATOM 175 N GLN A 12 12.940 -18.258 -18.141 1.00 0.00 N ATOM 176 CA GLN A 12 11.838 -17.315 -18.291 1.00 0.00 C ATOM 177 C GLN A 12 11.883 -16.247 -17.204 1.00 0.00 C ATOM 178 O GLN A 12 12.492 -16.444 -16.153 1.00 0.00 O ATOM 179 CB GLN A 12 10.498 -18.053 -18.243 1.00 0.00 C ATOM 180 CG GLN A 12 10.403 -19.206 -19.229 1.00 0.00 C ATOM 181 CD GLN A 12 10.439 -18.744 -20.672 1.00 0.00 C ATOM 182 OE1 GLN A 12 9.408 -18.400 -21.252 1.00 0.00 O ATOM 183 NE2 GLN A 12 11.629 -18.734 -21.261 1.00 0.00 N ATOM 0 H GLN A 12 12.720 -19.078 -17.575 1.00 0.00 H new ATOM 0 HA GLN A 12 11.941 -16.825 -19.259 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.339 -18.434 -17.234 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.695 -17.345 -18.447 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.226 -19.899 -19.053 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.479 -19.756 -19.051 1.00 0.00 H new ATOM 0 HE21 GLN A 12 12.457 -19.027 -20.743 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.715 -18.433 -22.232 1.00 0.00 H new ATOM 192 N GLU A 13 11.234 -15.116 -17.465 1.00 0.00 N ATOM 193 CA GLU A 13 11.202 -14.016 -16.508 1.00 0.00 C ATOM 194 C GLU A 13 9.779 -13.500 -16.320 1.00 0.00 C ATOM 195 O GLU A 13 9.113 -13.120 -17.283 1.00 0.00 O ATOM 196 CB GLU A 13 12.112 -12.878 -16.975 1.00 0.00 C ATOM 197 CG GLU A 13 13.491 -12.901 -16.338 1.00 0.00 C ATOM 198 CD GLU A 13 14.558 -12.302 -17.234 1.00 0.00 C ATOM 199 OE1 GLU A 13 14.199 -11.541 -18.158 1.00 0.00 O ATOM 200 OE2 GLU A 13 15.752 -12.594 -17.012 1.00 0.00 O ATOM 0 H GLU A 13 10.724 -14.938 -18.330 1.00 0.00 H new ATOM 0 HA GLU A 13 11.563 -14.391 -15.550 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.220 -12.932 -18.058 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.633 -11.925 -16.750 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.462 -12.352 -15.397 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.759 -13.930 -16.098 1.00 0.00 H new ATOM 207 N TYR A 14 9.319 -13.490 -15.074 1.00 0.00 N ATOM 208 CA TYR A 14 7.974 -13.024 -14.759 1.00 0.00 C ATOM 209 C TYR A 14 7.980 -12.148 -13.509 1.00 0.00 C ATOM 210 O TYR A 14 8.344 -12.599 -12.424 1.00 0.00 O ATOM 211 CB TYR A 14 7.033 -14.213 -14.558 1.00 0.00 C ATOM 212 CG TYR A 14 7.102 -15.234 -15.671 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.447 -15.021 -16.878 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.822 -16.412 -15.516 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.506 -15.951 -17.897 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.889 -17.347 -16.531 1.00 0.00 C ATOM 217 CZ TYR A 14 7.229 -17.113 -17.719 1.00 0.00 C ATOM 218 OH TYR A 14 7.291 -18.042 -18.732 1.00 0.00 O ATOM 0 H TYR A 14 9.858 -13.799 -14.265 1.00 0.00 H new ATOM 0 HA TYR A 14 7.618 -12.426 -15.598 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.274 -14.701 -13.613 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.010 -13.846 -14.476 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.882 -14.112 -17.022 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.338 -16.600 -14.586 1.00 0.00 H new ATOM 0 HE1 TYR A 14 5.989 -15.770 -18.828 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.455 -18.256 -16.395 1.00 0.00 H new ATOM 0 HH TYR A 14 7.219 -17.588 -19.597 1.00 0.00 H new ATOM 228 N SER A 15 7.572 -10.894 -13.672 1.00 0.00 N ATOM 229 CA SER A 15 7.532 -9.953 -12.559 1.00 0.00 C ATOM 230 C SER A 15 6.143 -9.915 -11.928 1.00 0.00 C ATOM 231 O SER A 15 5.140 -10.177 -12.592 1.00 0.00 O ATOM 232 CB SER A 15 7.927 -8.553 -13.032 1.00 0.00 C ATOM 233 OG SER A 15 7.279 -8.224 -14.249 1.00 0.00 O ATOM 0 H SER A 15 7.264 -10.506 -14.564 1.00 0.00 H new ATOM 0 HA SER A 15 8.245 -10.290 -11.806 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.666 -7.821 -12.268 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.007 -8.503 -13.166 1.00 0.00 H new ATOM 0 HG SER A 15 7.547 -7.324 -14.529 1.00 0.00 H new ATOM 239 N VAL A 16 6.093 -9.588 -10.641 1.00 0.00 N ATOM 240 CA VAL A 16 4.829 -9.515 -9.919 1.00 0.00 C ATOM 241 C VAL A 16 4.422 -8.067 -9.669 1.00 0.00 C ATOM 242 O VAL A 16 5.270 -7.200 -9.455 1.00 0.00 O ATOM 243 CB VAL A 16 4.908 -10.255 -8.571 1.00 0.00 C ATOM 244 CG1 VAL A 16 4.965 -9.262 -7.419 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.728 -11.201 -8.412 1.00 0.00 C ATOM 0 H VAL A 16 6.914 -9.369 -10.077 1.00 0.00 H new ATOM 0 HA VAL A 16 4.079 -9.997 -10.545 1.00 0.00 H new ATOM 0 HB VAL A 16 5.823 -10.847 -8.555 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.020 -9.803 -6.475 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.846 -8.630 -7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.069 -8.641 -7.429 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.801 -11.715 -7.454 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.799 -10.633 -8.449 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.738 -11.934 -9.219 1.00 0.00 H new ATOM 255 N THR A 17 3.118 -7.811 -9.696 1.00 0.00 N ATOM 256 CA THR A 17 2.597 -6.469 -9.473 1.00 0.00 C ATOM 257 C THR A 17 1.194 -6.515 -8.878 1.00 0.00 C ATOM 258 O THR A 17 0.279 -5.851 -9.367 1.00 0.00 O ATOM 259 CB THR A 17 2.562 -5.655 -10.780 1.00 0.00 C ATOM 260 OG1 THR A 17 1.832 -6.371 -11.783 1.00 0.00 O ATOM 261 CG2 THR A 17 3.971 -5.369 -11.278 1.00 0.00 C ATOM 0 H THR A 17 2.403 -8.517 -9.870 1.00 0.00 H new ATOM 0 HA THR A 17 3.271 -5.982 -8.769 1.00 0.00 H new ATOM 0 HB THR A 17 2.066 -4.706 -10.578 1.00 0.00 H new ATOM 0 HG1 THR A 17 1.813 -5.846 -12.611 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.920 -4.793 -12.202 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.515 -4.799 -10.524 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.489 -6.310 -11.465 1.00 0.00 H new ATOM 269 N THR A 18 1.030 -7.302 -7.820 1.00 0.00 N ATOM 270 CA THR A 18 -0.261 -7.435 -7.158 1.00 0.00 C ATOM 271 C THR A 18 -0.117 -7.334 -5.644 1.00 0.00 C ATOM 272 O THR A 18 -0.972 -6.764 -4.965 1.00 0.00 O ATOM 273 CB THR A 18 -0.938 -8.773 -7.510 1.00 0.00 C ATOM 274 OG1 THR A 18 -1.940 -9.086 -6.536 1.00 0.00 O ATOM 275 CG2 THR A 18 0.085 -9.897 -7.572 1.00 0.00 C ATOM 0 H THR A 18 1.777 -7.858 -7.403 1.00 0.00 H new ATOM 0 HA THR A 18 -0.884 -6.616 -7.516 1.00 0.00 H new ATOM 0 HB THR A 18 -1.404 -8.673 -8.490 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.367 -9.937 -6.768 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.416 -10.832 -7.822 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.830 -9.669 -8.335 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.576 -9.996 -6.604 1.00 0.00 H new ATOM 283 N LEU A 19 0.970 -7.889 -5.120 1.00 0.00 N ATOM 284 CA LEU A 19 1.227 -7.861 -3.684 1.00 0.00 C ATOM 285 C LEU A 19 2.633 -7.346 -3.393 1.00 0.00 C ATOM 286 O LEU A 19 3.341 -6.900 -4.296 1.00 0.00 O ATOM 287 CB LEU A 19 1.050 -9.258 -3.087 1.00 0.00 C ATOM 288 CG LEU A 19 2.090 -10.301 -3.500 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.352 -11.273 -2.360 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.632 -11.047 -4.745 1.00 0.00 C ATOM 0 H LEU A 19 1.688 -8.364 -5.668 1.00 0.00 H new ATOM 0 HA LEU A 19 0.509 -7.182 -3.224 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.063 -9.171 -2.001 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.063 -9.628 -3.365 1.00 0.00 H new ATOM 0 HG LEU A 19 3.022 -9.785 -3.732 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.094 -12.008 -2.672 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.724 -10.726 -1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.425 -11.783 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.384 -11.785 -5.024 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.688 -11.551 -4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.496 -10.340 -5.563 1.00 0.00 H new ATOM 302 N SER A 20 3.031 -7.412 -2.127 1.00 0.00 N ATOM 303 CA SER A 20 4.352 -6.950 -1.716 1.00 0.00 C ATOM 304 C SER A 20 5.167 -8.095 -1.120 1.00 0.00 C ATOM 305 O SER A 20 4.610 -9.078 -0.634 1.00 0.00 O ATOM 306 CB SER A 20 4.225 -5.816 -0.697 1.00 0.00 C ATOM 307 OG SER A 20 2.884 -5.371 -0.594 1.00 0.00 O ATOM 0 H SER A 20 2.458 -7.781 -1.368 1.00 0.00 H new ATOM 0 HA SER A 20 4.871 -6.579 -2.600 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.574 -6.158 0.277 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.866 -4.985 -0.991 1.00 0.00 H new ATOM 0 HG SER A 20 2.844 -4.408 -0.773 1.00 0.00 H new ATOM 313 N GLU A 21 6.488 -7.957 -1.163 1.00 0.00 N ATOM 314 CA GLU A 21 7.380 -8.980 -0.629 1.00 0.00 C ATOM 315 C GLU A 21 7.112 -9.214 0.855 1.00 0.00 C ATOM 316 O GLU A 21 7.430 -10.274 1.395 1.00 0.00 O ATOM 317 CB GLU A 21 8.840 -8.575 -0.838 1.00 0.00 C ATOM 318 CG GLU A 21 9.359 -7.606 0.212 1.00 0.00 C ATOM 319 CD GLU A 21 10.806 -7.216 -0.019 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.482 -7.894 -0.820 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.262 -6.232 0.601 1.00 0.00 O ATOM 0 H GLU A 21 6.964 -7.148 -1.562 1.00 0.00 H new ATOM 0 HA GLU A 21 7.189 -9.909 -1.166 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.461 -9.471 -0.832 1.00 0.00 H new ATOM 0 HB3 GLU A 21 8.945 -8.121 -1.823 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.740 -6.709 0.211 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.262 -8.059 1.199 1.00 0.00 H new ATOM 328 N ASP A 22 6.527 -8.216 1.509 1.00 0.00 N ATOM 329 CA ASP A 22 6.216 -8.312 2.930 1.00 0.00 C ATOM 330 C ASP A 22 4.862 -8.981 3.146 1.00 0.00 C ATOM 331 O ASP A 22 4.362 -9.045 4.270 1.00 0.00 O ATOM 332 CB ASP A 22 6.220 -6.922 3.570 1.00 0.00 C ATOM 333 CG ASP A 22 4.848 -6.277 3.560 1.00 0.00 C ATOM 334 OD1 ASP A 22 4.166 -6.348 2.517 1.00 0.00 O ATOM 335 OD2 ASP A 22 4.457 -5.698 4.596 1.00 0.00 O ATOM 0 H ASP A 22 6.259 -7.332 1.077 1.00 0.00 H new ATOM 0 HA ASP A 22 6.983 -8.924 3.404 1.00 0.00 H new ATOM 0 HB2 ASP A 22 6.575 -6.999 4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 22 6.923 -6.282 3.037 1.00 0.00 H new ATOM 340 N ASP A 23 4.273 -9.476 2.064 1.00 0.00 N ATOM 341 CA ASP A 23 2.977 -10.140 2.134 1.00 0.00 C ATOM 342 C ASP A 23 3.131 -11.586 2.594 1.00 0.00 C ATOM 343 O ASP A 23 2.809 -11.926 3.733 1.00 0.00 O ATOM 344 CB ASP A 23 2.282 -10.096 0.772 1.00 0.00 C ATOM 345 CG ASP A 23 0.789 -10.340 0.875 1.00 0.00 C ATOM 346 OD1 ASP A 23 0.376 -11.133 1.748 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.034 -9.737 0.085 1.00 0.00 O ATOM 0 H ASP A 23 4.673 -9.430 1.127 1.00 0.00 H new ATOM 0 HA ASP A 23 2.364 -9.609 2.863 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.457 -9.125 0.309 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.725 -10.846 0.117 1.00 0.00 H new ATOM 352 N THR A 24 3.626 -12.437 1.699 1.00 0.00 N ATOM 353 CA THR A 24 3.822 -13.847 2.012 1.00 0.00 C ATOM 354 C THR A 24 4.303 -14.619 0.789 1.00 0.00 C ATOM 355 O THR A 24 3.971 -14.275 -0.346 1.00 0.00 O ATOM 356 CB THR A 24 2.524 -14.491 2.534 1.00 0.00 C ATOM 357 OG1 THR A 24 1.404 -13.653 2.231 1.00 0.00 O ATOM 358 CG2 THR A 24 2.600 -14.721 4.036 1.00 0.00 C ATOM 0 H THR A 24 3.898 -12.173 0.752 1.00 0.00 H new ATOM 0 HA THR A 24 4.582 -13.896 2.791 1.00 0.00 H new ATOM 0 HB THR A 24 2.399 -15.455 2.040 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.583 -14.071 2.566 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.672 -15.177 4.382 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.435 -15.384 4.261 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.747 -13.767 4.543 1.00 0.00 H new ATOM 366 N VAL A 25 5.087 -15.666 1.026 1.00 0.00 N ATOM 367 CA VAL A 25 5.612 -16.489 -0.057 1.00 0.00 C ATOM 368 C VAL A 25 4.484 -17.105 -0.876 1.00 0.00 C ATOM 369 O VAL A 25 4.450 -16.978 -2.101 1.00 0.00 O ATOM 370 CB VAL A 25 6.515 -17.615 0.482 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.350 -18.876 -0.353 1.00 0.00 C ATOM 372 CG2 VAL A 25 7.968 -17.167 0.505 1.00 0.00 C ATOM 0 H VAL A 25 5.373 -15.964 1.959 1.00 0.00 H new ATOM 0 HA VAL A 25 6.203 -15.833 -0.696 1.00 0.00 H new ATOM 0 HB VAL A 25 6.213 -17.842 1.504 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.995 -19.661 0.042 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.312 -19.205 -0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.625 -18.666 -1.387 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.592 -17.975 0.888 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.286 -16.912 -0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.069 -16.293 1.149 1.00 0.00 H new ATOM 382 N LEU A 26 3.560 -17.772 -0.193 1.00 0.00 N ATOM 383 CA LEU A 26 2.428 -18.408 -0.858 1.00 0.00 C ATOM 384 C LEU A 26 1.593 -17.380 -1.614 1.00 0.00 C ATOM 385 O LEU A 26 0.871 -17.721 -2.552 1.00 0.00 O ATOM 386 CB LEU A 26 1.556 -19.139 0.165 1.00 0.00 C ATOM 387 CG LEU A 26 0.177 -18.532 0.426 1.00 0.00 C ATOM 388 CD1 LEU A 26 -0.821 -19.003 -0.621 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.306 -18.888 1.824 1.00 0.00 C ATOM 0 H LEU A 26 3.572 -17.886 0.820 1.00 0.00 H new ATOM 0 HA LEU A 26 2.818 -19.130 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.421 -20.167 -0.171 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.097 -19.181 1.110 1.00 0.00 H new ATOM 0 HG LEU A 26 0.260 -17.447 0.357 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.796 -18.561 -0.419 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.482 -18.697 -1.611 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.901 -20.089 -0.585 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.289 -18.448 1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.372 -19.972 1.921 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.397 -18.500 2.561 1.00 0.00 H new ATOM 401 N ASP A 27 1.697 -16.122 -1.201 1.00 0.00 N ATOM 402 CA ASP A 27 0.953 -15.043 -1.841 1.00 0.00 C ATOM 403 C ASP A 27 1.574 -14.679 -3.186 1.00 0.00 C ATOM 404 O ASP A 27 0.869 -14.505 -4.181 1.00 0.00 O ATOM 405 CB ASP A 27 0.915 -13.813 -0.934 1.00 0.00 C ATOM 406 CG ASP A 27 -0.130 -12.805 -1.369 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.238 -12.550 -2.587 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.840 -12.269 -0.492 1.00 0.00 O ATOM 0 H ASP A 27 2.289 -15.824 -0.426 1.00 0.00 H new ATOM 0 HA ASP A 27 -0.066 -15.390 -2.013 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.709 -14.126 0.090 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.896 -13.337 -0.931 1.00 0.00 H new ATOM 413 N LEU A 28 2.897 -14.563 -3.209 1.00 0.00 N ATOM 414 CA LEU A 28 3.614 -14.218 -4.432 1.00 0.00 C ATOM 415 C LEU A 28 3.842 -15.454 -5.297 1.00 0.00 C ATOM 416 O LEU A 28 3.525 -15.460 -6.487 1.00 0.00 O ATOM 417 CB LEU A 28 4.955 -13.565 -4.094 1.00 0.00 C ATOM 418 CG LEU A 28 5.493 -12.566 -5.119 1.00 0.00 C ATOM 419 CD1 LEU A 28 5.884 -11.263 -4.441 1.00 0.00 C ATOM 420 CD2 LEU A 28 6.679 -13.157 -5.867 1.00 0.00 C ATOM 0 H LEU A 28 3.495 -14.703 -2.395 1.00 0.00 H new ATOM 0 HA LEU A 28 3.004 -13.511 -4.994 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.856 -13.054 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.696 -14.353 -3.960 1.00 0.00 H new ATOM 0 HG LEU A 28 4.703 -12.353 -5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.265 -10.565 -5.187 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.011 -10.831 -3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.657 -11.457 -3.698 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.049 -12.433 -6.592 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.472 -13.399 -5.159 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.367 -14.063 -6.386 1.00 0.00 H new ATOM 432 N LYS A 29 4.391 -16.501 -4.691 1.00 0.00 N ATOM 433 CA LYS A 29 4.658 -17.745 -5.403 1.00 0.00 C ATOM 434 C LYS A 29 3.423 -18.210 -6.168 1.00 0.00 C ATOM 435 O LYS A 29 3.514 -18.603 -7.331 1.00 0.00 O ATOM 436 CB LYS A 29 5.104 -18.833 -4.423 1.00 0.00 C ATOM 437 CG LYS A 29 6.612 -18.955 -4.294 1.00 0.00 C ATOM 438 CD LYS A 29 7.216 -17.732 -3.625 1.00 0.00 C ATOM 439 CE LYS A 29 7.544 -16.647 -4.640 1.00 0.00 C ATOM 440 NZ LYS A 29 8.878 -16.035 -4.386 1.00 0.00 N ATOM 0 H LYS A 29 4.660 -16.513 -3.707 1.00 0.00 H new ATOM 0 HA LYS A 29 5.459 -17.560 -6.119 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.680 -18.622 -3.441 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.697 -19.791 -4.747 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.858 -19.846 -3.715 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.053 -19.085 -5.282 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.519 -17.340 -2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.122 -18.018 -3.091 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.524 -17.071 -5.644 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.777 -15.873 -4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.390 -15.932 -5.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.753 -15.099 -3.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.424 -16.646 -3.745 1.00 0.00 H new ATOM 454 N GLN A 30 2.271 -18.160 -5.508 1.00 0.00 N ATOM 455 CA GLN A 30 1.018 -18.576 -6.128 1.00 0.00 C ATOM 456 C GLN A 30 0.755 -17.788 -7.407 1.00 0.00 C ATOM 457 O GLN A 30 0.245 -18.329 -8.388 1.00 0.00 O ATOM 458 CB GLN A 30 -0.145 -18.389 -5.152 1.00 0.00 C ATOM 459 CG GLN A 30 -0.505 -16.933 -4.905 1.00 0.00 C ATOM 460 CD GLN A 30 -1.642 -16.456 -5.787 1.00 0.00 C ATOM 461 OE1 GLN A 30 -1.512 -15.462 -6.503 1.00 0.00 O ATOM 462 NE2 GLN A 30 -2.765 -17.162 -5.740 1.00 0.00 N ATOM 0 H GLN A 30 2.179 -17.836 -4.545 1.00 0.00 H new ATOM 0 HA GLN A 30 1.102 -19.632 -6.384 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -1.020 -18.910 -5.539 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.110 -18.858 -4.202 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.783 -16.804 -3.859 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.372 -16.311 -5.081 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -2.829 -17.979 -5.132 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.564 -16.888 -6.311 1.00 0.00 H new ATOM 471 N PHE A 31 1.106 -16.506 -7.389 1.00 0.00 N ATOM 472 CA PHE A 31 0.907 -15.643 -8.547 1.00 0.00 C ATOM 473 C PHE A 31 1.769 -16.099 -9.720 1.00 0.00 C ATOM 474 O PHE A 31 1.258 -16.407 -10.798 1.00 0.00 O ATOM 475 CB PHE A 31 1.238 -14.192 -8.191 1.00 0.00 C ATOM 476 CG PHE A 31 0.718 -13.196 -9.188 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.602 -12.777 -9.146 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.550 -12.679 -10.168 1.00 0.00 C ATOM 479 CE1 PHE A 31 -1.082 -11.862 -10.063 1.00 0.00 C ATOM 480 CE2 PHE A 31 1.076 -11.763 -11.088 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.242 -11.353 -11.035 1.00 0.00 C ATOM 0 H PHE A 31 1.530 -16.042 -6.585 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.140 -15.708 -8.841 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.822 -13.963 -7.210 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.320 -14.084 -8.112 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.263 -13.170 -8.388 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.582 -12.996 -10.213 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.113 -11.545 -10.020 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.735 -11.368 -11.847 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.615 -10.636 -11.752 1.00 0.00 H new ATOM 491 N LEU A 32 3.079 -16.139 -9.504 1.00 0.00 N ATOM 492 CA LEU A 32 4.014 -16.558 -10.543 1.00 0.00 C ATOM 493 C LEU A 32 3.808 -18.026 -10.902 1.00 0.00 C ATOM 494 O LEU A 32 4.096 -18.449 -12.021 1.00 0.00 O ATOM 495 CB LEU A 32 5.454 -16.331 -10.081 1.00 0.00 C ATOM 496 CG LEU A 32 5.820 -16.907 -8.713 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.224 -18.367 -8.839 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.937 -16.095 -8.074 1.00 0.00 C ATOM 0 H LEU A 32 3.518 -15.886 -8.619 1.00 0.00 H new ATOM 0 HA LEU A 32 3.825 -15.956 -11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.125 -16.761 -10.825 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.644 -15.258 -10.063 1.00 0.00 H new ATOM 0 HG LEU A 32 4.942 -16.849 -8.069 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.481 -18.760 -7.855 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.394 -18.940 -9.253 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.087 -18.450 -9.500 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.184 -16.519 -7.101 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.818 -16.120 -8.715 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.610 -15.063 -7.947 1.00 0.00 H new ATOM 510 N LYS A 33 3.306 -18.799 -9.944 1.00 0.00 N ATOM 511 CA LYS A 33 3.057 -20.219 -10.159 1.00 0.00 C ATOM 512 C LYS A 33 2.142 -20.436 -11.360 1.00 0.00 C ATOM 513 O LYS A 33 2.286 -21.413 -12.095 1.00 0.00 O ATOM 514 CB LYS A 33 2.432 -20.843 -8.909 1.00 0.00 C ATOM 515 CG LYS A 33 1.206 -21.692 -9.201 1.00 0.00 C ATOM 516 CD LYS A 33 1.584 -23.009 -9.858 1.00 0.00 C ATOM 517 CE LYS A 33 0.452 -23.545 -10.722 1.00 0.00 C ATOM 518 NZ LYS A 33 -0.203 -24.731 -10.104 1.00 0.00 N ATOM 0 H LYS A 33 3.064 -18.465 -9.011 1.00 0.00 H new ATOM 0 HA LYS A 33 4.013 -20.703 -10.361 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.179 -21.459 -8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.157 -20.049 -8.215 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.669 -21.888 -8.273 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.527 -21.141 -9.852 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.475 -22.869 -10.470 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.836 -23.741 -9.090 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.289 -22.761 -10.878 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.841 -23.815 -11.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.228 -24.691 -10.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.185 -25.600 -10.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.024 -24.732 -9.079 1.00 0.00 H new ATOM 532 N THR A 34 1.201 -19.517 -11.555 1.00 0.00 N ATOM 533 CA THR A 34 0.263 -19.608 -12.667 1.00 0.00 C ATOM 534 C THR A 34 0.949 -19.294 -13.992 1.00 0.00 C ATOM 535 O THR A 34 0.513 -19.746 -15.051 1.00 0.00 O ATOM 536 CB THR A 34 -0.927 -18.648 -12.478 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.047 -19.098 -13.248 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.553 -17.234 -12.896 1.00 0.00 C ATOM 0 H THR A 34 1.068 -18.701 -10.957 1.00 0.00 H new ATOM 0 HA THR A 34 -0.106 -20.633 -12.686 1.00 0.00 H new ATOM 0 HB THR A 34 -1.194 -18.639 -11.421 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.799 -18.483 -13.121 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.409 -16.574 -12.754 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.281 -16.883 -12.288 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.263 -17.230 -13.947 1.00 0.00 H new ATOM 546 N LEU A 35 2.025 -18.518 -13.926 1.00 0.00 N ATOM 547 CA LEU A 35 2.773 -18.144 -15.122 1.00 0.00 C ATOM 548 C LEU A 35 3.938 -19.100 -15.356 1.00 0.00 C ATOM 549 O LEU A 35 4.447 -19.214 -16.472 1.00 0.00 O ATOM 550 CB LEU A 35 3.292 -16.710 -14.995 1.00 0.00 C ATOM 551 CG LEU A 35 2.237 -15.636 -14.728 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.870 -14.253 -14.735 1.00 0.00 C ATOM 553 CD2 LEU A 35 1.119 -15.718 -15.757 1.00 0.00 C ATOM 0 H LEU A 35 2.399 -18.135 -13.058 1.00 0.00 H new ATOM 0 HA LEU A 35 2.099 -18.206 -15.977 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.024 -16.680 -14.188 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.819 -16.453 -15.914 1.00 0.00 H new ATOM 0 HG LEU A 35 1.809 -15.812 -13.741 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.104 -13.501 -14.543 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.634 -14.199 -13.959 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.326 -14.067 -15.707 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.378 -14.946 -15.551 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.531 -15.568 -16.755 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.646 -16.699 -15.703 1.00 0.00 H new ATOM 565 N THR A 36 4.356 -19.787 -14.298 1.00 0.00 N ATOM 566 CA THR A 36 5.460 -20.734 -14.388 1.00 0.00 C ATOM 567 C THR A 36 4.951 -22.170 -14.414 1.00 0.00 C ATOM 568 O THR A 36 5.628 -23.070 -14.911 1.00 0.00 O ATOM 569 CB THR A 36 6.439 -20.569 -13.210 1.00 0.00 C ATOM 570 OG1 THR A 36 5.752 -20.769 -11.970 1.00 0.00 O ATOM 571 CG2 THR A 36 7.076 -19.188 -13.225 1.00 0.00 C ATOM 0 H THR A 36 3.946 -19.705 -13.368 1.00 0.00 H new ATOM 0 HA THR A 36 5.985 -20.521 -15.319 1.00 0.00 H new ATOM 0 HB THR A 36 7.226 -21.316 -13.314 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.167 -20.003 -11.793 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.763 -19.095 -12.384 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.623 -19.050 -14.158 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.299 -18.428 -13.144 1.00 0.00 H new ATOM 579 N GLY A 37 3.753 -22.379 -13.877 1.00 0.00 N ATOM 580 CA GLY A 37 3.174 -23.710 -13.849 1.00 0.00 C ATOM 581 C GLY A 37 3.563 -24.486 -12.607 1.00 0.00 C ATOM 582 O GLY A 37 2.861 -25.412 -12.199 1.00 0.00 O ATOM 0 H GLY A 37 3.173 -21.651 -13.461 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.088 -23.631 -13.899 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.495 -24.261 -14.733 1.00 0.00 H new ATOM 586 N VAL A 38 4.686 -24.110 -12.004 1.00 0.00 N ATOM 587 CA VAL A 38 5.168 -24.778 -10.801 1.00 0.00 C ATOM 588 C VAL A 38 4.689 -24.061 -9.544 1.00 0.00 C ATOM 589 O VAL A 38 4.760 -22.834 -9.450 1.00 0.00 O ATOM 590 CB VAL A 38 6.706 -24.855 -10.779 1.00 0.00 C ATOM 591 CG1 VAL A 38 7.178 -25.824 -9.705 1.00 0.00 C ATOM 592 CG2 VAL A 38 7.238 -25.260 -12.145 1.00 0.00 C ATOM 0 H VAL A 38 5.279 -23.346 -12.329 1.00 0.00 H new ATOM 0 HA VAL A 38 4.761 -25.789 -10.817 1.00 0.00 H new ATOM 0 HB VAL A 38 7.098 -23.867 -10.540 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.267 -25.865 -9.705 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.828 -25.485 -8.730 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.778 -26.817 -9.910 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.326 -25.310 -12.112 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.838 -26.237 -12.416 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.931 -24.524 -12.888 1.00 0.00 H new ATOM 602 N LEU A 39 4.200 -24.832 -8.579 1.00 0.00 N ATOM 603 CA LEU A 39 3.708 -24.270 -7.326 1.00 0.00 C ATOM 604 C LEU A 39 4.754 -24.400 -6.223 1.00 0.00 C ATOM 605 O LEU A 39 5.659 -25.233 -6.287 1.00 0.00 O ATOM 606 CB LEU A 39 2.415 -24.970 -6.903 1.00 0.00 C ATOM 607 CG LEU A 39 2.280 -26.436 -7.316 1.00 0.00 C ATOM 608 CD1 LEU A 39 2.038 -26.549 -8.813 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.520 -27.220 -6.913 1.00 0.00 C ATOM 0 H LEU A 39 4.134 -25.848 -8.640 1.00 0.00 H new ATOM 0 HA LEU A 39 3.505 -23.211 -7.486 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.331 -24.910 -5.818 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.573 -24.417 -7.319 1.00 0.00 H new ATOM 0 HG LEU A 39 1.421 -26.862 -6.797 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.945 -27.600 -9.088 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.120 -26.022 -9.074 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.876 -26.106 -9.351 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.406 -28.261 -7.215 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.395 -26.794 -7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.648 -27.168 -5.832 1.00 0.00 H new ATOM 621 N PRO A 40 4.629 -23.559 -5.186 1.00 0.00 N ATOM 622 CA PRO A 40 5.553 -23.562 -4.048 1.00 0.00 C ATOM 623 C PRO A 40 5.402 -24.808 -3.182 1.00 0.00 C ATOM 624 O PRO A 40 6.322 -25.187 -2.459 1.00 0.00 O ATOM 625 CB PRO A 40 5.150 -22.312 -3.261 1.00 0.00 C ATOM 626 CG PRO A 40 3.723 -22.082 -3.619 1.00 0.00 C ATOM 627 CD PRO A 40 3.574 -22.541 -5.044 1.00 0.00 C ATOM 0 HA PRO A 40 6.595 -23.563 -4.369 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.269 -22.464 -2.188 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.769 -21.457 -3.532 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.060 -22.640 -2.958 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.460 -21.029 -3.519 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.585 -22.959 -5.230 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.711 -21.720 -5.747 1.00 0.00 H new ATOM 635 N GLU A 41 4.235 -25.441 -3.262 1.00 0.00 N ATOM 636 CA GLU A 41 3.965 -26.645 -2.484 1.00 0.00 C ATOM 637 C GLU A 41 4.900 -27.779 -2.895 1.00 0.00 C ATOM 638 O GLU A 41 5.122 -28.721 -2.133 1.00 0.00 O ATOM 639 CB GLU A 41 2.509 -27.079 -2.664 1.00 0.00 C ATOM 640 CG GLU A 41 2.191 -27.576 -4.064 1.00 0.00 C ATOM 641 CD GLU A 41 0.845 -28.271 -4.145 1.00 0.00 C ATOM 642 OE1 GLU A 41 0.046 -28.131 -3.196 1.00 0.00 O ATOM 643 OE2 GLU A 41 0.592 -28.956 -5.159 1.00 0.00 O ATOM 0 H GLU A 41 3.463 -25.141 -3.857 1.00 0.00 H new ATOM 0 HA GLU A 41 4.141 -26.415 -1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.283 -27.868 -1.947 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.856 -26.238 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.203 -26.734 -4.756 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.971 -28.265 -4.387 1.00 0.00 H new ATOM 650 N ARG A 42 5.444 -27.681 -4.103 1.00 0.00 N ATOM 651 CA ARG A 42 6.354 -28.698 -4.616 1.00 0.00 C ATOM 652 C ARG A 42 7.804 -28.239 -4.502 1.00 0.00 C ATOM 653 O ARG A 42 8.673 -28.998 -4.074 1.00 0.00 O ATOM 654 CB ARG A 42 6.023 -29.020 -6.075 1.00 0.00 C ATOM 655 CG ARG A 42 4.887 -30.017 -6.236 1.00 0.00 C ATOM 656 CD ARG A 42 5.402 -31.447 -6.271 1.00 0.00 C ATOM 657 NE ARG A 42 4.632 -32.285 -7.186 1.00 0.00 N ATOM 658 CZ ARG A 42 4.834 -32.319 -8.498 1.00 0.00 C ATOM 659 NH1 ARG A 42 5.779 -31.568 -9.046 1.00 0.00 N ATOM 660 NH2 ARG A 42 4.092 -33.107 -9.265 1.00 0.00 N ATOM 0 H ARG A 42 5.271 -26.908 -4.745 1.00 0.00 H new ATOM 0 HA ARG A 42 6.228 -29.598 -4.014 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.761 -28.097 -6.592 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.914 -29.416 -6.562 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.182 -29.903 -5.413 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.341 -29.803 -7.155 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.449 -31.448 -6.574 1.00 0.00 H new ATOM 0 HD3 ARG A 42 5.360 -31.872 -5.268 1.00 0.00 H new ATOM 0 HE ARG A 42 3.899 -32.877 -6.796 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.353 -30.962 -8.460 1.00 0.00 H new ATOM 0 HH12 ARG A 42 5.932 -31.596 -10.054 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.365 -33.688 -8.847 1.00 0.00 H new ATOM 0 HH22 ARG A 42 4.248 -33.132 -10.273 1.00 0.00 H new ATOM 674 N GLN A 43 8.057 -26.992 -4.887 1.00 0.00 N ATOM 675 CA GLN A 43 9.402 -26.433 -4.829 1.00 0.00 C ATOM 676 C GLN A 43 9.403 -25.092 -4.102 1.00 0.00 C ATOM 677 O GLN A 43 8.354 -24.595 -3.693 1.00 0.00 O ATOM 678 CB GLN A 43 9.967 -26.261 -6.240 1.00 0.00 C ATOM 679 CG GLN A 43 9.099 -26.882 -7.323 1.00 0.00 C ATOM 680 CD GLN A 43 9.150 -28.397 -7.314 1.00 0.00 C ATOM 681 OE1 GLN A 43 9.792 -29.003 -6.456 1.00 0.00 O ATOM 682 NE2 GLN A 43 8.471 -29.018 -8.271 1.00 0.00 N ATOM 0 H GLN A 43 7.348 -26.350 -5.242 1.00 0.00 H new ATOM 0 HA GLN A 43 10.033 -27.127 -4.274 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.087 -25.198 -6.447 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.960 -26.708 -6.282 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.068 -26.556 -7.188 1.00 0.00 H new ATOM 0 HG3 GLN A 43 9.424 -26.517 -8.297 1.00 0.00 H new ATOM 0 HE21 GLN A 43 7.952 -28.476 -8.962 1.00 0.00 H new ATOM 0 HE22 GLN A 43 8.468 -30.037 -8.315 1.00 0.00 H new ATOM 691 N LYS A 44 10.588 -24.512 -3.943 1.00 0.00 N ATOM 692 CA LYS A 44 10.727 -23.229 -3.265 1.00 0.00 C ATOM 693 C LYS A 44 11.641 -22.294 -4.051 1.00 0.00 C ATOM 694 O LYS A 44 12.505 -22.744 -4.805 1.00 0.00 O ATOM 695 CB LYS A 44 11.280 -23.431 -1.853 1.00 0.00 C ATOM 696 CG LYS A 44 12.671 -24.040 -1.826 1.00 0.00 C ATOM 697 CD LYS A 44 12.690 -25.355 -1.066 1.00 0.00 C ATOM 698 CE LYS A 44 12.561 -26.544 -2.006 1.00 0.00 C ATOM 699 NZ LYS A 44 13.706 -26.628 -2.955 1.00 0.00 N ATOM 0 H LYS A 44 11.466 -24.911 -4.275 1.00 0.00 H new ATOM 0 HA LYS A 44 9.739 -22.773 -3.200 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.303 -22.470 -1.340 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.600 -24.074 -1.294 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.017 -24.204 -2.847 1.00 0.00 H new ATOM 0 HG3 LYS A 44 13.366 -23.341 -1.362 1.00 0.00 H new ATOM 0 HD2 LYS A 44 13.618 -25.436 -0.500 1.00 0.00 H new ATOM 0 HD3 LYS A 44 11.874 -25.371 -0.344 1.00 0.00 H new ATOM 0 HE2 LYS A 44 12.504 -27.463 -1.423 1.00 0.00 H new ATOM 0 HE3 LYS A 44 11.630 -26.464 -2.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 13.803 -27.606 -3.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 13.535 -25.995 -3.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 14.581 -26.342 -2.470 1.00 0.00 H new ATOM 713 N LEU A 45 11.446 -20.993 -3.870 1.00 0.00 N ATOM 714 CA LEU A 45 12.255 -19.995 -4.562 1.00 0.00 C ATOM 715 C LEU A 45 13.592 -19.794 -3.857 1.00 0.00 C ATOM 716 O LEU A 45 13.651 -19.699 -2.630 1.00 0.00 O ATOM 717 CB LEU A 45 11.502 -18.666 -4.641 1.00 0.00 C ATOM 718 CG LEU A 45 10.718 -18.414 -5.930 1.00 0.00 C ATOM 719 CD1 LEU A 45 11.647 -18.443 -7.134 1.00 0.00 C ATOM 720 CD2 LEU A 45 9.606 -19.441 -6.087 1.00 0.00 C ATOM 0 H LEU A 45 10.735 -20.604 -3.250 1.00 0.00 H new ATOM 0 HA LEU A 45 12.449 -20.357 -5.572 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.809 -18.614 -3.802 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.220 -17.856 -4.512 1.00 0.00 H new ATOM 0 HG LEU A 45 10.265 -17.424 -5.870 1.00 0.00 H new ATOM 0 HD11 LEU A 45 11.072 -18.262 -8.042 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.407 -17.669 -7.026 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.129 -19.419 -7.198 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.059 -19.246 -7.009 1.00 0.00 H new ATOM 0 HD22 LEU A 45 10.037 -20.441 -6.125 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.924 -19.372 -5.239 1.00 0.00 H new ATOM 732 N LEU A 46 14.664 -19.727 -4.639 1.00 0.00 N ATOM 733 CA LEU A 46 16.001 -19.534 -4.090 1.00 0.00 C ATOM 734 C LEU A 46 16.022 -18.372 -3.103 1.00 0.00 C ATOM 735 O LEU A 46 15.670 -17.245 -3.447 1.00 0.00 O ATOM 736 CB LEU A 46 17.004 -19.280 -5.217 1.00 0.00 C ATOM 737 CG LEU A 46 18.087 -20.343 -5.404 1.00 0.00 C ATOM 738 CD1 LEU A 46 19.009 -19.969 -6.554 1.00 0.00 C ATOM 739 CD2 LEU A 46 18.882 -20.527 -4.119 1.00 0.00 C ATOM 0 H LEU A 46 14.633 -19.804 -5.656 1.00 0.00 H new ATOM 0 HA LEU A 46 16.284 -20.443 -3.558 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.452 -19.184 -6.152 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.491 -18.322 -5.034 1.00 0.00 H new ATOM 0 HG LEU A 46 17.602 -21.289 -5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 46 19.773 -20.737 -6.672 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.430 -19.889 -7.474 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.486 -19.012 -6.342 1.00 0.00 H new ATOM 0 HD21 LEU A 46 19.648 -21.287 -4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.356 -19.584 -3.846 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.212 -20.842 -3.319 1.00 0.00 H new ATOM 751 N GLY A 47 16.441 -18.654 -1.873 1.00 0.00 N ATOM 752 CA GLY A 47 16.502 -17.622 -0.855 1.00 0.00 C ATOM 753 C GLY A 47 17.172 -18.101 0.418 1.00 0.00 C ATOM 754 O GLY A 47 18.399 -18.104 0.520 1.00 0.00 O ATOM 0 H GLY A 47 16.739 -19.579 -1.564 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.045 -16.762 -1.246 1.00 0.00 H new ATOM 0 HA3 GLY A 47 15.492 -17.283 -0.625 1.00 0.00 H new ATOM 758 N LEU A 48 16.365 -18.507 1.392 1.00 0.00 N ATOM 759 CA LEU A 48 16.886 -18.990 2.666 1.00 0.00 C ATOM 760 C LEU A 48 15.815 -19.751 3.440 1.00 0.00 C ATOM 761 O LEU A 48 14.628 -19.669 3.123 1.00 0.00 O ATOM 762 CB LEU A 48 17.402 -17.819 3.505 1.00 0.00 C ATOM 763 CG LEU A 48 18.575 -18.126 4.437 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.788 -18.576 3.637 1.00 0.00 C ATOM 765 CD2 LEU A 48 18.915 -16.910 5.285 1.00 0.00 C ATOM 0 H LEU A 48 15.347 -18.511 1.324 1.00 0.00 H new ATOM 0 HA LEU A 48 17.710 -19.672 2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.701 -17.018 2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.577 -17.437 4.106 1.00 0.00 H new ATOM 0 HG LEU A 48 18.282 -18.938 5.103 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.613 -18.790 4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.539 -19.475 3.074 1.00 0.00 H new ATOM 0 HD13 LEU A 48 20.082 -17.785 2.947 1.00 0.00 H new ATOM 0 HD21 LEU A 48 19.752 -17.147 5.942 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.188 -16.078 4.635 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.049 -16.632 5.886 1.00 0.00 H new ATOM 777 N LYS A 49 16.241 -20.492 4.457 1.00 0.00 N ATOM 778 CA LYS A 49 15.319 -21.266 5.280 1.00 0.00 C ATOM 779 C LYS A 49 15.171 -20.644 6.665 1.00 0.00 C ATOM 780 O LYS A 49 16.147 -20.181 7.255 1.00 0.00 O ATOM 781 CB LYS A 49 15.807 -22.711 5.407 1.00 0.00 C ATOM 782 CG LYS A 49 16.454 -23.248 4.143 1.00 0.00 C ATOM 783 CD LYS A 49 16.304 -24.757 4.037 1.00 0.00 C ATOM 784 CE LYS A 49 16.820 -25.276 2.704 1.00 0.00 C ATOM 785 NZ LYS A 49 17.288 -26.687 2.802 1.00 0.00 N ATOM 0 H LYS A 49 17.220 -20.573 4.731 1.00 0.00 H new ATOM 0 HA LYS A 49 14.344 -21.260 4.793 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.523 -22.773 6.226 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.964 -23.348 5.672 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.001 -22.774 3.272 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.512 -22.985 4.135 1.00 0.00 H new ATOM 0 HD2 LYS A 49 16.849 -25.236 4.851 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.255 -25.028 4.153 1.00 0.00 H new ATOM 0 HE2 LYS A 49 16.030 -25.207 1.957 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.639 -24.644 2.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 17.632 -27.004 1.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 18.059 -26.749 3.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 16.500 -27.294 3.105 1.00 0.00 H new ATOM 799 N VAL A 50 13.945 -20.638 7.178 1.00 0.00 N ATOM 800 CA VAL A 50 13.670 -20.075 8.495 1.00 0.00 C ATOM 801 C VAL A 50 13.151 -21.143 9.451 1.00 0.00 C ATOM 802 O VAL A 50 12.276 -21.935 9.100 1.00 0.00 O ATOM 803 CB VAL A 50 12.642 -18.931 8.413 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.313 -19.445 7.881 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.464 -18.278 9.775 1.00 0.00 C ATOM 0 H VAL A 50 13.126 -21.017 6.702 1.00 0.00 H new ATOM 0 HA VAL A 50 14.612 -19.679 8.874 1.00 0.00 H new ATOM 0 HB VAL A 50 13.016 -18.177 7.720 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.599 -18.623 7.830 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.457 -19.863 6.885 1.00 0.00 H new ATOM 0 HG13 VAL A 50 10.929 -20.218 8.547 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.734 -17.472 9.699 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.112 -19.020 10.491 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.418 -17.873 10.112 1.00 0.00 H new ATOM 815 N LYS A 51 13.697 -21.160 10.663 1.00 0.00 N ATOM 816 CA LYS A 51 13.288 -22.129 11.673 1.00 0.00 C ATOM 817 C LYS A 51 13.556 -23.554 11.199 1.00 0.00 C ATOM 818 O LYS A 51 12.955 -24.507 11.695 1.00 0.00 O ATOM 819 CB LYS A 51 11.803 -21.960 12.001 1.00 0.00 C ATOM 820 CG LYS A 51 11.435 -20.554 12.443 1.00 0.00 C ATOM 821 CD LYS A 51 12.001 -20.234 13.816 1.00 0.00 C ATOM 822 CE LYS A 51 11.026 -20.606 14.922 1.00 0.00 C ATOM 823 NZ LYS A 51 11.014 -22.072 15.182 1.00 0.00 N ATOM 0 H LYS A 51 14.424 -20.513 10.969 1.00 0.00 H new ATOM 0 HA LYS A 51 13.875 -21.947 12.573 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.213 -22.222 11.123 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.531 -22.663 12.789 1.00 0.00 H new ATOM 0 HG2 LYS A 51 11.811 -19.833 11.717 1.00 0.00 H new ATOM 0 HG3 LYS A 51 10.350 -20.450 12.463 1.00 0.00 H new ATOM 0 HD2 LYS A 51 12.938 -20.773 13.959 1.00 0.00 H new ATOM 0 HD3 LYS A 51 12.233 -19.171 13.876 1.00 0.00 H new ATOM 0 HE2 LYS A 51 11.295 -20.077 15.836 1.00 0.00 H new ATOM 0 HE3 LYS A 51 10.023 -20.278 14.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 10.766 -22.246 16.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 10.312 -22.528 14.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 11.956 -22.467 14.985 1.00 0.00 H new ATOM 837 N GLY A 52 14.462 -23.693 10.236 1.00 0.00 N ATOM 838 CA GLY A 52 14.794 -25.005 9.713 1.00 0.00 C ATOM 839 C GLY A 52 13.888 -25.420 8.571 1.00 0.00 C ATOM 840 O GLY A 52 14.137 -26.424 7.903 1.00 0.00 O ATOM 0 H GLY A 52 14.972 -22.920 9.809 1.00 0.00 H new ATOM 0 HA2 GLY A 52 15.829 -25.005 9.370 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.724 -25.741 10.514 1.00 0.00 H new ATOM 844 N LYS A 53 12.831 -24.646 8.345 1.00 0.00 N ATOM 845 CA LYS A 53 11.883 -24.938 7.276 1.00 0.00 C ATOM 846 C LYS A 53 12.243 -24.174 6.006 1.00 0.00 C ATOM 847 O LYS A 53 12.722 -23.040 6.050 1.00 0.00 O ATOM 848 CB LYS A 53 10.462 -24.578 7.715 1.00 0.00 C ATOM 849 CG LYS A 53 9.870 -25.551 8.719 1.00 0.00 C ATOM 850 CD LYS A 53 9.053 -26.633 8.033 1.00 0.00 C ATOM 851 CE LYS A 53 8.252 -27.447 9.037 1.00 0.00 C ATOM 852 NZ LYS A 53 9.106 -28.425 9.766 1.00 0.00 N ATOM 0 H LYS A 53 12.610 -23.812 8.888 1.00 0.00 H new ATOM 0 HA LYS A 53 11.931 -26.006 7.062 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.468 -23.579 8.150 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.818 -24.539 6.836 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.671 -26.011 9.297 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.239 -25.009 9.423 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.376 -26.177 7.311 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.717 -27.293 7.475 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.777 -26.776 9.752 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.453 -27.978 8.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.523 -28.960 10.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.539 -29.082 9.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.853 -27.917 10.281 1.00 0.00 H new ATOM 866 N PRO A 54 12.007 -24.806 4.847 1.00 0.00 N ATOM 867 CA PRO A 54 12.298 -24.203 3.543 1.00 0.00 C ATOM 868 C PRO A 54 11.359 -23.047 3.217 1.00 0.00 C ATOM 869 O PRO A 54 10.577 -23.118 2.269 1.00 0.00 O ATOM 870 CB PRO A 54 12.084 -25.358 2.562 1.00 0.00 C ATOM 871 CG PRO A 54 11.129 -26.270 3.253 1.00 0.00 C ATOM 872 CD PRO A 54 11.438 -26.158 4.720 1.00 0.00 C ATOM 0 HA PRO A 54 13.300 -23.775 3.507 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.678 -25.003 1.615 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.022 -25.865 2.336 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.098 -25.983 3.048 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.249 -27.296 2.906 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.542 -26.276 5.329 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.145 -26.923 5.041 1.00 0.00 H new ATOM 880 N ALA A 55 11.442 -21.982 4.007 1.00 0.00 N ATOM 881 CA ALA A 55 10.601 -20.809 3.800 1.00 0.00 C ATOM 882 C ALA A 55 9.138 -21.205 3.633 1.00 0.00 C ATOM 883 O ALA A 55 8.638 -21.309 2.514 1.00 0.00 O ATOM 884 CB ALA A 55 11.079 -20.024 2.587 1.00 0.00 C ATOM 0 H ALA A 55 12.083 -21.907 4.797 1.00 0.00 H new ATOM 0 HA ALA A 55 10.680 -20.175 4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.442 -19.151 2.444 1.00 0.00 H new ATOM 0 HB2 ALA A 55 12.108 -19.701 2.745 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.030 -20.657 1.701 1.00 0.00 H new ATOM 890 N GLU A 56 8.458 -21.426 4.754 1.00 0.00 N ATOM 891 CA GLU A 56 7.052 -21.812 4.730 1.00 0.00 C ATOM 892 C GLU A 56 6.244 -20.870 3.842 1.00 0.00 C ATOM 893 O GLU A 56 6.643 -19.732 3.602 1.00 0.00 O ATOM 894 CB GLU A 56 6.476 -21.815 6.147 1.00 0.00 C ATOM 895 CG GLU A 56 5.415 -22.878 6.372 1.00 0.00 C ATOM 896 CD GLU A 56 6.005 -24.264 6.548 1.00 0.00 C ATOM 897 OE1 GLU A 56 6.374 -24.885 5.529 1.00 0.00 O ATOM 898 OE2 GLU A 56 6.098 -24.727 7.704 1.00 0.00 O ATOM 0 H GLU A 56 8.858 -21.344 5.689 1.00 0.00 H new ATOM 0 HA GLU A 56 6.985 -22.819 4.317 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.287 -21.967 6.859 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.047 -20.835 6.357 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.831 -22.621 7.256 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.728 -22.885 5.526 1.00 0.00 H new ATOM 905 N ASN A 57 5.105 -21.355 3.357 1.00 0.00 N ATOM 906 CA ASN A 57 4.240 -20.557 2.495 1.00 0.00 C ATOM 907 C ASN A 57 3.810 -19.272 3.196 1.00 0.00 C ATOM 908 O ASN A 57 3.538 -18.261 2.549 1.00 0.00 O ATOM 909 CB ASN A 57 3.008 -21.365 2.085 1.00 0.00 C ATOM 910 CG ASN A 57 3.062 -21.807 0.635 1.00 0.00 C ATOM 911 OD1 ASN A 57 3.692 -21.157 -0.200 1.00 0.00 O ATOM 912 ND2 ASN A 57 2.399 -22.916 0.330 1.00 0.00 N ATOM 0 H ASN A 57 4.760 -22.296 3.546 1.00 0.00 H new ATOM 0 HA ASN A 57 4.805 -20.291 1.602 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.922 -22.242 2.726 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.113 -20.764 2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 57 2.398 -23.262 -0.630 1.00 0.00 H new ATOM 0 HD22 ASN A 57 1.891 -23.422 1.055 1.00 0.00 H new ATOM 919 N ASP A 58 3.750 -19.320 4.522 1.00 0.00 N ATOM 920 CA ASP A 58 3.354 -18.159 5.312 1.00 0.00 C ATOM 921 C ASP A 58 4.529 -17.205 5.502 1.00 0.00 C ATOM 922 O ASP A 58 4.355 -16.071 5.949 1.00 0.00 O ATOM 923 CB ASP A 58 2.815 -18.602 6.673 1.00 0.00 C ATOM 924 CG ASP A 58 1.834 -17.605 7.259 1.00 0.00 C ATOM 925 OD1 ASP A 58 0.807 -17.328 6.603 1.00 0.00 O ATOM 926 OD2 ASP A 58 2.092 -17.104 8.373 1.00 0.00 O ATOM 0 H ASP A 58 3.970 -20.150 5.073 1.00 0.00 H new ATOM 0 HA ASP A 58 2.567 -17.634 4.772 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.326 -19.571 6.569 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.647 -18.737 7.364 1.00 0.00 H new ATOM 931 N VAL A 59 5.726 -17.673 5.162 1.00 0.00 N ATOM 932 CA VAL A 59 6.930 -16.861 5.295 1.00 0.00 C ATOM 933 C VAL A 59 6.963 -15.751 4.251 1.00 0.00 C ATOM 934 O VAL A 59 6.730 -15.990 3.066 1.00 0.00 O ATOM 935 CB VAL A 59 8.202 -17.718 5.157 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.445 -16.843 5.214 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.244 -18.788 6.238 1.00 0.00 C ATOM 0 H VAL A 59 5.888 -18.610 4.793 1.00 0.00 H new ATOM 0 HA VAL A 59 6.905 -16.418 6.291 1.00 0.00 H new ATOM 0 HB VAL A 59 8.180 -18.214 4.187 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.334 -17.466 5.115 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.417 -16.118 4.400 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.476 -16.316 6.168 1.00 0.00 H new ATOM 0 HG21 VAL A 59 9.150 -19.384 6.125 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.242 -18.314 7.219 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.371 -19.434 6.145 1.00 0.00 H new ATOM 947 N LYS A 60 7.254 -14.534 4.699 1.00 0.00 N ATOM 948 CA LYS A 60 7.320 -13.385 3.804 1.00 0.00 C ATOM 949 C LYS A 60 8.485 -13.519 2.830 1.00 0.00 C ATOM 950 O LYS A 60 9.444 -14.248 3.089 1.00 0.00 O ATOM 951 CB LYS A 60 7.463 -12.092 4.611 1.00 0.00 C ATOM 952 CG LYS A 60 6.762 -12.135 5.958 1.00 0.00 C ATOM 953 CD LYS A 60 6.127 -10.797 6.299 1.00 0.00 C ATOM 954 CE LYS A 60 4.630 -10.934 6.533 1.00 0.00 C ATOM 955 NZ LYS A 60 4.328 -11.470 7.889 1.00 0.00 N ATOM 0 H LYS A 60 7.448 -14.318 5.677 1.00 0.00 H new ATOM 0 HA LYS A 60 6.393 -13.349 3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.522 -11.887 4.768 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.061 -11.263 4.028 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.996 -12.910 5.946 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.478 -12.407 6.733 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.600 -10.386 7.191 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.307 -10.091 5.488 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.153 -9.961 6.412 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.203 -11.594 5.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.298 -11.549 8.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.762 -12.409 7.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.713 -10.827 8.610 1.00 0.00 H new ATOM 969 N LEU A 61 8.397 -12.812 1.708 1.00 0.00 N ATOM 970 CA LEU A 61 9.446 -12.852 0.695 1.00 0.00 C ATOM 971 C LEU A 61 10.713 -12.166 1.196 1.00 0.00 C ATOM 972 O LEU A 61 11.745 -12.808 1.387 1.00 0.00 O ATOM 973 CB LEU A 61 8.964 -12.181 -0.592 1.00 0.00 C ATOM 974 CG LEU A 61 7.851 -12.905 -1.351 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.178 -14.383 -1.496 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.516 -12.720 -0.644 1.00 0.00 C ATOM 0 H LEU A 61 7.611 -12.205 1.477 1.00 0.00 H new ATOM 0 HA LEU A 61 9.678 -13.897 0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.616 -11.178 -0.346 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.818 -12.067 -1.260 1.00 0.00 H new ATOM 0 HG LEU A 61 7.775 -12.471 -2.348 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.375 -14.882 -2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.112 -14.497 -2.046 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.281 -14.831 -0.508 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.736 -13.242 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.579 -13.127 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.276 -11.658 -0.592 1.00 0.00 H new ATOM 988 N GLY A 62 10.627 -10.856 1.408 1.00 0.00 N ATOM 989 CA GLY A 62 11.773 -10.105 1.886 1.00 0.00 C ATOM 990 C GLY A 62 12.349 -10.680 3.165 1.00 0.00 C ATOM 991 O GLY A 62 13.450 -10.314 3.577 1.00 0.00 O ATOM 0 H GLY A 62 9.784 -10.302 1.257 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.544 -10.095 1.116 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.480 -9.069 2.057 1.00 0.00 H new ATOM 995 N ALA A 63 11.604 -11.581 3.796 1.00 0.00 N ATOM 996 CA ALA A 63 12.048 -12.207 5.035 1.00 0.00 C ATOM 997 C ALA A 63 13.358 -12.959 4.831 1.00 0.00 C ATOM 998 O ALA A 63 14.374 -12.637 5.449 1.00 0.00 O ATOM 999 CB ALA A 63 10.975 -13.146 5.566 1.00 0.00 C ATOM 0 H ALA A 63 10.690 -11.894 3.469 1.00 0.00 H new ATOM 0 HA ALA A 63 12.222 -11.420 5.769 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.320 -13.607 6.492 1.00 0.00 H new ATOM 0 HB2 ALA A 63 10.062 -12.583 5.759 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.773 -13.922 4.828 1.00 0.00 H new ATOM 1005 N LEU A 64 13.329 -13.964 3.963 1.00 0.00 N ATOM 1006 CA LEU A 64 14.515 -14.764 3.677 1.00 0.00 C ATOM 1007 C LEU A 64 14.820 -14.772 2.183 1.00 0.00 C ATOM 1008 O LEU A 64 15.982 -14.798 1.775 1.00 0.00 O ATOM 1009 CB LEU A 64 14.321 -16.196 4.178 1.00 0.00 C ATOM 1010 CG LEU A 64 12.874 -16.646 4.379 1.00 0.00 C ATOM 1011 CD1 LEU A 64 12.159 -16.758 3.042 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.827 -17.973 5.123 1.00 0.00 C ATOM 0 H LEU A 64 12.497 -14.245 3.445 1.00 0.00 H new ATOM 0 HA LEU A 64 15.360 -14.315 4.198 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.797 -16.875 3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.849 -16.303 5.126 1.00 0.00 H new ATOM 0 HG LEU A 64 12.361 -15.896 4.981 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.130 -17.079 3.205 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.161 -15.788 2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.672 -17.487 2.415 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.789 -18.278 5.257 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.357 -18.732 4.547 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.301 -17.860 6.098 1.00 0.00 H new ATOM 1024 N LYS A 65 13.770 -14.747 1.370 1.00 0.00 N ATOM 1025 CA LYS A 65 13.923 -14.748 -0.080 1.00 0.00 C ATOM 1026 C LYS A 65 14.941 -13.700 -0.520 1.00 0.00 C ATOM 1027 O LYS A 65 16.119 -14.006 -0.711 1.00 0.00 O ATOM 1028 CB LYS A 65 12.577 -14.481 -0.756 1.00 0.00 C ATOM 1029 CG LYS A 65 11.502 -15.490 -0.390 1.00 0.00 C ATOM 1030 CD LYS A 65 11.797 -16.859 -0.982 1.00 0.00 C ATOM 1031 CE LYS A 65 11.816 -17.937 0.090 1.00 0.00 C ATOM 1032 NZ LYS A 65 11.500 -19.281 -0.469 1.00 0.00 N ATOM 0 H LYS A 65 12.802 -14.726 1.691 1.00 0.00 H new ATOM 0 HA LYS A 65 14.285 -15.731 -0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.235 -13.483 -0.483 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.715 -14.486 -1.837 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.430 -15.569 0.695 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.535 -15.138 -0.748 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.044 -17.103 -1.731 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.759 -16.836 -1.493 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.798 -17.962 0.563 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.094 -17.688 0.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.077 -20.001 0.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.492 -19.490 -0.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 11.710 -19.291 -1.488 1.00 0.00 H new ATOM 1046 N LEU A 66 14.481 -12.464 -0.678 1.00 0.00 N ATOM 1047 CA LEU A 66 15.352 -11.371 -1.094 1.00 0.00 C ATOM 1048 C LEU A 66 14.554 -10.087 -1.297 1.00 0.00 C ATOM 1049 O LEU A 66 13.361 -10.030 -0.999 1.00 0.00 O ATOM 1050 CB LEU A 66 16.085 -11.739 -2.385 1.00 0.00 C ATOM 1051 CG LEU A 66 15.271 -12.514 -3.421 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.177 -11.635 -4.007 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.177 -13.046 -4.522 1.00 0.00 C ATOM 0 H LEU A 66 13.510 -12.194 -0.524 1.00 0.00 H new ATOM 0 HA LEU A 66 16.084 -11.202 -0.304 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.446 -10.821 -2.849 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.962 -12.331 -2.125 1.00 0.00 H new ATOM 0 HG LEU A 66 14.800 -13.362 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.608 -12.204 -4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.511 -11.303 -3.210 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.627 -10.767 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.580 -13.595 -5.251 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.677 -12.213 -5.016 1.00 0.00 H new ATOM 0 HD23 LEU A 66 16.924 -13.712 -4.089 1.00 0.00 H new ATOM 1065 N LYS A 67 15.220 -9.057 -1.810 1.00 0.00 N ATOM 1066 CA LYS A 67 14.574 -7.774 -2.058 1.00 0.00 C ATOM 1067 C LYS A 67 13.482 -7.910 -3.114 1.00 0.00 C ATOM 1068 O LYS A 67 13.392 -8.912 -3.823 1.00 0.00 O ATOM 1069 CB LYS A 67 15.607 -6.738 -2.506 1.00 0.00 C ATOM 1070 CG LYS A 67 16.041 -5.793 -1.399 1.00 0.00 C ATOM 1071 CD LYS A 67 17.266 -4.988 -1.801 1.00 0.00 C ATOM 1072 CE LYS A 67 17.541 -3.863 -0.815 1.00 0.00 C ATOM 1073 NZ LYS A 67 18.385 -2.793 -1.417 1.00 0.00 N ATOM 0 H LYS A 67 16.208 -9.087 -2.062 1.00 0.00 H new ATOM 0 HA LYS A 67 14.115 -7.440 -1.127 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.484 -7.256 -2.894 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.191 -6.155 -3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 67 15.223 -5.115 -1.156 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.260 -6.364 -0.497 1.00 0.00 H new ATOM 0 HD2 LYS A 67 18.133 -5.646 -1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.118 -4.572 -2.798 1.00 0.00 H new ATOM 0 HE2 LYS A 67 16.596 -3.435 -0.479 1.00 0.00 H new ATOM 0 HE3 LYS A 67 18.039 -4.266 0.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 18.550 -2.045 -0.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 19.296 -3.196 -1.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 17.898 -2.391 -2.243 1.00 0.00 H new ATOM 1087 N PRO A 68 12.633 -6.877 -3.224 1.00 0.00 N ATOM 1088 CA PRO A 68 11.533 -6.857 -4.194 1.00 0.00 C ATOM 1089 C PRO A 68 12.029 -6.729 -5.630 1.00 0.00 C ATOM 1090 O PRO A 68 11.827 -7.625 -6.448 1.00 0.00 O ATOM 1091 CB PRO A 68 10.730 -5.617 -3.793 1.00 0.00 C ATOM 1092 CG PRO A 68 11.714 -4.733 -3.108 1.00 0.00 C ATOM 1093 CD PRO A 68 12.680 -5.651 -2.411 1.00 0.00 C ATOM 0 HA PRO A 68 10.955 -7.781 -4.175 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.297 -5.127 -4.665 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.904 -5.877 -3.131 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.230 -4.095 -3.825 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.217 -4.075 -2.395 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.684 -5.228 -2.379 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.381 -5.841 -1.380 1.00 0.00 H new ATOM 1101 N ASN A 69 12.679 -5.609 -5.929 1.00 0.00 N ATOM 1102 CA ASN A 69 13.204 -5.365 -7.268 1.00 0.00 C ATOM 1103 C ASN A 69 14.148 -6.484 -7.695 1.00 0.00 C ATOM 1104 O ASN A 69 14.376 -6.699 -8.886 1.00 0.00 O ATOM 1105 CB ASN A 69 13.934 -4.021 -7.314 1.00 0.00 C ATOM 1106 CG ASN A 69 14.987 -3.898 -6.229 1.00 0.00 C ATOM 1107 OD1 ASN A 69 14.674 -3.930 -5.039 1.00 0.00 O ATOM 1108 ND2 ASN A 69 16.243 -3.755 -6.636 1.00 0.00 N ATOM 0 H ASN A 69 12.855 -4.857 -5.263 1.00 0.00 H new ATOM 0 HA ASN A 69 12.364 -5.339 -7.962 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.405 -3.900 -8.289 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.210 -3.213 -7.207 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.994 -3.666 -5.951 1.00 0.00 H new ATOM 0 HD22 ASN A 69 16.457 -3.734 -7.633 1.00 0.00 H new ATOM 1115 N THR A 70 14.694 -7.197 -6.715 1.00 0.00 N ATOM 1116 CA THR A 70 15.614 -8.294 -6.988 1.00 0.00 C ATOM 1117 C THR A 70 14.884 -9.483 -7.603 1.00 0.00 C ATOM 1118 O THR A 70 13.702 -9.703 -7.338 1.00 0.00 O ATOM 1119 CB THR A 70 16.335 -8.756 -5.707 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.076 -7.668 -5.144 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.272 -9.917 -6.003 1.00 0.00 C ATOM 0 H THR A 70 14.515 -7.034 -5.724 1.00 0.00 H new ATOM 0 HA THR A 70 16.353 -7.918 -7.696 1.00 0.00 H new ATOM 0 HB THR A 70 15.583 -9.091 -4.992 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.700 -8.011 -4.471 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.770 -10.226 -5.084 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.700 -10.753 -6.405 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.019 -9.605 -6.733 1.00 0.00 H new ATOM 1129 N LYS A 71 15.595 -10.247 -8.425 1.00 0.00 N ATOM 1130 CA LYS A 71 15.016 -11.415 -9.077 1.00 0.00 C ATOM 1131 C LYS A 71 15.334 -12.687 -8.298 1.00 0.00 C ATOM 1132 O LYS A 71 16.398 -12.803 -7.688 1.00 0.00 O ATOM 1133 CB LYS A 71 15.540 -11.538 -10.510 1.00 0.00 C ATOM 1134 CG LYS A 71 15.556 -10.221 -11.266 1.00 0.00 C ATOM 1135 CD LYS A 71 16.948 -9.613 -11.299 1.00 0.00 C ATOM 1136 CE LYS A 71 17.172 -8.800 -12.565 1.00 0.00 C ATOM 1137 NZ LYS A 71 16.133 -7.748 -12.738 1.00 0.00 N ATOM 0 H LYS A 71 16.574 -10.078 -8.656 1.00 0.00 H new ATOM 0 HA LYS A 71 13.934 -11.286 -9.102 1.00 0.00 H new ATOM 0 HB2 LYS A 71 16.551 -11.945 -10.485 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.922 -12.252 -11.054 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.204 -10.381 -12.285 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.864 -9.522 -10.796 1.00 0.00 H new ATOM 0 HD2 LYS A 71 17.088 -8.975 -10.426 1.00 0.00 H new ATOM 0 HD3 LYS A 71 17.694 -10.406 -11.238 1.00 0.00 H new ATOM 0 HE2 LYS A 71 18.157 -8.335 -12.529 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.164 -9.464 -13.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 16.590 -6.845 -12.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 15.485 -8.023 -13.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 15.597 -7.640 -11.853 1.00 0.00 H new ATOM 1151 N ILE A 72 14.407 -13.639 -8.323 1.00 0.00 N ATOM 1152 CA ILE A 72 14.591 -14.903 -7.621 1.00 0.00 C ATOM 1153 C ILE A 72 14.646 -16.072 -8.598 1.00 0.00 C ATOM 1154 O ILE A 72 14.126 -15.989 -9.710 1.00 0.00 O ATOM 1155 CB ILE A 72 13.462 -15.151 -6.603 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.475 -13.982 -6.609 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.040 -15.357 -5.211 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.374 -14.116 -5.579 1.00 0.00 C ATOM 0 H ILE A 72 13.521 -13.559 -8.822 1.00 0.00 H new ATOM 0 HA ILE A 72 15.540 -14.833 -7.089 1.00 0.00 H new ATOM 0 HB ILE A 72 12.926 -16.056 -6.890 1.00 0.00 H new ATOM 0 HG12 ILE A 72 13.020 -13.056 -6.428 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.027 -13.900 -7.599 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.230 -15.531 -4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.707 -16.219 -5.218 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.597 -14.469 -4.913 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.712 -13.252 -5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 72 10.804 -15.025 -5.772 1.00 0.00 H new ATOM 0 HD13 ILE A 72 11.812 -14.167 -4.582 1.00 0.00 H new ATOM 1170 N MET A 73 15.278 -17.161 -8.174 1.00 0.00 N ATOM 1171 CA MET A 73 15.398 -18.349 -9.012 1.00 0.00 C ATOM 1172 C MET A 73 14.442 -19.442 -8.545 1.00 0.00 C ATOM 1173 O MET A 73 14.241 -19.633 -7.346 1.00 0.00 O ATOM 1174 CB MET A 73 16.836 -18.871 -8.991 1.00 0.00 C ATOM 1175 CG MET A 73 17.682 -18.367 -10.149 1.00 0.00 C ATOM 1176 SD MET A 73 19.117 -19.411 -10.468 1.00 0.00 S ATOM 1177 CE MET A 73 18.749 -19.998 -12.119 1.00 0.00 C ATOM 0 H MET A 73 15.715 -17.246 -7.256 1.00 0.00 H new ATOM 0 HA MET A 73 15.135 -18.071 -10.033 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.307 -18.577 -8.053 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.819 -19.961 -9.012 1.00 0.00 H new ATOM 0 HG2 MET A 73 17.067 -18.317 -11.048 1.00 0.00 H new ATOM 0 HG3 MET A 73 18.017 -17.352 -9.934 1.00 0.00 H new ATOM 0 HE1 MET A 73 19.548 -20.658 -12.457 1.00 0.00 H new ATOM 0 HE2 MET A 73 17.806 -20.545 -12.109 1.00 0.00 H new ATOM 0 HE3 MET A 73 18.669 -19.149 -12.798 1.00 0.00 H new ATOM 1187 N MET A 74 13.854 -20.156 -9.500 1.00 0.00 N ATOM 1188 CA MET A 74 12.920 -21.230 -9.185 1.00 0.00 C ATOM 1189 C MET A 74 13.584 -22.594 -9.348 1.00 0.00 C ATOM 1190 O MET A 74 13.986 -22.971 -10.448 1.00 0.00 O ATOM 1191 CB MET A 74 11.685 -21.141 -10.084 1.00 0.00 C ATOM 1192 CG MET A 74 10.583 -20.261 -9.516 1.00 0.00 C ATOM 1193 SD MET A 74 9.045 -20.387 -10.449 1.00 0.00 S ATOM 1194 CE MET A 74 8.134 -21.557 -9.444 1.00 0.00 C ATOM 0 H MET A 74 14.008 -20.010 -10.498 1.00 0.00 H new ATOM 0 HA MET A 74 12.613 -21.117 -8.145 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.982 -20.754 -11.059 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.291 -22.144 -10.246 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.398 -20.540 -8.479 1.00 0.00 H new ATOM 0 HG3 MET A 74 10.917 -19.224 -9.512 1.00 0.00 H new ATOM 0 HE1 MET A 74 7.115 -21.644 -9.821 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.622 -22.531 -9.487 1.00 0.00 H new ATOM 0 HE3 MET A 74 8.110 -21.209 -8.411 1.00 0.00 H new ATOM 1204 N MET A 75 13.696 -23.328 -8.246 1.00 0.00 N ATOM 1205 CA MET A 75 14.311 -24.650 -8.268 1.00 0.00 C ATOM 1206 C MET A 75 13.262 -25.741 -8.074 1.00 0.00 C ATOM 1207 O MET A 75 12.665 -25.858 -7.005 1.00 0.00 O ATOM 1208 CB MET A 75 15.381 -24.757 -7.180 1.00 0.00 C ATOM 1209 CG MET A 75 16.317 -23.560 -7.129 1.00 0.00 C ATOM 1210 SD MET A 75 18.031 -24.030 -6.827 1.00 0.00 S ATOM 1211 CE MET A 75 17.913 -24.693 -5.167 1.00 0.00 C ATOM 0 H MET A 75 13.369 -23.030 -7.327 1.00 0.00 H new ATOM 0 HA MET A 75 14.779 -24.789 -9.243 1.00 0.00 H new ATOM 0 HB2 MET A 75 14.893 -24.868 -6.212 1.00 0.00 H new ATOM 0 HB3 MET A 75 15.968 -25.660 -7.347 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.255 -23.015 -8.071 1.00 0.00 H new ATOM 0 HG3 MET A 75 15.987 -22.879 -6.344 1.00 0.00 H new ATOM 0 HE1 MET A 75 18.903 -24.994 -4.824 1.00 0.00 H new ATOM 0 HE2 MET A 75 17.514 -23.930 -4.498 1.00 0.00 H new ATOM 0 HE3 MET A 75 17.250 -25.558 -5.167 1.00 0.00 H new ATOM 1221 N GLY A 76 13.044 -26.537 -9.116 1.00 0.00 N ATOM 1222 CA GLY A 76 12.066 -27.608 -9.040 1.00 0.00 C ATOM 1223 C GLY A 76 11.527 -27.999 -10.401 1.00 0.00 C ATOM 1224 O GLY A 76 12.171 -27.764 -11.424 1.00 0.00 O ATOM 0 H GLY A 76 13.527 -26.460 -10.011 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.522 -28.479 -8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.240 -27.296 -8.401 1.00 0.00 H new ATOM 1228 N THR A 77 10.341 -28.599 -10.416 1.00 0.00 N ATOM 1229 CA THR A 77 9.716 -29.027 -11.662 1.00 0.00 C ATOM 1230 C THR A 77 8.245 -28.628 -11.704 1.00 0.00 C ATOM 1231 O THR A 77 7.611 -28.448 -10.664 1.00 0.00 O ATOM 1232 CB THR A 77 9.830 -30.551 -11.853 1.00 0.00 C ATOM 1233 OG1 THR A 77 9.467 -30.905 -13.192 1.00 0.00 O ATOM 1234 CG2 THR A 77 8.934 -31.288 -10.868 1.00 0.00 C ATOM 0 H THR A 77 9.794 -28.800 -9.579 1.00 0.00 H new ATOM 0 HA THR A 77 10.248 -28.527 -12.471 1.00 0.00 H new ATOM 0 HB THR A 77 10.864 -30.842 -11.668 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.544 -31.875 -13.306 1.00 0.00 H new ATOM 0 HG21 THR A 77 9.031 -32.363 -11.022 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.231 -31.039 -9.849 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.897 -30.991 -11.027 1.00 0.00 H new ATOM 1242 N ARG A 78 7.708 -28.494 -12.912 1.00 0.00 N ATOM 1243 CA ARG A 78 6.311 -28.116 -13.089 1.00 0.00 C ATOM 1244 C ARG A 78 5.413 -29.350 -13.108 1.00 0.00 C ATOM 1245 O ARG A 78 5.799 -30.402 -13.617 1.00 0.00 O ATOM 1246 CB ARG A 78 6.135 -27.324 -14.386 1.00 0.00 C ATOM 1247 CG ARG A 78 6.467 -28.121 -15.637 1.00 0.00 C ATOM 1248 CD ARG A 78 7.904 -27.894 -16.078 1.00 0.00 C ATOM 1249 NE ARG A 78 8.566 -29.140 -16.453 1.00 0.00 N ATOM 1250 CZ ARG A 78 9.789 -29.197 -16.967 1.00 0.00 C ATOM 1251 NH1 ARG A 78 10.480 -28.084 -17.167 1.00 0.00 N ATOM 1252 NH2 ARG A 78 10.323 -30.370 -17.283 1.00 0.00 N ATOM 0 H ARG A 78 8.219 -28.641 -13.782 1.00 0.00 H new ATOM 0 HA ARG A 78 6.020 -27.489 -12.246 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.105 -26.974 -14.451 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.770 -26.439 -14.350 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.307 -29.182 -15.446 1.00 0.00 H new ATOM 0 HG3 ARG A 78 5.789 -27.836 -16.442 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.919 -27.207 -16.924 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.460 -27.417 -15.270 1.00 0.00 H new ATOM 0 HE ARG A 78 8.061 -30.015 -16.312 1.00 0.00 H new ATOM 0 HH11 ARG A 78 10.073 -27.181 -16.926 1.00 0.00 H new ATOM 0 HH12 ARG A 78 11.419 -28.131 -17.562 1.00 0.00 H new ATOM 0 HH21 ARG A 78 9.794 -31.229 -17.131 1.00 0.00 H new ATOM 0 HH22 ARG A 78 11.263 -30.413 -17.678 1.00 0.00 H new ATOM 1266 N GLU A 79 4.214 -29.211 -12.550 1.00 0.00 N ATOM 1267 CA GLU A 79 3.263 -30.315 -12.503 1.00 0.00 C ATOM 1268 C GLU A 79 1.969 -29.950 -13.224 1.00 0.00 C ATOM 1269 O GLU A 79 1.812 -28.829 -13.708 1.00 0.00 O ATOM 1270 CB GLU A 79 2.960 -30.695 -11.051 1.00 0.00 C ATOM 1271 CG GLU A 79 2.319 -29.574 -10.250 1.00 0.00 C ATOM 1272 CD GLU A 79 1.321 -30.085 -9.229 1.00 0.00 C ATOM 1273 OE1 GLU A 79 1.568 -31.162 -8.646 1.00 0.00 O ATOM 1274 OE2 GLU A 79 0.294 -29.408 -9.013 1.00 0.00 O ATOM 0 H GLU A 79 3.879 -28.346 -12.125 1.00 0.00 H new ATOM 0 HA GLU A 79 3.712 -31.169 -13.009 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.299 -31.561 -11.041 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.887 -30.996 -10.562 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.097 -29.006 -9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.817 -28.887 -10.931 1.00 0.00 H new ATOM 1281 N GLU A 80 1.046 -30.905 -13.293 1.00 0.00 N ATOM 1282 CA GLU A 80 -0.233 -30.683 -13.957 1.00 0.00 C ATOM 1283 C GLU A 80 -1.383 -30.746 -12.956 1.00 0.00 C ATOM 1284 O GLU A 80 -1.480 -31.682 -12.163 1.00 0.00 O ATOM 1285 CB GLU A 80 -0.446 -31.721 -15.060 1.00 0.00 C ATOM 1286 CG GLU A 80 -1.556 -31.357 -16.032 1.00 0.00 C ATOM 1287 CD GLU A 80 -1.397 -32.034 -17.380 1.00 0.00 C ATOM 1288 OE1 GLU A 80 -1.472 -33.279 -17.432 1.00 0.00 O ATOM 1289 OE2 GLU A 80 -1.197 -31.317 -18.383 1.00 0.00 O ATOM 0 H GLU A 80 1.160 -31.838 -12.898 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.215 -29.688 -14.402 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.484 -31.846 -15.614 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.676 -32.683 -14.602 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.517 -31.636 -15.601 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.571 -30.276 -16.172 1.00 0.00 H new ATOM 1296 N SER A 81 -2.253 -29.741 -12.999 1.00 0.00 N ATOM 1297 CA SER A 81 -3.394 -29.679 -12.094 1.00 0.00 C ATOM 1298 C SER A 81 -4.599 -30.401 -12.689 1.00 0.00 C ATOM 1299 O SER A 81 -5.486 -30.850 -11.964 1.00 0.00 O ATOM 1300 CB SER A 81 -3.755 -28.222 -11.794 1.00 0.00 C ATOM 1301 OG SER A 81 -2.590 -27.429 -11.645 1.00 0.00 O ATOM 0 H SER A 81 -2.189 -28.959 -13.651 1.00 0.00 H new ATOM 0 HA SER A 81 -3.117 -30.176 -11.165 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.370 -27.823 -12.601 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.352 -28.172 -10.883 1.00 0.00 H new ATOM 0 HG SER A 81 -2.847 -26.502 -11.456 1.00 0.00 H new TER 1307 SER A 81