USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 70 ASN : amide:sc= 2.31 K(o=4.7,f=-10!) USER MOD Set 1.2: A 73 LYS NZ :NH3+ -167:sc= 2.41 (180deg=1.02) USER MOD Set 2.1: A 49 THR OG1 : rot 166:sc= 1.25 USER MOD Set 2.2: A 52 ASN : amide:sc= 0.338 K(o=4.8,f=-0.98!) USER MOD Set 2.3: A 53 LYS NZ :NH3+ -156:sc= 0.451 (180deg=-1.79) USER MOD Set 2.4: A 78 THR OG1 : rot -60:sc= 1.98 USER MOD Set 2.5: A 105 HEC O2D : rot 172:sc= 0.744 USER MOD Set 3.1: A 26 HIS : no HE2:sc= -2.75 K(o=-1.9,f=-4.2!) USER MOD Set 3.2: A 31 ASN : amide:sc= 0.888 K(o=-1.9,f=-7.4!) USER MOD Single : A 1 GLY N :NH3+ -169:sc= 2 (180deg=1.49) USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 1.32 (180deg=1.25) USER MOD Single : A 7 LYS NZ :NH3+ -153:sc= 1.08 (180deg=-1.03!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.766 K(o=0.77,f=-0.059) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 19 THR OG1 : rot 0:sc= 1.14 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00426) USER MOD Single : A 28 THR OG1 : rot -35:sc= 0.649 USER MOD Single : A 33 HIS : no HE2:sc= -0.343 K(o=-0.34,f=-3.5!) USER MOD Single : A 39 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00685) USER MOD Single : A 40 THR OG1 : rot 100:sc= 1.55 USER MOD Single : A 42 GLN : amide:sc= -0.574 K(o=-0.57,f=-3.3!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= 1.1 K(o=1.1,f=-0.48) USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= 1.26 (180deg=1.13) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -157:sc= 1.26 (180deg=1.08) USER MOD Single : A 63 THR OG1 : rot -147:sc= 1.19 USER MOD Single : A 65 MET CE :methyl -150:sc= -1.89 (180deg=-8.14!) USER MOD Single : A 67 TYR OH : rot -125:sc= 0.406 USER MOD Single : A 72 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0442) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.219 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 163:sc= -0.995 (180deg=-2.57) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot -79:sc= 1.04 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 173:sc= 1.25 (180deg=1.11) USER MOD Single : A 100 LYS NZ :NH3+ 177:sc= 1.22 (180deg=1.15) USER MOD Single : A 102 THR OG1 : rot -178:sc= 1.21 USER MOD Single : A 103 ASN : amide:sc= 1.58 K(o=1.6,f=-0.056) USER MOD Single : A 105 HEC O2A : rot -114:sc= 0.0945 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.631 1.036 -0.188 1.00 10.00 N ATOM 2 CA GLY A 1 1.388 2.338 0.450 1.00 10.00 C ATOM 3 C GLY A 1 0.679 2.188 1.787 1.00 10.00 C ATOM 4 O GLY A 1 1.287 2.515 2.798 1.00 10.00 O ATOM 0 H1 GLY A 1 2.274 1.160 -0.996 1.00 10.00 H new ATOM 0 H2 GLY A 1 2.062 0.387 0.501 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.729 0.639 -0.520 1.00 10.00 H new ATOM 0 HA2 GLY A 1 2.337 2.853 0.598 1.00 10.00 H new ATOM 0 HA3 GLY A 1 0.787 2.961 -0.212 1.00 10.00 H new ATOM 10 N ASP A 2 -0.574 1.714 1.811 1.00 10.00 N ATOM 11 CA ASP A 2 -1.405 1.654 3.030 1.00 10.00 C ATOM 12 C ASP A 2 -2.247 0.373 3.176 1.00 10.00 C ATOM 13 O ASP A 2 -2.509 -0.332 2.205 1.00 10.00 O ATOM 14 CB ASP A 2 -2.360 2.862 3.043 1.00 10.00 C ATOM 15 CG ASP A 2 -2.754 3.348 4.438 1.00 10.00 C ATOM 16 OD1 ASP A 2 -2.465 2.640 5.424 1.00 10.00 O ATOM 17 OD2 ASP A 2 -3.352 4.449 4.473 1.00 10.00 O ATOM 0 H ASP A 2 -1.047 1.358 0.980 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.706 1.662 3.866 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.890 3.685 2.505 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -3.265 2.599 2.495 1.00 10.00 H new ATOM 22 N VAL A 3 -2.752 0.143 4.397 1.00 10.00 N ATOM 23 CA VAL A 3 -3.812 -0.815 4.732 1.00 10.00 C ATOM 24 C VAL A 3 -5.172 -0.264 4.288 1.00 10.00 C ATOM 25 O VAL A 3 -5.820 -0.863 3.437 1.00 10.00 O ATOM 26 CB VAL A 3 -3.787 -1.145 6.242 1.00 10.00 C ATOM 27 CG1 VAL A 3 -4.972 -2.019 6.687 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.497 -1.892 6.606 1.00 10.00 C ATOM 0 H VAL A 3 -2.414 0.646 5.217 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.638 -1.748 4.196 1.00 10.00 H new ATOM 0 HB VAL A 3 -3.849 -0.185 6.755 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -4.898 -2.216 7.756 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -5.907 -1.499 6.478 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -4.953 -2.963 6.142 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.495 -2.117 7.673 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -2.442 -2.821 6.039 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -1.636 -1.269 6.365 1.00 10.00 H new ATOM 38 N GLU A 4 -5.619 0.881 4.814 1.00 10.00 N ATOM 39 CA GLU A 4 -6.949 1.447 4.537 1.00 10.00 C ATOM 40 C GLU A 4 -7.187 1.752 3.056 1.00 10.00 C ATOM 41 O GLU A 4 -8.213 1.345 2.502 1.00 10.00 O ATOM 42 CB GLU A 4 -7.181 2.699 5.388 1.00 10.00 C ATOM 43 CG GLU A 4 -7.660 2.395 6.814 1.00 10.00 C ATOM 44 CD GLU A 4 -6.786 1.375 7.551 1.00 10.00 C ATOM 45 OE1 GLU A 4 -5.550 1.563 7.539 1.00 10.00 O ATOM 46 OE2 GLU A 4 -7.362 0.387 8.055 1.00 10.00 O ATOM 0 H GLU A 4 -5.063 1.450 5.452 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.674 0.679 4.809 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -6.254 3.270 5.439 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.918 3.332 4.894 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -7.682 3.322 7.386 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -8.683 2.021 6.773 1.00 10.00 H new ATOM 53 N LYS A 5 -6.230 2.413 2.391 1.00 10.00 N ATOM 54 CA LYS A 5 -6.286 2.624 0.935 1.00 10.00 C ATOM 55 C LYS A 5 -6.339 1.287 0.181 1.00 10.00 C ATOM 56 O LYS A 5 -7.021 1.186 -0.840 1.00 10.00 O ATOM 57 CB LYS A 5 -5.106 3.496 0.460 1.00 10.00 C ATOM 58 CG LYS A 5 -4.965 4.779 1.301 1.00 10.00 C ATOM 59 CD LYS A 5 -3.825 5.687 0.826 1.00 10.00 C ATOM 60 CE LYS A 5 -3.675 6.874 1.789 1.00 10.00 C ATOM 61 NZ LYS A 5 -2.839 6.554 2.973 1.00 10.00 N ATOM 0 H LYS A 5 -5.405 2.812 2.838 1.00 10.00 H new ATOM 0 HA LYS A 5 -7.207 3.161 0.707 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -4.182 2.920 0.519 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -5.250 3.762 -0.587 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -5.902 5.334 1.266 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -4.795 4.507 2.343 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -2.893 5.123 0.780 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.030 6.047 -0.182 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -3.233 7.715 1.255 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -4.663 7.192 2.123 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -2.758 7.396 3.579 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -3.280 5.781 3.511 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -1.892 6.261 2.660 1.00 10.00 H new ATOM 75 N GLY A 6 -5.709 0.249 0.745 1.00 10.00 N ATOM 76 CA GLY A 6 -5.657 -1.108 0.216 1.00 10.00 C ATOM 77 C GLY A 6 -7.000 -1.800 0.337 1.00 10.00 C ATOM 78 O GLY A 6 -7.521 -2.310 -0.655 1.00 10.00 O ATOM 0 H GLY A 6 -5.200 0.343 1.624 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.353 -1.081 -0.830 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.901 -1.681 0.753 1.00 10.00 H new ATOM 82 N LYS A 7 -7.605 -1.788 1.531 1.00 10.00 N ATOM 83 CA LYS A 7 -8.886 -2.440 1.734 1.00 10.00 C ATOM 84 C LYS A 7 -10.007 -1.758 0.934 1.00 10.00 C ATOM 85 O LYS A 7 -10.879 -2.437 0.402 1.00 10.00 O ATOM 86 CB LYS A 7 -9.124 -2.591 3.241 1.00 10.00 C ATOM 87 CG LYS A 7 -9.786 -1.398 3.935 1.00 10.00 C ATOM 88 CD LYS A 7 -11.250 -1.754 4.218 1.00 10.00 C ATOM 89 CE LYS A 7 -12.117 -0.536 4.507 1.00 10.00 C ATOM 90 NZ LYS A 7 -13.547 -0.909 4.449 1.00 10.00 N ATOM 0 H LYS A 7 -7.224 -1.334 2.361 1.00 10.00 H new ATOM 0 HA LYS A 7 -8.883 -3.450 1.324 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -9.744 -3.472 3.405 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.165 -2.782 3.724 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -9.266 -1.164 4.864 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -9.727 -0.511 3.304 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.660 -2.289 3.361 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -11.294 -2.434 5.069 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -11.877 -0.134 5.491 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.908 0.250 3.782 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -14.113 -0.076 4.190 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -13.683 -1.655 3.737 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -13.852 -1.259 5.379 1.00 10.00 H new ATOM 104 N LYS A 8 -9.920 -0.431 0.749 1.00 10.00 N ATOM 105 CA LYS A 8 -10.815 0.355 -0.105 1.00 10.00 C ATOM 106 C LYS A 8 -10.701 -0.067 -1.572 1.00 10.00 C ATOM 107 O LYS A 8 -11.710 -0.417 -2.178 1.00 10.00 O ATOM 108 CB LYS A 8 -10.536 1.852 0.100 1.00 10.00 C ATOM 109 CG LYS A 8 -11.547 2.729 -0.658 1.00 10.00 C ATOM 110 CD LYS A 8 -11.280 4.232 -0.485 1.00 10.00 C ATOM 111 CE LYS A 8 -11.380 4.729 0.965 1.00 10.00 C ATOM 112 NZ LYS A 8 -12.745 4.575 1.523 1.00 10.00 N ATOM 0 H LYS A 8 -9.205 0.137 1.203 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.848 0.162 0.184 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -10.576 2.087 1.164 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -9.527 2.084 -0.240 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -11.515 2.479 -1.718 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -12.553 2.501 -0.307 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -10.284 4.459 -0.867 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -11.990 4.788 -1.097 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -10.673 4.178 1.585 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -11.090 5.779 1.007 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -12.761 4.924 2.503 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -13.418 5.122 0.949 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -13.014 3.571 1.509 1.00 10.00 H new ATOM 126 N ILE A 9 -9.491 -0.050 -2.150 1.00 10.00 N ATOM 127 CA ILE A 9 -9.293 -0.429 -3.558 1.00 10.00 C ATOM 128 C ILE A 9 -9.543 -1.940 -3.786 1.00 10.00 C ATOM 129 O ILE A 9 -10.122 -2.311 -4.809 1.00 10.00 O ATOM 130 CB ILE A 9 -7.950 0.157 -4.070 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.872 0.439 -5.587 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.710 -0.601 -3.607 1.00 10.00 C ATOM 133 CD1 ILE A 9 -7.746 -0.748 -6.555 1.00 10.00 C ATOM 0 H ILE A 9 -8.635 0.222 -1.666 1.00 10.00 H new ATOM 0 HA ILE A 9 -10.051 0.025 -4.197 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.947 1.131 -3.580 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -8.765 0.998 -5.865 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -7.019 1.096 -5.757 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.818 -0.122 -4.012 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.664 -0.592 -2.518 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.760 -1.631 -3.960 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -7.703 -0.379 -7.580 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -6.836 -1.305 -6.332 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.609 -1.404 -6.441 1.00 10.00 H new ATOM 145 N PHE A 10 -9.294 -2.809 -2.790 1.00 10.00 N ATOM 146 CA PHE A 10 -9.790 -4.191 -2.783 1.00 10.00 C ATOM 147 C PHE A 10 -11.314 -4.223 -2.921 1.00 10.00 C ATOM 148 O PHE A 10 -11.842 -4.857 -3.835 1.00 10.00 O ATOM 149 CB PHE A 10 -9.353 -4.945 -1.517 1.00 10.00 C ATOM 150 CG PHE A 10 -9.720 -6.414 -1.557 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.017 -6.830 -1.201 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.771 -7.371 -1.966 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.375 -8.182 -1.310 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.126 -8.727 -2.042 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.435 -9.129 -1.739 1.00 10.00 C ATOM 0 H PHE A 10 -8.742 -2.569 -1.967 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.350 -4.697 -3.642 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.274 -4.847 -1.395 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.816 -4.482 -0.645 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.737 -6.108 -0.844 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.768 -7.061 -2.222 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.379 -8.494 -1.062 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.390 -9.462 -2.334 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.718 -10.167 -1.836 1.00 10.00 H new ATOM 165 N VAL A 11 -12.044 -3.511 -2.058 1.00 10.00 N ATOM 166 CA VAL A 11 -13.512 -3.470 -2.124 1.00 10.00 C ATOM 167 C VAL A 11 -14.045 -2.865 -3.440 1.00 10.00 C ATOM 168 O VAL A 11 -15.203 -3.070 -3.791 1.00 10.00 O ATOM 169 CB VAL A 11 -14.085 -2.790 -0.858 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.579 -2.439 -0.915 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.907 -3.735 0.340 1.00 10.00 C ATOM 0 H VAL A 11 -11.644 -2.953 -1.303 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.874 -4.498 -2.137 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.534 -1.854 -0.772 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.878 -1.968 0.021 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.760 -1.752 -1.741 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.161 -3.348 -1.065 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.308 -3.264 1.238 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.439 -4.667 0.150 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.847 -3.945 0.483 1.00 10.00 H new ATOM 181 N GLN A 12 -13.184 -2.203 -4.219 1.00 10.00 N ATOM 182 CA GLN A 12 -13.523 -1.600 -5.508 1.00 10.00 C ATOM 183 C GLN A 12 -13.275 -2.555 -6.679 1.00 10.00 C ATOM 184 O GLN A 12 -14.083 -2.569 -7.610 1.00 10.00 O ATOM 185 CB GLN A 12 -12.711 -0.312 -5.726 1.00 10.00 C ATOM 186 CG GLN A 12 -13.076 0.471 -7.001 1.00 10.00 C ATOM 187 CD GLN A 12 -14.558 0.823 -7.107 1.00 10.00 C ATOM 188 OE1 GLN A 12 -14.991 1.897 -6.727 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.379 -0.074 -7.620 1.00 10.00 N ATOM 0 H GLN A 12 -12.206 -2.069 -3.962 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.588 -1.371 -5.479 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.851 0.340 -4.863 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.652 -0.568 -5.764 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.491 1.390 -7.031 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -12.789 -0.118 -7.872 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.018 -0.973 -7.938 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -16.375 0.132 -7.698 1.00 10.00 H new ATOM 198 N LYS A 13 -12.148 -3.288 -6.662 1.00 10.00 N ATOM 199 CA LYS A 13 -11.664 -4.055 -7.821 1.00 10.00 C ATOM 200 C LYS A 13 -11.426 -5.547 -7.575 1.00 10.00 C ATOM 201 O LYS A 13 -11.129 -6.284 -8.508 1.00 10.00 O ATOM 202 CB LYS A 13 -10.429 -3.356 -8.426 1.00 10.00 C ATOM 203 CG LYS A 13 -10.412 -3.441 -9.962 1.00 10.00 C ATOM 204 CD LYS A 13 -11.473 -2.523 -10.584 1.00 10.00 C ATOM 205 CE LYS A 13 -11.627 -2.792 -12.080 1.00 10.00 C ATOM 206 NZ LYS A 13 -12.666 -1.913 -12.662 1.00 10.00 N ATOM 0 H LYS A 13 -11.547 -3.365 -5.842 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.480 -4.054 -8.544 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.419 -2.310 -8.121 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -9.523 -3.813 -8.028 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -9.425 -3.163 -10.333 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -10.591 -4.470 -10.273 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -12.429 -2.677 -10.084 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -11.194 -1.481 -10.426 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -10.676 -2.624 -12.585 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -11.894 -3.836 -12.242 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -12.757 -2.110 -13.679 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -13.576 -2.093 -12.192 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -12.396 -0.918 -12.525 1.00 10.00 H new ATOM 220 N CYS A 14 -11.613 -6.003 -6.339 1.00 10.00 N ATOM 221 CA CYS A 14 -11.446 -7.383 -5.903 1.00 10.00 C ATOM 222 C CYS A 14 -12.751 -7.937 -5.322 1.00 10.00 C ATOM 223 O CYS A 14 -13.154 -9.046 -5.681 1.00 10.00 O ATOM 224 CB CYS A 14 -10.328 -7.424 -4.863 1.00 10.00 C ATOM 225 SG CYS A 14 -8.735 -6.675 -5.325 1.00 10.00 S ATOM 0 H CYS A 14 -11.899 -5.387 -5.578 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.183 -8.009 -6.756 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.686 -6.927 -3.962 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.148 -8.467 -4.601 1.00 10.00 H new ATOM 230 N ALA A 15 -13.452 -7.154 -4.485 1.00 10.00 N ATOM 231 CA ALA A 15 -14.757 -7.559 -3.935 1.00 10.00 C ATOM 232 C ALA A 15 -15.887 -7.671 -4.983 1.00 10.00 C ATOM 233 O ALA A 15 -16.982 -8.125 -4.664 1.00 10.00 O ATOM 234 CB ALA A 15 -15.159 -6.637 -2.785 1.00 10.00 C ATOM 0 H ALA A 15 -13.136 -6.235 -4.174 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.621 -8.573 -3.559 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.125 -6.949 -2.389 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.409 -6.691 -1.996 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.230 -5.612 -3.148 1.00 10.00 H new ATOM 240 N GLN A 16 -15.624 -7.315 -6.249 1.00 10.00 N ATOM 241 CA GLN A 16 -16.461 -7.651 -7.396 1.00 10.00 C ATOM 242 C GLN A 16 -16.489 -9.158 -7.732 1.00 10.00 C ATOM 243 O GLN A 16 -17.339 -9.582 -8.511 1.00 10.00 O ATOM 244 CB GLN A 16 -15.996 -6.809 -8.595 1.00 10.00 C ATOM 245 CG GLN A 16 -14.557 -7.075 -9.059 1.00 10.00 C ATOM 246 CD GLN A 16 -14.258 -6.390 -10.392 1.00 10.00 C ATOM 247 OE1 GLN A 16 -13.746 -5.279 -10.463 1.00 10.00 O ATOM 248 NE2 GLN A 16 -14.584 -7.031 -11.500 1.00 10.00 N ATOM 0 H GLN A 16 -14.800 -6.771 -6.504 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.494 -7.413 -7.141 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -16.671 -6.992 -9.431 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -16.089 -5.754 -8.336 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -13.859 -6.719 -8.302 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -14.399 -8.149 -9.158 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -15.010 -7.956 -11.447 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.409 -6.601 -12.408 1.00 10.00 H new ATOM 257 N CYS A 17 -15.589 -9.962 -7.146 1.00 10.00 N ATOM 258 CA CYS A 17 -15.397 -11.383 -7.439 1.00 10.00 C ATOM 259 C CYS A 17 -15.045 -12.205 -6.177 1.00 10.00 C ATOM 260 O CYS A 17 -15.557 -13.315 -6.007 1.00 10.00 O ATOM 261 CB CYS A 17 -14.275 -11.490 -8.476 1.00 10.00 C ATOM 262 SG CYS A 17 -14.683 -10.984 -10.183 1.00 10.00 S ATOM 0 H CYS A 17 -14.951 -9.622 -6.426 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.330 -11.799 -7.820 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.436 -10.884 -8.133 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.932 -12.524 -8.501 1.00 10.00 H new ATOM 267 N HIS A 18 -14.195 -11.653 -5.300 1.00 10.00 N ATOM 268 CA HIS A 18 -13.923 -12.087 -3.927 1.00 10.00 C ATOM 269 C HIS A 18 -14.837 -11.294 -2.955 1.00 10.00 C ATOM 270 O HIS A 18 -15.837 -10.715 -3.375 1.00 10.00 O ATOM 271 CB HIS A 18 -12.412 -11.870 -3.678 1.00 10.00 C ATOM 272 CG HIS A 18 -11.544 -12.560 -4.689 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.161 -13.869 -4.620 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.939 -12.001 -5.780 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.325 -14.092 -5.649 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.170 -12.996 -6.399 1.00 10.00 N ATOM 0 H HIS A 18 -13.642 -10.834 -5.551 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.148 -13.140 -3.761 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.197 -10.801 -3.692 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.158 -12.233 -2.682 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.454 -14.550 -3.919 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.036 -10.976 -6.107 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.840 -15.037 -5.845 1.00 10.00 H new ATOM 284 N THR A 19 -14.530 -11.235 -1.651 1.00 10.00 N ATOM 285 CA THR A 19 -15.154 -10.257 -0.728 1.00 10.00 C ATOM 286 C THR A 19 -14.274 -9.948 0.481 1.00 10.00 C ATOM 287 O THR A 19 -13.964 -8.782 0.709 1.00 10.00 O ATOM 288 CB THR A 19 -16.547 -10.721 -0.273 1.00 10.00 C ATOM 289 OG1 THR A 19 -17.432 -10.615 -1.355 1.00 10.00 O ATOM 290 CG2 THR A 19 -17.159 -9.866 0.839 1.00 10.00 C ATOM 0 H THR A 19 -13.852 -11.852 -1.204 1.00 10.00 H new ATOM 0 HA THR A 19 -15.265 -9.332 -1.295 1.00 10.00 H new ATOM 0 HB THR A 19 -16.411 -11.737 0.097 1.00 10.00 H new ATOM 0 HG1 THR A 19 -16.951 -10.277 -2.139 1.00 10.00 H new ATOM 0 HG21 THR A 19 -18.141 -10.260 1.102 1.00 10.00 H new ATOM 0 HG22 THR A 19 -16.511 -9.891 1.715 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.261 -8.838 0.493 1.00 10.00 H new ATOM 298 N VAL A 20 -13.857 -10.976 1.234 1.00 10.00 N ATOM 299 CA VAL A 20 -12.964 -10.889 2.407 1.00 10.00 C ATOM 300 C VAL A 20 -13.516 -10.043 3.564 1.00 10.00 C ATOM 301 O VAL A 20 -13.853 -10.618 4.593 1.00 10.00 O ATOM 302 CB VAL A 20 -11.533 -10.454 2.015 1.00 10.00 C ATOM 303 CG1 VAL A 20 -10.571 -10.491 3.213 1.00 10.00 C ATOM 304 CG2 VAL A 20 -10.949 -11.372 0.940 1.00 10.00 C ATOM 0 H VAL A 20 -14.144 -11.935 1.036 1.00 10.00 H new ATOM 0 HA VAL A 20 -12.913 -11.907 2.795 1.00 10.00 H new ATOM 0 HB VAL A 20 -11.626 -9.434 1.643 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -9.578 -10.178 2.892 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -10.931 -9.816 3.989 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -10.521 -11.505 3.609 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -9.942 -11.040 0.686 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -10.910 -12.394 1.316 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -11.578 -11.337 0.051 1.00 10.00 H new ATOM 314 N GLU A 21 -13.574 -8.710 3.429 1.00 10.00 N ATOM 315 CA GLU A 21 -13.813 -7.773 4.538 1.00 10.00 C ATOM 316 C GLU A 21 -15.147 -8.058 5.248 1.00 10.00 C ATOM 317 O GLU A 21 -15.171 -8.198 6.470 1.00 10.00 O ATOM 318 CB GLU A 21 -13.740 -6.307 4.047 1.00 10.00 C ATOM 319 CG GLU A 21 -13.593 -5.313 5.222 1.00 10.00 C ATOM 320 CD GLU A 21 -14.010 -3.868 4.894 1.00 10.00 C ATOM 321 OE1 GLU A 21 -13.886 -3.440 3.725 1.00 10.00 O ATOM 322 OE2 GLU A 21 -14.399 -3.113 5.822 1.00 10.00 O ATOM 0 H GLU A 21 -13.454 -8.244 2.530 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.021 -7.924 5.272 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.896 -6.193 3.367 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -14.640 -6.069 3.480 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -14.193 -5.669 6.059 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -12.554 -5.312 5.552 1.00 10.00 H new ATOM 329 N LYS A 22 -16.253 -8.130 4.488 1.00 10.00 N ATOM 330 CA LYS A 22 -17.628 -8.214 5.006 1.00 10.00 C ATOM 331 C LYS A 22 -18.542 -8.925 3.998 1.00 10.00 C ATOM 332 O LYS A 22 -18.985 -8.318 3.028 1.00 10.00 O ATOM 333 CB LYS A 22 -18.186 -6.802 5.321 1.00 10.00 C ATOM 334 CG LYS A 22 -17.382 -6.061 6.400 1.00 10.00 C ATOM 335 CD LYS A 22 -17.919 -4.674 6.754 1.00 10.00 C ATOM 336 CE LYS A 22 -16.888 -4.017 7.682 1.00 10.00 C ATOM 337 NZ LYS A 22 -17.206 -2.600 7.955 1.00 10.00 N ATOM 0 H LYS A 22 -16.213 -8.131 3.469 1.00 10.00 H new ATOM 0 HA LYS A 22 -17.604 -8.793 5.929 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.190 -6.208 4.407 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -19.222 -6.892 5.647 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.364 -6.671 7.303 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -16.351 -5.961 6.062 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -18.065 -4.076 5.855 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -18.888 -4.750 7.247 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -16.846 -4.566 8.623 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -15.899 -4.085 7.229 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -16.483 -2.197 8.585 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -17.220 -2.069 7.061 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -18.138 -2.535 8.411 1.00 10.00 H new ATOM 351 N GLY A 23 -18.819 -10.217 4.230 1.00 10.00 N ATOM 352 CA GLY A 23 -19.901 -10.954 3.556 1.00 10.00 C ATOM 353 C GLY A 23 -19.513 -12.244 2.822 1.00 10.00 C ATOM 354 O GLY A 23 -20.409 -12.952 2.369 1.00 10.00 O ATOM 0 H GLY A 23 -18.295 -10.785 4.896 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -20.657 -11.202 4.301 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -20.371 -10.283 2.837 1.00 10.00 H new ATOM 358 N GLY A 24 -18.219 -12.568 2.684 1.00 10.00 N ATOM 359 CA GLY A 24 -17.730 -13.872 2.193 1.00 10.00 C ATOM 360 C GLY A 24 -18.078 -14.257 0.745 1.00 10.00 C ATOM 361 O GLY A 24 -17.858 -15.398 0.330 1.00 10.00 O ATOM 0 H GLY A 24 -17.465 -11.920 2.914 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -16.645 -13.885 2.294 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -18.120 -14.648 2.851 1.00 10.00 H new ATOM 365 N LYS A 25 -18.670 -13.328 -0.006 1.00 10.00 N ATOM 366 CA LYS A 25 -19.381 -13.521 -1.273 1.00 10.00 C ATOM 367 C LYS A 25 -18.448 -13.771 -2.476 1.00 10.00 C ATOM 368 O LYS A 25 -18.275 -12.940 -3.365 1.00 10.00 O ATOM 369 CB LYS A 25 -20.325 -12.317 -1.451 1.00 10.00 C ATOM 370 CG LYS A 25 -21.386 -12.490 -2.545 1.00 10.00 C ATOM 371 CD LYS A 25 -22.472 -13.528 -2.235 1.00 10.00 C ATOM 372 CE LYS A 25 -23.397 -13.056 -1.103 1.00 10.00 C ATOM 373 NZ LYS A 25 -24.615 -13.894 -1.016 1.00 10.00 N ATOM 0 H LYS A 25 -18.665 -12.348 0.275 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.965 -14.441 -1.235 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.828 -12.124 -0.503 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -19.727 -11.435 -1.680 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -21.865 -11.527 -2.722 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -20.888 -12.773 -3.472 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -23.061 -13.718 -3.132 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -22.005 -14.472 -1.954 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -22.861 -13.091 -0.155 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -23.680 -12.017 -1.271 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -25.219 -13.550 -0.242 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -25.138 -13.841 -1.913 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -24.345 -14.881 -0.831 1.00 10.00 H new ATOM 387 N HIS A 26 -17.910 -14.988 -2.534 1.00 10.00 N ATOM 388 CA HIS A 26 -17.106 -15.584 -3.611 1.00 10.00 C ATOM 389 C HIS A 26 -17.882 -15.760 -4.942 1.00 10.00 C ATOM 390 O HIS A 26 -18.081 -16.879 -5.427 1.00 10.00 O ATOM 391 CB HIS A 26 -16.569 -16.932 -3.081 1.00 10.00 C ATOM 392 CG HIS A 26 -17.664 -17.766 -2.469 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.824 -18.138 -3.103 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.802 -18.047 -1.143 1.00 10.00 C ATOM 395 CE1 HIS A 26 -19.672 -18.601 -2.173 1.00 10.00 C ATOM 396 NE2 HIS A 26 -19.099 -18.547 -0.962 1.00 10.00 N ATOM 0 H HIS A 26 -18.034 -15.644 -1.763 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.290 -14.907 -3.864 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -16.104 -17.485 -3.897 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.793 -16.748 -2.338 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -19.008 -18.074 -4.104 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -17.054 -17.910 -0.376 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -20.670 -18.964 -2.370 1.00 10.00 H new ATOM 404 N LYS A 27 -18.348 -14.664 -5.556 1.00 10.00 N ATOM 405 CA LYS A 27 -19.040 -14.709 -6.857 1.00 10.00 C ATOM 406 C LYS A 27 -18.137 -15.130 -8.019 1.00 10.00 C ATOM 407 O LYS A 27 -18.651 -15.568 -9.049 1.00 10.00 O ATOM 408 CB LYS A 27 -19.732 -13.367 -7.159 1.00 10.00 C ATOM 409 CG LYS A 27 -21.141 -13.359 -6.551 1.00 10.00 C ATOM 410 CD LYS A 27 -21.870 -12.029 -6.791 1.00 10.00 C ATOM 411 CE LYS A 27 -23.210 -11.978 -6.045 1.00 10.00 C ATOM 412 NZ LYS A 27 -24.179 -12.988 -6.533 1.00 10.00 N ATOM 0 H LYS A 27 -18.258 -13.724 -5.170 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.797 -15.488 -6.767 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -19.145 -12.545 -6.750 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -19.790 -13.212 -8.236 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.724 -14.174 -6.980 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -21.073 -13.546 -5.479 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -21.239 -11.203 -6.464 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -22.042 -11.895 -7.859 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -23.034 -12.135 -4.981 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.643 -10.984 -6.153 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -25.071 -12.897 -6.006 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -24.358 -12.836 -7.546 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -23.789 -13.941 -6.390 1.00 10.00 H new ATOM 426 N THR A 28 -16.810 -15.008 -7.904 1.00 10.00 N ATOM 427 CA THR A 28 -15.866 -15.509 -8.925 1.00 10.00 C ATOM 428 C THR A 28 -14.463 -15.842 -8.374 1.00 10.00 C ATOM 429 O THR A 28 -13.641 -16.345 -9.127 1.00 10.00 O ATOM 430 CB THR A 28 -15.786 -14.550 -10.139 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.056 -14.051 -10.496 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.261 -15.191 -11.428 1.00 10.00 C ATOM 0 H THR A 28 -16.356 -14.562 -7.107 1.00 10.00 H new ATOM 0 HA THR A 28 -16.278 -16.460 -9.263 1.00 10.00 H new ATOM 0 HB THR A 28 -15.099 -13.780 -9.789 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.734 -14.742 -10.344 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.240 -14.445 -12.223 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.253 -15.572 -11.261 1.00 10.00 H new ATOM 0 HG23 THR A 28 -15.916 -16.013 -11.719 1.00 10.00 H new ATOM 440 N GLY A 29 -14.174 -15.653 -7.077 1.00 10.00 N ATOM 441 CA GLY A 29 -12.965 -16.185 -6.434 1.00 10.00 C ATOM 442 C GLY A 29 -13.191 -16.518 -4.950 1.00 10.00 C ATOM 443 O GLY A 29 -14.066 -15.916 -4.332 1.00 10.00 O ATOM 0 H GLY A 29 -14.775 -15.125 -6.444 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.642 -17.083 -6.960 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.159 -15.456 -6.522 1.00 10.00 H new ATOM 447 N PRO A 30 -12.401 -17.419 -4.328 1.00 10.00 N ATOM 448 CA PRO A 30 -12.821 -18.267 -3.189 1.00 10.00 C ATOM 449 C PRO A 30 -13.010 -17.568 -1.823 1.00 10.00 C ATOM 450 O PRO A 30 -13.312 -18.224 -0.821 1.00 10.00 O ATOM 451 CB PRO A 30 -11.727 -19.345 -3.091 1.00 10.00 C ATOM 452 CG PRO A 30 -10.487 -18.678 -3.672 1.00 10.00 C ATOM 453 CD PRO A 30 -11.066 -17.797 -4.776 1.00 10.00 C ATOM 0 HA PRO A 30 -13.824 -18.640 -3.394 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.565 -19.655 -2.058 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.998 -20.239 -3.653 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.954 -18.091 -2.923 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.781 -19.409 -4.066 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.445 -16.916 -4.939 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.110 -18.336 -5.723 1.00 10.00 H new ATOM 461 N ASN A 31 -12.860 -16.240 -1.783 1.00 10.00 N ATOM 462 CA ASN A 31 -12.296 -15.420 -0.712 1.00 10.00 C ATOM 463 C ASN A 31 -10.807 -15.709 -0.467 1.00 10.00 C ATOM 464 O ASN A 31 -10.345 -16.840 -0.571 1.00 10.00 O ATOM 465 CB ASN A 31 -13.055 -15.539 0.609 1.00 10.00 C ATOM 466 CG ASN A 31 -14.538 -15.354 0.464 1.00 10.00 C ATOM 467 OD1 ASN A 31 -15.022 -14.228 0.416 1.00 10.00 O ATOM 468 ND2 ASN A 31 -15.261 -16.453 0.424 1.00 10.00 N ATOM 0 H ASN A 31 -13.157 -15.663 -2.570 1.00 10.00 H new ATOM 0 HA ASN A 31 -12.403 -14.397 -1.072 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -12.860 -16.519 1.045 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -12.670 -14.797 1.308 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -16.277 -16.393 0.350 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.806 -17.365 0.467 1.00 10.00 H new ATOM 475 N LEU A 32 -10.064 -14.688 -0.036 1.00 10.00 N ATOM 476 CA LEU A 32 -8.649 -14.784 0.330 1.00 10.00 C ATOM 477 C LEU A 32 -8.494 -15.280 1.784 1.00 10.00 C ATOM 478 O LEU A 32 -7.772 -14.708 2.601 1.00 10.00 O ATOM 479 CB LEU A 32 -7.966 -13.433 0.049 1.00 10.00 C ATOM 480 CG LEU A 32 -7.813 -13.122 -1.456 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.098 -12.667 -2.149 1.00 10.00 C ATOM 482 CD2 LEU A 32 -6.788 -12.004 -1.596 1.00 10.00 C ATOM 0 H LEU A 32 -10.440 -13.746 0.071 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.142 -15.531 -0.281 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -8.544 -12.638 0.519 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -6.981 -13.429 0.515 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.514 -14.053 -1.938 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.894 -12.472 -3.202 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -9.853 -13.448 -2.065 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -9.464 -11.756 -1.675 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.657 -11.760 -2.650 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.137 -11.121 -1.060 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -5.835 -12.329 -1.178 1.00 10.00 H new ATOM 494 N HIS A 33 -9.191 -16.378 2.089 1.00 10.00 N ATOM 495 CA HIS A 33 -9.350 -17.016 3.395 1.00 10.00 C ATOM 496 C HIS A 33 -8.018 -17.356 4.087 1.00 10.00 C ATOM 497 O HIS A 33 -7.396 -18.382 3.804 1.00 10.00 O ATOM 498 CB HIS A 33 -10.246 -18.257 3.234 1.00 10.00 C ATOM 499 CG HIS A 33 -9.919 -19.152 2.056 1.00 10.00 C ATOM 500 ND1 HIS A 33 -8.693 -19.321 1.449 1.00 10.00 N ATOM 501 CD2 HIS A 33 -10.827 -19.899 1.363 1.00 10.00 C ATOM 502 CE1 HIS A 33 -8.870 -20.132 0.388 1.00 10.00 C ATOM 503 NE2 HIS A 33 -10.154 -20.519 0.312 1.00 10.00 N ATOM 0 H HIS A 33 -9.701 -16.885 1.366 1.00 10.00 H new ATOM 0 HA HIS A 33 -9.827 -16.297 4.062 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -10.182 -18.850 4.146 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.280 -17.926 3.140 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -7.811 -18.907 1.749 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.879 -19.993 1.589 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -8.093 -20.428 -0.301 1.00 10.00 H new ATOM 511 N GLY A 34 -7.590 -16.489 5.012 1.00 10.00 N ATOM 512 CA GLY A 34 -6.420 -16.697 5.867 1.00 10.00 C ATOM 513 C GLY A 34 -5.079 -16.703 5.125 1.00 10.00 C ATOM 514 O GLY A 34 -4.104 -17.233 5.650 1.00 10.00 O ATOM 0 H GLY A 34 -8.061 -15.602 5.190 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.397 -15.914 6.625 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.534 -17.646 6.392 1.00 10.00 H new ATOM 518 N LEU A 35 -5.017 -16.176 3.895 1.00 10.00 N ATOM 519 CA LEU A 35 -3.796 -16.106 3.083 1.00 10.00 C ATOM 520 C LEU A 35 -2.693 -15.264 3.766 1.00 10.00 C ATOM 521 O LEU A 35 -2.928 -14.640 4.799 1.00 10.00 O ATOM 522 CB LEU A 35 -4.184 -15.612 1.674 1.00 10.00 C ATOM 523 CG LEU A 35 -4.523 -16.752 0.692 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.690 -17.645 1.112 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.840 -16.149 -0.676 1.00 10.00 C ATOM 0 H LEU A 35 -5.832 -15.778 3.427 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.348 -17.095 2.984 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -5.043 -14.946 1.755 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.362 -15.024 1.265 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.643 -17.395 0.673 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -5.849 -18.415 0.357 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.462 -18.116 2.068 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.592 -17.042 1.211 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -5.081 -16.947 -1.378 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.691 -15.474 -0.588 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.974 -15.596 -1.039 1.00 10.00 H new ATOM 537 N PHE A 36 -1.477 -15.253 3.203 1.00 10.00 N ATOM 538 CA PHE A 36 -0.225 -14.809 3.837 1.00 10.00 C ATOM 539 C PHE A 36 0.245 -15.795 4.907 1.00 10.00 C ATOM 540 O PHE A 36 0.250 -15.522 6.104 1.00 10.00 O ATOM 541 CB PHE A 36 -0.229 -13.335 4.244 1.00 10.00 C ATOM 542 CG PHE A 36 -0.457 -12.438 3.051 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.765 -12.186 2.596 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.647 -11.999 2.299 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.958 -11.555 1.358 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.447 -11.332 1.082 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.856 -11.111 0.617 1.00 10.00 C ATOM 0 H PHE A 36 -1.331 -15.569 2.244 1.00 10.00 H new ATOM 0 HA PHE A 36 0.553 -14.834 3.074 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.009 -13.162 4.986 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.721 -13.083 4.715 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.615 -12.477 3.196 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.650 -12.176 2.659 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.958 -11.411 0.976 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.294 -10.990 0.505 1.00 10.00 H new ATOM 0 HZ PHE A 36 -1.011 -10.595 -0.319 1.00 10.00 H new ATOM 557 N GLY A 37 0.646 -16.966 4.408 1.00 10.00 N ATOM 558 CA GLY A 37 1.158 -18.111 5.164 1.00 10.00 C ATOM 559 C GLY A 37 0.439 -19.424 4.833 1.00 10.00 C ATOM 560 O GLY A 37 1.018 -20.495 5.006 1.00 10.00 O ATOM 0 H GLY A 37 0.620 -17.151 3.405 1.00 10.00 H new ATOM 0 HA2 GLY A 37 2.223 -18.226 4.960 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.058 -17.908 6.230 1.00 10.00 H new ATOM 564 N ARG A 38 -0.803 -19.359 4.327 1.00 10.00 N ATOM 565 CA ARG A 38 -1.543 -20.535 3.846 1.00 10.00 C ATOM 566 C ARG A 38 -1.078 -20.996 2.456 1.00 10.00 C ATOM 567 O ARG A 38 -0.432 -20.267 1.700 1.00 10.00 O ATOM 568 CB ARG A 38 -3.064 -20.281 3.884 1.00 10.00 C ATOM 569 CG ARG A 38 -3.581 -20.307 5.331 1.00 10.00 C ATOM 570 CD ARG A 38 -5.120 -20.229 5.444 1.00 10.00 C ATOM 571 NE ARG A 38 -5.839 -21.353 4.805 1.00 10.00 N ATOM 572 CZ ARG A 38 -5.599 -22.645 5.006 1.00 10.00 C ATOM 573 NH1 ARG A 38 -4.879 -23.113 5.998 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.088 -23.539 4.201 1.00 10.00 N ATOM 0 H ARG A 38 -1.323 -18.486 4.240 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.321 -21.355 4.529 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.288 -19.316 3.429 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.580 -21.039 3.294 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.236 -21.221 5.814 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -3.143 -19.473 5.879 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.393 -20.192 6.499 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.458 -19.295 4.994 1.00 10.00 H new ATOM 0 HE ARG A 38 -6.586 -21.115 4.152 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -4.464 -22.472 6.674 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -4.734 -24.118 6.093 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -6.661 -23.252 3.407 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -5.899 -24.528 4.362 1.00 10.00 H new ATOM 588 N LYS A 39 -1.445 -22.241 2.145 1.00 10.00 N ATOM 589 CA LYS A 39 -1.309 -22.913 0.850 1.00 10.00 C ATOM 590 C LYS A 39 -2.329 -22.388 -0.175 1.00 10.00 C ATOM 591 O LYS A 39 -3.172 -21.550 0.140 1.00 10.00 O ATOM 592 CB LYS A 39 -1.414 -24.445 1.050 1.00 10.00 C ATOM 593 CG LYS A 39 -2.678 -24.902 1.807 1.00 10.00 C ATOM 594 CD LYS A 39 -2.436 -25.102 3.316 1.00 10.00 C ATOM 595 CE LYS A 39 -1.938 -26.511 3.666 1.00 10.00 C ATOM 596 NZ LYS A 39 -3.027 -27.513 3.583 1.00 10.00 N ATOM 0 H LYS A 39 -1.876 -22.850 2.841 1.00 10.00 H new ATOM 0 HA LYS A 39 -0.326 -22.687 0.436 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -1.395 -24.929 0.074 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -0.535 -24.790 1.594 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -3.467 -24.163 1.666 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -3.036 -25.837 1.375 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -1.706 -24.369 3.661 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -3.363 -24.907 3.855 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -1.133 -26.792 2.987 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -1.520 -26.510 4.673 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -2.666 -28.443 3.875 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -3.806 -27.231 4.211 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -3.374 -27.568 2.604 1.00 10.00 H new ATOM 610 N THR A 40 -2.267 -22.929 -1.393 1.00 10.00 N ATOM 611 CA THR A 40 -3.352 -22.876 -2.376 1.00 10.00 C ATOM 612 C THR A 40 -4.468 -23.838 -1.956 1.00 10.00 C ATOM 613 O THR A 40 -4.317 -24.618 -1.009 1.00 10.00 O ATOM 614 CB THR A 40 -2.852 -23.266 -3.782 1.00 10.00 C ATOM 615 OG1 THR A 40 -2.434 -24.614 -3.796 1.00 10.00 O ATOM 616 CG2 THR A 40 -1.677 -22.416 -4.259 1.00 10.00 C ATOM 0 H THR A 40 -1.444 -23.427 -1.731 1.00 10.00 H new ATOM 0 HA THR A 40 -3.727 -21.853 -2.413 1.00 10.00 H new ATOM 0 HB THR A 40 -3.696 -23.101 -4.452 1.00 10.00 H new ATOM 0 HG1 THR A 40 -3.141 -25.172 -4.183 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.373 -22.741 -5.254 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.977 -21.369 -4.295 1.00 10.00 H new ATOM 0 HG23 THR A 40 -0.841 -22.531 -3.569 1.00 10.00 H new ATOM 624 N GLY A 41 -5.578 -23.828 -2.695 1.00 10.00 N ATOM 625 CA GLY A 41 -6.705 -24.710 -2.416 1.00 10.00 C ATOM 626 C GLY A 41 -7.751 -24.029 -1.543 1.00 10.00 C ATOM 627 O GLY A 41 -7.599 -22.883 -1.125 1.00 10.00 O ATOM 0 H GLY A 41 -5.718 -23.213 -3.496 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.163 -25.024 -3.354 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.347 -25.612 -1.919 1.00 10.00 H new ATOM 631 N GLN A 42 -8.800 -24.796 -1.245 1.00 10.00 N ATOM 632 CA GLN A 42 -9.988 -24.394 -0.488 1.00 10.00 C ATOM 633 C GLN A 42 -10.856 -23.324 -1.174 1.00 10.00 C ATOM 634 O GLN A 42 -10.502 -22.760 -2.207 1.00 10.00 O ATOM 635 CB GLN A 42 -9.635 -23.978 0.947 1.00 10.00 C ATOM 636 CG GLN A 42 -8.692 -24.939 1.678 1.00 10.00 C ATOM 637 CD GLN A 42 -8.775 -24.663 3.172 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.677 -23.525 3.608 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.902 -25.674 4.007 1.00 10.00 N ATOM 0 H GLN A 42 -8.847 -25.771 -1.542 1.00 10.00 H new ATOM 0 HA GLN A 42 -10.606 -25.291 -0.452 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -9.177 -22.989 0.922 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -10.557 -23.887 1.522 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.969 -25.972 1.469 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.669 -24.806 1.326 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -8.984 -26.625 3.648 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -8.918 -25.506 5.013 1.00 10.00 H new ATOM 648 N ALA A 43 -12.058 -23.178 -0.612 1.00 10.00 N ATOM 649 CA ALA A 43 -13.263 -22.468 -1.009 1.00 10.00 C ATOM 650 C ALA A 43 -14.395 -23.078 -0.150 1.00 10.00 C ATOM 651 O ALA A 43 -14.215 -24.163 0.415 1.00 10.00 O ATOM 652 CB ALA A 43 -13.553 -22.679 -2.502 1.00 10.00 C ATOM 0 H ALA A 43 -12.226 -23.637 0.283 1.00 10.00 H new ATOM 0 HA ALA A 43 -13.166 -21.393 -0.857 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -14.459 -22.139 -2.777 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -12.715 -22.306 -3.092 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -13.691 -23.742 -2.699 1.00 10.00 H new ATOM 658 N PRO A 44 -15.585 -22.466 -0.097 1.00 10.00 N ATOM 659 CA PRO A 44 -16.839 -23.199 0.042 1.00 10.00 C ATOM 660 C PRO A 44 -17.248 -23.763 -1.343 1.00 10.00 C ATOM 661 O PRO A 44 -16.389 -24.147 -2.131 1.00 10.00 O ATOM 662 CB PRO A 44 -17.790 -22.170 0.646 1.00 10.00 C ATOM 663 CG PRO A 44 -17.337 -20.895 -0.049 1.00 10.00 C ATOM 664 CD PRO A 44 -15.833 -21.048 -0.260 1.00 10.00 C ATOM 0 HA PRO A 44 -16.809 -24.079 0.684 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -18.834 -22.403 0.436 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -17.690 -22.105 1.729 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -17.854 -20.763 -1.000 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -17.559 -20.018 0.559 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -15.534 -20.704 -1.250 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -15.269 -20.461 0.465 1.00 10.00 H new ATOM 672 N GLY A 45 -18.542 -23.803 -1.691 1.00 10.00 N ATOM 673 CA GLY A 45 -19.062 -24.328 -2.969 1.00 10.00 C ATOM 674 C GLY A 45 -18.689 -23.563 -4.257 1.00 10.00 C ATOM 675 O GLY A 45 -19.373 -23.720 -5.265 1.00 10.00 O ATOM 0 H GLY A 45 -19.280 -23.462 -1.075 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -18.716 -25.356 -3.076 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -20.149 -24.363 -2.901 1.00 10.00 H new ATOM 679 N PHE A 46 -17.646 -22.727 -4.246 1.00 10.00 N ATOM 680 CA PHE A 46 -17.128 -22.008 -5.416 1.00 10.00 C ATOM 681 C PHE A 46 -16.293 -22.945 -6.312 1.00 10.00 C ATOM 682 O PHE A 46 -15.170 -23.314 -5.971 1.00 10.00 O ATOM 683 CB PHE A 46 -16.346 -20.763 -4.953 1.00 10.00 C ATOM 684 CG PHE A 46 -15.375 -20.196 -5.972 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.846 -19.509 -7.103 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.995 -20.409 -5.816 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.937 -19.068 -8.082 1.00 10.00 C ATOM 688 CE2 PHE A 46 -13.087 -19.941 -6.780 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.560 -19.287 -7.924 1.00 10.00 C ATOM 0 H PHE A 46 -17.121 -22.525 -3.395 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.958 -21.662 -6.032 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -17.060 -19.985 -4.682 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -15.793 -21.016 -4.049 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.903 -19.320 -7.221 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -13.629 -20.937 -4.948 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.301 -18.557 -8.961 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -12.026 -20.085 -6.639 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.868 -18.952 -8.682 1.00 10.00 H new ATOM 699 N THR A 47 -16.857 -23.339 -7.461 1.00 10.00 N ATOM 700 CA THR A 47 -16.182 -24.115 -8.513 1.00 10.00 C ATOM 701 C THR A 47 -15.043 -23.314 -9.163 1.00 10.00 C ATOM 702 O THR A 47 -15.203 -22.133 -9.460 1.00 10.00 O ATOM 703 CB THR A 47 -17.195 -24.526 -9.598 1.00 10.00 C ATOM 704 OG1 THR A 47 -18.362 -25.056 -9.009 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.643 -25.598 -10.541 1.00 10.00 C ATOM 0 H THR A 47 -17.826 -23.120 -7.693 1.00 10.00 H new ATOM 0 HA THR A 47 -15.756 -25.002 -8.045 1.00 10.00 H new ATOM 0 HB THR A 47 -17.409 -23.620 -10.165 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.996 -25.311 -9.711 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.398 -25.851 -11.286 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.752 -25.219 -11.041 1.00 10.00 H new ATOM 0 HG23 THR A 47 -16.386 -26.489 -9.968 1.00 10.00 H new ATOM 713 N TYR A 48 -13.908 -23.973 -9.425 1.00 10.00 N ATOM 714 CA TYR A 48 -12.675 -23.373 -9.946 1.00 10.00 C ATOM 715 C TYR A 48 -11.880 -24.349 -10.835 1.00 10.00 C ATOM 716 O TYR A 48 -12.296 -25.493 -11.023 1.00 10.00 O ATOM 717 CB TYR A 48 -11.852 -22.875 -8.751 1.00 10.00 C ATOM 718 CG TYR A 48 -11.611 -23.822 -7.579 1.00 10.00 C ATOM 719 CD1 TYR A 48 -11.234 -25.174 -7.749 1.00 10.00 C ATOM 720 CD2 TYR A 48 -11.687 -23.298 -6.278 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.868 -25.962 -6.640 1.00 10.00 C ATOM 722 CE2 TYR A 48 -11.338 -24.081 -5.169 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.897 -25.406 -5.345 1.00 10.00 C ATOM 724 OH TYR A 48 -10.431 -26.100 -4.274 1.00 10.00 O ATOM 0 H TYR A 48 -13.820 -24.978 -9.274 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.922 -22.535 -10.597 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.878 -22.562 -9.128 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -12.344 -21.984 -8.360 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -11.227 -25.607 -8.738 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -12.018 -22.281 -6.131 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.566 -26.989 -6.782 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -11.408 -23.666 -4.175 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.531 -25.557 -3.464 1.00 10.00 H new ATOM 734 N THR A 49 -10.720 -23.925 -11.355 1.00 10.00 N ATOM 735 CA THR A 49 -9.745 -24.827 -11.998 1.00 10.00 C ATOM 736 C THR A 49 -9.028 -25.720 -10.970 1.00 10.00 C ATOM 737 O THR A 49 -9.004 -25.413 -9.778 1.00 10.00 O ATOM 738 CB THR A 49 -8.674 -24.030 -12.765 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.880 -23.317 -11.850 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.250 -23.038 -13.779 1.00 10.00 C ATOM 0 H THR A 49 -10.428 -22.948 -11.343 1.00 10.00 H new ATOM 0 HA THR A 49 -10.315 -25.451 -12.687 1.00 10.00 H new ATOM 0 HB THR A 49 -8.092 -24.762 -13.324 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.073 -22.992 -12.301 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.435 -22.515 -14.279 1.00 10.00 H new ATOM 0 HG22 THR A 49 -9.843 -23.576 -14.518 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.882 -22.316 -13.263 1.00 10.00 H new ATOM 748 N ASP A 50 -8.366 -26.789 -11.424 1.00 10.00 N ATOM 749 CA ASP A 50 -7.375 -27.516 -10.623 1.00 10.00 C ATOM 750 C ASP A 50 -6.054 -26.703 -10.554 1.00 10.00 C ATOM 751 O ASP A 50 -6.036 -25.626 -9.952 1.00 10.00 O ATOM 752 CB ASP A 50 -7.247 -28.940 -11.195 1.00 10.00 C ATOM 753 CG ASP A 50 -6.287 -29.796 -10.370 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.663 -30.203 -9.254 1.00 10.00 O ATOM 755 OD2 ASP A 50 -5.131 -29.959 -10.828 1.00 10.00 O ATOM 0 H ASP A 50 -8.502 -27.175 -12.358 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.683 -27.628 -9.583 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -8.229 -29.413 -11.217 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -6.895 -28.888 -12.225 1.00 10.00 H new ATOM 760 N ALA A 51 -4.977 -27.189 -11.194 1.00 10.00 N ATOM 761 CA ALA A 51 -3.689 -26.557 -11.486 1.00 10.00 C ATOM 762 C ALA A 51 -3.167 -25.607 -10.394 1.00 10.00 C ATOM 763 O ALA A 51 -2.443 -26.054 -9.511 1.00 10.00 O ATOM 764 CB ALA A 51 -3.756 -25.925 -12.880 1.00 10.00 C ATOM 0 H ALA A 51 -4.995 -28.142 -11.558 1.00 10.00 H new ATOM 0 HA ALA A 51 -2.927 -27.337 -11.485 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.802 -25.450 -13.110 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.965 -26.697 -13.620 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.548 -25.177 -12.903 1.00 10.00 H new ATOM 770 N ASN A 52 -3.542 -24.324 -10.411 1.00 10.00 N ATOM 771 CA ASN A 52 -3.292 -23.357 -9.340 1.00 10.00 C ATOM 772 C ASN A 52 -3.616 -23.917 -7.947 1.00 10.00 C ATOM 773 O ASN A 52 -2.736 -23.960 -7.088 1.00 10.00 O ATOM 774 CB ASN A 52 -4.129 -22.110 -9.678 1.00 10.00 C ATOM 775 CG ASN A 52 -4.045 -20.973 -8.662 1.00 10.00 C ATOM 776 OD1 ASN A 52 -4.080 -21.163 -7.459 1.00 10.00 O ATOM 777 ND2 ASN A 52 -3.984 -19.746 -9.122 1.00 10.00 N ATOM 0 H ASN A 52 -4.046 -23.917 -11.199 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.231 -23.111 -9.290 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.811 -21.731 -10.649 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -5.172 -22.409 -9.779 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -3.966 -18.959 -8.474 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -3.954 -19.579 -10.128 1.00 10.00 H new ATOM 784 N LYS A 53 -4.855 -24.373 -7.728 1.00 10.00 N ATOM 785 CA LYS A 53 -5.317 -24.847 -6.420 1.00 10.00 C ATOM 786 C LYS A 53 -4.534 -26.087 -5.969 1.00 10.00 C ATOM 787 O LYS A 53 -4.196 -26.188 -4.791 1.00 10.00 O ATOM 788 CB LYS A 53 -6.842 -25.048 -6.432 1.00 10.00 C ATOM 789 CG LYS A 53 -7.582 -23.807 -5.890 1.00 10.00 C ATOM 790 CD LYS A 53 -7.453 -22.485 -6.654 1.00 10.00 C ATOM 791 CE LYS A 53 -8.398 -22.395 -7.849 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.874 -23.066 -9.055 1.00 10.00 N ATOM 0 H LYS A 53 -5.567 -24.423 -8.456 1.00 10.00 H new ATOM 0 HA LYS A 53 -5.111 -24.084 -5.669 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -7.174 -25.255 -7.449 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -7.100 -25.919 -5.829 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.642 -24.053 -5.831 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.237 -23.635 -4.870 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.655 -21.657 -5.974 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.426 -22.370 -7.000 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -9.356 -22.840 -7.581 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.586 -21.346 -8.077 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.314 -22.652 -9.901 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.843 -22.938 -9.103 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -8.095 -24.081 -9.011 1.00 10.00 H new ATOM 806 N ASN A 54 -4.175 -26.953 -6.920 1.00 10.00 N ATOM 807 CA ASN A 54 -3.306 -28.123 -6.782 1.00 10.00 C ATOM 808 C ASN A 54 -1.838 -27.763 -6.446 1.00 10.00 C ATOM 809 O ASN A 54 -1.228 -28.391 -5.584 1.00 10.00 O ATOM 810 CB ASN A 54 -3.439 -28.909 -8.103 1.00 10.00 C ATOM 811 CG ASN A 54 -3.038 -30.375 -8.044 1.00 10.00 C ATOM 812 OD1 ASN A 54 -2.268 -30.816 -7.209 1.00 10.00 O ATOM 813 ND2 ASN A 54 -3.550 -31.166 -8.963 1.00 10.00 N ATOM 0 H ASN A 54 -4.509 -26.846 -7.878 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.617 -28.729 -5.931 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.475 -28.848 -8.437 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.830 -28.415 -8.860 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -3.303 -32.155 -8.979 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -4.194 -30.790 -9.659 1.00 10.00 H new ATOM 820 N LYS A 55 -1.261 -26.748 -7.115 1.00 10.00 N ATOM 821 CA LYS A 55 0.178 -26.420 -7.122 1.00 10.00 C ATOM 822 C LYS A 55 0.801 -26.123 -5.757 1.00 10.00 C ATOM 823 O LYS A 55 2.023 -26.248 -5.655 1.00 10.00 O ATOM 824 CB LYS A 55 0.457 -25.258 -8.096 1.00 10.00 C ATOM 825 CG LYS A 55 0.755 -25.732 -9.528 1.00 10.00 C ATOM 826 CD LYS A 55 2.250 -25.925 -9.846 1.00 10.00 C ATOM 827 CE LYS A 55 2.935 -27.106 -9.137 1.00 10.00 C ATOM 828 NZ LYS A 55 3.585 -26.728 -7.855 1.00 10.00 N ATOM 0 H LYS A 55 -1.807 -26.106 -7.690 1.00 10.00 H new ATOM 0 HA LYS A 55 0.666 -27.335 -7.457 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.404 -24.590 -8.112 1.00 10.00 H new ATOM 0 HB3 LYS A 55 1.303 -24.678 -7.728 1.00 10.00 H new ATOM 0 HG2 LYS A 55 0.237 -26.676 -9.699 1.00 10.00 H new ATOM 0 HG3 LYS A 55 0.339 -25.009 -10.229 1.00 10.00 H new ATOM 0 HD2 LYS A 55 2.360 -26.058 -10.922 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.780 -25.010 -9.582 1.00 10.00 H new ATOM 0 HE2 LYS A 55 2.196 -27.884 -8.945 1.00 10.00 H new ATOM 0 HE3 LYS A 55 3.684 -27.535 -9.803 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 4.258 -27.470 -7.575 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 4.092 -25.828 -7.975 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 2.860 -26.621 -7.117 1.00 10.00 H new ATOM 842 N GLY A 56 0.025 -25.740 -4.745 1.00 10.00 N ATOM 843 CA GLY A 56 0.410 -25.838 -3.331 1.00 10.00 C ATOM 844 C GLY A 56 1.292 -24.710 -2.790 1.00 10.00 C ATOM 845 O GLY A 56 1.527 -24.672 -1.583 1.00 10.00 O ATOM 0 H GLY A 56 -0.906 -25.346 -4.883 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.499 -25.880 -2.731 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.933 -26.783 -3.183 1.00 10.00 H new ATOM 849 N ILE A 57 1.778 -23.807 -3.651 1.00 10.00 N ATOM 850 CA ILE A 57 2.683 -22.712 -3.285 1.00 10.00 C ATOM 851 C ILE A 57 2.087 -21.816 -2.188 1.00 10.00 C ATOM 852 O ILE A 57 0.885 -21.556 -2.145 1.00 10.00 O ATOM 853 CB ILE A 57 3.176 -21.924 -4.532 1.00 10.00 C ATOM 854 CG1 ILE A 57 2.119 -21.493 -5.580 1.00 10.00 C ATOM 855 CG2 ILE A 57 4.224 -22.787 -5.259 1.00 10.00 C ATOM 856 CD1 ILE A 57 1.263 -20.289 -5.181 1.00 10.00 C ATOM 0 H ILE A 57 1.547 -23.818 -4.644 1.00 10.00 H new ATOM 0 HA ILE A 57 3.576 -23.158 -2.847 1.00 10.00 H new ATOM 0 HB ILE A 57 3.554 -20.988 -4.121 1.00 10.00 H new ATOM 0 HG12 ILE A 57 2.630 -21.262 -6.515 1.00 10.00 H new ATOM 0 HG13 ILE A 57 1.460 -22.338 -5.777 1.00 10.00 H new ATOM 0 HG21 ILE A 57 4.586 -22.255 -6.139 1.00 10.00 H new ATOM 0 HG22 ILE A 57 5.059 -22.988 -4.588 1.00 10.00 H new ATOM 0 HG23 ILE A 57 3.770 -23.729 -5.566 1.00 10.00 H new ATOM 0 HD11 ILE A 57 0.555 -20.066 -5.979 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.718 -20.518 -4.265 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.906 -19.425 -5.014 1.00 10.00 H new ATOM 868 N THR A 58 2.935 -21.363 -1.262 1.00 10.00 N ATOM 869 CA THR A 58 2.508 -20.531 -0.137 1.00 10.00 C ATOM 870 C THR A 58 2.056 -19.163 -0.641 1.00 10.00 C ATOM 871 O THR A 58 2.852 -18.416 -1.214 1.00 10.00 O ATOM 872 CB THR A 58 3.638 -20.364 0.890 1.00 10.00 C ATOM 873 OG1 THR A 58 4.205 -21.616 1.199 1.00 10.00 O ATOM 874 CG2 THR A 58 3.124 -19.761 2.198 1.00 10.00 C ATOM 0 H THR A 58 3.935 -21.563 -1.272 1.00 10.00 H new ATOM 0 HA THR A 58 1.673 -21.029 0.355 1.00 10.00 H new ATOM 0 HB THR A 58 4.376 -19.699 0.442 1.00 10.00 H new ATOM 0 HG1 THR A 58 4.925 -21.497 1.853 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.951 -19.658 2.901 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.690 -18.781 2.001 1.00 10.00 H new ATOM 0 HG23 THR A 58 2.364 -20.415 2.626 1.00 10.00 H new ATOM 882 N TRP A 59 0.786 -18.814 -0.430 1.00 10.00 N ATOM 883 CA TRP A 59 0.284 -17.468 -0.688 1.00 10.00 C ATOM 884 C TRP A 59 0.846 -16.508 0.362 1.00 10.00 C ATOM 885 O TRP A 59 0.547 -16.657 1.549 1.00 10.00 O ATOM 886 CB TRP A 59 -1.245 -17.464 -0.718 1.00 10.00 C ATOM 887 CG TRP A 59 -1.890 -18.044 -1.946 1.00 10.00 C ATOM 888 CD1 TRP A 59 -2.980 -18.849 -1.950 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.538 -17.853 -3.357 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.344 -19.134 -3.251 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.467 -18.586 -4.157 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.537 -17.136 -4.052 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.395 -18.634 -5.558 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.424 -17.211 -5.449 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.348 -17.957 -6.204 1.00 10.00 C ATOM 0 H TRP A 59 0.079 -19.458 -0.076 1.00 10.00 H new ATOM 0 HA TRP A 59 0.619 -17.129 -1.668 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.605 -18.016 0.150 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.586 -16.435 -0.606 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.487 -19.213 -1.069 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.164 -19.684 -3.509 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.154 -16.519 -3.497 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.131 -19.181 -6.128 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.380 -16.691 -5.949 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.252 -18.009 -7.278 1.00 10.00 H new ATOM 906 N LYS A 60 1.698 -15.567 -0.075 1.00 10.00 N ATOM 907 CA LYS A 60 2.536 -14.696 0.766 1.00 10.00 C ATOM 908 C LYS A 60 3.075 -13.484 -0.020 1.00 10.00 C ATOM 909 O LYS A 60 2.772 -13.350 -1.209 1.00 10.00 O ATOM 910 CB LYS A 60 3.653 -15.551 1.400 1.00 10.00 C ATOM 911 CG LYS A 60 4.709 -16.105 0.420 1.00 10.00 C ATOM 912 CD LYS A 60 6.073 -15.417 0.558 1.00 10.00 C ATOM 913 CE LYS A 60 6.761 -15.764 1.884 1.00 10.00 C ATOM 914 NZ LYS A 60 7.763 -14.737 2.240 1.00 10.00 N ATOM 0 H LYS A 60 1.828 -15.384 -1.070 1.00 10.00 H new ATOM 0 HA LYS A 60 1.933 -14.266 1.566 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.163 -14.950 2.153 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.192 -16.390 1.921 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.829 -17.175 0.590 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.348 -15.983 -0.601 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.714 -15.714 -0.272 1.00 10.00 H new ATOM 0 HD3 LYS A 60 5.943 -14.337 0.489 1.00 10.00 H new ATOM 0 HE2 LYS A 60 6.016 -15.842 2.676 1.00 10.00 H new ATOM 0 HE3 LYS A 60 7.244 -16.738 1.804 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 8.468 -15.148 2.885 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 8.238 -14.401 1.378 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.290 -13.938 2.708 1.00 10.00 H new ATOM 928 N GLU A 61 3.850 -12.595 0.626 1.00 10.00 N ATOM 929 CA GLU A 61 4.332 -11.301 0.091 1.00 10.00 C ATOM 930 C GLU A 61 5.391 -11.406 -1.037 1.00 10.00 C ATOM 931 O GLU A 61 6.341 -10.632 -1.094 1.00 10.00 O ATOM 932 CB GLU A 61 4.813 -10.369 1.226 1.00 10.00 C ATOM 933 CG GLU A 61 3.702 -9.987 2.212 1.00 10.00 C ATOM 934 CD GLU A 61 4.086 -8.762 3.050 1.00 10.00 C ATOM 935 OE1 GLU A 61 3.797 -7.633 2.598 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.620 -8.970 4.165 1.00 10.00 O ATOM 0 H GLU A 61 4.174 -12.763 1.578 1.00 10.00 H new ATOM 0 HA GLU A 61 3.459 -10.859 -0.390 1.00 10.00 H new ATOM 0 HB2 GLU A 61 5.620 -10.859 1.771 1.00 10.00 H new ATOM 0 HB3 GLU A 61 5.229 -9.461 0.789 1.00 10.00 H new ATOM 0 HG2 GLU A 61 2.784 -9.779 1.663 1.00 10.00 H new ATOM 0 HG3 GLU A 61 3.495 -10.829 2.872 1.00 10.00 H new ATOM 943 N GLU A 62 5.191 -12.322 -1.988 1.00 10.00 N ATOM 944 CA GLU A 62 6.086 -12.651 -3.103 1.00 10.00 C ATOM 945 C GLU A 62 5.262 -13.369 -4.187 1.00 10.00 C ATOM 946 O GLU A 62 4.997 -12.821 -5.258 1.00 10.00 O ATOM 947 CB GLU A 62 7.224 -13.602 -2.650 1.00 10.00 C ATOM 948 CG GLU A 62 8.247 -13.038 -1.652 1.00 10.00 C ATOM 949 CD GLU A 62 9.234 -14.118 -1.196 1.00 10.00 C ATOM 950 OE1 GLU A 62 10.001 -14.612 -2.048 1.00 10.00 O ATOM 951 OE2 GLU A 62 9.181 -14.462 0.011 1.00 10.00 O ATOM 0 H GLU A 62 4.345 -12.891 -2.001 1.00 10.00 H new ATOM 0 HA GLU A 62 6.530 -11.729 -3.478 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.769 -14.487 -2.205 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.763 -13.932 -3.538 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.793 -12.215 -2.113 1.00 10.00 H new ATOM 0 HG3 GLU A 62 7.726 -12.629 -0.786 1.00 10.00 H new ATOM 958 N THR A 63 4.774 -14.573 -3.874 1.00 10.00 N ATOM 959 CA THR A 63 3.969 -15.440 -4.737 1.00 10.00 C ATOM 960 C THR A 63 2.701 -14.766 -5.226 1.00 10.00 C ATOM 961 O THR A 63 2.342 -14.934 -6.385 1.00 10.00 O ATOM 962 CB THR A 63 3.626 -16.740 -3.988 1.00 10.00 C ATOM 963 OG1 THR A 63 2.876 -16.461 -2.823 1.00 10.00 O ATOM 964 CG2 THR A 63 4.879 -17.495 -3.532 1.00 10.00 C ATOM 0 H THR A 63 4.940 -14.992 -2.959 1.00 10.00 H new ATOM 0 HA THR A 63 4.566 -15.665 -5.621 1.00 10.00 H new ATOM 0 HB THR A 63 3.060 -17.349 -4.693 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.093 -17.118 -2.129 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.585 -18.405 -3.009 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.483 -17.755 -4.401 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.461 -16.863 -2.862 1.00 10.00 H new ATOM 972 N LEU A 64 2.046 -13.970 -4.377 1.00 10.00 N ATOM 973 CA LEU A 64 0.860 -13.211 -4.732 1.00 10.00 C ATOM 974 C LEU A 64 1.172 -11.973 -5.586 1.00 10.00 C ATOM 975 O LEU A 64 0.307 -11.554 -6.345 1.00 10.00 O ATOM 976 CB LEU A 64 0.078 -12.883 -3.446 1.00 10.00 C ATOM 977 CG LEU A 64 -1.433 -13.177 -3.536 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.050 -13.132 -2.136 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.168 -12.158 -4.409 1.00 10.00 C ATOM 0 H LEU A 64 2.336 -13.838 -3.408 1.00 10.00 H new ATOM 0 HA LEU A 64 0.229 -13.822 -5.377 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.500 -13.456 -2.621 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.219 -11.829 -3.207 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.540 -14.165 -3.985 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.118 -13.340 -2.202 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.573 -13.881 -1.504 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.899 -12.143 -1.704 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.229 -12.406 -4.443 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.042 -11.160 -3.989 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.758 -12.181 -5.419 1.00 10.00 H new ATOM 991 N MET A 65 2.394 -11.419 -5.549 1.00 10.00 N ATOM 992 CA MET A 65 2.788 -10.387 -6.515 1.00 10.00 C ATOM 993 C MET A 65 2.925 -11.037 -7.887 1.00 10.00 C ATOM 994 O MET A 65 2.291 -10.578 -8.833 1.00 10.00 O ATOM 995 CB MET A 65 4.095 -9.657 -6.139 1.00 10.00 C ATOM 996 CG MET A 65 3.879 -8.394 -5.291 1.00 10.00 C ATOM 997 SD MET A 65 4.260 -8.512 -3.523 1.00 10.00 S ATOM 998 CE MET A 65 3.097 -9.799 -3.033 1.00 10.00 C ATOM 0 H MET A 65 3.115 -11.665 -4.871 1.00 10.00 H new ATOM 0 HA MET A 65 2.011 -9.623 -6.517 1.00 10.00 H new ATOM 0 HB2 MET A 65 4.740 -10.345 -5.592 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.623 -9.384 -7.053 1.00 10.00 H new ATOM 0 HG2 MET A 65 4.486 -7.594 -5.715 1.00 10.00 H new ATOM 0 HG3 MET A 65 2.837 -8.092 -5.393 1.00 10.00 H new ATOM 0 HE1 MET A 65 2.801 -9.646 -1.995 1.00 10.00 H new ATOM 0 HE2 MET A 65 2.215 -9.755 -3.672 1.00 10.00 H new ATOM 0 HE3 MET A 65 3.571 -10.775 -3.134 1.00 10.00 H new ATOM 1008 N GLU A 66 3.698 -12.130 -7.976 1.00 10.00 N ATOM 1009 CA GLU A 66 3.912 -12.822 -9.254 1.00 10.00 C ATOM 1010 C GLU A 66 2.587 -13.336 -9.806 1.00 10.00 C ATOM 1011 O GLU A 66 2.292 -13.161 -10.986 1.00 10.00 O ATOM 1012 CB GLU A 66 4.879 -14.008 -9.078 1.00 10.00 C ATOM 1013 CG GLU A 66 5.403 -14.599 -10.404 1.00 10.00 C ATOM 1014 CD GLU A 66 5.968 -13.607 -11.433 1.00 10.00 C ATOM 1015 OE1 GLU A 66 6.557 -12.589 -11.017 1.00 10.00 O ATOM 1016 OE2 GLU A 66 5.815 -13.895 -12.649 1.00 10.00 O ATOM 0 H GLU A 66 4.182 -12.551 -7.183 1.00 10.00 H new ATOM 0 HA GLU A 66 4.347 -12.107 -9.953 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.728 -13.684 -8.477 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.374 -14.794 -8.517 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.183 -15.323 -10.168 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.589 -15.149 -10.875 1.00 10.00 H new ATOM 1023 N TYR A 67 1.766 -13.924 -8.927 1.00 10.00 N ATOM 1024 CA TYR A 67 0.439 -14.367 -9.291 1.00 10.00 C ATOM 1025 C TYR A 67 -0.437 -13.211 -9.770 1.00 10.00 C ATOM 1026 O TYR A 67 -0.946 -13.290 -10.880 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.223 -15.092 -8.129 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.684 -15.409 -8.371 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.023 -16.365 -9.343 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.700 -14.717 -7.683 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.369 -16.635 -9.623 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.054 -14.968 -7.981 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.393 -15.932 -8.954 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.693 -16.180 -9.263 1.00 10.00 O ATOM 0 H TYR A 67 2.012 -14.100 -7.953 1.00 10.00 H new ATOM 0 HA TYR A 67 0.547 -15.063 -10.123 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.315 -16.020 -7.936 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.136 -14.480 -7.231 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.245 -16.892 -9.875 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.440 -13.992 -6.925 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.624 -17.386 -10.356 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.831 -14.423 -7.465 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.138 -15.341 -9.504 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.661 -12.156 -8.972 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.638 -11.146 -9.379 1.00 10.00 C ATOM 1046 C LEU A 68 -1.198 -10.319 -10.589 1.00 10.00 C ATOM 1047 O LEU A 68 -2.060 -9.906 -11.364 1.00 10.00 O ATOM 1048 CB LEU A 68 -2.061 -10.260 -8.194 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.586 -10.113 -8.187 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.254 -11.415 -7.729 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -4.066 -8.990 -7.287 1.00 10.00 C ATOM 0 H LEU A 68 -0.199 -11.986 -8.079 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.518 -11.697 -9.712 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.723 -10.702 -7.257 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.591 -9.280 -8.272 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.867 -9.876 -9.213 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.337 -11.289 -7.731 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -3.981 -12.222 -8.409 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -3.919 -11.661 -6.721 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -5.154 -8.934 -7.323 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.746 -9.183 -6.263 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.643 -8.045 -7.627 1.00 10.00 H new ATOM 1063 N GLU A 69 0.111 -10.130 -10.793 1.00 10.00 N ATOM 1064 CA GLU A 69 0.656 -9.485 -11.981 1.00 10.00 C ATOM 1065 C GLU A 69 0.723 -10.385 -13.219 1.00 10.00 C ATOM 1066 O GLU A 69 0.801 -9.880 -14.338 1.00 10.00 O ATOM 1067 CB GLU A 69 2.065 -8.993 -11.647 1.00 10.00 C ATOM 1068 CG GLU A 69 2.074 -7.808 -10.665 1.00 10.00 C ATOM 1069 CD GLU A 69 1.143 -6.669 -11.101 1.00 10.00 C ATOM 1070 OE1 GLU A 69 1.549 -5.868 -11.968 1.00 10.00 O ATOM 1071 OE2 GLU A 69 0.016 -6.609 -10.551 1.00 10.00 O ATOM 0 H GLU A 69 0.825 -10.426 -10.127 1.00 10.00 H new ATOM 0 HA GLU A 69 -0.022 -8.672 -12.240 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.639 -9.815 -11.220 1.00 10.00 H new ATOM 0 HB3 GLU A 69 2.568 -8.698 -12.568 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.775 -8.158 -9.677 1.00 10.00 H new ATOM 0 HG3 GLU A 69 3.091 -7.426 -10.573 1.00 10.00 H new ATOM 1078 N ASN A 70 0.680 -11.708 -13.046 1.00 10.00 N ATOM 1079 CA ASN A 70 0.990 -12.689 -14.089 1.00 10.00 C ATOM 1080 C ASN A 70 0.389 -14.076 -13.739 1.00 10.00 C ATOM 1081 O ASN A 70 1.099 -15.081 -13.644 1.00 10.00 O ATOM 1082 CB ASN A 70 2.535 -12.688 -14.276 1.00 10.00 C ATOM 1083 CG ASN A 70 2.979 -12.208 -15.649 1.00 10.00 C ATOM 1084 OD1 ASN A 70 3.754 -12.870 -16.322 1.00 10.00 O ATOM 1085 ND2 ASN A 70 2.531 -11.054 -16.096 1.00 10.00 N ATOM 0 H ASN A 70 0.423 -12.137 -12.157 1.00 10.00 H new ATOM 0 HA ASN A 70 0.531 -12.428 -15.042 1.00 10.00 H new ATOM 0 HB2 ASN A 70 2.985 -12.051 -13.514 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.914 -13.697 -14.113 1.00 10.00 H new ATOM 0 HD21 ASN A 70 2.831 -10.709 -17.008 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.884 -10.505 -15.531 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.952 -14.174 -13.600 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.599 -15.355 -13.030 1.00 10.00 C ATOM 1094 C PRO A 71 -1.453 -16.566 -13.948 1.00 10.00 C ATOM 1095 O PRO A 71 -0.832 -17.557 -13.572 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.056 -14.953 -12.775 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.307 -13.777 -13.714 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.934 -13.119 -13.834 1.00 10.00 C ATOM 0 HA PRO A 71 -1.132 -15.668 -12.096 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.736 -15.778 -12.985 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.211 -14.668 -11.734 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.679 -14.109 -14.683 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.048 -13.089 -13.307 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -1.800 -12.675 -14.821 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.823 -12.316 -13.106 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.953 -16.445 -15.185 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.949 -17.419 -16.283 1.00 10.00 C ATOM 1108 C LYS A 72 -0.545 -17.645 -16.891 1.00 10.00 C ATOM 1109 O LYS A 72 -0.383 -17.743 -18.106 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.917 -16.917 -17.364 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.366 -16.698 -16.902 1.00 10.00 C ATOM 1112 CD LYS A 72 -5.282 -16.336 -18.086 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.559 -14.832 -18.228 1.00 10.00 C ATOM 1114 NZ LYS A 72 -4.389 -14.083 -18.746 1.00 10.00 N ATOM 0 H LYS A 72 -2.414 -15.580 -15.468 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.263 -18.384 -15.884 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.535 -15.977 -17.762 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.920 -17.633 -18.186 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.736 -17.601 -16.416 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.397 -15.901 -16.159 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.827 -16.699 -19.008 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -6.231 -16.860 -17.971 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -6.406 -14.684 -18.898 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -5.845 -14.426 -17.258 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -4.659 -13.094 -18.919 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -3.619 -14.115 -18.047 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -4.067 -14.514 -19.636 1.00 10.00 H new ATOM 1128 N LYS A 73 0.478 -17.658 -16.038 1.00 10.00 N ATOM 1129 CA LYS A 73 1.913 -17.637 -16.337 1.00 10.00 C ATOM 1130 C LYS A 73 2.677 -18.130 -15.115 1.00 10.00 C ATOM 1131 O LYS A 73 3.514 -19.016 -15.250 1.00 10.00 O ATOM 1132 CB LYS A 73 2.335 -16.196 -16.692 1.00 10.00 C ATOM 1133 CG LYS A 73 3.677 -16.051 -17.439 1.00 10.00 C ATOM 1134 CD LYS A 73 4.961 -16.494 -16.706 1.00 10.00 C ATOM 1135 CE LYS A 73 5.151 -15.960 -15.273 1.00 10.00 C ATOM 1136 NZ LYS A 73 5.601 -14.551 -15.219 1.00 10.00 N ATOM 0 H LYS A 73 0.312 -17.686 -15.032 1.00 10.00 H new ATOM 0 HA LYS A 73 2.135 -18.287 -17.183 1.00 10.00 H new ATOM 0 HB2 LYS A 73 1.551 -15.749 -17.303 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.390 -15.617 -15.770 1.00 10.00 H new ATOM 0 HG2 LYS A 73 3.607 -16.620 -18.366 1.00 10.00 H new ATOM 0 HG3 LYS A 73 3.794 -15.003 -17.716 1.00 10.00 H new ATOM 0 HD2 LYS A 73 4.975 -17.583 -16.669 1.00 10.00 H new ATOM 0 HD3 LYS A 73 5.819 -16.184 -17.303 1.00 10.00 H new ATOM 0 HE2 LYS A 73 4.209 -16.053 -14.732 1.00 10.00 H new ATOM 0 HE3 LYS A 73 5.879 -16.585 -14.755 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 5.918 -14.325 -14.255 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 6.389 -14.412 -15.884 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 4.813 -13.925 -15.480 1.00 10.00 H new ATOM 1150 N TYR A 74 2.380 -17.585 -13.928 1.00 10.00 N ATOM 1151 CA TYR A 74 2.973 -18.067 -12.680 1.00 10.00 C ATOM 1152 C TYR A 74 2.593 -19.527 -12.403 1.00 10.00 C ATOM 1153 O TYR A 74 3.424 -20.318 -11.961 1.00 10.00 O ATOM 1154 CB TYR A 74 2.587 -17.153 -11.516 1.00 10.00 C ATOM 1155 CG TYR A 74 3.262 -17.525 -10.205 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.643 -17.818 -10.152 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.500 -17.584 -9.026 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.245 -18.195 -8.938 1.00 10.00 C ATOM 1159 CE2 TYR A 74 3.107 -17.905 -7.800 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.474 -18.247 -7.761 1.00 10.00 C ATOM 1161 OH TYR A 74 5.044 -18.656 -6.598 1.00 10.00 O ATOM 0 H TYR A 74 1.730 -16.808 -13.809 1.00 10.00 H new ATOM 0 HA TYR A 74 4.057 -18.037 -12.786 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.846 -16.125 -11.770 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.506 -17.186 -11.381 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.240 -17.752 -11.049 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.440 -17.381 -9.062 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.296 -18.444 -8.909 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.527 -17.890 -6.889 1.00 10.00 H new ATOM 0 HH TYR A 74 5.996 -18.423 -6.601 1.00 10.00 H new ATOM 1171 N ILE A 75 1.355 -19.888 -12.748 1.00 10.00 N ATOM 1172 CA ILE A 75 0.855 -21.252 -12.852 1.00 10.00 C ATOM 1173 C ILE A 75 -0.036 -21.358 -14.105 1.00 10.00 C ATOM 1174 O ILE A 75 -0.611 -20.353 -14.529 1.00 10.00 O ATOM 1175 CB ILE A 75 0.087 -21.677 -11.577 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.042 -20.719 -11.126 1.00 10.00 C ATOM 1177 CG2 ILE A 75 1.055 -22.001 -10.425 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -0.667 -19.382 -10.493 1.00 10.00 C ATOM 0 H ILE A 75 0.640 -19.196 -12.973 1.00 10.00 H new ATOM 0 HA ILE A 75 1.698 -21.936 -12.947 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.440 -22.587 -11.865 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -1.663 -20.508 -11.997 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.666 -21.258 -10.413 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.486 -22.296 -9.544 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.714 -22.817 -10.722 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.652 -21.119 -10.193 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.574 -18.834 -10.236 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -0.081 -19.558 -9.591 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.078 -18.797 -11.200 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.190 -22.553 -14.702 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.243 -22.788 -15.685 1.00 10.00 C ATOM 1192 C PRO A 76 -2.616 -22.856 -14.995 1.00 10.00 C ATOM 1193 O PRO A 76 -2.702 -23.056 -13.783 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.862 -24.118 -16.344 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.157 -24.880 -15.222 1.00 10.00 C ATOM 1196 CD PRO A 76 0.556 -23.777 -14.438 1.00 10.00 C ATOM 0 HA PRO A 76 -1.325 -21.989 -16.421 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -1.740 -24.654 -16.704 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.206 -23.968 -17.202 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.867 -25.423 -14.597 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.547 -25.613 -15.615 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.571 -24.003 -13.372 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.593 -23.679 -14.758 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.692 -22.753 -15.781 1.00 10.00 N ATOM 1205 CA GLY A 77 -5.054 -23.039 -15.336 1.00 10.00 C ATOM 1206 C GLY A 77 -5.560 -22.112 -14.230 1.00 10.00 C ATOM 1207 O GLY A 77 -5.850 -22.589 -13.133 1.00 10.00 O ATOM 0 H GLY A 77 -3.638 -22.464 -16.758 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.726 -22.967 -16.191 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -5.100 -24.069 -14.981 1.00 10.00 H new ATOM 1211 N THR A 78 -5.748 -20.822 -14.539 1.00 10.00 N ATOM 1212 CA THR A 78 -6.377 -19.853 -13.621 1.00 10.00 C ATOM 1213 C THR A 78 -7.515 -19.022 -14.210 1.00 10.00 C ATOM 1214 O THR A 78 -8.448 -18.689 -13.480 1.00 10.00 O ATOM 1215 CB THR A 78 -5.318 -18.972 -12.920 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.849 -19.628 -11.766 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.831 -17.611 -12.448 1.00 10.00 C ATOM 0 H THR A 78 -5.469 -20.417 -15.433 1.00 10.00 H new ATOM 0 HA THR A 78 -6.872 -20.471 -12.872 1.00 10.00 H new ATOM 0 HB THR A 78 -4.549 -18.809 -13.675 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.598 -19.789 -11.154 1.00 10.00 H new ATOM 0 HG21 THR A 78 -5.020 -17.063 -11.969 1.00 10.00 H new ATOM 0 HG22 THR A 78 -6.197 -17.043 -13.304 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.643 -17.755 -11.735 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.474 -18.673 -15.502 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.389 -17.717 -16.151 1.00 10.00 C ATOM 1227 C LYS A 79 -8.299 -16.286 -15.587 1.00 10.00 C ATOM 1228 O LYS A 79 -7.931 -15.406 -16.359 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.836 -18.265 -16.237 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.114 -19.023 -17.549 1.00 10.00 C ATOM 1231 CD LYS A 79 -9.436 -20.401 -17.613 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.233 -20.848 -19.066 1.00 10.00 C ATOM 1233 NZ LYS A 79 -8.154 -21.859 -19.166 1.00 10.00 N ATOM 0 H LYS A 79 -6.784 -19.058 -16.147 1.00 10.00 H new ATOM 0 HA LYS A 79 -8.041 -17.616 -17.179 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -10.017 -18.931 -15.393 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.539 -17.437 -16.146 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -11.190 -19.150 -17.666 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -9.772 -18.418 -18.389 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -8.473 -20.360 -17.104 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -10.045 -21.135 -17.085 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -10.162 -21.263 -19.455 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -8.986 -19.985 -19.684 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -8.037 -22.145 -20.159 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -7.263 -21.452 -18.815 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -8.403 -22.691 -18.594 1.00 10.00 H new ATOM 1247 N MET A 80 -8.630 -16.067 -14.302 1.00 10.00 N ATOM 1248 CA MET A 80 -8.762 -14.790 -13.563 1.00 10.00 C ATOM 1249 C MET A 80 -8.721 -13.531 -14.450 1.00 10.00 C ATOM 1250 O MET A 80 -7.657 -12.967 -14.727 1.00 10.00 O ATOM 1251 CB MET A 80 -7.779 -14.701 -12.374 1.00 10.00 C ATOM 1252 CG MET A 80 -7.986 -13.376 -11.623 1.00 10.00 C ATOM 1253 SD MET A 80 -7.143 -13.145 -10.035 1.00 10.00 S ATOM 1254 CE MET A 80 -6.903 -11.356 -10.198 1.00 10.00 C ATOM 0 H MET A 80 -8.833 -16.857 -13.690 1.00 10.00 H new ATOM 0 HA MET A 80 -9.772 -14.807 -13.153 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.936 -15.541 -11.697 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.752 -14.769 -12.734 1.00 10.00 H new ATOM 0 HG2 MET A 80 -7.675 -12.567 -12.285 1.00 10.00 H new ATOM 0 HG3 MET A 80 -9.056 -13.255 -11.452 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.674 -10.929 -9.222 1.00 10.00 H new ATOM 0 HE2 MET A 80 -6.077 -11.161 -10.882 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.813 -10.901 -10.589 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.908 -13.096 -14.886 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.115 -11.973 -15.807 1.00 10.00 C ATOM 1266 C ILE A 81 -9.841 -10.627 -15.104 1.00 10.00 C ATOM 1267 O ILE A 81 -10.755 -9.866 -14.791 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.521 -12.054 -16.460 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.902 -13.468 -16.969 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.646 -11.042 -17.616 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -10.946 -14.085 -18.002 1.00 10.00 C ATOM 0 H ILE A 81 -10.783 -13.532 -14.597 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.394 -12.040 -16.621 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.223 -11.808 -15.663 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -11.963 -14.138 -16.112 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -12.899 -13.420 -17.407 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.639 -11.116 -18.059 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.494 -10.033 -17.234 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.894 -11.260 -18.374 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -11.308 -15.073 -18.288 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -10.901 -13.445 -18.884 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -9.950 -14.175 -17.568 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.553 -10.336 -14.882 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.035 -9.038 -14.433 1.00 10.00 C ATOM 1285 C PHE A 82 -6.519 -8.907 -14.667 1.00 10.00 C ATOM 1286 O PHE A 82 -6.099 -7.915 -15.253 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.347 -8.800 -12.946 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.067 -7.385 -12.482 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -8.671 -6.283 -13.119 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.188 -7.174 -11.412 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.362 -4.974 -12.709 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -6.883 -5.865 -10.992 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.462 -4.766 -11.649 1.00 10.00 C ATOM 0 H PHE A 82 -7.814 -11.026 -15.016 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.540 -8.280 -15.032 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.396 -9.032 -12.763 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.758 -9.493 -12.345 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -9.373 -6.444 -13.924 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.743 -8.018 -10.907 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -8.815 -4.130 -13.207 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.205 -5.706 -10.166 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.216 -3.761 -11.340 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.731 -9.911 -14.245 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.288 -10.083 -14.480 1.00 10.00 C ATOM 1305 C ALA A 83 -3.455 -8.776 -14.514 1.00 10.00 C ATOM 1306 O ALA A 83 -3.079 -8.303 -15.588 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.129 -10.929 -15.753 1.00 10.00 C ATOM 0 H ALA A 83 -6.114 -10.678 -13.692 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.864 -10.595 -13.616 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.069 -11.078 -15.961 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.611 -11.896 -15.610 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.594 -10.413 -16.593 1.00 10.00 H new ATOM 1313 N GLY A 84 -3.143 -8.217 -13.337 1.00 10.00 N ATOM 1314 CA GLY A 84 -2.426 -6.951 -13.167 1.00 10.00 C ATOM 1315 C GLY A 84 -2.995 -6.090 -12.032 1.00 10.00 C ATOM 1316 O GLY A 84 -3.688 -6.577 -11.132 1.00 10.00 O ATOM 0 H GLY A 84 -3.392 -8.651 -12.448 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.375 -7.159 -12.967 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.468 -6.388 -14.099 1.00 10.00 H new ATOM 1320 N ILE A 85 -2.695 -4.786 -12.089 1.00 10.00 N ATOM 1321 CA ILE A 85 -3.462 -3.708 -11.450 1.00 10.00 C ATOM 1322 C ILE A 85 -3.251 -2.388 -12.221 1.00 10.00 C ATOM 1323 O ILE A 85 -2.606 -2.392 -13.267 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.153 -3.634 -9.937 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.315 -2.983 -9.157 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -1.793 -2.987 -9.627 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -4.421 -3.536 -7.734 1.00 10.00 C ATOM 0 H ILE A 85 -1.883 -4.440 -12.600 1.00 10.00 H new ATOM 0 HA ILE A 85 -4.530 -3.919 -11.505 1.00 10.00 H new ATOM 0 HB ILE A 85 -3.065 -4.662 -9.586 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.168 -1.904 -9.118 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.252 -3.158 -9.686 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -1.638 -2.966 -8.548 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -0.999 -3.567 -10.097 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -1.777 -1.969 -10.016 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.250 -3.053 -7.217 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -4.595 -4.611 -7.774 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -3.494 -3.338 -7.197 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.857 -1.282 -11.762 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.987 -0.023 -12.512 1.00 10.00 C ATOM 1341 C LYS A 86 -2.695 0.810 -12.565 1.00 10.00 C ATOM 1342 O LYS A 86 -1.982 0.705 -13.558 1.00 10.00 O ATOM 1343 CB LYS A 86 -5.200 0.768 -12.003 1.00 10.00 C ATOM 1344 CG LYS A 86 -6.536 0.099 -12.365 1.00 10.00 C ATOM 1345 CD LYS A 86 -7.719 0.787 -11.671 1.00 10.00 C ATOM 1346 CE LYS A 86 -7.890 2.237 -12.139 1.00 10.00 C ATOM 1347 NZ LYS A 86 -9.067 2.877 -11.513 1.00 10.00 N ATOM 0 H LYS A 86 -4.281 -1.237 -10.835 1.00 10.00 H new ATOM 0 HA LYS A 86 -4.166 -0.283 -13.555 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -5.132 0.873 -10.920 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -5.176 1.774 -12.423 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -6.679 0.131 -13.445 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -6.507 -0.952 -12.078 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -8.633 0.230 -11.874 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -7.568 0.769 -10.592 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -6.993 2.807 -11.895 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -7.997 2.259 -13.224 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -9.151 3.856 -11.853 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -9.926 2.348 -11.766 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -8.953 2.878 -10.479 1.00 10.00 H new ATOM 1361 N LYS A 87 -2.404 1.688 -11.588 1.00 10.00 N ATOM 1362 CA LYS A 87 -1.214 2.562 -11.654 1.00 10.00 C ATOM 1363 C LYS A 87 0.062 1.790 -11.322 1.00 10.00 C ATOM 1364 O LYS A 87 0.933 1.685 -12.181 1.00 10.00 O ATOM 1365 CB LYS A 87 -1.348 3.847 -10.812 1.00 10.00 C ATOM 1366 CG LYS A 87 -2.163 4.956 -11.511 1.00 10.00 C ATOM 1367 CD LYS A 87 -3.662 4.664 -11.678 1.00 10.00 C ATOM 1368 CE LYS A 87 -4.356 4.553 -10.318 1.00 10.00 C ATOM 1369 NZ LYS A 87 -4.817 5.864 -9.817 1.00 10.00 N ATOM 0 H LYS A 87 -2.970 1.812 -10.749 1.00 10.00 H new ATOM 0 HA LYS A 87 -1.141 2.899 -12.688 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -1.822 3.602 -9.862 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -0.353 4.228 -10.583 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -2.051 5.879 -10.943 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -1.732 5.134 -12.496 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -4.127 5.457 -12.264 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -3.795 3.736 -12.235 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -5.208 3.878 -10.401 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -3.669 4.112 -9.596 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -5.280 5.740 -8.894 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -4.002 6.502 -9.712 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -5.494 6.275 -10.492 1.00 10.00 H new ATOM 1383 N LYS A 88 0.180 1.323 -10.070 1.00 10.00 N ATOM 1384 CA LYS A 88 1.265 0.495 -9.510 1.00 10.00 C ATOM 1385 C LYS A 88 1.096 0.283 -8.007 1.00 10.00 C ATOM 1386 O LYS A 88 0.949 -0.856 -7.584 1.00 10.00 O ATOM 1387 CB LYS A 88 2.684 0.997 -9.861 1.00 10.00 C ATOM 1388 CG LYS A 88 2.967 2.481 -9.559 1.00 10.00 C ATOM 1389 CD LYS A 88 4.152 2.968 -10.398 1.00 10.00 C ATOM 1390 CE LYS A 88 4.408 4.454 -10.143 1.00 10.00 C ATOM 1391 NZ LYS A 88 5.443 4.980 -11.063 1.00 10.00 N ATOM 0 H LYS A 88 -0.532 1.528 -9.369 1.00 10.00 H new ATOM 0 HA LYS A 88 1.172 -0.474 -10.000 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.408 0.391 -9.316 1.00 10.00 H new ATOM 0 HB3 LYS A 88 2.858 0.823 -10.923 1.00 10.00 H new ATOM 0 HG2 LYS A 88 2.084 3.081 -9.779 1.00 10.00 H new ATOM 0 HG3 LYS A 88 3.184 2.610 -8.499 1.00 10.00 H new ATOM 0 HD2 LYS A 88 5.043 2.391 -10.151 1.00 10.00 H new ATOM 0 HD3 LYS A 88 3.949 2.803 -11.456 1.00 10.00 H new ATOM 0 HE2 LYS A 88 3.482 5.014 -10.274 1.00 10.00 H new ATOM 0 HE3 LYS A 88 4.726 4.600 -9.111 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 5.598 5.990 -10.870 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 6.332 4.459 -10.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 5.126 4.860 -12.046 1.00 10.00 H new ATOM 1405 N THR A 89 1.110 1.353 -7.203 1.00 10.00 N ATOM 1406 CA THR A 89 1.102 1.281 -5.728 1.00 10.00 C ATOM 1407 C THR A 89 -0.117 0.561 -5.143 1.00 10.00 C ATOM 1408 O THR A 89 -0.001 -0.030 -4.070 1.00 10.00 O ATOM 1409 CB THR A 89 1.351 2.679 -5.125 1.00 10.00 C ATOM 1410 OG1 THR A 89 2.725 2.938 -5.324 1.00 10.00 O ATOM 1411 CG2 THR A 89 1.049 2.891 -3.634 1.00 10.00 C ATOM 0 H THR A 89 1.127 2.309 -7.559 1.00 10.00 H new ATOM 0 HA THR A 89 1.932 0.641 -5.430 1.00 10.00 H new ATOM 0 HB THR A 89 0.649 3.346 -5.626 1.00 10.00 H new ATOM 0 HG1 THR A 89 3.249 2.457 -4.650 1.00 10.00 H new ATOM 0 HG21 THR A 89 1.274 3.922 -3.360 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.005 2.687 -3.444 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.663 2.215 -3.039 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.222 0.443 -5.888 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.346 -0.425 -5.532 1.00 10.00 C ATOM 1421 C GLU A 90 -1.918 -1.896 -5.333 1.00 10.00 C ATOM 1422 O GLU A 90 -2.545 -2.618 -4.555 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.435 -0.347 -6.615 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.887 1.069 -7.000 1.00 10.00 C ATOM 1425 CD GLU A 90 -3.181 1.555 -8.275 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -1.930 1.516 -8.321 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -3.880 1.944 -9.238 1.00 10.00 O ATOM 0 H GLU A 90 -1.361 0.952 -6.761 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.737 -0.066 -4.580 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -3.068 -0.848 -7.511 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.305 -0.906 -6.271 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.966 1.079 -7.153 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -3.675 1.756 -6.181 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.829 -2.332 -5.999 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.191 -3.640 -5.806 1.00 10.00 C ATOM 1436 C ARG A 91 0.283 -3.805 -4.374 1.00 10.00 C ATOM 1437 O ARG A 91 -0.017 -4.818 -3.748 1.00 10.00 O ATOM 1438 CB ARG A 91 0.984 -3.836 -6.795 1.00 10.00 C ATOM 1439 CG ARG A 91 1.762 -5.170 -6.704 1.00 10.00 C ATOM 1440 CD ARG A 91 1.059 -6.358 -7.371 1.00 10.00 C ATOM 1441 NE ARG A 91 -0.211 -6.680 -6.707 1.00 10.00 N ATOM 1442 CZ ARG A 91 -1.424 -6.594 -7.230 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.675 -6.553 -8.521 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -2.424 -6.501 -6.390 1.00 10.00 N ATOM 0 H ARG A 91 -0.360 -1.764 -6.705 1.00 10.00 H new ATOM 0 HA ARG A 91 -0.937 -4.408 -6.009 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.594 -3.740 -7.808 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.691 -3.020 -6.647 1.00 10.00 H new ATOM 0 HG2 ARG A 91 2.741 -5.038 -7.164 1.00 10.00 H new ATOM 0 HG3 ARG A 91 1.932 -5.407 -5.654 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.873 -6.129 -8.420 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.714 -7.229 -7.346 1.00 10.00 H new ATOM 0 HE ARG A 91 -0.152 -7.004 -5.742 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -0.907 -6.588 -9.191 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -2.638 -6.486 -8.852 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -2.248 -6.497 -5.385 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -3.380 -6.432 -6.740 1.00 10.00 H new ATOM 1458 N GLU A 92 1.012 -2.809 -3.875 1.00 10.00 N ATOM 1459 CA GLU A 92 1.510 -2.740 -2.507 1.00 10.00 C ATOM 1460 C GLU A 92 0.342 -2.693 -1.521 1.00 10.00 C ATOM 1461 O GLU A 92 0.338 -3.432 -0.541 1.00 10.00 O ATOM 1462 CB GLU A 92 2.344 -1.469 -2.287 1.00 10.00 C ATOM 1463 CG GLU A 92 3.352 -1.031 -3.356 1.00 10.00 C ATOM 1464 CD GLU A 92 3.703 0.451 -3.138 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.700 0.897 -1.963 1.00 10.00 O ATOM 1466 OE2 GLU A 92 3.871 1.160 -4.158 1.00 10.00 O ATOM 0 H GLU A 92 1.281 -1.999 -4.434 1.00 10.00 H new ATOM 0 HA GLU A 92 2.124 -3.625 -2.343 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.648 -0.644 -2.137 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.893 -1.596 -1.354 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.252 -1.643 -3.298 1.00 10.00 H new ATOM 0 HG3 GLU A 92 2.932 -1.176 -4.351 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.635 -1.813 -1.781 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.744 -1.519 -0.880 1.00 10.00 C ATOM 1475 C ASP A 93 -2.581 -2.766 -0.584 1.00 10.00 C ATOM 1476 O ASP A 93 -2.821 -3.080 0.578 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.609 -0.398 -1.471 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.879 0.929 -1.657 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.965 1.207 -0.848 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.272 1.678 -2.577 1.00 10.00 O ATOM 0 H ASP A 93 -0.671 -1.276 -2.647 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.332 -1.183 0.072 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.996 -0.725 -2.436 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.469 -0.238 -0.821 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.976 -3.523 -1.615 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.658 -4.811 -1.432 1.00 10.00 C ATOM 1487 C LEU A 94 -2.879 -5.783 -0.555 1.00 10.00 C ATOM 1488 O LEU A 94 -3.445 -6.377 0.361 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.896 -5.465 -2.805 1.00 10.00 C ATOM 1490 CG LEU A 94 -5.287 -5.240 -3.405 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.779 -3.806 -3.326 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.223 -5.617 -4.880 1.00 10.00 C ATOM 0 H LEU A 94 -2.834 -3.264 -2.591 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.600 -4.598 -0.926 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.151 -5.085 -3.504 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.728 -6.538 -2.712 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.980 -5.849 -2.825 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.771 -3.736 -3.773 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.829 -3.495 -2.282 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.091 -3.155 -3.866 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.201 -5.467 -5.337 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.487 -4.990 -5.384 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.934 -6.664 -4.976 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.596 -5.963 -0.864 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.725 -6.888 -0.152 1.00 10.00 C ATOM 1506 C ILE A 95 -0.592 -6.449 1.315 1.00 10.00 C ATOM 1507 O ILE A 95 -0.791 -7.267 2.212 1.00 10.00 O ATOM 1508 CB ILE A 95 0.608 -7.002 -0.920 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.399 -7.635 -2.319 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.672 -7.763 -0.120 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -0.151 -9.064 -2.371 1.00 10.00 C ATOM 0 H ILE A 95 -1.131 -5.465 -1.623 1.00 10.00 H new ATOM 0 HA ILE A 95 -1.144 -7.894 -0.114 1.00 10.00 H new ATOM 0 HB ILE A 95 0.980 -5.988 -1.063 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -0.278 -6.993 -2.882 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.356 -7.623 -2.840 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.593 -7.818 -0.700 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.864 -7.241 0.818 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.316 -8.771 0.092 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -0.247 -9.379 -3.410 1.00 10.00 H new ATOM 0 HD12 ILE A 95 0.531 -9.735 -1.849 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -1.129 -9.095 -1.891 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.365 -5.151 1.556 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.322 -4.544 2.885 1.00 10.00 C ATOM 1525 C ALA A 96 -1.637 -4.737 3.655 1.00 10.00 C ATOM 1526 O ALA A 96 -1.614 -5.157 4.815 1.00 10.00 O ATOM 1527 CB ALA A 96 0.039 -3.058 2.740 1.00 10.00 C ATOM 0 H ALA A 96 -0.202 -4.478 0.807 1.00 10.00 H new ATOM 0 HA ALA A 96 0.444 -5.046 3.476 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.074 -2.594 3.726 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.014 -2.965 2.261 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.714 -2.558 2.131 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.781 -4.479 3.007 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.108 -4.736 3.563 1.00 10.00 C ATOM 1535 C TYR A 97 -4.262 -6.198 3.976 1.00 10.00 C ATOM 1536 O TYR A 97 -4.503 -6.475 5.148 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.197 -4.288 2.572 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.508 -5.058 2.598 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.246 -5.213 3.790 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.970 -5.660 1.414 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.452 -5.948 3.781 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.146 -6.425 1.420 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.906 -6.553 2.595 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.068 -7.259 2.590 1.00 10.00 O ATOM 0 H TYR A 97 -2.806 -4.080 2.069 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.228 -4.145 4.471 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.417 -3.237 2.761 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.786 -4.351 1.564 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -6.889 -4.770 4.708 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.417 -5.533 0.495 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.028 -6.046 4.689 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.469 -6.919 0.516 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.234 -7.609 1.690 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.120 -7.132 3.035 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.381 -8.546 3.285 1.00 10.00 C ATOM 1556 C LEU A 98 -3.413 -9.141 4.316 1.00 10.00 C ATOM 1557 O LEU A 98 -3.850 -9.902 5.181 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.332 -9.304 1.957 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.465 -8.919 0.987 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.073 -9.269 -0.446 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.779 -9.615 1.356 1.00 10.00 C ATOM 0 H LEU A 98 -3.822 -6.928 2.081 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.376 -8.647 3.719 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.373 -9.115 1.475 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.384 -10.374 2.157 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.620 -7.843 1.066 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.882 -8.992 -1.122 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.169 -8.725 -0.719 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.888 -10.341 -0.521 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.557 -9.321 0.651 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.642 -10.696 1.315 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -7.074 -9.324 2.364 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.130 -8.738 4.292 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.110 -9.176 5.260 1.00 10.00 C ATOM 1575 C LYS A 99 -1.439 -8.762 6.701 1.00 10.00 C ATOM 1576 O LYS A 99 -1.022 -9.444 7.639 1.00 10.00 O ATOM 1577 CB LYS A 99 0.272 -8.668 4.801 1.00 10.00 C ATOM 1578 CG LYS A 99 1.463 -9.060 5.693 1.00 10.00 C ATOM 1579 CD LYS A 99 1.698 -10.576 5.787 1.00 10.00 C ATOM 1580 CE LYS A 99 2.898 -10.917 6.682 1.00 10.00 C ATOM 1581 NZ LYS A 99 4.191 -10.837 5.962 1.00 10.00 N ATOM 0 H LYS A 99 -1.769 -8.091 3.591 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.097 -10.266 5.280 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.459 -9.042 3.794 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.234 -7.581 4.736 1.00 10.00 H new ATOM 0 HG2 LYS A 99 2.365 -8.586 5.307 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.299 -8.665 6.696 1.00 10.00 H new ATOM 0 HD2 LYS A 99 0.803 -11.058 6.181 1.00 10.00 H new ATOM 0 HD3 LYS A 99 1.864 -10.980 4.788 1.00 10.00 H new ATOM 0 HE2 LYS A 99 2.917 -10.235 7.532 1.00 10.00 H new ATOM 0 HE3 LYS A 99 2.772 -11.923 7.083 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.972 -10.960 6.637 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 4.235 -11.586 5.242 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 4.275 -9.909 5.501 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.238 -7.702 6.879 1.00 10.00 N ATOM 1596 CA LYS A 100 -2.904 -7.336 8.138 1.00 10.00 C ATOM 1597 C LYS A 100 -4.227 -8.085 8.323 1.00 10.00 C ATOM 1598 O LYS A 100 -4.346 -8.823 9.299 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.096 -5.809 8.202 1.00 10.00 C ATOM 1600 CG LYS A 100 -1.831 -5.090 8.711 1.00 10.00 C ATOM 1601 CD LYS A 100 -2.004 -4.527 10.131 1.00 10.00 C ATOM 1602 CE LYS A 100 -2.205 -5.631 11.176 1.00 10.00 C ATOM 1603 NZ LYS A 100 -2.618 -5.065 12.478 1.00 10.00 N ATOM 0 H LYS A 100 -2.447 -7.051 6.122 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.264 -7.639 8.967 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.353 -5.434 7.211 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.935 -5.576 8.858 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -0.992 -5.786 8.699 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -1.580 -4.277 8.030 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -1.127 -3.936 10.394 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -2.860 -3.852 10.150 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -2.961 -6.334 10.826 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -1.279 -6.193 11.298 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -2.796 -5.837 13.151 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -1.862 -4.452 12.846 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -3.487 -4.507 12.354 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.181 -7.935 7.399 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.558 -8.428 7.505 1.00 10.00 C ATOM 1619 C ALA A 101 -6.678 -9.933 7.773 1.00 10.00 C ATOM 1620 O ALA A 101 -7.576 -10.375 8.481 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.311 -8.052 6.226 1.00 10.00 C ATOM 0 H ALA A 101 -5.008 -7.447 6.520 1.00 10.00 H new ATOM 0 HA ALA A 101 -6.999 -7.951 8.380 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.338 -8.412 6.289 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.313 -6.968 6.110 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.819 -8.508 5.367 1.00 10.00 H new ATOM 1627 N THR A 102 -5.738 -10.724 7.253 1.00 10.00 N ATOM 1628 CA THR A 102 -5.651 -12.168 7.509 1.00 10.00 C ATOM 1629 C THR A 102 -5.602 -12.519 9.008 1.00 10.00 C ATOM 1630 O THR A 102 -6.103 -13.563 9.415 1.00 10.00 O ATOM 1631 CB THR A 102 -4.444 -12.736 6.749 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.508 -14.132 6.700 1.00 10.00 O ATOM 1633 CG2 THR A 102 -3.086 -12.350 7.339 1.00 10.00 C ATOM 0 H THR A 102 -5.005 -10.378 6.634 1.00 10.00 H new ATOM 0 HA THR A 102 -6.566 -12.633 7.142 1.00 10.00 H new ATOM 0 HB THR A 102 -4.509 -12.294 5.755 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.713 -14.480 6.245 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.290 -12.793 6.741 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.982 -11.265 7.334 1.00 10.00 H new ATOM 0 HG23 THR A 102 -3.017 -12.716 8.363 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.999 -11.645 9.827 1.00 10.00 N ATOM 1642 CA ASN A 103 -4.893 -11.786 11.278 1.00 10.00 C ATOM 1643 C ASN A 103 -6.086 -11.200 12.064 1.00 10.00 C ATOM 1644 O ASN A 103 -6.209 -11.494 13.252 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.598 -11.104 11.771 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.381 -11.286 10.878 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -1.626 -12.240 10.974 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.176 -10.330 9.995 1.00 10.00 N ATOM 0 H ASN A 103 -4.558 -10.793 9.481 1.00 10.00 H new ATOM 0 HA ASN A 103 -4.885 -12.859 11.470 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.790 -10.037 11.881 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.360 -11.489 12.763 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.371 -10.376 9.371 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -2.823 -9.543 9.936 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.868 -10.287 11.463 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.406 -9.114 12.181 1.00 10.00 C ATOM 1657 C GLU A 104 -8.565 -8.435 11.435 1.00 10.00 C ATOM 1658 O GLU A 104 -9.690 -8.497 11.988 1.00 10.00 O ATOM 1659 CB GLU A 104 -6.233 -8.131 12.392 1.00 10.00 C ATOM 1660 CG GLU A 104 -6.553 -6.882 13.226 1.00 10.00 C ATOM 1661 CD GLU A 104 -5.295 -6.008 13.336 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -4.291 -6.452 13.947 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -5.235 -4.913 12.723 1.00 10.00 O ATOM 1664 OXT GLU A 104 -8.314 -7.852 10.361 1.00 10.00 O ATOM 0 H GLU A 104 -7.143 -10.337 10.482 1.00 10.00 H new ATOM 0 HA GLU A 104 -7.827 -9.438 13.133 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.416 -8.668 12.874 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -5.872 -7.810 11.415 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -7.362 -6.318 12.761 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -6.896 -7.172 14.219 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.865 -13.086 -7.927 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.228 -16.396 -7.268 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.736 -12.188 -5.451 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.512 -9.838 -8.588 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.285 -14.019 -10.123 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.649 -14.088 -6.692 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.493 -15.458 -6.559 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.506 -15.777 -5.540 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.112 -14.591 -5.012 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.842 -13.543 -5.716 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.104 -14.408 -3.903 1.00 10.00 C HETATM 1683 CAA HEC A 105 -6.019 -17.158 -5.133 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.041 -18.006 -4.344 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.419 -19.171 -3.570 1.00 10.00 C HETATM 1686 O1A HEC A 105 -5.860 -20.082 -4.223 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.473 -19.118 -2.324 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.309 -11.368 -7.128 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.453 -11.180 -6.073 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.329 -9.764 -5.747 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.084 -9.086 -6.659 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.668 -10.099 -7.524 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.468 -9.216 -4.623 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.282 -7.580 -6.827 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.114 -6.936 -7.575 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.220 -12.137 -8.993 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.287 -10.782 -9.220 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.379 -10.446 -10.107 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.002 -11.614 -10.401 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.180 -12.671 -9.823 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.789 -9.032 -10.464 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.336 -11.803 -11.095 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.306 -11.474 -12.594 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.617 -14.833 -8.533 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.520 -15.022 -9.559 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.561 -16.419 -9.970 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.870 -17.110 -9.030 1.00 10.00 C HETATM 1708 C4D HEC A 105 -9.206 -16.110 -8.203 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.247 -16.982 -11.202 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.670 -18.615 -8.960 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.232 -19.062 -9.313 1.00 10.00 C HETATM 1712 CGD HEC A 105 -8.087 -20.284 -10.218 1.00 10.00 C HETATM 1713 O1D HEC A 105 -9.096 -20.956 -10.533 1.00 10.00 O HETATM 1714 O2D HEC A 105 -6.910 -20.590 -10.506 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.313 -16.761 -11.158 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.819 -16.528 -12.096 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -11.102 -18.062 -11.238 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.071 -8.495 -9.558 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -10.954 -8.521 -10.943 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.637 -9.061 -11.148 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.803 -9.631 -3.672 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.428 -9.493 -4.793 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.554 -8.130 -4.595 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.450 -14.924 -3.008 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.144 -14.822 -4.212 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -4.989 -13.346 -3.688 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.725 -18.224 -9.792 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -7.703 -19.265 -8.382 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.014 -10.433 -12.732 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.586 -12.122 -13.094 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.296 -11.633 -13.021 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.191 -7.100 -7.019 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -7.026 -7.383 -8.565 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.292 -5.865 -7.675 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.570 -17.360 -3.644 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.784 -18.400 -5.038 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.913 -18.960 -7.955 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.370 -19.099 -9.641 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.733 -17.705 -6.031 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.119 -17.045 -4.528 1.00 10.00 H new HETATM 0 HHD HEC A 105 -12.030 -14.312 -10.863 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.567 -8.812 -8.951 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.023 -11.888 -4.683 1.00 10.00 H new HETATM 0 HHA HEC A 105 -8.017 -17.447 -7.072 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.902 -21.446 -10.983 1.00 10.00 H new HETATM 0 H2A HEC A 105 -5.567 -19.037 -1.960 1.00 10.00 H new