USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 739 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 70 GLN :FLIP amide:sc= 0.235 F(o=-1.1,f=0.57) USER MOD Set 1.2: A 97 THR OG1 : rot 23:sc= 0.34 USER MOD Set 2.1: A 61 LYS NZ :NH3+ 161:sc= -0.954 (180deg=-1.98!) USER MOD Set 2.2: A 96 THR OG1 : rot -3:sc= 0.209 USER MOD Set 3.1: A 17 SER OG : rot -74:sc= -0.279 USER MOD Set 3.2: A 20 GLN : amide:sc= -0.242 K(o=-0.52,f=-4.1!) USER MOD Set 4.1: A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -111:sc= 0.0616 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -167:sc= -0.0201 (180deg=-0.191) USER MOD Single : A 8 LYS NZ :NH3+ 173:sc= 0.974 (180deg=0.811) USER MOD Single : A 15 LYS NZ :NH3+ 163:sc= 0.992 (180deg=0.708) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 75:sc= 0.0482 USER MOD Single : A 23 HIS : no HE2:sc= -0.993 X(o=-0.99,f=-0.87) USER MOD Single : A 28 LYS NZ :NH3+ -140:sc= 1.17 (180deg=0.352) USER MOD Single : A 33 ASN : amide:sc= -0.277 K(o=-0.28,f=-9!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 173:sc= 1.16 (180deg=1.06) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 101:sc= 1.25 USER MOD Single : A 54 HIS : no HD1:sc= 0.973 K(o=0.97,f=-4.8!) USER MOD Single : A 56 LYS NZ :NH3+ 127:sc= 1.31 (180deg=0.728) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 69 GLN :FLIP amide:sc= -0.318 F(o=-0.94,f=-0.32) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 73:sc= 0.922 USER MOD Single : A 73 THR OG1 : rot 71:sc= 0.539 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -2.17! X(o=-2.2!,f=-2.6) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0.017 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN : amide:sc= -0.447 K(o=-0.45,f=-5.6!) USER MOD Single : A 100 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.15) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.525 -3.841 -16.057 1.00 0.00 N ATOM 2 CA GLY A 1 2.039 -3.789 -14.669 1.00 0.00 C ATOM 3 C GLY A 1 1.169 -2.929 -13.779 1.00 0.00 C ATOM 4 O GLY A 1 0.392 -2.111 -14.269 1.00 0.00 O ATOM 0 H1 GLY A 1 1.166 -4.796 -16.259 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.755 -3.151 -16.168 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.293 -3.613 -16.720 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.089 -4.799 -14.262 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.056 -3.396 -14.672 1.00 0.00 H new ATOM 7 N ALA A 2 1.289 -3.110 -12.472 1.00 0.00 N ATOM 8 CA ALA A 2 0.538 -2.302 -11.526 1.00 0.00 C ATOM 9 C ALA A 2 1.477 -1.605 -10.550 1.00 0.00 C ATOM 10 O ALA A 2 1.650 -0.389 -10.600 1.00 0.00 O ATOM 11 CB ALA A 2 -0.471 -3.159 -10.777 1.00 0.00 C ATOM 0 H ALA A 2 1.898 -3.808 -12.044 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.004 -1.538 -12.083 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.024 -2.538 -10.073 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.165 -3.609 -11.487 1.00 0.00 H new ATOM 0 HB3 ALA A 2 0.052 -3.946 -10.233 1.00 0.00 H new ATOM 17 N MET A 3 2.101 -2.384 -9.681 1.00 0.00 N ATOM 18 CA MET A 3 3.012 -1.837 -8.683 1.00 0.00 C ATOM 19 C MET A 3 4.448 -2.280 -8.943 1.00 0.00 C ATOM 20 O MET A 3 5.378 -1.829 -8.275 1.00 0.00 O ATOM 21 CB MET A 3 2.568 -2.227 -7.264 1.00 0.00 C ATOM 22 CG MET A 3 1.966 -3.624 -7.140 1.00 0.00 C ATOM 23 SD MET A 3 3.096 -4.947 -7.619 1.00 0.00 S ATOM 24 CE MET A 3 2.089 -6.385 -7.261 1.00 0.00 C ATOM 0 H MET A 3 1.995 -3.398 -9.645 1.00 0.00 H new ATOM 0 HA MET A 3 2.979 -0.750 -8.763 1.00 0.00 H new ATOM 0 HB2 MET A 3 3.428 -2.157 -6.598 1.00 0.00 H new ATOM 0 HB3 MET A 3 1.835 -1.499 -6.915 1.00 0.00 H new ATOM 0 HG2 MET A 3 1.650 -3.784 -6.109 1.00 0.00 H new ATOM 0 HG3 MET A 3 1.071 -3.681 -7.760 1.00 0.00 H new ATOM 0 HE1 MET A 3 2.647 -7.289 -7.504 1.00 0.00 H new ATOM 0 HE2 MET A 3 1.829 -6.393 -6.203 1.00 0.00 H new ATOM 0 HE3 MET A 3 1.178 -6.349 -7.858 1.00 0.00 H new ATOM 34 N GLY A 4 4.625 -3.153 -9.922 1.00 0.00 N ATOM 35 CA GLY A 4 5.954 -3.612 -10.270 1.00 0.00 C ATOM 36 C GLY A 4 5.941 -5.009 -10.853 1.00 0.00 C ATOM 37 O GLY A 4 5.149 -5.299 -11.756 1.00 0.00 O ATOM 0 H GLY A 4 3.872 -3.553 -10.482 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.398 -2.924 -10.990 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.586 -3.596 -9.382 1.00 0.00 H new ATOM 41 N PRO A 5 6.802 -5.899 -10.351 1.00 0.00 N ATOM 42 CA PRO A 5 6.887 -7.276 -10.815 1.00 0.00 C ATOM 43 C PRO A 5 5.869 -8.176 -10.127 1.00 0.00 C ATOM 44 O PRO A 5 5.138 -7.740 -9.234 1.00 0.00 O ATOM 45 CB PRO A 5 8.311 -7.707 -10.435 1.00 0.00 C ATOM 46 CG PRO A 5 8.892 -6.593 -9.614 1.00 0.00 C ATOM 47 CD PRO A 5 7.771 -5.645 -9.284 1.00 0.00 C ATOM 0 HA PRO A 5 6.677 -7.354 -11.882 1.00 0.00 H new ATOM 0 HB2 PRO A 5 8.296 -8.638 -9.869 1.00 0.00 H new ATOM 0 HB3 PRO A 5 8.912 -7.886 -11.326 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.345 -6.984 -8.703 1.00 0.00 H new ATOM 0 HG3 PRO A 5 9.679 -6.079 -10.166 1.00 0.00 H new ATOM 0 HD2 PRO A 5 7.349 -5.846 -8.299 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.107 -4.608 -9.282 1.00 0.00 H new ATOM 55 N LYS A 6 5.821 -9.430 -10.554 1.00 0.00 N ATOM 56 CA LYS A 6 4.945 -10.413 -9.947 1.00 0.00 C ATOM 57 C LYS A 6 5.318 -10.633 -8.479 1.00 0.00 C ATOM 58 O LYS A 6 6.498 -10.732 -8.130 1.00 0.00 O ATOM 59 CB LYS A 6 5.023 -11.725 -10.721 1.00 0.00 C ATOM 60 CG LYS A 6 6.374 -12.401 -10.636 1.00 0.00 C ATOM 61 CD LYS A 6 6.450 -13.590 -11.562 1.00 0.00 C ATOM 62 CE LYS A 6 7.729 -14.380 -11.344 1.00 0.00 C ATOM 63 NZ LYS A 6 8.941 -13.519 -11.422 1.00 0.00 N ATOM 0 H LYS A 6 6.384 -9.789 -11.325 1.00 0.00 H new ATOM 0 HA LYS A 6 3.921 -10.042 -9.985 1.00 0.00 H new ATOM 0 HB2 LYS A 6 4.261 -12.406 -10.342 1.00 0.00 H new ATOM 0 HB3 LYS A 6 4.787 -11.534 -11.768 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.157 -11.687 -10.892 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.558 -12.723 -9.611 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.588 -14.237 -11.398 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.402 -13.251 -12.597 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.692 -14.866 -10.369 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.798 -15.170 -12.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.789 -14.118 -11.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.881 -12.910 -12.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 9.002 -12.927 -10.569 1.00 0.00 H new ATOM 77 N SER A 7 4.311 -10.690 -7.625 1.00 0.00 N ATOM 78 CA SER A 7 4.526 -10.896 -6.202 1.00 0.00 C ATOM 79 C SER A 7 3.921 -12.229 -5.764 1.00 0.00 C ATOM 80 O SER A 7 3.533 -13.035 -6.612 1.00 0.00 O ATOM 81 CB SER A 7 3.910 -9.733 -5.423 1.00 0.00 C ATOM 82 OG SER A 7 4.428 -8.493 -5.880 1.00 0.00 O ATOM 0 H SER A 7 3.331 -10.596 -7.893 1.00 0.00 H new ATOM 0 HA SER A 7 5.596 -10.930 -5.995 1.00 0.00 H new ATOM 0 HB2 SER A 7 2.826 -9.745 -5.539 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.118 -9.850 -4.360 1.00 0.00 H new ATOM 0 HG SER A 7 4.021 -7.761 -5.371 1.00 0.00 H new ATOM 88 N LYS A 8 3.847 -12.458 -4.448 1.00 0.00 N ATOM 89 CA LYS A 8 3.239 -13.674 -3.890 1.00 0.00 C ATOM 90 C LYS A 8 1.896 -13.960 -4.540 1.00 0.00 C ATOM 91 O LYS A 8 1.604 -15.091 -4.930 1.00 0.00 O ATOM 92 CB LYS A 8 3.031 -13.518 -2.382 1.00 0.00 C ATOM 93 CG LYS A 8 4.286 -13.712 -1.554 1.00 0.00 C ATOM 94 CD LYS A 8 4.686 -15.176 -1.485 1.00 0.00 C ATOM 95 CE LYS A 8 5.814 -15.396 -0.491 1.00 0.00 C ATOM 96 NZ LYS A 8 5.382 -15.138 0.910 1.00 0.00 N ATOM 0 H LYS A 8 4.203 -11.812 -3.744 1.00 0.00 H new ATOM 0 HA LYS A 8 3.918 -14.504 -4.089 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.629 -12.524 -2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.280 -14.237 -2.055 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.101 -13.131 -1.985 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.121 -13.331 -0.546 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.823 -15.777 -1.198 1.00 0.00 H new ATOM 0 HD3 LYS A 8 4.997 -15.517 -2.472 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.177 -16.420 -0.576 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.649 -14.741 -0.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.143 -15.413 1.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.172 -14.126 1.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.529 -15.695 1.118 1.00 0.00 H new ATOM 110 N GLU A 9 1.094 -12.915 -4.659 1.00 0.00 N ATOM 111 CA GLU A 9 -0.227 -13.021 -5.247 1.00 0.00 C ATOM 112 C GLU A 9 -0.161 -13.564 -6.670 1.00 0.00 C ATOM 113 O GLU A 9 -0.910 -14.467 -7.018 1.00 0.00 O ATOM 114 CB GLU A 9 -0.913 -11.658 -5.220 1.00 0.00 C ATOM 115 CG GLU A 9 -0.095 -10.556 -5.867 1.00 0.00 C ATOM 116 CD GLU A 9 -0.540 -9.186 -5.429 1.00 0.00 C ATOM 117 OE1 GLU A 9 0.156 -8.581 -4.589 1.00 0.00 O ATOM 118 OE2 GLU A 9 -1.595 -8.723 -5.891 1.00 0.00 O ATOM 0 H GLU A 9 1.341 -11.974 -4.352 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.811 -13.727 -4.657 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.874 -11.733 -5.729 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.121 -11.385 -4.185 1.00 0.00 H new ATOM 0 HG2 GLU A 9 0.957 -10.692 -5.616 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.177 -10.634 -6.951 1.00 0.00 H new ATOM 125 N GLU A 10 0.764 -13.049 -7.469 1.00 0.00 N ATOM 126 CA GLU A 10 0.856 -13.422 -8.862 1.00 0.00 C ATOM 127 C GLU A 10 1.289 -14.868 -9.024 1.00 0.00 C ATOM 128 O GLU A 10 0.785 -15.573 -9.893 1.00 0.00 O ATOM 129 CB GLU A 10 1.827 -12.494 -9.575 1.00 0.00 C ATOM 130 CG GLU A 10 1.164 -11.245 -10.125 1.00 0.00 C ATOM 131 CD GLU A 10 0.221 -11.559 -11.270 1.00 0.00 C ATOM 132 OE1 GLU A 10 0.554 -11.220 -12.421 1.00 0.00 O ATOM 133 OE2 GLU A 10 -0.839 -12.175 -11.027 1.00 0.00 O ATOM 0 H GLU A 10 1.462 -12.369 -7.168 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.133 -13.325 -9.309 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.617 -12.203 -8.882 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.303 -13.035 -10.393 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.613 -10.746 -9.328 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.930 -10.549 -10.467 1.00 0.00 H new ATOM 140 N LEU A 11 2.202 -15.305 -8.165 1.00 0.00 N ATOM 141 CA LEU A 11 2.707 -16.675 -8.201 1.00 0.00 C ATOM 142 C LEU A 11 1.566 -17.668 -7.997 1.00 0.00 C ATOM 143 O LEU A 11 1.543 -18.747 -8.602 1.00 0.00 O ATOM 144 CB LEU A 11 3.768 -16.873 -7.116 1.00 0.00 C ATOM 145 CG LEU A 11 4.947 -15.899 -7.170 1.00 0.00 C ATOM 146 CD1 LEU A 11 5.862 -16.108 -5.973 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.724 -16.065 -8.466 1.00 0.00 C ATOM 0 H LEU A 11 2.611 -14.728 -7.430 1.00 0.00 H new ATOM 0 HA LEU A 11 3.157 -16.853 -9.178 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.288 -16.784 -6.141 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.154 -17.890 -7.189 1.00 0.00 H new ATOM 0 HG LEU A 11 4.553 -14.883 -7.135 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.696 -15.408 -6.026 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.303 -15.937 -5.053 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.244 -17.129 -5.981 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.558 -15.363 -8.483 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.106 -17.084 -8.533 1.00 0.00 H new ATOM 0 HD23 LEU A 11 5.066 -15.868 -9.312 1.00 0.00 H new ATOM 159 N LEU A 12 0.620 -17.293 -7.146 1.00 0.00 N ATOM 160 CA LEU A 12 -0.550 -18.115 -6.898 1.00 0.00 C ATOM 161 C LEU A 12 -1.617 -17.875 -7.964 1.00 0.00 C ATOM 162 O LEU A 12 -2.296 -18.809 -8.387 1.00 0.00 O ATOM 163 CB LEU A 12 -1.115 -17.820 -5.512 1.00 0.00 C ATOM 164 CG LEU A 12 -2.312 -18.675 -5.106 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.915 -20.138 -4.982 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.902 -18.162 -3.806 1.00 0.00 C ATOM 0 H LEU A 12 0.643 -16.422 -6.616 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.250 -19.162 -6.943 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.323 -17.959 -4.776 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.407 -16.771 -5.471 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.072 -18.602 -5.884 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.785 -20.728 -4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.538 -20.495 -5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.138 -20.241 -4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.756 -18.779 -3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -2.147 -18.208 -3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.228 -17.130 -3.936 1.00 0.00 H new ATOM 178 N ARG A 13 -1.748 -16.622 -8.408 1.00 0.00 N ATOM 179 CA ARG A 13 -2.729 -16.253 -9.437 1.00 0.00 C ATOM 180 C ARG A 13 -2.477 -17.009 -10.738 1.00 0.00 C ATOM 181 O ARG A 13 -3.394 -17.204 -11.533 1.00 0.00 O ATOM 182 CB ARG A 13 -2.711 -14.739 -9.690 1.00 0.00 C ATOM 183 CG ARG A 13 -3.366 -13.937 -8.577 1.00 0.00 C ATOM 184 CD ARG A 13 -3.006 -12.457 -8.631 1.00 0.00 C ATOM 185 NE ARG A 13 -3.621 -11.761 -9.760 1.00 0.00 N ATOM 186 CZ ARG A 13 -4.354 -10.645 -9.646 1.00 0.00 C ATOM 187 NH1 ARG A 13 -4.597 -10.115 -8.449 1.00 0.00 N ATOM 188 NH2 ARG A 13 -4.850 -10.060 -10.730 1.00 0.00 N ATOM 0 H ARG A 13 -1.185 -15.841 -8.070 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.715 -16.533 -9.067 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.679 -14.409 -9.807 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.222 -14.528 -10.630 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.448 -14.046 -8.644 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.063 -14.346 -7.613 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -3.318 -11.979 -7.703 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -1.923 -12.354 -8.694 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.484 -12.149 -10.693 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.224 -10.559 -7.610 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.156 -9.265 -8.371 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -4.673 -10.460 -11.651 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -5.408 -9.211 -10.641 1.00 0.00 H new ATOM 202 N GLU A 14 -1.236 -17.440 -10.943 1.00 0.00 N ATOM 203 CA GLU A 14 -0.893 -18.287 -12.082 1.00 0.00 C ATOM 204 C GLU A 14 -1.718 -19.570 -12.049 1.00 0.00 C ATOM 205 O GLU A 14 -2.130 -20.094 -13.083 1.00 0.00 O ATOM 206 CB GLU A 14 0.591 -18.666 -12.046 1.00 0.00 C ATOM 207 CG GLU A 14 1.558 -17.494 -12.054 1.00 0.00 C ATOM 208 CD GLU A 14 3.000 -17.952 -12.004 1.00 0.00 C ATOM 209 OE1 GLU A 14 3.727 -17.560 -11.069 1.00 0.00 O ATOM 210 OE2 GLU A 14 3.409 -18.736 -12.887 1.00 0.00 O ATOM 0 H GLU A 14 -0.449 -17.216 -10.334 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.106 -17.726 -12.992 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.776 -19.263 -11.153 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.808 -19.302 -12.904 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.398 -16.897 -12.952 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.352 -16.848 -11.201 1.00 0.00 H new ATOM 217 N LYS A 15 -1.959 -20.055 -10.841 1.00 0.00 N ATOM 218 CA LYS A 15 -2.604 -21.334 -10.627 1.00 0.00 C ATOM 219 C LYS A 15 -4.066 -21.157 -10.222 1.00 0.00 C ATOM 220 O LYS A 15 -4.724 -22.108 -9.796 1.00 0.00 O ATOM 221 CB LYS A 15 -1.837 -22.065 -9.537 1.00 0.00 C ATOM 222 CG LYS A 15 -0.348 -22.148 -9.826 1.00 0.00 C ATOM 223 CD LYS A 15 0.452 -22.231 -8.546 1.00 0.00 C ATOM 224 CE LYS A 15 1.940 -22.402 -8.817 1.00 0.00 C ATOM 225 NZ LYS A 15 2.505 -21.275 -9.610 1.00 0.00 N ATOM 0 H LYS A 15 -1.710 -19.568 -9.980 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.596 -21.909 -11.553 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.991 -21.556 -8.586 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -2.239 -23.072 -9.428 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.143 -23.022 -10.444 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.036 -21.274 -10.397 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.292 -21.327 -7.958 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.093 -23.068 -7.947 1.00 0.00 H new ATOM 0 HE2 LYS A 15 2.473 -22.479 -7.869 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.104 -23.337 -9.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.542 -21.278 -9.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.237 -21.385 -10.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 2.131 -20.374 -9.248 1.00 0.00 H new ATOM 239 N LEU A 16 -4.570 -19.937 -10.365 1.00 0.00 N ATOM 240 CA LEU A 16 -5.938 -19.620 -9.980 1.00 0.00 C ATOM 241 C LEU A 16 -6.742 -19.172 -11.189 1.00 0.00 C ATOM 242 O LEU A 16 -6.178 -18.863 -12.238 1.00 0.00 O ATOM 243 CB LEU A 16 -5.957 -18.516 -8.921 1.00 0.00 C ATOM 244 CG LEU A 16 -5.269 -18.853 -7.600 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.362 -17.678 -6.648 1.00 0.00 C ATOM 246 CD2 LEU A 16 -5.884 -20.091 -6.970 1.00 0.00 C ATOM 0 H LEU A 16 -4.048 -19.148 -10.747 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.387 -20.522 -9.565 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.483 -17.628 -9.340 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.995 -18.256 -8.713 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.219 -19.061 -7.804 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.868 -17.930 -5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.875 -16.810 -7.093 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.410 -17.447 -6.456 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.377 -20.311 -6.030 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.942 -19.914 -6.779 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.774 -20.937 -7.648 1.00 0.00 H new ATOM 258 N SER A 17 -8.056 -19.126 -11.034 1.00 0.00 N ATOM 259 CA SER A 17 -8.929 -18.661 -12.098 1.00 0.00 C ATOM 260 C SER A 17 -9.090 -17.148 -12.004 1.00 0.00 C ATOM 261 O SER A 17 -8.603 -16.530 -11.055 1.00 0.00 O ATOM 262 CB SER A 17 -10.291 -19.353 -12.006 1.00 0.00 C ATOM 263 OG SER A 17 -10.863 -19.177 -10.723 1.00 0.00 O ATOM 0 H SER A 17 -8.541 -19.405 -10.181 1.00 0.00 H new ATOM 0 HA SER A 17 -8.484 -18.909 -13.061 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.960 -18.949 -12.765 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.177 -20.417 -12.215 1.00 0.00 H new ATOM 0 HG SER A 17 -10.397 -19.747 -10.076 1.00 0.00 H new ATOM 269 N GLU A 18 -9.790 -16.557 -12.965 1.00 0.00 N ATOM 270 CA GLU A 18 -9.964 -15.110 -13.008 1.00 0.00 C ATOM 271 C GLU A 18 -10.774 -14.648 -11.809 1.00 0.00 C ATOM 272 O GLU A 18 -10.523 -13.586 -11.240 1.00 0.00 O ATOM 273 CB GLU A 18 -10.662 -14.699 -14.302 1.00 0.00 C ATOM 274 CG GLU A 18 -9.920 -15.138 -15.551 1.00 0.00 C ATOM 275 CD GLU A 18 -10.588 -14.662 -16.820 1.00 0.00 C ATOM 276 OE1 GLU A 18 -11.306 -15.459 -17.453 1.00 0.00 O ATOM 277 OE2 GLU A 18 -10.382 -13.489 -17.198 1.00 0.00 O ATOM 0 H GLU A 18 -10.247 -17.059 -13.726 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.982 -14.638 -12.976 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.666 -15.124 -14.316 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -10.775 -13.615 -14.317 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.900 -14.756 -15.516 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -9.853 -16.226 -15.566 1.00 0.00 H new ATOM 284 N ASP A 19 -11.737 -15.479 -11.432 1.00 0.00 N ATOM 285 CA ASP A 19 -12.561 -15.249 -10.254 1.00 0.00 C ATOM 286 C ASP A 19 -11.674 -15.080 -9.029 1.00 0.00 C ATOM 287 O ASP A 19 -11.731 -14.070 -8.330 1.00 0.00 O ATOM 288 CB ASP A 19 -13.491 -16.452 -10.033 1.00 0.00 C ATOM 289 CG ASP A 19 -14.284 -16.835 -11.267 1.00 0.00 C ATOM 290 OD1 ASP A 19 -15.527 -16.743 -11.232 1.00 0.00 O ATOM 291 OD2 ASP A 19 -13.670 -17.256 -12.272 1.00 0.00 O ATOM 0 H ASP A 19 -11.969 -16.334 -11.937 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.152 -14.346 -10.406 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.896 -17.307 -9.712 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.183 -16.223 -9.222 1.00 0.00 H new ATOM 296 N GLN A 20 -10.817 -16.071 -8.824 1.00 0.00 N ATOM 297 CA GLN A 20 -9.981 -16.165 -7.634 1.00 0.00 C ATOM 298 C GLN A 20 -8.968 -15.022 -7.555 1.00 0.00 C ATOM 299 O GLN A 20 -8.607 -14.580 -6.464 1.00 0.00 O ATOM 300 CB GLN A 20 -9.268 -17.516 -7.638 1.00 0.00 C ATOM 301 CG GLN A 20 -10.229 -18.692 -7.658 1.00 0.00 C ATOM 302 CD GLN A 20 -9.521 -20.029 -7.710 1.00 0.00 C ATOM 303 OE1 GLN A 20 -9.200 -20.533 -8.789 1.00 0.00 O ATOM 304 NE2 GLN A 20 -9.287 -20.619 -6.550 1.00 0.00 N ATOM 0 H GLN A 20 -10.681 -16.838 -9.483 1.00 0.00 H new ATOM 0 HA GLN A 20 -10.618 -16.082 -6.754 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.614 -17.573 -8.508 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.632 -17.588 -6.756 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -10.860 -18.655 -6.770 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -10.888 -18.602 -8.521 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -9.570 -20.166 -5.681 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -8.824 -21.527 -6.524 1.00 0.00 H new ATOM 313 N LYS A 21 -8.516 -14.541 -8.706 1.00 0.00 N ATOM 314 CA LYS A 21 -7.548 -13.449 -8.746 1.00 0.00 C ATOM 315 C LYS A 21 -8.162 -12.169 -8.191 1.00 0.00 C ATOM 316 O LYS A 21 -7.500 -11.405 -7.487 1.00 0.00 O ATOM 317 CB LYS A 21 -7.059 -13.221 -10.177 1.00 0.00 C ATOM 318 CG LYS A 21 -6.427 -14.451 -10.804 1.00 0.00 C ATOM 319 CD LYS A 21 -5.949 -14.179 -12.218 1.00 0.00 C ATOM 320 CE LYS A 21 -5.484 -15.458 -12.893 1.00 0.00 C ATOM 321 NZ LYS A 21 -4.830 -15.197 -14.202 1.00 0.00 N ATOM 0 H LYS A 21 -8.802 -14.887 -9.622 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.696 -13.724 -8.124 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -7.899 -12.900 -10.793 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.333 -12.408 -10.179 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.586 -14.779 -10.193 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.151 -15.266 -10.815 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -6.756 -13.730 -12.798 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.132 -13.458 -12.197 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.786 -15.979 -12.238 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.337 -16.120 -13.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.529 -16.098 -14.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.503 -14.723 -14.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.000 -14.587 -14.060 1.00 0.00 H new ATOM 335 N THR A 22 -9.431 -11.949 -8.493 1.00 0.00 N ATOM 336 CA THR A 22 -10.134 -10.772 -8.016 1.00 0.00 C ATOM 337 C THR A 22 -10.384 -10.864 -6.511 1.00 0.00 C ATOM 338 O THR A 22 -10.302 -9.864 -5.795 1.00 0.00 O ATOM 339 CB THR A 22 -11.464 -10.591 -8.768 1.00 0.00 C ATOM 340 OG1 THR A 22 -11.212 -10.575 -10.180 1.00 0.00 O ATOM 341 CG2 THR A 22 -12.154 -9.297 -8.362 1.00 0.00 C ATOM 0 H THR A 22 -9.996 -12.573 -9.069 1.00 0.00 H new ATOM 0 HA THR A 22 -9.506 -9.902 -8.209 1.00 0.00 H new ATOM 0 HB THR A 22 -12.120 -11.423 -8.512 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.021 -11.485 -10.488 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.091 -9.197 -8.910 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.360 -9.315 -7.292 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.506 -8.451 -8.593 1.00 0.00 H new ATOM 349 N HIS A 23 -10.656 -12.071 -6.027 1.00 0.00 N ATOM 350 CA HIS A 23 -10.881 -12.277 -4.601 1.00 0.00 C ATOM 351 C HIS A 23 -9.582 -12.140 -3.812 1.00 0.00 C ATOM 352 O HIS A 23 -9.601 -11.882 -2.609 1.00 0.00 O ATOM 353 CB HIS A 23 -11.544 -13.632 -4.344 1.00 0.00 C ATOM 354 CG HIS A 23 -12.959 -13.679 -4.828 1.00 0.00 C ATOM 355 ND1 HIS A 23 -13.322 -14.433 -5.914 1.00 0.00 N ATOM 356 CD2 HIS A 23 -14.046 -13.017 -4.366 1.00 0.00 C ATOM 357 CE1 HIS A 23 -14.611 -14.211 -6.093 1.00 0.00 C ATOM 358 NE2 HIS A 23 -15.096 -13.357 -5.179 1.00 0.00 N ATOM 0 H HIS A 23 -10.726 -12.915 -6.595 1.00 0.00 H new ATOM 0 HA HIS A 23 -11.561 -11.499 -4.253 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -10.968 -14.414 -4.839 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.522 -13.847 -3.276 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -12.720 -15.041 -6.470 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.079 -12.348 -3.518 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.202 -14.661 -6.877 1.00 0.00 H new ATOM 366 N LEU A 24 -8.454 -12.296 -4.494 1.00 0.00 N ATOM 367 CA LEU A 24 -7.164 -12.023 -3.890 1.00 0.00 C ATOM 368 C LEU A 24 -6.988 -10.523 -3.685 1.00 0.00 C ATOM 369 O LEU A 24 -6.551 -10.080 -2.624 1.00 0.00 O ATOM 370 CB LEU A 24 -6.033 -12.577 -4.757 1.00 0.00 C ATOM 371 CG LEU A 24 -5.760 -14.072 -4.596 1.00 0.00 C ATOM 372 CD1 LEU A 24 -4.533 -14.476 -5.391 1.00 0.00 C ATOM 373 CD2 LEU A 24 -5.586 -14.436 -3.131 1.00 0.00 C ATOM 0 H LEU A 24 -8.410 -12.610 -5.464 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.125 -12.518 -2.920 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.268 -12.378 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.119 -12.030 -4.526 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.621 -14.618 -4.983 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.353 -15.544 -5.265 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.695 -14.257 -6.446 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.668 -13.918 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.393 -15.505 -3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.746 -13.880 -2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.494 -14.185 -2.583 1.00 0.00 H new ATOM 385 N ASP A 25 -7.349 -9.739 -4.695 1.00 0.00 N ATOM 386 CA ASP A 25 -7.313 -8.286 -4.578 1.00 0.00 C ATOM 387 C ASP A 25 -8.268 -7.826 -3.485 1.00 0.00 C ATOM 388 O ASP A 25 -7.999 -6.859 -2.772 1.00 0.00 O ATOM 389 CB ASP A 25 -7.671 -7.622 -5.911 1.00 0.00 C ATOM 390 CG ASP A 25 -6.525 -7.644 -6.903 1.00 0.00 C ATOM 391 OD1 ASP A 25 -6.603 -8.395 -7.899 1.00 0.00 O ATOM 392 OD2 ASP A 25 -5.541 -6.906 -6.693 1.00 0.00 O ATOM 0 H ASP A 25 -7.669 -10.083 -5.600 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.299 -7.987 -4.312 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.532 -8.130 -6.346 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.969 -6.589 -5.729 1.00 0.00 H new ATOM 397 N TRP A 26 -9.378 -8.542 -3.359 1.00 0.00 N ATOM 398 CA TRP A 26 -10.348 -8.292 -2.302 1.00 0.00 C ATOM 399 C TRP A 26 -9.727 -8.576 -0.932 1.00 0.00 C ATOM 400 O TRP A 26 -9.835 -7.762 -0.017 1.00 0.00 O ATOM 401 CB TRP A 26 -11.595 -9.160 -2.516 1.00 0.00 C ATOM 402 CG TRP A 26 -12.673 -8.942 -1.497 1.00 0.00 C ATOM 403 CD1 TRP A 26 -13.670 -8.011 -1.543 1.00 0.00 C ATOM 404 CD2 TRP A 26 -12.866 -9.677 -0.283 1.00 0.00 C ATOM 405 NE1 TRP A 26 -14.469 -8.121 -0.431 1.00 0.00 N ATOM 406 CE2 TRP A 26 -13.998 -9.139 0.354 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.192 -10.744 0.324 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -14.469 -9.625 1.570 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -12.661 -11.224 1.530 1.00 0.00 C ATOM 410 CH2 TRP A 26 -13.791 -10.668 2.140 1.00 0.00 C ATOM 0 H TRP A 26 -9.630 -9.308 -3.983 1.00 0.00 H new ATOM 0 HA TRP A 26 -10.642 -7.243 -2.336 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.000 -8.957 -3.507 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.301 -10.210 -2.500 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -13.810 -7.293 -2.337 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -15.281 -7.539 -0.224 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.322 -11.183 -0.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -15.338 -9.195 2.046 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.147 -12.043 2.011 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.135 -11.071 3.081 1.00 0.00 H new ATOM 421 N LEU A 27 -9.067 -9.726 -0.801 1.00 0.00 N ATOM 422 CA LEU A 27 -8.411 -10.105 0.452 1.00 0.00 C ATOM 423 C LEU A 27 -7.289 -9.141 0.801 1.00 0.00 C ATOM 424 O LEU A 27 -7.025 -8.884 1.974 1.00 0.00 O ATOM 425 CB LEU A 27 -7.859 -11.524 0.367 1.00 0.00 C ATOM 426 CG LEU A 27 -8.644 -12.561 1.152 1.00 0.00 C ATOM 427 CD1 LEU A 27 -8.134 -13.960 0.861 1.00 0.00 C ATOM 428 CD2 LEU A 27 -8.579 -12.274 2.636 1.00 0.00 C ATOM 0 H LEU A 27 -8.972 -10.413 -1.548 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.164 -10.062 1.239 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.831 -11.826 -0.680 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -6.830 -11.520 0.725 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.685 -12.503 0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.712 -14.685 1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -8.240 -14.172 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -7.083 -14.030 1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -9.148 -13.029 3.178 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.540 -12.296 2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.002 -11.289 2.835 1.00 0.00 H new ATOM 440 N LYS A 28 -6.634 -8.617 -0.223 1.00 0.00 N ATOM 441 CA LYS A 28 -5.594 -7.621 -0.034 1.00 0.00 C ATOM 442 C LYS A 28 -6.162 -6.428 0.721 1.00 0.00 C ATOM 443 O LYS A 28 -5.526 -5.885 1.625 1.00 0.00 O ATOM 444 CB LYS A 28 -5.041 -7.185 -1.389 1.00 0.00 C ATOM 445 CG LYS A 28 -3.822 -6.281 -1.300 1.00 0.00 C ATOM 446 CD LYS A 28 -3.317 -5.900 -2.681 1.00 0.00 C ATOM 447 CE LYS A 28 -2.654 -7.068 -3.390 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.326 -7.392 -2.802 1.00 0.00 N ATOM 0 H LYS A 28 -6.806 -8.867 -1.197 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.780 -8.051 0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -4.781 -8.073 -1.966 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.826 -6.666 -1.940 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.075 -5.380 -0.741 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.030 -6.787 -0.748 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.150 -5.536 -3.283 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.605 -5.079 -2.592 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.301 -7.943 -3.331 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.535 -6.831 -4.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.657 -7.624 -3.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.973 -6.572 -2.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.419 -8.207 -2.162 1.00 0.00 H new ATOM 462 N GLU A 29 -7.381 -6.051 0.359 1.00 0.00 N ATOM 463 CA GLU A 29 -8.078 -4.967 1.034 1.00 0.00 C ATOM 464 C GLU A 29 -8.662 -5.443 2.357 1.00 0.00 C ATOM 465 O GLU A 29 -8.713 -4.686 3.322 1.00 0.00 O ATOM 466 CB GLU A 29 -9.206 -4.416 0.169 1.00 0.00 C ATOM 467 CG GLU A 29 -8.752 -3.841 -1.159 1.00 0.00 C ATOM 468 CD GLU A 29 -9.893 -3.188 -1.905 1.00 0.00 C ATOM 469 OE1 GLU A 29 -10.562 -3.876 -2.704 1.00 0.00 O ATOM 470 OE2 GLU A 29 -10.147 -1.989 -1.677 1.00 0.00 O ATOM 0 H GLU A 29 -7.908 -6.482 -0.401 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.348 -4.178 1.218 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -9.925 -5.213 -0.021 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.730 -3.640 0.727 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.963 -3.109 -0.988 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -8.323 -4.634 -1.772 1.00 0.00 H new ATOM 477 N ALA A 30 -9.117 -6.694 2.380 1.00 0.00 N ATOM 478 CA ALA A 30 -9.702 -7.287 3.576 1.00 0.00 C ATOM 479 C ALA A 30 -8.730 -7.217 4.741 1.00 0.00 C ATOM 480 O ALA A 30 -9.054 -6.671 5.797 1.00 0.00 O ATOM 481 CB ALA A 30 -10.116 -8.727 3.312 1.00 0.00 C ATOM 0 H ALA A 30 -9.090 -7.320 1.575 1.00 0.00 H new ATOM 0 HA ALA A 30 -10.592 -6.716 3.839 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.550 -9.152 4.217 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.853 -8.752 2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.242 -9.309 3.021 1.00 0.00 H new ATOM 487 N LEU A 31 -7.542 -7.782 4.553 1.00 0.00 N ATOM 488 CA LEU A 31 -6.486 -7.660 5.541 1.00 0.00 C ATOM 489 C LEU A 31 -6.039 -6.208 5.700 1.00 0.00 C ATOM 490 O LEU A 31 -5.751 -5.754 6.808 1.00 0.00 O ATOM 491 CB LEU A 31 -5.301 -8.532 5.159 1.00 0.00 C ATOM 492 CG LEU A 31 -5.483 -10.025 5.422 1.00 0.00 C ATOM 493 CD1 LEU A 31 -5.724 -10.298 6.901 1.00 0.00 C ATOM 494 CD2 LEU A 31 -6.613 -10.605 4.598 1.00 0.00 C ATOM 0 H LEU A 31 -7.291 -8.326 3.728 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.884 -7.998 6.498 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.091 -8.389 4.099 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.424 -8.187 5.707 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.557 -10.515 5.122 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.850 -11.369 7.057 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.871 -9.945 7.480 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -6.624 -9.776 7.225 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -6.711 -11.669 4.813 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.544 -10.097 4.849 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.398 -10.467 3.538 1.00 0.00 H new ATOM 506 N GLY A 32 -5.989 -5.483 4.588 1.00 0.00 N ATOM 507 CA GLY A 32 -5.511 -4.111 4.614 1.00 0.00 C ATOM 508 C GLY A 32 -4.030 -4.057 4.907 1.00 0.00 C ATOM 509 O GLY A 32 -3.511 -3.061 5.414 1.00 0.00 O ATOM 0 H GLY A 32 -6.271 -5.820 3.668 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.713 -3.634 3.655 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.056 -3.547 5.371 1.00 0.00 H new ATOM 513 N ASN A 33 -3.357 -5.153 4.590 1.00 0.00 N ATOM 514 CA ASN A 33 -1.936 -5.305 4.845 1.00 0.00 C ATOM 515 C ASN A 33 -1.399 -6.402 3.944 1.00 0.00 C ATOM 516 O ASN A 33 -1.903 -7.528 3.967 1.00 0.00 O ATOM 517 CB ASN A 33 -1.703 -5.670 6.319 1.00 0.00 C ATOM 518 CG ASN A 33 -0.242 -5.637 6.733 1.00 0.00 C ATOM 519 OD1 ASN A 33 0.658 -5.882 5.931 1.00 0.00 O ATOM 520 ND2 ASN A 33 0.006 -5.334 7.996 1.00 0.00 N ATOM 0 H ASN A 33 -3.786 -5.965 4.146 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.418 -4.369 4.637 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.265 -4.980 6.948 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -2.102 -6.667 6.504 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.968 -5.298 8.332 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.765 -5.136 8.634 1.00 0.00 H new ATOM 527 N ASP A 34 -0.389 -6.085 3.150 1.00 0.00 N ATOM 528 CA ASP A 34 0.161 -7.055 2.213 1.00 0.00 C ATOM 529 C ASP A 34 0.834 -8.187 2.971 1.00 0.00 C ATOM 530 O ASP A 34 0.810 -9.335 2.543 1.00 0.00 O ATOM 531 CB ASP A 34 1.159 -6.393 1.267 1.00 0.00 C ATOM 532 CG ASP A 34 1.545 -7.297 0.111 1.00 0.00 C ATOM 533 OD1 ASP A 34 2.584 -7.981 0.204 1.00 0.00 O ATOM 534 OD2 ASP A 34 0.809 -7.317 -0.902 1.00 0.00 O ATOM 0 H ASP A 34 0.065 -5.172 3.134 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.658 -7.459 1.618 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.729 -5.471 0.876 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.055 -6.116 1.823 1.00 0.00 H new ATOM 539 N GLY A 35 1.401 -7.850 4.122 1.00 0.00 N ATOM 540 CA GLY A 35 2.050 -8.840 4.961 1.00 0.00 C ATOM 541 C GLY A 35 1.066 -9.839 5.544 1.00 0.00 C ATOM 542 O GLY A 35 1.381 -11.025 5.677 1.00 0.00 O ATOM 0 H GLY A 35 1.423 -6.900 4.493 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.800 -9.372 4.376 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.576 -8.336 5.772 1.00 0.00 H new ATOM 546 N GLU A 36 -0.129 -9.366 5.891 1.00 0.00 N ATOM 547 CA GLU A 36 -1.158 -10.239 6.443 1.00 0.00 C ATOM 548 C GLU A 36 -1.849 -11.023 5.333 1.00 0.00 C ATOM 549 O GLU A 36 -2.248 -12.169 5.525 1.00 0.00 O ATOM 550 CB GLU A 36 -2.179 -9.424 7.235 1.00 0.00 C ATOM 551 CG GLU A 36 -1.560 -8.630 8.371 1.00 0.00 C ATOM 552 CD GLU A 36 -0.759 -9.502 9.316 1.00 0.00 C ATOM 553 OE1 GLU A 36 -1.367 -10.156 10.187 1.00 0.00 O ATOM 554 OE2 GLU A 36 0.481 -9.531 9.195 1.00 0.00 O ATOM 0 H GLU A 36 -0.406 -8.389 5.800 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.681 -10.949 7.119 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.691 -8.739 6.559 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.935 -10.096 7.640 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -0.913 -7.856 7.959 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.348 -8.124 8.928 1.00 0.00 H new ATOM 561 N PHE A 37 -1.984 -10.397 4.174 1.00 0.00 N ATOM 562 CA PHE A 37 -2.539 -11.060 3.002 1.00 0.00 C ATOM 563 C PHE A 37 -1.558 -12.120 2.500 1.00 0.00 C ATOM 564 O PHE A 37 -1.960 -13.187 2.046 1.00 0.00 O ATOM 565 CB PHE A 37 -2.853 -10.007 1.928 1.00 0.00 C ATOM 566 CG PHE A 37 -3.277 -10.549 0.589 1.00 0.00 C ATOM 567 CD1 PHE A 37 -2.644 -10.107 -0.561 1.00 0.00 C ATOM 568 CD2 PHE A 37 -4.306 -11.479 0.472 1.00 0.00 C ATOM 569 CE1 PHE A 37 -3.015 -10.577 -1.803 1.00 0.00 C ATOM 570 CE2 PHE A 37 -4.680 -11.954 -0.770 1.00 0.00 C ATOM 571 CZ PHE A 37 -4.034 -11.507 -1.909 1.00 0.00 C ATOM 0 H PHE A 37 -1.715 -9.425 4.019 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.469 -11.569 3.255 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -3.643 -9.356 2.303 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.969 -9.386 1.785 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.847 -9.382 -0.484 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -4.815 -11.831 1.357 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.512 -10.221 -2.690 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -5.479 -12.676 -0.852 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.325 -11.883 -2.879 1.00 0.00 H new ATOM 581 N ASP A 38 -0.270 -11.813 2.625 1.00 0.00 N ATOM 582 CA ASP A 38 0.820 -12.747 2.313 1.00 0.00 C ATOM 583 C ASP A 38 0.604 -14.088 2.990 1.00 0.00 C ATOM 584 O ASP A 38 0.826 -15.145 2.401 1.00 0.00 O ATOM 585 CB ASP A 38 2.138 -12.162 2.810 1.00 0.00 C ATOM 586 CG ASP A 38 3.330 -13.060 2.543 1.00 0.00 C ATOM 587 OD1 ASP A 38 3.748 -13.794 3.467 1.00 0.00 O ATOM 588 OD2 ASP A 38 3.864 -13.028 1.416 1.00 0.00 O ATOM 0 H ASP A 38 0.055 -10.902 2.948 1.00 0.00 H new ATOM 0 HA ASP A 38 0.842 -12.896 1.233 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.304 -11.197 2.330 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.064 -11.976 3.882 1.00 0.00 H new ATOM 593 N LYS A 39 0.182 -14.010 4.241 1.00 0.00 N ATOM 594 CA LYS A 39 -0.070 -15.188 5.070 1.00 0.00 C ATOM 595 C LYS A 39 -0.997 -16.184 4.369 1.00 0.00 C ATOM 596 O LYS A 39 -0.839 -17.395 4.517 1.00 0.00 O ATOM 597 CB LYS A 39 -0.684 -14.759 6.407 1.00 0.00 C ATOM 598 CG LYS A 39 -0.753 -15.862 7.458 1.00 0.00 C ATOM 599 CD LYS A 39 0.497 -15.901 8.333 1.00 0.00 C ATOM 600 CE LYS A 39 1.732 -16.346 7.565 1.00 0.00 C ATOM 601 NZ LYS A 39 2.963 -16.240 8.390 1.00 0.00 N ATOM 0 H LYS A 39 0.002 -13.126 4.717 1.00 0.00 H new ATOM 0 HA LYS A 39 0.884 -15.685 5.244 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.103 -13.929 6.809 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.692 -14.385 6.226 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.630 -15.709 8.087 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.879 -16.825 6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.672 -14.911 8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.330 -16.579 9.170 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.603 -17.377 7.235 1.00 0.00 H new ATOM 0 HE3 LYS A 39 1.842 -15.736 6.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 3.783 -16.552 7.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 3.100 -15.252 8.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.869 -16.842 9.233 1.00 0.00 H new ATOM 615 N PHE A 40 -1.944 -15.667 3.593 1.00 0.00 N ATOM 616 CA PHE A 40 -2.915 -16.497 2.898 1.00 0.00 C ATOM 617 C PHE A 40 -2.255 -17.210 1.724 1.00 0.00 C ATOM 618 O PHE A 40 -2.527 -18.377 1.450 1.00 0.00 O ATOM 619 CB PHE A 40 -4.073 -15.623 2.407 1.00 0.00 C ATOM 620 CG PHE A 40 -5.161 -16.380 1.701 1.00 0.00 C ATOM 621 CD1 PHE A 40 -5.263 -16.332 0.323 1.00 0.00 C ATOM 622 CD2 PHE A 40 -6.083 -17.133 2.413 1.00 0.00 C ATOM 623 CE1 PHE A 40 -6.262 -17.017 -0.337 1.00 0.00 C ATOM 624 CE2 PHE A 40 -7.085 -17.822 1.760 1.00 0.00 C ATOM 625 CZ PHE A 40 -7.174 -17.765 0.382 1.00 0.00 C ATOM 0 H PHE A 40 -2.058 -14.667 3.430 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.301 -17.251 3.584 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.505 -15.100 3.260 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.679 -14.863 1.733 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.551 -15.751 -0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.016 -17.181 3.490 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -6.331 -16.969 -1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.798 -18.404 2.325 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.956 -18.305 -0.132 1.00 0.00 H new ATOM 635 N LEU A 41 -1.374 -16.487 1.047 1.00 0.00 N ATOM 636 CA LEU A 41 -0.657 -16.994 -0.104 1.00 0.00 C ATOM 637 C LEU A 41 0.290 -18.119 0.296 1.00 0.00 C ATOM 638 O LEU A 41 0.616 -18.993 -0.508 1.00 0.00 O ATOM 639 CB LEU A 41 0.128 -15.847 -0.731 1.00 0.00 C ATOM 640 CG LEU A 41 -0.695 -14.802 -1.496 1.00 0.00 C ATOM 641 CD1 LEU A 41 -1.132 -15.350 -2.834 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.912 -14.325 -0.725 1.00 0.00 C ATOM 0 H LEU A 41 -1.138 -15.524 1.287 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.370 -17.399 -0.823 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.680 -15.337 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.865 -16.269 -1.414 1.00 0.00 H new ATOM 0 HG LEU A 41 -0.041 -13.942 -1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -1.715 -14.596 -3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.254 -15.611 -3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -1.743 -16.239 -2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.453 -13.588 -1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -2.565 -15.172 -0.516 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.593 -13.872 0.214 1.00 0.00 H new ATOM 654 N GLY A 42 0.722 -18.085 1.546 1.00 0.00 N ATOM 655 CA GLY A 42 1.629 -19.094 2.048 1.00 0.00 C ATOM 656 C GLY A 42 0.908 -20.287 2.642 1.00 0.00 C ATOM 657 O GLY A 42 1.351 -20.849 3.648 1.00 0.00 O ATOM 0 H GLY A 42 0.459 -17.372 2.226 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.274 -19.432 1.237 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.275 -18.651 2.806 1.00 0.00 H new ATOM 661 N TYR A 43 -0.205 -20.670 2.033 1.00 0.00 N ATOM 662 CA TYR A 43 -0.945 -21.845 2.461 1.00 0.00 C ATOM 663 C TYR A 43 -0.996 -22.888 1.358 1.00 0.00 C ATOM 664 O TYR A 43 -0.369 -22.739 0.309 1.00 0.00 O ATOM 665 CB TYR A 43 -2.370 -21.481 2.879 1.00 0.00 C ATOM 666 CG TYR A 43 -2.479 -20.971 4.294 1.00 0.00 C ATOM 667 CD1 TYR A 43 -2.044 -21.748 5.357 1.00 0.00 C ATOM 668 CD2 TYR A 43 -3.038 -19.732 4.570 1.00 0.00 C ATOM 669 CE1 TYR A 43 -2.163 -21.308 6.656 1.00 0.00 C ATOM 670 CE2 TYR A 43 -3.155 -19.278 5.869 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.719 -20.070 6.910 1.00 0.00 C ATOM 672 OH TYR A 43 -2.847 -19.628 8.205 1.00 0.00 O ATOM 0 H TYR A 43 -0.616 -20.181 1.238 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.420 -22.259 3.321 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.755 -20.722 2.199 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -3.006 -22.359 2.769 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.604 -22.715 5.162 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -3.387 -19.113 3.757 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -1.823 -21.928 7.472 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -3.586 -18.308 6.068 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.256 -18.738 8.208 1.00 0.00 H new ATOM 682 N ASP A 44 -1.750 -23.947 1.612 1.00 0.00 N ATOM 683 CA ASP A 44 -1.931 -25.017 0.637 1.00 0.00 C ATOM 684 C ASP A 44 -2.856 -24.569 -0.478 1.00 0.00 C ATOM 685 O ASP A 44 -3.899 -23.985 -0.207 1.00 0.00 O ATOM 686 CB ASP A 44 -2.536 -26.246 1.305 1.00 0.00 C ATOM 687 CG ASP A 44 -2.763 -27.376 0.333 1.00 0.00 C ATOM 688 OD1 ASP A 44 -3.921 -27.786 0.164 1.00 0.00 O ATOM 689 OD2 ASP A 44 -1.783 -27.847 -0.276 1.00 0.00 O ATOM 0 H ASP A 44 -2.250 -24.090 2.490 1.00 0.00 H new ATOM 0 HA ASP A 44 -0.952 -25.264 0.225 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -1.875 -26.584 2.103 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.484 -25.974 1.769 1.00 0.00 H new ATOM 694 N GLU A 45 -2.490 -24.864 -1.722 1.00 0.00 N ATOM 695 CA GLU A 45 -3.309 -24.501 -2.869 1.00 0.00 C ATOM 696 C GLU A 45 -4.721 -25.053 -2.741 1.00 0.00 C ATOM 697 O GLU A 45 -5.692 -24.356 -3.031 1.00 0.00 O ATOM 698 CB GLU A 45 -2.678 -25.009 -4.159 1.00 0.00 C ATOM 699 CG GLU A 45 -1.734 -24.019 -4.814 1.00 0.00 C ATOM 700 CD GLU A 45 -1.213 -24.527 -6.138 1.00 0.00 C ATOM 701 OE1 GLU A 45 -2.017 -24.665 -7.086 1.00 0.00 O ATOM 702 OE2 GLU A 45 -0.001 -24.804 -6.237 1.00 0.00 O ATOM 0 H GLU A 45 -1.628 -25.355 -1.960 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.365 -23.413 -2.898 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.134 -25.929 -3.948 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.470 -25.262 -4.864 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.251 -23.072 -4.967 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.896 -23.821 -4.146 1.00 0.00 H new ATOM 709 N SER A 46 -4.837 -26.290 -2.274 1.00 0.00 N ATOM 710 CA SER A 46 -6.137 -26.931 -2.158 1.00 0.00 C ATOM 711 C SER A 46 -6.960 -26.269 -1.055 1.00 0.00 C ATOM 712 O SER A 46 -8.189 -26.255 -1.112 1.00 0.00 O ATOM 713 CB SER A 46 -5.980 -28.429 -1.890 1.00 0.00 C ATOM 714 OG SER A 46 -5.143 -29.037 -2.865 1.00 0.00 O ATOM 0 H SER A 46 -4.051 -26.865 -1.972 1.00 0.00 H new ATOM 0 HA SER A 46 -6.666 -26.810 -3.103 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.558 -28.582 -0.897 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.959 -28.908 -1.897 1.00 0.00 H new ATOM 0 HG SER A 46 -5.057 -29.994 -2.671 1.00 0.00 H new ATOM 720 N LYS A 47 -6.283 -25.697 -0.063 1.00 0.00 N ATOM 721 CA LYS A 47 -6.975 -24.982 0.998 1.00 0.00 C ATOM 722 C LYS A 47 -7.297 -23.563 0.548 1.00 0.00 C ATOM 723 O LYS A 47 -8.383 -23.049 0.809 1.00 0.00 O ATOM 724 CB LYS A 47 -6.132 -24.983 2.277 1.00 0.00 C ATOM 725 CG LYS A 47 -6.030 -26.364 2.911 1.00 0.00 C ATOM 726 CD LYS A 47 -5.274 -26.338 4.228 1.00 0.00 C ATOM 727 CE LYS A 47 -4.957 -27.748 4.716 1.00 0.00 C ATOM 728 NZ LYS A 47 -6.181 -28.574 4.909 1.00 0.00 N ATOM 0 H LYS A 47 -5.267 -25.715 0.026 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.915 -25.489 1.217 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.131 -24.618 2.048 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.568 -24.289 2.995 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -7.032 -26.760 3.077 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.529 -27.043 2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.348 -25.777 4.106 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.867 -25.816 4.979 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.301 -28.239 3.997 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.411 -27.689 5.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.908 -29.554 5.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.740 -28.188 5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.751 -28.558 4.040 1.00 0.00 H new ATOM 742 N ILE A 48 -6.354 -22.954 -0.156 1.00 0.00 N ATOM 743 CA ILE A 48 -6.517 -21.608 -0.684 1.00 0.00 C ATOM 744 C ILE A 48 -7.682 -21.529 -1.667 1.00 0.00 C ATOM 745 O ILE A 48 -8.551 -20.666 -1.547 1.00 0.00 O ATOM 746 CB ILE A 48 -5.228 -21.147 -1.394 1.00 0.00 C ATOM 747 CG1 ILE A 48 -4.088 -21.015 -0.385 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.455 -19.836 -2.125 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.761 -20.649 -1.010 1.00 0.00 C ATOM 0 H ILE A 48 -5.454 -23.380 -0.377 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.728 -20.953 0.162 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.951 -21.899 -2.133 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.353 -20.257 0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.979 -21.957 0.152 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.532 -19.530 -2.618 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.239 -19.966 -2.871 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.756 -19.069 -1.412 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.001 -20.573 -0.232 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.472 -21.418 -1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.852 -19.691 -1.523 1.00 0.00 H new ATOM 761 N LYS A 49 -7.694 -22.437 -2.633 1.00 0.00 N ATOM 762 CA LYS A 49 -8.724 -22.442 -3.660 1.00 0.00 C ATOM 763 C LYS A 49 -10.103 -22.670 -3.050 1.00 0.00 C ATOM 764 O LYS A 49 -11.091 -22.092 -3.503 1.00 0.00 O ATOM 765 CB LYS A 49 -8.410 -23.500 -4.724 1.00 0.00 C ATOM 766 CG LYS A 49 -7.120 -23.220 -5.480 1.00 0.00 C ATOM 767 CD LYS A 49 -6.814 -24.302 -6.500 1.00 0.00 C ATOM 768 CE LYS A 49 -5.479 -24.050 -7.184 1.00 0.00 C ATOM 769 NZ LYS A 49 -5.174 -25.077 -8.213 1.00 0.00 N ATOM 0 H LYS A 49 -7.001 -23.180 -2.726 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.734 -21.464 -4.142 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.340 -24.477 -4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.236 -23.550 -5.433 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.197 -22.257 -5.985 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.294 -23.144 -4.773 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.796 -25.275 -6.008 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.607 -24.337 -7.247 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.491 -23.064 -7.649 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.686 -24.040 -6.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.256 -24.866 -8.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.136 -26.015 -7.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.916 -25.070 -8.941 1.00 0.00 H new ATOM 783 N THR A 50 -10.160 -23.489 -2.010 1.00 0.00 N ATOM 784 CA THR A 50 -11.401 -23.726 -1.296 1.00 0.00 C ATOM 785 C THR A 50 -11.823 -22.475 -0.520 1.00 0.00 C ATOM 786 O THR A 50 -12.995 -22.101 -0.521 1.00 0.00 O ATOM 787 CB THR A 50 -11.258 -24.925 -0.337 1.00 0.00 C ATOM 788 OG1 THR A 50 -10.883 -26.094 -1.079 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.556 -25.186 0.409 1.00 0.00 C ATOM 0 H THR A 50 -9.358 -24.001 -1.643 1.00 0.00 H new ATOM 0 HA THR A 50 -12.174 -23.959 -2.028 1.00 0.00 H new ATOM 0 HB THR A 50 -10.485 -24.689 0.394 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.920 -26.248 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.426 -26.037 1.078 1.00 0.00 H new ATOM 0 HG22 THR A 50 -12.825 -24.304 0.991 1.00 0.00 H new ATOM 0 HG23 THR A 50 -13.349 -25.404 -0.306 1.00 0.00 H new ATOM 797 N ALA A 51 -10.852 -21.821 0.119 1.00 0.00 N ATOM 798 CA ALA A 51 -11.112 -20.594 0.864 1.00 0.00 C ATOM 799 C ALA A 51 -11.635 -19.497 -0.058 1.00 0.00 C ATOM 800 O ALA A 51 -12.640 -18.851 0.241 1.00 0.00 O ATOM 801 CB ALA A 51 -9.852 -20.129 1.587 1.00 0.00 C ATOM 0 H ALA A 51 -9.878 -22.123 0.134 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.880 -20.806 1.608 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.065 -19.213 2.137 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.525 -20.902 2.283 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.064 -19.940 0.859 1.00 0.00 H new ATOM 807 N LEU A 52 -10.963 -19.309 -1.193 1.00 0.00 N ATOM 808 CA LEU A 52 -11.364 -18.294 -2.165 1.00 0.00 C ATOM 809 C LEU A 52 -12.742 -18.595 -2.741 1.00 0.00 C ATOM 810 O LEU A 52 -13.544 -17.684 -2.951 1.00 0.00 O ATOM 811 CB LEU A 52 -10.335 -18.185 -3.295 1.00 0.00 C ATOM 812 CG LEU A 52 -8.983 -17.591 -2.889 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.016 -17.625 -4.060 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.160 -16.163 -2.386 1.00 0.00 C ATOM 0 H LEU A 52 -10.139 -19.846 -1.462 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.412 -17.339 -1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.168 -19.179 -3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.758 -17.574 -4.092 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.568 -18.194 -2.081 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.060 -17.199 -3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.868 -18.656 -4.380 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.425 -17.044 -4.886 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.190 -15.755 -2.101 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.594 -15.550 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.822 -16.162 -1.520 1.00 0.00 H new ATOM 826 N ASP A 53 -13.021 -19.871 -2.986 1.00 0.00 N ATOM 827 CA ASP A 53 -14.324 -20.269 -3.511 1.00 0.00 C ATOM 828 C ASP A 53 -15.410 -19.999 -2.484 1.00 0.00 C ATOM 829 O ASP A 53 -16.496 -19.547 -2.829 1.00 0.00 O ATOM 830 CB ASP A 53 -14.339 -21.748 -3.908 1.00 0.00 C ATOM 831 CG ASP A 53 -15.671 -22.169 -4.503 1.00 0.00 C ATOM 832 OD1 ASP A 53 -15.905 -21.890 -5.699 1.00 0.00 O ATOM 833 OD2 ASP A 53 -16.482 -22.789 -3.784 1.00 0.00 O ATOM 0 H ASP A 53 -12.370 -20.641 -2.832 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.517 -19.676 -4.405 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.545 -21.937 -4.630 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.125 -22.360 -3.032 1.00 0.00 H new ATOM 838 N HIS A 54 -15.106 -20.263 -1.218 1.00 0.00 N ATOM 839 CA HIS A 54 -16.038 -19.977 -0.137 1.00 0.00 C ATOM 840 C HIS A 54 -16.315 -18.478 -0.058 1.00 0.00 C ATOM 841 O HIS A 54 -17.467 -18.057 0.047 1.00 0.00 O ATOM 842 CB HIS A 54 -15.495 -20.490 1.200 1.00 0.00 C ATOM 843 CG HIS A 54 -16.407 -20.221 2.352 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.550 -20.956 2.554 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.316 -19.271 3.305 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.129 -20.432 3.620 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.415 -19.412 4.109 1.00 0.00 N ATOM 0 H HIS A 54 -14.222 -20.674 -0.917 1.00 0.00 H new ATOM 0 HA HIS A 54 -16.974 -20.495 -0.347 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.322 -21.564 1.126 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.529 -20.024 1.394 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.528 -18.540 3.413 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.059 -20.782 4.042 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.646 -18.847 4.926 1.00 0.00 H new ATOM 855 N ILE A 55 -15.250 -17.677 -0.109 1.00 0.00 N ATOM 856 CA ILE A 55 -15.386 -16.224 -0.153 1.00 0.00 C ATOM 857 C ILE A 55 -16.299 -15.816 -1.305 1.00 0.00 C ATOM 858 O ILE A 55 -17.244 -15.050 -1.121 1.00 0.00 O ATOM 859 CB ILE A 55 -14.014 -15.522 -0.315 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.102 -15.829 0.879 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.201 -14.018 -0.469 1.00 0.00 C ATOM 862 CD1 ILE A 55 -11.720 -15.211 0.771 1.00 0.00 C ATOM 0 H ILE A 55 -14.286 -18.011 -0.121 1.00 0.00 H new ATOM 0 HA ILE A 55 -15.821 -15.910 0.796 1.00 0.00 H new ATOM 0 HB ILE A 55 -13.537 -15.907 -1.217 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.580 -15.470 1.791 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.000 -16.910 0.977 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.228 -13.540 -0.582 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -14.809 -13.815 -1.351 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -14.700 -13.621 0.415 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.134 -15.473 1.652 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.221 -15.589 -0.121 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.810 -14.127 0.705 1.00 0.00 H new ATOM 874 N LYS A 56 -16.016 -16.356 -2.486 1.00 0.00 N ATOM 875 CA LYS A 56 -16.827 -16.098 -3.668 1.00 0.00 C ATOM 876 C LYS A 56 -18.270 -16.538 -3.446 1.00 0.00 C ATOM 877 O LYS A 56 -19.205 -15.798 -3.736 1.00 0.00 O ATOM 878 CB LYS A 56 -16.251 -16.834 -4.882 1.00 0.00 C ATOM 879 CG LYS A 56 -17.096 -16.683 -6.137 1.00 0.00 C ATOM 880 CD LYS A 56 -16.534 -17.478 -7.300 1.00 0.00 C ATOM 881 CE LYS A 56 -17.485 -17.449 -8.485 1.00 0.00 C ATOM 882 NZ LYS A 56 -17.004 -18.276 -9.622 1.00 0.00 N ATOM 0 H LYS A 56 -15.225 -16.979 -2.649 1.00 0.00 H new ATOM 0 HA LYS A 56 -16.812 -15.024 -3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.247 -16.460 -5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.155 -17.893 -4.643 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.114 -17.013 -5.930 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.152 -15.630 -6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.568 -17.067 -7.594 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.362 -18.509 -6.992 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.465 -17.807 -8.169 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.614 -16.419 -8.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -17.751 -18.941 -9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.764 -17.658 -10.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.160 -18.809 -9.331 1.00 0.00 H new ATOM 896 N SER A 57 -18.430 -17.746 -2.929 1.00 0.00 N ATOM 897 CA SER A 57 -19.740 -18.341 -2.722 1.00 0.00 C ATOM 898 C SER A 57 -20.608 -17.447 -1.841 1.00 0.00 C ATOM 899 O SER A 57 -21.702 -17.051 -2.238 1.00 0.00 O ATOM 900 CB SER A 57 -19.585 -19.724 -2.086 1.00 0.00 C ATOM 901 OG SER A 57 -20.625 -20.596 -2.489 1.00 0.00 O ATOM 0 H SER A 57 -17.654 -18.342 -2.641 1.00 0.00 H new ATOM 0 HA SER A 57 -20.233 -18.445 -3.689 1.00 0.00 H new ATOM 0 HB2 SER A 57 -18.622 -20.150 -2.367 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.587 -19.629 -1.000 1.00 0.00 H new ATOM 0 HG SER A 57 -20.499 -21.472 -2.068 1.00 0.00 H new ATOM 907 N GLU A 58 -20.104 -17.118 -0.657 1.00 0.00 N ATOM 908 CA GLU A 58 -20.817 -16.256 0.265 1.00 0.00 C ATOM 909 C GLU A 58 -21.112 -14.900 -0.364 1.00 0.00 C ATOM 910 O GLU A 58 -22.254 -14.439 -0.350 1.00 0.00 O ATOM 911 CB GLU A 58 -19.995 -16.069 1.541 1.00 0.00 C ATOM 912 CG GLU A 58 -20.005 -17.272 2.466 1.00 0.00 C ATOM 913 CD GLU A 58 -21.387 -17.555 3.008 1.00 0.00 C ATOM 914 OE1 GLU A 58 -21.820 -18.718 2.978 1.00 0.00 O ATOM 915 OE2 GLU A 58 -22.062 -16.592 3.436 1.00 0.00 O ATOM 0 H GLU A 58 -19.198 -17.440 -0.316 1.00 0.00 H new ATOM 0 HA GLU A 58 -21.767 -16.731 0.509 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.964 -15.844 1.267 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.377 -15.204 2.083 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.640 -18.147 1.928 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.319 -17.098 3.295 1.00 0.00 H new ATOM 922 N LEU A 59 -20.086 -14.291 -0.941 1.00 0.00 N ATOM 923 CA LEU A 59 -20.191 -12.939 -1.475 1.00 0.00 C ATOM 924 C LEU A 59 -21.156 -12.887 -2.661 1.00 0.00 C ATOM 925 O LEU A 59 -21.847 -11.889 -2.872 1.00 0.00 O ATOM 926 CB LEU A 59 -18.803 -12.445 -1.885 1.00 0.00 C ATOM 927 CG LEU A 59 -18.593 -10.936 -1.799 1.00 0.00 C ATOM 928 CD1 LEU A 59 -18.953 -10.433 -0.412 1.00 0.00 C ATOM 929 CD2 LEU A 59 -17.151 -10.587 -2.129 1.00 0.00 C ATOM 0 H LEU A 59 -19.165 -14.715 -1.052 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.591 -12.285 -0.700 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -18.061 -12.934 -1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -18.611 -12.764 -2.909 1.00 0.00 H new ATOM 0 HG LEU A 59 -19.245 -10.450 -2.525 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -18.799 -9.355 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -19.999 -10.659 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -18.321 -10.923 0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.014 -9.508 -2.064 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -16.486 -11.080 -1.420 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.918 -10.922 -3.140 1.00 0.00 H new ATOM 941 N ASP A 60 -21.211 -13.977 -3.420 1.00 0.00 N ATOM 942 CA ASP A 60 -22.121 -14.089 -4.560 1.00 0.00 C ATOM 943 C ASP A 60 -23.575 -14.065 -4.100 1.00 0.00 C ATOM 944 O ASP A 60 -24.472 -13.669 -4.846 1.00 0.00 O ATOM 945 CB ASP A 60 -21.841 -15.384 -5.334 1.00 0.00 C ATOM 946 CG ASP A 60 -22.770 -15.584 -6.517 1.00 0.00 C ATOM 947 OD1 ASP A 60 -23.755 -16.345 -6.387 1.00 0.00 O ATOM 948 OD2 ASP A 60 -22.511 -14.999 -7.590 1.00 0.00 O ATOM 0 H ASP A 60 -20.632 -14.803 -3.266 1.00 0.00 H new ATOM 0 HA ASP A 60 -21.952 -13.235 -5.215 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -20.810 -15.373 -5.687 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -21.937 -16.233 -4.657 1.00 0.00 H new ATOM 953 N LYS A 61 -23.804 -14.470 -2.856 1.00 0.00 N ATOM 954 CA LYS A 61 -25.149 -14.513 -2.301 1.00 0.00 C ATOM 955 C LYS A 61 -25.609 -13.122 -1.872 1.00 0.00 C ATOM 956 O LYS A 61 -26.738 -12.943 -1.417 1.00 0.00 O ATOM 957 CB LYS A 61 -25.196 -15.461 -1.100 1.00 0.00 C ATOM 958 CG LYS A 61 -24.586 -16.824 -1.384 1.00 0.00 C ATOM 959 CD LYS A 61 -24.884 -17.841 -0.291 1.00 0.00 C ATOM 960 CE LYS A 61 -24.010 -17.697 0.943 1.00 0.00 C ATOM 961 NZ LYS A 61 -24.062 -16.345 1.562 1.00 0.00 N ATOM 0 H LYS A 61 -23.073 -14.774 -2.213 1.00 0.00 H new ATOM 0 HA LYS A 61 -25.821 -14.878 -3.078 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -24.669 -15.002 -0.263 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -26.233 -15.592 -0.790 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -24.967 -17.197 -2.335 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -23.506 -16.719 -1.492 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -25.929 -17.746 0.004 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -24.757 -18.844 -0.698 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -24.317 -18.437 1.682 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -22.978 -17.924 0.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -23.721 -16.399 2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -23.460 -15.692 1.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -25.042 -15.998 1.555 1.00 0.00 H new ATOM 975 N CYS A 62 -24.735 -12.138 -2.012 1.00 0.00 N ATOM 976 CA CYS A 62 -25.055 -10.783 -1.598 1.00 0.00 C ATOM 977 C CYS A 62 -25.810 -10.040 -2.689 1.00 0.00 C ATOM 978 O CYS A 62 -25.223 -9.401 -3.561 1.00 0.00 O ATOM 979 CB CYS A 62 -23.790 -10.036 -1.179 1.00 0.00 C ATOM 980 SG CYS A 62 -22.914 -10.824 0.216 1.00 0.00 S ATOM 0 H CYS A 62 -23.802 -12.252 -2.408 1.00 0.00 H new ATOM 0 HA CYS A 62 -25.713 -10.836 -0.730 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -23.115 -9.971 -2.033 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -24.054 -9.015 -0.903 1.00 0.00 H new ATOM 985 N ASN A 63 -27.130 -10.165 -2.636 1.00 0.00 N ATOM 986 CA ASN A 63 -28.028 -9.484 -3.549 1.00 0.00 C ATOM 987 C ASN A 63 -29.210 -8.950 -2.765 1.00 0.00 C ATOM 988 O ASN A 63 -30.112 -9.700 -2.394 1.00 0.00 O ATOM 989 CB ASN A 63 -28.519 -10.425 -4.655 1.00 0.00 C ATOM 990 CG ASN A 63 -27.463 -10.707 -5.705 1.00 0.00 C ATOM 991 OD1 ASN A 63 -27.350 -9.984 -6.698 1.00 0.00 O ATOM 992 ND2 ASN A 63 -26.694 -11.768 -5.512 1.00 0.00 N ATOM 0 H ASN A 63 -27.608 -10.749 -1.950 1.00 0.00 H new ATOM 0 HA ASN A 63 -27.489 -8.665 -4.025 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -28.839 -11.366 -4.208 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -29.393 -9.987 -5.136 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -25.979 -12.011 -6.197 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -26.817 -12.342 -4.678 1.00 0.00 H new ATOM 999 N GLY A 64 -29.172 -7.666 -2.475 1.00 0.00 N ATOM 1000 CA GLY A 64 -30.230 -7.046 -1.710 1.00 0.00 C ATOM 1001 C GLY A 64 -29.959 -5.583 -1.432 1.00 0.00 C ATOM 1002 O GLY A 64 -29.259 -4.916 -2.197 1.00 0.00 O ATOM 0 H GLY A 64 -28.422 -7.035 -2.757 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -31.171 -7.142 -2.252 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -30.351 -7.576 -0.765 1.00 0.00 H new ATOM 1006 N ASN A 65 -30.506 -5.091 -0.332 1.00 0.00 N ATOM 1007 CA ASN A 65 -30.386 -3.683 0.027 1.00 0.00 C ATOM 1008 C ASN A 65 -29.012 -3.369 0.607 1.00 0.00 C ATOM 1009 O ASN A 65 -28.423 -2.335 0.306 1.00 0.00 O ATOM 1010 CB ASN A 65 -31.468 -3.308 1.040 1.00 0.00 C ATOM 1011 CG ASN A 65 -31.535 -1.813 1.300 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -30.834 -1.285 2.164 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -32.397 -1.126 0.566 1.00 0.00 N ATOM 0 H ASN A 65 -31.041 -5.649 0.333 1.00 0.00 H new ATOM 0 HA ASN A 65 -30.513 -3.096 -0.883 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -32.436 -3.653 0.676 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -31.277 -3.828 1.979 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -32.499 -0.121 0.706 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -32.959 -1.602 -0.140 1.00 0.00 H new ATOM 1020 N ASP A 66 -28.502 -4.271 1.433 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.251 -4.030 2.156 1.00 0.00 C ATOM 1022 C ASP A 66 -26.091 -4.795 1.534 1.00 0.00 C ATOM 1023 O ASP A 66 -25.122 -5.122 2.217 1.00 0.00 O ATOM 1024 CB ASP A 66 -27.396 -4.447 3.621 1.00 0.00 C ATOM 1025 CG ASP A 66 -28.422 -3.625 4.372 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -29.555 -4.114 4.566 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -28.091 -2.495 4.792 1.00 0.00 O ATOM 0 H ASP A 66 -28.931 -5.177 1.622 1.00 0.00 H new ATOM 0 HA ASP A 66 -27.039 -2.963 2.093 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -27.677 -5.499 3.667 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -26.430 -4.353 4.117 1.00 0.00 H new ATOM 1032 N ALA A 67 -26.165 -5.032 0.233 1.00 0.00 N ATOM 1033 CA ALA A 67 -25.176 -5.860 -0.452 1.00 0.00 C ATOM 1034 C ALA A 67 -23.784 -5.237 -0.384 1.00 0.00 C ATOM 1035 O ALA A 67 -22.812 -5.908 -0.033 1.00 0.00 O ATOM 1036 CB ALA A 67 -25.582 -6.080 -1.902 1.00 0.00 C ATOM 0 H ALA A 67 -26.899 -4.664 -0.372 1.00 0.00 H new ATOM 0 HA ALA A 67 -25.139 -6.823 0.057 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.835 -6.699 -2.399 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -26.550 -6.581 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -25.653 -5.118 -2.410 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.706 -3.950 -0.706 1.00 0.00 N ATOM 1043 CA ASP A 68 -22.440 -3.212 -0.679 1.00 0.00 C ATOM 1044 C ASP A 68 -21.803 -3.252 0.702 1.00 0.00 C ATOM 1045 O ASP A 68 -20.584 -3.376 0.840 1.00 0.00 O ATOM 1046 CB ASP A 68 -22.660 -1.750 -1.077 1.00 0.00 C ATOM 1047 CG ASP A 68 -22.920 -1.563 -2.558 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -24.078 -1.737 -2.990 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -21.972 -1.214 -3.293 1.00 0.00 O ATOM 0 H ASP A 68 -24.509 -3.389 -0.991 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.772 -3.694 -1.393 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -23.504 -1.351 -0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -21.783 -1.168 -0.793 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.636 -3.153 1.725 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.155 -3.089 3.090 1.00 0.00 C ATOM 1056 C GLN A 69 -21.636 -4.449 3.525 1.00 0.00 C ATOM 1057 O GLN A 69 -20.582 -4.548 4.151 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.266 -2.622 4.026 1.00 0.00 C ATOM 1059 CG GLN A 69 -22.753 -2.138 5.371 1.00 0.00 C ATOM 1060 CD GLN A 69 -21.785 -0.982 5.229 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -20.504 -1.293 5.109 1.00 0.00 O flip ATOM 1062 NE2 GLN A 69 -22.186 0.179 5.212 1.00 0.00 N flip ATOM 0 H GLN A 69 -23.651 -3.115 1.633 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.338 -2.369 3.138 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -23.822 -1.817 3.546 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -23.966 -3.442 4.185 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -23.595 -1.831 5.991 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.260 -2.961 5.888 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.182 0.376 5.308 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -21.523 0.946 5.102 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.373 -5.492 3.169 1.00 0.00 N ATOM 1072 CA GLN A 70 -21.975 -6.854 3.482 1.00 0.00 C ATOM 1073 C GLN A 70 -20.652 -7.202 2.814 1.00 0.00 C ATOM 1074 O GLN A 70 -19.793 -7.837 3.422 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.062 -7.826 3.036 1.00 0.00 C ATOM 1076 CG GLN A 70 -24.362 -7.672 3.807 1.00 0.00 C ATOM 1077 CD GLN A 70 -24.243 -8.090 5.263 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -23.408 -9.083 5.533 1.00 0.00 O flip ATOM 1079 NE2 GLN A 70 -24.910 -7.536 6.137 1.00 0.00 N flip ATOM 0 H GLN A 70 -23.254 -5.418 2.661 1.00 0.00 H new ATOM 0 HA GLN A 70 -21.841 -6.935 4.561 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.258 -7.678 1.974 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -22.697 -8.846 3.153 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -24.685 -6.632 3.759 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -25.136 -8.269 3.326 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -25.542 -6.775 5.890 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -24.830 -7.838 7.108 1.00 0.00 H new ATOM 1088 N LYS A 71 -20.485 -6.760 1.571 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.246 -6.997 0.831 1.00 0.00 C ATOM 1090 C LYS A 71 -18.080 -6.250 1.470 1.00 0.00 C ATOM 1091 O LYS A 71 -16.913 -6.580 1.246 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.406 -6.579 -0.634 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.426 -7.416 -1.390 1.00 0.00 C ATOM 1094 CD LYS A 71 -20.549 -6.989 -2.842 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.560 -7.849 -3.582 1.00 0.00 C ATOM 1096 NZ LYS A 71 -21.724 -7.422 -4.995 1.00 0.00 N ATOM 0 H LYS A 71 -21.191 -6.236 1.054 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.030 -8.065 0.867 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.704 -5.531 -0.675 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.441 -6.656 -1.134 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.138 -8.466 -1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.398 -7.330 -0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -20.851 -5.943 -2.892 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.577 -7.064 -3.330 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -21.241 -8.891 -3.553 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -22.522 -7.796 -3.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -22.422 -8.034 -5.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -22.054 -6.436 -5.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -20.811 -7.496 -5.488 1.00 0.00 H new ATOM 1110 N THR A 72 -18.402 -5.240 2.267 1.00 0.00 N ATOM 1111 CA THR A 72 -17.389 -4.498 3.000 1.00 0.00 C ATOM 1112 C THR A 72 -17.118 -5.146 4.363 1.00 0.00 C ATOM 1113 O THR A 72 -15.967 -5.310 4.765 1.00 0.00 O ATOM 1114 CB THR A 72 -17.812 -3.028 3.196 1.00 0.00 C ATOM 1115 OG1 THR A 72 -18.126 -2.439 1.927 1.00 0.00 O ATOM 1116 CG2 THR A 72 -16.707 -2.223 3.866 1.00 0.00 C ATOM 0 H THR A 72 -19.357 -4.917 2.421 1.00 0.00 H new ATOM 0 HA THR A 72 -16.473 -4.521 2.410 1.00 0.00 H new ATOM 0 HB THR A 72 -18.691 -3.013 3.840 1.00 0.00 H new ATOM 0 HG1 THR A 72 -18.978 -2.798 1.601 1.00 0.00 H new ATOM 0 HG21 THR A 72 -17.034 -1.191 3.991 1.00 0.00 H new ATOM 0 HG22 THR A 72 -16.484 -2.654 4.842 1.00 0.00 H new ATOM 0 HG23 THR A 72 -15.811 -2.247 3.245 1.00 0.00 H new ATOM 1124 N THR A 73 -18.182 -5.532 5.059 1.00 0.00 N ATOM 1125 CA THR A 73 -18.064 -6.124 6.387 1.00 0.00 C ATOM 1126 C THR A 73 -17.449 -7.523 6.321 1.00 0.00 C ATOM 1127 O THR A 73 -16.774 -7.963 7.255 1.00 0.00 O ATOM 1128 CB THR A 73 -19.445 -6.188 7.076 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.057 -4.891 7.046 1.00 0.00 O ATOM 1130 CG2 THR A 73 -19.321 -6.653 8.521 1.00 0.00 C ATOM 0 H THR A 73 -19.141 -5.445 4.723 1.00 0.00 H new ATOM 0 HA THR A 73 -17.402 -5.488 6.974 1.00 0.00 H new ATOM 0 HB THR A 73 -20.061 -6.907 6.535 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.325 -4.677 6.128 1.00 0.00 H new ATOM 0 HG21 THR A 73 -20.310 -6.688 8.978 1.00 0.00 H new ATOM 0 HG22 THR A 73 -18.875 -7.647 8.546 1.00 0.00 H new ATOM 0 HG23 THR A 73 -18.690 -5.958 9.074 1.00 0.00 H new ATOM 1138 N PHE A 74 -17.660 -8.203 5.197 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.132 -9.550 4.986 1.00 0.00 C ATOM 1140 C PHE A 74 -15.606 -9.552 5.092 1.00 0.00 C ATOM 1141 O PHE A 74 -15.000 -10.556 5.467 1.00 0.00 O ATOM 1142 CB PHE A 74 -17.574 -10.060 3.612 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.358 -11.532 3.382 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -17.010 -12.000 2.125 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -17.521 -12.449 4.412 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -16.833 -13.349 1.896 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.338 -13.801 4.188 1.00 0.00 C ATOM 1148 CZ PHE A 74 -16.997 -14.251 2.926 1.00 0.00 C ATOM 0 H PHE A 74 -18.198 -7.839 4.411 1.00 0.00 H new ATOM 0 HA PHE A 74 -17.524 -10.212 5.758 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -18.633 -9.839 3.482 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.036 -9.504 2.844 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -16.876 -11.300 1.314 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -17.793 -12.103 5.398 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -16.566 -13.699 0.910 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -17.461 -14.505 4.998 1.00 0.00 H new ATOM 0 HZ PHE A 74 -16.859 -15.307 2.747 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.001 -8.410 4.776 1.00 0.00 N ATOM 1159 CA LYS A 75 -13.563 -8.235 4.901 1.00 0.00 C ATOM 1160 C LYS A 75 -13.116 -8.483 6.339 1.00 0.00 C ATOM 1161 O LYS A 75 -12.132 -9.180 6.581 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.180 -6.819 4.466 1.00 0.00 C ATOM 1163 CG LYS A 75 -13.386 -6.558 2.982 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.179 -5.092 2.638 1.00 0.00 C ATOM 1165 CE LYS A 75 -13.227 -4.853 1.136 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.095 -3.409 0.795 1.00 0.00 N ATOM 0 H LYS A 75 -15.493 -7.587 4.429 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.062 -8.958 4.258 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -13.769 -6.101 5.037 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.134 -6.643 4.715 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.692 -7.169 2.405 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -14.393 -6.861 2.695 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.947 -4.492 3.126 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.217 -4.759 3.029 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -12.426 -5.414 0.654 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.167 -5.235 0.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.133 -3.291 -0.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.874 -2.876 1.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.186 -3.050 1.151 1.00 0.00 H new ATOM 1180 N GLN A 76 -13.865 -7.928 7.285 1.00 0.00 N ATOM 1181 CA GLN A 76 -13.558 -8.066 8.693 1.00 0.00 C ATOM 1182 C GLN A 76 -13.822 -9.490 9.161 1.00 0.00 C ATOM 1183 O GLN A 76 -13.116 -10.020 10.023 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.418 -7.095 9.486 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.247 -5.642 9.076 1.00 0.00 C ATOM 1186 CD GLN A 76 -15.099 -4.702 9.905 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -16.232 -5.196 10.380 1.00 0.00 O flip ATOM 1188 NE2 GLN A 76 -14.743 -3.542 10.117 1.00 0.00 N flip ATOM 0 H GLN A 76 -14.698 -7.372 7.092 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.503 -7.842 8.852 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.465 -7.374 9.369 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.178 -7.194 10.545 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.199 -5.361 9.176 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -14.508 -5.531 8.024 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -13.862 -3.200 9.732 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -15.329 -2.923 10.677 1.00 0.00 H new ATOM 1197 N THR A 77 -14.850 -10.097 8.591 1.00 0.00 N ATOM 1198 CA THR A 77 -15.202 -11.470 8.903 1.00 0.00 C ATOM 1199 C THR A 77 -14.047 -12.415 8.578 1.00 0.00 C ATOM 1200 O THR A 77 -13.675 -13.259 9.392 1.00 0.00 O ATOM 1201 CB THR A 77 -16.459 -11.896 8.122 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.533 -10.990 8.410 1.00 0.00 O ATOM 1203 CG2 THR A 77 -16.877 -13.312 8.486 1.00 0.00 C ATOM 0 H THR A 77 -15.460 -9.654 7.904 1.00 0.00 H new ATOM 0 HA THR A 77 -15.411 -11.528 9.971 1.00 0.00 H new ATOM 0 HB THR A 77 -16.226 -11.870 7.058 1.00 0.00 H new ATOM 0 HG1 THR A 77 -18.332 -11.261 7.911 1.00 0.00 H new ATOM 0 HG21 THR A 77 -17.767 -13.586 7.919 1.00 0.00 H new ATOM 0 HG22 THR A 77 -16.068 -14.003 8.247 1.00 0.00 H new ATOM 0 HG23 THR A 77 -17.096 -13.364 9.553 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.462 -12.247 7.396 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.351 -13.087 6.964 1.00 0.00 C ATOM 1213 C VAL A 78 -11.106 -12.832 7.816 1.00 0.00 C ATOM 1214 O VAL A 78 -10.330 -13.752 8.087 1.00 0.00 O ATOM 1215 CB VAL A 78 -12.030 -12.870 5.470 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -10.882 -13.761 5.025 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -13.265 -13.140 4.625 1.00 0.00 C ATOM 0 H VAL A 78 -13.740 -11.536 6.720 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.656 -14.125 7.099 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.726 -11.832 5.333 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.676 -13.589 3.969 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.993 -13.528 5.611 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.153 -14.806 5.176 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -13.027 -12.984 3.573 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -13.590 -14.170 4.775 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.064 -12.460 4.921 1.00 0.00 H new ATOM 1227 N GLN A 79 -10.938 -11.587 8.258 1.00 0.00 N ATOM 1228 CA GLN A 79 -9.849 -11.220 9.157 1.00 0.00 C ATOM 1229 C GLN A 79 -9.856 -12.097 10.406 1.00 0.00 C ATOM 1230 O GLN A 79 -8.838 -12.679 10.779 1.00 0.00 O ATOM 1231 CB GLN A 79 -9.984 -9.752 9.554 1.00 0.00 C ATOM 1232 CG GLN A 79 -9.492 -8.777 8.503 1.00 0.00 C ATOM 1233 CD GLN A 79 -8.102 -8.254 8.805 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -7.294 -8.925 9.448 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -7.813 -7.050 8.337 1.00 0.00 N ATOM 0 H GLN A 79 -11.549 -10.810 8.005 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.904 -11.372 8.636 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.031 -9.540 9.768 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.429 -9.584 10.477 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.489 -9.267 7.530 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -10.186 -7.939 8.436 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -8.511 -6.527 7.809 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -6.892 -6.645 8.505 1.00 0.00 H new ATOM 1244 N GLY A 80 -11.021 -12.198 11.034 1.00 0.00 N ATOM 1245 CA GLY A 80 -11.151 -13.000 12.236 1.00 0.00 C ATOM 1246 C GLY A 80 -11.228 -14.481 11.923 1.00 0.00 C ATOM 1247 O GLY A 80 -10.968 -15.323 12.781 1.00 0.00 O ATOM 0 H GLY A 80 -11.880 -11.738 10.732 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.301 -12.811 12.892 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.046 -12.697 12.779 1.00 0.00 H new ATOM 1251 N ALA A 81 -11.575 -14.796 10.685 1.00 0.00 N ATOM 1252 CA ALA A 81 -11.706 -16.178 10.253 1.00 0.00 C ATOM 1253 C ALA A 81 -10.342 -16.823 10.037 1.00 0.00 C ATOM 1254 O ALA A 81 -10.134 -17.986 10.379 1.00 0.00 O ATOM 1255 CB ALA A 81 -12.535 -16.258 8.985 1.00 0.00 C ATOM 0 H ALA A 81 -11.772 -14.108 9.958 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.215 -16.729 11.043 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -12.624 -17.299 8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -13.528 -15.849 9.173 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -12.049 -15.684 8.196 1.00 0.00 H new ATOM 1261 N LEU A 82 -9.410 -16.058 9.476 1.00 0.00 N ATOM 1262 CA LEU A 82 -8.055 -16.547 9.251 1.00 0.00 C ATOM 1263 C LEU A 82 -7.263 -16.514 10.545 1.00 0.00 C ATOM 1264 O LEU A 82 -6.140 -17.013 10.626 1.00 0.00 O ATOM 1265 CB LEU A 82 -7.351 -15.729 8.164 1.00 0.00 C ATOM 1266 CG LEU A 82 -7.996 -15.795 6.776 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -7.255 -14.895 5.801 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -8.018 -17.230 6.267 1.00 0.00 C ATOM 0 H LEU A 82 -9.569 -15.098 9.169 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.115 -17.579 8.906 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.316 -14.687 8.482 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.320 -16.072 8.084 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.024 -15.442 6.856 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.727 -14.955 4.820 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.289 -13.866 6.158 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.217 -15.218 5.724 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.479 -17.259 5.280 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.998 -17.609 6.202 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.592 -17.851 6.954 1.00 0.00 H new ATOM 1280 N SER A 83 -7.885 -15.955 11.561 1.00 0.00 N ATOM 1281 CA SER A 83 -7.317 -15.918 12.896 1.00 0.00 C ATOM 1282 C SER A 83 -7.614 -17.244 13.588 1.00 0.00 C ATOM 1283 O SER A 83 -8.277 -17.304 14.625 1.00 0.00 O ATOM 1284 CB SER A 83 -7.880 -14.737 13.694 1.00 0.00 C ATOM 1285 OG SER A 83 -7.220 -14.592 14.944 1.00 0.00 O ATOM 0 H SER A 83 -8.801 -15.512 11.487 1.00 0.00 H new ATOM 0 HA SER A 83 -6.238 -15.777 12.834 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.771 -13.820 13.115 1.00 0.00 H new ATOM 0 HB3 SER A 83 -8.947 -14.884 13.860 1.00 0.00 H new ATOM 0 HG SER A 83 -7.600 -13.830 15.428 1.00 0.00 H new ATOM 1291 N GLY A 84 -7.138 -18.305 12.967 1.00 0.00 N ATOM 1292 CA GLY A 84 -7.363 -19.644 13.473 1.00 0.00 C ATOM 1293 C GLY A 84 -6.845 -20.715 12.529 1.00 0.00 C ATOM 1294 O GLY A 84 -6.733 -21.881 12.908 1.00 0.00 O ATOM 0 H GLY A 84 -6.591 -18.265 12.107 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -6.874 -19.750 14.442 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -8.430 -19.793 13.636 1.00 0.00 H new ATOM 1298 N GLY A 85 -6.541 -20.327 11.295 1.00 0.00 N ATOM 1299 CA GLY A 85 -6.017 -21.264 10.335 1.00 0.00 C ATOM 1300 C GLY A 85 -6.937 -21.399 9.148 1.00 0.00 C ATOM 1301 O GLY A 85 -8.158 -21.352 9.296 1.00 0.00 O ATOM 0 H GLY A 85 -6.651 -19.374 10.947 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.033 -20.934 10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.884 -22.237 10.808 1.00 0.00 H new ATOM 1305 N ILE A 86 -6.356 -21.548 7.971 1.00 0.00 N ATOM 1306 CA ILE A 86 -7.134 -21.699 6.750 1.00 0.00 C ATOM 1307 C ILE A 86 -7.872 -23.040 6.755 1.00 0.00 C ATOM 1308 O ILE A 86 -8.906 -23.202 6.107 1.00 0.00 O ATOM 1309 CB ILE A 86 -6.229 -21.594 5.508 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -7.065 -21.521 4.229 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.267 -22.772 5.457 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.248 -21.210 2.998 1.00 0.00 C ATOM 0 H ILE A 86 -5.346 -21.568 7.833 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.867 -20.893 6.709 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.648 -20.675 5.581 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.579 -22.471 4.085 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -7.834 -20.758 4.349 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.633 -22.686 4.575 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.645 -22.773 6.352 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.833 -23.702 5.408 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -6.902 -21.173 2.127 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -5.755 -20.246 3.123 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.496 -21.986 2.854 1.00 0.00 H new ATOM 1324 N ASP A 87 -7.337 -23.994 7.506 1.00 0.00 N ATOM 1325 CA ASP A 87 -7.980 -25.289 7.661 1.00 0.00 C ATOM 1326 C ASP A 87 -9.069 -25.178 8.719 1.00 0.00 C ATOM 1327 O ASP A 87 -8.795 -25.244 9.918 1.00 0.00 O ATOM 1328 CB ASP A 87 -6.961 -26.362 8.052 1.00 0.00 C ATOM 1329 CG ASP A 87 -7.564 -27.749 8.064 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -7.824 -28.291 6.970 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -7.760 -28.315 9.156 1.00 0.00 O ATOM 0 H ASP A 87 -6.460 -23.894 8.017 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.423 -25.585 6.710 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.125 -26.338 7.353 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.558 -26.135 9.039 1.00 0.00 H new ATOM 1336 N GLY A 88 -10.292 -24.967 8.267 1.00 0.00 N ATOM 1337 CA GLY A 88 -11.393 -24.715 9.176 1.00 0.00 C ATOM 1338 C GLY A 88 -12.148 -23.465 8.783 1.00 0.00 C ATOM 1339 O GLY A 88 -13.230 -23.187 9.302 1.00 0.00 O ATOM 0 H GLY A 88 -10.546 -24.965 7.279 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.071 -25.568 9.176 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -11.013 -24.610 10.192 1.00 0.00 H new ATOM 1343 N PHE A 89 -11.557 -22.707 7.865 1.00 0.00 N ATOM 1344 CA PHE A 89 -12.201 -21.536 7.291 1.00 0.00 C ATOM 1345 C PHE A 89 -13.441 -21.972 6.518 1.00 0.00 C ATOM 1346 O PHE A 89 -13.344 -22.722 5.546 1.00 0.00 O ATOM 1347 CB PHE A 89 -11.217 -20.801 6.368 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.775 -19.579 5.680 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -11.657 -18.324 6.259 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -12.402 -19.685 4.446 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -12.153 -17.202 5.621 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -12.902 -18.567 3.807 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.778 -17.323 4.396 1.00 0.00 C ATOM 0 H PHE A 89 -10.622 -22.888 7.501 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.502 -20.853 8.086 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -10.347 -20.504 6.953 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.866 -21.499 5.607 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -11.172 -18.222 7.219 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -12.500 -20.654 3.980 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -12.051 -16.230 6.081 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -13.389 -18.665 2.848 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.169 -16.447 3.899 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.596 -21.526 6.974 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.839 -21.900 6.335 1.00 0.00 C ATOM 1365 C GLY A 90 -17.025 -21.203 6.959 1.00 0.00 C ATOM 1366 O GLY A 90 -16.862 -20.204 7.658 1.00 0.00 O ATOM 0 H GLY A 90 -14.698 -20.908 7.779 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.790 -21.654 5.274 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.973 -22.979 6.406 1.00 0.00 H new ATOM 1370 N SER A 91 -18.213 -21.755 6.743 1.00 0.00 N ATOM 1371 CA SER A 91 -19.458 -21.143 7.203 1.00 0.00 C ATOM 1372 C SER A 91 -19.583 -21.166 8.729 1.00 0.00 C ATOM 1373 O SER A 91 -20.515 -20.594 9.296 1.00 0.00 O ATOM 1374 CB SER A 91 -20.646 -21.865 6.567 1.00 0.00 C ATOM 1375 OG SER A 91 -20.511 -23.269 6.700 1.00 0.00 O ATOM 0 H SER A 91 -18.343 -22.636 6.246 1.00 0.00 H new ATOM 0 HA SER A 91 -19.450 -20.097 6.896 1.00 0.00 H new ATOM 0 HB2 SER A 91 -21.572 -21.538 7.040 1.00 0.00 H new ATOM 0 HB3 SER A 91 -20.716 -21.600 5.512 1.00 0.00 H new ATOM 0 HG SER A 91 -21.282 -23.712 6.288 1.00 0.00 H new ATOM 1381 N ASN A 92 -18.636 -21.814 9.391 1.00 0.00 N ATOM 1382 CA ASN A 92 -18.667 -21.941 10.841 1.00 0.00 C ATOM 1383 C ASN A 92 -18.035 -20.735 11.517 1.00 0.00 C ATOM 1384 O ASN A 92 -18.130 -20.583 12.735 1.00 0.00 O ATOM 1385 CB ASN A 92 -17.959 -23.221 11.282 1.00 0.00 C ATOM 1386 CG ASN A 92 -18.769 -24.459 10.959 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -18.679 -25.004 9.860 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -19.575 -24.908 11.908 1.00 0.00 N ATOM 0 H ASN A 92 -17.835 -22.261 8.946 1.00 0.00 H new ATOM 0 HA ASN A 92 -19.712 -21.991 11.146 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.988 -23.285 10.791 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -17.772 -23.180 12.355 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -20.150 -25.734 11.741 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -19.622 -24.428 12.807 1.00 0.00 H new ATOM 1395 N ASN A 93 -17.388 -19.878 10.736 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.770 -18.679 11.293 1.00 0.00 C ATOM 1397 C ASN A 93 -16.783 -17.520 10.296 1.00 0.00 C ATOM 1398 O ASN A 93 -16.890 -16.358 10.690 1.00 0.00 O ATOM 1399 CB ASN A 93 -15.338 -18.966 11.778 1.00 0.00 C ATOM 1400 CG ASN A 93 -14.362 -19.336 10.672 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -14.738 -19.894 9.639 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -13.092 -19.036 10.895 1.00 0.00 N ATOM 0 H ASN A 93 -17.278 -19.987 9.728 1.00 0.00 H new ATOM 0 HA ASN A 93 -17.367 -18.379 12.154 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.961 -18.086 12.299 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.369 -19.778 12.505 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.384 -19.267 10.198 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.822 -18.574 11.763 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.690 -17.829 9.010 1.00 0.00 N ATOM 1410 CA ALA A 94 -16.699 -16.803 7.977 1.00 0.00 C ATOM 1411 C ALA A 94 -17.921 -16.940 7.080 1.00 0.00 C ATOM 1412 O ALA A 94 -17.970 -17.812 6.213 1.00 0.00 O ATOM 1413 CB ALA A 94 -15.428 -16.876 7.150 1.00 0.00 C ATOM 0 H ALA A 94 -16.607 -18.782 8.657 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.746 -15.830 8.467 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -15.449 -16.103 6.382 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -14.564 -16.722 7.796 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.357 -17.856 6.677 1.00 0.00 H new ATOM 1419 N VAL A 95 -18.913 -16.092 7.301 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.116 -16.110 6.490 1.00 0.00 C ATOM 1421 C VAL A 95 -20.550 -14.710 6.118 1.00 0.00 C ATOM 1422 O VAL A 95 -20.235 -13.740 6.810 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.303 -16.788 7.207 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.184 -18.296 7.139 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.400 -16.321 8.653 1.00 0.00 C ATOM 0 H VAL A 95 -18.907 -15.384 8.035 1.00 0.00 H new ATOM 0 HA VAL A 95 -19.856 -16.682 5.599 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.219 -16.496 6.693 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -22.032 -18.751 7.651 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.176 -18.614 6.096 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.258 -18.610 7.621 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -22.244 -16.812 9.138 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.480 -16.575 9.180 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.546 -15.241 8.678 1.00 0.00 H new ATOM 1435 N THR A 96 -21.260 -14.615 5.017 1.00 0.00 N ATOM 1436 CA THR A 96 -21.993 -13.416 4.707 1.00 0.00 C ATOM 1437 C THR A 96 -23.433 -13.612 5.132 1.00 0.00 C ATOM 1438 O THR A 96 -24.077 -14.585 4.736 1.00 0.00 O ATOM 1439 CB THR A 96 -21.967 -13.082 3.205 1.00 0.00 C ATOM 1440 OG1 THR A 96 -22.419 -14.209 2.450 1.00 0.00 O ATOM 1441 CG2 THR A 96 -20.575 -12.684 2.753 1.00 0.00 C ATOM 0 H THR A 96 -21.343 -15.357 4.322 1.00 0.00 H new ATOM 0 HA THR A 96 -21.522 -12.589 5.239 1.00 0.00 H new ATOM 0 HB THR A 96 -22.633 -12.236 3.034 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.594 -14.959 3.055 1.00 0.00 H new ATOM 0 HG21 THR A 96 -20.590 -12.454 1.688 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.249 -11.805 3.309 1.00 0.00 H new ATOM 0 HG23 THR A 96 -19.884 -13.506 2.937 1.00 0.00 H new ATOM 1449 N THR A 97 -23.943 -12.706 5.941 1.00 0.00 N ATOM 1450 CA THR A 97 -25.345 -12.726 6.317 1.00 0.00 C ATOM 1451 C THR A 97 -26.219 -12.256 5.146 1.00 0.00 C ATOM 1452 O THR A 97 -27.304 -11.700 5.327 1.00 0.00 O ATOM 1453 CB THR A 97 -25.569 -11.848 7.560 1.00 0.00 C ATOM 1454 OG1 THR A 97 -24.838 -10.624 7.424 1.00 0.00 O ATOM 1455 CG2 THR A 97 -25.118 -12.578 8.819 1.00 0.00 C ATOM 0 H THR A 97 -23.406 -11.943 6.353 1.00 0.00 H new ATOM 0 HA THR A 97 -25.633 -13.748 6.562 1.00 0.00 H new ATOM 0 HB THR A 97 -26.633 -11.630 7.646 1.00 0.00 H new ATOM 0 HG1 THR A 97 -24.666 -10.450 6.475 1.00 0.00 H new ATOM 0 HG21 THR A 97 -25.284 -11.941 9.688 1.00 0.00 H new ATOM 0 HG22 THR A 97 -25.690 -13.500 8.930 1.00 0.00 H new ATOM 0 HG23 THR A 97 -24.057 -12.816 8.741 1.00 0.00 H new ATOM 1463 N CYS A 98 -25.736 -12.532 3.937 1.00 0.00 N ATOM 1464 CA CYS A 98 -26.399 -12.130 2.716 1.00 0.00 C ATOM 1465 C CYS A 98 -27.501 -13.111 2.348 1.00 0.00 C ATOM 1466 O CYS A 98 -27.259 -14.128 1.698 1.00 0.00 O ATOM 1467 CB CYS A 98 -25.383 -12.022 1.579 1.00 0.00 C ATOM 1468 SG CYS A 98 -24.205 -10.644 1.777 1.00 0.00 S ATOM 0 H CYS A 98 -24.867 -13.045 3.785 1.00 0.00 H new ATOM 0 HA CYS A 98 -26.855 -11.153 2.878 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -24.827 -12.957 1.511 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -25.917 -11.899 0.637 1.00 0.00 H new ATOM 1473 N GLY A 99 -28.695 -12.813 2.824 1.00 0.00 N ATOM 1474 CA GLY A 99 -29.876 -13.571 2.467 1.00 0.00 C ATOM 1475 C GLY A 99 -31.102 -12.716 2.657 1.00 0.00 C ATOM 1476 O GLY A 99 -32.168 -13.194 3.046 1.00 0.00 O ATOM 0 H GLY A 99 -28.872 -12.041 3.467 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -29.808 -13.902 1.431 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -29.946 -14.467 3.084 1.00 0.00 H new ATOM 1480 N ASN A 100 -30.929 -11.435 2.368 1.00 0.00 N ATOM 1481 CA ASN A 100 -31.912 -10.418 2.700 1.00 0.00 C ATOM 1482 C ASN A 100 -32.896 -10.210 1.558 1.00 0.00 C ATOM 1483 O ASN A 100 -32.587 -10.484 0.396 1.00 0.00 O ATOM 1484 CB ASN A 100 -31.184 -9.114 3.043 1.00 0.00 C ATOM 1485 CG ASN A 100 -32.104 -8.023 3.552 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -32.495 -7.122 2.811 1.00 0.00 O ATOM 1487 ND2 ASN A 100 -32.464 -8.111 4.820 1.00 0.00 N ATOM 0 H ASN A 100 -30.101 -11.072 1.896 1.00 0.00 H new ATOM 0 HA ASN A 100 -32.490 -10.747 3.564 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -30.425 -9.319 3.798 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -30.663 -8.754 2.156 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -33.091 -7.414 5.222 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -32.115 -8.876 5.397 1.00 0.00 H new ATOM 1494 N GLY A 101 -34.085 -9.748 1.903 1.00 0.00 N ATOM 1495 CA GLY A 101 -35.108 -9.499 0.915 1.00 0.00 C ATOM 1496 C GLY A 101 -36.457 -9.275 1.561 1.00 0.00 C ATOM 1497 O GLY A 101 -36.748 -8.182 2.052 1.00 0.00 O ATOM 0 H GLY A 101 -34.362 -9.539 2.862 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -34.838 -8.626 0.322 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -35.167 -10.344 0.229 1.00 0.00 H new ATOM 1501 N SER A 102 -37.273 -10.316 1.584 1.00 0.00 N ATOM 1502 CA SER A 102 -38.582 -10.246 2.202 1.00 0.00 C ATOM 1503 C SER A 102 -39.098 -11.661 2.445 1.00 0.00 C ATOM 1504 O SER A 102 -39.668 -12.258 1.507 1.00 0.00 O ATOM 1505 CB SER A 102 -39.551 -9.460 1.306 1.00 0.00 C ATOM 1506 OG SER A 102 -40.496 -8.736 2.077 1.00 0.00 O ATOM 0 H SER A 102 -37.048 -11.224 1.178 1.00 0.00 H new ATOM 0 HA SER A 102 -38.508 -9.725 3.157 1.00 0.00 H new ATOM 0 HB2 SER A 102 -38.989 -8.771 0.676 1.00 0.00 H new ATOM 0 HB3 SER A 102 -40.072 -10.148 0.640 1.00 0.00 H new ATOM 0 HG SER A 102 -41.098 -8.245 1.480 1.00 0.00 H new TER 1512 SER A 102