USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 938 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 83 ASN : amide:sc= -1.13 K(o=-1.2,f=-4.5!) USER MOD Set 1.2: A 114 SER OG : rot 180:sc= -0.0332 USER MOD Set 2.1: A 31 MET CE :methyl -163:sc= 0 (180deg=-0.0836) USER MOD Set 2.2: A 105 THR OG1 : rot -130:sc= -2.21 USER MOD Set 3.1: A 8 SER OG : rot -53:sc= -4.49! USER MOD Set 3.2: A 27 MET CE :methyl 155:sc= -2.57! (180deg=-3.68!) USER MOD Single : A 1 MET CE :methyl -132:sc= -0.123 (180deg=-0.697) USER MOD Single : A 1 MET N :NH3+ -147:sc= -0.588 (180deg=-2.6!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 0:sc= -0.175 USER MOD Single : A 10 THR OG1 : rot 40:sc= -2.21! USER MOD Single : A 14 SER OG : rot 150:sc= 0.542 USER MOD Single : A 17 SER OG : rot -135:sc= 0.28 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.336 X(o=-0.34,f=-0.14) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 33:sc= 1 USER MOD Single : A 44 ASN : amide:sc= -0.35 K(o=-0.35,f=-3.3!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0.0492 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0.014) USER MOD Single : A 63 ASN : amide:sc= -0.117 X(o=-0.12,f=0) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 67:sc= 1.03 USER MOD Single : A 73 SER OG : rot -130:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.5!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= -0.0842 USER MOD Single : A 93 THR OG1 : rot -92:sc= 0.105 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0.165 USER MOD Single : A 100 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.9!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= -0.225 K(o=-0.23,f=-2.9!) USER MOD Single : A 117 SER OG : rot -58:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.089 1.620 -3.580 1.00 0.00 N ATOM 2 CA MET A 1 7.969 1.340 -4.522 1.00 0.00 C ATOM 3 C MET A 1 6.684 1.093 -3.728 1.00 0.00 C ATOM 4 O MET A 1 6.688 0.413 -2.721 1.00 0.00 O ATOM 5 CB MET A 1 8.300 0.100 -5.354 1.00 0.00 C ATOM 6 CG MET A 1 9.723 0.217 -5.899 1.00 0.00 C ATOM 7 SD MET A 1 9.673 0.881 -7.583 1.00 0.00 S ATOM 8 CE MET A 1 9.029 -0.605 -8.391 1.00 0.00 C ATOM 0 H1 MET A 1 9.751 2.293 -4.017 1.00 0.00 H new ATOM 0 H2 MET A 1 8.710 2.028 -2.702 1.00 0.00 H new ATOM 0 H3 MET A 1 9.589 0.735 -3.362 1.00 0.00 H new ATOM 0 HA MET A 1 7.829 2.195 -5.184 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.206 -0.797 -4.742 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.591 0.001 -6.176 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.317 0.868 -5.258 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.206 -0.760 -5.896 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.624 -0.824 -9.277 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.082 -1.447 -7.701 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.992 -0.440 -8.683 1.00 0.00 H new ATOM 20 N LYS A 2 5.585 1.639 -4.174 1.00 0.00 N ATOM 21 CA LYS A 2 4.303 1.433 -3.443 1.00 0.00 C ATOM 22 C LYS A 2 3.287 0.764 -4.370 1.00 0.00 C ATOM 23 O LYS A 2 3.152 1.125 -5.524 1.00 0.00 O ATOM 24 CB LYS A 2 3.754 2.784 -2.979 1.00 0.00 C ATOM 25 CG LYS A 2 4.586 3.300 -1.802 1.00 0.00 C ATOM 26 CD LYS A 2 4.773 4.813 -1.934 1.00 0.00 C ATOM 27 CE LYS A 2 5.162 5.401 -0.575 1.00 0.00 C ATOM 28 NZ LYS A 2 4.032 6.213 -0.043 1.00 0.00 N ATOM 0 H LYS A 2 5.520 2.218 -5.011 1.00 0.00 H new ATOM 0 HA LYS A 2 4.481 0.796 -2.577 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.783 3.501 -3.800 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.710 2.681 -2.682 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.089 3.065 -0.861 1.00 0.00 H new ATOM 0 HG3 LYS A 2 5.556 2.803 -1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.546 5.031 -2.671 1.00 0.00 H new ATOM 0 HD3 LYS A 2 3.852 5.274 -2.291 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.408 4.600 0.122 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.053 6.021 -0.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 4.296 6.613 0.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.817 6.985 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.193 5.609 0.068 1.00 0.00 H new ATOM 42 N ILE A 3 2.568 -0.206 -3.874 1.00 0.00 N ATOM 43 CA ILE A 3 1.559 -0.897 -4.724 1.00 0.00 C ATOM 44 C ILE A 3 0.157 -0.617 -4.178 1.00 0.00 C ATOM 45 O ILE A 3 -0.227 -1.118 -3.140 1.00 0.00 O ATOM 46 CB ILE A 3 1.821 -2.405 -4.705 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.243 -2.682 -5.200 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.819 -3.110 -5.620 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.907 -3.722 -4.294 1.00 0.00 C ATOM 0 H ILE A 3 2.636 -0.549 -2.916 1.00 0.00 H new ATOM 0 HA ILE A 3 1.632 -0.529 -5.747 1.00 0.00 H new ATOM 0 HB ILE A 3 1.709 -2.779 -3.687 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.217 -3.043 -6.228 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.825 -1.760 -5.201 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.006 -4.184 -5.606 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.194 -2.914 -5.270 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.930 -2.736 -6.638 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.919 -3.919 -4.647 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.946 -3.343 -3.273 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.329 -4.646 -4.316 1.00 0.00 H new ATOM 61 N ALA A 4 -0.611 0.180 -4.870 1.00 0.00 N ATOM 62 CA ALA A 4 -1.988 0.490 -4.391 1.00 0.00 C ATOM 63 C ALA A 4 -3.008 -0.130 -5.348 1.00 0.00 C ATOM 64 O ALA A 4 -2.955 0.075 -6.544 1.00 0.00 O ATOM 65 CB ALA A 4 -2.184 2.007 -4.346 1.00 0.00 C ATOM 0 H ALA A 4 -0.344 0.630 -5.746 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.129 0.078 -3.392 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.191 2.234 -3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.455 2.448 -3.666 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.045 2.422 -5.345 1.00 0.00 H new ATOM 71 N ILE A 5 -3.936 -0.888 -4.831 1.00 0.00 N ATOM 72 CA ILE A 5 -4.956 -1.523 -5.713 1.00 0.00 C ATOM 73 C ILE A 5 -6.275 -0.755 -5.606 1.00 0.00 C ATOM 74 O ILE A 5 -6.676 -0.338 -4.537 1.00 0.00 O ATOM 75 CB ILE A 5 -5.173 -2.974 -5.280 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.822 -3.688 -5.197 1.00 0.00 C ATOM 77 CG2 ILE A 5 -6.063 -3.686 -6.302 1.00 0.00 C ATOM 78 CD1 ILE A 5 -4.042 -5.159 -4.836 1.00 0.00 C ATOM 0 H ILE A 5 -4.032 -1.095 -3.837 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.607 -1.501 -6.745 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.656 -2.992 -4.303 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.299 -3.611 -6.150 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -3.191 -3.209 -4.448 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.217 -4.720 -5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.026 -3.178 -6.363 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.581 -3.668 -7.279 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -3.079 -5.667 -4.777 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.547 -5.226 -3.872 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.656 -5.633 -5.601 1.00 0.00 H new ATOM 90 N ALA A 6 -6.951 -0.567 -6.705 1.00 0.00 N ATOM 91 CA ALA A 6 -8.244 0.172 -6.667 1.00 0.00 C ATOM 92 C ALA A 6 -9.340 -0.748 -6.126 1.00 0.00 C ATOM 93 O ALA A 6 -9.143 -1.937 -5.972 1.00 0.00 O ATOM 94 CB ALA A 6 -8.614 0.628 -8.080 1.00 0.00 C ATOM 0 H ALA A 6 -6.664 -0.893 -7.628 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.146 1.043 -6.019 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.560 1.169 -8.052 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.833 1.283 -8.467 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.713 -0.242 -8.729 1.00 0.00 H new ATOM 100 N SER A 7 -10.493 -0.210 -5.838 1.00 0.00 N ATOM 101 CA SER A 7 -11.597 -1.059 -5.308 1.00 0.00 C ATOM 102 C SER A 7 -11.051 -1.969 -4.201 1.00 0.00 C ATOM 103 O SER A 7 -10.227 -1.562 -3.406 1.00 0.00 O ATOM 104 CB SER A 7 -12.170 -1.906 -6.445 1.00 0.00 C ATOM 105 OG SER A 7 -11.254 -2.946 -6.763 1.00 0.00 O ATOM 0 H SER A 7 -10.718 0.779 -5.946 1.00 0.00 H new ATOM 0 HA SER A 7 -12.385 -0.429 -4.896 1.00 0.00 H new ATOM 0 HB2 SER A 7 -13.130 -2.329 -6.151 1.00 0.00 H new ATOM 0 HB3 SER A 7 -12.351 -1.284 -7.322 1.00 0.00 H new ATOM 0 HG SER A 7 -10.471 -2.883 -6.177 1.00 0.00 H new ATOM 111 N SER A 8 -11.502 -3.195 -4.139 1.00 0.00 N ATOM 112 CA SER A 8 -11.004 -4.119 -3.081 1.00 0.00 C ATOM 113 C SER A 8 -11.404 -3.581 -1.707 1.00 0.00 C ATOM 114 O SER A 8 -10.585 -3.440 -0.821 1.00 0.00 O ATOM 115 CB SER A 8 -9.481 -4.225 -3.165 1.00 0.00 C ATOM 116 OG SER A 8 -9.018 -5.128 -2.169 1.00 0.00 O ATOM 0 H SER A 8 -12.192 -3.594 -4.775 1.00 0.00 H new ATOM 0 HA SER A 8 -11.442 -5.106 -3.227 1.00 0.00 H new ATOM 0 HB2 SER A 8 -9.183 -4.572 -4.154 1.00 0.00 H new ATOM 0 HB3 SER A 8 -9.028 -3.244 -3.022 1.00 0.00 H new ATOM 0 HG SER A 8 -9.370 -4.859 -1.295 1.00 0.00 H new ATOM 122 N GLY A 9 -12.659 -3.280 -1.524 1.00 0.00 N ATOM 123 CA GLY A 9 -13.116 -2.751 -0.208 1.00 0.00 C ATOM 124 C GLY A 9 -12.623 -3.666 0.914 1.00 0.00 C ATOM 125 O GLY A 9 -13.129 -4.754 1.107 1.00 0.00 O ATOM 0 H GLY A 9 -13.389 -3.377 -2.229 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -12.736 -1.740 -0.060 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.204 -2.689 -0.188 1.00 0.00 H new ATOM 129 N THR A 10 -11.640 -3.233 1.656 1.00 0.00 N ATOM 130 CA THR A 10 -11.113 -4.072 2.770 1.00 0.00 C ATOM 131 C THR A 10 -10.843 -5.493 2.269 1.00 0.00 C ATOM 132 O THR A 10 -9.763 -5.801 1.804 1.00 0.00 O ATOM 133 CB THR A 10 -12.140 -4.116 3.904 1.00 0.00 C ATOM 134 OG1 THR A 10 -13.446 -4.229 3.356 1.00 0.00 O ATOM 135 CG2 THR A 10 -12.042 -2.834 4.732 1.00 0.00 C ATOM 0 H THR A 10 -11.178 -2.331 1.538 1.00 0.00 H new ATOM 0 HA THR A 10 -10.182 -3.639 3.136 1.00 0.00 H new ATOM 0 HB THR A 10 -11.939 -4.976 4.543 1.00 0.00 H new ATOM 0 HG1 THR A 10 -13.430 -4.849 2.597 1.00 0.00 H new ATOM 0 HG21 THR A 10 -12.773 -2.866 5.539 1.00 0.00 H new ATOM 0 HG22 THR A 10 -11.040 -2.748 5.153 1.00 0.00 H new ATOM 0 HG23 THR A 10 -12.242 -1.973 4.094 1.00 0.00 H new ATOM 143 N ASP A 11 -11.811 -6.363 2.364 1.00 0.00 N ATOM 144 CA ASP A 11 -11.601 -7.763 1.898 1.00 0.00 C ATOM 145 C ASP A 11 -12.817 -8.613 2.274 1.00 0.00 C ATOM 146 O ASP A 11 -13.925 -8.124 2.361 1.00 0.00 O ATOM 147 CB ASP A 11 -10.349 -8.338 2.564 1.00 0.00 C ATOM 148 CG ASP A 11 -9.498 -9.058 1.516 1.00 0.00 C ATOM 149 OD1 ASP A 11 -10.074 -9.696 0.650 1.00 0.00 O ATOM 150 OD2 ASP A 11 -8.285 -8.957 1.598 1.00 0.00 O ATOM 0 H ASP A 11 -12.737 -6.165 2.744 1.00 0.00 H new ATOM 0 HA ASP A 11 -11.473 -7.772 0.816 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -9.772 -7.539 3.030 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -10.631 -9.031 3.357 1.00 0.00 H new ATOM 155 N LEU A 12 -12.618 -9.884 2.497 1.00 0.00 N ATOM 156 CA LEU A 12 -13.763 -10.763 2.866 1.00 0.00 C ATOM 157 C LEU A 12 -14.674 -10.945 1.652 1.00 0.00 C ATOM 158 O LEU A 12 -15.787 -11.419 1.763 1.00 0.00 O ATOM 159 CB LEU A 12 -14.557 -10.118 4.007 1.00 0.00 C ATOM 160 CG LEU A 12 -15.487 -11.160 4.630 1.00 0.00 C ATOM 161 CD1 LEU A 12 -14.679 -12.085 5.542 1.00 0.00 C ATOM 162 CD2 LEU A 12 -16.566 -10.451 5.452 1.00 0.00 C ATOM 0 H LEU A 12 -11.713 -10.351 2.440 1.00 0.00 H new ATOM 0 HA LEU A 12 -13.387 -11.734 3.190 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.876 -9.724 4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -15.137 -9.275 3.630 1.00 0.00 H new ATOM 0 HG LEU A 12 -15.956 -11.747 3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -15.342 -12.828 5.986 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -13.908 -12.589 4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -14.210 -11.498 6.332 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -17.230 -11.192 5.897 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.096 -9.865 6.241 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -17.142 -9.790 4.804 1.00 0.00 H new ATOM 174 N GLY A 13 -14.210 -10.571 0.491 1.00 0.00 N ATOM 175 CA GLY A 13 -15.049 -10.724 -0.731 1.00 0.00 C ATOM 176 C GLY A 13 -14.765 -9.569 -1.693 1.00 0.00 C ATOM 177 O GLY A 13 -14.977 -9.675 -2.885 1.00 0.00 O ATOM 0 H GLY A 13 -13.287 -10.166 0.336 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.834 -11.676 -1.216 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -16.105 -10.735 -0.461 1.00 0.00 H new ATOM 181 N SER A 14 -14.287 -8.465 -1.187 1.00 0.00 N ATOM 182 CA SER A 14 -13.990 -7.304 -2.072 1.00 0.00 C ATOM 183 C SER A 14 -12.679 -7.550 -2.820 1.00 0.00 C ATOM 184 O SER A 14 -11.629 -7.083 -2.424 1.00 0.00 O ATOM 185 CB SER A 14 -13.863 -6.039 -1.224 1.00 0.00 C ATOM 186 OG SER A 14 -15.063 -5.846 -0.486 1.00 0.00 O ATOM 0 H SER A 14 -14.089 -8.317 -0.197 1.00 0.00 H new ATOM 0 HA SER A 14 -14.799 -7.181 -2.792 1.00 0.00 H new ATOM 0 HB2 SER A 14 -13.015 -6.126 -0.545 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.673 -5.177 -1.863 1.00 0.00 H new ATOM 0 HG SER A 14 -14.859 -5.392 0.358 1.00 0.00 H new ATOM 192 N GLU A 15 -12.729 -8.282 -3.899 1.00 0.00 N ATOM 193 CA GLU A 15 -11.484 -8.561 -4.670 1.00 0.00 C ATOM 194 C GLU A 15 -11.046 -7.288 -5.414 1.00 0.00 C ATOM 195 O GLU A 15 -10.680 -6.305 -4.801 1.00 0.00 O ATOM 196 CB GLU A 15 -11.746 -9.695 -5.663 1.00 0.00 C ATOM 197 CG GLU A 15 -13.074 -9.448 -6.384 1.00 0.00 C ATOM 198 CD GLU A 15 -12.910 -9.751 -7.874 1.00 0.00 C ATOM 199 OE1 GLU A 15 -12.624 -10.893 -8.198 1.00 0.00 O ATOM 200 OE2 GLU A 15 -13.069 -8.837 -8.666 1.00 0.00 O ATOM 0 H GLU A 15 -13.578 -8.699 -4.280 1.00 0.00 H new ATOM 0 HA GLU A 15 -10.687 -8.863 -3.990 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -10.933 -9.754 -6.387 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -11.777 -10.651 -5.140 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.854 -10.079 -5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.389 -8.414 -6.245 1.00 0.00 H new ATOM 207 N VAL A 16 -11.075 -7.288 -6.724 1.00 0.00 N ATOM 208 CA VAL A 16 -10.654 -6.071 -7.475 1.00 0.00 C ATOM 209 C VAL A 16 -11.849 -5.500 -8.243 1.00 0.00 C ATOM 210 O VAL A 16 -11.691 -4.801 -9.224 1.00 0.00 O ATOM 211 CB VAL A 16 -9.545 -6.441 -8.464 1.00 0.00 C ATOM 212 CG1 VAL A 16 -8.860 -5.169 -8.966 1.00 0.00 C ATOM 213 CG2 VAL A 16 -8.514 -7.330 -7.762 1.00 0.00 C ATOM 0 H VAL A 16 -11.371 -8.075 -7.301 1.00 0.00 H new ATOM 0 HA VAL A 16 -10.284 -5.324 -6.773 1.00 0.00 H new ATOM 0 HB VAL A 16 -9.977 -6.978 -9.309 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.071 -5.434 -9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.592 -4.534 -9.464 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.428 -4.631 -8.122 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.724 -7.595 -8.464 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.084 -6.791 -6.918 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.000 -8.238 -7.404 1.00 0.00 H new ATOM 223 N SER A 17 -13.044 -5.791 -7.806 1.00 0.00 N ATOM 224 CA SER A 17 -14.244 -5.262 -8.515 1.00 0.00 C ATOM 225 C SER A 17 -14.084 -5.488 -10.021 1.00 0.00 C ATOM 226 O SER A 17 -13.446 -6.426 -10.453 1.00 0.00 O ATOM 227 CB SER A 17 -14.384 -3.766 -8.235 1.00 0.00 C ATOM 228 OG SER A 17 -15.726 -3.365 -8.479 1.00 0.00 O ATOM 0 H SER A 17 -13.241 -6.371 -6.990 1.00 0.00 H new ATOM 0 HA SER A 17 -15.135 -5.781 -8.161 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.110 -3.551 -7.202 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.702 -3.200 -8.870 1.00 0.00 H new ATOM 0 HG SER A 17 -15.730 -2.533 -8.996 1.00 0.00 H new ATOM 234 N ARG A 18 -14.660 -4.635 -10.824 1.00 0.00 N ATOM 235 CA ARG A 18 -14.538 -4.803 -12.299 1.00 0.00 C ATOM 236 C ARG A 18 -14.458 -3.429 -12.967 1.00 0.00 C ATOM 237 O ARG A 18 -14.587 -3.305 -14.169 1.00 0.00 O ATOM 238 CB ARG A 18 -15.759 -5.558 -12.831 1.00 0.00 C ATOM 239 CG ARG A 18 -15.298 -6.761 -13.657 1.00 0.00 C ATOM 240 CD ARG A 18 -15.834 -8.048 -13.028 1.00 0.00 C ATOM 241 NE ARG A 18 -16.557 -8.843 -14.060 1.00 0.00 N ATOM 242 CZ ARG A 18 -16.286 -10.109 -14.217 1.00 0.00 C ATOM 243 NH1 ARG A 18 -16.795 -10.992 -13.402 1.00 0.00 N ATOM 244 NH2 ARG A 18 -15.508 -10.493 -15.191 1.00 0.00 N ATOM 0 H ARG A 18 -15.209 -3.830 -10.522 1.00 0.00 H new ATOM 0 HA ARG A 18 -13.634 -5.369 -12.524 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -16.383 -5.891 -12.002 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.370 -4.896 -13.444 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -15.655 -6.669 -14.683 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.209 -6.791 -13.700 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.012 -8.632 -12.614 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -16.504 -7.810 -12.202 1.00 0.00 H new ATOM 0 HE ARG A 18 -17.264 -8.397 -14.644 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -17.405 -10.692 -12.642 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -16.583 -11.982 -13.525 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -15.112 -9.803 -15.829 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -15.296 -11.483 -15.314 1.00 0.00 H new ATOM 258 N PHE A 19 -14.245 -2.395 -12.199 1.00 0.00 N ATOM 259 CA PHE A 19 -14.156 -1.033 -12.795 1.00 0.00 C ATOM 260 C PHE A 19 -13.299 -0.135 -11.901 1.00 0.00 C ATOM 261 O PHE A 19 -13.323 -0.241 -10.690 1.00 0.00 O ATOM 262 CB PHE A 19 -15.559 -0.438 -12.922 1.00 0.00 C ATOM 263 CG PHE A 19 -16.176 -0.300 -11.550 1.00 0.00 C ATOM 264 CD1 PHE A 19 -15.804 0.764 -10.717 1.00 0.00 C ATOM 265 CD2 PHE A 19 -17.121 -1.237 -11.111 1.00 0.00 C ATOM 266 CE1 PHE A 19 -16.378 0.892 -9.446 1.00 0.00 C ATOM 267 CE2 PHE A 19 -17.694 -1.110 -9.838 1.00 0.00 C ATOM 268 CZ PHE A 19 -17.323 -0.045 -9.006 1.00 0.00 C ATOM 0 H PHE A 19 -14.129 -2.435 -11.186 1.00 0.00 H new ATOM 0 HA PHE A 19 -13.699 -1.100 -13.782 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.509 0.536 -13.409 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -16.181 -1.077 -13.549 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -15.075 1.485 -11.055 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.408 -2.057 -11.753 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.092 1.713 -8.805 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -18.421 -1.833 -9.498 1.00 0.00 H new ATOM 0 HZ PHE A 19 -17.765 0.054 -8.026 1.00 0.00 H new ATOM 278 N PHE A 20 -12.543 0.750 -12.489 1.00 0.00 N ATOM 279 CA PHE A 20 -11.685 1.659 -11.680 1.00 0.00 C ATOM 280 C PHE A 20 -12.020 3.111 -12.029 1.00 0.00 C ATOM 281 O PHE A 20 -11.437 3.693 -12.924 1.00 0.00 O ATOM 282 CB PHE A 20 -10.212 1.382 -11.995 1.00 0.00 C ATOM 283 CG PHE A 20 -9.352 2.472 -11.400 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.718 3.069 -10.185 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.188 2.886 -12.061 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.920 4.080 -9.633 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.389 3.897 -11.508 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.756 4.493 -10.294 1.00 0.00 C ATOM 0 H PHE A 20 -12.483 0.883 -13.498 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.866 1.488 -10.619 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.919 0.413 -11.591 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.063 1.336 -13.074 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -10.615 2.750 -9.675 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -7.906 2.426 -12.997 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.202 4.541 -8.698 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.492 4.216 -12.017 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.141 5.272 -9.868 1.00 0.00 H new ATOM 298 N GLY A 21 -12.956 3.699 -11.335 1.00 0.00 N ATOM 299 CA GLY A 21 -13.326 5.111 -11.634 1.00 0.00 C ATOM 300 C GLY A 21 -13.702 5.834 -10.339 1.00 0.00 C ATOM 301 O GLY A 21 -12.961 6.658 -9.841 1.00 0.00 O ATOM 0 H GLY A 21 -13.479 3.264 -10.575 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.492 5.621 -12.117 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.163 5.137 -12.332 1.00 0.00 H new ATOM 305 N ARG A 22 -14.849 5.537 -9.791 1.00 0.00 N ATOM 306 CA ARG A 22 -15.269 6.214 -8.532 1.00 0.00 C ATOM 307 C ARG A 22 -15.253 5.210 -7.377 1.00 0.00 C ATOM 308 O ARG A 22 -15.903 5.401 -6.368 1.00 0.00 O ATOM 309 CB ARG A 22 -16.682 6.774 -8.700 1.00 0.00 C ATOM 310 CG ARG A 22 -17.607 5.677 -9.230 1.00 0.00 C ATOM 311 CD ARG A 22 -19.027 6.229 -9.367 1.00 0.00 C ATOM 312 NE ARG A 22 -19.408 6.268 -10.806 1.00 0.00 N ATOM 313 CZ ARG A 22 -19.875 5.196 -11.386 1.00 0.00 C ATOM 314 NH1 ARG A 22 -19.630 4.021 -10.877 1.00 0.00 N ATOM 315 NH2 ARG A 22 -20.586 5.300 -12.475 1.00 0.00 N ATOM 0 H ARG A 22 -15.512 4.856 -10.160 1.00 0.00 H new ATOM 0 HA ARG A 22 -14.578 7.028 -8.313 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.053 7.147 -7.745 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.670 7.619 -9.389 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -17.249 5.320 -10.196 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.601 4.823 -8.553 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -19.727 5.604 -8.811 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -19.083 7.229 -8.938 1.00 0.00 H new ATOM 0 HE ARG A 22 -19.304 7.132 -11.338 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -19.074 3.940 -10.026 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -19.995 3.183 -11.330 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -20.777 6.219 -12.873 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -20.951 4.462 -12.928 1.00 0.00 H new ATOM 329 N ALA A 23 -14.514 4.144 -7.514 1.00 0.00 N ATOM 330 CA ALA A 23 -14.457 3.135 -6.421 1.00 0.00 C ATOM 331 C ALA A 23 -13.963 3.811 -5.134 1.00 0.00 C ATOM 332 O ALA A 23 -12.829 4.240 -5.068 1.00 0.00 O ATOM 333 CB ALA A 23 -13.485 2.020 -6.813 1.00 0.00 C ATOM 0 H ALA A 23 -13.948 3.929 -8.335 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.449 2.714 -6.257 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.440 1.279 -6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -13.829 1.544 -7.731 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.493 2.442 -6.972 1.00 0.00 H new ATOM 339 N PRO A 24 -14.832 3.895 -4.153 1.00 0.00 N ATOM 340 CA PRO A 24 -14.508 4.520 -2.856 1.00 0.00 C ATOM 341 C PRO A 24 -13.738 3.545 -1.957 1.00 0.00 C ATOM 342 O PRO A 24 -14.124 3.286 -0.834 1.00 0.00 O ATOM 343 CB PRO A 24 -15.882 4.828 -2.256 1.00 0.00 C ATOM 344 CG PRO A 24 -16.883 3.867 -2.943 1.00 0.00 C ATOM 345 CD PRO A 24 -16.215 3.387 -4.245 1.00 0.00 C ATOM 0 HA PRO A 24 -13.876 5.402 -2.958 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -15.877 4.677 -1.176 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.159 5.868 -2.432 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.116 3.023 -2.294 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.824 4.375 -3.155 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -16.235 2.300 -4.325 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.726 3.781 -5.123 1.00 0.00 H new ATOM 353 N TYR A 25 -12.651 3.003 -2.436 1.00 0.00 N ATOM 354 CA TYR A 25 -11.861 2.052 -1.606 1.00 0.00 C ATOM 355 C TYR A 25 -10.442 1.951 -2.169 1.00 0.00 C ATOM 356 O TYR A 25 -10.059 0.951 -2.742 1.00 0.00 O ATOM 357 CB TYR A 25 -12.528 0.675 -1.632 1.00 0.00 C ATOM 358 CG TYR A 25 -13.652 0.647 -0.625 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.367 0.504 0.740 1.00 0.00 C ATOM 360 CD2 TYR A 25 -14.980 0.768 -1.053 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.410 0.481 1.676 1.00 0.00 C ATOM 362 CE2 TYR A 25 -16.024 0.745 -0.117 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.738 0.601 1.247 1.00 0.00 C ATOM 364 OH TYR A 25 -16.764 0.580 2.168 1.00 0.00 O ATOM 0 H TYR A 25 -12.276 3.179 -3.368 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.819 2.409 -0.577 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -12.913 0.463 -2.630 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.798 -0.100 -1.401 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.343 0.411 1.071 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.200 0.879 -2.104 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -14.190 0.371 2.728 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -17.048 0.838 -0.447 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.622 0.676 1.704 1.00 0.00 H new ATOM 374 N PHE A 26 -9.664 2.986 -2.014 1.00 0.00 N ATOM 375 CA PHE A 26 -8.271 2.962 -2.542 1.00 0.00 C ATOM 376 C PHE A 26 -7.367 2.191 -1.579 1.00 0.00 C ATOM 377 O PHE A 26 -6.992 2.686 -0.534 1.00 0.00 O ATOM 378 CB PHE A 26 -7.759 4.397 -2.684 1.00 0.00 C ATOM 379 CG PHE A 26 -6.358 4.382 -3.246 1.00 0.00 C ATOM 380 CD1 PHE A 26 -6.103 3.756 -4.473 1.00 0.00 C ATOM 381 CD2 PHE A 26 -5.313 4.994 -2.541 1.00 0.00 C ATOM 382 CE1 PHE A 26 -4.804 3.743 -4.996 1.00 0.00 C ATOM 383 CE2 PHE A 26 -4.014 4.981 -3.064 1.00 0.00 C ATOM 384 CZ PHE A 26 -3.759 4.355 -4.292 1.00 0.00 C ATOM 0 H PHE A 26 -9.934 3.850 -1.543 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.261 2.471 -3.515 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.418 4.966 -3.340 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.767 4.894 -1.714 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.908 3.283 -5.016 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -5.509 5.476 -1.594 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.608 3.261 -5.942 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.209 5.453 -2.521 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.757 4.345 -4.695 1.00 0.00 H new ATOM 394 N MET A 27 -7.008 0.985 -1.925 1.00 0.00 N ATOM 395 CA MET A 27 -6.123 0.186 -1.033 1.00 0.00 C ATOM 396 C MET A 27 -4.667 0.586 -1.279 1.00 0.00 C ATOM 397 O MET A 27 -4.183 0.547 -2.393 1.00 0.00 O ATOM 398 CB MET A 27 -6.300 -1.303 -1.340 1.00 0.00 C ATOM 399 CG MET A 27 -6.581 -2.065 -0.043 1.00 0.00 C ATOM 400 SD MET A 27 -6.424 -3.843 -0.345 1.00 0.00 S ATOM 401 CE MET A 27 -7.756 -4.380 0.758 1.00 0.00 C ATOM 0 H MET A 27 -7.290 0.519 -2.787 1.00 0.00 H new ATOM 0 HA MET A 27 -6.385 0.375 0.008 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.122 -1.445 -2.042 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.402 -1.696 -1.817 1.00 0.00 H new ATOM 0 HG2 MET A 27 -5.882 -1.754 0.733 1.00 0.00 H new ATOM 0 HG3 MET A 27 -7.583 -1.833 0.318 1.00 0.00 H new ATOM 0 HE1 MET A 27 -8.139 -5.344 0.424 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.372 -4.475 1.774 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.561 -3.645 0.742 1.00 0.00 H new ATOM 411 N ILE A 28 -3.964 0.974 -0.251 1.00 0.00 N ATOM 412 CA ILE A 28 -2.543 1.380 -0.433 1.00 0.00 C ATOM 413 C ILE A 28 -1.640 0.476 0.407 1.00 0.00 C ATOM 414 O ILE A 28 -1.693 0.483 1.621 1.00 0.00 O ATOM 415 CB ILE A 28 -2.367 2.833 0.009 1.00 0.00 C ATOM 416 CG1 ILE A 28 -0.875 3.161 0.103 1.00 0.00 C ATOM 417 CG2 ILE A 28 -3.019 3.034 1.377 1.00 0.00 C ATOM 418 CD1 ILE A 28 -0.184 2.786 -1.209 1.00 0.00 C ATOM 0 H ILE A 28 -4.312 1.027 0.706 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.271 1.285 -1.484 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.840 3.493 -0.719 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.738 4.223 0.307 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.424 2.616 0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.893 4.070 1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.082 2.801 1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.548 2.374 2.105 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.878 3.020 -1.141 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.309 1.719 -1.394 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.628 3.351 -2.029 1.00 0.00 H new ATOM 430 N VAL A 29 -0.808 -0.304 -0.230 1.00 0.00 N ATOM 431 CA VAL A 29 0.100 -1.207 0.532 1.00 0.00 C ATOM 432 C VAL A 29 1.554 -0.843 0.225 1.00 0.00 C ATOM 433 O VAL A 29 1.891 -0.472 -0.883 1.00 0.00 O ATOM 434 CB VAL A 29 -0.160 -2.657 0.124 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.419 -3.597 1.181 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.668 -2.889 0.007 1.00 0.00 C ATOM 0 H VAL A 29 -0.719 -0.354 -1.245 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.086 -1.093 1.600 1.00 0.00 H new ATOM 0 HB VAL A 29 0.315 -2.855 -0.837 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.233 -4.631 0.890 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.493 -3.431 1.266 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.056 -3.400 2.142 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.856 -3.923 -0.284 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.142 -2.691 0.968 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.082 -2.219 -0.747 1.00 0.00 H new ATOM 446 N GLU A 30 2.419 -0.946 1.197 1.00 0.00 N ATOM 447 CA GLU A 30 3.849 -0.606 0.959 1.00 0.00 C ATOM 448 C GLU A 30 4.711 -1.849 1.179 1.00 0.00 C ATOM 449 O GLU A 30 4.524 -2.586 2.127 1.00 0.00 O ATOM 450 CB GLU A 30 4.279 0.494 1.933 1.00 0.00 C ATOM 451 CG GLU A 30 4.823 1.688 1.146 1.00 0.00 C ATOM 452 CD GLU A 30 5.929 2.369 1.954 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.732 2.568 3.141 1.00 0.00 O ATOM 454 OE2 GLU A 30 6.954 2.681 1.371 1.00 0.00 O ATOM 0 H GLU A 30 2.197 -1.251 2.145 1.00 0.00 H new ATOM 0 HA GLU A 30 3.975 -0.254 -0.065 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.432 0.804 2.545 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.042 0.115 2.613 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.213 1.356 0.184 1.00 0.00 H new ATOM 0 HG3 GLU A 30 4.021 2.396 0.938 1.00 0.00 H new ATOM 461 N MET A 31 5.653 -2.092 0.309 1.00 0.00 N ATOM 462 CA MET A 31 6.524 -3.288 0.469 1.00 0.00 C ATOM 463 C MET A 31 7.981 -2.845 0.607 1.00 0.00 C ATOM 464 O MET A 31 8.470 -2.037 -0.158 1.00 0.00 O ATOM 465 CB MET A 31 6.382 -4.190 -0.760 1.00 0.00 C ATOM 466 CG MET A 31 5.773 -5.530 -0.343 1.00 0.00 C ATOM 467 SD MET A 31 5.927 -6.712 -1.705 1.00 0.00 S ATOM 468 CE MET A 31 4.227 -7.330 -1.658 1.00 0.00 C ATOM 0 H MET A 31 5.856 -1.513 -0.506 1.00 0.00 H new ATOM 0 HA MET A 31 6.225 -3.837 1.362 1.00 0.00 H new ATOM 0 HB2 MET A 31 5.751 -3.708 -1.507 1.00 0.00 H new ATOM 0 HB3 MET A 31 7.356 -4.349 -1.222 1.00 0.00 H new ATOM 0 HG2 MET A 31 6.280 -5.912 0.543 1.00 0.00 H new ATOM 0 HG3 MET A 31 4.724 -5.398 -0.078 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.167 -8.273 -2.202 1.00 0.00 H new ATOM 0 HE2 MET A 31 3.926 -7.489 -0.622 1.00 0.00 H new ATOM 0 HE3 MET A 31 3.562 -6.601 -2.121 1.00 0.00 H new ATOM 478 N LYS A 32 8.679 -3.369 1.577 1.00 0.00 N ATOM 479 CA LYS A 32 10.104 -2.979 1.764 1.00 0.00 C ATOM 480 C LYS A 32 10.980 -3.787 0.803 1.00 0.00 C ATOM 481 O LYS A 32 11.382 -3.310 -0.238 1.00 0.00 O ATOM 482 CB LYS A 32 10.527 -3.267 3.207 1.00 0.00 C ATOM 483 CG LYS A 32 10.390 -1.994 4.044 1.00 0.00 C ATOM 484 CD LYS A 32 11.660 -1.152 3.906 1.00 0.00 C ATOM 485 CE LYS A 32 11.322 0.323 4.127 1.00 0.00 C ATOM 486 NZ LYS A 32 12.571 1.134 4.059 1.00 0.00 N ATOM 0 H LYS A 32 8.324 -4.050 2.248 1.00 0.00 H new ATOM 0 HA LYS A 32 10.222 -1.915 1.558 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.908 -4.059 3.627 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.558 -3.621 3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 32 9.524 -1.421 3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.223 -2.250 5.090 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.405 -1.478 4.632 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.096 -1.292 2.917 1.00 0.00 H new ATOM 0 HE2 LYS A 32 10.614 0.662 3.371 1.00 0.00 H new ATOM 0 HE3 LYS A 32 10.842 0.456 5.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 12.342 2.137 4.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 13.232 0.816 4.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.011 1.016 3.124 1.00 0.00 H new ATOM 500 N LYS A 33 11.274 -5.012 1.146 1.00 0.00 N ATOM 501 CA LYS A 33 12.119 -5.855 0.254 1.00 0.00 C ATOM 502 C LYS A 33 11.388 -7.167 -0.038 1.00 0.00 C ATOM 503 O LYS A 33 11.578 -8.157 0.640 1.00 0.00 O ATOM 504 CB LYS A 33 13.452 -6.155 0.944 1.00 0.00 C ATOM 505 CG LYS A 33 14.535 -5.223 0.396 1.00 0.00 C ATOM 506 CD LYS A 33 15.269 -5.916 -0.755 1.00 0.00 C ATOM 507 CE LYS A 33 16.775 -5.685 -0.612 1.00 0.00 C ATOM 508 NZ LYS A 33 17.402 -6.879 0.023 1.00 0.00 N ATOM 0 H LYS A 33 10.965 -5.465 2.006 1.00 0.00 H new ATOM 0 HA LYS A 33 12.308 -5.325 -0.679 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.354 -6.021 2.021 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.734 -7.195 0.777 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.087 -4.292 0.048 1.00 0.00 H new ATOM 0 HG3 LYS A 33 15.239 -4.962 1.186 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.052 -6.984 -0.748 1.00 0.00 H new ATOM 0 HD3 LYS A 33 14.919 -5.526 -1.711 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.221 -5.504 -1.590 1.00 0.00 H new ATOM 0 HE3 LYS A 33 16.962 -4.798 -0.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 18.426 -6.723 0.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.984 -7.032 0.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.235 -7.716 -0.571 1.00 0.00 H new ATOM 522 N GLY A 34 10.550 -7.181 -1.039 1.00 0.00 N ATOM 523 CA GLY A 34 9.806 -8.430 -1.369 1.00 0.00 C ATOM 524 C GLY A 34 9.181 -8.998 -0.093 1.00 0.00 C ATOM 525 O GLY A 34 9.076 -10.196 0.078 1.00 0.00 O ATOM 0 H GLY A 34 10.349 -6.383 -1.642 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.030 -8.221 -2.106 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.480 -9.162 -1.814 1.00 0.00 H new ATOM 529 N ASN A 35 8.768 -8.145 0.805 1.00 0.00 N ATOM 530 CA ASN A 35 8.153 -8.635 2.071 1.00 0.00 C ATOM 531 C ASN A 35 7.117 -7.620 2.561 1.00 0.00 C ATOM 532 O ASN A 35 7.453 -6.614 3.152 1.00 0.00 O ATOM 533 CB ASN A 35 9.241 -8.800 3.133 1.00 0.00 C ATOM 534 CG ASN A 35 9.582 -10.282 3.291 1.00 0.00 C ATOM 535 OD1 ASN A 35 10.738 -10.655 3.289 1.00 0.00 O ATOM 536 ND2 ASN A 35 8.617 -11.151 3.430 1.00 0.00 N ATOM 0 H ASN A 35 8.830 -7.131 0.716 1.00 0.00 H new ATOM 0 HA ASN A 35 7.667 -9.594 1.892 1.00 0.00 H new ATOM 0 HB2 ASN A 35 10.131 -8.240 2.846 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.900 -8.391 4.084 1.00 0.00 H new ATOM 0 HD21 ASN A 35 8.834 -12.142 3.537 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.646 -10.839 3.432 1.00 0.00 H new ATOM 543 N ILE A 36 5.860 -7.877 2.323 1.00 0.00 N ATOM 544 CA ILE A 36 4.807 -6.926 2.778 1.00 0.00 C ATOM 545 C ILE A 36 5.099 -6.497 4.218 1.00 0.00 C ATOM 546 O ILE A 36 5.407 -7.310 5.067 1.00 0.00 O ATOM 547 CB ILE A 36 3.440 -7.609 2.719 1.00 0.00 C ATOM 548 CG1 ILE A 36 2.363 -6.632 3.195 1.00 0.00 C ATOM 549 CG2 ILE A 36 3.445 -8.839 3.628 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.023 -7.360 3.301 1.00 0.00 C ATOM 0 H ILE A 36 5.517 -8.704 1.834 1.00 0.00 H new ATOM 0 HA ILE A 36 4.803 -6.051 2.129 1.00 0.00 H new ATOM 0 HB ILE A 36 3.230 -7.914 1.694 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.639 -6.214 4.163 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.281 -5.797 2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 36 2.471 -9.326 3.586 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.214 -9.536 3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 36 3.654 -8.533 4.653 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.256 -6.663 3.640 1.00 0.00 H new ATOM 0 HD12 ILE A 36 0.746 -7.757 2.324 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.110 -8.180 4.014 1.00 0.00 H new ATOM 562 N GLU A 37 5.007 -5.227 4.498 1.00 0.00 N ATOM 563 CA GLU A 37 5.280 -4.748 5.881 1.00 0.00 C ATOM 564 C GLU A 37 4.366 -3.565 6.201 1.00 0.00 C ATOM 565 O GLU A 37 4.632 -2.787 7.095 1.00 0.00 O ATOM 566 CB GLU A 37 6.741 -4.306 5.987 1.00 0.00 C ATOM 567 CG GLU A 37 6.992 -3.136 5.034 1.00 0.00 C ATOM 568 CD GLU A 37 7.421 -1.904 5.834 1.00 0.00 C ATOM 569 OE1 GLU A 37 7.789 -2.068 6.986 1.00 0.00 O ATOM 570 OE2 GLU A 37 7.375 -0.818 5.281 1.00 0.00 O ATOM 0 H GLU A 37 4.754 -4.500 3.829 1.00 0.00 H new ATOM 0 HA GLU A 37 5.091 -5.555 6.589 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.969 -4.010 7.011 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.402 -5.137 5.741 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.765 -3.401 4.313 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.088 -2.916 4.466 1.00 0.00 H new ATOM 577 N SER A 38 3.290 -3.423 5.478 1.00 0.00 N ATOM 578 CA SER A 38 2.361 -2.290 5.740 1.00 0.00 C ATOM 579 C SER A 38 1.179 -2.366 4.773 1.00 0.00 C ATOM 580 O SER A 38 1.349 -2.495 3.578 1.00 0.00 O ATOM 581 CB SER A 38 3.102 -0.967 5.539 1.00 0.00 C ATOM 582 OG SER A 38 2.397 0.073 6.203 1.00 0.00 O ATOM 0 H SER A 38 3.014 -4.043 4.717 1.00 0.00 H new ATOM 0 HA SER A 38 1.995 -2.349 6.765 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.116 -1.042 5.931 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.187 -0.743 4.476 1.00 0.00 H new ATOM 0 HG SER A 38 2.871 0.922 6.077 1.00 0.00 H new ATOM 588 N SER A 39 -0.019 -2.288 5.282 1.00 0.00 N ATOM 589 CA SER A 39 -1.213 -2.354 4.394 1.00 0.00 C ATOM 590 C SER A 39 -2.360 -1.565 5.028 1.00 0.00 C ATOM 591 O SER A 39 -2.859 -1.914 6.079 1.00 0.00 O ATOM 592 CB SER A 39 -1.636 -3.814 4.215 1.00 0.00 C ATOM 593 OG SER A 39 -2.038 -4.343 5.473 1.00 0.00 O ATOM 0 H SER A 39 -0.223 -2.181 6.276 1.00 0.00 H new ATOM 0 HA SER A 39 -0.969 -1.926 3.422 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.456 -3.882 3.500 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.809 -4.397 3.809 1.00 0.00 H new ATOM 0 HG SER A 39 -2.445 -3.633 6.012 1.00 0.00 H new ATOM 599 N GLU A 40 -2.781 -0.503 4.398 1.00 0.00 N ATOM 600 CA GLU A 40 -3.893 0.310 4.968 1.00 0.00 C ATOM 601 C GLU A 40 -4.930 0.597 3.880 1.00 0.00 C ATOM 602 O GLU A 40 -4.599 1.006 2.785 1.00 0.00 O ATOM 603 CB GLU A 40 -3.337 1.631 5.501 1.00 0.00 C ATOM 604 CG GLU A 40 -3.884 1.887 6.906 1.00 0.00 C ATOM 605 CD GLU A 40 -4.409 3.320 6.998 1.00 0.00 C ATOM 606 OE1 GLU A 40 -3.596 4.230 6.994 1.00 0.00 O ATOM 607 OE2 GLU A 40 -5.615 3.485 7.072 1.00 0.00 O ATOM 0 H GLU A 40 -2.404 -0.163 3.514 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.364 -0.242 5.781 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.248 1.596 5.524 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.615 2.449 4.837 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.683 1.181 7.130 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.101 1.728 7.647 1.00 0.00 H new ATOM 614 N VAL A 41 -6.184 0.390 4.176 1.00 0.00 N ATOM 615 CA VAL A 41 -7.244 0.656 3.163 1.00 0.00 C ATOM 616 C VAL A 41 -7.841 2.044 3.407 1.00 0.00 C ATOM 617 O VAL A 41 -8.086 2.434 4.531 1.00 0.00 O ATOM 618 CB VAL A 41 -8.343 -0.400 3.284 1.00 0.00 C ATOM 619 CG1 VAL A 41 -7.773 -1.777 2.938 1.00 0.00 C ATOM 620 CG2 VAL A 41 -8.877 -0.415 4.719 1.00 0.00 C ATOM 0 H VAL A 41 -6.520 0.048 5.076 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.811 0.615 2.163 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.153 -0.161 2.595 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.558 -2.528 3.025 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.392 -1.767 1.917 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.962 -2.018 3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -9.661 -1.167 4.808 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.066 -0.654 5.407 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.285 0.565 4.966 1.00 0.00 H new ATOM 630 N ILE A 42 -8.076 2.792 2.365 1.00 0.00 N ATOM 631 CA ILE A 42 -8.657 4.154 2.541 1.00 0.00 C ATOM 632 C ILE A 42 -9.946 4.270 1.726 1.00 0.00 C ATOM 633 O ILE A 42 -10.066 3.709 0.654 1.00 0.00 O ATOM 634 CB ILE A 42 -7.653 5.202 2.061 1.00 0.00 C ATOM 635 CG1 ILE A 42 -6.313 4.988 2.769 1.00 0.00 C ATOM 636 CG2 ILE A 42 -8.181 6.601 2.385 1.00 0.00 C ATOM 637 CD1 ILE A 42 -5.266 5.933 2.177 1.00 0.00 C ATOM 0 H ILE A 42 -7.891 2.520 1.399 1.00 0.00 H new ATOM 0 HA ILE A 42 -8.879 4.320 3.595 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.515 5.105 0.984 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.421 5.172 3.838 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.990 3.953 2.654 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.465 7.348 2.043 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.135 6.755 1.882 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.319 6.697 3.462 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -4.312 5.781 2.681 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -5.151 5.728 1.113 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.588 6.965 2.315 1.00 0.00 H new ATOM 649 N GLU A 43 -10.911 4.993 2.224 1.00 0.00 N ATOM 650 CA GLU A 43 -12.191 5.142 1.476 1.00 0.00 C ATOM 651 C GLU A 43 -12.374 6.602 1.059 1.00 0.00 C ATOM 652 O GLU A 43 -11.945 7.513 1.742 1.00 0.00 O ATOM 653 CB GLU A 43 -13.357 4.717 2.370 1.00 0.00 C ATOM 654 CG GLU A 43 -13.212 3.237 2.727 1.00 0.00 C ATOM 655 CD GLU A 43 -12.660 3.106 4.147 1.00 0.00 C ATOM 656 OE1 GLU A 43 -13.257 3.672 5.048 1.00 0.00 O ATOM 657 OE2 GLU A 43 -11.649 2.443 4.311 1.00 0.00 O ATOM 0 H GLU A 43 -10.869 5.487 3.116 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.166 4.512 0.587 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.373 5.321 3.277 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.304 4.887 1.857 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.178 2.738 2.654 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -12.545 2.745 2.019 1.00 0.00 H new ATOM 664 N ASN A 44 -13.010 6.833 -0.055 1.00 0.00 N ATOM 665 CA ASN A 44 -13.225 8.233 -0.518 1.00 0.00 C ATOM 666 C ASN A 44 -14.674 8.395 -0.985 1.00 0.00 C ATOM 667 O ASN A 44 -14.950 8.358 -2.167 1.00 0.00 O ATOM 668 CB ASN A 44 -12.276 8.538 -1.678 1.00 0.00 C ATOM 669 CG ASN A 44 -11.011 9.207 -1.140 1.00 0.00 C ATOM 670 OD1 ASN A 44 -10.947 9.568 0.018 1.00 0.00 O ATOM 671 ND2 ASN A 44 -9.993 9.388 -1.937 1.00 0.00 N ATOM 0 H ASN A 44 -13.391 6.111 -0.667 1.00 0.00 H new ATOM 0 HA ASN A 44 -13.027 8.924 0.302 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.018 7.618 -2.203 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -12.766 9.191 -2.401 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -9.144 9.832 -1.587 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -10.046 9.085 -2.909 1.00 0.00 H new ATOM 678 N PRO A 45 -15.557 8.566 -0.035 1.00 0.00 N ATOM 679 CA PRO A 45 -16.995 8.732 -0.307 1.00 0.00 C ATOM 680 C PRO A 45 -17.289 10.155 -0.789 1.00 0.00 C ATOM 681 O PRO A 45 -16.987 11.123 -0.119 1.00 0.00 O ATOM 682 CB PRO A 45 -17.650 8.468 1.052 1.00 0.00 C ATOM 683 CG PRO A 45 -16.560 8.726 2.119 1.00 0.00 C ATOM 684 CD PRO A 45 -15.203 8.609 1.400 1.00 0.00 C ATOM 0 HA PRO A 45 -17.363 8.067 -1.088 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -18.506 9.125 1.205 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -18.019 7.444 1.113 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -16.679 9.714 2.563 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -16.632 8.001 2.930 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -14.558 9.458 1.626 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -14.666 7.711 1.705 1.00 0.00 H new ATOM 692 N SER A 46 -17.879 10.289 -1.945 1.00 0.00 N ATOM 693 CA SER A 46 -18.193 11.648 -2.467 1.00 0.00 C ATOM 694 C SER A 46 -16.907 12.315 -2.959 1.00 0.00 C ATOM 695 O SER A 46 -16.719 13.506 -2.811 1.00 0.00 O ATOM 696 CB SER A 46 -18.811 12.491 -1.352 1.00 0.00 C ATOM 697 OG SER A 46 -20.015 13.082 -1.823 1.00 0.00 O ATOM 0 H SER A 46 -18.157 9.516 -2.550 1.00 0.00 H new ATOM 0 HA SER A 46 -18.898 11.566 -3.294 1.00 0.00 H new ATOM 0 HB2 SER A 46 -19.014 11.869 -0.480 1.00 0.00 H new ATOM 0 HB3 SER A 46 -18.112 13.265 -1.035 1.00 0.00 H new ATOM 0 HG SER A 46 -20.415 13.622 -1.110 1.00 0.00 H new ATOM 703 N ALA A 47 -16.020 11.556 -3.543 1.00 0.00 N ATOM 704 CA ALA A 47 -14.747 12.147 -4.043 1.00 0.00 C ATOM 705 C ALA A 47 -15.060 13.313 -4.983 1.00 0.00 C ATOM 706 O ALA A 47 -14.712 14.446 -4.719 1.00 0.00 O ATOM 707 CB ALA A 47 -13.953 11.081 -4.798 1.00 0.00 C ATOM 0 H ALA A 47 -16.122 10.553 -3.695 1.00 0.00 H new ATOM 0 HA ALA A 47 -14.158 12.509 -3.200 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -13.021 11.512 -5.164 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -13.730 10.251 -4.128 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -14.541 10.718 -5.641 1.00 0.00 H new ATOM 713 N SER A 48 -15.714 13.044 -6.080 1.00 0.00 N ATOM 714 CA SER A 48 -16.047 14.138 -7.034 1.00 0.00 C ATOM 715 C SER A 48 -17.489 14.595 -6.806 1.00 0.00 C ATOM 716 O SER A 48 -18.378 14.286 -7.575 1.00 0.00 O ATOM 717 CB SER A 48 -15.895 13.630 -8.468 1.00 0.00 C ATOM 718 OG SER A 48 -16.326 12.276 -8.535 1.00 0.00 O ATOM 0 H SER A 48 -16.032 12.115 -6.356 1.00 0.00 H new ATOM 0 HA SER A 48 -15.370 14.977 -6.872 1.00 0.00 H new ATOM 0 HB2 SER A 48 -16.484 14.245 -9.148 1.00 0.00 H new ATOM 0 HB3 SER A 48 -14.855 13.709 -8.786 1.00 0.00 H new ATOM 0 HG SER A 48 -16.231 11.948 -9.454 1.00 0.00 H new ATOM 724 N ALA A 49 -17.728 15.332 -5.756 1.00 0.00 N ATOM 725 CA ALA A 49 -19.112 15.808 -5.481 1.00 0.00 C ATOM 726 C ALA A 49 -19.369 17.099 -6.259 1.00 0.00 C ATOM 727 O ALA A 49 -20.498 17.465 -6.521 1.00 0.00 O ATOM 728 CB ALA A 49 -19.273 16.076 -3.983 1.00 0.00 C ATOM 0 H ALA A 49 -17.025 15.625 -5.077 1.00 0.00 H new ATOM 0 HA ALA A 49 -19.827 15.046 -5.792 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -20.286 16.424 -3.783 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -19.089 15.157 -3.427 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -18.559 16.838 -3.671 1.00 0.00 H new ATOM 734 N SER A 50 -18.329 17.791 -6.633 1.00 0.00 N ATOM 735 CA SER A 50 -18.512 19.058 -7.396 1.00 0.00 C ATOM 736 C SER A 50 -18.258 18.798 -8.882 1.00 0.00 C ATOM 737 O SER A 50 -17.392 19.399 -9.487 1.00 0.00 O ATOM 738 CB SER A 50 -17.524 20.108 -6.885 1.00 0.00 C ATOM 739 OG SER A 50 -18.090 20.783 -5.769 1.00 0.00 O ATOM 0 H SER A 50 -17.360 17.534 -6.443 1.00 0.00 H new ATOM 0 HA SER A 50 -19.530 19.422 -7.259 1.00 0.00 H new ATOM 0 HB2 SER A 50 -16.586 19.632 -6.599 1.00 0.00 H new ATOM 0 HB3 SER A 50 -17.292 20.821 -7.676 1.00 0.00 H new ATOM 0 HG SER A 50 -17.458 21.455 -5.438 1.00 0.00 H new ATOM 745 N GLY A 51 -19.004 17.907 -9.475 1.00 0.00 N ATOM 746 CA GLY A 51 -18.802 17.611 -10.922 1.00 0.00 C ATOM 747 C GLY A 51 -18.360 16.156 -11.089 1.00 0.00 C ATOM 748 O GLY A 51 -17.916 15.521 -10.154 1.00 0.00 O ATOM 0 H GLY A 51 -19.744 17.372 -9.021 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -19.726 17.787 -11.472 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -18.050 18.281 -11.339 1.00 0.00 H new ATOM 752 N GLY A 52 -18.479 15.623 -12.274 1.00 0.00 N ATOM 753 CA GLY A 52 -18.065 14.209 -12.499 1.00 0.00 C ATOM 754 C GLY A 52 -16.544 14.135 -12.639 1.00 0.00 C ATOM 755 O GLY A 52 -15.891 15.109 -12.958 1.00 0.00 O ATOM 0 H GLY A 52 -18.845 16.105 -13.095 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -18.394 13.586 -11.667 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -18.542 13.818 -13.398 1.00 0.00 H new ATOM 759 N ALA A 53 -15.974 12.985 -12.402 1.00 0.00 N ATOM 760 CA ALA A 53 -14.495 12.845 -12.524 1.00 0.00 C ATOM 761 C ALA A 53 -14.166 11.495 -13.163 1.00 0.00 C ATOM 762 O ALA A 53 -14.014 11.387 -14.364 1.00 0.00 O ATOM 763 CB ALA A 53 -13.861 12.920 -11.133 1.00 0.00 C ATOM 0 H ALA A 53 -16.469 12.136 -12.129 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.101 13.648 -13.146 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.779 12.818 -11.220 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.099 13.880 -10.676 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -14.253 12.115 -10.511 1.00 0.00 H new ATOM 769 N GLY A 54 -14.058 10.464 -12.371 1.00 0.00 N ATOM 770 CA GLY A 54 -13.743 9.120 -12.934 1.00 0.00 C ATOM 771 C GLY A 54 -12.238 9.000 -13.182 1.00 0.00 C ATOM 772 O GLY A 54 -11.477 8.672 -12.293 1.00 0.00 O ATOM 0 H GLY A 54 -14.174 10.494 -11.358 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -14.070 8.341 -12.245 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.287 8.970 -13.866 1.00 0.00 H new ATOM 776 N ILE A 55 -11.803 9.257 -14.385 1.00 0.00 N ATOM 777 CA ILE A 55 -10.348 9.150 -14.691 1.00 0.00 C ATOM 778 C ILE A 55 -9.598 10.331 -14.068 1.00 0.00 C ATOM 779 O ILE A 55 -8.391 10.307 -13.932 1.00 0.00 O ATOM 780 CB ILE A 55 -10.147 9.162 -16.207 1.00 0.00 C ATOM 781 CG1 ILE A 55 -11.067 8.120 -16.850 1.00 0.00 C ATOM 782 CG2 ILE A 55 -8.690 8.824 -16.532 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.695 6.726 -16.341 1.00 0.00 C ATOM 0 H ILE A 55 -12.392 9.536 -15.169 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.960 8.220 -14.276 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.386 10.151 -16.598 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.107 8.341 -16.610 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -10.975 8.159 -17.935 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -8.547 8.833 -17.613 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.034 9.564 -16.073 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.450 7.835 -16.142 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.350 5.985 -16.799 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.660 6.507 -16.603 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.810 6.692 -15.258 1.00 0.00 H new ATOM 795 N ARG A 56 -10.301 11.363 -13.692 1.00 0.00 N ATOM 796 CA ARG A 56 -9.623 12.541 -13.081 1.00 0.00 C ATOM 797 C ARG A 56 -9.021 12.146 -11.730 1.00 0.00 C ATOM 798 O ARG A 56 -8.106 12.776 -11.240 1.00 0.00 O ATOM 799 CB ARG A 56 -10.639 13.666 -12.875 1.00 0.00 C ATOM 800 CG ARG A 56 -10.319 14.823 -13.822 1.00 0.00 C ATOM 801 CD ARG A 56 -10.781 14.468 -15.237 1.00 0.00 C ATOM 802 NE ARG A 56 -9.626 13.942 -16.018 1.00 0.00 N ATOM 803 CZ ARG A 56 -9.789 13.588 -17.264 1.00 0.00 C ATOM 804 NH1 ARG A 56 -10.988 13.363 -17.728 1.00 0.00 N ATOM 805 NH2 ARG A 56 -8.752 13.455 -18.045 1.00 0.00 N ATOM 0 H ARG A 56 -11.314 11.442 -13.781 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.829 12.883 -13.745 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.648 13.298 -13.062 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.612 14.010 -11.841 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.816 15.732 -13.483 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.248 15.025 -13.818 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -11.576 13.723 -15.196 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.195 15.349 -15.728 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.709 13.859 -15.579 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -11.799 13.464 -17.117 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.114 13.086 -18.702 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.815 13.628 -17.682 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.879 13.178 -19.019 1.00 0.00 H new ATOM 819 N THR A 57 -9.530 11.108 -11.123 1.00 0.00 N ATOM 820 CA THR A 57 -8.988 10.676 -9.803 1.00 0.00 C ATOM 821 C THR A 57 -7.528 10.243 -9.962 1.00 0.00 C ATOM 822 O THR A 57 -6.771 10.221 -9.013 1.00 0.00 O ATOM 823 CB THR A 57 -9.811 9.502 -9.271 1.00 0.00 C ATOM 824 OG1 THR A 57 -11.181 9.877 -9.201 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.309 9.113 -7.880 1.00 0.00 C ATOM 0 H THR A 57 -10.297 10.541 -11.484 1.00 0.00 H new ATOM 0 HA THR A 57 -9.045 11.508 -9.101 1.00 0.00 H new ATOM 0 HB THR A 57 -9.705 8.649 -9.942 1.00 0.00 H new ATOM 0 HG1 THR A 57 -11.709 9.124 -8.862 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.896 8.276 -7.502 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.260 8.822 -7.940 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.412 9.963 -7.205 1.00 0.00 H new ATOM 833 N ALA A 58 -7.128 9.896 -11.155 1.00 0.00 N ATOM 834 CA ALA A 58 -5.717 9.464 -11.370 1.00 0.00 C ATOM 835 C ALA A 58 -4.766 10.529 -10.816 1.00 0.00 C ATOM 836 O ALA A 58 -3.832 10.228 -10.096 1.00 0.00 O ATOM 837 CB ALA A 58 -5.461 9.282 -12.867 1.00 0.00 C ATOM 0 H ALA A 58 -7.716 9.893 -11.989 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.545 8.519 -10.854 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.430 8.966 -13.024 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.137 8.524 -13.262 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.634 10.226 -13.383 1.00 0.00 H new ATOM 843 N GLN A 59 -4.996 11.770 -11.144 1.00 0.00 N ATOM 844 CA GLN A 59 -4.107 12.852 -10.637 1.00 0.00 C ATOM 845 C GLN A 59 -3.822 12.622 -9.151 1.00 0.00 C ATOM 846 O GLN A 59 -2.702 12.755 -8.697 1.00 0.00 O ATOM 847 CB GLN A 59 -4.793 14.207 -10.824 1.00 0.00 C ATOM 848 CG GLN A 59 -3.876 15.138 -11.621 1.00 0.00 C ATOM 849 CD GLN A 59 -3.101 16.038 -10.657 1.00 0.00 C ATOM 850 OE1 GLN A 59 -2.231 15.577 -9.944 1.00 0.00 O ATOM 851 NE2 GLN A 59 -3.380 17.311 -10.605 1.00 0.00 N ATOM 0 H GLN A 59 -5.762 12.082 -11.742 1.00 0.00 H new ATOM 0 HA GLN A 59 -3.169 12.842 -11.192 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.741 14.078 -11.347 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.022 14.648 -9.854 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -3.183 14.553 -12.226 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.465 15.745 -12.308 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.110 17.698 -11.203 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.868 17.920 -9.966 1.00 0.00 H new ATOM 860 N ILE A 60 -4.823 12.274 -8.389 1.00 0.00 N ATOM 861 CA ILE A 60 -4.600 12.033 -6.935 1.00 0.00 C ATOM 862 C ILE A 60 -3.855 10.711 -6.754 1.00 0.00 C ATOM 863 O ILE A 60 -3.016 10.572 -5.887 1.00 0.00 O ATOM 864 CB ILE A 60 -5.946 11.962 -6.209 1.00 0.00 C ATOM 865 CG1 ILE A 60 -6.751 13.234 -6.492 1.00 0.00 C ATOM 866 CG2 ILE A 60 -5.706 11.839 -4.703 1.00 0.00 C ATOM 867 CD1 ILE A 60 -5.856 14.461 -6.303 1.00 0.00 C ATOM 0 H ILE A 60 -5.783 12.146 -8.709 1.00 0.00 H new ATOM 0 HA ILE A 60 -4.010 12.850 -6.518 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.502 11.094 -6.564 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.142 13.210 -7.509 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -7.609 13.290 -5.822 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.664 11.788 -4.185 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.134 10.934 -4.498 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.149 12.707 -4.351 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.431 15.365 -6.505 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -5.486 14.487 -5.278 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.013 14.406 -6.991 1.00 0.00 H new ATOM 879 N ILE A 61 -4.155 9.739 -7.570 1.00 0.00 N ATOM 880 CA ILE A 61 -3.465 8.426 -7.451 1.00 0.00 C ATOM 881 C ILE A 61 -1.952 8.653 -7.415 1.00 0.00 C ATOM 882 O ILE A 61 -1.226 7.967 -6.722 1.00 0.00 O ATOM 883 CB ILE A 61 -3.823 7.554 -8.655 1.00 0.00 C ATOM 884 CG1 ILE A 61 -5.337 7.315 -8.678 1.00 0.00 C ATOM 885 CG2 ILE A 61 -3.089 6.215 -8.556 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.716 6.298 -7.599 1.00 0.00 C ATOM 0 H ILE A 61 -4.849 9.798 -8.315 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.781 7.926 -6.535 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.523 8.059 -9.573 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.865 8.253 -8.509 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.642 6.950 -9.659 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.346 5.595 -9.415 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.013 6.390 -8.543 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.385 5.705 -7.639 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.793 6.131 -7.619 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.199 5.357 -7.788 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.426 6.681 -6.620 1.00 0.00 H new ATOM 898 N ALA A 62 -1.471 9.611 -8.159 1.00 0.00 N ATOM 899 CA ALA A 62 -0.004 9.881 -8.170 1.00 0.00 C ATOM 900 C ALA A 62 0.399 10.595 -6.876 1.00 0.00 C ATOM 901 O ALA A 62 1.485 10.407 -6.366 1.00 0.00 O ATOM 902 CB ALA A 62 0.341 10.769 -9.368 1.00 0.00 C ATOM 0 H ALA A 62 -2.029 10.218 -8.759 1.00 0.00 H new ATOM 0 HA ALA A 62 0.536 8.937 -8.246 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.413 10.967 -9.377 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.058 10.262 -10.290 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.202 11.711 -9.291 1.00 0.00 H new ATOM 908 N ASN A 63 -0.465 11.414 -6.345 1.00 0.00 N ATOM 909 CA ASN A 63 -0.128 12.143 -5.088 1.00 0.00 C ATOM 910 C ASN A 63 0.122 11.140 -3.959 1.00 0.00 C ATOM 911 O ASN A 63 0.717 11.464 -2.950 1.00 0.00 O ATOM 912 CB ASN A 63 -1.291 13.061 -4.705 1.00 0.00 C ATOM 913 CG ASN A 63 -0.784 14.498 -4.571 1.00 0.00 C ATOM 914 OD1 ASN A 63 -0.943 15.117 -3.538 1.00 0.00 O ATOM 915 ND2 ASN A 63 -0.175 15.058 -5.579 1.00 0.00 N ATOM 0 H ASN A 63 -1.390 11.611 -6.726 1.00 0.00 H new ATOM 0 HA ASN A 63 0.771 12.738 -5.247 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.074 13.009 -5.462 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.734 12.731 -3.765 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.168 16.015 -5.500 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -0.041 14.539 -6.447 1.00 0.00 H new ATOM 922 N ASN A 64 -0.328 9.925 -4.115 1.00 0.00 N ATOM 923 CA ASN A 64 -0.114 8.910 -3.044 1.00 0.00 C ATOM 924 C ASN A 64 1.198 8.165 -3.296 1.00 0.00 C ATOM 925 O ASN A 64 1.363 7.029 -2.899 1.00 0.00 O ATOM 926 CB ASN A 64 -1.276 7.914 -3.043 1.00 0.00 C ATOM 927 CG ASN A 64 -1.960 7.929 -1.675 1.00 0.00 C ATOM 928 OD1 ASN A 64 -2.972 8.576 -1.496 1.00 0.00 O ATOM 929 ND2 ASN A 64 -1.447 7.236 -0.694 1.00 0.00 N ATOM 0 H ASN A 64 -0.834 9.591 -4.936 1.00 0.00 H new ATOM 0 HA ASN A 64 -0.065 9.411 -2.077 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.992 8.174 -3.822 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.910 6.912 -3.268 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.896 7.238 0.222 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -0.597 6.692 -0.844 1.00 0.00 H new ATOM 936 N GLY A 65 2.136 8.796 -3.950 1.00 0.00 N ATOM 937 CA GLY A 65 3.436 8.120 -4.223 1.00 0.00 C ATOM 938 C GLY A 65 3.180 6.687 -4.689 1.00 0.00 C ATOM 939 O GLY A 65 3.875 5.765 -4.310 1.00 0.00 O ATOM 0 H GLY A 65 2.058 9.749 -4.306 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.989 8.668 -4.986 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.052 8.116 -3.323 1.00 0.00 H new ATOM 943 N VAL A 66 2.185 6.492 -5.509 1.00 0.00 N ATOM 944 CA VAL A 66 1.880 5.119 -6.002 1.00 0.00 C ATOM 945 C VAL A 66 2.724 4.817 -7.235 1.00 0.00 C ATOM 946 O VAL A 66 2.368 5.161 -8.345 1.00 0.00 O ATOM 947 CB VAL A 66 0.397 5.024 -6.364 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.018 3.553 -6.426 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.435 5.742 -5.300 1.00 0.00 C ATOM 0 H VAL A 66 1.569 7.225 -5.860 1.00 0.00 H new ATOM 0 HA VAL A 66 2.111 4.396 -5.220 1.00 0.00 H new ATOM 0 HB VAL A 66 0.229 5.492 -7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.075 3.484 -6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.575 3.039 -7.183 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.150 3.086 -5.455 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.492 5.674 -5.558 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.267 5.274 -4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.139 6.790 -5.253 1.00 0.00 H new ATOM 959 N LYS A 67 3.833 4.159 -7.052 1.00 0.00 N ATOM 960 CA LYS A 67 4.688 3.816 -8.217 1.00 0.00 C ATOM 961 C LYS A 67 4.079 2.602 -8.917 1.00 0.00 C ATOM 962 O LYS A 67 4.457 2.249 -10.017 1.00 0.00 O ATOM 963 CB LYS A 67 6.102 3.477 -7.736 1.00 0.00 C ATOM 964 CG LYS A 67 7.119 3.922 -8.790 1.00 0.00 C ATOM 965 CD LYS A 67 7.162 5.450 -8.845 1.00 0.00 C ATOM 966 CE LYS A 67 8.539 5.904 -9.330 1.00 0.00 C ATOM 967 NZ LYS A 67 8.398 7.151 -10.133 1.00 0.00 N ATOM 0 H LYS A 67 4.183 3.845 -6.147 1.00 0.00 H new ATOM 0 HA LYS A 67 4.743 4.660 -8.905 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.304 3.974 -6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.191 2.405 -7.559 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.106 3.528 -8.547 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.847 3.520 -9.766 1.00 0.00 H new ATOM 0 HD2 LYS A 67 6.387 5.822 -9.516 1.00 0.00 H new ATOM 0 HD3 LYS A 67 6.957 5.866 -7.859 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.196 6.080 -8.478 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.000 5.121 -9.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.335 7.459 -10.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.785 6.968 -10.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.975 7.897 -9.544 1.00 0.00 H new ATOM 981 N ALA A 68 3.124 1.968 -8.288 1.00 0.00 N ATOM 982 CA ALA A 68 2.474 0.782 -8.914 1.00 0.00 C ATOM 983 C ALA A 68 0.962 0.877 -8.707 1.00 0.00 C ATOM 984 O ALA A 68 0.487 1.015 -7.599 1.00 0.00 O ATOM 985 CB ALA A 68 3.001 -0.497 -8.259 1.00 0.00 C ATOM 0 H ALA A 68 2.767 2.222 -7.367 1.00 0.00 H new ATOM 0 HA ALA A 68 2.700 0.758 -9.980 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.525 -1.364 -8.718 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.080 -0.559 -8.399 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.774 -0.480 -7.193 1.00 0.00 H new ATOM 991 N VAL A 69 0.198 0.812 -9.764 1.00 0.00 N ATOM 992 CA VAL A 69 -1.282 0.908 -9.614 1.00 0.00 C ATOM 993 C VAL A 69 -1.951 -0.313 -10.246 1.00 0.00 C ATOM 994 O VAL A 69 -1.822 -0.564 -11.429 1.00 0.00 O ATOM 995 CB VAL A 69 -1.781 2.178 -10.304 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.301 2.273 -10.160 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.131 3.401 -9.651 1.00 0.00 C ATOM 0 H VAL A 69 0.533 0.697 -10.721 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.533 0.944 -8.554 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.517 2.145 -11.361 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.657 3.178 -10.652 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.765 1.402 -10.622 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.565 2.306 -9.103 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.486 4.307 -10.142 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.396 3.433 -8.594 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.048 3.334 -9.751 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.673 -1.070 -9.466 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.362 -2.272 -10.014 1.00 0.00 C ATOM 1009 C ILE A 70 -4.845 -1.948 -10.214 1.00 0.00 C ATOM 1010 O ILE A 70 -5.568 -1.713 -9.267 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.217 -3.434 -9.029 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -1.793 -3.989 -9.106 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -4.212 -4.543 -9.381 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -0.984 -3.491 -7.907 1.00 0.00 C ATOM 0 H ILE A 70 -2.816 -0.907 -8.469 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.916 -2.553 -10.968 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.420 -3.076 -8.020 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.816 -5.079 -9.115 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.318 -3.673 -10.035 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.103 -5.367 -8.676 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.228 -4.151 -9.327 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.015 -4.902 -10.391 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.030 -3.887 -7.963 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.949 -2.402 -7.919 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.455 -3.829 -6.984 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.303 -1.928 -11.436 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.737 -1.613 -11.683 1.00 0.00 C ATOM 1028 C ALA A 71 -7.204 -2.293 -12.970 1.00 0.00 C ATOM 1029 O ALA A 71 -6.422 -2.866 -13.703 1.00 0.00 O ATOM 1030 CB ALA A 71 -6.906 -0.098 -11.820 1.00 0.00 C ATOM 0 H ALA A 71 -4.748 -2.116 -12.271 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.335 -1.977 -10.847 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.955 0.136 -12.001 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.579 0.389 -10.901 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.305 0.261 -12.655 1.00 0.00 H new ATOM 1036 N SER A 72 -8.477 -2.231 -13.250 1.00 0.00 N ATOM 1037 CA SER A 72 -9.006 -2.870 -14.488 1.00 0.00 C ATOM 1038 C SER A 72 -9.982 -1.910 -15.174 1.00 0.00 C ATOM 1039 O SER A 72 -11.122 -2.245 -15.427 1.00 0.00 O ATOM 1040 CB SER A 72 -9.735 -4.163 -14.122 1.00 0.00 C ATOM 1041 OG SER A 72 -11.061 -3.856 -13.714 1.00 0.00 O ATOM 0 H SER A 72 -9.176 -1.764 -12.672 1.00 0.00 H new ATOM 0 HA SER A 72 -8.182 -3.098 -15.164 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.753 -4.838 -14.977 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.206 -4.678 -13.320 1.00 0.00 H new ATOM 0 HG SER A 72 -11.569 -3.516 -14.480 1.00 0.00 H new ATOM 1047 N SER A 73 -9.543 -0.717 -15.474 1.00 0.00 N ATOM 1048 CA SER A 73 -10.445 0.265 -16.138 1.00 0.00 C ATOM 1049 C SER A 73 -11.009 -0.343 -17.427 1.00 0.00 C ATOM 1050 O SER A 73 -10.390 -1.195 -18.032 1.00 0.00 O ATOM 1051 CB SER A 73 -9.660 1.532 -16.475 1.00 0.00 C ATOM 1052 OG SER A 73 -10.082 2.587 -15.620 1.00 0.00 O ATOM 0 H SER A 73 -8.598 -0.381 -15.287 1.00 0.00 H new ATOM 0 HA SER A 73 -11.266 0.513 -15.465 1.00 0.00 H new ATOM 0 HB2 SER A 73 -8.591 1.355 -16.353 1.00 0.00 H new ATOM 0 HB3 SER A 73 -9.821 1.807 -17.517 1.00 0.00 H new ATOM 0 HG SER A 73 -10.289 3.380 -16.157 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.174 0.121 -17.806 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.863 -0.350 -19.020 1.00 0.00 C ATOM 1060 C PRO A 74 -12.258 0.301 -20.268 1.00 0.00 C ATOM 1061 O PRO A 74 -12.505 -0.120 -21.380 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.308 0.112 -18.812 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.252 1.284 -17.803 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.912 1.159 -17.056 1.00 0.00 C ATOM 0 HA PRO A 74 -12.780 -1.426 -19.170 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.753 0.432 -19.754 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.924 -0.701 -18.429 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.320 2.242 -18.318 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.089 1.236 -17.107 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.371 2.105 -17.048 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.061 0.868 -16.016 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.470 1.326 -20.093 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.854 2.001 -21.272 1.00 0.00 C ATOM 1074 C GLY A 75 -9.402 2.374 -20.953 1.00 0.00 C ATOM 1075 O GLY A 75 -9.016 2.425 -19.803 1.00 0.00 O ATOM 0 H GLY A 75 -11.226 1.725 -19.187 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.888 1.342 -22.140 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.421 2.896 -21.529 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.643 2.623 -21.989 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.222 2.997 -21.864 1.00 0.00 C ATOM 1081 C PRO A 76 -7.090 4.474 -21.478 1.00 0.00 C ATOM 1082 O PRO A 76 -6.008 4.965 -21.227 1.00 0.00 O ATOM 1083 CB PRO A 76 -6.664 2.749 -23.269 1.00 0.00 C ATOM 1084 CG PRO A 76 -7.871 2.803 -24.235 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.129 2.553 -23.383 1.00 0.00 C ATOM 0 HA PRO A 76 -6.695 2.434 -21.094 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.923 3.504 -23.531 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.166 1.781 -23.324 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -7.926 3.771 -24.732 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -7.776 2.049 -25.016 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.896 3.303 -23.575 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.572 1.581 -23.602 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.183 5.185 -21.433 1.00 0.00 N ATOM 1094 CA ASN A 77 -8.120 6.628 -21.067 1.00 0.00 C ATOM 1095 C ASN A 77 -7.480 6.781 -19.685 1.00 0.00 C ATOM 1096 O ASN A 77 -6.795 7.745 -19.411 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.534 7.211 -21.041 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.496 8.665 -21.516 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -8.729 9.009 -22.395 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -10.296 9.538 -20.970 1.00 0.00 N ATOM 0 H ASN A 77 -9.117 4.829 -21.634 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.520 7.161 -21.805 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.192 6.625 -21.682 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.942 7.158 -20.032 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -10.279 10.510 -21.280 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -10.939 9.249 -20.233 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.700 5.837 -18.812 1.00 0.00 N ATOM 1108 CA ALA A 78 -7.103 5.931 -17.448 1.00 0.00 C ATOM 1109 C ALA A 78 -5.596 5.685 -17.534 1.00 0.00 C ATOM 1110 O ALA A 78 -4.797 6.532 -17.185 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.742 4.878 -16.540 1.00 0.00 C ATOM 0 H ALA A 78 -8.266 5.006 -18.983 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.286 6.924 -17.037 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.307 4.945 -15.543 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.816 5.053 -16.480 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.559 3.885 -16.950 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.200 4.532 -17.998 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.745 4.236 -18.107 1.00 0.00 C ATOM 1119 C PHE A 79 -3.058 5.373 -18.865 1.00 0.00 C ATOM 1120 O PHE A 79 -1.866 5.582 -18.745 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.545 2.921 -18.862 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.519 1.891 -18.345 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -4.950 1.940 -17.013 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -4.994 0.886 -19.198 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.855 0.984 -16.533 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -5.899 -0.070 -18.719 1.00 0.00 C ATOM 1127 CZ PHE A 79 -6.330 -0.021 -17.387 1.00 0.00 C ATOM 0 H PHE A 79 -5.821 3.783 -18.306 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.313 4.146 -17.110 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.696 3.076 -19.930 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.522 2.567 -18.733 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.585 2.715 -16.356 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.662 0.848 -20.225 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.186 1.021 -15.506 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.264 -0.845 -19.377 1.00 0.00 H new ATOM 0 HZ PHE A 79 -7.028 -0.758 -17.018 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.802 6.115 -19.641 1.00 0.00 N ATOM 1138 CA GLU A 80 -3.194 7.242 -20.402 1.00 0.00 C ATOM 1139 C GLU A 80 -2.659 8.284 -19.419 1.00 0.00 C ATOM 1140 O GLU A 80 -1.547 8.757 -19.543 1.00 0.00 O ATOM 1141 CB GLU A 80 -4.254 7.881 -21.303 1.00 0.00 C ATOM 1142 CG GLU A 80 -3.566 8.663 -22.424 1.00 0.00 C ATOM 1143 CD GLU A 80 -4.531 9.714 -22.977 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -5.705 9.405 -23.101 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -4.080 10.809 -23.268 1.00 0.00 O ATOM 0 H GLU A 80 -4.805 5.988 -19.780 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.376 6.869 -21.018 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.900 7.111 -21.725 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.890 8.546 -20.719 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.664 9.145 -22.046 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -3.256 7.984 -23.219 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.443 8.644 -18.438 1.00 0.00 N ATOM 1153 CA VAL A 81 -2.976 9.652 -17.444 1.00 0.00 C ATOM 1154 C VAL A 81 -1.871 9.037 -16.586 1.00 0.00 C ATOM 1155 O VAL A 81 -0.861 9.656 -16.316 1.00 0.00 O ATOM 1156 CB VAL A 81 -4.144 10.065 -16.547 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -3.840 11.417 -15.902 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -5.418 10.176 -17.387 1.00 0.00 C ATOM 0 H VAL A 81 -4.385 8.284 -18.283 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.592 10.529 -17.966 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.286 9.315 -15.769 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.673 11.711 -15.263 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.933 11.339 -15.303 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.697 12.167 -16.680 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.251 10.470 -16.748 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.276 10.925 -18.166 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.636 9.212 -17.846 1.00 0.00 H new ATOM 1168 N LEU A 82 -2.055 7.818 -16.157 1.00 0.00 N ATOM 1169 CA LEU A 82 -1.016 7.160 -15.317 1.00 0.00 C ATOM 1170 C LEU A 82 0.274 7.007 -16.126 1.00 0.00 C ATOM 1171 O LEU A 82 1.349 6.864 -15.577 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.511 5.778 -14.885 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.527 5.928 -13.754 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.704 4.981 -13.996 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.861 5.580 -12.421 1.00 0.00 C ATOM 0 H LEU A 82 -2.880 7.250 -16.352 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.822 7.771 -14.435 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.967 5.263 -15.731 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.671 5.167 -14.554 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.887 6.956 -13.724 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.429 5.088 -13.189 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.179 5.227 -14.946 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.344 3.953 -14.026 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.585 5.687 -11.614 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.501 4.552 -12.452 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.022 6.253 -12.247 1.00 0.00 H new ATOM 1187 N ASN A 83 0.176 7.031 -17.427 1.00 0.00 N ATOM 1188 CA ASN A 83 1.395 6.882 -18.270 1.00 0.00 C ATOM 1189 C ASN A 83 2.175 8.200 -18.283 1.00 0.00 C ATOM 1190 O ASN A 83 3.312 8.263 -17.859 1.00 0.00 O ATOM 1191 CB ASN A 83 0.985 6.519 -19.699 1.00 0.00 C ATOM 1192 CG ASN A 83 1.718 5.248 -20.133 1.00 0.00 C ATOM 1193 OD1 ASN A 83 1.932 4.355 -19.337 1.00 0.00 O ATOM 1194 ND2 ASN A 83 2.112 5.127 -21.370 1.00 0.00 N ATOM 0 H ASN A 83 -0.696 7.147 -17.943 1.00 0.00 H new ATOM 0 HA ASN A 83 2.025 6.093 -17.859 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.093 6.366 -19.752 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.224 7.339 -20.377 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.600 4.283 -21.670 1.00 0.00 H new ATOM 0 HD22 ASN A 83 1.932 5.877 -22.038 1.00 0.00 H new ATOM 1201 N GLU A 84 1.576 9.251 -18.770 1.00 0.00 N ATOM 1202 CA GLU A 84 2.286 10.561 -18.814 1.00 0.00 C ATOM 1203 C GLU A 84 2.697 10.972 -17.398 1.00 0.00 C ATOM 1204 O GLU A 84 3.594 11.770 -17.211 1.00 0.00 O ATOM 1205 CB GLU A 84 1.358 11.624 -19.403 1.00 0.00 C ATOM 1206 CG GLU A 84 2.174 12.864 -19.777 1.00 0.00 C ATOM 1207 CD GLU A 84 1.805 14.018 -18.843 1.00 0.00 C ATOM 1208 OE1 GLU A 84 1.375 13.743 -17.735 1.00 0.00 O ATOM 1209 OE2 GLU A 84 1.959 15.157 -19.253 1.00 0.00 O ATOM 0 H GLU A 84 0.625 9.260 -19.140 1.00 0.00 H new ATOM 0 HA GLU A 84 3.176 10.468 -19.436 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.850 11.231 -20.284 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.586 11.888 -18.681 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.240 12.648 -19.702 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.978 13.143 -20.812 1.00 0.00 H new ATOM 1216 N LEU A 85 2.049 10.437 -16.400 1.00 0.00 N ATOM 1217 CA LEU A 85 2.406 10.803 -14.999 1.00 0.00 C ATOM 1218 C LEU A 85 3.738 10.152 -14.621 1.00 0.00 C ATOM 1219 O LEU A 85 4.548 10.735 -13.928 1.00 0.00 O ATOM 1220 CB LEU A 85 1.311 10.313 -14.049 1.00 0.00 C ATOM 1221 CG LEU A 85 0.887 11.456 -13.125 1.00 0.00 C ATOM 1222 CD1 LEU A 85 2.124 12.064 -12.464 1.00 0.00 C ATOM 1223 CD2 LEU A 85 0.166 12.531 -13.941 1.00 0.00 C ATOM 0 H LEU A 85 1.289 9.763 -16.493 1.00 0.00 H new ATOM 0 HA LEU A 85 2.498 11.886 -14.921 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.454 9.955 -14.619 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.676 9.471 -13.460 1.00 0.00 H new ATOM 0 HG LEU A 85 0.216 11.071 -12.357 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.822 12.878 -11.806 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.639 11.299 -11.882 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.795 12.448 -13.232 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.136 13.346 -13.283 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.837 12.915 -14.710 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.717 12.099 -14.413 1.00 0.00 H new ATOM 1235 N GLY A 86 3.974 8.949 -15.071 1.00 0.00 N ATOM 1236 CA GLY A 86 5.256 8.266 -14.735 1.00 0.00 C ATOM 1237 C GLY A 86 4.986 7.130 -13.747 1.00 0.00 C ATOM 1238 O GLY A 86 5.867 6.691 -13.035 1.00 0.00 O ATOM 0 H GLY A 86 3.335 8.410 -15.656 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.719 7.873 -15.640 1.00 0.00 H new ATOM 0 HA3 GLY A 86 5.958 8.979 -14.302 1.00 0.00 H new ATOM 1242 N ILE A 87 3.774 6.650 -13.697 1.00 0.00 N ATOM 1243 CA ILE A 87 3.450 5.542 -12.754 1.00 0.00 C ATOM 1244 C ILE A 87 3.340 4.227 -13.529 1.00 0.00 C ATOM 1245 O ILE A 87 2.976 4.208 -14.688 1.00 0.00 O ATOM 1246 CB ILE A 87 2.119 5.836 -12.060 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.284 7.041 -11.129 1.00 0.00 C ATOM 1248 CG2 ILE A 87 1.689 4.618 -11.242 1.00 0.00 C ATOM 1249 CD1 ILE A 87 1.089 7.982 -11.297 1.00 0.00 C ATOM 0 H ILE A 87 2.994 6.977 -14.268 1.00 0.00 H new ATOM 0 HA ILE A 87 4.240 5.459 -12.007 1.00 0.00 H new ATOM 0 HB ILE A 87 1.360 6.056 -12.811 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.355 6.707 -10.094 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.210 7.568 -11.359 1.00 0.00 H new ATOM 0 HG21 ILE A 87 0.741 4.828 -10.748 1.00 0.00 H new ATOM 0 HG22 ILE A 87 1.571 3.759 -11.903 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.448 4.397 -10.492 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.206 8.840 -10.635 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.039 8.325 -12.330 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.170 7.452 -11.046 1.00 0.00 H new ATOM 1261 N LYS A 88 3.650 3.127 -12.899 1.00 0.00 N ATOM 1262 CA LYS A 88 3.560 1.816 -13.600 1.00 0.00 C ATOM 1263 C LYS A 88 2.103 1.350 -13.619 1.00 0.00 C ATOM 1264 O LYS A 88 1.457 1.262 -12.594 1.00 0.00 O ATOM 1265 CB LYS A 88 4.415 0.783 -12.864 1.00 0.00 C ATOM 1266 CG LYS A 88 5.841 0.816 -13.414 1.00 0.00 C ATOM 1267 CD LYS A 88 6.744 -0.061 -12.545 1.00 0.00 C ATOM 1268 CE LYS A 88 8.025 0.702 -12.206 1.00 0.00 C ATOM 1269 NZ LYS A 88 9.208 -0.139 -12.544 1.00 0.00 N ATOM 0 H LYS A 88 3.962 3.080 -11.929 1.00 0.00 H new ATOM 0 HA LYS A 88 3.922 1.924 -14.622 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.421 0.996 -11.795 1.00 0.00 H new ATOM 0 HB3 LYS A 88 3.989 -0.213 -12.988 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.853 0.460 -14.444 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.214 1.840 -13.426 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.223 -0.343 -11.630 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.987 -0.984 -13.071 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.061 1.639 -12.762 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.039 0.959 -11.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.080 0.379 -12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 9.175 -1.022 -11.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.196 -0.362 -13.560 1.00 0.00 H new ATOM 1283 N ILE A 89 1.578 1.051 -14.776 1.00 0.00 N ATOM 1284 CA ILE A 89 0.162 0.593 -14.850 1.00 0.00 C ATOM 1285 C ILE A 89 0.110 -0.930 -14.727 1.00 0.00 C ATOM 1286 O ILE A 89 0.944 -1.636 -15.260 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.445 1.015 -16.188 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.481 2.543 -16.271 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.868 0.465 -16.297 1.00 0.00 C ATOM 1290 CD1 ILE A 89 0.620 3.029 -17.215 1.00 0.00 C ATOM 0 H ILE A 89 2.066 1.104 -15.670 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.405 1.044 -14.036 1.00 0.00 H new ATOM 0 HB ILE A 89 0.161 0.621 -17.004 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.455 2.875 -16.630 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.342 2.975 -15.280 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.302 0.765 -17.251 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.843 -0.623 -16.236 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.474 0.860 -15.482 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.594 4.117 -17.274 1.00 0.00 H new ATOM 0 HD12 ILE A 89 1.591 2.709 -16.837 1.00 0.00 H new ATOM 0 HD13 ILE A 89 0.460 2.608 -18.208 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.866 -1.445 -14.028 1.00 0.00 N ATOM 1303 CA TYR A 90 -0.969 -2.922 -13.873 1.00 0.00 C ATOM 1304 C TYR A 90 -2.376 -3.380 -14.261 1.00 0.00 C ATOM 1305 O TYR A 90 -3.364 -2.872 -13.768 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.690 -3.305 -12.419 1.00 0.00 C ATOM 1307 CG TYR A 90 0.738 -3.776 -12.292 1.00 0.00 C ATOM 1308 CD1 TYR A 90 1.787 -2.955 -12.725 1.00 0.00 C ATOM 1309 CD2 TYR A 90 1.015 -5.035 -11.744 1.00 0.00 C ATOM 1310 CE1 TYR A 90 3.113 -3.392 -12.609 1.00 0.00 C ATOM 1311 CE2 TYR A 90 2.341 -5.473 -11.627 1.00 0.00 C ATOM 1312 CZ TYR A 90 3.390 -4.651 -12.061 1.00 0.00 C ATOM 1313 OH TYR A 90 4.696 -5.082 -11.947 1.00 0.00 O ATOM 0 H TYR A 90 -1.594 -0.907 -13.559 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.238 -3.406 -14.521 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.862 -2.449 -11.766 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.374 -4.092 -12.100 1.00 0.00 H new ATOM 0 HD1 TYR A 90 1.574 -1.985 -13.148 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.206 -5.669 -11.411 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.922 -2.758 -12.942 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.554 -6.443 -11.203 1.00 0.00 H new ATOM 0 HH TYR A 90 4.712 -5.976 -11.546 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.475 -4.336 -15.144 1.00 0.00 N ATOM 1324 CA ARG A 91 -3.818 -4.826 -15.565 1.00 0.00 C ATOM 1325 C ARG A 91 -4.279 -5.930 -14.613 1.00 0.00 C ATOM 1326 O ARG A 91 -3.613 -6.931 -14.438 1.00 0.00 O ATOM 1327 CB ARG A 91 -3.738 -5.379 -16.990 1.00 0.00 C ATOM 1328 CG ARG A 91 -3.758 -4.219 -17.987 1.00 0.00 C ATOM 1329 CD ARG A 91 -3.878 -4.767 -19.410 1.00 0.00 C ATOM 1330 NE ARG A 91 -3.771 -3.643 -20.384 1.00 0.00 N ATOM 1331 CZ ARG A 91 -4.290 -3.758 -21.576 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -4.469 -4.940 -22.099 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -4.631 -2.691 -22.246 1.00 0.00 N ATOM 0 H ARG A 91 -1.684 -4.799 -15.592 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.530 -4.001 -15.537 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.827 -5.964 -17.114 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.576 -6.050 -17.179 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -4.595 -3.555 -17.771 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -2.848 -3.627 -17.890 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.093 -5.500 -19.596 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.831 -5.281 -19.534 1.00 0.00 H new ATOM 0 HE ARG A 91 -3.291 -2.783 -20.118 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.203 -5.775 -21.576 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.875 -5.029 -23.031 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.492 -1.767 -21.838 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -5.037 -2.782 -23.178 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.415 -5.756 -13.994 1.00 0.00 N ATOM 1348 CA ALA A 92 -5.919 -6.796 -13.055 1.00 0.00 C ATOM 1349 C ALA A 92 -6.777 -7.804 -13.823 1.00 0.00 C ATOM 1350 O ALA A 92 -7.748 -7.448 -14.461 1.00 0.00 O ATOM 1351 CB ALA A 92 -6.761 -6.135 -11.963 1.00 0.00 C ATOM 0 H ALA A 92 -6.015 -4.938 -14.099 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.075 -7.312 -12.598 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.129 -6.897 -11.276 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.149 -5.418 -11.415 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.606 -5.618 -12.418 1.00 0.00 H new ATOM 1357 N THR A 93 -6.424 -9.059 -13.767 1.00 0.00 N ATOM 1358 CA THR A 93 -7.218 -10.088 -14.495 1.00 0.00 C ATOM 1359 C THR A 93 -8.622 -10.172 -13.893 1.00 0.00 C ATOM 1360 O THR A 93 -9.603 -10.308 -14.597 1.00 0.00 O ATOM 1361 CB THR A 93 -6.526 -11.448 -14.369 1.00 0.00 C ATOM 1362 OG1 THR A 93 -5.719 -11.459 -13.199 1.00 0.00 O ATOM 1363 CG2 THR A 93 -5.650 -11.692 -15.598 1.00 0.00 C ATOM 0 H THR A 93 -5.621 -9.416 -13.249 1.00 0.00 H new ATOM 0 HA THR A 93 -7.291 -9.813 -15.547 1.00 0.00 H new ATOM 0 HB THR A 93 -7.277 -12.235 -14.300 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.809 -11.175 -13.427 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.158 -12.660 -15.508 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.270 -11.682 -16.494 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.897 -10.907 -15.670 1.00 0.00 H new ATOM 1371 N GLY A 94 -8.726 -10.092 -12.594 1.00 0.00 N ATOM 1372 CA GLY A 94 -10.068 -10.166 -11.951 1.00 0.00 C ATOM 1373 C GLY A 94 -10.140 -11.407 -11.058 1.00 0.00 C ATOM 1374 O GLY A 94 -11.045 -12.209 -11.167 1.00 0.00 O ATOM 0 H GLY A 94 -7.941 -9.979 -11.952 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.249 -9.269 -11.359 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -10.846 -10.208 -12.713 1.00 0.00 H new ATOM 1378 N THR A 95 -9.193 -11.569 -10.174 1.00 0.00 N ATOM 1379 CA THR A 95 -9.208 -12.757 -9.275 1.00 0.00 C ATOM 1380 C THR A 95 -9.417 -12.297 -7.830 1.00 0.00 C ATOM 1381 O THR A 95 -10.518 -12.311 -7.318 1.00 0.00 O ATOM 1382 CB THR A 95 -7.873 -13.498 -9.386 1.00 0.00 C ATOM 1383 OG1 THR A 95 -7.760 -14.075 -10.680 1.00 0.00 O ATOM 1384 CG2 THR A 95 -7.806 -14.598 -8.326 1.00 0.00 C ATOM 0 H THR A 95 -8.410 -10.930 -10.036 1.00 0.00 H new ATOM 0 HA THR A 95 -10.019 -13.425 -9.567 1.00 0.00 H new ATOM 0 HB THR A 95 -7.054 -12.796 -9.228 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.905 -14.548 -10.754 1.00 0.00 H new ATOM 0 HG21 THR A 95 -6.855 -15.124 -8.407 1.00 0.00 H new ATOM 0 HG22 THR A 95 -7.891 -14.153 -7.334 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.624 -15.302 -8.480 1.00 0.00 H new ATOM 1392 N SER A 96 -8.366 -11.888 -7.172 1.00 0.00 N ATOM 1393 CA SER A 96 -8.505 -11.426 -5.762 1.00 0.00 C ATOM 1394 C SER A 96 -7.330 -10.510 -5.410 1.00 0.00 C ATOM 1395 O SER A 96 -6.181 -10.851 -5.611 1.00 0.00 O ATOM 1396 CB SER A 96 -8.517 -12.640 -4.827 1.00 0.00 C ATOM 1397 OG SER A 96 -7.373 -12.610 -3.983 1.00 0.00 O ATOM 0 H SER A 96 -7.419 -11.854 -7.549 1.00 0.00 H new ATOM 0 HA SER A 96 -9.438 -10.875 -5.646 1.00 0.00 H new ATOM 0 HB2 SER A 96 -9.425 -12.637 -4.224 1.00 0.00 H new ATOM 0 HB3 SER A 96 -8.525 -13.560 -5.411 1.00 0.00 H new ATOM 0 HG SER A 96 -7.386 -13.387 -3.386 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.609 -9.347 -4.887 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.508 -8.410 -4.524 1.00 0.00 C ATOM 1405 C VAL A 97 -5.476 -9.142 -3.664 1.00 0.00 C ATOM 1406 O VAL A 97 -4.327 -8.756 -3.593 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.075 -7.227 -3.736 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -7.539 -6.141 -4.709 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -8.263 -7.695 -2.893 1.00 0.00 C ATOM 0 H VAL A 97 -8.551 -9.005 -4.696 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.033 -8.045 -5.435 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.302 -6.824 -3.082 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.943 -5.298 -4.148 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.694 -5.805 -5.310 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -8.311 -6.545 -5.363 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.666 -6.852 -2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.036 -8.099 -3.547 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.934 -8.468 -2.199 1.00 0.00 H new ATOM 1419 N GLU A 98 -5.876 -10.199 -3.010 1.00 0.00 N ATOM 1420 CA GLU A 98 -4.915 -10.955 -2.158 1.00 0.00 C ATOM 1421 C GLU A 98 -3.843 -11.589 -3.045 1.00 0.00 C ATOM 1422 O GLU A 98 -2.662 -11.471 -2.787 1.00 0.00 O ATOM 1423 CB GLU A 98 -5.661 -12.052 -1.396 1.00 0.00 C ATOM 1424 CG GLU A 98 -5.361 -11.930 0.100 1.00 0.00 C ATOM 1425 CD GLU A 98 -4.201 -12.859 0.466 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.097 -13.912 -0.139 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -3.436 -12.500 1.348 1.00 0.00 O ATOM 0 H GLU A 98 -6.826 -10.571 -3.029 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.446 -10.276 -1.447 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.733 -11.966 -1.571 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.357 -13.033 -1.760 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.107 -10.899 0.348 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -6.246 -12.189 0.681 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.245 -12.259 -4.090 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.246 -12.897 -4.994 1.00 0.00 C ATOM 1436 C GLU A 99 -2.507 -11.811 -5.778 1.00 0.00 C ATOM 1437 O GLU A 99 -1.370 -11.979 -6.169 1.00 0.00 O ATOM 1438 CB GLU A 99 -3.961 -13.833 -5.969 1.00 0.00 C ATOM 1439 CG GLU A 99 -2.979 -14.283 -7.054 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.403 -15.650 -7.592 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -4.254 -16.269 -6.975 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -2.871 -16.054 -8.612 1.00 0.00 O ATOM 0 H GLU A 99 -5.220 -12.392 -4.357 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.533 -13.470 -4.402 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.354 -14.699 -5.437 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.812 -13.324 -6.422 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.956 -13.553 -7.863 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -1.970 -14.338 -6.646 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.146 -10.696 -6.008 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.479 -9.600 -6.763 1.00 0.00 C ATOM 1451 C ASN A 100 -1.277 -9.093 -5.967 1.00 0.00 C ATOM 1452 O ASN A 100 -0.185 -8.965 -6.484 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.468 -8.452 -6.978 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.592 -8.913 -7.907 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -5.162 -9.969 -7.714 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -4.937 -8.160 -8.915 1.00 0.00 N ATOM 0 H ASN A 100 -4.100 -10.498 -5.706 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.144 -9.976 -7.730 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -3.881 -8.130 -6.022 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.955 -7.592 -7.409 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.685 -8.457 -9.541 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -4.459 -7.274 -9.077 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.469 -8.803 -4.708 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.337 -8.306 -3.877 1.00 0.00 C ATOM 1465 C LEU A 101 0.796 -9.332 -3.901 1.00 0.00 C ATOM 1466 O LEU A 101 1.910 -9.034 -4.285 1.00 0.00 O ATOM 1467 CB LEU A 101 -0.811 -8.101 -2.437 1.00 0.00 C ATOM 1468 CG LEU A 101 0.304 -7.445 -1.623 1.00 0.00 C ATOM 1469 CD1 LEU A 101 0.682 -6.108 -2.264 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -0.182 -7.203 -0.193 1.00 0.00 C ATOM 0 H LEU A 101 -2.361 -8.889 -4.220 1.00 0.00 H new ATOM 0 HA LEU A 101 0.021 -7.358 -4.278 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.703 -7.475 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.085 -9.058 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 101 1.174 -8.101 -1.605 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.477 -5.639 -1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.028 -6.278 -3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -0.189 -5.453 -2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.613 -6.735 0.387 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.052 -6.547 -0.211 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.454 -8.154 0.265 1.00 0.00 H new ATOM 1482 N LYS A 102 0.523 -10.542 -3.497 1.00 0.00 N ATOM 1483 CA LYS A 102 1.584 -11.585 -3.502 1.00 0.00 C ATOM 1484 C LYS A 102 2.151 -11.721 -4.916 1.00 0.00 C ATOM 1485 O LYS A 102 3.280 -12.129 -5.106 1.00 0.00 O ATOM 1486 CB LYS A 102 0.987 -12.923 -3.058 1.00 0.00 C ATOM 1487 CG LYS A 102 1.945 -13.609 -2.083 1.00 0.00 C ATOM 1488 CD LYS A 102 3.315 -13.772 -2.743 1.00 0.00 C ATOM 1489 CE LYS A 102 4.131 -14.816 -1.979 1.00 0.00 C ATOM 1490 NZ LYS A 102 5.203 -15.354 -2.864 1.00 0.00 N ATOM 0 H LYS A 102 -0.390 -10.852 -3.164 1.00 0.00 H new ATOM 0 HA LYS A 102 2.381 -11.300 -2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.020 -12.762 -2.582 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.813 -13.562 -3.924 1.00 0.00 H new ATOM 0 HG2 LYS A 102 2.037 -13.019 -1.171 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.551 -14.583 -1.794 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.195 -14.078 -3.782 1.00 0.00 H new ATOM 0 HD3 LYS A 102 3.842 -12.818 -2.751 1.00 0.00 H new ATOM 0 HE2 LYS A 102 4.571 -14.368 -1.088 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.483 -15.625 -1.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.758 -16.064 -2.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.773 -15.796 -3.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.827 -14.578 -3.164 1.00 0.00 H new ATOM 1504 N LEU A 103 1.378 -11.381 -5.911 1.00 0.00 N ATOM 1505 CA LEU A 103 1.874 -11.488 -7.311 1.00 0.00 C ATOM 1506 C LEU A 103 2.926 -10.404 -7.561 1.00 0.00 C ATOM 1507 O LEU A 103 3.904 -10.622 -8.249 1.00 0.00 O ATOM 1508 CB LEU A 103 0.707 -11.308 -8.283 1.00 0.00 C ATOM 1509 CG LEU A 103 0.550 -12.572 -9.129 1.00 0.00 C ATOM 1510 CD1 LEU A 103 -0.932 -12.809 -9.424 1.00 0.00 C ATOM 1511 CD2 LEU A 103 1.311 -12.403 -10.445 1.00 0.00 C ATOM 0 H LEU A 103 0.424 -11.034 -5.814 1.00 0.00 H new ATOM 0 HA LEU A 103 2.321 -12.470 -7.466 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.212 -11.110 -7.732 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.885 -10.446 -8.926 1.00 0.00 H new ATOM 0 HG LEU A 103 0.952 -13.426 -8.583 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.043 -13.710 -10.027 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.475 -12.930 -8.487 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.336 -11.956 -9.969 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.199 -13.304 -11.048 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.909 -11.549 -10.990 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.367 -12.235 -10.235 1.00 0.00 H new ATOM 1523 N PHE A 104 2.737 -9.238 -7.004 1.00 0.00 N ATOM 1524 CA PHE A 104 3.732 -8.149 -7.207 1.00 0.00 C ATOM 1525 C PHE A 104 5.054 -8.548 -6.551 1.00 0.00 C ATOM 1526 O PHE A 104 6.109 -8.064 -6.909 1.00 0.00 O ATOM 1527 CB PHE A 104 3.216 -6.857 -6.569 1.00 0.00 C ATOM 1528 CG PHE A 104 3.992 -5.681 -7.111 1.00 0.00 C ATOM 1529 CD1 PHE A 104 5.294 -5.432 -6.658 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.410 -4.838 -8.066 1.00 0.00 C ATOM 1531 CE1 PHE A 104 6.015 -4.340 -7.161 1.00 0.00 C ATOM 1532 CE2 PHE A 104 4.129 -3.746 -8.570 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.432 -3.497 -8.117 1.00 0.00 C ATOM 0 H PHE A 104 1.938 -8.994 -6.419 1.00 0.00 H new ATOM 0 HA PHE A 104 3.885 -7.988 -8.274 1.00 0.00 H new ATOM 0 HB2 PHE A 104 2.154 -6.734 -6.781 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.321 -6.907 -5.485 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.743 -6.082 -5.921 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.406 -5.030 -8.414 1.00 0.00 H new ATOM 0 HE1 PHE A 104 7.019 -4.148 -6.812 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.680 -3.097 -9.307 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.987 -2.655 -8.505 1.00 0.00 H new ATOM 1543 N THR A 105 5.002 -9.434 -5.594 1.00 0.00 N ATOM 1544 CA THR A 105 6.252 -9.873 -4.915 1.00 0.00 C ATOM 1545 C THR A 105 7.222 -10.434 -5.955 1.00 0.00 C ATOM 1546 O THR A 105 8.425 -10.359 -5.802 1.00 0.00 O ATOM 1547 CB THR A 105 5.919 -10.961 -3.890 1.00 0.00 C ATOM 1548 OG1 THR A 105 4.580 -10.798 -3.445 1.00 0.00 O ATOM 1549 CG2 THR A 105 6.872 -10.855 -2.699 1.00 0.00 C ATOM 0 H THR A 105 4.146 -9.873 -5.253 1.00 0.00 H new ATOM 0 HA THR A 105 6.711 -9.024 -4.408 1.00 0.00 H new ATOM 0 HB THR A 105 6.031 -11.941 -4.353 1.00 0.00 H new ATOM 0 HG1 THR A 105 4.557 -10.811 -2.465 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.633 -11.630 -1.971 1.00 0.00 H new ATOM 0 HG22 THR A 105 7.899 -10.984 -3.042 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.765 -9.875 -2.234 1.00 0.00 H new ATOM 1557 N GLU A 106 6.707 -10.994 -7.016 1.00 0.00 N ATOM 1558 CA GLU A 106 7.596 -11.560 -8.069 1.00 0.00 C ATOM 1559 C GLU A 106 7.469 -10.730 -9.349 1.00 0.00 C ATOM 1560 O GLU A 106 8.142 -10.979 -10.330 1.00 0.00 O ATOM 1561 CB GLU A 106 7.188 -13.006 -8.352 1.00 0.00 C ATOM 1562 CG GLU A 106 7.242 -13.814 -7.055 1.00 0.00 C ATOM 1563 CD GLU A 106 8.702 -14.069 -6.675 1.00 0.00 C ATOM 1564 OE1 GLU A 106 9.437 -14.557 -7.518 1.00 0.00 O ATOM 1565 OE2 GLU A 106 9.060 -13.771 -5.547 1.00 0.00 O ATOM 0 H GLU A 106 5.708 -11.084 -7.199 1.00 0.00 H new ATOM 0 HA GLU A 106 8.630 -11.534 -7.725 1.00 0.00 H new ATOM 0 HB2 GLU A 106 6.182 -13.036 -8.770 1.00 0.00 H new ATOM 0 HB3 GLU A 106 7.855 -13.445 -9.094 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.736 -13.273 -6.255 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.717 -14.761 -7.181 1.00 0.00 H new ATOM 1572 N GLY A 107 6.612 -9.745 -9.348 1.00 0.00 N ATOM 1573 CA GLY A 107 6.447 -8.900 -10.565 1.00 0.00 C ATOM 1574 C GLY A 107 5.973 -9.765 -11.733 1.00 0.00 C ATOM 1575 O GLY A 107 6.400 -9.594 -12.858 1.00 0.00 O ATOM 0 H GLY A 107 6.020 -9.489 -8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.726 -8.105 -10.373 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.392 -8.419 -10.816 1.00 0.00 H new ATOM 1579 N ASN A 108 5.092 -10.695 -11.480 1.00 0.00 N ATOM 1580 CA ASN A 108 4.592 -11.567 -12.579 1.00 0.00 C ATOM 1581 C ASN A 108 3.301 -10.977 -13.148 1.00 0.00 C ATOM 1582 O ASN A 108 2.882 -11.311 -14.239 1.00 0.00 O ATOM 1583 CB ASN A 108 4.318 -12.970 -12.036 1.00 0.00 C ATOM 1584 CG ASN A 108 4.410 -13.985 -13.177 1.00 0.00 C ATOM 1585 OD1 ASN A 108 4.828 -13.653 -14.268 1.00 0.00 O ATOM 1586 ND2 ASN A 108 4.035 -15.218 -12.969 1.00 0.00 N ATOM 0 H ASN A 108 4.697 -10.888 -10.559 1.00 0.00 H new ATOM 0 HA ASN A 108 5.343 -11.626 -13.367 1.00 0.00 H new ATOM 0 HB2 ASN A 108 5.039 -13.217 -11.256 1.00 0.00 H new ATOM 0 HB3 ASN A 108 3.329 -13.008 -11.580 1.00 0.00 H new ATOM 0 HD21 ASN A 108 4.093 -15.903 -13.723 1.00 0.00 H new ATOM 0 HD22 ASN A 108 3.684 -15.497 -12.053 1.00 0.00 H new ATOM 1593 N LEU A 109 2.667 -10.099 -12.419 1.00 0.00 N ATOM 1594 CA LEU A 109 1.405 -9.486 -12.919 1.00 0.00 C ATOM 1595 C LEU A 109 1.661 -8.840 -14.282 1.00 0.00 C ATOM 1596 O LEU A 109 2.693 -9.042 -14.891 1.00 0.00 O ATOM 1597 CB LEU A 109 0.930 -8.417 -11.932 1.00 0.00 C ATOM 1598 CG LEU A 109 -0.219 -8.970 -11.090 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -0.655 -7.918 -10.069 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -1.399 -9.315 -12.001 1.00 0.00 C ATOM 0 H LEU A 109 2.969 -9.780 -11.498 1.00 0.00 H new ATOM 0 HA LEU A 109 0.640 -10.256 -13.016 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.754 -8.113 -11.286 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.603 -7.528 -12.472 1.00 0.00 H new ATOM 0 HG LEU A 109 0.112 -9.868 -10.568 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.475 -8.312 -9.468 1.00 0.00 H new ATOM 0 HD12 LEU A 109 0.185 -7.671 -9.420 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -0.986 -7.020 -10.591 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.219 -9.710 -11.401 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -1.731 -8.417 -12.523 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.089 -10.064 -12.729 1.00 0.00 H new ATOM 1612 N GLU A 110 0.733 -8.060 -14.763 1.00 0.00 N ATOM 1613 CA GLU A 110 0.927 -7.397 -16.082 1.00 0.00 C ATOM 1614 C GLU A 110 1.285 -5.927 -15.861 1.00 0.00 C ATOM 1615 O GLU A 110 0.452 -5.126 -15.488 1.00 0.00 O ATOM 1616 CB GLU A 110 -0.365 -7.491 -16.895 1.00 0.00 C ATOM 1617 CG GLU A 110 -0.276 -6.562 -18.107 1.00 0.00 C ATOM 1618 CD GLU A 110 -0.692 -7.322 -19.367 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -1.885 -7.462 -19.583 1.00 0.00 O ATOM 1620 OE2 GLU A 110 0.188 -7.751 -20.095 1.00 0.00 O ATOM 0 H GLU A 110 -0.152 -7.853 -14.299 1.00 0.00 H new ATOM 0 HA GLU A 110 1.733 -7.891 -16.624 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -0.527 -8.518 -17.222 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -1.218 -7.216 -16.275 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -0.922 -5.696 -17.962 1.00 0.00 H new ATOM 0 HG3 GLU A 110 0.741 -6.186 -18.216 1.00 0.00 H new ATOM 1627 N GLU A 111 2.519 -5.567 -16.082 1.00 0.00 N ATOM 1628 CA GLU A 111 2.926 -4.149 -15.877 1.00 0.00 C ATOM 1629 C GLU A 111 3.016 -3.436 -17.228 1.00 0.00 C ATOM 1630 O GLU A 111 3.196 -4.055 -18.259 1.00 0.00 O ATOM 1631 CB GLU A 111 4.293 -4.108 -15.191 1.00 0.00 C ATOM 1632 CG GLU A 111 5.331 -4.789 -16.085 1.00 0.00 C ATOM 1633 CD GLU A 111 6.718 -4.215 -15.787 1.00 0.00 C ATOM 1634 OE1 GLU A 111 6.942 -3.061 -16.112 1.00 0.00 O ATOM 1635 OE2 GLU A 111 7.532 -4.941 -15.240 1.00 0.00 O ATOM 0 H GLU A 111 3.262 -6.192 -16.395 1.00 0.00 H new ATOM 0 HA GLU A 111 2.186 -3.648 -15.253 1.00 0.00 H new ATOM 0 HB2 GLU A 111 4.584 -3.076 -14.998 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.243 -4.611 -14.225 1.00 0.00 H new ATOM 0 HG2 GLU A 111 5.326 -5.865 -15.911 1.00 0.00 H new ATOM 0 HG3 GLU A 111 5.080 -4.635 -17.134 1.00 0.00 H new ATOM 1642 N ILE A 112 2.897 -2.137 -17.230 1.00 0.00 N ATOM 1643 CA ILE A 112 2.980 -1.378 -18.511 1.00 0.00 C ATOM 1644 C ILE A 112 3.712 -0.058 -18.270 1.00 0.00 C ATOM 1645 O ILE A 112 3.350 0.715 -17.403 1.00 0.00 O ATOM 1646 CB ILE A 112 1.570 -1.089 -19.031 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.660 -2.285 -18.736 1.00 0.00 C ATOM 1648 CG2 ILE A 112 1.623 -0.853 -20.542 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.690 -2.081 -19.427 1.00 0.00 C ATOM 0 H ILE A 112 2.745 -1.567 -16.398 1.00 0.00 H new ATOM 0 HA ILE A 112 3.522 -1.970 -19.248 1.00 0.00 H new ATOM 0 HB ILE A 112 1.176 -0.201 -18.536 1.00 0.00 H new ATOM 0 HG12 ILE A 112 1.126 -3.205 -19.088 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.518 -2.391 -17.661 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.619 -0.647 -20.914 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.270 -0.002 -20.755 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.017 -1.741 -21.035 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.338 -2.932 -19.218 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -1.156 -1.169 -19.053 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -0.539 -1.996 -20.503 1.00 0.00 H new ATOM 1661 N ARG A 113 4.741 0.207 -19.028 1.00 0.00 N ATOM 1662 CA ARG A 113 5.500 1.477 -18.841 1.00 0.00 C ATOM 1663 C ARG A 113 6.051 1.945 -20.191 1.00 0.00 C ATOM 1664 O ARG A 113 7.118 1.542 -20.609 1.00 0.00 O ATOM 1665 CB ARG A 113 6.661 1.236 -17.873 1.00 0.00 C ATOM 1666 CG ARG A 113 6.936 2.511 -17.075 1.00 0.00 C ATOM 1667 CD ARG A 113 8.298 2.400 -16.388 1.00 0.00 C ATOM 1668 NE ARG A 113 9.307 3.185 -17.156 1.00 0.00 N ATOM 1669 CZ ARG A 113 9.112 4.456 -17.379 1.00 0.00 C ATOM 1670 NH1 ARG A 113 8.762 5.244 -16.400 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.272 4.939 -18.581 1.00 0.00 N ATOM 0 H ARG A 113 5.089 -0.401 -19.769 1.00 0.00 H new ATOM 0 HA ARG A 113 4.838 2.241 -18.434 1.00 0.00 H new ATOM 0 HB2 ARG A 113 6.419 0.416 -17.196 1.00 0.00 H new ATOM 0 HB3 ARG A 113 7.553 0.941 -18.425 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.920 3.377 -17.737 1.00 0.00 H new ATOM 0 HG3 ARG A 113 6.153 2.663 -16.332 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.233 2.772 -15.366 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.603 1.355 -16.328 1.00 0.00 H new ATOM 0 HE ARG A 113 10.149 2.729 -17.507 1.00 0.00 H new ATOM 0 HH11 ARG A 113 8.641 4.867 -15.460 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.610 6.237 -16.574 1.00 0.00 H new ATOM 0 HH21 ARG A 113 9.549 4.323 -19.345 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.120 5.932 -18.756 1.00 0.00 H new ATOM 1685 N SER A 114 5.332 2.793 -20.877 1.00 0.00 N ATOM 1686 CA SER A 114 5.818 3.282 -22.199 1.00 0.00 C ATOM 1687 C SER A 114 6.347 4.713 -22.054 1.00 0.00 C ATOM 1688 O SER A 114 5.950 5.431 -21.159 1.00 0.00 O ATOM 1689 CB SER A 114 4.666 3.263 -23.204 1.00 0.00 C ATOM 1690 OG SER A 114 4.105 4.565 -23.303 1.00 0.00 O ATOM 0 H SER A 114 4.431 3.167 -20.579 1.00 0.00 H new ATOM 0 HA SER A 114 6.620 2.634 -22.553 1.00 0.00 H new ATOM 0 HB2 SER A 114 5.025 2.935 -24.179 1.00 0.00 H new ATOM 0 HB3 SER A 114 3.905 2.550 -22.888 1.00 0.00 H new ATOM 0 HG SER A 114 3.367 4.555 -23.948 1.00 0.00 H new ATOM 1696 N PRO A 115 7.231 5.081 -22.946 1.00 0.00 N ATOM 1697 CA PRO A 115 7.842 6.421 -22.954 1.00 0.00 C ATOM 1698 C PRO A 115 6.876 7.449 -23.550 1.00 0.00 C ATOM 1699 O PRO A 115 5.715 7.168 -23.773 1.00 0.00 O ATOM 1700 CB PRO A 115 9.074 6.249 -23.848 1.00 0.00 C ATOM 1701 CG PRO A 115 8.794 5.018 -24.742 1.00 0.00 C ATOM 1702 CD PRO A 115 7.704 4.195 -24.030 1.00 0.00 C ATOM 0 HA PRO A 115 8.091 6.783 -21.956 1.00 0.00 H new ATOM 0 HB2 PRO A 115 9.242 7.139 -24.454 1.00 0.00 H new ATOM 0 HB3 PRO A 115 9.971 6.098 -23.248 1.00 0.00 H new ATOM 0 HG2 PRO A 115 8.461 5.327 -25.733 1.00 0.00 H new ATOM 0 HG3 PRO A 115 9.699 4.426 -24.880 1.00 0.00 H new ATOM 0 HD2 PRO A 115 6.895 3.932 -24.711 1.00 0.00 H new ATOM 0 HD3 PRO A 115 8.104 3.261 -23.635 1.00 0.00 H new ATOM 1710 N GLY A 116 7.349 8.637 -23.811 1.00 0.00 N ATOM 1711 CA GLY A 116 6.462 9.682 -24.395 1.00 0.00 C ATOM 1712 C GLY A 116 6.511 9.600 -25.921 1.00 0.00 C ATOM 1713 O GLY A 116 7.552 9.374 -26.507 1.00 0.00 O ATOM 0 H GLY A 116 8.312 8.929 -23.645 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.439 9.542 -24.046 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.780 10.670 -24.063 1.00 0.00 H new ATOM 1717 N SER A 117 5.393 9.781 -26.571 1.00 0.00 N ATOM 1718 CA SER A 117 5.378 9.712 -28.058 1.00 0.00 C ATOM 1719 C SER A 117 6.087 8.433 -28.514 1.00 0.00 C ATOM 1720 O SER A 117 7.298 8.381 -28.604 1.00 0.00 O ATOM 1721 CB SER A 117 6.093 10.939 -28.632 1.00 0.00 C ATOM 1722 OG SER A 117 7.132 10.524 -29.511 1.00 0.00 O ATOM 0 H SER A 117 4.491 9.973 -26.136 1.00 0.00 H new ATOM 0 HA SER A 117 4.348 9.698 -28.416 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.382 11.569 -29.167 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.507 11.541 -27.823 1.00 0.00 H new ATOM 0 HG SER A 117 7.764 9.954 -29.025 1.00 0.00 H new ATOM 1728 N GLY A 118 5.342 7.401 -28.800 1.00 0.00 N ATOM 1729 CA GLY A 118 5.973 6.128 -29.248 1.00 0.00 C ATOM 1730 C GLY A 118 4.953 4.992 -29.155 1.00 0.00 C ATOM 1731 O GLY A 118 5.259 3.903 -28.712 1.00 0.00 O ATOM 0 H GLY A 118 4.324 7.384 -28.743 1.00 0.00 H new ATOM 0 HA2 GLY A 118 6.330 6.228 -30.273 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.841 5.903 -28.629 1.00 0.00 H new ATOM 1735 N ARG A 119 3.740 5.236 -29.571 1.00 0.00 N ATOM 1736 CA ARG A 119 2.700 4.171 -29.506 1.00 0.00 C ATOM 1737 C ARG A 119 1.869 4.194 -30.792 1.00 0.00 C ATOM 1738 O ARG A 119 1.582 5.241 -31.337 1.00 0.00 O ATOM 1739 CB ARG A 119 1.787 4.419 -28.304 1.00 0.00 C ATOM 1740 CG ARG A 119 1.372 3.080 -27.691 1.00 0.00 C ATOM 1741 CD ARG A 119 0.301 3.315 -26.624 1.00 0.00 C ATOM 1742 NE ARG A 119 0.587 2.464 -25.435 1.00 0.00 N ATOM 1743 CZ ARG A 119 -0.387 2.095 -24.647 1.00 0.00 C ATOM 1744 NH1 ARG A 119 -0.989 2.975 -23.896 1.00 0.00 N ATOM 1745 NH2 ARG A 119 -0.758 0.844 -24.610 1.00 0.00 N ATOM 0 H ARG A 119 3.425 6.128 -29.953 1.00 0.00 H new ATOM 0 HA ARG A 119 3.181 3.199 -29.400 1.00 0.00 H new ATOM 0 HB2 ARG A 119 2.304 5.026 -27.561 1.00 0.00 H new ATOM 0 HB3 ARG A 119 0.904 4.978 -28.614 1.00 0.00 H new ATOM 0 HG2 ARG A 119 0.988 2.417 -28.466 1.00 0.00 H new ATOM 0 HG3 ARG A 119 2.238 2.587 -27.249 1.00 0.00 H new ATOM 0 HD2 ARG A 119 0.284 4.366 -26.336 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -0.685 3.078 -27.025 1.00 0.00 H new ATOM 0 HE ARG A 119 1.543 2.170 -25.236 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.699 3.953 -23.924 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -1.750 2.686 -23.281 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.287 0.155 -25.196 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -1.519 0.556 -23.995 1.00 0.00 H new ATOM 1759 N GLY A 120 1.481 3.046 -31.281 1.00 0.00 N ATOM 1760 CA GLY A 120 0.670 3.005 -32.531 1.00 0.00 C ATOM 1761 C GLY A 120 1.146 1.845 -33.411 1.00 0.00 C ATOM 1762 O GLY A 120 2.314 1.515 -33.440 1.00 0.00 O ATOM 0 H GLY A 120 1.691 2.137 -30.869 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.386 2.882 -32.288 1.00 0.00 H new ATOM 0 HA3 GLY A 120 0.765 3.947 -33.070 1.00 0.00 H new ATOM 1766 N ARG A 121 0.249 1.225 -34.127 1.00 0.00 N ATOM 1767 CA ARG A 121 0.651 0.087 -35.003 1.00 0.00 C ATOM 1768 C ARG A 121 0.863 0.592 -36.432 1.00 0.00 C ATOM 1769 O ARG A 121 1.851 0.288 -37.068 1.00 0.00 O ATOM 1770 CB ARG A 121 -0.450 -0.978 -34.993 1.00 0.00 C ATOM 1771 CG ARG A 121 -0.162 -2.000 -33.891 1.00 0.00 C ATOM 1772 CD ARG A 121 -0.944 -3.286 -34.165 1.00 0.00 C ATOM 1773 NE ARG A 121 -0.960 -4.130 -32.937 1.00 0.00 N ATOM 1774 CZ ARG A 121 -0.997 -5.431 -33.037 1.00 0.00 C ATOM 1775 NH1 ARG A 121 -1.982 -6.010 -33.667 1.00 0.00 N ATOM 1776 NH2 ARG A 121 -0.047 -6.153 -32.508 1.00 0.00 N ATOM 0 H ARG A 121 -0.744 1.456 -34.144 1.00 0.00 H new ATOM 0 HA ARG A 121 1.579 -0.348 -34.632 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -1.421 -0.511 -34.826 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.498 -1.476 -35.962 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.906 -2.214 -33.850 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -0.443 -1.592 -32.920 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -1.963 -3.047 -34.468 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -0.487 -3.833 -34.989 1.00 0.00 H new ATOM 0 HE ARG A 121 -0.942 -3.690 -32.017 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -2.724 -5.446 -34.082 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -2.010 -7.027 -33.745 1.00 0.00 H new ATOM 0 HH21 ARG A 121 0.724 -5.701 -32.017 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -0.076 -7.170 -32.586 1.00 0.00 H new ATOM 1790 N ARG A 122 -0.059 1.364 -36.940 1.00 0.00 N ATOM 1791 CA ARG A 122 0.089 1.890 -38.328 1.00 0.00 C ATOM 1792 C ARG A 122 0.799 3.245 -38.284 1.00 0.00 C ATOM 1793 O ARG A 122 0.574 4.047 -37.399 1.00 0.00 O ATOM 1794 CB ARG A 122 -1.294 2.060 -38.958 1.00 0.00 C ATOM 1795 CG ARG A 122 -1.147 2.314 -40.459 1.00 0.00 C ATOM 1796 CD ARG A 122 -2.219 1.530 -41.218 1.00 0.00 C ATOM 1797 NE ARG A 122 -2.674 2.319 -42.397 1.00 0.00 N ATOM 1798 CZ ARG A 122 -2.515 1.845 -43.602 1.00 0.00 C ATOM 1799 NH1 ARG A 122 -1.375 1.314 -43.951 1.00 0.00 N ATOM 1800 NH2 ARG A 122 -3.499 1.899 -44.459 1.00 0.00 N ATOM 0 H ARG A 122 -0.908 1.653 -36.454 1.00 0.00 H new ATOM 0 HA ARG A 122 0.676 1.190 -38.923 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -1.895 1.167 -38.787 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -1.819 2.892 -38.488 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -1.243 3.379 -40.669 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -0.155 2.012 -40.794 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -1.820 0.569 -41.543 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -3.063 1.319 -40.561 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.110 3.231 -42.262 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.607 1.269 -43.281 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.252 0.944 -44.893 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -4.391 2.312 -44.186 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -3.375 1.529 -45.401 1.00 0.00 H new ATOM 1814 N ARG A 123 1.655 3.510 -39.234 1.00 0.00 N ATOM 1815 CA ARG A 123 2.376 4.814 -39.243 1.00 0.00 C ATOM 1816 C ARG A 123 2.618 5.256 -40.688 1.00 0.00 C ATOM 1817 O ARG A 123 2.104 6.262 -41.134 1.00 0.00 O ATOM 1818 CB ARG A 123 3.718 4.663 -38.523 1.00 0.00 C ATOM 1819 CG ARG A 123 3.532 4.945 -37.031 1.00 0.00 C ATOM 1820 CD ARG A 123 4.352 3.945 -36.215 1.00 0.00 C ATOM 1821 NE ARG A 123 5.397 4.672 -35.440 1.00 0.00 N ATOM 1822 CZ ARG A 123 6.573 4.880 -35.966 1.00 0.00 C ATOM 1823 NH1 ARG A 123 7.383 3.877 -36.169 1.00 0.00 N ATOM 1824 NH2 ARG A 123 6.938 6.090 -36.290 1.00 0.00 N ATOM 0 H ARG A 123 1.885 2.881 -40.003 1.00 0.00 H new ATOM 0 HA ARG A 123 1.773 5.564 -38.731 1.00 0.00 H new ATOM 0 HB2 ARG A 123 4.109 3.656 -38.667 1.00 0.00 H new ATOM 0 HB3 ARG A 123 4.449 5.352 -38.946 1.00 0.00 H new ATOM 0 HG2 ARG A 123 3.847 5.963 -36.801 1.00 0.00 H new ATOM 0 HG3 ARG A 123 2.478 4.870 -36.765 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.701 3.392 -35.538 1.00 0.00 H new ATOM 0 HD3 ARG A 123 4.818 3.215 -36.877 1.00 0.00 H new ATOM 0 HE ARG A 123 5.193 5.007 -34.498 1.00 0.00 H new ATOM 0 HH11 ARG A 123 7.097 2.931 -35.917 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.302 4.039 -36.580 1.00 0.00 H new ATOM 0 HH21 ARG A 123 6.304 6.873 -36.132 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.857 6.253 -36.701 1.00 0.00 H new ATOM 1838 N ARG A 124 3.398 4.510 -41.423 1.00 0.00 N ATOM 1839 CA ARG A 124 3.673 4.887 -42.838 1.00 0.00 C ATOM 1840 C ARG A 124 2.521 4.416 -43.726 1.00 0.00 C ATOM 1841 O ARG A 124 1.477 4.088 -43.187 1.00 0.00 O ATOM 1842 CB ARG A 124 4.974 4.226 -43.297 1.00 0.00 C ATOM 1843 CG ARG A 124 5.732 5.178 -44.224 1.00 0.00 C ATOM 1844 CD ARG A 124 5.586 4.705 -45.670 1.00 0.00 C ATOM 1845 NE ARG A 124 6.936 4.500 -46.263 1.00 0.00 N ATOM 1846 CZ ARG A 124 7.054 3.971 -47.450 1.00 0.00 C ATOM 1847 NH1 ARG A 124 6.161 3.122 -47.879 1.00 0.00 N ATOM 1848 NH2 ARG A 124 8.068 4.290 -48.206 1.00 0.00 N ATOM 1849 OXT ARG A 124 2.702 4.392 -44.933 1.00 0.00 O ATOM 0 H ARG A 124 3.856 3.656 -41.104 1.00 0.00 H new ATOM 0 HA ARG A 124 3.769 5.970 -42.913 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.590 3.974 -42.434 1.00 0.00 H new ATOM 0 HB3 ARG A 124 4.756 3.293 -43.816 1.00 0.00 H new ATOM 0 HG2 ARG A 124 5.342 6.191 -44.120 1.00 0.00 H new ATOM 0 HG3 ARG A 124 6.785 5.212 -43.946 1.00 0.00 H new ATOM 0 HD2 ARG A 124 5.017 3.776 -45.704 1.00 0.00 H new ATOM 0 HD3 ARG A 124 5.030 5.441 -46.250 1.00 0.00 H new ATOM 0 HE ARG A 124 7.769 4.773 -45.741 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.370 2.871 -47.286 1.00 0.00 H new ATOM 0 HH12 ARG A 124 6.254 2.709 -48.807 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.767 4.952 -47.869 1.00 0.00 H new ATOM 0 HH22 ARG A 124 8.162 3.877 -49.134 1.00 0.00 H new TER 1863 ARG A 124