USER MOD reduce.3.24.130724 H: found=0, std=0, add=523, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 523 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 12 LYS NZ :NH3+ 156:sc= 2.57 (180deg=1.27) USER MOD Set 1.2: A 15 TYR OH : rot 30:sc= 1.01 USER MOD Set 2.1: A 13 TYR OH : rot -37:sc= 1.62 USER MOD Set 2.2: A 23 TYR OH : rot -30:sc= 0.967 USER MOD Set 3.1: A 3 GLN : amide:sc= 2.15 K(o=4.3,f=-14!) USER MOD Set 3.2: A 4 LYS NZ :NH3+ -174:sc= 2.19 (180deg=1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0.234 (180deg=0.231) USER MOD Single : A 5 LYS NZ :NH3+ -166:sc= 2.35 (180deg=2.02) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -164:sc= 0.0388 (180deg=0.00901) USER MOD Single : A 20 LYS NZ :NH3+ -160:sc= 1.23 (180deg=1.08) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN :FLIP amide:sc= 0.114 F(o=-1.2,f=0.11) USER MOD Single : A 33 THR OG1 : rot 138:sc= 1.26 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 163:sc= 1.53 (180deg=1.3) USER MOD Single : A 49 LYS NZ :NH3+ -170:sc= 0.666 (180deg=0.591) USER MOD Single : A 52 LYS NZ :NH3+ -140:sc= 0.27 (180deg=-1.4) USER MOD Single : A 56 TYR OH : rot 8:sc= 1.26 USER MOD Single : A 59 ASN : amide:sc= 0.406! C(o=0.41!,f=-8.4!) USER MOD Single : A 60 GLN : amide:sc= 1.13 K(o=1.1,f=-0.041) USER MOD Single : A 65 GLN : amide:sc= 1.16 K(o=1.2,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.757 -40.576 -2.766 1.00 0.00 N ATOM 2 CA MET A 1 19.009 -41.326 -2.920 1.00 0.00 C ATOM 3 C MET A 1 19.610 -41.350 -4.353 1.00 0.00 C ATOM 4 O MET A 1 20.566 -42.087 -4.616 1.00 0.00 O ATOM 5 CB MET A 1 18.772 -42.775 -2.416 1.00 0.00 C ATOM 6 CG MET A 1 18.575 -42.903 -0.888 1.00 0.00 C ATOM 7 SD MET A 1 18.300 -44.619 -0.374 1.00 0.00 S ATOM 8 CE MET A 1 19.989 -45.135 0.026 1.00 0.00 C ATOM 0 H1 MET A 1 17.461 -40.595 -1.769 1.00 0.00 H new ATOM 0 H2 MET A 1 17.904 -39.591 -3.065 1.00 0.00 H new ATOM 0 H3 MET A 1 17.018 -41.010 -3.355 1.00 0.00 H new ATOM 0 HA MET A 1 19.755 -40.798 -2.326 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.893 -43.180 -2.917 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.621 -43.392 -2.712 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.453 -42.508 -0.376 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.726 -42.293 -0.581 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.983 -46.173 0.359 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.617 -45.042 -0.860 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.385 -44.501 0.820 1.00 0.00 H new ATOM 20 N LEU A 2 19.070 -40.529 -5.270 1.00 0.00 N ATOM 21 CA LEU A 2 19.429 -40.433 -6.692 1.00 0.00 C ATOM 22 C LEU A 2 19.413 -41.789 -7.436 1.00 0.00 C ATOM 23 O LEU A 2 18.334 -42.305 -7.756 1.00 0.00 O ATOM 24 CB LEU A 2 20.735 -39.591 -6.886 1.00 0.00 C ATOM 25 CG LEU A 2 20.700 -38.146 -6.319 1.00 0.00 C ATOM 26 CD1 LEU A 2 22.093 -37.511 -6.455 1.00 0.00 C ATOM 27 CD2 LEU A 2 19.679 -37.229 -7.019 1.00 0.00 C ATOM 0 H LEU A 2 18.327 -39.876 -5.021 1.00 0.00 H new ATOM 0 HA LEU A 2 18.634 -39.878 -7.190 1.00 0.00 H new ATOM 0 HB2 LEU A 2 21.562 -40.125 -6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 2 20.955 -39.537 -7.952 1.00 0.00 H new ATOM 0 HG LEU A 2 20.394 -38.235 -5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 2 22.071 -36.496 -6.058 1.00 0.00 H new ATOM 0 HD12 LEU A 2 22.819 -38.103 -5.898 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.379 -37.483 -7.506 1.00 0.00 H new ATOM 0 HD21 LEU A 2 19.712 -36.237 -6.569 1.00 0.00 H new ATOM 0 HD22 LEU A 2 19.923 -37.155 -8.079 1.00 0.00 H new ATOM 0 HD23 LEU A 2 18.678 -37.645 -6.905 1.00 0.00 H new ATOM 39 N GLN A 3 20.595 -42.394 -7.628 1.00 0.00 N ATOM 40 CA GLN A 3 20.806 -43.591 -8.444 1.00 0.00 C ATOM 41 C GLN A 3 20.055 -44.808 -7.880 1.00 0.00 C ATOM 42 O GLN A 3 19.274 -45.441 -8.592 1.00 0.00 O ATOM 43 CB GLN A 3 22.350 -43.826 -8.517 1.00 0.00 C ATOM 44 CG GLN A 3 22.873 -44.835 -9.590 1.00 0.00 C ATOM 45 CD GLN A 3 22.690 -46.319 -9.234 1.00 0.00 C ATOM 46 OE1 GLN A 3 22.908 -46.775 -8.112 1.00 0.00 O ATOM 47 NE2 GLN A 3 22.297 -47.125 -10.201 1.00 0.00 N ATOM 0 H GLN A 3 21.456 -42.049 -7.204 1.00 0.00 H new ATOM 0 HA GLN A 3 20.401 -43.449 -9.446 1.00 0.00 H new ATOM 0 HB2 GLN A 3 22.829 -42.864 -8.697 1.00 0.00 H new ATOM 0 HB3 GLN A 3 22.685 -44.171 -7.539 1.00 0.00 H new ATOM 0 HG2 GLN A 3 22.361 -44.638 -10.532 1.00 0.00 H new ATOM 0 HG3 GLN A 3 23.933 -44.646 -9.758 1.00 0.00 H new ATOM 0 HE21 GLN A 3 22.115 -46.753 -11.133 1.00 0.00 H new ATOM 0 HE22 GLN A 3 22.175 -48.121 -10.017 1.00 0.00 H new ATOM 56 N LYS A 4 20.258 -45.071 -6.582 1.00 0.00 N ATOM 57 CA LYS A 4 19.726 -46.240 -5.881 1.00 0.00 C ATOM 58 C LYS A 4 18.192 -46.304 -5.814 1.00 0.00 C ATOM 59 O LYS A 4 17.638 -47.392 -5.991 1.00 0.00 O ATOM 60 CB LYS A 4 20.384 -46.319 -4.479 1.00 0.00 C ATOM 61 CG LYS A 4 21.852 -46.806 -4.572 1.00 0.00 C ATOM 62 CD LYS A 4 21.953 -48.350 -4.613 1.00 0.00 C ATOM 63 CE LYS A 4 23.280 -48.858 -5.183 1.00 0.00 C ATOM 64 NZ LYS A 4 23.184 -48.881 -6.641 1.00 0.00 N ATOM 0 H LYS A 4 20.810 -44.461 -5.979 1.00 0.00 H new ATOM 0 HA LYS A 4 19.988 -47.122 -6.466 1.00 0.00 H new ATOM 0 HB2 LYS A 4 20.354 -45.338 -4.005 1.00 0.00 H new ATOM 0 HB3 LYS A 4 19.813 -46.997 -3.845 1.00 0.00 H new ATOM 0 HG2 LYS A 4 22.316 -46.389 -5.466 1.00 0.00 H new ATOM 0 HG3 LYS A 4 22.413 -46.429 -3.717 1.00 0.00 H new ATOM 0 HD2 LYS A 4 21.826 -48.742 -3.604 1.00 0.00 H new ATOM 0 HD3 LYS A 4 21.133 -48.744 -5.214 1.00 0.00 H new ATOM 0 HE2 LYS A 4 24.099 -48.211 -4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 4 23.498 -49.856 -4.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 24.039 -49.319 -7.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 22.349 -49.432 -6.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 23.095 -47.908 -6.998 1.00 0.00 H new ATOM 78 N LYS A 5 17.479 -45.193 -5.578 1.00 0.00 N ATOM 79 CA LYS A 5 16.019 -45.185 -5.680 1.00 0.00 C ATOM 80 C LYS A 5 15.459 -45.168 -7.112 1.00 0.00 C ATOM 81 O LYS A 5 14.405 -45.787 -7.289 1.00 0.00 O ATOM 82 CB LYS A 5 15.345 -44.140 -4.757 1.00 0.00 C ATOM 83 CG LYS A 5 15.048 -44.653 -3.322 1.00 0.00 C ATOM 84 CD LYS A 5 13.930 -45.722 -3.316 1.00 0.00 C ATOM 85 CE LYS A 5 13.505 -46.165 -1.926 1.00 0.00 C ATOM 86 NZ LYS A 5 12.592 -47.287 -2.115 1.00 0.00 N ATOM 0 H LYS A 5 17.889 -44.296 -5.317 1.00 0.00 H new ATOM 0 HA LYS A 5 15.734 -46.165 -5.298 1.00 0.00 H new ATOM 0 HB2 LYS A 5 15.988 -43.262 -4.691 1.00 0.00 H new ATOM 0 HB3 LYS A 5 14.410 -43.817 -5.215 1.00 0.00 H new ATOM 0 HG2 LYS A 5 15.956 -45.074 -2.891 1.00 0.00 H new ATOM 0 HG3 LYS A 5 14.754 -43.815 -2.690 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.061 -45.327 -3.842 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.272 -46.593 -3.875 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.369 -46.463 -1.332 1.00 0.00 H new ATOM 0 HE3 LYS A 5 13.015 -45.351 -1.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.088 -47.478 -1.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.904 -47.053 -2.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.132 -48.130 -2.396 1.00 0.00 H new ATOM 100 N ILE A 6 16.071 -44.543 -8.145 1.00 0.00 N ATOM 101 CA ILE A 6 15.641 -44.810 -9.536 1.00 0.00 C ATOM 102 C ILE A 6 15.890 -46.293 -9.870 1.00 0.00 C ATOM 103 O ILE A 6 15.024 -46.929 -10.463 1.00 0.00 O ATOM 104 CB ILE A 6 16.288 -43.911 -10.642 1.00 0.00 C ATOM 105 CG1 ILE A 6 16.171 -42.424 -10.262 1.00 0.00 C ATOM 106 CG2 ILE A 6 15.602 -44.156 -12.044 1.00 0.00 C ATOM 107 CD1 ILE A 6 17.008 -41.502 -11.155 1.00 0.00 C ATOM 0 H ILE A 6 16.836 -43.875 -8.049 1.00 0.00 H new ATOM 0 HA ILE A 6 14.581 -44.555 -9.556 1.00 0.00 H new ATOM 0 HB ILE A 6 17.341 -44.181 -10.717 1.00 0.00 H new ATOM 0 HG12 ILE A 6 15.125 -42.123 -10.320 1.00 0.00 H new ATOM 0 HG13 ILE A 6 16.483 -42.295 -9.226 1.00 0.00 H new ATOM 0 HG21 ILE A 6 16.070 -43.519 -12.794 1.00 0.00 H new ATOM 0 HG22 ILE A 6 15.721 -45.201 -12.330 1.00 0.00 H new ATOM 0 HG23 ILE A 6 14.541 -43.917 -11.976 1.00 0.00 H new ATOM 0 HD11 ILE A 6 16.880 -40.469 -10.833 1.00 0.00 H new ATOM 0 HD12 ILE A 6 18.060 -41.778 -11.079 1.00 0.00 H new ATOM 0 HD13 ILE A 6 16.681 -41.603 -12.190 1.00 0.00 H new ATOM 119 N GLU A 7 17.037 -46.858 -9.456 1.00 0.00 N ATOM 120 CA GLU A 7 17.317 -48.289 -9.567 1.00 0.00 C ATOM 121 C GLU A 7 16.286 -49.143 -8.808 1.00 0.00 C ATOM 122 O GLU A 7 15.552 -49.849 -9.485 1.00 0.00 O ATOM 123 CB GLU A 7 18.761 -48.535 -9.084 1.00 0.00 C ATOM 124 CG GLU A 7 19.326 -49.972 -9.259 1.00 0.00 C ATOM 125 CD GLU A 7 20.812 -49.999 -8.896 1.00 0.00 C ATOM 126 OE1 GLU A 7 21.148 -50.174 -7.723 1.00 0.00 O ATOM 127 OE2 GLU A 7 21.639 -49.781 -9.778 1.00 0.00 O ATOM 0 H GLU A 7 17.797 -46.326 -9.033 1.00 0.00 H new ATOM 0 HA GLU A 7 17.229 -48.601 -10.608 1.00 0.00 H new ATOM 0 HB2 GLU A 7 19.418 -47.845 -9.614 1.00 0.00 H new ATOM 0 HB3 GLU A 7 18.814 -48.276 -8.026 1.00 0.00 H new ATOM 0 HG2 GLU A 7 18.776 -50.667 -8.625 1.00 0.00 H new ATOM 0 HG3 GLU A 7 19.189 -50.302 -10.289 1.00 0.00 H new ATOM 134 N GLU A 8 16.107 -49.100 -7.479 1.00 0.00 N ATOM 135 CA GLU A 8 15.182 -50.009 -6.782 1.00 0.00 C ATOM 136 C GLU A 8 13.683 -49.768 -7.094 1.00 0.00 C ATOM 137 O GLU A 8 12.885 -50.684 -6.887 1.00 0.00 O ATOM 138 CB GLU A 8 15.521 -49.949 -5.258 1.00 0.00 C ATOM 139 CG GLU A 8 14.859 -51.021 -4.316 1.00 0.00 C ATOM 140 CD GLU A 8 13.518 -50.608 -3.689 1.00 0.00 C ATOM 141 OE1 GLU A 8 13.397 -49.487 -3.191 1.00 0.00 O ATOM 142 OE2 GLU A 8 12.596 -51.430 -3.645 1.00 0.00 O ATOM 0 H GLU A 8 16.591 -48.445 -6.864 1.00 0.00 H new ATOM 0 HA GLU A 8 15.334 -51.021 -7.157 1.00 0.00 H new ATOM 0 HB2 GLU A 8 16.603 -50.033 -5.152 1.00 0.00 H new ATOM 0 HB3 GLU A 8 15.240 -48.962 -4.891 1.00 0.00 H new ATOM 0 HG2 GLU A 8 14.707 -51.937 -4.887 1.00 0.00 H new ATOM 0 HG3 GLU A 8 15.559 -51.257 -3.514 1.00 0.00 H new ATOM 149 N GLU A 9 13.236 -48.602 -7.591 1.00 0.00 N ATOM 150 CA GLU A 9 11.874 -48.472 -8.126 1.00 0.00 C ATOM 151 C GLU A 9 11.796 -48.858 -9.618 1.00 0.00 C ATOM 152 O GLU A 9 11.076 -49.798 -9.953 1.00 0.00 O ATOM 153 CB GLU A 9 11.300 -47.062 -7.838 1.00 0.00 C ATOM 154 CG GLU A 9 11.331 -46.662 -6.319 1.00 0.00 C ATOM 155 CD GLU A 9 10.500 -47.517 -5.353 1.00 0.00 C ATOM 156 OE1 GLU A 9 9.493 -48.117 -5.729 1.00 0.00 O ATOM 157 OE2 GLU A 9 10.867 -47.565 -4.173 1.00 0.00 O ATOM 0 H GLU A 9 13.791 -47.747 -7.633 1.00 0.00 H new ATOM 0 HA GLU A 9 11.240 -49.188 -7.604 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.866 -46.326 -8.409 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.271 -47.019 -8.194 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.368 -46.685 -5.984 1.00 0.00 H new ATOM 0 HG3 GLU A 9 10.992 -45.630 -6.234 1.00 0.00 H new ATOM 164 N ALA A 10 12.490 -48.170 -10.538 1.00 0.00 N ATOM 165 CA ALA A 10 12.517 -48.535 -11.966 1.00 0.00 C ATOM 166 C ALA A 10 13.345 -49.783 -12.386 1.00 0.00 C ATOM 167 O ALA A 10 13.407 -50.061 -13.584 1.00 0.00 O ATOM 168 CB ALA A 10 12.898 -47.270 -12.765 1.00 0.00 C ATOM 0 H ALA A 10 13.048 -47.346 -10.315 1.00 0.00 H new ATOM 0 HA ALA A 10 11.513 -48.884 -12.205 1.00 0.00 H new ATOM 0 HB1 ALA A 10 12.927 -47.506 -13.829 1.00 0.00 H new ATOM 0 HB2 ALA A 10 12.158 -46.490 -12.587 1.00 0.00 H new ATOM 0 HB3 ALA A 10 13.879 -46.919 -12.445 1.00 0.00 H new ATOM 174 N ALA A 11 14.039 -50.556 -11.535 1.00 0.00 N ATOM 175 CA ALA A 11 14.359 -51.964 -11.830 1.00 0.00 C ATOM 176 C ALA A 11 13.137 -52.882 -11.654 1.00 0.00 C ATOM 177 O ALA A 11 12.776 -53.668 -12.533 1.00 0.00 O ATOM 178 CB ALA A 11 15.532 -52.459 -10.946 1.00 0.00 C ATOM 0 H ALA A 11 14.390 -50.229 -10.635 1.00 0.00 H new ATOM 0 HA ALA A 11 14.660 -52.011 -12.877 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.750 -53.501 -11.181 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.415 -51.850 -11.139 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.256 -52.375 -9.895 1.00 0.00 H new ATOM 184 N LYS A 12 12.471 -52.732 -10.506 1.00 0.00 N ATOM 185 CA LYS A 12 11.318 -53.534 -10.122 1.00 0.00 C ATOM 186 C LYS A 12 10.027 -53.023 -10.800 1.00 0.00 C ATOM 187 O LYS A 12 9.118 -52.476 -10.171 1.00 0.00 O ATOM 188 CB LYS A 12 11.188 -53.503 -8.585 1.00 0.00 C ATOM 189 CG LYS A 12 12.277 -54.240 -7.767 1.00 0.00 C ATOM 190 CD LYS A 12 11.936 -53.933 -6.305 1.00 0.00 C ATOM 191 CE LYS A 12 12.711 -54.612 -5.193 1.00 0.00 C ATOM 192 NZ LYS A 12 12.168 -54.046 -3.954 1.00 0.00 N ATOM 0 H LYS A 12 12.727 -52.035 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 12 11.464 -54.561 -10.457 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.176 -52.460 -8.268 1.00 0.00 H new ATOM 0 HB3 LYS A 12 10.220 -53.928 -8.319 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.261 -55.312 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.275 -53.885 -8.024 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.042 -52.857 -6.165 1.00 0.00 H new ATOM 0 HD3 LYS A 12 10.882 -54.171 -6.160 1.00 0.00 H new ATOM 0 HE2 LYS A 12 12.580 -55.694 -5.224 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.780 -54.418 -5.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.329 -54.710 -3.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 12.643 -53.144 -3.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.147 -53.882 -4.065 1.00 0.00 H new ATOM 206 N TYR A 13 9.953 -53.232 -12.121 1.00 0.00 N ATOM 207 CA TYR A 13 8.767 -52.954 -12.949 1.00 0.00 C ATOM 208 C TYR A 13 7.446 -53.637 -12.505 1.00 0.00 C ATOM 209 O TYR A 13 6.381 -53.344 -13.049 1.00 0.00 O ATOM 210 CB TYR A 13 9.115 -53.279 -14.435 1.00 0.00 C ATOM 211 CG TYR A 13 9.673 -52.076 -15.228 1.00 0.00 C ATOM 212 CD1 TYR A 13 10.474 -51.078 -14.683 1.00 0.00 C ATOM 213 CD2 TYR A 13 9.361 -51.949 -16.575 1.00 0.00 C ATOM 214 CE1 TYR A 13 10.922 -50.020 -15.448 1.00 0.00 C ATOM 215 CE2 TYR A 13 9.808 -50.890 -17.343 1.00 0.00 C ATOM 216 CZ TYR A 13 10.588 -49.918 -16.770 1.00 0.00 C ATOM 217 OH TYR A 13 11.029 -48.845 -17.483 1.00 0.00 O ATOM 0 H TYR A 13 10.734 -53.608 -12.659 1.00 0.00 H new ATOM 0 HA TYR A 13 8.543 -51.895 -12.817 1.00 0.00 H new ATOM 0 HB2 TYR A 13 9.847 -54.087 -14.458 1.00 0.00 H new ATOM 0 HB3 TYR A 13 8.219 -53.646 -14.935 1.00 0.00 H new ATOM 0 HD1 TYR A 13 10.751 -51.132 -13.641 1.00 0.00 H new ATOM 0 HD2 TYR A 13 8.746 -52.706 -17.040 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.545 -49.262 -14.996 1.00 0.00 H new ATOM 0 HE2 TYR A 13 9.544 -50.828 -18.389 1.00 0.00 H new ATOM 0 HH TYR A 13 11.018 -48.047 -16.914 1.00 0.00 H new ATOM 227 N LYS A 14 7.505 -54.555 -11.530 1.00 0.00 N ATOM 228 CA LYS A 14 6.363 -54.982 -10.715 1.00 0.00 C ATOM 229 C LYS A 14 5.751 -53.820 -9.893 1.00 0.00 C ATOM 230 O LYS A 14 4.530 -53.764 -9.718 1.00 0.00 O ATOM 231 CB LYS A 14 6.867 -56.127 -9.796 1.00 0.00 C ATOM 232 CG LYS A 14 5.745 -56.850 -9.008 1.00 0.00 C ATOM 233 CD LYS A 14 6.264 -57.961 -8.066 1.00 0.00 C ATOM 234 CE LYS A 14 6.779 -59.202 -8.800 1.00 0.00 C ATOM 235 NZ LYS A 14 7.172 -60.177 -7.793 1.00 0.00 N ATOM 0 H LYS A 14 8.371 -55.032 -11.281 1.00 0.00 H new ATOM 0 HA LYS A 14 5.556 -55.328 -11.361 1.00 0.00 H new ATOM 0 HB2 LYS A 14 7.398 -56.859 -10.405 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.588 -55.719 -9.088 1.00 0.00 H new ATOM 0 HG2 LYS A 14 5.195 -56.115 -8.420 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.039 -57.286 -9.715 1.00 0.00 H new ATOM 0 HD2 LYS A 14 7.066 -57.556 -7.449 1.00 0.00 H new ATOM 0 HD3 LYS A 14 5.461 -58.257 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 14 6.005 -59.612 -9.449 1.00 0.00 H new ATOM 0 HE3 LYS A 14 7.626 -58.946 -9.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 7.528 -61.035 -8.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 7.920 -59.774 -7.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 6.349 -60.419 -7.205 1.00 0.00 H new ATOM 249 N TYR A 15 6.549 -52.851 -9.406 1.00 0.00 N ATOM 250 CA TYR A 15 6.051 -51.655 -8.713 1.00 0.00 C ATOM 251 C TYR A 15 5.570 -50.596 -9.736 1.00 0.00 C ATOM 252 O TYR A 15 6.035 -49.450 -9.775 1.00 0.00 O ATOM 253 CB TYR A 15 7.174 -51.054 -7.812 1.00 0.00 C ATOM 254 CG TYR A 15 7.687 -51.901 -6.634 1.00 0.00 C ATOM 255 CD1 TYR A 15 7.199 -53.150 -6.268 1.00 0.00 C ATOM 256 CD2 TYR A 15 8.758 -51.410 -5.910 1.00 0.00 C ATOM 257 CE1 TYR A 15 7.775 -53.878 -5.242 1.00 0.00 C ATOM 258 CE2 TYR A 15 9.338 -52.130 -4.890 1.00 0.00 C ATOM 259 CZ TYR A 15 8.856 -53.369 -4.561 1.00 0.00 C ATOM 260 OH TYR A 15 9.528 -54.106 -3.632 1.00 0.00 O ATOM 0 H TYR A 15 7.566 -52.880 -9.485 1.00 0.00 H new ATOM 0 HA TYR A 15 5.206 -51.943 -8.087 1.00 0.00 H new ATOM 0 HB2 TYR A 15 8.026 -50.821 -8.451 1.00 0.00 H new ATOM 0 HB3 TYR A 15 6.809 -50.109 -7.410 1.00 0.00 H new ATOM 0 HD1 TYR A 15 6.351 -53.561 -6.796 1.00 0.00 H new ATOM 0 HD2 TYR A 15 9.151 -50.433 -6.152 1.00 0.00 H new ATOM 0 HE1 TYR A 15 7.376 -54.846 -4.976 1.00 0.00 H new ATOM 0 HE2 TYR A 15 10.176 -51.717 -4.348 1.00 0.00 H new ATOM 0 HH TYR A 15 9.475 -55.056 -3.867 1.00 0.00 H new ATOM 270 N ALA A 16 4.566 -51.003 -10.528 1.00 0.00 N ATOM 271 CA ALA A 16 4.112 -50.314 -11.740 1.00 0.00 C ATOM 272 C ALA A 16 3.746 -48.827 -11.559 1.00 0.00 C ATOM 273 O ALA A 16 4.259 -47.967 -12.279 1.00 0.00 O ATOM 274 CB ALA A 16 2.927 -51.115 -12.319 1.00 0.00 C ATOM 0 H ALA A 16 4.032 -51.850 -10.333 1.00 0.00 H new ATOM 0 HA ALA A 16 4.956 -50.284 -12.430 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.565 -50.627 -13.224 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.254 -52.127 -12.558 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.123 -51.158 -11.584 1.00 0.00 H new ATOM 280 N MET A 17 2.914 -48.526 -10.554 1.00 0.00 N ATOM 281 CA MET A 17 2.536 -47.157 -10.194 1.00 0.00 C ATOM 282 C MET A 17 3.713 -46.325 -9.647 1.00 0.00 C ATOM 283 O MET A 17 3.787 -45.126 -9.908 1.00 0.00 O ATOM 284 CB MET A 17 1.380 -47.191 -9.163 1.00 0.00 C ATOM 285 CG MET A 17 0.063 -47.750 -9.747 1.00 0.00 C ATOM 286 SD MET A 17 -1.276 -47.790 -8.528 1.00 0.00 S ATOM 287 CE MET A 17 -1.145 -49.493 -7.925 1.00 0.00 C ATOM 0 H MET A 17 2.481 -49.235 -9.963 1.00 0.00 H new ATOM 0 HA MET A 17 2.210 -46.664 -11.110 1.00 0.00 H new ATOM 0 HB2 MET A 17 1.680 -47.800 -8.310 1.00 0.00 H new ATOM 0 HB3 MET A 17 1.205 -46.182 -8.789 1.00 0.00 H new ATOM 0 HG2 MET A 17 -0.242 -47.139 -10.597 1.00 0.00 H new ATOM 0 HG3 MET A 17 0.236 -48.758 -10.125 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.907 -49.670 -7.166 1.00 0.00 H new ATOM 0 HE2 MET A 17 -1.291 -50.185 -8.754 1.00 0.00 H new ATOM 0 HE3 MET A 17 -0.158 -49.650 -7.491 1.00 0.00 H new ATOM 297 N LEU A 18 4.670 -46.953 -8.952 1.00 0.00 N ATOM 298 CA LEU A 18 5.762 -46.258 -8.266 1.00 0.00 C ATOM 299 C LEU A 18 6.931 -45.938 -9.212 1.00 0.00 C ATOM 300 O LEU A 18 7.519 -44.854 -9.139 1.00 0.00 O ATOM 301 CB LEU A 18 6.221 -47.091 -7.040 1.00 0.00 C ATOM 302 CG LEU A 18 5.074 -47.520 -6.086 1.00 0.00 C ATOM 303 CD1 LEU A 18 5.620 -48.378 -4.940 1.00 0.00 C ATOM 304 CD2 LEU A 18 4.320 -46.312 -5.513 1.00 0.00 C ATOM 0 H LEU A 18 4.707 -47.967 -8.850 1.00 0.00 H new ATOM 0 HA LEU A 18 5.390 -45.296 -7.914 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.734 -47.985 -7.396 1.00 0.00 H new ATOM 0 HB3 LEU A 18 6.949 -46.510 -6.474 1.00 0.00 H new ATOM 0 HG LEU A 18 4.370 -48.107 -6.676 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.802 -48.669 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.093 -49.271 -5.348 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.354 -47.805 -4.374 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.526 -46.659 -4.851 1.00 0.00 H new ATOM 0 HD22 LEU A 18 5.012 -45.684 -4.952 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.885 -45.734 -6.329 1.00 0.00 H new ATOM 316 N LYS A 19 7.283 -46.854 -10.123 1.00 0.00 N ATOM 317 CA LYS A 19 8.137 -46.482 -11.249 1.00 0.00 C ATOM 318 C LYS A 19 7.416 -45.544 -12.244 1.00 0.00 C ATOM 319 O LYS A 19 8.095 -44.741 -12.884 1.00 0.00 O ATOM 320 CB LYS A 19 8.729 -47.744 -11.933 1.00 0.00 C ATOM 321 CG LYS A 19 7.738 -48.694 -12.651 1.00 0.00 C ATOM 322 CD LYS A 19 7.627 -48.439 -14.168 1.00 0.00 C ATOM 323 CE LYS A 19 6.627 -49.383 -14.822 1.00 0.00 C ATOM 324 NZ LYS A 19 6.724 -49.184 -16.258 1.00 0.00 N ATOM 0 H LYS A 19 6.997 -47.833 -10.102 1.00 0.00 H new ATOM 0 HA LYS A 19 8.975 -45.906 -10.857 1.00 0.00 H new ATOM 0 HB2 LYS A 19 9.470 -47.416 -12.662 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.260 -48.320 -11.176 1.00 0.00 H new ATOM 0 HG2 LYS A 19 8.052 -49.725 -12.486 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.752 -48.585 -12.200 1.00 0.00 H new ATOM 0 HD2 LYS A 19 7.323 -47.407 -14.343 1.00 0.00 H new ATOM 0 HD3 LYS A 19 8.605 -48.566 -14.632 1.00 0.00 H new ATOM 0 HE2 LYS A 19 6.848 -50.418 -14.561 1.00 0.00 H new ATOM 0 HE3 LYS A 19 5.616 -49.175 -14.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 5.890 -49.596 -16.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 6.768 -48.166 -16.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 7.584 -49.647 -16.615 1.00 0.00 H new ATOM 338 N LYS A 20 6.079 -45.587 -12.421 1.00 0.00 N ATOM 339 CA LYS A 20 5.359 -44.500 -13.098 1.00 0.00 C ATOM 340 C LYS A 20 5.486 -43.179 -12.302 1.00 0.00 C ATOM 341 O LYS A 20 5.599 -42.141 -12.951 1.00 0.00 O ATOM 342 CB LYS A 20 3.872 -44.904 -13.341 1.00 0.00 C ATOM 343 CG LYS A 20 3.012 -43.991 -14.268 1.00 0.00 C ATOM 344 CD LYS A 20 2.356 -42.772 -13.568 1.00 0.00 C ATOM 345 CE LYS A 20 1.505 -41.948 -14.527 1.00 0.00 C ATOM 346 NZ LYS A 20 1.020 -40.774 -13.807 1.00 0.00 N ATOM 0 H LYS A 20 5.486 -46.355 -12.107 1.00 0.00 H new ATOM 0 HA LYS A 20 5.813 -44.327 -14.074 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.863 -45.910 -13.760 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.377 -44.958 -12.371 1.00 0.00 H new ATOM 0 HG2 LYS A 20 3.642 -43.628 -15.080 1.00 0.00 H new ATOM 0 HG3 LYS A 20 2.226 -44.596 -14.720 1.00 0.00 H new ATOM 0 HD2 LYS A 20 1.736 -43.120 -12.742 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.133 -42.139 -13.139 1.00 0.00 H new ATOM 0 HE2 LYS A 20 2.092 -41.647 -15.395 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.668 -42.540 -14.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.191 -40.383 -14.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 0.753 -41.046 -12.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.771 -40.055 -13.769 1.00 0.00 H new ATOM 360 N CYS A 21 5.468 -43.136 -10.952 1.00 0.00 N ATOM 361 CA CYS A 21 5.868 -41.943 -10.180 1.00 0.00 C ATOM 362 C CYS A 21 7.288 -41.428 -10.508 1.00 0.00 C ATOM 363 O CYS A 21 7.476 -40.211 -10.605 1.00 0.00 O ATOM 364 CB CYS A 21 5.763 -42.208 -8.670 1.00 0.00 C ATOM 365 SG CYS A 21 4.084 -42.429 -8.026 1.00 0.00 S ATOM 0 H CYS A 21 5.178 -43.923 -10.371 1.00 0.00 H new ATOM 0 HA CYS A 21 5.169 -41.162 -10.479 1.00 0.00 H new ATOM 0 HB2 CYS A 21 6.343 -43.101 -8.435 1.00 0.00 H new ATOM 0 HB3 CYS A 21 6.229 -41.377 -8.141 1.00 0.00 H new ATOM 370 N CYS A 22 8.278 -42.326 -10.688 1.00 0.00 N ATOM 371 CA CYS A 22 9.562 -41.987 -11.334 1.00 0.00 C ATOM 372 C CYS A 22 9.363 -41.290 -12.672 1.00 0.00 C ATOM 373 O CYS A 22 9.810 -40.161 -12.858 1.00 0.00 O ATOM 374 CB CYS A 22 10.542 -43.186 -11.373 1.00 0.00 C ATOM 375 SG CYS A 22 12.272 -42.736 -11.036 1.00 0.00 S ATOM 0 H CYS A 22 8.211 -43.300 -10.392 1.00 0.00 H new ATOM 0 HA CYS A 22 10.059 -41.250 -10.703 1.00 0.00 H new ATOM 0 HB2 CYS A 22 10.221 -43.929 -10.642 1.00 0.00 H new ATOM 0 HB3 CYS A 22 10.484 -43.658 -12.354 1.00 0.00 H new ATOM 380 N TYR A 23 8.637 -41.911 -13.579 1.00 0.00 N ATOM 381 CA TYR A 23 8.526 -41.389 -14.931 1.00 0.00 C ATOM 382 C TYR A 23 7.634 -40.129 -15.054 1.00 0.00 C ATOM 383 O TYR A 23 7.829 -39.302 -15.950 1.00 0.00 O ATOM 384 CB TYR A 23 8.195 -42.592 -15.795 1.00 0.00 C ATOM 385 CG TYR A 23 9.230 -43.744 -15.647 1.00 0.00 C ATOM 386 CD1 TYR A 23 10.481 -43.705 -14.981 1.00 0.00 C ATOM 387 CD2 TYR A 23 8.925 -44.892 -16.353 1.00 0.00 C ATOM 388 CE1 TYR A 23 11.364 -44.762 -15.123 1.00 0.00 C ATOM 389 CE2 TYR A 23 9.810 -45.940 -16.478 1.00 0.00 C ATOM 390 CZ TYR A 23 11.036 -45.867 -15.871 1.00 0.00 C ATOM 391 OH TYR A 23 11.933 -46.877 -16.022 1.00 0.00 O ATOM 0 H TYR A 23 8.117 -42.772 -13.409 1.00 0.00 H new ATOM 0 HA TYR A 23 9.455 -40.951 -15.295 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.205 -42.963 -15.529 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.150 -42.282 -16.839 1.00 0.00 H new ATOM 0 HD1 TYR A 23 10.744 -42.856 -14.367 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.956 -44.970 -16.824 1.00 0.00 H new ATOM 0 HE1 TYR A 23 12.328 -44.717 -14.637 1.00 0.00 H new ATOM 0 HE2 TYR A 23 9.539 -46.814 -17.051 1.00 0.00 H new ATOM 0 HH TYR A 23 12.843 -46.515 -15.985 1.00 0.00 H new ATOM 401 N ASP A 24 6.701 -39.963 -14.101 1.00 0.00 N ATOM 402 CA ASP A 24 6.036 -38.697 -13.771 1.00 0.00 C ATOM 403 C ASP A 24 7.068 -37.612 -13.407 1.00 0.00 C ATOM 404 O ASP A 24 7.071 -36.562 -14.050 1.00 0.00 O ATOM 405 CB ASP A 24 5.029 -38.960 -12.602 1.00 0.00 C ATOM 406 CG ASP A 24 3.698 -38.239 -12.799 1.00 0.00 C ATOM 407 OD1 ASP A 24 3.638 -37.019 -12.637 1.00 0.00 O ATOM 408 OD2 ASP A 24 2.724 -38.929 -13.109 1.00 0.00 O ATOM 0 H ASP A 24 6.380 -40.737 -13.520 1.00 0.00 H new ATOM 0 HA ASP A 24 5.489 -38.324 -14.637 1.00 0.00 H new ATOM 0 HB2 ASP A 24 4.848 -40.032 -12.518 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.477 -38.637 -11.662 1.00 0.00 H new ATOM 413 N GLY A 25 7.964 -37.871 -12.438 1.00 0.00 N ATOM 414 CA GLY A 25 9.068 -36.963 -12.089 1.00 0.00 C ATOM 415 C GLY A 25 10.095 -36.720 -13.203 1.00 0.00 C ATOM 416 O GLY A 25 10.595 -35.602 -13.323 1.00 0.00 O ATOM 0 H GLY A 25 7.941 -38.720 -11.873 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.646 -36.003 -11.791 1.00 0.00 H new ATOM 0 HA3 GLY A 25 9.588 -37.367 -11.220 1.00 0.00 H new ATOM 420 N ALA A 26 10.433 -37.748 -13.996 1.00 0.00 N ATOM 421 CA ALA A 26 11.274 -37.607 -15.190 1.00 0.00 C ATOM 422 C ALA A 26 10.657 -36.680 -16.256 1.00 0.00 C ATOM 423 O ALA A 26 11.375 -35.911 -16.902 1.00 0.00 O ATOM 424 CB ALA A 26 11.582 -38.991 -15.791 1.00 0.00 C ATOM 0 H ALA A 26 10.128 -38.706 -13.824 1.00 0.00 H new ATOM 0 HA ALA A 26 12.202 -37.135 -14.868 1.00 0.00 H new ATOM 0 HB1 ALA A 26 12.207 -38.872 -16.676 1.00 0.00 H new ATOM 0 HB2 ALA A 26 12.108 -39.599 -15.055 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.650 -39.483 -16.068 1.00 0.00 H new ATOM 430 N TYR A 27 9.331 -36.731 -16.453 1.00 0.00 N ATOM 431 CA TYR A 27 8.614 -35.733 -17.249 1.00 0.00 C ATOM 432 C TYR A 27 8.520 -34.361 -16.523 1.00 0.00 C ATOM 433 O TYR A 27 7.488 -33.957 -15.968 1.00 0.00 O ATOM 434 CB TYR A 27 7.238 -36.364 -17.619 1.00 0.00 C ATOM 435 CG TYR A 27 6.388 -35.514 -18.580 1.00 0.00 C ATOM 436 CD1 TYR A 27 6.852 -35.110 -19.823 1.00 0.00 C ATOM 437 CD2 TYR A 27 5.098 -35.146 -18.236 1.00 0.00 C ATOM 438 CE1 TYR A 27 6.065 -34.367 -20.683 1.00 0.00 C ATOM 439 CE2 TYR A 27 4.305 -34.405 -19.091 1.00 0.00 C ATOM 440 CZ TYR A 27 4.790 -34.016 -20.312 1.00 0.00 C ATOM 441 OH TYR A 27 4.003 -33.282 -21.137 1.00 0.00 O ATOM 0 H TYR A 27 8.732 -37.461 -16.067 1.00 0.00 H new ATOM 0 HA TYR A 27 9.152 -35.491 -18.166 1.00 0.00 H new ATOM 0 HB2 TYR A 27 7.410 -37.341 -18.072 1.00 0.00 H new ATOM 0 HB3 TYR A 27 6.671 -36.532 -16.703 1.00 0.00 H new ATOM 0 HD1 TYR A 27 7.852 -35.382 -20.126 1.00 0.00 H new ATOM 0 HD2 TYR A 27 4.702 -35.445 -17.277 1.00 0.00 H new ATOM 0 HE1 TYR A 27 6.452 -34.063 -21.644 1.00 0.00 H new ATOM 0 HE2 TYR A 27 3.302 -34.132 -18.797 1.00 0.00 H new ATOM 0 HH TYR A 27 3.134 -33.130 -20.710 1.00 0.00 H new ATOM 451 N ARG A 28 9.654 -33.638 -16.482 1.00 0.00 N ATOM 452 CA ARG A 28 9.687 -32.236 -16.049 1.00 0.00 C ATOM 453 C ARG A 28 9.154 -31.250 -17.112 1.00 0.00 C ATOM 454 O ARG A 28 9.889 -30.648 -17.901 1.00 0.00 O ATOM 455 CB ARG A 28 11.113 -31.853 -15.562 1.00 0.00 C ATOM 456 CG ARG A 28 11.319 -32.097 -14.051 1.00 0.00 C ATOM 457 CD ARG A 28 10.769 -30.961 -13.171 1.00 0.00 C ATOM 458 NE ARG A 28 11.707 -29.840 -13.205 1.00 0.00 N ATOM 459 CZ ARG A 28 11.541 -28.693 -12.614 1.00 0.00 C ATOM 460 NH1 ARG A 28 10.466 -28.258 -12.084 1.00 0.00 N ATOM 461 NH2 ARG A 28 12.531 -27.898 -12.574 1.00 0.00 N ATOM 0 H ARG A 28 10.566 -34.010 -16.747 1.00 0.00 H new ATOM 0 HA ARG A 28 8.998 -32.147 -15.209 1.00 0.00 H new ATOM 0 HB2 ARG A 28 11.849 -32.430 -16.122 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.297 -30.802 -15.783 1.00 0.00 H new ATOM 0 HG2 ARG A 28 10.833 -33.032 -13.771 1.00 0.00 H new ATOM 0 HG3 ARG A 28 12.384 -32.219 -13.851 1.00 0.00 H new ATOM 0 HD2 ARG A 28 9.790 -30.645 -13.532 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.634 -31.309 -12.147 1.00 0.00 H new ATOM 0 HE ARG A 28 12.567 -29.968 -13.739 1.00 0.00 H new ATOM 0 HH11 ARG A 28 9.622 -28.831 -12.099 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.450 -27.337 -11.645 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.419 -28.168 -12.997 1.00 0.00 H new ATOM 0 HH22 ARG A 28 12.438 -26.990 -12.119 1.00 0.00 H new ATOM 475 N ASN A 29 7.824 -31.125 -17.128 1.00 0.00 N ATOM 476 CA ASN A 29 7.105 -30.115 -17.913 1.00 0.00 C ATOM 477 C ASN A 29 6.960 -28.759 -17.187 1.00 0.00 C ATOM 478 O ASN A 29 7.059 -27.696 -17.794 1.00 0.00 O ATOM 479 CB ASN A 29 5.713 -30.684 -18.323 1.00 0.00 C ATOM 480 CG ASN A 29 4.856 -31.095 -17.121 1.00 0.00 C ATOM 481 OD1 ASN A 29 5.124 -32.219 -16.484 1.00 0.00 O flip ATOM 482 ND2 ASN A 29 3.938 -30.396 -16.719 1.00 0.00 N flip ATOM 0 H ASN A 29 7.206 -31.731 -16.588 1.00 0.00 H new ATOM 0 HA ASN A 29 7.700 -29.905 -18.802 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.177 -29.934 -18.905 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.857 -31.548 -18.972 1.00 0.00 H new ATOM 0 HD21 ASN A 29 3.714 -29.523 -17.197 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.395 -30.685 -15.905 1.00 0.00 H new ATOM 489 N ASP A 30 6.768 -28.828 -15.865 1.00 0.00 N ATOM 490 CA ASP A 30 6.423 -27.713 -14.975 1.00 0.00 C ATOM 491 C ASP A 30 7.441 -26.559 -14.821 1.00 0.00 C ATOM 492 O ASP A 30 7.054 -25.504 -14.311 1.00 0.00 O ATOM 493 CB ASP A 30 6.041 -28.314 -13.584 1.00 0.00 C ATOM 494 CG ASP A 30 7.070 -29.324 -13.073 1.00 0.00 C ATOM 495 OD1 ASP A 30 7.061 -30.459 -13.556 1.00 0.00 O ATOM 496 OD2 ASP A 30 7.883 -28.982 -12.219 1.00 0.00 O ATOM 0 H ASP A 30 6.854 -29.710 -15.360 1.00 0.00 H new ATOM 0 HA ASP A 30 5.593 -27.204 -15.465 1.00 0.00 H new ATOM 0 HB2 ASP A 30 5.940 -27.506 -12.859 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.068 -28.799 -13.658 1.00 0.00 H new ATOM 501 N ASP A 31 8.719 -26.724 -15.206 1.00 0.00 N ATOM 502 CA ASP A 31 9.787 -25.705 -15.160 1.00 0.00 C ATOM 503 C ASP A 31 10.177 -25.177 -13.759 1.00 0.00 C ATOM 504 O ASP A 31 11.368 -25.111 -13.455 1.00 0.00 O ATOM 505 CB ASP A 31 9.490 -24.508 -16.123 1.00 0.00 C ATOM 506 CG ASP A 31 9.346 -24.932 -17.583 1.00 0.00 C ATOM 507 OD1 ASP A 31 10.245 -25.597 -18.107 1.00 0.00 O ATOM 508 OD2 ASP A 31 8.349 -24.564 -18.192 1.00 0.00 O ATOM 0 H ASP A 31 9.053 -27.614 -15.576 1.00 0.00 H new ATOM 0 HA ASP A 31 10.662 -26.256 -15.503 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.574 -24.012 -15.803 1.00 0.00 H new ATOM 0 HB3 ASP A 31 10.294 -23.776 -16.041 1.00 0.00 H new ATOM 513 N GLU A 32 9.209 -24.750 -12.932 1.00 0.00 N ATOM 514 CA GLU A 32 9.423 -24.248 -11.568 1.00 0.00 C ATOM 515 C GLU A 32 9.782 -25.355 -10.541 1.00 0.00 C ATOM 516 O GLU A 32 10.810 -26.017 -10.714 1.00 0.00 O ATOM 517 CB GLU A 32 8.189 -23.398 -11.154 1.00 0.00 C ATOM 518 CG GLU A 32 7.999 -22.132 -12.045 1.00 0.00 C ATOM 519 CD GLU A 32 6.794 -21.294 -11.615 1.00 0.00 C ATOM 520 OE1 GLU A 32 6.960 -20.435 -10.752 1.00 0.00 O ATOM 521 OE2 GLU A 32 5.712 -21.507 -12.155 1.00 0.00 O ATOM 0 H GLU A 32 8.226 -24.745 -13.204 1.00 0.00 H new ATOM 0 HA GLU A 32 10.309 -23.613 -11.567 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.293 -24.015 -11.212 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.298 -23.091 -10.114 1.00 0.00 H new ATOM 0 HG2 GLU A 32 8.900 -21.520 -11.999 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.874 -22.437 -13.084 1.00 0.00 H new ATOM 528 N THR A 33 9.024 -25.638 -9.469 1.00 0.00 N ATOM 529 CA THR A 33 9.374 -26.677 -8.489 1.00 0.00 C ATOM 530 C THR A 33 8.493 -27.934 -8.591 1.00 0.00 C ATOM 531 O THR A 33 7.259 -27.875 -8.521 1.00 0.00 O ATOM 532 CB THR A 33 9.326 -26.126 -7.039 1.00 0.00 C ATOM 533 OG1 THR A 33 8.112 -25.427 -6.810 1.00 0.00 O ATOM 534 CG2 THR A 33 10.438 -25.131 -6.737 1.00 0.00 C ATOM 0 H THR A 33 8.152 -25.153 -9.258 1.00 0.00 H new ATOM 0 HA THR A 33 10.394 -26.973 -8.733 1.00 0.00 H new ATOM 0 HB THR A 33 9.430 -27.004 -6.401 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.764 -25.658 -5.924 1.00 0.00 H new ATOM 0 HG21 THR A 33 10.347 -24.785 -5.708 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.405 -25.614 -6.873 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.359 -24.281 -7.414 1.00 0.00 H new ATOM 542 N CYS A 34 9.134 -29.101 -8.760 1.00 0.00 N ATOM 543 CA CYS A 34 8.438 -30.391 -8.751 1.00 0.00 C ATOM 544 C CYS A 34 7.868 -30.784 -7.373 1.00 0.00 C ATOM 545 O CYS A 34 6.946 -31.594 -7.305 1.00 0.00 O ATOM 546 CB CYS A 34 9.305 -31.528 -9.341 1.00 0.00 C ATOM 547 SG CYS A 34 10.760 -32.043 -8.390 1.00 0.00 S ATOM 0 H CYS A 34 10.141 -29.174 -8.905 1.00 0.00 H new ATOM 0 HA CYS A 34 7.578 -30.249 -9.405 1.00 0.00 H new ATOM 0 HB2 CYS A 34 8.667 -32.401 -9.481 1.00 0.00 H new ATOM 0 HB3 CYS A 34 9.641 -31.217 -10.330 1.00 0.00 H new ATOM 552 N GLU A 35 8.391 -30.212 -6.279 1.00 0.00 N ATOM 553 CA GLU A 35 7.929 -30.449 -4.909 1.00 0.00 C ATOM 554 C GLU A 35 6.478 -29.996 -4.652 1.00 0.00 C ATOM 555 O GLU A 35 5.771 -30.667 -3.905 1.00 0.00 O ATOM 556 CB GLU A 35 8.880 -29.724 -3.907 1.00 0.00 C ATOM 557 CG GLU A 35 10.367 -30.232 -3.852 1.00 0.00 C ATOM 558 CD GLU A 35 11.289 -29.847 -5.024 1.00 0.00 C ATOM 559 OE1 GLU A 35 10.904 -29.068 -5.901 1.00 0.00 O ATOM 560 OE2 GLU A 35 12.417 -30.341 -5.036 1.00 0.00 O ATOM 0 H GLU A 35 9.169 -29.554 -6.327 1.00 0.00 H new ATOM 0 HA GLU A 35 7.948 -31.529 -4.761 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.892 -28.663 -4.156 1.00 0.00 H new ATOM 0 HB3 GLU A 35 8.453 -29.812 -2.908 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.817 -29.859 -2.932 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.349 -31.319 -3.780 1.00 0.00 H new ATOM 567 N GLU A 36 6.008 -28.887 -5.242 1.00 0.00 N ATOM 568 CA GLU A 36 4.604 -28.457 -5.150 1.00 0.00 C ATOM 569 C GLU A 36 3.646 -29.384 -5.929 1.00 0.00 C ATOM 570 O GLU A 36 2.596 -29.810 -5.421 1.00 0.00 O ATOM 571 CB GLU A 36 4.487 -26.972 -5.606 1.00 0.00 C ATOM 572 CG GLU A 36 4.750 -25.935 -4.461 1.00 0.00 C ATOM 573 CD GLU A 36 6.112 -26.077 -3.773 1.00 0.00 C ATOM 574 OE1 GLU A 36 7.136 -25.852 -4.421 1.00 0.00 O ATOM 575 OE2 GLU A 36 6.134 -26.413 -2.593 1.00 0.00 O ATOM 0 H GLU A 36 6.592 -28.262 -5.798 1.00 0.00 H new ATOM 0 HA GLU A 36 4.291 -28.530 -4.109 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.196 -26.793 -6.415 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.490 -26.804 -6.013 1.00 0.00 H new ATOM 0 HG2 GLU A 36 4.669 -24.929 -4.874 1.00 0.00 H new ATOM 0 HG3 GLU A 36 3.966 -26.036 -3.710 1.00 0.00 H new ATOM 582 N ARG A 37 4.052 -29.703 -7.164 1.00 0.00 N ATOM 583 CA ARG A 37 3.437 -30.743 -7.988 1.00 0.00 C ATOM 584 C ARG A 37 3.387 -32.101 -7.253 1.00 0.00 C ATOM 585 O ARG A 37 2.318 -32.706 -7.172 1.00 0.00 O ATOM 586 CB ARG A 37 4.249 -30.798 -9.311 1.00 0.00 C ATOM 587 CG ARG A 37 3.846 -31.915 -10.295 1.00 0.00 C ATOM 588 CD ARG A 37 4.721 -31.906 -11.546 1.00 0.00 C ATOM 589 NE ARG A 37 4.516 -33.172 -12.241 1.00 0.00 N ATOM 590 CZ ARG A 37 5.273 -33.652 -13.187 1.00 0.00 C ATOM 591 NH1 ARG A 37 6.212 -33.023 -13.796 1.00 0.00 N ATOM 592 NH2 ARG A 37 5.076 -34.856 -13.535 1.00 0.00 N ATOM 0 H ARG A 37 4.832 -29.235 -7.625 1.00 0.00 H new ATOM 0 HA ARG A 37 2.394 -30.510 -8.203 1.00 0.00 H new ATOM 0 HB2 ARG A 37 4.149 -29.838 -9.818 1.00 0.00 H new ATOM 0 HB3 ARG A 37 5.304 -30.919 -9.064 1.00 0.00 H new ATOM 0 HG2 ARG A 37 3.928 -32.883 -9.800 1.00 0.00 H new ATOM 0 HG3 ARG A 37 2.801 -31.790 -10.580 1.00 0.00 H new ATOM 0 HD2 ARG A 37 4.456 -31.068 -12.191 1.00 0.00 H new ATOM 0 HD3 ARG A 37 5.770 -31.783 -11.278 1.00 0.00 H new ATOM 0 HE ARG A 37 3.709 -33.731 -11.962 1.00 0.00 H new ATOM 0 HH11 ARG A 37 6.421 -32.055 -13.550 1.00 0.00 H new ATOM 0 HH12 ARG A 37 6.749 -33.491 -14.526 1.00 0.00 H new ATOM 0 HH21 ARG A 37 4.349 -35.406 -13.078 1.00 0.00 H new ATOM 0 HH22 ARG A 37 5.645 -35.274 -14.271 1.00 0.00 H new ATOM 606 N ALA A 38 4.498 -32.596 -6.691 1.00 0.00 N ATOM 607 CA ALA A 38 4.515 -33.814 -5.882 1.00 0.00 C ATOM 608 C ALA A 38 4.066 -33.678 -4.407 1.00 0.00 C ATOM 609 O ALA A 38 4.048 -34.668 -3.677 1.00 0.00 O ATOM 610 CB ALA A 38 5.856 -34.506 -6.092 1.00 0.00 C ATOM 0 H ALA A 38 5.414 -32.157 -6.788 1.00 0.00 H new ATOM 0 HA ALA A 38 3.715 -34.459 -6.244 1.00 0.00 H new ATOM 0 HB1 ALA A 38 5.892 -35.419 -5.497 1.00 0.00 H new ATOM 0 HB2 ALA A 38 5.976 -34.755 -7.146 1.00 0.00 H new ATOM 0 HB3 ALA A 38 6.662 -33.840 -5.783 1.00 0.00 H new ATOM 616 N ALA A 39 3.738 -32.482 -3.900 1.00 0.00 N ATOM 617 CA ALA A 39 2.779 -32.334 -2.801 1.00 0.00 C ATOM 618 C ALA A 39 1.322 -32.626 -3.224 1.00 0.00 C ATOM 619 O ALA A 39 0.508 -32.979 -2.370 1.00 0.00 O ATOM 620 CB ALA A 39 2.919 -30.938 -2.168 1.00 0.00 C ATOM 0 H ALA A 39 4.126 -31.600 -4.236 1.00 0.00 H new ATOM 0 HA ALA A 39 3.021 -33.088 -2.052 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.203 -30.835 -1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 39 3.931 -30.814 -1.781 1.00 0.00 H new ATOM 0 HB3 ALA A 39 2.722 -30.175 -2.922 1.00 0.00 H new ATOM 626 N ARG A 40 0.939 -32.444 -4.500 1.00 0.00 N ATOM 627 CA ARG A 40 -0.265 -33.103 -5.043 1.00 0.00 C ATOM 628 C ARG A 40 -0.101 -34.625 -5.298 1.00 0.00 C ATOM 629 O ARG A 40 -1.028 -35.385 -5.011 1.00 0.00 O ATOM 630 CB ARG A 40 -0.784 -32.388 -6.323 1.00 0.00 C ATOM 631 CG ARG A 40 -1.648 -31.124 -6.063 1.00 0.00 C ATOM 632 CD ARG A 40 -0.996 -29.792 -6.482 1.00 0.00 C ATOM 633 NE ARG A 40 -0.002 -29.378 -5.490 1.00 0.00 N ATOM 634 CZ ARG A 40 -0.232 -28.697 -4.402 1.00 0.00 C ATOM 635 NH1 ARG A 40 -1.384 -28.309 -4.000 1.00 0.00 N ATOM 636 NH2 ARG A 40 0.782 -28.414 -3.692 1.00 0.00 N ATOM 0 H ARG A 40 1.437 -31.855 -5.168 1.00 0.00 H new ATOM 0 HA ARG A 40 -1.012 -33.008 -4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 40 0.072 -32.105 -6.936 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.372 -33.098 -6.905 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -2.593 -31.232 -6.596 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.885 -31.077 -5.000 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -0.522 -29.902 -7.457 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -1.760 -29.022 -6.584 1.00 0.00 H new ATOM 0 HE ARG A 40 0.965 -29.649 -5.667 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -2.216 -28.530 -4.547 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -1.470 -27.779 -3.133 1.00 0.00 H new ATOM 0 HH21 ARG A 40 1.711 -28.718 -3.985 1.00 0.00 H new ATOM 0 HH22 ARG A 40 0.668 -27.883 -2.829 1.00 0.00 H new ATOM 650 N ILE A 41 1.008 -35.115 -5.881 1.00 0.00 N ATOM 651 CA ILE A 41 1.321 -36.551 -6.004 1.00 0.00 C ATOM 652 C ILE A 41 1.685 -37.240 -4.664 1.00 0.00 C ATOM 653 O ILE A 41 2.816 -37.486 -4.241 1.00 0.00 O ATOM 654 CB ILE A 41 2.294 -36.896 -7.175 1.00 0.00 C ATOM 655 CG1 ILE A 41 1.754 -36.432 -8.545 1.00 0.00 C ATOM 656 CG2 ILE A 41 2.522 -38.374 -7.294 1.00 0.00 C ATOM 657 CD1 ILE A 41 2.567 -35.242 -8.965 1.00 0.00 C ATOM 0 H ILE A 41 1.725 -34.514 -6.287 1.00 0.00 H new ATOM 0 HA ILE A 41 0.373 -37.003 -6.294 1.00 0.00 H new ATOM 0 HB ILE A 41 3.219 -36.374 -6.931 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.835 -37.232 -9.281 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.698 -36.170 -8.473 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.205 -38.571 -8.121 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.955 -38.751 -6.368 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.572 -38.875 -7.480 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.215 -34.884 -9.932 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.462 -34.450 -8.224 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.616 -35.528 -9.044 1.00 0.00 H new ATOM 669 N LYS A 42 0.558 -37.571 -4.053 1.00 0.00 N ATOM 670 CA LYS A 42 0.437 -38.221 -2.743 1.00 0.00 C ATOM 671 C LYS A 42 0.107 -39.732 -2.787 1.00 0.00 C ATOM 672 O LYS A 42 -0.492 -40.263 -1.847 1.00 0.00 O ATOM 673 CB LYS A 42 -0.615 -37.441 -1.895 1.00 0.00 C ATOM 674 CG LYS A 42 -0.124 -36.118 -1.265 1.00 0.00 C ATOM 675 CD LYS A 42 0.900 -36.322 -0.127 1.00 0.00 C ATOM 676 CE LYS A 42 1.251 -34.998 0.544 1.00 0.00 C ATOM 677 NZ LYS A 42 2.260 -35.272 1.555 1.00 0.00 N ATOM 0 H LYS A 42 -0.352 -37.386 -4.476 1.00 0.00 H new ATOM 0 HA LYS A 42 1.423 -38.180 -2.280 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.475 -37.223 -2.529 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -0.966 -38.094 -1.096 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.326 -35.500 -2.042 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.982 -35.569 -0.877 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.493 -37.011 0.613 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.804 -36.781 -0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.627 -34.285 -0.189 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.366 -34.552 0.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.522 -34.386 2.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 1.879 -35.942 2.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 3.101 -35.684 1.103 1.00 0.00 H new ATOM 691 N ILE A 43 0.495 -40.456 -3.848 1.00 0.00 N ATOM 692 CA ILE A 43 0.178 -41.886 -4.013 1.00 0.00 C ATOM 693 C ILE A 43 0.914 -42.785 -2.989 1.00 0.00 C ATOM 694 O ILE A 43 0.348 -43.774 -2.515 1.00 0.00 O ATOM 695 CB ILE A 43 0.429 -42.316 -5.503 1.00 0.00 C ATOM 696 CG1 ILE A 43 -0.351 -41.468 -6.557 1.00 0.00 C ATOM 697 CG2 ILE A 43 0.206 -43.824 -5.786 1.00 0.00 C ATOM 698 CD1 ILE A 43 -1.897 -41.477 -6.457 1.00 0.00 C ATOM 0 H ILE A 43 1.039 -40.067 -4.618 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.880 -42.030 -3.795 1.00 0.00 H new ATOM 0 HB ILE A 43 1.492 -42.110 -5.623 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.012 -40.435 -6.480 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.073 -41.821 -7.550 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.402 -44.030 -6.838 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.883 -44.414 -5.169 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.824 -44.090 -5.550 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.316 -40.851 -7.244 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.263 -42.497 -6.571 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.201 -41.089 -5.485 1.00 0.00 H new ATOM 710 N GLY A 44 2.158 -42.453 -2.608 1.00 0.00 N ATOM 711 CA GLY A 44 2.870 -43.163 -1.535 1.00 0.00 C ATOM 712 C GLY A 44 4.260 -42.594 -1.165 1.00 0.00 C ATOM 713 O GLY A 44 4.804 -41.812 -1.954 1.00 0.00 O ATOM 0 H GLY A 44 2.693 -41.694 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.245 -43.156 -0.642 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.991 -44.205 -1.831 1.00 0.00 H new ATOM 717 N PRO A 45 4.882 -42.944 -0.008 1.00 0.00 N ATOM 718 CA PRO A 45 6.260 -42.548 0.366 1.00 0.00 C ATOM 719 C PRO A 45 7.360 -42.895 -0.663 1.00 0.00 C ATOM 720 O PRO A 45 8.206 -42.052 -1.001 1.00 0.00 O ATOM 721 CB PRO A 45 6.496 -43.292 1.694 1.00 0.00 C ATOM 722 CG PRO A 45 5.111 -43.318 2.300 1.00 0.00 C ATOM 723 CD PRO A 45 4.235 -43.663 1.099 1.00 0.00 C ATOM 0 HA PRO A 45 6.333 -41.462 0.428 1.00 0.00 H new ATOM 0 HB2 PRO A 45 6.888 -44.296 1.533 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.209 -42.769 2.332 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.028 -44.063 3.091 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.841 -42.357 2.737 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.205 -44.737 0.918 1.00 0.00 H new ATOM 0 HD3 PRO A 45 3.206 -43.336 1.244 1.00 0.00 H new ATOM 731 N LYS A 46 7.325 -44.152 -1.132 1.00 0.00 N ATOM 732 CA LYS A 46 8.154 -44.669 -2.225 1.00 0.00 C ATOM 733 C LYS A 46 7.911 -43.968 -3.576 1.00 0.00 C ATOM 734 O LYS A 46 8.849 -43.813 -4.362 1.00 0.00 O ATOM 735 CB LYS A 46 7.902 -46.193 -2.359 1.00 0.00 C ATOM 736 CG LYS A 46 8.755 -47.042 -1.395 1.00 0.00 C ATOM 737 CD LYS A 46 8.377 -48.543 -1.467 1.00 0.00 C ATOM 738 CE LYS A 46 9.583 -49.486 -1.350 1.00 0.00 C ATOM 739 NZ LYS A 46 10.168 -49.649 -2.678 1.00 0.00 N ATOM 0 H LYS A 46 6.697 -44.857 -0.746 1.00 0.00 H new ATOM 0 HA LYS A 46 9.194 -44.463 -1.970 1.00 0.00 H new ATOM 0 HB2 LYS A 46 6.847 -46.397 -2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 46 8.111 -46.500 -3.384 1.00 0.00 H new ATOM 0 HG2 LYS A 46 9.810 -46.920 -1.639 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.620 -46.681 -0.375 1.00 0.00 H new ATOM 0 HD2 LYS A 46 7.670 -48.770 -0.669 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.866 -48.736 -2.410 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.319 -49.077 -0.658 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.273 -50.452 -0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.130 -50.035 -2.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 9.583 -50.303 -3.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.208 -48.726 -3.155 1.00 0.00 H new ATOM 753 N CYS A 47 6.661 -43.544 -3.824 1.00 0.00 N ATOM 754 CA CYS A 47 6.291 -42.725 -4.977 1.00 0.00 C ATOM 755 C CYS A 47 6.985 -41.355 -4.933 1.00 0.00 C ATOM 756 O CYS A 47 7.694 -41.028 -5.886 1.00 0.00 O ATOM 757 CB CYS A 47 4.752 -42.567 -5.047 1.00 0.00 C ATOM 758 SG CYS A 47 4.126 -41.406 -6.289 1.00 0.00 S ATOM 0 H CYS A 47 5.872 -43.767 -3.217 1.00 0.00 H new ATOM 0 HA CYS A 47 6.629 -43.232 -5.881 1.00 0.00 H new ATOM 0 HB2 CYS A 47 4.315 -43.546 -5.242 1.00 0.00 H new ATOM 0 HB3 CYS A 47 4.395 -42.248 -4.068 1.00 0.00 H new ATOM 763 N VAL A 48 6.790 -40.552 -3.867 1.00 0.00 N ATOM 764 CA VAL A 48 7.548 -39.300 -3.685 1.00 0.00 C ATOM 765 C VAL A 48 9.086 -39.434 -3.742 1.00 0.00 C ATOM 766 O VAL A 48 9.729 -38.490 -4.218 1.00 0.00 O ATOM 767 CB VAL A 48 7.103 -38.401 -2.475 1.00 0.00 C ATOM 768 CG1 VAL A 48 6.167 -37.272 -2.916 1.00 0.00 C ATOM 769 CG2 VAL A 48 6.359 -39.140 -1.363 1.00 0.00 C ATOM 0 H VAL A 48 6.118 -40.747 -3.125 1.00 0.00 H new ATOM 0 HA VAL A 48 7.254 -38.762 -4.586 1.00 0.00 H new ATOM 0 HB VAL A 48 8.053 -38.030 -2.090 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.884 -36.675 -2.049 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.677 -36.639 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.273 -37.698 -3.371 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.094 -38.437 -0.573 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.453 -39.590 -1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.000 -39.921 -0.953 1.00 0.00 H new ATOM 779 N LYS A 49 9.687 -40.548 -3.264 1.00 0.00 N ATOM 780 CA LYS A 49 11.119 -40.842 -3.501 1.00 0.00 C ATOM 781 C LYS A 49 11.474 -41.080 -4.986 1.00 0.00 C ATOM 782 O LYS A 49 12.377 -40.406 -5.492 1.00 0.00 O ATOM 783 CB LYS A 49 11.650 -42.056 -2.679 1.00 0.00 C ATOM 784 CG LYS A 49 11.329 -42.078 -1.175 1.00 0.00 C ATOM 785 CD LYS A 49 11.801 -40.858 -0.352 1.00 0.00 C ATOM 786 CE LYS A 49 11.092 -40.792 1.004 1.00 0.00 C ATOM 787 NZ LYS A 49 9.694 -40.431 0.775 1.00 0.00 N ATOM 0 H LYS A 49 9.203 -41.257 -2.713 1.00 0.00 H new ATOM 0 HA LYS A 49 11.611 -39.931 -3.161 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.249 -42.967 -3.124 1.00 0.00 H new ATOM 0 HB3 LYS A 49 12.733 -42.095 -2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.249 -42.172 -1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.775 -42.974 -0.744 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.879 -40.915 -0.199 1.00 0.00 H new ATOM 0 HD3 LYS A 49 11.607 -39.943 -0.911 1.00 0.00 H new ATOM 0 HE2 LYS A 49 11.157 -41.753 1.514 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.573 -40.056 1.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 9.238 -40.216 1.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.648 -39.595 0.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 9.200 -41.225 0.320 1.00 0.00 H new ATOM 801 N ALA A 50 10.785 -42.013 -5.679 1.00 0.00 N ATOM 802 CA ALA A 50 10.918 -42.255 -7.128 1.00 0.00 C ATOM 803 C ALA A 50 10.782 -40.936 -7.921 1.00 0.00 C ATOM 804 O ALA A 50 11.676 -40.569 -8.689 1.00 0.00 O ATOM 805 CB ALA A 50 9.805 -43.256 -7.535 1.00 0.00 C ATOM 0 H ALA A 50 10.106 -42.631 -5.234 1.00 0.00 H new ATOM 0 HA ALA A 50 11.902 -42.664 -7.355 1.00 0.00 H new ATOM 0 HB1 ALA A 50 9.872 -43.460 -8.604 1.00 0.00 H new ATOM 0 HB2 ALA A 50 9.931 -44.186 -6.980 1.00 0.00 H new ATOM 0 HB3 ALA A 50 8.829 -42.827 -7.308 1.00 0.00 H new ATOM 811 N PHE A 51 9.704 -40.190 -7.615 1.00 0.00 N ATOM 812 CA PHE A 51 9.406 -38.872 -8.179 1.00 0.00 C ATOM 813 C PHE A 51 10.567 -37.883 -7.985 1.00 0.00 C ATOM 814 O PHE A 51 11.051 -37.323 -8.969 1.00 0.00 O ATOM 815 CB PHE A 51 8.123 -38.331 -7.471 1.00 0.00 C ATOM 816 CG PHE A 51 7.364 -37.285 -8.296 1.00 0.00 C ATOM 817 CD1 PHE A 51 7.892 -36.036 -8.587 1.00 0.00 C ATOM 818 CD2 PHE A 51 6.158 -37.608 -8.887 1.00 0.00 C ATOM 819 CE1 PHE A 51 7.261 -35.174 -9.460 1.00 0.00 C ATOM 820 CE2 PHE A 51 5.524 -36.758 -9.747 1.00 0.00 C ATOM 821 CZ PHE A 51 6.077 -35.538 -10.050 1.00 0.00 C ATOM 0 H PHE A 51 8.999 -40.503 -6.948 1.00 0.00 H new ATOM 0 HA PHE A 51 9.253 -38.972 -9.254 1.00 0.00 H new ATOM 0 HB2 PHE A 51 7.456 -39.166 -7.256 1.00 0.00 H new ATOM 0 HB3 PHE A 51 8.404 -37.893 -6.513 1.00 0.00 H new ATOM 0 HD1 PHE A 51 8.817 -35.732 -8.120 1.00 0.00 H new ATOM 0 HD2 PHE A 51 5.703 -38.561 -8.662 1.00 0.00 H new ATOM 0 HE1 PHE A 51 7.699 -34.212 -9.679 1.00 0.00 H new ATOM 0 HE2 PHE A 51 4.583 -37.047 -10.191 1.00 0.00 H new ATOM 0 HZ PHE A 51 5.586 -34.873 -10.745 1.00 0.00 H new ATOM 831 N LYS A 52 11.023 -37.690 -6.735 1.00 0.00 N ATOM 832 CA LYS A 52 12.066 -36.720 -6.401 1.00 0.00 C ATOM 833 C LYS A 52 13.420 -37.031 -7.063 1.00 0.00 C ATOM 834 O LYS A 52 14.065 -36.131 -7.610 1.00 0.00 O ATOM 835 CB LYS A 52 12.252 -36.681 -4.856 1.00 0.00 C ATOM 836 CG LYS A 52 12.481 -35.271 -4.269 1.00 0.00 C ATOM 837 CD LYS A 52 11.296 -34.270 -4.379 1.00 0.00 C ATOM 838 CE LYS A 52 10.035 -34.582 -3.550 1.00 0.00 C ATOM 839 NZ LYS A 52 9.201 -35.575 -4.218 1.00 0.00 N ATOM 0 H LYS A 52 10.673 -38.208 -5.929 1.00 0.00 H new ATOM 0 HA LYS A 52 11.737 -35.754 -6.785 1.00 0.00 H new ATOM 0 HB2 LYS A 52 11.370 -37.116 -4.386 1.00 0.00 H new ATOM 0 HB3 LYS A 52 13.099 -37.313 -4.590 1.00 0.00 H new ATOM 0 HG2 LYS A 52 12.740 -35.378 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 52 13.346 -34.831 -4.766 1.00 0.00 H new ATOM 0 HD2 LYS A 52 11.658 -33.284 -4.087 1.00 0.00 H new ATOM 0 HD3 LYS A 52 11.004 -34.205 -5.427 1.00 0.00 H new ATOM 0 HE2 LYS A 52 10.325 -34.949 -2.565 1.00 0.00 H new ATOM 0 HE3 LYS A 52 9.463 -33.667 -3.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 8.199 -35.317 -4.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 9.443 -35.608 -5.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.365 -36.509 -3.792 1.00 0.00 H new ATOM 853 N ASP A 53 13.836 -38.308 -7.041 1.00 0.00 N ATOM 854 CA ASP A 53 15.117 -38.712 -7.615 1.00 0.00 C ATOM 855 C ASP A 53 15.143 -38.636 -9.155 1.00 0.00 C ATOM 856 O ASP A 53 16.097 -38.088 -9.729 1.00 0.00 O ATOM 857 CB ASP A 53 15.493 -40.102 -7.042 1.00 0.00 C ATOM 858 CG ASP A 53 15.890 -40.003 -5.565 1.00 0.00 C ATOM 859 OD1 ASP A 53 16.654 -39.112 -5.189 1.00 0.00 O ATOM 860 OD2 ASP A 53 15.520 -40.869 -4.780 1.00 0.00 O ATOM 0 H ASP A 53 13.300 -39.073 -6.631 1.00 0.00 H new ATOM 0 HA ASP A 53 15.888 -37.999 -7.321 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.649 -40.783 -7.150 1.00 0.00 H new ATOM 0 HB3 ASP A 53 16.318 -40.524 -7.616 1.00 0.00 H new ATOM 865 N CYS A 54 14.088 -39.140 -9.819 1.00 0.00 N ATOM 866 CA CYS A 54 13.866 -38.878 -11.243 1.00 0.00 C ATOM 867 C CYS A 54 13.725 -37.374 -11.589 1.00 0.00 C ATOM 868 O CYS A 54 14.304 -36.971 -12.600 1.00 0.00 O ATOM 869 CB CYS A 54 12.653 -39.695 -11.740 1.00 0.00 C ATOM 870 SG CYS A 54 12.967 -41.375 -12.367 1.00 0.00 S ATOM 0 H CYS A 54 13.378 -39.731 -9.387 1.00 0.00 H new ATOM 0 HA CYS A 54 14.762 -39.203 -11.771 1.00 0.00 H new ATOM 0 HB2 CYS A 54 11.940 -39.771 -10.919 1.00 0.00 H new ATOM 0 HB3 CYS A 54 12.167 -39.126 -12.533 1.00 0.00 H new ATOM 875 N CYS A 55 13.019 -36.528 -10.805 1.00 0.00 N ATOM 876 CA CYS A 55 12.992 -35.060 -10.977 1.00 0.00 C ATOM 877 C CYS A 55 14.387 -34.401 -10.953 1.00 0.00 C ATOM 878 O CYS A 55 14.695 -33.571 -11.817 1.00 0.00 O ATOM 879 CB CYS A 55 12.063 -34.408 -9.903 1.00 0.00 C ATOM 880 SG CYS A 55 12.092 -32.593 -9.804 1.00 0.00 S ATOM 0 H CYS A 55 12.445 -36.851 -10.026 1.00 0.00 H new ATOM 0 HA CYS A 55 12.593 -34.879 -11.975 1.00 0.00 H new ATOM 0 HB2 CYS A 55 11.038 -34.723 -10.101 1.00 0.00 H new ATOM 0 HB3 CYS A 55 12.336 -34.808 -8.927 1.00 0.00 H new ATOM 885 N TYR A 56 15.234 -34.738 -9.972 1.00 0.00 N ATOM 886 CA TYR A 56 16.596 -34.203 -9.899 1.00 0.00 C ATOM 887 C TYR A 56 17.517 -34.678 -11.041 1.00 0.00 C ATOM 888 O TYR A 56 18.325 -33.876 -11.518 1.00 0.00 O ATOM 889 CB TYR A 56 17.184 -34.399 -8.476 1.00 0.00 C ATOM 890 CG TYR A 56 16.625 -33.305 -7.546 1.00 0.00 C ATOM 891 CD1 TYR A 56 15.321 -33.337 -7.076 1.00 0.00 C ATOM 892 CD2 TYR A 56 17.379 -32.188 -7.224 1.00 0.00 C ATOM 893 CE1 TYR A 56 14.783 -32.299 -6.342 1.00 0.00 C ATOM 894 CE2 TYR A 56 16.851 -31.146 -6.485 1.00 0.00 C ATOM 895 CZ TYR A 56 15.551 -31.200 -6.051 1.00 0.00 C ATOM 896 OH TYR A 56 15.035 -30.163 -5.342 1.00 0.00 O ATOM 0 H TYR A 56 14.997 -35.381 -9.216 1.00 0.00 H new ATOM 0 HA TYR A 56 16.534 -33.128 -10.069 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.924 -35.386 -8.094 1.00 0.00 H new ATOM 0 HB3 TYR A 56 18.272 -34.346 -8.508 1.00 0.00 H new ATOM 0 HD1 TYR A 56 14.708 -34.200 -7.291 1.00 0.00 H new ATOM 0 HD2 TYR A 56 18.404 -32.130 -7.559 1.00 0.00 H new ATOM 0 HE1 TYR A 56 13.761 -32.352 -5.998 1.00 0.00 H new ATOM 0 HE2 TYR A 56 17.463 -30.288 -6.249 1.00 0.00 H new ATOM 0 HH TYR A 56 14.149 -30.408 -5.001 1.00 0.00 H new ATOM 906 N ILE A 57 17.422 -35.932 -11.520 1.00 0.00 N ATOM 907 CA ILE A 57 18.096 -36.334 -12.773 1.00 0.00 C ATOM 908 C ILE A 57 17.518 -35.662 -14.035 1.00 0.00 C ATOM 909 O ILE A 57 18.274 -35.285 -14.934 1.00 0.00 O ATOM 910 CB ILE A 57 18.201 -37.890 -12.883 1.00 0.00 C ATOM 911 CG1 ILE A 57 18.893 -38.528 -11.643 1.00 0.00 C ATOM 912 CG2 ILE A 57 18.907 -38.398 -14.167 1.00 0.00 C ATOM 913 CD1 ILE A 57 20.174 -37.836 -11.148 1.00 0.00 C ATOM 0 H ILE A 57 16.893 -36.677 -11.067 1.00 0.00 H new ATOM 0 HA ILE A 57 19.115 -35.950 -12.718 1.00 0.00 H new ATOM 0 HB ILE A 57 17.161 -38.212 -12.932 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.175 -38.547 -10.823 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.134 -39.564 -11.881 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.935 -39.488 -14.160 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.358 -38.055 -15.044 1.00 0.00 H new ATOM 0 HG23 ILE A 57 19.925 -38.009 -14.201 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.564 -38.370 -10.281 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.920 -37.840 -11.943 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.947 -36.807 -10.868 1.00 0.00 H new ATOM 925 N ALA A 58 16.195 -35.476 -14.099 1.00 0.00 N ATOM 926 CA ALA A 58 15.533 -34.661 -15.134 1.00 0.00 C ATOM 927 C ALA A 58 16.048 -33.204 -15.183 1.00 0.00 C ATOM 928 O ALA A 58 16.283 -32.659 -16.265 1.00 0.00 O ATOM 929 CB ALA A 58 14.023 -34.680 -14.911 1.00 0.00 C ATOM 0 H ALA A 58 15.545 -35.889 -13.430 1.00 0.00 H new ATOM 0 HA ALA A 58 15.778 -35.106 -16.098 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.535 -34.077 -15.677 1.00 0.00 H new ATOM 0 HB2 ALA A 58 13.659 -35.706 -14.970 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.795 -34.270 -13.927 1.00 0.00 H new ATOM 935 N ASN A 59 16.224 -32.566 -14.016 1.00 0.00 N ATOM 936 CA ASN A 59 16.893 -31.265 -13.908 1.00 0.00 C ATOM 937 C ASN A 59 18.399 -31.284 -14.236 1.00 0.00 C ATOM 938 O ASN A 59 18.899 -30.296 -14.779 1.00 0.00 O ATOM 939 CB ASN A 59 16.605 -30.615 -12.540 1.00 0.00 C ATOM 940 CG ASN A 59 15.152 -30.152 -12.514 1.00 0.00 C ATOM 941 OD1 ASN A 59 14.810 -29.099 -13.045 1.00 0.00 O ATOM 942 ND2 ASN A 59 14.229 -30.902 -11.948 1.00 0.00 N ATOM 0 H ASN A 59 15.906 -32.939 -13.122 1.00 0.00 H new ATOM 0 HA ASN A 59 16.458 -30.643 -14.690 1.00 0.00 H new ATOM 0 HB2 ASN A 59 16.789 -31.328 -11.737 1.00 0.00 H new ATOM 0 HB3 ASN A 59 17.274 -29.770 -12.375 1.00 0.00 H new ATOM 0 HD21 ASN A 59 13.254 -30.604 -11.957 1.00 0.00 H new ATOM 0 HD22 ASN A 59 14.490 -31.781 -11.501 1.00 0.00 H new ATOM 949 N GLN A 60 19.139 -32.361 -13.928 1.00 0.00 N ATOM 950 CA GLN A 60 20.497 -32.564 -14.449 1.00 0.00 C ATOM 951 C GLN A 60 20.520 -32.653 -15.994 1.00 0.00 C ATOM 952 O GLN A 60 21.389 -32.043 -16.622 1.00 0.00 O ATOM 953 CB GLN A 60 21.106 -33.835 -13.811 1.00 0.00 C ATOM 954 CG GLN A 60 22.644 -33.937 -13.990 1.00 0.00 C ATOM 955 CD GLN A 60 23.154 -35.340 -13.654 1.00 0.00 C ATOM 956 OE1 GLN A 60 23.126 -35.796 -12.517 1.00 0.00 O ATOM 957 NE2 GLN A 60 23.642 -36.079 -14.631 1.00 0.00 N ATOM 0 H GLN A 60 18.815 -33.109 -13.315 1.00 0.00 H new ATOM 0 HA GLN A 60 21.101 -31.698 -14.179 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.870 -33.848 -12.747 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.637 -34.715 -14.252 1.00 0.00 H new ATOM 0 HG2 GLN A 60 22.909 -33.688 -15.018 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.136 -33.206 -13.348 1.00 0.00 H new ATOM 0 HE21 GLN A 60 23.671 -35.712 -15.582 1.00 0.00 H new ATOM 0 HE22 GLN A 60 23.990 -37.018 -14.435 1.00 0.00 H new ATOM 966 N VAL A 61 19.576 -33.382 -16.621 1.00 0.00 N ATOM 967 CA VAL A 61 19.381 -33.392 -18.083 1.00 0.00 C ATOM 968 C VAL A 61 19.029 -31.997 -18.650 1.00 0.00 C ATOM 969 O VAL A 61 19.583 -31.614 -19.685 1.00 0.00 O ATOM 970 CB VAL A 61 18.336 -34.486 -18.493 1.00 0.00 C ATOM 971 CG1 VAL A 61 17.993 -34.516 -20.001 1.00 0.00 C ATOM 972 CG2 VAL A 61 18.837 -35.900 -18.130 1.00 0.00 C ATOM 0 H VAL A 61 18.922 -33.985 -16.122 1.00 0.00 H new ATOM 0 HA VAL A 61 20.336 -33.656 -18.538 1.00 0.00 H new ATOM 0 HB VAL A 61 17.440 -34.209 -17.937 1.00 0.00 H new ATOM 0 HG11 VAL A 61 17.263 -35.303 -20.193 1.00 0.00 H new ATOM 0 HG12 VAL A 61 17.576 -33.554 -20.298 1.00 0.00 H new ATOM 0 HG13 VAL A 61 18.898 -34.713 -20.576 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.091 -36.638 -18.426 1.00 0.00 H new ATOM 0 HG22 VAL A 61 19.772 -36.100 -18.653 1.00 0.00 H new ATOM 0 HG23 VAL A 61 19.002 -35.963 -17.054 1.00 0.00 H new ATOM 982 N ARG A 62 18.134 -31.223 -18.008 1.00 0.00 N ATOM 983 CA ARG A 62 17.914 -29.804 -18.338 1.00 0.00 C ATOM 984 C ARG A 62 19.176 -28.921 -18.213 1.00 0.00 C ATOM 985 O ARG A 62 19.332 -27.982 -18.994 1.00 0.00 O ATOM 986 CB ARG A 62 16.791 -29.202 -17.454 1.00 0.00 C ATOM 987 CG ARG A 62 15.356 -29.634 -17.832 1.00 0.00 C ATOM 988 CD ARG A 62 14.350 -29.077 -16.815 1.00 0.00 C ATOM 989 NE ARG A 62 12.997 -29.156 -17.371 1.00 0.00 N ATOM 990 CZ ARG A 62 12.237 -28.137 -17.663 1.00 0.00 C ATOM 991 NH1 ARG A 62 12.602 -26.913 -17.670 1.00 0.00 N ATOM 992 NH2 ARG A 62 11.028 -28.330 -18.009 1.00 0.00 N ATOM 0 H ARG A 62 17.545 -31.563 -17.248 1.00 0.00 H new ATOM 0 HA ARG A 62 17.624 -29.800 -19.389 1.00 0.00 H new ATOM 0 HB2 ARG A 62 16.977 -29.482 -16.417 1.00 0.00 H new ATOM 0 HB3 ARG A 62 16.852 -28.115 -17.506 1.00 0.00 H new ATOM 0 HG2 ARG A 62 15.111 -29.274 -18.831 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.291 -30.722 -17.860 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.406 -29.643 -15.885 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.596 -28.043 -16.574 1.00 0.00 H new ATOM 0 HE ARG A 62 12.617 -30.087 -17.544 1.00 0.00 H new ATOM 0 HH11 ARG A 62 13.563 -26.666 -17.433 1.00 0.00 H new ATOM 0 HH12 ARG A 62 11.933 -26.183 -17.913 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.657 -29.279 -18.057 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.430 -27.536 -18.238 1.00 0.00 H new ATOM 1006 N ALA A 63 20.062 -29.174 -17.236 1.00 0.00 N ATOM 1007 CA ALA A 63 21.357 -28.496 -17.134 1.00 0.00 C ATOM 1008 C ALA A 63 22.397 -28.952 -18.181 1.00 0.00 C ATOM 1009 O ALA A 63 22.942 -28.095 -18.883 1.00 0.00 O ATOM 1010 CB ALA A 63 21.897 -28.672 -15.701 1.00 0.00 C ATOM 0 H ALA A 63 19.897 -29.856 -16.496 1.00 0.00 H new ATOM 0 HA ALA A 63 21.188 -27.442 -17.354 1.00 0.00 H new ATOM 0 HB1 ALA A 63 22.861 -28.172 -15.612 1.00 0.00 H new ATOM 0 HB2 ALA A 63 21.194 -28.235 -14.991 1.00 0.00 H new ATOM 0 HB3 ALA A 63 22.018 -29.734 -15.486 1.00 0.00 H new ATOM 1016 N GLU A 64 22.701 -30.253 -18.346 1.00 0.00 N ATOM 1017 CA GLU A 64 23.732 -30.713 -19.294 1.00 0.00 C ATOM 1018 C GLU A 64 23.282 -30.714 -20.782 1.00 0.00 C ATOM 1019 O GLU A 64 23.176 -31.731 -21.471 1.00 0.00 O ATOM 1020 CB GLU A 64 24.379 -32.053 -18.817 1.00 0.00 C ATOM 1021 CG GLU A 64 23.420 -33.282 -18.762 1.00 0.00 C ATOM 1022 CD GLU A 64 24.089 -34.551 -18.235 1.00 0.00 C ATOM 1023 OE1 GLU A 64 24.902 -35.137 -18.946 1.00 0.00 O ATOM 1024 OE2 GLU A 64 23.770 -34.952 -17.116 1.00 0.00 O ATOM 0 H GLU A 64 22.245 -31.007 -17.832 1.00 0.00 H new ATOM 0 HA GLU A 64 24.522 -29.962 -19.282 1.00 0.00 H new ATOM 0 HB2 GLU A 64 25.209 -32.292 -19.482 1.00 0.00 H new ATOM 0 HB3 GLU A 64 24.800 -31.899 -17.824 1.00 0.00 H new ATOM 0 HG2 GLU A 64 22.567 -33.040 -18.128 1.00 0.00 H new ATOM 0 HG3 GLU A 64 23.030 -33.474 -19.762 1.00 0.00 H new ATOM 1031 N GLN A 65 23.004 -29.510 -21.290 1.00 0.00 N ATOM 1032 CA GLN A 65 22.683 -29.294 -22.704 1.00 0.00 C ATOM 1033 C GLN A 65 23.873 -28.745 -23.522 1.00 0.00 C ATOM 1034 O GLN A 65 24.194 -29.343 -24.548 1.00 0.00 O ATOM 1035 CB GLN A 65 21.445 -28.352 -22.819 1.00 0.00 C ATOM 1036 CG GLN A 65 20.115 -28.913 -22.227 1.00 0.00 C ATOM 1037 CD GLN A 65 19.610 -30.151 -22.976 1.00 0.00 C ATOM 1038 OE1 GLN A 65 19.352 -30.123 -24.173 1.00 0.00 O ATOM 1039 NE2 GLN A 65 19.435 -31.288 -22.333 1.00 0.00 N ATOM 0 H GLN A 65 22.995 -28.656 -20.732 1.00 0.00 H new ATOM 0 HA GLN A 65 22.449 -30.267 -23.137 1.00 0.00 H new ATOM 0 HB2 GLN A 65 21.678 -27.413 -22.317 1.00 0.00 H new ATOM 0 HB3 GLN A 65 21.284 -28.120 -23.872 1.00 0.00 H new ATOM 0 HG2 GLN A 65 20.267 -29.165 -21.178 1.00 0.00 H new ATOM 0 HG3 GLN A 65 19.351 -28.136 -22.261 1.00 0.00 H new ATOM 0 HE21 GLN A 65 19.640 -31.347 -21.336 1.00 0.00 H new ATOM 0 HE22 GLN A 65 19.094 -32.109 -22.833 1.00 0.00 H new ATOM 1048 N SER A 66 24.465 -27.733 -23.140 1.00 0.00 N TER 1049 SER A 66