USER MOD reduce.3.24.130724 H: found=0, std=0, add=523, rem=0, adj=15 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 13 TYR OH : rot -16:sc= 1.28 USER MOD Set 1.2: A 23 TYR OH : rot -30:sc= 0.878 USER MOD Set 2.1: A 12 LYS NZ :NH3+ -165:sc= 1.07 (180deg=0) USER MOD Set 2.2: A 15 TYR OH : rot -24:sc= 2.29 USER MOD Set 2.3: A 46 LYS NZ :NH3+ -153:sc= 1.37 (180deg=1.15) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= 1.28 (180deg=1.23) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 LYS NZ :NH3+ 176:sc= 1.16 (180deg=1.03) USER MOD Single : A 5 LYS NZ :NH3+ -133:sc= 2.58 (180deg=1.36) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -161:sc= 1.25 (180deg=0.975) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0.0366 X(o=0.037,f=0) USER MOD Single : A 33 THR OG1 : rot -96:sc= 1.24 USER MOD Single : A 42 LYS NZ :NH3+ -142:sc= 2.04 (180deg=0.298) USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 0.741 (180deg=0.639) USER MOD Single : A 52 LYS NZ :NH3+ 156:sc= 1.3 (180deg=1.18) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 1.67 K(o=1.7,f=-2.9!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 65 GLN : amide:sc= 0.932 K(o=0.93,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.700 -41.883 0.723 1.00 0.00 N ATOM 2 CA MET A 1 19.312 -42.073 2.037 1.00 0.00 C ATOM 3 C MET A 1 20.239 -43.308 2.103 1.00 0.00 C ATOM 4 O MET A 1 21.389 -43.178 2.524 1.00 0.00 O ATOM 5 CB MET A 1 18.195 -42.191 3.116 1.00 0.00 C ATOM 6 CG MET A 1 17.309 -40.934 3.318 1.00 0.00 C ATOM 7 SD MET A 1 18.200 -39.486 3.947 1.00 0.00 S ATOM 8 CE MET A 1 17.870 -39.623 5.722 1.00 0.00 C ATOM 0 H1 MET A 1 18.215 -40.963 0.695 1.00 0.00 H new ATOM 0 H2 MET A 1 19.437 -41.908 -0.010 1.00 0.00 H new ATOM 0 H3 MET A 1 18.011 -42.642 0.548 1.00 0.00 H new ATOM 0 HA MET A 1 19.939 -41.202 2.228 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.549 -43.028 2.851 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.663 -42.438 4.069 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.844 -40.675 2.367 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.503 -41.179 4.010 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.354 -38.800 6.247 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.795 -39.582 5.896 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.262 -40.570 6.093 1.00 0.00 H new ATOM 20 N LEU A 2 19.785 -44.497 1.668 1.00 0.00 N ATOM 21 CA LEU A 2 20.551 -45.737 1.810 1.00 0.00 C ATOM 22 C LEU A 2 20.493 -46.650 0.557 1.00 0.00 C ATOM 23 O LEU A 2 19.436 -47.045 0.042 1.00 0.00 O ATOM 24 CB LEU A 2 20.062 -46.475 3.090 1.00 0.00 C ATOM 25 CG LEU A 2 20.957 -47.637 3.598 1.00 0.00 C ATOM 26 CD1 LEU A 2 22.330 -47.160 4.112 1.00 0.00 C ATOM 27 CD2 LEU A 2 20.249 -48.384 4.736 1.00 0.00 C ATOM 0 H LEU A 2 18.881 -44.620 1.211 1.00 0.00 H new ATOM 0 HA LEU A 2 21.605 -45.477 1.909 1.00 0.00 H new ATOM 0 HB2 LEU A 2 19.965 -45.742 3.891 1.00 0.00 H new ATOM 0 HB3 LEU A 2 19.065 -46.870 2.897 1.00 0.00 H new ATOM 0 HG LEU A 2 21.126 -48.291 2.742 1.00 0.00 H new ATOM 0 HD11 LEU A 2 22.909 -48.018 4.453 1.00 0.00 H new ATOM 0 HD12 LEU A 2 22.866 -46.658 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.187 -46.466 4.940 1.00 0.00 H new ATOM 0 HD21 LEU A 2 20.883 -49.198 5.087 1.00 0.00 H new ATOM 0 HD22 LEU A 2 20.055 -47.695 5.558 1.00 0.00 H new ATOM 0 HD23 LEU A 2 19.305 -48.791 4.373 1.00 0.00 H new ATOM 39 N GLN A 3 21.711 -46.993 0.112 1.00 0.00 N ATOM 40 CA GLN A 3 21.981 -47.846 -1.050 1.00 0.00 C ATOM 41 C GLN A 3 21.370 -49.261 -0.936 1.00 0.00 C ATOM 42 O GLN A 3 20.699 -49.739 -1.854 1.00 0.00 O ATOM 43 CB GLN A 3 23.523 -47.882 -1.227 1.00 0.00 C ATOM 44 CG GLN A 3 24.000 -48.548 -2.544 1.00 0.00 C ATOM 45 CD GLN A 3 25.525 -48.526 -2.648 1.00 0.00 C ATOM 46 OE1 GLN A 3 26.224 -49.373 -2.108 1.00 0.00 O ATOM 47 NE2 GLN A 3 26.118 -47.568 -3.334 1.00 0.00 N ATOM 0 H GLN A 3 22.564 -46.671 0.569 1.00 0.00 H new ATOM 0 HA GLN A 3 21.496 -47.427 -1.932 1.00 0.00 H new ATOM 0 HB2 GLN A 3 23.905 -46.862 -1.191 1.00 0.00 H new ATOM 0 HB3 GLN A 3 23.961 -48.416 -0.384 1.00 0.00 H new ATOM 0 HG2 GLN A 3 23.644 -49.577 -2.585 1.00 0.00 H new ATOM 0 HG3 GLN A 3 23.566 -48.027 -3.397 1.00 0.00 H new ATOM 0 HE21 GLN A 3 25.559 -46.849 -3.794 1.00 0.00 H new ATOM 0 HE22 GLN A 3 27.135 -47.546 -3.404 1.00 0.00 H new ATOM 56 N LYS A 4 21.562 -49.892 0.232 1.00 0.00 N ATOM 57 CA LYS A 4 20.973 -51.186 0.586 1.00 0.00 C ATOM 58 C LYS A 4 19.432 -51.197 0.476 1.00 0.00 C ATOM 59 O LYS A 4 18.856 -52.189 0.025 1.00 0.00 O ATOM 60 CB LYS A 4 21.464 -51.527 2.019 1.00 0.00 C ATOM 61 CG LYS A 4 21.057 -52.921 2.544 1.00 0.00 C ATOM 62 CD LYS A 4 21.677 -53.184 3.932 1.00 0.00 C ATOM 63 CE LYS A 4 21.277 -54.531 4.546 1.00 0.00 C ATOM 64 NZ LYS A 4 19.912 -54.460 5.060 1.00 0.00 N ATOM 0 H LYS A 4 22.146 -49.504 0.973 1.00 0.00 H new ATOM 0 HA LYS A 4 21.297 -51.948 -0.122 1.00 0.00 H new ATOM 0 HB2 LYS A 4 22.551 -51.453 2.040 1.00 0.00 H new ATOM 0 HB3 LYS A 4 21.080 -50.772 2.706 1.00 0.00 H new ATOM 0 HG2 LYS A 4 19.971 -52.988 2.607 1.00 0.00 H new ATOM 0 HG3 LYS A 4 21.384 -53.689 1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 4 22.763 -53.142 3.848 1.00 0.00 H new ATOM 0 HD3 LYS A 4 21.379 -52.384 4.610 1.00 0.00 H new ATOM 0 HE2 LYS A 4 21.351 -55.318 3.796 1.00 0.00 H new ATOM 0 HE3 LYS A 4 21.964 -54.792 5.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 19.625 -55.395 5.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 19.869 -53.769 5.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 19.269 -54.165 4.298 1.00 0.00 H new ATOM 78 N LYS A 5 18.748 -50.103 0.846 1.00 0.00 N ATOM 79 CA LYS A 5 17.303 -49.972 0.662 1.00 0.00 C ATOM 80 C LYS A 5 16.843 -49.692 -0.783 1.00 0.00 C ATOM 81 O LYS A 5 15.757 -50.185 -1.107 1.00 0.00 O ATOM 82 CB LYS A 5 16.679 -49.023 1.712 1.00 0.00 C ATOM 83 CG LYS A 5 16.537 -49.743 3.094 1.00 0.00 C ATOM 84 CD LYS A 5 15.155 -49.652 3.803 1.00 0.00 C ATOM 85 CE LYS A 5 13.939 -50.098 2.973 1.00 0.00 C ATOM 86 NZ LYS A 5 13.927 -51.546 2.776 1.00 0.00 N ATOM 0 H LYS A 5 19.184 -49.289 1.280 1.00 0.00 H new ATOM 0 HA LYS A 5 16.899 -50.967 0.849 1.00 0.00 H new ATOM 0 HB2 LYS A 5 17.301 -48.135 1.822 1.00 0.00 H new ATOM 0 HB3 LYS A 5 15.700 -48.687 1.369 1.00 0.00 H new ATOM 0 HG2 LYS A 5 16.775 -50.797 2.952 1.00 0.00 H new ATOM 0 HG3 LYS A 5 17.290 -49.334 3.767 1.00 0.00 H new ATOM 0 HD2 LYS A 5 15.193 -50.257 4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.997 -48.620 4.116 1.00 0.00 H new ATOM 0 HE2 LYS A 5 13.022 -49.790 3.475 1.00 0.00 H new ATOM 0 HE3 LYS A 5 13.955 -49.598 2.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 13.740 -51.759 1.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 14.850 -51.941 3.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.182 -51.970 3.365 1.00 0.00 H new ATOM 100 N ILE A 6 17.574 -48.977 -1.675 1.00 0.00 N ATOM 101 CA ILE A 6 17.257 -49.015 -3.130 1.00 0.00 C ATOM 102 C ILE A 6 17.298 -50.475 -3.609 1.00 0.00 C ATOM 103 O ILE A 6 16.359 -50.930 -4.262 1.00 0.00 O ATOM 104 CB ILE A 6 18.206 -48.256 -4.134 1.00 0.00 C ATOM 105 CG1 ILE A 6 18.790 -46.935 -3.613 1.00 0.00 C ATOM 106 CG2 ILE A 6 17.434 -47.988 -5.488 1.00 0.00 C ATOM 107 CD1 ILE A 6 20.154 -46.658 -4.263 1.00 0.00 C ATOM 0 H ILE A 6 18.365 -48.383 -1.426 1.00 0.00 H new ATOM 0 HA ILE A 6 16.293 -48.508 -3.162 1.00 0.00 H new ATOM 0 HB ILE A 6 19.061 -48.916 -4.279 1.00 0.00 H new ATOM 0 HG12 ILE A 6 18.104 -46.116 -3.830 1.00 0.00 H new ATOM 0 HG13 ILE A 6 18.899 -46.981 -2.529 1.00 0.00 H new ATOM 0 HG21 ILE A 6 18.090 -47.463 -6.183 1.00 0.00 H new ATOM 0 HG22 ILE A 6 17.127 -48.938 -5.926 1.00 0.00 H new ATOM 0 HG23 ILE A 6 16.553 -47.378 -5.290 1.00 0.00 H new ATOM 0 HD11 ILE A 6 20.554 -45.718 -3.883 1.00 0.00 H new ATOM 0 HD12 ILE A 6 20.842 -47.469 -4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 6 20.035 -46.591 -5.344 1.00 0.00 H new ATOM 119 N GLU A 7 18.376 -51.194 -3.243 1.00 0.00 N ATOM 120 CA GLU A 7 18.506 -52.618 -3.531 1.00 0.00 C ATOM 121 C GLU A 7 17.391 -53.462 -2.901 1.00 0.00 C ATOM 122 O GLU A 7 16.751 -54.152 -3.676 1.00 0.00 O ATOM 123 CB GLU A 7 19.917 -53.169 -3.195 1.00 0.00 C ATOM 124 CG GLU A 7 20.963 -52.970 -4.342 1.00 0.00 C ATOM 125 CD GLU A 7 21.488 -51.540 -4.494 1.00 0.00 C ATOM 126 OE1 GLU A 7 20.858 -50.736 -5.180 1.00 0.00 O ATOM 127 OE2 GLU A 7 22.555 -51.265 -3.953 1.00 0.00 O ATOM 0 H GLU A 7 19.172 -50.799 -2.743 1.00 0.00 H new ATOM 0 HA GLU A 7 18.384 -52.711 -4.610 1.00 0.00 H new ATOM 0 HB2 GLU A 7 20.283 -52.678 -2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 7 19.837 -54.232 -2.969 1.00 0.00 H new ATOM 0 HG2 GLU A 7 21.808 -53.635 -4.163 1.00 0.00 H new ATOM 0 HG3 GLU A 7 20.510 -53.277 -5.285 1.00 0.00 H new ATOM 134 N GLU A 8 17.039 -53.464 -1.608 1.00 0.00 N ATOM 135 CA GLU A 8 15.926 -54.298 -1.110 1.00 0.00 C ATOM 136 C GLU A 8 14.541 -53.963 -1.713 1.00 0.00 C ATOM 137 O GLU A 8 13.619 -54.786 -1.630 1.00 0.00 O ATOM 138 CB GLU A 8 15.788 -54.145 0.416 1.00 0.00 C ATOM 139 CG GLU A 8 17.031 -54.531 1.268 1.00 0.00 C ATOM 140 CD GLU A 8 17.018 -53.905 2.672 1.00 0.00 C ATOM 141 OE1 GLU A 8 16.148 -53.084 2.986 1.00 0.00 O ATOM 142 OE2 GLU A 8 17.920 -54.227 3.446 1.00 0.00 O ATOM 0 H GLU A 8 17.501 -52.905 -0.891 1.00 0.00 H new ATOM 0 HA GLU A 8 16.192 -55.310 -1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 8 15.535 -53.107 0.633 1.00 0.00 H new ATOM 0 HB3 GLU A 8 14.946 -54.754 0.745 1.00 0.00 H new ATOM 0 HG2 GLU A 8 17.078 -55.616 1.361 1.00 0.00 H new ATOM 0 HG3 GLU A 8 17.934 -54.217 0.745 1.00 0.00 H new ATOM 149 N GLU A 9 14.339 -52.759 -2.271 1.00 0.00 N ATOM 150 CA GLU A 9 13.154 -52.489 -3.086 1.00 0.00 C ATOM 151 C GLU A 9 13.351 -52.934 -4.552 1.00 0.00 C ATOM 152 O GLU A 9 12.660 -53.845 -5.009 1.00 0.00 O ATOM 153 CB GLU A 9 12.700 -51.014 -2.920 1.00 0.00 C ATOM 154 CG GLU A 9 12.631 -50.522 -1.424 1.00 0.00 C ATOM 155 CD GLU A 9 11.931 -51.466 -0.440 1.00 0.00 C ATOM 156 OE1 GLU A 9 10.732 -51.720 -0.584 1.00 0.00 O ATOM 157 OE2 GLU A 9 12.590 -51.940 0.491 1.00 0.00 O ATOM 0 H GLU A 9 14.975 -51.968 -2.172 1.00 0.00 H new ATOM 0 HA GLU A 9 12.329 -53.100 -2.721 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.386 -50.371 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.717 -50.895 -3.375 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.648 -50.350 -1.071 1.00 0.00 H new ATOM 0 HG3 GLU A 9 12.119 -49.560 -1.402 1.00 0.00 H new ATOM 164 N ALA A 10 14.272 -52.318 -5.301 1.00 0.00 N ATOM 165 CA ALA A 10 14.595 -52.684 -6.691 1.00 0.00 C ATOM 166 C ALA A 10 15.456 -53.952 -6.960 1.00 0.00 C ATOM 167 O ALA A 10 15.826 -54.177 -8.113 1.00 0.00 O ATOM 168 CB ALA A 10 15.213 -51.422 -7.323 1.00 0.00 C ATOM 0 H ALA A 10 14.827 -51.535 -4.954 1.00 0.00 H new ATOM 0 HA ALA A 10 13.660 -53.005 -7.150 1.00 0.00 H new ATOM 0 HB1 ALA A 10 15.477 -51.627 -8.361 1.00 0.00 H new ATOM 0 HB2 ALA A 10 14.491 -50.606 -7.286 1.00 0.00 H new ATOM 0 HB3 ALA A 10 16.109 -51.139 -6.770 1.00 0.00 H new ATOM 174 N ALA A 11 15.880 -54.791 -6.008 1.00 0.00 N ATOM 175 CA ALA A 11 16.254 -56.191 -6.265 1.00 0.00 C ATOM 176 C ALA A 11 15.024 -57.110 -6.330 1.00 0.00 C ATOM 177 O ALA A 11 14.796 -57.850 -7.290 1.00 0.00 O ATOM 178 CB ALA A 11 17.236 -56.687 -5.167 1.00 0.00 C ATOM 0 H ALA A 11 15.975 -54.518 -5.030 1.00 0.00 H new ATOM 0 HA ALA A 11 16.744 -56.231 -7.238 1.00 0.00 H new ATOM 0 HB1 ALA A 11 17.508 -57.724 -5.364 1.00 0.00 H new ATOM 0 HB2 ALA A 11 18.133 -56.068 -5.175 1.00 0.00 H new ATOM 0 HB3 ALA A 11 16.756 -56.617 -4.191 1.00 0.00 H new ATOM 184 N LYS A 12 14.198 -57.004 -5.287 1.00 0.00 N ATOM 185 CA LYS A 12 13.043 -57.864 -5.068 1.00 0.00 C ATOM 186 C LYS A 12 11.811 -57.356 -5.845 1.00 0.00 C ATOM 187 O LYS A 12 10.808 -56.888 -5.302 1.00 0.00 O ATOM 188 CB LYS A 12 12.810 -57.960 -3.542 1.00 0.00 C ATOM 189 CG LYS A 12 13.941 -58.712 -2.789 1.00 0.00 C ATOM 190 CD LYS A 12 13.940 -58.395 -1.278 1.00 0.00 C ATOM 191 CE LYS A 12 12.776 -59.012 -0.492 1.00 0.00 C ATOM 192 NZ LYS A 12 12.388 -58.046 0.529 1.00 0.00 N ATOM 0 H LYS A 12 14.320 -56.301 -4.558 1.00 0.00 H new ATOM 0 HA LYS A 12 13.226 -58.866 -5.457 1.00 0.00 H new ATOM 0 HB2 LYS A 12 12.718 -56.954 -3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.863 -58.467 -3.358 1.00 0.00 H new ATOM 0 HG2 LYS A 12 13.822 -59.786 -2.934 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.906 -58.438 -3.216 1.00 0.00 H new ATOM 0 HD2 LYS A 12 14.878 -58.746 -0.847 1.00 0.00 H new ATOM 0 HD3 LYS A 12 13.915 -57.313 -1.148 1.00 0.00 H new ATOM 0 HE2 LYS A 12 11.938 -59.231 -1.153 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.077 -59.955 -0.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 11.786 -58.513 1.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.240 -57.669 0.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.861 -57.266 0.087 1.00 0.00 H new ATOM 206 N TYR A 13 11.923 -57.508 -7.171 1.00 0.00 N ATOM 207 CA TYR A 13 10.871 -57.220 -8.158 1.00 0.00 C ATOM 208 C TYR A 13 9.518 -57.961 -7.965 1.00 0.00 C ATOM 209 O TYR A 13 8.602 -57.775 -8.768 1.00 0.00 O ATOM 210 CB TYR A 13 11.461 -57.520 -9.575 1.00 0.00 C ATOM 211 CG TYR A 13 12.249 -56.363 -10.232 1.00 0.00 C ATOM 212 CD1 TYR A 13 13.005 -55.417 -9.546 1.00 0.00 C ATOM 213 CD2 TYR A 13 12.228 -56.244 -11.615 1.00 0.00 C ATOM 214 CE1 TYR A 13 13.687 -54.423 -10.221 1.00 0.00 C ATOM 215 CE2 TYR A 13 12.907 -55.244 -12.290 1.00 0.00 C ATOM 216 CZ TYR A 13 13.638 -54.324 -11.582 1.00 0.00 C ATOM 217 OH TYR A 13 14.272 -53.285 -12.194 1.00 0.00 O ATOM 0 H TYR A 13 12.782 -57.848 -7.604 1.00 0.00 H new ATOM 0 HA TYR A 13 10.602 -56.172 -8.024 1.00 0.00 H new ATOM 0 HB2 TYR A 13 12.119 -58.386 -9.499 1.00 0.00 H new ATOM 0 HB3 TYR A 13 10.642 -57.800 -10.238 1.00 0.00 H new ATOM 0 HD1 TYR A 13 13.059 -55.461 -8.468 1.00 0.00 H new ATOM 0 HD2 TYR A 13 11.659 -56.961 -12.188 1.00 0.00 H new ATOM 0 HE1 TYR A 13 14.272 -53.709 -9.660 1.00 0.00 H new ATOM 0 HE2 TYR A 13 12.861 -55.188 -13.368 1.00 0.00 H new ATOM 0 HH TYR A 13 14.478 -52.592 -11.532 1.00 0.00 H new ATOM 227 N LYS A 14 9.369 -58.805 -6.928 1.00 0.00 N ATOM 228 CA LYS A 14 8.097 -59.370 -6.464 1.00 0.00 C ATOM 229 C LYS A 14 7.083 -58.282 -6.059 1.00 0.00 C ATOM 230 O LYS A 14 5.946 -58.285 -6.538 1.00 0.00 O ATOM 231 CB LYS A 14 8.365 -60.303 -5.252 1.00 0.00 C ATOM 232 CG LYS A 14 9.219 -61.539 -5.608 1.00 0.00 C ATOM 233 CD LYS A 14 9.456 -62.427 -4.374 1.00 0.00 C ATOM 234 CE LYS A 14 10.300 -63.648 -4.729 1.00 0.00 C ATOM 235 NZ LYS A 14 10.466 -64.436 -3.517 1.00 0.00 N ATOM 0 H LYS A 14 10.163 -59.122 -6.372 1.00 0.00 H new ATOM 0 HA LYS A 14 7.662 -59.929 -7.293 1.00 0.00 H new ATOM 0 HB2 LYS A 14 8.869 -59.735 -4.470 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.412 -60.635 -4.841 1.00 0.00 H new ATOM 0 HG2 LYS A 14 8.719 -62.118 -6.385 1.00 0.00 H new ATOM 0 HG3 LYS A 14 10.177 -61.217 -6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 14 9.956 -61.849 -3.597 1.00 0.00 H new ATOM 0 HD3 LYS A 14 8.498 -62.749 -3.965 1.00 0.00 H new ATOM 0 HE2 LYS A 14 9.813 -64.238 -5.505 1.00 0.00 H new ATOM 0 HE3 LYS A 14 11.269 -63.342 -5.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 11.039 -65.278 -3.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 10.945 -63.863 -2.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.533 -64.731 -3.164 1.00 0.00 H new ATOM 249 N TYR A 15 7.466 -57.325 -5.200 1.00 0.00 N ATOM 250 CA TYR A 15 6.640 -56.145 -4.926 1.00 0.00 C ATOM 251 C TYR A 15 6.927 -55.001 -5.928 1.00 0.00 C ATOM 252 O TYR A 15 7.472 -53.923 -5.650 1.00 0.00 O ATOM 253 CB TYR A 15 6.633 -55.738 -3.425 1.00 0.00 C ATOM 254 CG TYR A 15 7.993 -55.840 -2.715 1.00 0.00 C ATOM 255 CD1 TYR A 15 9.103 -55.133 -3.137 1.00 0.00 C ATOM 256 CD2 TYR A 15 8.129 -56.607 -1.572 1.00 0.00 C ATOM 257 CE1 TYR A 15 10.293 -55.178 -2.441 1.00 0.00 C ATOM 258 CE2 TYR A 15 9.313 -56.649 -0.864 1.00 0.00 C ATOM 259 CZ TYR A 15 10.396 -55.928 -1.296 1.00 0.00 C ATOM 260 OH TYR A 15 11.545 -55.942 -0.560 1.00 0.00 O ATOM 0 H TYR A 15 8.345 -57.348 -4.683 1.00 0.00 H new ATOM 0 HA TYR A 15 5.601 -56.419 -5.109 1.00 0.00 H new ATOM 0 HB2 TYR A 15 6.275 -54.712 -3.345 1.00 0.00 H new ATOM 0 HB3 TYR A 15 5.917 -56.368 -2.897 1.00 0.00 H new ATOM 0 HD1 TYR A 15 9.037 -54.532 -4.032 1.00 0.00 H new ATOM 0 HD2 TYR A 15 7.287 -57.188 -1.225 1.00 0.00 H new ATOM 0 HE1 TYR A 15 11.147 -54.621 -2.798 1.00 0.00 H new ATOM 0 HE2 TYR A 15 9.386 -57.250 0.030 1.00 0.00 H new ATOM 0 HH TYR A 15 12.304 -55.707 -1.134 1.00 0.00 H new ATOM 270 N ALA A 16 6.473 -55.340 -7.141 1.00 0.00 N ATOM 271 CA ALA A 16 6.600 -54.542 -8.357 1.00 0.00 C ATOM 272 C ALA A 16 6.015 -53.121 -8.267 1.00 0.00 C ATOM 273 O ALA A 16 6.565 -52.194 -8.860 1.00 0.00 O ATOM 274 CB ALA A 16 5.939 -55.339 -9.500 1.00 0.00 C ATOM 0 H ALA A 16 5.985 -56.221 -7.304 1.00 0.00 H new ATOM 0 HA ALA A 16 7.662 -54.376 -8.535 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.014 -54.773 -10.429 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.446 -56.297 -9.617 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.889 -55.511 -9.264 1.00 0.00 H new ATOM 280 N MET A 17 4.922 -52.953 -7.513 1.00 0.00 N ATOM 281 CA MET A 17 4.318 -51.657 -7.200 1.00 0.00 C ATOM 282 C MET A 17 5.249 -50.737 -6.376 1.00 0.00 C ATOM 283 O MET A 17 5.339 -49.539 -6.651 1.00 0.00 O ATOM 284 CB MET A 17 2.986 -51.962 -6.463 1.00 0.00 C ATOM 285 CG MET A 17 2.134 -50.723 -6.108 1.00 0.00 C ATOM 286 SD MET A 17 0.525 -51.174 -5.405 1.00 0.00 S ATOM 287 CE MET A 17 0.961 -51.506 -3.679 1.00 0.00 C ATOM 0 H MET A 17 4.422 -53.737 -7.094 1.00 0.00 H new ATOM 0 HA MET A 17 4.137 -51.095 -8.116 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.389 -52.628 -7.086 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.213 -52.503 -5.544 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.678 -50.102 -5.396 1.00 0.00 H new ATOM 0 HG3 MET A 17 1.981 -50.121 -7.004 1.00 0.00 H new ATOM 0 HE1 MET A 17 0.067 -51.795 -3.127 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.690 -52.315 -3.637 1.00 0.00 H new ATOM 0 HE3 MET A 17 1.389 -50.608 -3.233 1.00 0.00 H new ATOM 297 N LEU A 18 5.990 -51.292 -5.407 1.00 0.00 N ATOM 298 CA LEU A 18 6.876 -50.522 -4.529 1.00 0.00 C ATOM 299 C LEU A 18 8.233 -50.223 -5.188 1.00 0.00 C ATOM 300 O LEU A 18 8.786 -49.128 -5.039 1.00 0.00 O ATOM 301 CB LEU A 18 7.036 -51.260 -3.175 1.00 0.00 C ATOM 302 CG LEU A 18 5.691 -51.544 -2.454 1.00 0.00 C ATOM 303 CD1 LEU A 18 5.942 -52.331 -1.167 1.00 0.00 C ATOM 304 CD2 LEU A 18 4.925 -50.255 -2.117 1.00 0.00 C ATOM 0 H LEU A 18 5.990 -52.293 -5.211 1.00 0.00 H new ATOM 0 HA LEU A 18 6.417 -49.551 -4.344 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.553 -52.204 -3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.670 -50.663 -2.519 1.00 0.00 H new ATOM 0 HG LEU A 18 5.078 -52.128 -3.141 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.992 -52.525 -0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.426 -53.278 -1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.587 -51.752 -0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.992 -50.507 -1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 18 5.533 -49.631 -1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.706 -49.711 -3.036 1.00 0.00 H new ATOM 316 N LYS A 19 8.780 -51.184 -5.939 1.00 0.00 N ATOM 317 CA LYS A 19 9.857 -50.879 -6.880 1.00 0.00 C ATOM 318 C LYS A 19 9.420 -49.905 -8.007 1.00 0.00 C ATOM 319 O LYS A 19 10.245 -49.102 -8.448 1.00 0.00 O ATOM 320 CB LYS A 19 10.457 -52.235 -7.382 1.00 0.00 C ATOM 321 CG LYS A 19 10.896 -52.337 -8.869 1.00 0.00 C ATOM 322 CD LYS A 19 9.769 -52.900 -9.763 1.00 0.00 C ATOM 323 CE LYS A 19 10.004 -52.699 -11.250 1.00 0.00 C ATOM 324 NZ LYS A 19 8.861 -53.275 -11.940 1.00 0.00 N ATOM 0 H LYS A 19 8.499 -52.164 -5.914 1.00 0.00 H new ATOM 0 HA LYS A 19 10.648 -50.322 -6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 19 11.324 -52.466 -6.762 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.718 -53.015 -7.199 1.00 0.00 H new ATOM 0 HG2 LYS A 19 11.188 -51.351 -9.230 1.00 0.00 H new ATOM 0 HG3 LYS A 19 11.775 -52.977 -8.945 1.00 0.00 H new ATOM 0 HD2 LYS A 19 9.659 -53.966 -9.563 1.00 0.00 H new ATOM 0 HD3 LYS A 19 8.828 -52.425 -9.486 1.00 0.00 H new ATOM 0 HE2 LYS A 19 10.103 -51.639 -11.485 1.00 0.00 H new ATOM 0 HE3 LYS A 19 10.929 -53.183 -11.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 8.981 -53.159 -12.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 8.792 -54.287 -11.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 7.992 -52.791 -11.636 1.00 0.00 H new ATOM 338 N LYS A 20 8.172 -49.920 -8.514 1.00 0.00 N ATOM 339 CA LYS A 20 7.664 -48.830 -9.357 1.00 0.00 C ATOM 340 C LYS A 20 7.641 -47.492 -8.585 1.00 0.00 C ATOM 341 O LYS A 20 7.983 -46.487 -9.203 1.00 0.00 O ATOM 342 CB LYS A 20 6.244 -49.159 -9.890 1.00 0.00 C ATOM 343 CG LYS A 20 5.652 -48.077 -10.827 1.00 0.00 C ATOM 344 CD LYS A 20 4.134 -48.239 -11.019 1.00 0.00 C ATOM 345 CE LYS A 20 3.489 -46.976 -11.602 1.00 0.00 C ATOM 346 NZ LYS A 20 3.417 -45.944 -10.568 1.00 0.00 N ATOM 0 H LYS A 20 7.503 -50.673 -8.353 1.00 0.00 H new ATOM 0 HA LYS A 20 8.342 -48.728 -10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.280 -50.108 -10.426 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.573 -49.297 -9.042 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.861 -47.089 -10.416 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.146 -48.129 -11.797 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.941 -49.083 -11.681 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.671 -48.473 -10.061 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.071 -46.616 -12.450 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.490 -47.203 -11.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 2.715 -45.227 -10.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.137 -46.377 -9.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.348 -45.493 -10.462 1.00 0.00 H new ATOM 360 N CYS A 21 7.267 -47.410 -7.289 1.00 0.00 N ATOM 361 CA CYS A 21 7.471 -46.199 -6.472 1.00 0.00 C ATOM 362 C CYS A 21 8.929 -45.683 -6.469 1.00 0.00 C ATOM 363 O CYS A 21 9.142 -44.472 -6.601 1.00 0.00 O ATOM 364 CB CYS A 21 7.017 -46.448 -5.026 1.00 0.00 C ATOM 365 SG CYS A 21 5.230 -46.623 -4.786 1.00 0.00 S ATOM 0 H CYS A 21 6.819 -48.176 -6.786 1.00 0.00 H new ATOM 0 HA CYS A 21 6.863 -45.423 -6.937 1.00 0.00 H new ATOM 0 HB2 CYS A 21 7.505 -47.352 -4.662 1.00 0.00 H new ATOM 0 HB3 CYS A 21 7.370 -45.624 -4.406 1.00 0.00 H new ATOM 370 N CYS A 22 9.918 -46.594 -6.354 1.00 0.00 N ATOM 371 CA CYS A 22 11.330 -46.307 -6.680 1.00 0.00 C ATOM 372 C CYS A 22 11.459 -45.632 -8.038 1.00 0.00 C ATOM 373 O CYS A 22 11.951 -44.510 -8.146 1.00 0.00 O ATOM 374 CB CYS A 22 12.216 -47.569 -6.519 1.00 0.00 C ATOM 375 SG CYS A 22 13.900 -47.242 -5.920 1.00 0.00 S ATOM 0 H CYS A 22 9.760 -47.549 -6.033 1.00 0.00 H new ATOM 0 HA CYS A 22 11.712 -45.587 -5.956 1.00 0.00 H new ATOM 0 HB2 CYS A 22 11.726 -48.255 -5.828 1.00 0.00 H new ATOM 0 HB3 CYS A 22 12.279 -48.077 -7.481 1.00 0.00 H new ATOM 380 N TYR A 23 10.953 -46.267 -9.072 1.00 0.00 N ATOM 381 CA TYR A 23 11.153 -45.762 -10.415 1.00 0.00 C ATOM 382 C TYR A 23 10.301 -44.514 -10.773 1.00 0.00 C ATOM 383 O TYR A 23 10.682 -43.760 -11.669 1.00 0.00 O ATOM 384 CB TYR A 23 11.076 -46.981 -11.307 1.00 0.00 C ATOM 385 CG TYR A 23 12.084 -48.098 -10.903 1.00 0.00 C ATOM 386 CD1 TYR A 23 13.157 -48.032 -9.973 1.00 0.00 C ATOM 387 CD2 TYR A 23 11.972 -49.248 -11.658 1.00 0.00 C ATOM 388 CE1 TYR A 23 14.072 -49.072 -9.919 1.00 0.00 C ATOM 389 CE2 TYR A 23 12.885 -50.276 -11.585 1.00 0.00 C ATOM 390 CZ TYR A 23 13.942 -50.182 -10.722 1.00 0.00 C ATOM 391 OH TYR A 23 14.856 -51.189 -10.658 1.00 0.00 O ATOM 0 H TYR A 23 10.405 -47.125 -9.012 1.00 0.00 H new ATOM 0 HA TYR A 23 12.129 -45.298 -10.556 1.00 0.00 H new ATOM 0 HB2 TYR A 23 10.064 -47.384 -11.275 1.00 0.00 H new ATOM 0 HB3 TYR A 23 11.267 -46.682 -12.338 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.258 -47.181 -9.316 1.00 0.00 H new ATOM 0 HD2 TYR A 23 11.135 -49.345 -12.333 1.00 0.00 H new ATOM 0 HE1 TYR A 23 14.904 -49.010 -9.233 1.00 0.00 H new ATOM 0 HE2 TYR A 23 12.767 -51.152 -12.206 1.00 0.00 H new ATOM 0 HH TYR A 23 15.730 -50.822 -10.408 1.00 0.00 H new ATOM 401 N ASP A 24 9.185 -44.249 -10.068 1.00 0.00 N ATOM 402 CA ASP A 24 8.540 -42.928 -9.994 1.00 0.00 C ATOM 403 C ASP A 24 9.453 -41.846 -9.384 1.00 0.00 C ATOM 404 O ASP A 24 9.449 -40.701 -9.846 1.00 0.00 O ATOM 405 CB ASP A 24 7.190 -43.001 -9.212 1.00 0.00 C ATOM 406 CG ASP A 24 6.111 -43.756 -9.995 1.00 0.00 C ATOM 407 OD1 ASP A 24 5.803 -43.362 -11.115 1.00 0.00 O ATOM 408 OD2 ASP A 24 5.535 -44.715 -9.476 1.00 0.00 O ATOM 0 H ASP A 24 8.699 -44.962 -9.524 1.00 0.00 H new ATOM 0 HA ASP A 24 8.338 -42.633 -11.024 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.353 -43.493 -8.253 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.841 -41.991 -8.996 1.00 0.00 H new ATOM 413 N GLY A 25 10.214 -42.203 -8.336 1.00 0.00 N ATOM 414 CA GLY A 25 11.332 -41.387 -7.841 1.00 0.00 C ATOM 415 C GLY A 25 12.426 -41.131 -8.884 1.00 0.00 C ATOM 416 O GLY A 25 12.737 -39.971 -9.156 1.00 0.00 O ATOM 0 H GLY A 25 10.071 -43.065 -7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 25 10.944 -40.429 -7.494 1.00 0.00 H new ATOM 0 HA3 GLY A 25 11.776 -41.883 -6.978 1.00 0.00 H new ATOM 420 N ALA A 26 12.969 -42.207 -9.474 1.00 0.00 N ATOM 421 CA ALA A 26 14.035 -42.143 -10.482 1.00 0.00 C ATOM 422 C ALA A 26 13.678 -41.355 -11.760 1.00 0.00 C ATOM 423 O ALA A 26 14.482 -40.523 -12.192 1.00 0.00 O ATOM 424 CB ALA A 26 14.493 -43.568 -10.849 1.00 0.00 C ATOM 0 H ALA A 26 12.674 -43.160 -9.260 1.00 0.00 H new ATOM 0 HA ALA A 26 14.845 -41.582 -10.016 1.00 0.00 H new ATOM 0 HB1 ALA A 26 15.284 -43.515 -11.597 1.00 0.00 H new ATOM 0 HB2 ALA A 26 14.870 -44.070 -9.958 1.00 0.00 H new ATOM 0 HB3 ALA A 26 13.650 -44.129 -11.252 1.00 0.00 H new ATOM 430 N TYR A 27 12.504 -41.559 -12.381 1.00 0.00 N ATOM 431 CA TYR A 27 12.085 -40.785 -13.559 1.00 0.00 C ATOM 432 C TYR A 27 11.600 -39.355 -13.211 1.00 0.00 C ATOM 433 O TYR A 27 10.452 -38.957 -13.439 1.00 0.00 O ATOM 434 CB TYR A 27 11.029 -41.585 -14.375 1.00 0.00 C ATOM 435 CG TYR A 27 11.670 -42.776 -15.104 1.00 0.00 C ATOM 436 CD1 TYR A 27 12.275 -42.626 -16.341 1.00 0.00 C ATOM 437 CD2 TYR A 27 11.663 -44.044 -14.551 1.00 0.00 C ATOM 438 CE1 TYR A 27 12.851 -43.697 -16.999 1.00 0.00 C ATOM 439 CE2 TYR A 27 12.235 -45.120 -15.200 1.00 0.00 C ATOM 440 CZ TYR A 27 12.828 -44.945 -16.423 1.00 0.00 C ATOM 441 OH TYR A 27 13.387 -46.010 -17.050 1.00 0.00 O ATOM 0 H TYR A 27 11.825 -42.259 -12.083 1.00 0.00 H new ATOM 0 HA TYR A 27 12.966 -40.638 -14.184 1.00 0.00 H new ATOM 0 HB2 TYR A 27 10.246 -41.944 -13.707 1.00 0.00 H new ATOM 0 HB3 TYR A 27 10.552 -40.926 -15.100 1.00 0.00 H new ATOM 0 HD1 TYR A 27 12.297 -41.650 -16.802 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.199 -44.196 -13.588 1.00 0.00 H new ATOM 0 HE1 TYR A 27 13.318 -43.554 -17.962 1.00 0.00 H new ATOM 0 HE2 TYR A 27 12.215 -46.099 -14.744 1.00 0.00 H new ATOM 0 HH TYR A 27 13.278 -46.811 -16.495 1.00 0.00 H new ATOM 451 N ARG A 28 12.526 -38.548 -12.673 1.00 0.00 N ATOM 452 CA ARG A 28 12.260 -37.160 -12.293 1.00 0.00 C ATOM 453 C ARG A 28 12.226 -36.209 -13.514 1.00 0.00 C ATOM 454 O ARG A 28 13.181 -35.507 -13.869 1.00 0.00 O ATOM 455 CB ARG A 28 13.300 -36.753 -11.229 1.00 0.00 C ATOM 456 CG ARG A 28 12.998 -35.407 -10.533 1.00 0.00 C ATOM 457 CD ARG A 28 14.076 -35.121 -9.499 1.00 0.00 C ATOM 458 NE ARG A 28 13.797 -33.838 -8.861 1.00 0.00 N ATOM 459 CZ ARG A 28 14.612 -33.206 -8.068 1.00 0.00 C ATOM 460 NH1 ARG A 28 15.756 -33.655 -7.712 1.00 0.00 N ATOM 461 NH2 ARG A 28 14.225 -32.086 -7.613 1.00 0.00 N ATOM 0 H ARG A 28 13.484 -38.845 -12.490 1.00 0.00 H new ATOM 0 HA ARG A 28 11.262 -37.076 -11.864 1.00 0.00 H new ATOM 0 HB2 ARG A 28 13.356 -37.536 -10.473 1.00 0.00 H new ATOM 0 HB3 ARG A 28 14.281 -36.694 -11.700 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.962 -34.604 -11.269 1.00 0.00 H new ATOM 0 HG3 ARG A 28 12.020 -35.444 -10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 28 14.101 -35.915 -8.752 1.00 0.00 H new ATOM 0 HD3 ARG A 28 15.057 -35.099 -9.974 1.00 0.00 H new ATOM 0 HE ARG A 28 12.894 -33.404 -9.052 1.00 0.00 H new ATOM 0 HH11 ARG A 28 16.077 -34.561 -8.054 1.00 0.00 H new ATOM 0 HH12 ARG A 28 16.347 -33.107 -7.086 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.310 -31.719 -7.873 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.829 -31.553 -6.987 1.00 0.00 H new ATOM 475 N ASN A 29 11.084 -36.268 -14.205 1.00 0.00 N ATOM 476 CA ASN A 29 10.732 -35.314 -15.259 1.00 0.00 C ATOM 477 C ASN A 29 9.975 -34.086 -14.703 1.00 0.00 C ATOM 478 O ASN A 29 9.975 -33.021 -15.323 1.00 0.00 O ATOM 479 CB ASN A 29 9.875 -36.077 -16.311 1.00 0.00 C ATOM 480 CG ASN A 29 9.825 -35.365 -17.665 1.00 0.00 C ATOM 481 OD1 ASN A 29 10.299 -35.893 -18.661 1.00 0.00 O ATOM 482 ND2 ASN A 29 9.263 -34.178 -17.800 1.00 0.00 N ATOM 0 H ASN A 29 10.374 -36.983 -14.047 1.00 0.00 H new ATOM 0 HA ASN A 29 11.639 -34.920 -15.717 1.00 0.00 H new ATOM 0 HB2 ASN A 29 10.283 -37.079 -16.447 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.861 -36.195 -15.930 1.00 0.00 H new ATOM 0 HD21 ASN A 29 9.234 -33.729 -18.715 1.00 0.00 H new ATOM 0 HD22 ASN A 29 8.858 -33.710 -16.989 1.00 0.00 H new ATOM 489 N ASP A 30 9.362 -34.209 -13.517 1.00 0.00 N ATOM 490 CA ASP A 30 8.425 -33.233 -12.943 1.00 0.00 C ATOM 491 C ASP A 30 9.018 -31.876 -12.483 1.00 0.00 C ATOM 492 O ASP A 30 8.311 -31.129 -11.804 1.00 0.00 O ATOM 493 CB ASP A 30 7.711 -33.904 -11.729 1.00 0.00 C ATOM 494 CG ASP A 30 7.106 -35.269 -12.044 1.00 0.00 C ATOM 495 OD1 ASP A 30 6.202 -35.351 -12.870 1.00 0.00 O ATOM 496 OD2 ASP A 30 7.566 -36.240 -11.441 1.00 0.00 O ATOM 0 H ASP A 30 9.510 -35.017 -12.912 1.00 0.00 H new ATOM 0 HA ASP A 30 7.753 -32.971 -13.760 1.00 0.00 H new ATOM 0 HB2 ASP A 30 8.427 -34.014 -10.915 1.00 0.00 H new ATOM 0 HB3 ASP A 30 6.922 -33.242 -11.373 1.00 0.00 H new ATOM 501 N ASP A 31 10.269 -31.508 -12.818 1.00 0.00 N ATOM 502 CA ASP A 31 11.045 -30.335 -12.349 1.00 0.00 C ATOM 503 C ASP A 31 11.107 -30.008 -10.830 1.00 0.00 C ATOM 504 O ASP A 31 12.134 -29.515 -10.364 1.00 0.00 O ATOM 505 CB ASP A 31 10.783 -29.059 -13.222 1.00 0.00 C ATOM 506 CG ASP A 31 9.352 -28.524 -13.180 1.00 0.00 C ATOM 507 OD1 ASP A 31 8.997 -27.858 -12.209 1.00 0.00 O ATOM 508 OD2 ASP A 31 8.624 -28.750 -14.143 1.00 0.00 O ATOM 0 H ASP A 31 10.811 -32.066 -13.477 1.00 0.00 H new ATOM 0 HA ASP A 31 12.060 -30.698 -12.511 1.00 0.00 H new ATOM 0 HB2 ASP A 31 11.459 -28.269 -12.894 1.00 0.00 H new ATOM 0 HB3 ASP A 31 11.038 -29.288 -14.257 1.00 0.00 H new ATOM 513 N GLU A 32 10.035 -30.240 -10.064 1.00 0.00 N ATOM 514 CA GLU A 32 9.916 -30.001 -8.619 1.00 0.00 C ATOM 515 C GLU A 32 10.844 -30.847 -7.704 1.00 0.00 C ATOM 516 O GLU A 32 11.646 -31.677 -8.151 1.00 0.00 O ATOM 517 CB GLU A 32 8.429 -30.272 -8.247 1.00 0.00 C ATOM 518 CG GLU A 32 7.406 -29.370 -9.009 1.00 0.00 C ATOM 519 CD GLU A 32 5.969 -29.690 -8.599 1.00 0.00 C ATOM 520 OE1 GLU A 32 5.476 -29.097 -7.641 1.00 0.00 O ATOM 521 OE2 GLU A 32 5.339 -30.562 -9.197 1.00 0.00 O ATOM 0 H GLU A 32 9.176 -30.622 -10.459 1.00 0.00 H new ATOM 0 HA GLU A 32 10.238 -28.976 -8.438 1.00 0.00 H new ATOM 0 HB2 GLU A 32 8.199 -31.317 -8.453 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.301 -30.122 -7.175 1.00 0.00 H new ATOM 0 HG2 GLU A 32 7.620 -28.321 -8.804 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.520 -29.514 -10.083 1.00 0.00 H new ATOM 528 N THR A 33 10.756 -30.621 -6.382 1.00 0.00 N ATOM 529 CA THR A 33 11.502 -31.399 -5.380 1.00 0.00 C ATOM 530 C THR A 33 10.755 -32.659 -4.891 1.00 0.00 C ATOM 531 O THR A 33 9.520 -32.731 -4.888 1.00 0.00 O ATOM 532 CB THR A 33 11.989 -30.508 -4.206 1.00 0.00 C ATOM 533 OG1 THR A 33 12.892 -31.257 -3.407 1.00 0.00 O ATOM 534 CG2 THR A 33 10.903 -29.968 -3.273 1.00 0.00 C ATOM 0 H THR A 33 10.165 -29.894 -5.979 1.00 0.00 H new ATOM 0 HA THR A 33 12.388 -31.774 -5.893 1.00 0.00 H new ATOM 0 HB THR A 33 12.438 -29.640 -4.689 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.411 -31.645 -2.646 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.362 -29.361 -2.493 1.00 0.00 H new ATOM 0 HG22 THR A 33 10.204 -29.357 -3.844 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.368 -30.801 -2.816 1.00 0.00 H new ATOM 542 N CYS A 34 11.552 -33.627 -4.412 1.00 0.00 N ATOM 543 CA CYS A 34 11.146 -35.010 -4.132 1.00 0.00 C ATOM 544 C CYS A 34 9.981 -35.156 -3.139 1.00 0.00 C ATOM 545 O CYS A 34 8.964 -35.786 -3.430 1.00 0.00 O ATOM 546 CB CYS A 34 12.367 -35.786 -3.562 1.00 0.00 C ATOM 547 SG CYS A 34 13.787 -35.944 -4.674 1.00 0.00 S ATOM 0 H CYS A 34 12.536 -33.459 -4.201 1.00 0.00 H new ATOM 0 HA CYS A 34 10.794 -35.412 -5.082 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.697 -35.288 -2.650 1.00 0.00 H new ATOM 0 HB3 CYS A 34 12.038 -36.786 -3.278 1.00 0.00 H new ATOM 552 N GLU A 35 10.136 -34.526 -1.972 1.00 0.00 N ATOM 553 CA GLU A 35 9.205 -34.657 -0.850 1.00 0.00 C ATOM 554 C GLU A 35 7.867 -33.924 -1.040 1.00 0.00 C ATOM 555 O GLU A 35 6.908 -34.308 -0.376 1.00 0.00 O ATOM 556 CB GLU A 35 9.862 -34.310 0.527 1.00 0.00 C ATOM 557 CG GLU A 35 10.655 -32.964 0.661 1.00 0.00 C ATOM 558 CD GLU A 35 12.004 -32.999 -0.062 1.00 0.00 C ATOM 559 OE1 GLU A 35 12.960 -33.568 0.472 1.00 0.00 O ATOM 560 OE2 GLU A 35 12.061 -32.523 -1.198 1.00 0.00 O ATOM 0 H GLU A 35 10.921 -33.904 -1.778 1.00 0.00 H new ATOM 0 HA GLU A 35 8.955 -35.718 -0.837 1.00 0.00 H new ATOM 0 HB2 GLU A 35 9.073 -34.306 1.279 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.542 -35.122 0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.052 -32.150 0.258 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.819 -32.747 1.717 1.00 0.00 H new ATOM 567 N GLU A 36 7.737 -32.909 -1.910 1.00 0.00 N ATOM 568 CA GLU A 36 6.431 -32.308 -2.202 1.00 0.00 C ATOM 569 C GLU A 36 5.647 -33.176 -3.208 1.00 0.00 C ATOM 570 O GLU A 36 4.479 -33.502 -2.960 1.00 0.00 O ATOM 571 CB GLU A 36 6.573 -30.835 -2.684 1.00 0.00 C ATOM 572 CG GLU A 36 5.521 -29.857 -2.045 1.00 0.00 C ATOM 573 CD GLU A 36 4.052 -30.186 -2.343 1.00 0.00 C ATOM 574 OE1 GLU A 36 3.637 -30.074 -3.499 1.00 0.00 O ATOM 575 OE2 GLU A 36 3.336 -30.529 -1.408 1.00 0.00 O ATOM 0 H GLU A 36 8.516 -32.492 -2.419 1.00 0.00 H new ATOM 0 HA GLU A 36 5.857 -32.277 -1.276 1.00 0.00 H new ATOM 0 HB2 GLU A 36 7.576 -30.480 -2.448 1.00 0.00 H new ATOM 0 HB3 GLU A 36 6.471 -30.806 -3.769 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.663 -29.853 -0.964 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.728 -28.847 -2.397 1.00 0.00 H new ATOM 582 N ARG A 37 6.288 -33.600 -4.314 1.00 0.00 N ATOM 583 CA ARG A 37 5.660 -34.546 -5.237 1.00 0.00 C ATOM 584 C ARG A 37 5.384 -35.906 -4.565 1.00 0.00 C ATOM 585 O ARG A 37 4.334 -36.490 -4.827 1.00 0.00 O ATOM 586 CB ARG A 37 6.386 -34.670 -6.609 1.00 0.00 C ATOM 587 CG ARG A 37 7.795 -35.309 -6.628 1.00 0.00 C ATOM 588 CD ARG A 37 8.284 -35.520 -8.068 1.00 0.00 C ATOM 589 NE ARG A 37 9.563 -36.228 -8.031 1.00 0.00 N ATOM 590 CZ ARG A 37 9.892 -37.258 -8.766 1.00 0.00 C ATOM 591 NH1 ARG A 37 9.252 -37.698 -9.787 1.00 0.00 N ATOM 592 NH2 ARG A 37 10.973 -37.857 -8.459 1.00 0.00 N ATOM 0 H ARG A 37 7.227 -33.304 -4.582 1.00 0.00 H new ATOM 0 HA ARG A 37 4.689 -34.119 -5.488 1.00 0.00 H new ATOM 0 HB2 ARG A 37 5.747 -35.250 -7.274 1.00 0.00 H new ATOM 0 HB3 ARG A 37 6.466 -33.670 -7.036 1.00 0.00 H new ATOM 0 HG2 ARG A 37 8.496 -34.669 -6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 37 7.772 -36.265 -6.104 1.00 0.00 H new ATOM 0 HD2 ARG A 37 7.551 -36.094 -8.635 1.00 0.00 H new ATOM 0 HD3 ARG A 37 8.398 -34.561 -8.573 1.00 0.00 H new ATOM 0 HE ARG A 37 10.262 -35.887 -7.371 1.00 0.00 H new ATOM 0 HH11 ARG A 37 8.398 -37.232 -10.093 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.597 -38.514 -10.293 1.00 0.00 H new ATOM 0 HH21 ARG A 37 11.534 -37.527 -7.673 1.00 0.00 H new ATOM 0 HH22 ARG A 37 11.278 -38.667 -8.999 1.00 0.00 H new ATOM 606 N ALA A 38 6.245 -36.430 -3.679 1.00 0.00 N ATOM 607 CA ALA A 38 5.909 -37.605 -2.873 1.00 0.00 C ATOM 608 C ALA A 38 5.147 -37.349 -1.549 1.00 0.00 C ATOM 609 O ALA A 38 4.799 -38.306 -0.857 1.00 0.00 O ATOM 610 CB ALA A 38 7.145 -38.485 -2.757 1.00 0.00 C ATOM 0 H ALA A 38 7.178 -36.056 -3.505 1.00 0.00 H new ATOM 0 HA ALA A 38 5.135 -38.154 -3.409 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.910 -39.365 -2.159 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.464 -38.797 -3.751 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.947 -37.924 -2.278 1.00 0.00 H new ATOM 616 N ALA A 39 4.871 -36.102 -1.131 1.00 0.00 N ATOM 617 CA ALA A 39 3.687 -35.798 -0.315 1.00 0.00 C ATOM 618 C ALA A 39 2.372 -35.976 -1.102 1.00 0.00 C ATOM 619 O ALA A 39 1.316 -36.194 -0.499 1.00 0.00 O ATOM 620 CB ALA A 39 3.775 -34.370 0.257 1.00 0.00 C ATOM 0 H ALA A 39 5.451 -35.291 -1.345 1.00 0.00 H new ATOM 0 HA ALA A 39 3.675 -36.514 0.507 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.889 -34.164 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 39 4.665 -34.282 0.880 1.00 0.00 H new ATOM 0 HB3 ALA A 39 3.833 -33.653 -0.562 1.00 0.00 H new ATOM 626 N ARG A 40 2.396 -35.851 -2.439 1.00 0.00 N ATOM 627 CA ARG A 40 1.294 -36.318 -3.295 1.00 0.00 C ATOM 628 C ARG A 40 1.252 -37.866 -3.417 1.00 0.00 C ATOM 629 O ARG A 40 0.213 -38.434 -3.076 1.00 0.00 O ATOM 630 CB ARG A 40 1.343 -35.634 -4.689 1.00 0.00 C ATOM 631 CG ARG A 40 1.431 -34.089 -4.610 1.00 0.00 C ATOM 632 CD ARG A 40 1.732 -33.453 -5.973 1.00 0.00 C ATOM 633 NE ARG A 40 2.438 -32.200 -5.709 1.00 0.00 N ATOM 634 CZ ARG A 40 3.187 -31.540 -6.544 1.00 0.00 C ATOM 635 NH1 ARG A 40 3.367 -31.860 -7.773 1.00 0.00 N ATOM 636 NH2 ARG A 40 3.783 -30.510 -6.092 1.00 0.00 N ATOM 0 H ARG A 40 3.170 -35.429 -2.952 1.00 0.00 H new ATOM 0 HA ARG A 40 0.364 -36.023 -2.809 1.00 0.00 H new ATOM 0 HB2 ARG A 40 2.203 -36.012 -5.242 1.00 0.00 H new ATOM 0 HB3 ARG A 40 0.453 -35.912 -5.254 1.00 0.00 H new ATOM 0 HG2 ARG A 40 0.491 -33.693 -4.226 1.00 0.00 H new ATOM 0 HG3 ARG A 40 2.209 -33.807 -3.900 1.00 0.00 H new ATOM 0 HD2 ARG A 40 2.342 -34.119 -6.584 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.811 -33.268 -6.525 1.00 0.00 H new ATOM 0 HE ARG A 40 2.333 -31.803 -4.775 1.00 0.00 H new ATOM 0 HH11 ARG A 40 2.906 -32.684 -8.158 1.00 0.00 H new ATOM 0 HH12 ARG A 40 3.971 -31.290 -8.365 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.661 -30.237 -5.117 1.00 0.00 H new ATOM 0 HH22 ARG A 40 4.382 -29.957 -6.705 1.00 0.00 H new ATOM 650 N ILE A 41 2.313 -38.569 -3.878 1.00 0.00 N ATOM 651 CA ILE A 41 2.445 -40.040 -3.926 1.00 0.00 C ATOM 652 C ILE A 41 2.223 -40.753 -2.566 1.00 0.00 C ATOM 653 O ILE A 41 3.061 -40.959 -1.689 1.00 0.00 O ATOM 654 CB ILE A 41 3.704 -40.549 -4.727 1.00 0.00 C ATOM 655 CG1 ILE A 41 3.637 -40.127 -6.216 1.00 0.00 C ATOM 656 CG2 ILE A 41 3.883 -42.050 -4.721 1.00 0.00 C ATOM 657 CD1 ILE A 41 4.633 -39.017 -6.427 1.00 0.00 C ATOM 0 H ILE A 41 3.141 -38.099 -4.245 1.00 0.00 H new ATOM 0 HA ILE A 41 1.595 -40.360 -4.528 1.00 0.00 H new ATOM 0 HB ILE A 41 4.543 -40.088 -4.206 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.866 -40.974 -6.863 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.632 -39.792 -6.473 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.772 -42.313 -5.295 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.997 -42.399 -3.695 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.009 -42.522 -5.169 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.608 -38.699 -7.469 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.380 -38.174 -5.784 1.00 0.00 H new ATOM 0 HD13 ILE A 41 5.633 -39.374 -6.181 1.00 0.00 H new ATOM 669 N LYS A 42 0.944 -41.107 -2.521 1.00 0.00 N ATOM 670 CA LYS A 42 0.194 -41.560 -1.345 1.00 0.00 C ATOM 671 C LYS A 42 0.195 -43.074 -1.042 1.00 0.00 C ATOM 672 O LYS A 42 -0.251 -43.468 0.037 1.00 0.00 O ATOM 673 CB LYS A 42 -1.261 -41.035 -1.572 1.00 0.00 C ATOM 674 CG LYS A 42 -2.134 -40.817 -0.307 1.00 0.00 C ATOM 675 CD LYS A 42 -1.604 -39.842 0.788 1.00 0.00 C ATOM 676 CE LYS A 42 -1.326 -38.375 0.398 1.00 0.00 C ATOM 677 NZ LYS A 42 -0.066 -38.286 -0.331 1.00 0.00 N ATOM 0 H LYS A 42 0.361 -41.085 -3.358 1.00 0.00 H new ATOM 0 HA LYS A 42 0.688 -41.163 -0.458 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.200 -40.089 -2.110 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.778 -41.739 -2.224 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.109 -40.455 -0.633 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -2.294 -41.789 0.160 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.326 -39.836 1.604 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -0.679 -40.260 1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.140 -37.993 -0.218 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.284 -37.753 1.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.436 -37.419 -0.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.523 -39.114 -0.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.257 -38.262 -1.353 1.00 0.00 H new ATOM 691 N ILE A 43 0.722 -43.925 -1.934 1.00 0.00 N ATOM 692 CA ILE A 43 0.494 -45.381 -1.931 1.00 0.00 C ATOM 693 C ILE A 43 0.943 -46.114 -0.641 1.00 0.00 C ATOM 694 O ILE A 43 0.249 -47.035 -0.201 1.00 0.00 O ATOM 695 CB ILE A 43 1.050 -46.008 -3.272 1.00 0.00 C ATOM 696 CG1 ILE A 43 0.138 -45.757 -4.514 1.00 0.00 C ATOM 697 CG2 ILE A 43 1.340 -47.527 -3.225 1.00 0.00 C ATOM 698 CD1 ILE A 43 0.130 -44.321 -5.079 1.00 0.00 C ATOM 0 H ILE A 43 1.330 -43.617 -2.693 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.584 -45.542 -1.907 1.00 0.00 H new ATOM 0 HB ILE A 43 1.994 -45.473 -3.376 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.448 -46.435 -5.309 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.884 -46.025 -4.247 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.717 -47.856 -4.194 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.086 -47.731 -2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.422 -48.066 -2.991 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.539 -44.272 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -0.215 -43.629 -4.310 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.138 -44.046 -5.388 1.00 0.00 H new ATOM 710 N GLY A 44 2.056 -45.730 0.005 1.00 0.00 N ATOM 711 CA GLY A 44 2.417 -46.272 1.326 1.00 0.00 C ATOM 712 C GLY A 44 3.774 -45.812 1.904 1.00 0.00 C ATOM 713 O GLY A 44 4.578 -45.267 1.141 1.00 0.00 O ATOM 0 H GLY A 44 2.720 -45.049 -0.364 1.00 0.00 H new ATOM 0 HA2 GLY A 44 1.633 -46.001 2.034 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.424 -47.360 1.260 1.00 0.00 H new ATOM 717 N PRO A 45 4.094 -46.009 3.212 1.00 0.00 N ATOM 718 CA PRO A 45 5.404 -45.691 3.829 1.00 0.00 C ATOM 719 C PRO A 45 6.644 -46.277 3.119 1.00 0.00 C ATOM 720 O PRO A 45 7.632 -45.579 2.873 1.00 0.00 O ATOM 721 CB PRO A 45 5.273 -46.261 5.252 1.00 0.00 C ATOM 722 CG PRO A 45 3.806 -46.053 5.545 1.00 0.00 C ATOM 723 CD PRO A 45 3.148 -46.476 4.235 1.00 0.00 C ATOM 0 HA PRO A 45 5.589 -44.618 3.774 1.00 0.00 H new ATOM 0 HB2 PRO A 45 5.552 -47.314 5.296 1.00 0.00 H new ATOM 0 HB3 PRO A 45 5.909 -45.733 5.962 1.00 0.00 H new ATOM 0 HG2 PRO A 45 3.469 -46.662 6.384 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.585 -45.015 5.795 1.00 0.00 H new ATOM 0 HD2 PRO A 45 3.005 -47.556 4.187 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.166 -46.019 4.113 1.00 0.00 H new ATOM 731 N LYS A 46 6.559 -47.568 2.770 1.00 0.00 N ATOM 732 CA LYS A 46 7.596 -48.295 2.034 1.00 0.00 C ATOM 733 C LYS A 46 7.736 -47.802 0.571 1.00 0.00 C ATOM 734 O LYS A 46 8.829 -47.836 -0.002 1.00 0.00 O ATOM 735 CB LYS A 46 7.241 -49.800 2.147 1.00 0.00 C ATOM 736 CG LYS A 46 8.423 -50.764 1.908 1.00 0.00 C ATOM 737 CD LYS A 46 8.020 -52.202 2.311 1.00 0.00 C ATOM 738 CE LYS A 46 9.134 -53.246 2.184 1.00 0.00 C ATOM 739 NZ LYS A 46 9.411 -53.513 0.777 1.00 0.00 N ATOM 0 H LYS A 46 5.750 -48.146 2.997 1.00 0.00 H new ATOM 0 HA LYS A 46 8.581 -48.113 2.463 1.00 0.00 H new ATOM 0 HB2 LYS A 46 6.832 -49.989 3.139 1.00 0.00 H new ATOM 0 HB3 LYS A 46 6.454 -50.028 1.429 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.717 -50.740 0.859 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.288 -50.443 2.488 1.00 0.00 H new ATOM 0 HD2 LYS A 46 7.670 -52.189 3.343 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.178 -52.514 1.693 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.037 -52.888 2.679 1.00 0.00 H new ATOM 0 HE3 LYS A 46 8.839 -54.167 2.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 9.788 -54.477 0.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 8.533 -53.425 0.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.110 -52.828 0.425 1.00 0.00 H new ATOM 753 N CYS A 47 6.631 -47.291 0.000 1.00 0.00 N ATOM 754 CA CYS A 47 6.606 -46.598 -1.290 1.00 0.00 C ATOM 755 C CYS A 47 7.355 -45.255 -1.227 1.00 0.00 C ATOM 756 O CYS A 47 8.279 -45.084 -2.024 1.00 0.00 O ATOM 757 CB CYS A 47 5.137 -46.409 -1.750 1.00 0.00 C ATOM 758 SG CYS A 47 4.869 -45.393 -3.229 1.00 0.00 S ATOM 0 H CYS A 47 5.711 -47.353 0.437 1.00 0.00 H new ATOM 0 HA CYS A 47 7.127 -47.211 -2.025 1.00 0.00 H new ATOM 0 HB2 CYS A 47 4.708 -47.394 -1.932 1.00 0.00 H new ATOM 0 HB3 CYS A 47 4.577 -45.965 -0.927 1.00 0.00 H new ATOM 763 N VAL A 48 6.989 -44.303 -0.339 1.00 0.00 N ATOM 764 CA VAL A 48 7.790 -43.095 -0.089 1.00 0.00 C ATOM 765 C VAL A 48 9.280 -43.362 0.186 1.00 0.00 C ATOM 766 O VAL A 48 10.128 -42.600 -0.276 1.00 0.00 O ATOM 767 CB VAL A 48 7.248 -42.174 1.058 1.00 0.00 C ATOM 768 CG1 VAL A 48 7.116 -40.766 0.521 1.00 0.00 C ATOM 769 CG2 VAL A 48 5.888 -42.523 1.640 1.00 0.00 C ATOM 0 H VAL A 48 6.136 -44.354 0.218 1.00 0.00 H new ATOM 0 HA VAL A 48 7.690 -42.572 -1.040 1.00 0.00 H new ATOM 0 HB VAL A 48 7.974 -42.304 1.861 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.740 -40.111 1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.091 -40.411 0.188 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.422 -40.761 -0.319 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.633 -41.808 2.423 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.135 -42.484 0.853 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.920 -43.527 2.062 1.00 0.00 H new ATOM 779 N LYS A 49 9.605 -44.420 0.942 1.00 0.00 N ATOM 780 CA LYS A 49 10.998 -44.844 1.147 1.00 0.00 C ATOM 781 C LYS A 49 11.729 -45.309 -0.142 1.00 0.00 C ATOM 782 O LYS A 49 12.815 -44.787 -0.424 1.00 0.00 O ATOM 783 CB LYS A 49 11.035 -45.897 2.286 1.00 0.00 C ATOM 784 CG LYS A 49 12.439 -46.264 2.824 1.00 0.00 C ATOM 785 CD LYS A 49 13.226 -45.050 3.387 1.00 0.00 C ATOM 786 CE LYS A 49 14.549 -45.397 4.070 1.00 0.00 C ATOM 787 NZ LYS A 49 15.392 -46.145 3.145 1.00 0.00 N ATOM 0 H LYS A 49 8.919 -45.001 1.424 1.00 0.00 H new ATOM 0 HA LYS A 49 11.573 -43.968 1.446 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.435 -45.526 3.117 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.555 -46.808 1.928 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.334 -47.013 3.608 1.00 0.00 H new ATOM 0 HG3 LYS A 49 13.018 -46.721 2.022 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.427 -44.356 2.570 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.592 -44.525 4.102 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.057 -44.486 4.386 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.363 -45.987 4.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.323 -46.308 3.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 14.945 -47.059 2.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.509 -45.602 2.266 1.00 0.00 H new ATOM 801 N ALA A 50 11.163 -46.243 -0.940 1.00 0.00 N ATOM 802 CA ALA A 50 11.646 -46.588 -2.294 1.00 0.00 C ATOM 803 C ALA A 50 11.803 -45.318 -3.168 1.00 0.00 C ATOM 804 O ALA A 50 12.880 -45.067 -3.723 1.00 0.00 O ATOM 805 CB ALA A 50 10.620 -47.577 -2.918 1.00 0.00 C ATOM 0 H ALA A 50 10.347 -46.785 -0.656 1.00 0.00 H new ATOM 0 HA ALA A 50 12.631 -47.052 -2.239 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.945 -47.854 -3.921 1.00 0.00 H new ATOM 0 HB2 ALA A 50 10.553 -48.471 -2.298 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.642 -47.100 -2.973 1.00 0.00 H new ATOM 811 N PHE A 51 10.745 -44.481 -3.184 1.00 0.00 N ATOM 812 CA PHE A 51 10.698 -43.189 -3.879 1.00 0.00 C ATOM 813 C PHE A 51 11.858 -42.268 -3.463 1.00 0.00 C ATOM 814 O PHE A 51 12.618 -41.847 -4.332 1.00 0.00 O ATOM 815 CB PHE A 51 9.327 -42.517 -3.547 1.00 0.00 C ATOM 816 CG PHE A 51 8.896 -41.426 -4.535 1.00 0.00 C ATOM 817 CD1 PHE A 51 9.578 -40.225 -4.670 1.00 0.00 C ATOM 818 CD2 PHE A 51 7.847 -41.651 -5.407 1.00 0.00 C ATOM 819 CE1 PHE A 51 9.255 -39.314 -5.654 1.00 0.00 C ATOM 820 CE2 PHE A 51 7.520 -40.755 -6.383 1.00 0.00 C ATOM 821 CZ PHE A 51 8.226 -39.584 -6.525 1.00 0.00 C ATOM 0 H PHE A 51 9.875 -44.698 -2.697 1.00 0.00 H new ATOM 0 HA PHE A 51 10.801 -43.356 -4.951 1.00 0.00 H new ATOM 0 HB2 PHE A 51 8.557 -43.288 -3.518 1.00 0.00 H new ATOM 0 HB3 PHE A 51 9.382 -42.084 -2.548 1.00 0.00 H new ATOM 0 HD1 PHE A 51 10.383 -39.998 -3.987 1.00 0.00 H new ATOM 0 HD2 PHE A 51 7.271 -42.560 -5.313 1.00 0.00 H new ATOM 0 HE1 PHE A 51 9.809 -38.391 -5.740 1.00 0.00 H new ATOM 0 HE2 PHE A 51 6.698 -40.968 -7.051 1.00 0.00 H new ATOM 0 HZ PHE A 51 7.976 -38.886 -7.310 1.00 0.00 H new ATOM 831 N LYS A 52 12.014 -41.967 -2.163 1.00 0.00 N ATOM 832 CA LYS A 52 13.078 -41.105 -1.644 1.00 0.00 C ATOM 833 C LYS A 52 14.505 -41.617 -1.921 1.00 0.00 C ATOM 834 O LYS A 52 15.373 -40.803 -2.247 1.00 0.00 O ATOM 835 CB LYS A 52 12.869 -40.871 -0.117 1.00 0.00 C ATOM 836 CG LYS A 52 12.286 -39.482 0.231 1.00 0.00 C ATOM 837 CD LYS A 52 13.362 -38.379 0.160 1.00 0.00 C ATOM 838 CE LYS A 52 12.799 -37.006 0.486 1.00 0.00 C ATOM 839 NZ LYS A 52 13.875 -36.027 0.369 1.00 0.00 N ATOM 0 H LYS A 52 11.393 -42.323 -1.436 1.00 0.00 H new ATOM 0 HA LYS A 52 12.998 -40.164 -2.188 1.00 0.00 H new ATOM 0 HB2 LYS A 52 12.202 -41.641 0.270 1.00 0.00 H new ATOM 0 HB3 LYS A 52 13.825 -40.991 0.393 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.475 -39.245 -0.458 1.00 0.00 H new ATOM 0 HG3 LYS A 52 11.856 -39.508 1.232 1.00 0.00 H new ATOM 0 HD2 LYS A 52 14.167 -38.614 0.856 1.00 0.00 H new ATOM 0 HD3 LYS A 52 13.798 -38.363 -0.839 1.00 0.00 H new ATOM 0 HE2 LYS A 52 11.985 -36.758 -0.196 1.00 0.00 H new ATOM 0 HE3 LYS A 52 12.385 -36.996 1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.470 -35.087 0.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 14.419 -36.001 1.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 14.504 -36.294 -0.415 1.00 0.00 H new ATOM 853 N ASP A 53 14.782 -42.928 -1.813 1.00 0.00 N ATOM 854 CA ASP A 53 16.102 -43.469 -2.158 1.00 0.00 C ATOM 855 C ASP A 53 16.459 -43.345 -3.657 1.00 0.00 C ATOM 856 O ASP A 53 17.528 -42.823 -4.020 1.00 0.00 O ATOM 857 CB ASP A 53 16.204 -44.919 -1.618 1.00 0.00 C ATOM 858 CG ASP A 53 16.459 -44.918 -0.113 1.00 0.00 C ATOM 859 OD1 ASP A 53 17.443 -44.317 0.317 1.00 0.00 O ATOM 860 OD2 ASP A 53 15.695 -45.513 0.644 1.00 0.00 O ATOM 0 H ASP A 53 14.112 -43.626 -1.491 1.00 0.00 H new ATOM 0 HA ASP A 53 16.861 -42.857 -1.671 1.00 0.00 H new ATOM 0 HB2 ASP A 53 15.282 -45.459 -1.835 1.00 0.00 H new ATOM 0 HB3 ASP A 53 17.010 -45.446 -2.128 1.00 0.00 H new ATOM 865 N CYS A 54 15.542 -43.782 -4.532 1.00 0.00 N ATOM 866 CA CYS A 54 15.666 -43.521 -5.967 1.00 0.00 C ATOM 867 C CYS A 54 15.633 -42.018 -6.344 1.00 0.00 C ATOM 868 O CYS A 54 16.261 -41.639 -7.334 1.00 0.00 O ATOM 869 CB CYS A 54 14.580 -44.295 -6.719 1.00 0.00 C ATOM 870 SG CYS A 54 14.917 -46.021 -7.176 1.00 0.00 S ATOM 0 H CYS A 54 14.712 -44.314 -4.270 1.00 0.00 H new ATOM 0 HA CYS A 54 16.655 -43.868 -6.265 1.00 0.00 H new ATOM 0 HB2 CYS A 54 13.678 -44.283 -6.107 1.00 0.00 H new ATOM 0 HB3 CYS A 54 14.353 -43.747 -7.633 1.00 0.00 H new ATOM 875 N CYS A 55 14.925 -41.144 -5.606 1.00 0.00 N ATOM 876 CA CYS A 55 14.985 -39.688 -5.801 1.00 0.00 C ATOM 877 C CYS A 55 16.338 -39.067 -5.385 1.00 0.00 C ATOM 878 O CYS A 55 16.779 -38.097 -6.011 1.00 0.00 O ATOM 879 CB CYS A 55 13.802 -38.998 -5.082 1.00 0.00 C ATOM 880 SG CYS A 55 13.262 -37.467 -5.888 1.00 0.00 S ATOM 0 H CYS A 55 14.295 -41.430 -4.857 1.00 0.00 H new ATOM 0 HA CYS A 55 14.899 -39.512 -6.873 1.00 0.00 H new ATOM 0 HB2 CYS A 55 12.962 -39.691 -5.035 1.00 0.00 H new ATOM 0 HB3 CYS A 55 14.091 -38.776 -4.055 1.00 0.00 H new ATOM 885 N TYR A 56 17.024 -39.582 -4.349 1.00 0.00 N ATOM 886 CA TYR A 56 18.443 -39.271 -4.118 1.00 0.00 C ATOM 887 C TYR A 56 19.343 -39.682 -5.298 1.00 0.00 C ATOM 888 O TYR A 56 20.221 -38.903 -5.681 1.00 0.00 O ATOM 889 CB TYR A 56 18.957 -39.876 -2.785 1.00 0.00 C ATOM 890 CG TYR A 56 18.636 -38.939 -1.612 1.00 0.00 C ATOM 891 CD1 TYR A 56 17.445 -39.025 -0.917 1.00 0.00 C ATOM 892 CD2 TYR A 56 19.528 -37.952 -1.220 1.00 0.00 C ATOM 893 CE1 TYR A 56 17.155 -38.167 0.123 1.00 0.00 C ATOM 894 CE2 TYR A 56 19.241 -37.085 -0.183 1.00 0.00 C ATOM 895 CZ TYR A 56 18.046 -37.195 0.486 1.00 0.00 C ATOM 896 OH TYR A 56 17.715 -36.342 1.488 1.00 0.00 O ATOM 0 H TYR A 56 16.618 -40.215 -3.660 1.00 0.00 H new ATOM 0 HA TYR A 56 18.504 -38.186 -4.038 1.00 0.00 H new ATOM 0 HB2 TYR A 56 18.495 -40.849 -2.618 1.00 0.00 H new ATOM 0 HB3 TYR A 56 20.033 -40.040 -2.844 1.00 0.00 H new ATOM 0 HD1 TYR A 56 16.725 -39.781 -1.194 1.00 0.00 H new ATOM 0 HD2 TYR A 56 20.471 -37.859 -1.738 1.00 0.00 H new ATOM 0 HE1 TYR A 56 16.219 -38.263 0.654 1.00 0.00 H new ATOM 0 HE2 TYR A 56 19.953 -36.324 0.100 1.00 0.00 H new ATOM 0 HH TYR A 56 18.448 -35.708 1.633 1.00 0.00 H new ATOM 906 N ILE A 57 19.125 -40.870 -5.894 1.00 0.00 N ATOM 907 CA ILE A 57 19.767 -41.223 -7.180 1.00 0.00 C ATOM 908 C ILE A 57 19.416 -40.260 -8.330 1.00 0.00 C ATOM 909 O ILE A 57 20.303 -39.845 -9.080 1.00 0.00 O ATOM 910 CB ILE A 57 19.468 -42.713 -7.567 1.00 0.00 C ATOM 911 CG1 ILE A 57 19.899 -43.720 -6.473 1.00 0.00 C ATOM 912 CG2 ILE A 57 20.051 -43.165 -8.933 1.00 0.00 C ATOM 913 CD1 ILE A 57 21.332 -43.506 -5.945 1.00 0.00 C ATOM 0 H ILE A 57 18.517 -41.595 -5.513 1.00 0.00 H new ATOM 0 HA ILE A 57 20.840 -41.114 -7.023 1.00 0.00 H new ATOM 0 HB ILE A 57 18.382 -42.724 -7.662 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.202 -43.652 -5.638 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.819 -44.731 -6.873 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.792 -44.209 -9.112 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.635 -42.546 -9.729 1.00 0.00 H new ATOM 0 HG23 ILE A 57 21.136 -43.058 -8.919 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.554 -44.253 -5.182 1.00 0.00 H new ATOM 0 HD12 ILE A 57 22.041 -43.605 -6.767 1.00 0.00 H new ATOM 0 HD13 ILE A 57 21.415 -42.509 -5.512 1.00 0.00 H new ATOM 925 N ALA A 58 18.137 -39.895 -8.461 1.00 0.00 N ATOM 926 CA ALA A 58 17.682 -38.861 -9.402 1.00 0.00 C ATOM 927 C ALA A 58 18.356 -37.486 -9.191 1.00 0.00 C ATOM 928 O ALA A 58 18.675 -36.825 -10.180 1.00 0.00 O ATOM 929 CB ALA A 58 16.160 -38.708 -9.338 1.00 0.00 C ATOM 0 H ALA A 58 17.382 -40.310 -7.915 1.00 0.00 H new ATOM 0 HA ALA A 58 17.982 -39.207 -10.391 1.00 0.00 H new ATOM 0 HB1 ALA A 58 15.842 -37.938 -10.041 1.00 0.00 H new ATOM 0 HB2 ALA A 58 15.688 -39.655 -9.599 1.00 0.00 H new ATOM 0 HB3 ALA A 58 15.865 -38.421 -8.329 1.00 0.00 H new ATOM 935 N ASN A 59 18.576 -37.029 -7.945 1.00 0.00 N ATOM 936 CA ASN A 59 19.420 -35.858 -7.653 1.00 0.00 C ATOM 937 C ASN A 59 20.883 -36.024 -8.112 1.00 0.00 C ATOM 938 O ASN A 59 21.443 -35.088 -8.688 1.00 0.00 O ATOM 939 CB ASN A 59 19.380 -35.492 -6.145 1.00 0.00 C ATOM 940 CG ASN A 59 18.059 -34.828 -5.769 1.00 0.00 C ATOM 941 OD1 ASN A 59 17.887 -33.621 -5.903 1.00 0.00 O ATOM 942 ND2 ASN A 59 17.067 -35.550 -5.297 1.00 0.00 N ATOM 0 H ASN A 59 18.174 -37.461 -7.113 1.00 0.00 H new ATOM 0 HA ASN A 59 18.992 -35.042 -8.235 1.00 0.00 H new ATOM 0 HB2 ASN A 59 19.520 -36.392 -5.547 1.00 0.00 H new ATOM 0 HB3 ASN A 59 20.206 -34.821 -5.910 1.00 0.00 H new ATOM 0 HD21 ASN A 59 16.183 -35.104 -5.053 1.00 0.00 H new ATOM 0 HD22 ASN A 59 17.182 -36.556 -5.175 1.00 0.00 H new ATOM 949 N GLN A 60 21.508 -37.189 -7.875 1.00 0.00 N ATOM 950 CA GLN A 60 22.840 -37.505 -8.410 1.00 0.00 C ATOM 951 C GLN A 60 22.883 -37.543 -9.953 1.00 0.00 C ATOM 952 O GLN A 60 23.843 -37.040 -10.540 1.00 0.00 O ATOM 953 CB GLN A 60 23.356 -38.838 -7.814 1.00 0.00 C ATOM 954 CG GLN A 60 23.597 -38.748 -6.282 1.00 0.00 C ATOM 955 CD GLN A 60 24.071 -40.083 -5.709 1.00 0.00 C ATOM 956 OE1 GLN A 60 23.343 -40.774 -5.010 1.00 0.00 O ATOM 957 NE2 GLN A 60 25.294 -40.507 -5.959 1.00 0.00 N ATOM 0 H GLN A 60 21.105 -37.935 -7.309 1.00 0.00 H new ATOM 0 HA GLN A 60 23.501 -36.693 -8.107 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.634 -39.628 -8.020 1.00 0.00 H new ATOM 0 HB3 GLN A 60 24.285 -39.119 -8.309 1.00 0.00 H new ATOM 0 HG2 GLN A 60 24.340 -37.978 -6.074 1.00 0.00 H new ATOM 0 HG3 GLN A 60 22.676 -38.444 -5.785 1.00 0.00 H new ATOM 0 HE21 GLN A 60 25.919 -39.948 -6.539 1.00 0.00 H new ATOM 0 HE22 GLN A 60 25.615 -41.394 -5.572 1.00 0.00 H new ATOM 966 N VAL A 61 21.863 -38.116 -10.615 1.00 0.00 N ATOM 967 CA VAL A 61 21.688 -38.015 -12.073 1.00 0.00 C ATOM 968 C VAL A 61 21.443 -36.563 -12.538 1.00 0.00 C ATOM 969 O VAL A 61 22.076 -36.138 -13.505 1.00 0.00 O ATOM 970 CB VAL A 61 20.574 -38.995 -12.576 1.00 0.00 C ATOM 971 CG1 VAL A 61 20.271 -38.895 -14.090 1.00 0.00 C ATOM 972 CG2 VAL A 61 20.964 -40.462 -12.301 1.00 0.00 C ATOM 0 H VAL A 61 21.136 -38.663 -10.153 1.00 0.00 H new ATOM 0 HA VAL A 61 22.627 -38.323 -12.534 1.00 0.00 H new ATOM 0 HB VAL A 61 19.685 -38.693 -12.022 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.489 -39.607 -14.352 1.00 0.00 H new ATOM 0 HG12 VAL A 61 19.937 -37.885 -14.328 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.174 -39.122 -14.657 1.00 0.00 H new ATOM 0 HG21 VAL A 61 20.174 -41.122 -12.660 1.00 0.00 H new ATOM 0 HG22 VAL A 61 21.894 -40.694 -12.819 1.00 0.00 H new ATOM 0 HG23 VAL A 61 21.100 -40.608 -11.229 1.00 0.00 H new ATOM 982 N ARG A 62 20.570 -35.769 -11.894 1.00 0.00 N ATOM 983 CA ARG A 62 20.378 -34.345 -12.218 1.00 0.00 C ATOM 984 C ARG A 62 21.584 -33.427 -11.926 1.00 0.00 C ATOM 985 O ARG A 62 21.682 -32.356 -12.525 1.00 0.00 O ATOM 986 CB ARG A 62 19.065 -33.810 -11.580 1.00 0.00 C ATOM 987 CG ARG A 62 17.827 -33.908 -12.513 1.00 0.00 C ATOM 988 CD ARG A 62 17.479 -35.326 -13.000 1.00 0.00 C ATOM 989 NE ARG A 62 16.272 -35.252 -13.821 1.00 0.00 N ATOM 990 CZ ARG A 62 16.230 -35.033 -15.106 1.00 0.00 C ATOM 991 NH1 ARG A 62 17.238 -34.840 -15.878 1.00 0.00 N ATOM 992 NH2 ARG A 62 15.069 -35.010 -15.631 1.00 0.00 N ATOM 0 H ARG A 62 19.976 -36.098 -11.132 1.00 0.00 H new ATOM 0 HA ARG A 62 20.289 -34.308 -13.304 1.00 0.00 H new ATOM 0 HB2 ARG A 62 18.864 -34.368 -10.665 1.00 0.00 H new ATOM 0 HB3 ARG A 62 19.210 -32.769 -11.293 1.00 0.00 H new ATOM 0 HG2 ARG A 62 16.964 -33.501 -11.987 1.00 0.00 H new ATOM 0 HG3 ARG A 62 17.998 -33.275 -13.384 1.00 0.00 H new ATOM 0 HD2 ARG A 62 18.305 -35.741 -13.578 1.00 0.00 H new ATOM 0 HD3 ARG A 62 17.319 -35.990 -12.150 1.00 0.00 H new ATOM 0 HE ARG A 62 15.380 -35.384 -13.345 1.00 0.00 H new ATOM 0 HH11 ARG A 62 18.183 -34.850 -15.495 1.00 0.00 H new ATOM 0 HH12 ARG A 62 17.093 -34.677 -16.874 1.00 0.00 H new ATOM 0 HH21 ARG A 62 14.244 -35.158 -15.050 1.00 0.00 H new ATOM 0 HH22 ARG A 62 14.965 -34.844 -16.632 1.00 0.00 H new ATOM 1006 N ALA A 63 22.498 -33.796 -11.016 1.00 0.00 N ATOM 1007 CA ALA A 63 23.831 -33.185 -10.940 1.00 0.00 C ATOM 1008 C ALA A 63 24.710 -33.452 -12.186 1.00 0.00 C ATOM 1009 O ALA A 63 25.590 -32.653 -12.511 1.00 0.00 O ATOM 1010 CB ALA A 63 24.526 -33.696 -9.663 1.00 0.00 C ATOM 0 H ALA A 63 22.335 -34.521 -10.317 1.00 0.00 H new ATOM 0 HA ALA A 63 23.701 -32.103 -10.907 1.00 0.00 H new ATOM 0 HB1 ALA A 63 25.519 -33.253 -9.587 1.00 0.00 H new ATOM 0 HB2 ALA A 63 23.936 -33.415 -8.790 1.00 0.00 H new ATOM 0 HB3 ALA A 63 24.615 -34.781 -9.707 1.00 0.00 H new ATOM 1016 N GLU A 64 24.494 -34.579 -12.880 1.00 0.00 N ATOM 1017 CA GLU A 64 25.146 -34.896 -14.155 1.00 0.00 C ATOM 1018 C GLU A 64 24.347 -34.361 -15.365 1.00 0.00 C ATOM 1019 O GLU A 64 24.921 -33.746 -16.267 1.00 0.00 O ATOM 1020 CB GLU A 64 25.303 -36.436 -14.282 1.00 0.00 C ATOM 1021 CG GLU A 64 26.080 -37.098 -13.103 1.00 0.00 C ATOM 1022 CD GLU A 64 26.054 -38.626 -13.182 1.00 0.00 C ATOM 1023 OE1 GLU A 64 25.001 -39.215 -12.941 1.00 0.00 O ATOM 1024 OE2 GLU A 64 27.094 -39.207 -13.479 1.00 0.00 O ATOM 0 H GLU A 64 23.851 -35.306 -12.565 1.00 0.00 H new ATOM 0 HA GLU A 64 26.121 -34.409 -14.160 1.00 0.00 H new ATOM 0 HB2 GLU A 64 24.313 -36.887 -14.349 1.00 0.00 H new ATOM 0 HB3 GLU A 64 25.819 -36.662 -15.215 1.00 0.00 H new ATOM 0 HG2 GLU A 64 27.114 -36.753 -13.112 1.00 0.00 H new ATOM 0 HG3 GLU A 64 25.644 -36.777 -12.157 1.00 0.00 H new ATOM 1031 N GLN A 65 23.028 -34.608 -15.427 1.00 0.00 N ATOM 1032 CA GLN A 65 22.182 -34.145 -16.534 1.00 0.00 C ATOM 1033 C GLN A 65 20.693 -33.949 -16.156 1.00 0.00 C ATOM 1034 O GLN A 65 20.047 -34.865 -15.634 1.00 0.00 O ATOM 1035 CB GLN A 65 22.325 -35.154 -17.724 1.00 0.00 C ATOM 1036 CG GLN A 65 22.059 -34.541 -19.132 1.00 0.00 C ATOM 1037 CD GLN A 65 23.163 -33.602 -19.648 1.00 0.00 C ATOM 1038 OE1 GLN A 65 23.057 -33.119 -20.766 1.00 0.00 O ATOM 1039 NE2 GLN A 65 24.256 -33.254 -18.989 1.00 0.00 N ATOM 0 H GLN A 65 22.522 -35.132 -14.713 1.00 0.00 H new ATOM 0 HA GLN A 65 22.532 -33.153 -16.818 1.00 0.00 H new ATOM 0 HB2 GLN A 65 23.331 -35.572 -17.709 1.00 0.00 H new ATOM 0 HB3 GLN A 65 21.633 -35.982 -17.566 1.00 0.00 H new ATOM 0 HG2 GLN A 65 21.929 -35.353 -19.847 1.00 0.00 H new ATOM 0 HG3 GLN A 65 21.119 -33.990 -19.101 1.00 0.00 H new ATOM 0 HE21 GLN A 65 24.421 -33.614 -18.049 1.00 0.00 H new ATOM 0 HE22 GLN A 65 24.934 -32.626 -19.421 1.00 0.00 H new ATOM 1048 N SER A 66 20.172 -32.864 -16.400 1.00 0.00 N TER 1049 SER A 66