USER MOD reduce.3.24.130724 H: found=0, std=0, add=559, rem=0, adj=1 USER MOD reduce.3.24.130724 removed 561 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 Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 153:sc= 0.515 (180deg=0.143) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ARG A 3 -6.394 -10.576 -3.508 1.00 0.00 N ATOM 20 CA ARG A 3 -5.522 -9.892 -2.569 1.00 0.00 C ATOM 21 C ARG A 3 -4.773 -8.757 -3.270 1.00 0.00 C ATOM 22 O ARG A 3 -5.197 -7.603 -3.215 1.00 0.00 O ATOM 23 CB ARG A 3 -4.508 -10.859 -1.955 1.00 0.00 C ATOM 24 CG ARG A 3 -5.013 -11.408 -0.619 1.00 0.00 C ATOM 25 CD ARG A 3 -5.393 -12.885 -0.742 1.00 0.00 C ATOM 26 NE ARG A 3 -6.738 -13.112 -0.165 1.00 0.00 N ATOM 27 CZ ARG A 3 -6.983 -13.235 1.146 1.00 0.00 C ATOM 28 NH1 ARG A 3 -5.975 -13.153 2.026 1.00 0.00 N ATOM 29 NH2 ARG A 3 -8.234 -13.439 1.578 1.00 0.00 N ATOM 0 HA ARG A 3 -6.146 -9.484 -1.774 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -4.323 -11.683 -2.644 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -3.557 -10.348 -1.806 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -4.242 -11.289 0.142 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -5.878 -10.833 -0.289 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -5.382 -13.186 -1.790 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -4.658 -13.502 -0.226 1.00 0.00 H new ATOM 0 HE ARG A 3 -7.528 -13.179 -0.807 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -5.022 -12.997 1.697 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -6.161 -13.247 3.025 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -9.001 -13.501 0.908 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -8.420 -13.533 2.577 1.00 0.00 H new ATOM 43 N VAL A 4 -3.674 -9.123 -3.911 1.00 0.00 N ATOM 44 CA VAL A 4 -2.862 -8.149 -4.622 1.00 0.00 C ATOM 45 C VAL A 4 -3.741 -7.390 -5.618 1.00 0.00 C ATOM 46 O VAL A 4 -3.489 -6.221 -5.908 1.00 0.00 O ATOM 47 CB VAL A 4 -1.671 -8.844 -5.285 1.00 0.00 C ATOM 48 CG1 VAL A 4 -2.088 -10.184 -5.894 1.00 0.00 C ATOM 49 CG2 VAL A 4 -1.024 -7.941 -6.336 1.00 0.00 C ATOM 0 H VAL A 4 -3.326 -10.081 -3.954 1.00 0.00 H new ATOM 0 HA VAL A 4 -2.449 -7.417 -3.928 1.00 0.00 H new ATOM 0 HB VAL A 4 -0.928 -9.044 -4.513 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -1.223 -10.657 -6.359 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -2.480 -10.833 -5.111 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.859 -10.017 -6.647 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -0.180 -8.459 -6.792 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -1.756 -7.695 -7.105 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -0.673 -7.024 -5.862 1.00 0.00 H new ATOM 59 N LYS A 5 -4.754 -8.084 -6.114 1.00 0.00 N ATOM 60 CA LYS A 5 -5.671 -7.490 -7.073 1.00 0.00 C ATOM 61 C LYS A 5 -6.500 -6.409 -6.375 1.00 0.00 C ATOM 62 O LYS A 5 -6.499 -5.254 -6.797 1.00 0.00 O ATOM 63 CB LYS A 5 -6.515 -8.572 -7.748 1.00 0.00 C ATOM 64 CG LYS A 5 -7.522 -7.954 -8.722 1.00 0.00 C ATOM 65 CD LYS A 5 -7.039 -8.091 -10.168 1.00 0.00 C ATOM 66 CE LYS A 5 -8.202 -7.934 -11.150 1.00 0.00 C ATOM 67 NZ LYS A 5 -8.598 -9.250 -11.698 1.00 0.00 N ATOM 0 H LYS A 5 -4.961 -9.053 -5.870 1.00 0.00 H new ATOM 0 HA LYS A 5 -5.120 -7.002 -7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.865 -9.265 -8.282 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.044 -9.151 -6.991 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -8.490 -8.443 -8.610 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -7.667 -6.901 -8.481 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -6.279 -7.337 -10.375 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.569 -9.064 -10.308 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -9.051 -7.473 -10.646 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -7.913 -7.267 -11.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -9.388 -9.126 -12.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.790 -9.676 -12.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -8.894 -9.875 -10.921 1.00 0.00 H new ATOM 81 N ALA A 6 -7.186 -6.822 -5.320 1.00 0.00 N ATOM 82 CA ALA A 6 -8.017 -5.904 -4.561 1.00 0.00 C ATOM 83 C ALA A 6 -7.127 -4.861 -3.881 1.00 0.00 C ATOM 84 O ALA A 6 -7.621 -3.862 -3.362 1.00 0.00 O ATOM 85 CB ALA A 6 -8.863 -6.691 -3.558 1.00 0.00 C ATOM 0 H ALA A 6 -7.183 -7.781 -4.973 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.703 -5.373 -5.220 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.487 -6.002 -2.988 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -9.498 -7.398 -4.093 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.208 -7.235 -2.877 1.00 0.00 H new ATOM 91 N LEU A 7 -5.831 -5.131 -3.905 1.00 0.00 N ATOM 92 CA LEU A 7 -4.866 -4.228 -3.297 1.00 0.00 C ATOM 93 C LEU A 7 -4.487 -3.142 -4.306 1.00 0.00 C ATOM 94 O LEU A 7 -4.617 -1.952 -4.019 1.00 0.00 O ATOM 95 CB LEU A 7 -3.669 -5.010 -2.755 1.00 0.00 C ATOM 96 CG LEU A 7 -3.622 -5.197 -1.237 1.00 0.00 C ATOM 97 CD1 LEU A 7 -3.913 -3.880 -0.513 1.00 0.00 C ATOM 98 CD2 LEU A 7 -4.566 -6.316 -0.793 1.00 0.00 C ATOM 0 H LEU A 7 -5.425 -5.962 -4.336 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.304 -3.724 -2.435 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.661 -5.994 -3.223 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.757 -4.502 -3.067 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.612 -5.500 -0.961 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -3.873 -4.041 0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.168 -3.137 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.905 -3.524 -0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.513 -6.428 0.290 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.587 -6.067 -1.083 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.271 -7.251 -1.269 1.00 0.00 H new ATOM 110 N GLU A 8 -4.024 -3.588 -5.464 1.00 0.00 N ATOM 111 CA GLU A 8 -3.625 -2.670 -6.515 1.00 0.00 C ATOM 112 C GLU A 8 -4.569 -1.467 -6.555 1.00 0.00 C ATOM 113 O GLU A 8 -4.159 -0.362 -6.911 1.00 0.00 O ATOM 114 CB GLU A 8 -3.577 -3.375 -7.872 1.00 0.00 C ATOM 115 CG GLU A 8 -2.938 -2.477 -8.934 1.00 0.00 C ATOM 116 CD GLU A 8 -3.648 -2.631 -10.281 1.00 0.00 C ATOM 117 OE1 GLU A 8 -4.868 -2.358 -10.314 1.00 0.00 O ATOM 118 OE2 GLU A 8 -2.956 -3.020 -11.246 1.00 0.00 O ATOM 0 H GLU A 8 -3.916 -4.575 -5.697 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.620 -2.312 -6.294 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -3.009 -4.301 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.586 -3.647 -8.180 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -2.984 -1.437 -8.611 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -1.884 -2.731 -9.043 1.00 0.00 H new ATOM 125 N GLU A 9 -5.816 -1.720 -6.187 1.00 0.00 N ATOM 126 CA GLU A 9 -6.821 -0.672 -6.176 1.00 0.00 C ATOM 127 C GLU A 9 -6.395 0.464 -5.243 1.00 0.00 C ATOM 128 O GLU A 9 -6.387 1.628 -5.640 1.00 0.00 O ATOM 129 CB GLU A 9 -8.189 -1.227 -5.773 1.00 0.00 C ATOM 130 CG GLU A 9 -9.112 -0.110 -5.285 1.00 0.00 C ATOM 131 CD GLU A 9 -10.550 -0.341 -5.757 1.00 0.00 C ATOM 132 OE1 GLU A 9 -11.247 -1.133 -5.087 1.00 0.00 O ATOM 133 OE2 GLU A 9 -10.918 0.280 -6.777 1.00 0.00 O ATOM 0 H GLU A 9 -6.153 -2.637 -5.894 1.00 0.00 H new ATOM 0 HA GLU A 9 -6.910 -0.273 -7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.644 -1.734 -6.624 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.066 -1.971 -4.986 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.086 -0.062 -4.196 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.754 0.851 -5.655 1.00 0.00 H new ATOM 140 N LYS A 10 -6.051 0.085 -4.021 1.00 0.00 N ATOM 141 CA LYS A 10 -5.624 1.057 -3.028 1.00 0.00 C ATOM 142 C LYS A 10 -4.257 1.617 -3.425 1.00 0.00 C ATOM 143 O LYS A 10 -4.116 2.817 -3.653 1.00 0.00 O ATOM 144 CB LYS A 10 -5.655 0.441 -1.628 1.00 0.00 C ATOM 145 CG LYS A 10 -5.990 1.497 -0.573 1.00 0.00 C ATOM 146 CD LYS A 10 -7.503 1.645 -0.406 1.00 0.00 C ATOM 147 CE LYS A 10 -7.938 1.267 1.011 1.00 0.00 C ATOM 148 NZ LYS A 10 -8.037 -0.203 1.147 1.00 0.00 N ATOM 0 H LYS A 10 -6.059 -0.882 -3.696 1.00 0.00 H new ATOM 0 HA LYS A 10 -6.316 1.899 -2.995 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.395 -0.359 -1.595 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -4.688 -0.009 -1.403 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -5.541 1.219 0.380 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.557 2.455 -0.862 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -7.797 2.673 -0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.016 1.011 -1.129 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -7.222 1.658 1.734 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -8.901 1.725 1.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -8.333 -0.443 2.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -8.737 -0.568 0.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -7.110 -0.633 0.952 1.00 0.00 H new ATOM 162 N VAL A 11 -3.283 0.720 -3.493 1.00 0.00 N ATOM 163 CA VAL A 11 -1.931 1.110 -3.857 1.00 0.00 C ATOM 164 C VAL A 11 -1.987 2.111 -5.013 1.00 0.00 C ATOM 165 O VAL A 11 -1.522 3.242 -4.882 1.00 0.00 O ATOM 166 CB VAL A 11 -1.099 -0.132 -4.182 1.00 0.00 C ATOM 167 CG1 VAL A 11 0.357 0.244 -4.468 1.00 0.00 C ATOM 168 CG2 VAL A 11 -1.188 -1.162 -3.055 1.00 0.00 C ATOM 0 H VAL A 11 -3.403 -0.275 -3.302 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.438 1.606 -3.021 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.512 -0.586 -5.083 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.927 -0.656 -4.696 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.397 0.924 -5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.785 0.733 -3.593 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -0.588 -2.035 -3.312 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -0.813 -0.723 -2.130 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.227 -1.463 -2.919 1.00 0.00 H new ATOM 178 N LYS A 12 -2.562 1.659 -6.118 1.00 0.00 N ATOM 179 CA LYS A 12 -2.686 2.501 -7.296 1.00 0.00 C ATOM 180 C LYS A 12 -3.174 3.889 -6.876 1.00 0.00 C ATOM 181 O LYS A 12 -2.562 4.897 -7.221 1.00 0.00 O ATOM 182 CB LYS A 12 -3.571 1.828 -8.346 1.00 0.00 C ATOM 183 CG LYS A 12 -3.809 2.755 -9.540 1.00 0.00 C ATOM 184 CD LYS A 12 -3.248 2.147 -10.827 1.00 0.00 C ATOM 185 CE LYS A 12 -3.846 2.825 -12.060 1.00 0.00 C ATOM 186 NZ LYS A 12 -3.220 2.302 -13.294 1.00 0.00 N ATOM 0 H LYS A 12 -2.947 0.720 -6.222 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.715 2.635 -7.772 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -3.100 0.905 -8.686 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.526 1.553 -7.899 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.877 2.938 -9.656 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.339 3.721 -9.355 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -2.163 2.252 -10.840 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.465 1.079 -10.854 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.922 2.654 -12.090 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.696 3.903 -11.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -3.638 2.773 -14.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -2.197 2.487 -13.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.385 1.277 -13.359 1.00 0.00 H new ATOM 200 N ALA A 13 -4.275 3.895 -6.139 1.00 0.00 N ATOM 201 CA ALA A 13 -4.855 5.142 -5.669 1.00 0.00 C ATOM 202 C ALA A 13 -3.836 5.874 -4.792 1.00 0.00 C ATOM 203 O ALA A 13 -3.674 7.088 -4.903 1.00 0.00 O ATOM 204 CB ALA A 13 -6.160 4.852 -4.926 1.00 0.00 C ATOM 0 H ALA A 13 -4.781 3.056 -5.856 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.097 5.793 -6.509 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.594 5.788 -4.574 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.860 4.358 -5.600 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.957 4.203 -4.074 1.00 0.00 H new ATOM 210 N LEU A 14 -3.176 5.103 -3.939 1.00 0.00 N ATOM 211 CA LEU A 14 -2.178 5.663 -3.044 1.00 0.00 C ATOM 212 C LEU A 14 -1.125 6.410 -3.864 1.00 0.00 C ATOM 213 O LEU A 14 -0.622 7.449 -3.438 1.00 0.00 O ATOM 214 CB LEU A 14 -1.595 4.573 -2.142 1.00 0.00 C ATOM 215 CG LEU A 14 -2.565 3.939 -1.142 1.00 0.00 C ATOM 216 CD1 LEU A 14 -1.808 3.272 0.007 1.00 0.00 C ATOM 217 CD2 LEU A 14 -3.581 4.967 -0.639 1.00 0.00 C ATOM 0 H LEU A 14 -3.313 4.096 -3.849 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.634 6.390 -2.372 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.190 3.784 -2.775 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.758 4.998 -1.587 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.124 3.157 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.520 2.829 0.703 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.157 2.493 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.207 4.017 0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.259 4.492 0.070 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.057 5.786 -0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.152 5.356 -1.482 1.00 0.00 H new ATOM 229 N GLU A 15 -0.822 5.853 -5.027 1.00 0.00 N ATOM 230 CA GLU A 15 0.163 6.454 -5.911 1.00 0.00 C ATOM 231 C GLU A 15 -0.251 7.882 -6.274 1.00 0.00 C ATOM 232 O GLU A 15 0.574 8.794 -6.256 1.00 0.00 O ATOM 233 CB GLU A 15 0.361 5.606 -7.169 1.00 0.00 C ATOM 234 CG GLU A 15 1.675 5.960 -7.868 1.00 0.00 C ATOM 235 CD GLU A 15 1.717 5.380 -9.283 1.00 0.00 C ATOM 236 OE1 GLU A 15 1.034 5.960 -10.154 1.00 0.00 O ATOM 237 OE2 GLU A 15 2.431 4.369 -9.461 1.00 0.00 O ATOM 0 H GLU A 15 -1.241 4.992 -5.378 1.00 0.00 H new ATOM 0 HA GLU A 15 1.117 6.494 -5.385 1.00 0.00 H new ATOM 0 HB2 GLU A 15 0.360 4.549 -6.903 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.473 5.764 -7.853 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.787 7.043 -7.912 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.514 5.576 -7.289 1.00 0.00 H new ATOM 244 N GLU A 16 -1.528 8.031 -6.593 1.00 0.00 N ATOM 245 CA GLU A 16 -2.061 9.332 -6.959 1.00 0.00 C ATOM 246 C GLU A 16 -2.214 10.212 -5.716 1.00 0.00 C ATOM 247 O GLU A 16 -1.903 11.401 -5.751 1.00 0.00 O ATOM 248 CB GLU A 16 -3.393 9.192 -7.699 1.00 0.00 C ATOM 249 CG GLU A 16 -3.836 10.530 -8.291 1.00 0.00 C ATOM 250 CD GLU A 16 -5.345 10.547 -8.543 1.00 0.00 C ATOM 251 OE1 GLU A 16 -5.738 10.137 -9.656 1.00 0.00 O ATOM 252 OE2 GLU A 16 -6.071 10.968 -7.617 1.00 0.00 O ATOM 0 H GLU A 16 -2.209 7.272 -6.606 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.356 9.813 -7.637 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.295 8.453 -8.495 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.156 8.823 -7.014 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.568 11.339 -7.611 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.306 10.711 -9.226 1.00 0.00 H new ATOM 259 N LYS A 17 -2.695 9.592 -4.648 1.00 0.00 N ATOM 260 CA LYS A 17 -2.893 10.304 -3.397 1.00 0.00 C ATOM 261 C LYS A 17 -1.534 10.725 -2.834 1.00 0.00 C ATOM 262 O LYS A 17 -1.258 11.915 -2.695 1.00 0.00 O ATOM 263 CB LYS A 17 -3.725 9.461 -2.428 1.00 0.00 C ATOM 264 CG LYS A 17 -5.169 9.963 -2.367 1.00 0.00 C ATOM 265 CD LYS A 17 -5.257 11.293 -1.615 1.00 0.00 C ATOM 266 CE LYS A 17 -6.307 11.227 -0.504 1.00 0.00 C ATOM 267 NZ LYS A 17 -6.502 12.561 0.105 1.00 0.00 N ATOM 0 H LYS A 17 -2.953 8.606 -4.623 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.466 11.216 -3.564 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.712 8.418 -2.744 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -3.281 9.499 -1.433 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.558 10.087 -3.378 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.795 9.220 -1.873 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -4.285 11.538 -1.187 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.509 12.093 -2.312 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.252 10.864 -0.909 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.993 10.515 0.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.218 12.498 0.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -5.603 12.893 0.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -6.822 13.231 -0.623 1.00 0.00 H new ATOM 281 N VAL A 18 -0.722 9.725 -2.524 1.00 0.00 N ATOM 282 CA VAL A 18 0.602 9.977 -1.980 1.00 0.00 C ATOM 283 C VAL A 18 1.276 11.091 -2.783 1.00 0.00 C ATOM 284 O VAL A 18 1.972 11.934 -2.219 1.00 0.00 O ATOM 285 CB VAL A 18 1.414 8.681 -1.957 1.00 0.00 C ATOM 286 CG1 VAL A 18 2.882 8.959 -1.628 1.00 0.00 C ATOM 287 CG2 VAL A 18 0.813 7.674 -0.975 1.00 0.00 C ATOM 0 H VAL A 18 -0.955 8.739 -2.639 1.00 0.00 H new ATOM 0 HA VAL A 18 0.531 10.319 -0.947 1.00 0.00 H new ATOM 0 HB VAL A 18 1.372 8.242 -2.954 1.00 0.00 H new ATOM 0 HG11 VAL A 18 3.437 8.021 -1.618 1.00 0.00 H new ATOM 0 HG12 VAL A 18 3.305 9.622 -2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 18 2.952 9.432 -0.649 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.410 6.762 -0.979 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.809 8.101 0.028 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.209 7.440 -1.273 1.00 0.00 H new ATOM 297 N LYS A 19 1.045 11.059 -4.087 1.00 0.00 N ATOM 298 CA LYS A 19 1.622 12.056 -4.974 1.00 0.00 C ATOM 299 C LYS A 19 0.802 13.345 -4.885 1.00 0.00 C ATOM 300 O LYS A 19 1.353 14.441 -4.976 1.00 0.00 O ATOM 301 CB LYS A 19 1.744 11.501 -6.395 1.00 0.00 C ATOM 302 CG LYS A 19 2.520 12.466 -7.295 1.00 0.00 C ATOM 303 CD LYS A 19 2.479 12.008 -8.753 1.00 0.00 C ATOM 304 CE LYS A 19 1.377 12.735 -9.525 1.00 0.00 C ATOM 305 NZ LYS A 19 0.298 11.794 -9.900 1.00 0.00 N ATOM 0 H LYS A 19 0.466 10.359 -4.551 1.00 0.00 H new ATOM 0 HA LYS A 19 2.638 12.301 -4.664 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.249 10.535 -6.370 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.750 11.331 -6.809 1.00 0.00 H new ATOM 0 HG2 LYS A 19 2.096 13.467 -7.212 1.00 0.00 H new ATOM 0 HG3 LYS A 19 3.555 12.530 -6.959 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.443 12.197 -9.224 1.00 0.00 H new ATOM 0 HD3 LYS A 19 2.309 10.932 -8.795 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.969 13.541 -8.915 1.00 0.00 H new ATOM 0 HE3 LYS A 19 1.795 13.194 -10.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -0.442 12.305 -10.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.688 11.039 -10.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -0.112 11.376 -9.041 1.00 0.00 H new ATOM 319 N ALA A 20 -0.500 13.171 -4.710 1.00 0.00 N ATOM 320 CA ALA A 20 -1.399 14.307 -4.608 1.00 0.00 C ATOM 321 C ALA A 20 -1.026 15.138 -3.380 1.00 0.00 C ATOM 322 O ALA A 20 -1.434 16.294 -3.260 1.00 0.00 O ATOM 323 CB ALA A 20 -2.846 13.810 -4.558 1.00 0.00 C ATOM 0 H ALA A 20 -0.953 12.260 -4.636 1.00 0.00 H new ATOM 0 HA ALA A 20 -1.305 14.951 -5.483 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -3.521 14.662 -4.481 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -3.070 13.250 -5.466 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -2.979 13.163 -3.691 1.00 0.00 H new ATOM 329 N LEU A 21 -0.256 14.520 -2.496 1.00 0.00 N ATOM 330 CA LEU A 21 0.176 15.189 -1.281 1.00 0.00 C ATOM 331 C LEU A 21 1.245 16.227 -1.629 1.00 0.00 C ATOM 332 O LEU A 21 2.132 15.963 -2.439 1.00 0.00 O ATOM 333 CB LEU A 21 0.630 14.166 -0.239 1.00 0.00 C ATOM 334 CG LEU A 21 -0.170 12.862 -0.187 1.00 0.00 C ATOM 335 CD1 LEU A 21 0.180 12.054 1.063 1.00 0.00 C ATOM 336 CD2 LEU A 21 -1.672 13.135 -0.293 1.00 0.00 C ATOM 0 H LEU A 21 0.080 13.562 -2.598 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.656 15.726 -0.825 1.00 0.00 H new ATOM 0 HB2 LEU A 21 1.675 13.921 -0.430 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.588 14.635 0.744 1.00 0.00 H new ATOM 0 HG LEU A 21 0.108 12.256 -1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.402 11.133 1.075 1.00 0.00 H new ATOM 0 HD12 LEU A 21 1.243 11.812 1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.051 12.641 1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.217 12.192 -0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -1.986 13.770 0.535 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.885 13.638 -1.236 1.00 0.00 H new ATOM 348 N GLY A 22 1.126 17.387 -0.999 1.00 0.00 N ATOM 349 CA GLY A 22 2.070 18.466 -1.231 1.00 0.00 C ATOM 350 C GLY A 22 3.509 17.947 -1.224 1.00 0.00 C ATOM 351 O GLY A 22 4.390 18.537 -1.848 1.00 0.00 O ATOM 0 H GLY A 22 0.389 17.603 -0.328 1.00 0.00 H new ATOM 0 HA2 GLY A 22 1.856 18.942 -2.188 1.00 0.00 H new ATOM 0 HA3 GLY A 22 1.951 19.229 -0.462 1.00 0.00 H new ATOM 355 N GLY A 23 3.704 16.846 -0.511 1.00 0.00 N ATOM 356 CA GLY A 23 5.020 16.240 -0.415 1.00 0.00 C ATOM 357 C GLY A 23 6.083 17.288 -0.074 1.00 0.00 C ATOM 358 O GLY A 23 5.767 18.464 0.100 1.00 0.00 O ATOM 0 H GLY A 23 2.972 16.359 0.005 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.012 15.463 0.350 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.271 15.756 -1.359 1.00 0.00 H new ATOM 362 N GLY A 24 7.320 16.822 0.012 1.00 0.00 N ATOM 363 CA GLY A 24 8.430 17.704 0.330 1.00 0.00 C ATOM 364 C GLY A 24 9.126 17.267 1.620 1.00 0.00 C ATOM 365 O GLY A 24 10.337 17.426 1.762 1.00 0.00 O ATOM 0 H GLY A 24 7.578 15.846 -0.133 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.146 17.704 -0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.068 18.726 0.437 1.00 0.00 H new ATOM 369 N GLY A 25 8.329 16.726 2.531 1.00 0.00 N ATOM 370 CA GLY A 25 8.852 16.265 3.805 1.00 0.00 C ATOM 371 C GLY A 25 7.757 15.592 4.635 1.00 0.00 C ATOM 372 O GLY A 25 7.524 15.968 5.783 1.00 0.00 O ATOM 0 H GLY A 25 7.324 16.597 2.411 1.00 0.00 H new ATOM 0 HA2 GLY A 25 9.668 15.563 3.635 1.00 0.00 H new ATOM 0 HA3 GLY A 25 9.267 17.107 4.358 1.00 0.00 H new ATOM 376 N ARG A 26 7.116 14.607 4.023 1.00 0.00 N ATOM 377 CA ARG A 26 6.052 13.877 4.692 1.00 0.00 C ATOM 378 C ARG A 26 5.855 12.509 4.037 1.00 0.00 C ATOM 379 O ARG A 26 6.235 11.485 4.603 1.00 0.00 O ATOM 380 CB ARG A 26 4.735 14.654 4.642 1.00 0.00 C ATOM 381 CG ARG A 26 4.335 15.146 6.034 1.00 0.00 C ATOM 382 CD ARG A 26 4.471 16.666 6.139 1.00 0.00 C ATOM 383 NE ARG A 26 3.158 17.309 5.912 1.00 0.00 N ATOM 384 CZ ARG A 26 2.949 18.631 5.969 1.00 0.00 C ATOM 385 NH1 ARG A 26 3.966 19.458 6.245 1.00 0.00 N ATOM 386 NH2 ARG A 26 1.723 19.126 5.749 1.00 0.00 N ATOM 0 H ARG A 26 7.313 14.297 3.071 1.00 0.00 H new ATOM 0 HA ARG A 26 6.343 13.746 5.734 1.00 0.00 H new ATOM 0 HB2 ARG A 26 4.836 15.504 3.967 1.00 0.00 H new ATOM 0 HB3 ARG A 26 3.948 14.017 4.238 1.00 0.00 H new ATOM 0 HG2 ARG A 26 3.306 14.854 6.245 1.00 0.00 H new ATOM 0 HG3 ARG A 26 4.963 14.668 6.787 1.00 0.00 H new ATOM 0 HD2 ARG A 26 4.853 16.938 7.123 1.00 0.00 H new ATOM 0 HD3 ARG A 26 5.193 17.026 5.406 1.00 0.00 H new ATOM 0 HE ARG A 26 2.362 16.708 5.699 1.00 0.00 H new ATOM 0 HH11 ARG A 26 4.899 19.081 6.412 1.00 0.00 H new ATOM 0 HH12 ARG A 26 3.807 20.465 6.288 1.00 0.00 H new ATOM 0 HH21 ARG A 26 0.949 18.496 5.538 1.00 0.00 H new ATOM 0 HH22 ARG A 26 1.564 20.133 5.792 1.00 0.00 H new ATOM 400 N ILE A 27 5.259 12.535 2.853 1.00 0.00 N ATOM 401 CA ILE A 27 5.007 11.309 2.115 1.00 0.00 C ATOM 402 C ILE A 27 6.279 10.459 2.096 1.00 0.00 C ATOM 403 O ILE A 27 6.210 9.231 2.094 1.00 0.00 O ATOM 404 CB ILE A 27 4.457 11.626 0.723 1.00 0.00 C ATOM 405 CG1 ILE A 27 5.353 12.629 -0.005 1.00 0.00 C ATOM 406 CG2 ILE A 27 3.006 12.105 0.802 1.00 0.00 C ATOM 407 CD1 ILE A 27 4.580 13.355 -1.108 1.00 0.00 C ATOM 0 H ILE A 27 4.944 13.386 2.387 1.00 0.00 H new ATOM 0 HA ILE A 27 4.237 10.718 2.610 1.00 0.00 H new ATOM 0 HB ILE A 27 4.461 10.707 0.137 1.00 0.00 H new ATOM 0 HG12 ILE A 27 5.746 13.355 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.209 12.111 -0.437 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.640 12.323 -0.201 1.00 0.00 H new ATOM 0 HG22 ILE A 27 2.390 11.326 1.252 1.00 0.00 H new ATOM 0 HG23 ILE A 27 2.953 13.007 1.412 1.00 0.00 H new ATOM 0 HD11 ILE A 27 5.240 14.062 -1.610 1.00 0.00 H new ATOM 0 HD12 ILE A 27 4.209 12.629 -1.831 1.00 0.00 H new ATOM 0 HD13 ILE A 27 3.739 13.892 -0.670 1.00 0.00 H new ATOM 419 N GLU A 28 7.412 11.147 2.082 1.00 0.00 N ATOM 420 CA GLU A 28 8.697 10.471 2.062 1.00 0.00 C ATOM 421 C GLU A 28 8.628 9.174 2.870 1.00 0.00 C ATOM 422 O GLU A 28 8.889 8.094 2.342 1.00 0.00 O ATOM 423 CB GLU A 28 9.806 11.384 2.587 1.00 0.00 C ATOM 424 CG GLU A 28 11.184 10.760 2.363 1.00 0.00 C ATOM 425 CD GLU A 28 12.197 11.815 1.911 1.00 0.00 C ATOM 426 OE1 GLU A 28 12.819 12.425 2.807 1.00 0.00 O ATOM 427 OE2 GLU A 28 12.326 11.987 0.679 1.00 0.00 O ATOM 0 H GLU A 28 7.466 12.166 2.084 1.00 0.00 H new ATOM 0 HA GLU A 28 8.936 10.220 1.029 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.755 12.350 2.085 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.656 11.570 3.651 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.529 10.291 3.284 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.113 9.973 1.612 1.00 0.00 H new ATOM 434 N GLU A 29 8.272 9.322 4.138 1.00 0.00 N ATOM 435 CA GLU A 29 8.164 8.176 5.025 1.00 0.00 C ATOM 436 C GLU A 29 7.243 7.117 4.414 1.00 0.00 C ATOM 437 O GLU A 29 7.708 6.071 3.963 1.00 0.00 O ATOM 438 CB GLU A 29 7.671 8.598 6.409 1.00 0.00 C ATOM 439 CG GLU A 29 8.110 7.595 7.478 1.00 0.00 C ATOM 440 CD GLU A 29 6.902 7.035 8.233 1.00 0.00 C ATOM 441 OE1 GLU A 29 6.378 7.776 9.093 1.00 0.00 O ATOM 442 OE2 GLU A 29 6.531 5.880 7.935 1.00 0.00 O ATOM 0 H GLU A 29 8.055 10.219 4.572 1.00 0.00 H new ATOM 0 HA GLU A 29 9.156 7.741 5.147 1.00 0.00 H new ATOM 0 HB2 GLU A 29 8.060 9.587 6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.584 8.676 6.403 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.662 6.779 7.012 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.789 8.079 8.179 1.00 0.00 H new ATOM 449 N LEU A 30 5.955 7.426 4.419 1.00 0.00 N ATOM 450 CA LEU A 30 4.965 6.514 3.871 1.00 0.00 C ATOM 451 C LEU A 30 5.454 5.991 2.519 1.00 0.00 C ATOM 452 O LEU A 30 5.283 4.813 2.207 1.00 0.00 O ATOM 453 CB LEU A 30 3.592 7.188 3.810 1.00 0.00 C ATOM 454 CG LEU A 30 3.361 8.133 2.630 1.00 0.00 C ATOM 455 CD1 LEU A 30 3.334 7.363 1.308 1.00 0.00 C ATOM 456 CD2 LEU A 30 2.094 8.966 2.835 1.00 0.00 C ATOM 0 H LEU A 30 5.574 8.295 4.794 1.00 0.00 H new ATOM 0 HA LEU A 30 4.841 5.649 4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.829 6.411 3.782 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.443 7.748 4.733 1.00 0.00 H new ATOM 0 HG LEU A 30 4.199 8.829 2.580 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.168 8.058 0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.286 6.852 1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.528 6.629 1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.953 9.630 1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.233 8.303 2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.192 9.560 3.744 1.00 0.00 H new ATOM 468 N LYS A 31 6.051 6.891 1.753 1.00 0.00 N ATOM 469 CA LYS A 31 6.565 6.534 0.441 1.00 0.00 C ATOM 470 C LYS A 31 7.597 5.415 0.590 1.00 0.00 C ATOM 471 O LYS A 31 7.666 4.513 -0.245 1.00 0.00 O ATOM 472 CB LYS A 31 7.102 7.773 -0.280 1.00 0.00 C ATOM 473 CG LYS A 31 6.044 8.365 -1.213 1.00 0.00 C ATOM 474 CD LYS A 31 6.688 8.948 -2.472 1.00 0.00 C ATOM 475 CE LYS A 31 7.672 10.065 -2.118 1.00 0.00 C ATOM 476 NZ LYS A 31 8.507 10.411 -3.289 1.00 0.00 N ATOM 0 H LYS A 31 6.191 7.867 2.015 1.00 0.00 H new ATOM 0 HA LYS A 31 5.764 6.148 -0.190 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.406 8.521 0.452 1.00 0.00 H new ATOM 0 HB3 LYS A 31 7.991 7.508 -0.853 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.327 7.593 -1.491 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.488 9.144 -0.691 1.00 0.00 H new ATOM 0 HD2 LYS A 31 7.208 8.160 -3.017 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.914 9.337 -3.134 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.125 10.946 -1.781 1.00 0.00 H new ATOM 0 HE3 LYS A 31 8.308 9.749 -1.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 9.169 11.171 -3.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 9.043 9.573 -3.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.897 10.733 -4.067 1.00 0.00 H new ATOM 490 N LYS A 32 8.374 5.507 1.659 1.00 0.00 N ATOM 491 CA LYS A 32 9.399 4.513 1.928 1.00 0.00 C ATOM 492 C LYS A 32 8.744 3.139 2.076 1.00 0.00 C ATOM 493 O LYS A 32 9.153 2.179 1.425 1.00 0.00 O ATOM 494 CB LYS A 32 10.242 4.927 3.136 1.00 0.00 C ATOM 495 CG LYS A 32 10.770 6.353 2.974 1.00 0.00 C ATOM 496 CD LYS A 32 12.286 6.404 3.178 1.00 0.00 C ATOM 497 CE LYS A 32 12.816 7.828 3.001 1.00 0.00 C ATOM 498 NZ LYS A 32 13.975 7.839 2.080 1.00 0.00 N ATOM 0 H LYS A 32 8.314 6.255 2.350 1.00 0.00 H new ATOM 0 HA LYS A 32 10.094 4.446 1.091 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.642 4.859 4.043 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.078 4.237 3.254 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.521 6.726 1.981 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.281 7.010 3.693 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.535 6.041 4.175 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.775 5.739 2.466 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.027 8.470 2.610 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.109 8.236 3.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 14.322 8.813 1.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.733 7.242 2.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.685 7.469 1.152 1.00 0.00 H new ATOM 512 N LYS A 33 7.738 3.088 2.938 1.00 0.00 N ATOM 513 CA LYS A 33 7.023 1.847 3.180 1.00 0.00 C ATOM 514 C LYS A 33 6.249 1.454 1.920 1.00 0.00 C ATOM 515 O LYS A 33 6.241 0.288 1.530 1.00 0.00 O ATOM 516 CB LYS A 33 6.146 1.969 4.428 1.00 0.00 C ATOM 517 CG LYS A 33 6.976 2.388 5.643 1.00 0.00 C ATOM 518 CD LYS A 33 6.596 1.567 6.876 1.00 0.00 C ATOM 519 CE LYS A 33 7.790 0.755 7.384 1.00 0.00 C ATOM 520 NZ LYS A 33 7.591 0.371 8.799 1.00 0.00 N ATOM 0 H LYS A 33 7.402 3.886 3.477 1.00 0.00 H new ATOM 0 HA LYS A 33 7.724 1.038 3.388 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.357 2.700 4.252 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.658 1.015 4.628 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.036 2.256 5.427 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.821 3.448 5.846 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.242 2.231 7.664 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.773 0.896 6.631 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.916 -0.139 6.773 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.704 1.340 7.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.410 -0.179 9.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.493 1.228 9.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.730 -0.206 8.884 1.00 0.00 H new ATOM 534 N TRP A 34 5.618 2.452 1.319 1.00 0.00 N ATOM 535 CA TRP A 34 4.842 2.226 0.110 1.00 0.00 C ATOM 536 C TRP A 34 5.727 1.471 -0.884 1.00 0.00 C ATOM 537 O TRP A 34 5.222 0.768 -1.758 1.00 0.00 O ATOM 538 CB TRP A 34 4.303 3.544 -0.450 1.00 0.00 C ATOM 539 CG TRP A 34 4.348 3.637 -1.975 1.00 0.00 C ATOM 540 CD1 TRP A 34 5.392 3.957 -2.752 1.00 0.00 C ATOM 541 CD2 TRP A 34 3.254 3.391 -2.884 1.00 0.00 C ATOM 542 NE1 TRP A 34 5.052 3.937 -4.090 1.00 0.00 N ATOM 543 CE2 TRP A 34 3.711 3.581 -4.173 1.00 0.00 C ATOM 544 CE3 TRP A 34 1.923 3.020 -2.627 1.00 0.00 C ATOM 545 CZ2 TRP A 34 2.902 3.424 -5.305 1.00 0.00 C ATOM 546 CZ3 TRP A 34 1.127 2.867 -3.769 1.00 0.00 C ATOM 547 CH2 TRP A 34 1.572 3.055 -5.072 1.00 0.00 C ATOM 0 H TRP A 34 5.628 3.418 1.646 1.00 0.00 H new ATOM 0 HA TRP A 34 3.962 1.620 0.323 1.00 0.00 H new ATOM 0 HB2 TRP A 34 3.273 3.673 -0.119 1.00 0.00 H new ATOM 0 HB3 TRP A 34 4.879 4.368 -0.029 1.00 0.00 H new ATOM 0 HD1 TRP A 34 6.376 4.200 -2.378 1.00 0.00 H new ATOM 0 HE1 TRP A 34 5.671 4.145 -4.873 1.00 0.00 H new ATOM 0 HE3 TRP A 34 1.544 2.865 -1.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 3.283 3.579 -6.303 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 0.095 2.583 -3.627 1.00 0.00 H new ATOM 0 HH2 TRP A 34 0.894 2.917 -5.902 1.00 0.00 H new ATOM 558 N GLU A 35 7.030 1.643 -0.718 1.00 0.00 N ATOM 559 CA GLU A 35 7.989 0.987 -1.590 1.00 0.00 C ATOM 560 C GLU A 35 8.180 -0.471 -1.168 1.00 0.00 C ATOM 561 O GLU A 35 8.338 -1.350 -2.013 1.00 0.00 O ATOM 562 CB GLU A 35 9.324 1.735 -1.599 1.00 0.00 C ATOM 563 CG GLU A 35 9.625 2.303 -2.988 1.00 0.00 C ATOM 564 CD GLU A 35 11.082 2.045 -3.381 1.00 0.00 C ATOM 565 OE1 GLU A 35 11.957 2.342 -2.540 1.00 0.00 O ATOM 566 OE2 GLU A 35 11.286 1.556 -4.512 1.00 0.00 O ATOM 0 H GLU A 35 7.444 2.228 0.008 1.00 0.00 H new ATOM 0 HA GLU A 35 7.595 1.002 -2.606 1.00 0.00 H new ATOM 0 HB2 GLU A 35 9.296 2.544 -0.869 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.125 1.060 -1.297 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.960 1.849 -3.723 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.426 3.375 -2.998 1.00 0.00 H new ATOM 573 N GLU A 36 8.159 -0.682 0.140 1.00 0.00 N ATOM 574 CA GLU A 36 8.329 -2.018 0.685 1.00 0.00 C ATOM 575 C GLU A 36 6.987 -2.753 0.715 1.00 0.00 C ATOM 576 O GLU A 36 6.947 -3.982 0.719 1.00 0.00 O ATOM 577 CB GLU A 36 8.958 -1.967 2.078 1.00 0.00 C ATOM 578 CG GLU A 36 9.847 -0.731 2.232 1.00 0.00 C ATOM 579 CD GLU A 36 11.097 -1.055 3.055 1.00 0.00 C ATOM 580 OE1 GLU A 36 10.930 -1.710 4.107 1.00 0.00 O ATOM 581 OE2 GLU A 36 12.190 -0.641 2.613 1.00 0.00 O ATOM 0 H GLU A 36 8.027 0.050 0.838 1.00 0.00 H new ATOM 0 HA GLU A 36 9.009 -2.570 0.036 1.00 0.00 H new ATOM 0 HB2 GLU A 36 8.174 -1.952 2.835 1.00 0.00 H new ATOM 0 HB3 GLU A 36 9.548 -2.868 2.248 1.00 0.00 H new ATOM 0 HG2 GLU A 36 10.140 -0.364 1.248 1.00 0.00 H new ATOM 0 HG3 GLU A 36 9.285 0.068 2.716 1.00 0.00 H new ATOM 588 N LEU A 37 5.920 -1.968 0.738 1.00 0.00 N ATOM 589 CA LEU A 37 4.579 -2.528 0.769 1.00 0.00 C ATOM 590 C LEU A 37 4.217 -3.052 -0.623 1.00 0.00 C ATOM 591 O LEU A 37 3.935 -4.237 -0.790 1.00 0.00 O ATOM 592 CB LEU A 37 3.583 -1.505 1.319 1.00 0.00 C ATOM 593 CG LEU A 37 2.371 -1.207 0.434 1.00 0.00 C ATOM 594 CD1 LEU A 37 1.699 -2.500 -0.031 1.00 0.00 C ATOM 595 CD2 LEU A 37 1.388 -0.275 1.146 1.00 0.00 C ATOM 0 H LEU A 37 5.957 -0.949 0.736 1.00 0.00 H new ATOM 0 HA LEU A 37 4.537 -3.377 1.451 1.00 0.00 H new ATOM 0 HB2 LEU A 37 3.224 -1.860 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.115 -0.571 1.500 1.00 0.00 H new ATOM 0 HG LEU A 37 2.720 -0.687 -0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.841 -2.259 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.411 -3.095 -0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.366 -3.069 0.837 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.536 -0.079 0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.041 -0.746 2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.886 0.665 1.385 1.00 0.00 H new ATOM 607 N LYS A 38 4.238 -2.142 -1.585 1.00 0.00 N ATOM 608 CA LYS A 38 3.916 -2.497 -2.958 1.00 0.00 C ATOM 609 C LYS A 38 4.747 -3.713 -3.373 1.00 0.00 C ATOM 610 O LYS A 38 4.306 -4.519 -4.191 1.00 0.00 O ATOM 611 CB LYS A 38 4.092 -1.288 -3.879 1.00 0.00 C ATOM 612 CG LYS A 38 3.942 -1.692 -5.347 1.00 0.00 C ATOM 613 CD LYS A 38 4.935 -0.931 -6.229 1.00 0.00 C ATOM 614 CE LYS A 38 4.656 0.572 -6.198 1.00 0.00 C ATOM 615 NZ LYS A 38 3.730 0.951 -7.289 1.00 0.00 N ATOM 0 H LYS A 38 4.473 -1.160 -1.442 1.00 0.00 H new ATOM 0 HA LYS A 38 2.868 -2.783 -3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.353 -0.526 -3.630 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.074 -0.844 -3.719 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.105 -2.765 -5.451 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.924 -1.490 -5.681 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.952 -1.123 -5.887 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.870 -1.295 -7.254 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.225 0.848 -5.235 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.591 1.123 -6.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.201 1.803 -7.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 4.274 1.145 -8.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.064 0.172 -7.466 1.00 0.00 H new ATOM 629 N LYS A 39 5.933 -3.807 -2.791 1.00 0.00 N ATOM 630 CA LYS A 39 6.828 -4.911 -3.090 1.00 0.00 C ATOM 631 C LYS A 39 6.266 -6.198 -2.484 1.00 0.00 C ATOM 632 O LYS A 39 6.539 -7.291 -2.975 1.00 0.00 O ATOM 633 CB LYS A 39 8.251 -4.585 -2.633 1.00 0.00 C ATOM 634 CG LYS A 39 9.270 -5.502 -3.313 1.00 0.00 C ATOM 635 CD LYS A 39 10.679 -4.912 -3.235 1.00 0.00 C ATOM 636 CE LYS A 39 11.662 -5.726 -4.077 1.00 0.00 C ATOM 637 NZ LYS A 39 12.068 -6.955 -3.358 1.00 0.00 N ATOM 0 H LYS A 39 6.295 -3.136 -2.113 1.00 0.00 H new ATOM 0 HA LYS A 39 6.892 -5.069 -4.167 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.482 -3.545 -2.864 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.323 -4.695 -1.551 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.256 -6.483 -2.837 1.00 0.00 H new ATOM 0 HG3 LYS A 39 8.991 -5.650 -4.356 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.664 -3.879 -3.584 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.012 -4.893 -2.197 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.202 -5.990 -5.029 1.00 0.00 H new ATOM 0 HE3 LYS A 39 12.541 -5.123 -4.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.736 -7.496 -3.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.526 -6.697 -2.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 11.228 -7.537 -3.164 1.00 0.00 H new ATOM 651 N LYS A 40 5.490 -6.024 -1.424 1.00 0.00 N ATOM 652 CA LYS A 40 4.886 -7.158 -0.744 1.00 0.00 C ATOM 653 C LYS A 40 3.677 -7.642 -1.546 1.00 0.00 C ATOM 654 O LYS A 40 3.503 -8.843 -1.750 1.00 0.00 O ATOM 655 CB LYS A 40 4.560 -6.800 0.707 1.00 0.00 C ATOM 656 CG LYS A 40 5.642 -7.318 1.656 1.00 0.00 C ATOM 657 CD LYS A 40 5.943 -6.297 2.755 1.00 0.00 C ATOM 658 CE LYS A 40 7.443 -6.232 3.047 1.00 0.00 C ATOM 659 NZ LYS A 40 7.777 -7.055 4.231 1.00 0.00 N ATOM 0 H LYS A 40 5.266 -5.115 -1.019 1.00 0.00 H new ATOM 0 HA LYS A 40 5.588 -7.990 -0.692 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.471 -5.718 0.807 1.00 0.00 H new ATOM 0 HB3 LYS A 40 3.595 -7.226 0.982 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.317 -8.256 2.106 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.551 -7.532 1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.585 -5.313 2.450 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.403 -6.565 3.663 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.004 -6.585 2.181 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.741 -5.198 3.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.799 -7.000 4.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.256 -6.700 5.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.511 -8.044 4.052 1.00 0.00 H new ATOM 673 N ILE A 41 2.871 -6.683 -1.978 1.00 0.00 N ATOM 674 CA ILE A 41 1.682 -6.998 -2.753 1.00 0.00 C ATOM 675 C ILE A 41 2.095 -7.679 -4.059 1.00 0.00 C ATOM 676 O ILE A 41 1.269 -8.297 -4.729 1.00 0.00 O ATOM 677 CB ILE A 41 0.829 -5.743 -2.956 1.00 0.00 C ATOM 678 CG1 ILE A 41 0.639 -4.990 -1.638 1.00 0.00 C ATOM 679 CG2 ILE A 41 -0.508 -6.091 -3.614 1.00 0.00 C ATOM 680 CD1 ILE A 41 -0.456 -3.929 -1.765 1.00 0.00 C ATOM 0 H ILE A 41 3.018 -5.688 -1.806 1.00 0.00 H new ATOM 0 HA ILE A 41 1.050 -7.703 -2.213 1.00 0.00 H new ATOM 0 HB ILE A 41 1.359 -5.075 -3.635 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.378 -5.694 -0.847 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.577 -4.517 -1.347 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.095 -5.182 -3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.327 -6.552 -4.585 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.056 -6.787 -2.979 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.571 -3.409 -0.814 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.181 -3.213 -2.540 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.398 -4.408 -2.032 1.00 0.00 H new ATOM 692 N GLU A 42 3.373 -7.542 -4.382 1.00 0.00 N ATOM 693 CA GLU A 42 3.905 -8.137 -5.596 1.00 0.00 C ATOM 694 C GLU A 42 4.124 -9.639 -5.399 1.00 0.00 C ATOM 695 O GLU A 42 3.638 -10.449 -6.188 1.00 0.00 O ATOM 696 CB GLU A 42 5.201 -7.445 -6.022 1.00 0.00 C ATOM 697 CG GLU A 42 4.962 -6.523 -7.220 1.00 0.00 C ATOM 698 CD GLU A 42 6.271 -6.229 -7.955 1.00 0.00 C ATOM 699 OE1 GLU A 42 7.274 -5.980 -7.253 1.00 0.00 O ATOM 700 OE2 GLU A 42 6.239 -6.262 -9.205 1.00 0.00 O ATOM 0 H GLU A 42 4.055 -7.028 -3.824 1.00 0.00 H new ATOM 0 HA GLU A 42 3.177 -7.998 -6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.600 -6.868 -5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.950 -8.194 -6.279 1.00 0.00 H new ATOM 0 HG2 GLU A 42 4.253 -6.987 -7.905 1.00 0.00 H new ATOM 0 HG3 GLU A 42 4.513 -5.589 -6.881 1.00 0.00 H new ATOM 707 N GLU A 43 4.856 -9.965 -4.345 1.00 0.00 N ATOM 708 CA GLU A 43 5.145 -11.354 -4.035 1.00 0.00 C ATOM 709 C GLU A 43 3.908 -12.035 -3.444 1.00 0.00 C ATOM 710 O GLU A 43 3.882 -13.254 -3.287 1.00 0.00 O ATOM 711 CB GLU A 43 6.340 -11.467 -3.086 1.00 0.00 C ATOM 712 CG GLU A 43 7.409 -12.399 -3.659 1.00 0.00 C ATOM 713 CD GLU A 43 8.814 -11.868 -3.367 1.00 0.00 C ATOM 714 OE1 GLU A 43 9.077 -10.713 -3.764 1.00 0.00 O ATOM 715 OE2 GLU A 43 9.592 -12.629 -2.753 1.00 0.00 O ATOM 0 H GLU A 43 5.258 -9.290 -3.694 1.00 0.00 H new ATOM 0 HA GLU A 43 5.409 -11.865 -4.961 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.768 -10.479 -2.915 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.006 -11.842 -2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 43 7.296 -13.395 -3.230 1.00 0.00 H new ATOM 0 HG3 GLU A 43 7.271 -12.498 -4.736 1.00 0.00 H new ATOM 722 N LEU A 44 2.915 -11.216 -3.129 1.00 0.00 N ATOM 723 CA LEU A 44 1.679 -11.723 -2.558 1.00 0.00 C ATOM 724 C LEU A 44 1.269 -13.000 -3.295 1.00 0.00 C ATOM 725 O LEU A 44 0.702 -12.937 -4.386 1.00 0.00 O ATOM 726 CB LEU A 44 0.601 -10.638 -2.563 1.00 0.00 C ATOM 727 CG LEU A 44 0.384 -9.903 -1.239 1.00 0.00 C ATOM 728 CD1 LEU A 44 -0.803 -8.943 -1.332 1.00 0.00 C ATOM 729 CD2 LEU A 44 0.230 -10.894 -0.082 1.00 0.00 C ATOM 0 H LEU A 44 2.942 -10.205 -3.259 1.00 0.00 H new ATOM 0 HA LEU A 44 1.824 -11.990 -1.511 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.857 -9.903 -3.326 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.343 -11.093 -2.862 1.00 0.00 H new ATOM 0 HG LEU A 44 1.269 -9.301 -1.033 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.935 -8.434 -0.377 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.615 -8.206 -2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.706 -9.504 -1.572 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.077 -10.347 0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.628 -11.540 -0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.131 -11.502 -0.001 1.00 0.00 H new ATOM 769 N GLU A 49 0.275 -14.217 4.012 1.00 0.00 N ATOM 770 CA GLU A 49 0.664 -13.241 5.015 1.00 0.00 C ATOM 771 C GLU A 49 0.266 -11.833 4.567 1.00 0.00 C ATOM 772 O GLU A 49 0.927 -10.856 4.919 1.00 0.00 O ATOM 773 CB GLU A 49 2.163 -13.320 5.306 1.00 0.00 C ATOM 774 CG GLU A 49 2.448 -14.288 6.456 1.00 0.00 C ATOM 775 CD GLU A 49 3.899 -14.167 6.928 1.00 0.00 C ATOM 776 OE1 GLU A 49 4.784 -14.605 6.160 1.00 0.00 O ATOM 777 OE2 GLU A 49 4.090 -13.639 8.045 1.00 0.00 O ATOM 0 HA GLU A 49 0.136 -13.470 5.941 1.00 0.00 H new ATOM 0 HB2 GLU A 49 2.694 -13.646 4.412 1.00 0.00 H new ATOM 0 HB3 GLU A 49 2.541 -12.329 5.558 1.00 0.00 H new ATOM 0 HG2 GLU A 49 1.773 -14.080 7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.251 -15.310 6.133 1.00 0.00 H new ATOM 784 N VAL A 50 -0.812 -11.772 3.799 1.00 0.00 N ATOM 785 CA VAL A 50 -1.304 -10.500 3.300 1.00 0.00 C ATOM 786 C VAL A 50 -1.598 -9.573 4.482 1.00 0.00 C ATOM 787 O VAL A 50 -1.437 -8.358 4.377 1.00 0.00 O ATOM 788 CB VAL A 50 -2.523 -10.727 2.402 1.00 0.00 C ATOM 789 CG1 VAL A 50 -2.991 -9.413 1.772 1.00 0.00 C ATOM 790 CG2 VAL A 50 -2.224 -11.775 1.328 1.00 0.00 C ATOM 0 H VAL A 50 -1.358 -12.584 3.510 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.548 -10.013 2.684 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.333 -11.107 3.024 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.858 -9.602 1.139 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -3.262 -8.709 2.558 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.186 -8.992 1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.106 -11.918 0.703 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.393 -11.436 0.710 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.960 -12.719 1.804 1.00 0.00 H new ATOM 800 N LYS A 51 -2.024 -10.181 5.579 1.00 0.00 N ATOM 801 CA LYS A 51 -2.341 -9.426 6.778 1.00 0.00 C ATOM 802 C LYS A 51 -1.340 -8.280 6.933 1.00 0.00 C ATOM 803 O LYS A 51 -1.680 -7.220 7.457 1.00 0.00 O ATOM 804 CB LYS A 51 -2.408 -10.353 7.994 1.00 0.00 C ATOM 805 CG LYS A 51 -3.785 -10.289 8.657 1.00 0.00 C ATOM 806 CD LYS A 51 -4.628 -11.510 8.287 1.00 0.00 C ATOM 807 CE LYS A 51 -5.629 -11.171 7.181 1.00 0.00 C ATOM 808 NZ LYS A 51 -5.481 -12.104 6.042 1.00 0.00 N ATOM 0 H LYS A 51 -2.157 -11.189 5.662 1.00 0.00 H new ATOM 0 HA LYS A 51 -3.331 -8.977 6.694 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.195 -11.377 7.687 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.640 -10.070 8.714 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.669 -10.237 9.740 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.300 -9.380 8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.977 -12.319 7.957 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.161 -11.868 9.168 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.645 -11.225 7.573 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.472 -10.147 6.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.168 -11.859 5.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.517 -12.033 5.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -5.653 -13.077 6.366 1.00 0.00 H new ATOM 822 N LYS A 52 -0.125 -8.530 6.468 1.00 0.00 N ATOM 823 CA LYS A 52 0.929 -7.532 6.549 1.00 0.00 C ATOM 824 C LYS A 52 0.663 -6.432 5.518 1.00 0.00 C ATOM 825 O LYS A 52 0.534 -5.262 5.874 1.00 0.00 O ATOM 826 CB LYS A 52 2.303 -8.191 6.405 1.00 0.00 C ATOM 827 CG LYS A 52 2.997 -8.313 7.763 1.00 0.00 C ATOM 828 CD LYS A 52 3.765 -9.631 7.870 1.00 0.00 C ATOM 829 CE LYS A 52 4.888 -9.529 8.904 1.00 0.00 C ATOM 830 NZ LYS A 52 4.804 -10.646 9.871 1.00 0.00 N ATOM 0 H LYS A 52 0.154 -9.410 6.033 1.00 0.00 H new ATOM 0 HA LYS A 52 0.930 -7.057 7.530 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.191 -9.179 5.959 1.00 0.00 H new ATOM 0 HB3 LYS A 52 2.923 -7.604 5.727 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.682 -7.477 7.902 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.256 -8.254 8.560 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.081 -10.433 8.148 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.183 -9.892 6.898 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.855 -9.547 8.402 1.00 0.00 H new ATOM 0 HE3 LYS A 52 4.820 -8.578 9.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.573 -10.562 10.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 3.888 -10.612 10.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.892 -11.550 9.365 1.00 0.00 H new ATOM 844 N VAL A 53 0.589 -6.848 4.262 1.00 0.00 N ATOM 845 CA VAL A 53 0.341 -5.913 3.178 1.00 0.00 C ATOM 846 C VAL A 53 -0.725 -4.906 3.614 1.00 0.00 C ATOM 847 O VAL A 53 -0.444 -3.715 3.740 1.00 0.00 O ATOM 848 CB VAL A 53 -0.041 -6.674 1.907 1.00 0.00 C ATOM 849 CG1 VAL A 53 -1.020 -5.865 1.056 1.00 0.00 C ATOM 850 CG2 VAL A 53 1.204 -7.053 1.102 1.00 0.00 C ATOM 0 H VAL A 53 0.696 -7.820 3.971 1.00 0.00 H new ATOM 0 HA VAL A 53 1.245 -5.350 2.945 1.00 0.00 H new ATOM 0 HB VAL A 53 -0.541 -7.595 2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.275 -6.429 0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.925 -5.669 1.630 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.559 -4.919 0.771 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.906 -7.593 0.203 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.744 -6.149 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.850 -7.687 1.709 1.00 0.00 H new ATOM 860 N GLU A 54 -1.926 -5.420 3.832 1.00 0.00 N ATOM 861 CA GLU A 54 -3.035 -4.580 4.251 1.00 0.00 C ATOM 862 C GLU A 54 -2.584 -3.611 5.346 1.00 0.00 C ATOM 863 O GLU A 54 -2.552 -2.400 5.133 1.00 0.00 O ATOM 864 CB GLU A 54 -4.218 -5.428 4.722 1.00 0.00 C ATOM 865 CG GLU A 54 -4.503 -6.566 3.740 1.00 0.00 C ATOM 866 CD GLU A 54 -5.986 -6.607 3.364 1.00 0.00 C ATOM 867 OE1 GLU A 54 -6.769 -7.111 4.199 1.00 0.00 O ATOM 868 OE2 GLU A 54 -6.302 -6.136 2.251 1.00 0.00 O ATOM 0 H GLU A 54 -2.156 -6.408 3.726 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.368 -3.997 3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -4.005 -5.839 5.709 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -5.103 -4.800 4.823 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.900 -6.436 2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.210 -7.517 4.185 1.00 0.00 H new ATOM 875 N GLU A 55 -2.247 -4.181 6.493 1.00 0.00 N ATOM 876 CA GLU A 55 -1.798 -3.383 7.622 1.00 0.00 C ATOM 877 C GLU A 55 -0.797 -2.323 7.158 1.00 0.00 C ATOM 878 O GLU A 55 -0.706 -1.249 7.750 1.00 0.00 O ATOM 879 CB GLU A 55 -1.193 -4.267 8.712 1.00 0.00 C ATOM 880 CG GLU A 55 -2.009 -4.180 10.004 1.00 0.00 C ATOM 881 CD GLU A 55 -1.093 -4.120 11.228 1.00 0.00 C ATOM 882 OE1 GLU A 55 -0.170 -3.276 11.206 1.00 0.00 O ATOM 883 OE2 GLU A 55 -1.336 -4.918 12.159 1.00 0.00 O ATOM 0 H GLU A 55 -2.276 -5.186 6.665 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.663 -2.876 8.050 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.158 -5.301 8.369 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -0.165 -3.960 8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -2.645 -3.295 9.978 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.668 -5.045 10.081 1.00 0.00 H new ATOM 890 N GLU A 56 -0.071 -2.662 6.103 1.00 0.00 N ATOM 891 CA GLU A 56 0.920 -1.753 5.553 1.00 0.00 C ATOM 892 C GLU A 56 0.235 -0.642 4.753 1.00 0.00 C ATOM 893 O GLU A 56 0.530 0.537 4.944 1.00 0.00 O ATOM 894 CB GLU A 56 1.935 -2.505 4.689 1.00 0.00 C ATOM 895 CG GLU A 56 3.298 -1.811 4.713 1.00 0.00 C ATOM 896 CD GLU A 56 3.764 -1.568 6.151 1.00 0.00 C ATOM 897 OE1 GLU A 56 4.154 -2.565 6.797 1.00 0.00 O ATOM 898 OE2 GLU A 56 3.717 -0.392 6.571 1.00 0.00 O ATOM 0 H GLU A 56 -0.149 -3.554 5.614 1.00 0.00 H new ATOM 0 HA GLU A 56 1.464 -1.296 6.380 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.038 -3.528 5.050 1.00 0.00 H new ATOM 0 HB3 GLU A 56 1.571 -2.564 3.663 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.031 -2.423 4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.236 -0.861 4.181 1.00 0.00 H new ATOM 905 N VAL A 57 -0.664 -1.058 3.874 1.00 0.00 N ATOM 906 CA VAL A 57 -1.393 -0.113 3.044 1.00 0.00 C ATOM 907 C VAL A 57 -2.275 0.764 3.934 1.00 0.00 C ATOM 908 O VAL A 57 -2.637 1.877 3.551 1.00 0.00 O ATOM 909 CB VAL A 57 -2.183 -0.861 1.970 1.00 0.00 C ATOM 910 CG1 VAL A 57 -2.650 0.092 0.868 1.00 0.00 C ATOM 911 CG2 VAL A 57 -1.362 -2.013 1.386 1.00 0.00 C ATOM 0 H VAL A 57 -0.905 -2.037 3.718 1.00 0.00 H new ATOM 0 HA VAL A 57 -0.703 0.547 2.519 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.068 -1.286 2.443 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -3.209 -0.466 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.290 0.861 1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.784 0.561 0.401 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.948 -2.528 0.625 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.450 -1.619 0.937 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.102 -2.714 2.180 1.00 0.00 H new ATOM 921 N LYS A 58 -2.596 0.232 5.103 1.00 0.00 N ATOM 922 CA LYS A 58 -3.429 0.953 6.051 1.00 0.00 C ATOM 923 C LYS A 58 -2.677 2.190 6.548 1.00 0.00 C ATOM 924 O LYS A 58 -3.181 3.307 6.455 1.00 0.00 O ATOM 925 CB LYS A 58 -3.893 0.022 7.173 1.00 0.00 C ATOM 926 CG LYS A 58 -5.260 0.451 7.711 1.00 0.00 C ATOM 927 CD LYS A 58 -6.331 -0.590 7.376 1.00 0.00 C ATOM 928 CE LYS A 58 -7.727 -0.071 7.729 1.00 0.00 C ATOM 929 NZ LYS A 58 -8.720 -1.167 7.661 1.00 0.00 N ATOM 0 H LYS A 58 -2.294 -0.691 5.416 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.339 1.307 5.566 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.949 -1.001 6.802 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.162 0.028 7.981 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.204 0.586 8.791 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.537 1.414 7.283 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.287 -0.834 6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.132 -1.511 7.923 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.719 0.359 8.731 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.009 0.727 7.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -9.662 -0.798 7.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.739 -1.559 6.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.458 -1.915 8.334 1.00 0.00 H new ATOM 943 N LYS A 59 -1.482 1.946 7.066 1.00 0.00 N ATOM 944 CA LYS A 59 -0.654 3.025 7.577 1.00 0.00 C ATOM 945 C LYS A 59 -0.716 4.212 6.613 1.00 0.00 C ATOM 946 O LYS A 59 -0.694 5.365 7.039 1.00 0.00 O ATOM 947 CB LYS A 59 0.766 2.528 7.851 1.00 0.00 C ATOM 948 CG LYS A 59 1.532 3.514 8.736 1.00 0.00 C ATOM 949 CD LYS A 59 3.031 3.472 8.435 1.00 0.00 C ATOM 950 CE LYS A 59 3.765 2.568 9.428 1.00 0.00 C ATOM 951 NZ LYS A 59 4.567 3.379 10.370 1.00 0.00 N ATOM 0 H LYS A 59 -1.068 1.017 7.143 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.035 3.374 8.537 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.726 1.553 8.337 1.00 0.00 H new ATOM 0 HB3 LYS A 59 1.296 2.393 6.908 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.153 4.523 8.574 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.362 3.274 9.786 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.192 3.109 7.420 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.443 4.480 8.482 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.045 1.964 9.980 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.414 1.877 8.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.059 2.751 11.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 5.267 3.937 9.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.940 4.021 10.896 1.00 0.00 H new ATOM 965 N LEU A 60 -0.792 3.887 5.330 1.00 0.00 N ATOM 966 CA LEU A 60 -0.857 4.910 4.302 1.00 0.00 C ATOM 967 C LEU A 60 -2.200 5.637 4.396 1.00 0.00 C ATOM 968 O LEU A 60 -2.259 6.785 4.833 1.00 0.00 O ATOM 969 CB LEU A 60 -0.580 4.304 2.924 1.00 0.00 C ATOM 970 CG LEU A 60 0.873 4.348 2.451 1.00 0.00 C ATOM 971 CD1 LEU A 60 1.415 2.938 2.213 1.00 0.00 C ATOM 972 CD2 LEU A 60 1.020 5.237 1.213 1.00 0.00 C ATOM 0 H LEU A 60 -0.810 2.929 4.980 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.078 5.657 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.906 3.264 2.934 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.196 4.824 2.190 1.00 0.00 H new ATOM 0 HG LEU A 60 1.476 4.795 3.241 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.450 2.998 1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.367 2.368 3.141 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.815 2.441 1.451 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.063 5.251 0.897 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.402 4.843 0.406 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.700 6.251 1.453 1.00 0.00 H new ATOM 984 N GLU A 61 -3.246 4.939 3.979 1.00 0.00 N ATOM 985 CA GLU A 61 -4.584 5.504 4.010 1.00 0.00 C ATOM 986 C GLU A 61 -4.756 6.390 5.245 1.00 0.00 C ATOM 987 O GLU A 61 -5.099 7.566 5.126 1.00 0.00 O ATOM 988 CB GLU A 61 -5.644 4.402 3.974 1.00 0.00 C ATOM 989 CG GLU A 61 -5.881 3.915 2.543 1.00 0.00 C ATOM 990 CD GLU A 61 -7.321 4.187 2.103 1.00 0.00 C ATOM 991 OE1 GLU A 61 -8.209 4.093 2.977 1.00 0.00 O ATOM 992 OE2 GLU A 61 -7.501 4.480 0.901 1.00 0.00 O ATOM 0 H GLU A 61 -3.194 3.987 3.618 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.719 6.122 3.122 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -5.327 3.567 4.598 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.578 4.777 4.394 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.189 4.415 1.865 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.673 2.847 2.479 1.00 0.00 H new ATOM 999 N GLU A 62 -4.512 5.794 6.402 1.00 0.00 N ATOM 1000 CA GLU A 62 -4.636 6.515 7.657 1.00 0.00 C ATOM 1001 C GLU A 62 -3.870 7.838 7.587 1.00 0.00 C ATOM 1002 O GLU A 62 -4.468 8.910 7.666 1.00 0.00 O ATOM 1003 CB GLU A 62 -4.150 5.661 8.830 1.00 0.00 C ATOM 1004 CG GLU A 62 -5.322 5.218 9.708 1.00 0.00 C ATOM 1005 CD GLU A 62 -5.769 3.799 9.350 1.00 0.00 C ATOM 1006 OE1 GLU A 62 -4.871 2.975 9.069 1.00 0.00 O ATOM 1007 OE2 GLU A 62 -6.997 3.569 9.366 1.00 0.00 O ATOM 0 H GLU A 62 -4.229 4.819 6.497 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.690 6.737 7.824 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.622 4.785 8.453 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.438 6.229 9.428 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.030 5.257 10.757 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.156 5.908 9.583 1.00 0.00 H new ATOM 1014 N GLU A 63 -2.559 7.719 7.440 1.00 0.00 N ATOM 1015 CA GLU A 63 -1.706 8.892 7.358 1.00 0.00 C ATOM 1016 C GLU A 63 -2.157 9.798 6.211 1.00 0.00 C ATOM 1017 O GLU A 63 -2.471 10.967 6.426 1.00 0.00 O ATOM 1018 CB GLU A 63 -0.238 8.492 7.197 1.00 0.00 C ATOM 1019 CG GLU A 63 0.662 9.323 8.113 1.00 0.00 C ATOM 1020 CD GLU A 63 1.223 8.471 9.252 1.00 0.00 C ATOM 1021 OE1 GLU A 63 2.056 7.590 8.944 1.00 0.00 O ATOM 1022 OE2 GLU A 63 0.807 8.717 10.404 1.00 0.00 O ATOM 0 H GLU A 63 -2.067 6.828 7.376 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.796 9.449 8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.119 7.433 7.428 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.068 8.629 6.160 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.482 9.748 7.534 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.096 10.159 8.524 1.00 0.00 H new ATOM 1029 N ILE A 64 -2.174 9.223 5.018 1.00 0.00 N ATOM 1030 CA ILE A 64 -2.582 9.964 3.835 1.00 0.00 C ATOM 1031 C ILE A 64 -3.855 10.754 4.148 1.00 0.00 C ATOM 1032 O ILE A 64 -3.874 11.978 4.033 1.00 0.00 O ATOM 1033 CB ILE A 64 -2.719 9.026 2.635 1.00 0.00 C ATOM 1034 CG1 ILE A 64 -1.398 8.308 2.345 1.00 0.00 C ATOM 1035 CG2 ILE A 64 -3.246 9.775 1.410 1.00 0.00 C ATOM 1036 CD1 ILE A 64 -1.343 7.826 0.895 1.00 0.00 C ATOM 0 H ILE A 64 -1.912 8.253 4.844 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.817 10.689 3.556 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.453 8.260 2.883 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.563 8.982 2.540 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.286 7.459 3.019 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.334 9.084 0.571 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -4.225 10.198 1.636 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.555 10.577 1.149 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -0.395 7.320 0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.165 7.134 0.710 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.431 8.680 0.224 1.00 0.00 H new ATOM 1048 N LYS A 65 -4.887 10.019 4.536 1.00 0.00 N ATOM 1049 CA LYS A 65 -6.161 10.635 4.866 1.00 0.00 C ATOM 1050 C LYS A 65 -5.920 11.835 5.785 1.00 0.00 C ATOM 1051 O LYS A 65 -6.728 12.762 5.827 1.00 0.00 O ATOM 1052 CB LYS A 65 -7.123 9.599 5.448 1.00 0.00 C ATOM 1053 CG LYS A 65 -8.576 10.059 5.308 1.00 0.00 C ATOM 1054 CD LYS A 65 -9.528 8.862 5.271 1.00 0.00 C ATOM 1055 CE LYS A 65 -10.403 8.896 4.015 1.00 0.00 C ATOM 1056 NZ LYS A 65 -11.819 9.131 4.377 1.00 0.00 N ATOM 0 H LYS A 65 -4.867 9.003 4.629 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.645 11.014 3.966 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -6.989 8.646 4.937 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.890 9.432 6.500 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.837 10.710 6.142 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -8.689 10.647 4.397 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -8.954 7.936 5.294 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -10.160 8.868 6.159 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.057 9.683 3.345 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -10.311 7.954 3.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.399 9.151 3.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.150 8.366 4.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -11.904 10.041 4.873 1.00 0.00 H new ATOM 1070 N LYS A 66 -4.805 11.780 6.497 1.00 0.00 N ATOM 1071 CA LYS A 66 -4.447 12.849 7.413 1.00 0.00 C ATOM 1072 C LYS A 66 -3.562 13.863 6.685 1.00 0.00 C ATOM 1073 O LYS A 66 -3.712 15.069 6.872 1.00 0.00 O ATOM 1074 CB LYS A 66 -3.812 12.278 8.683 1.00 0.00 C ATOM 1075 CG LYS A 66 -4.387 12.947 9.932 1.00 0.00 C ATOM 1076 CD LYS A 66 -3.344 13.842 10.605 1.00 0.00 C ATOM 1077 CE LYS A 66 -3.048 13.364 12.027 1.00 0.00 C ATOM 1078 NZ LYS A 66 -1.610 13.047 12.178 1.00 0.00 N ATOM 0 H LYS A 66 -4.136 11.011 6.458 1.00 0.00 H new ATOM 0 HA LYS A 66 -5.339 13.382 7.743 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.986 11.203 8.729 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -2.732 12.425 8.652 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -5.260 13.541 9.661 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.725 12.185 10.634 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.425 13.841 10.018 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.704 14.870 10.631 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.334 14.135 12.743 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.647 12.482 12.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.426 12.724 13.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.348 12.296 11.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.045 13.898 11.983 1.00 0.00 H new ATOM 1092 N LEU A 67 -2.660 13.336 5.871 1.00 0.00 N ATOM 1093 CA LEU A 67 -1.752 14.180 5.114 1.00 0.00 C ATOM 1094 C LEU A 67 -2.561 15.185 4.291 1.00 0.00 C ATOM 1095 O LEU A 67 -2.798 14.972 3.104 1.00 0.00 O ATOM 1096 CB LEU A 67 -0.799 13.325 4.276 1.00 0.00 C ATOM 1097 CG LEU A 67 0.161 12.427 5.058 1.00 0.00 C ATOM 1098 CD1 LEU A 67 0.435 11.126 4.300 1.00 0.00 C ATOM 1099 CD2 LEU A 67 1.452 13.173 5.401 1.00 0.00 C ATOM 0 H LEU A 67 -2.538 12.335 5.719 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.118 14.757 5.788 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.394 12.697 3.613 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.210 13.988 3.642 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.315 12.156 6.000 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.120 10.506 4.878 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.501 10.589 4.149 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.881 11.356 3.333 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.117 12.512 5.957 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.943 13.492 4.482 1.00 0.00 H new ATOM 0 HD23 LEU A 67 1.217 14.046 6.009 1.00 0.00 H new