USER MOD reduce.3.24.130724 H: found=0, std=0, add=526, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 527 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 21 ASN : amide:sc= 0.916 K(o=2.8,f=1.6) USER MOD Set 1.2: A 22 GLN : amide:sc= 1.9 K(o=2.8,f=1.6) USER MOD Set 2.1: A 13 TYR OH : rot 162:sc= 0.263 USER MOD Set 2.2: A 34 THR OG1 : rot 73:sc= 1.71 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0127) USER MOD Single : A 16 LYS NZ :NH3+ 144:sc= 0.699 (180deg=0.0367) USER MOD Single : A 24 SER OG : rot -129:sc= 0.863 USER MOD Single : A 25 LYS NZ :NH3+ -116:sc= 1.47 (180deg=-0.965) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0419) USER MOD Single : A 33 GLN : amide:sc=-0.00426 K(o=-0.0043,f=-0.93) USER MOD Single : A 45 THR OG1 : rot -73:sc= 1.1 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.893 K(o=0.89,f=-0.043) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -1.44 X(o=-1.4,f=-1.9) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 142:sc= 0.691 (180deg=-0.321) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.004) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 3 -12.003 0.763 -6.006 1.00 0.00 N ATOM 37 CA PRO A 3 -10.794 1.416 -5.511 1.00 0.00 C ATOM 38 C PRO A 3 -10.973 2.200 -4.204 1.00 0.00 C ATOM 39 O PRO A 3 -10.048 2.261 -3.399 1.00 0.00 O ATOM 40 CB PRO A 3 -10.290 2.280 -6.666 1.00 0.00 C ATOM 41 CG PRO A 3 -10.698 1.431 -7.872 1.00 0.00 C ATOM 42 CD PRO A 3 -12.073 0.911 -7.448 1.00 0.00 C ATOM 0 HA PRO A 3 -10.060 0.664 -5.221 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -10.758 3.264 -6.678 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.213 2.440 -6.621 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -10.750 2.021 -8.787 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.994 0.619 -8.056 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.861 1.608 -7.733 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.299 -0.040 -7.930 1.00 0.00 H new ATOM 50 N GLU A 4 -12.155 2.775 -3.959 1.00 0.00 N ATOM 51 CA GLU A 4 -12.483 3.489 -2.752 1.00 0.00 C ATOM 52 C GLU A 4 -12.235 2.623 -1.507 1.00 0.00 C ATOM 53 O GLU A 4 -11.845 3.133 -0.461 1.00 0.00 O ATOM 54 CB GLU A 4 -13.944 3.922 -2.871 1.00 0.00 C ATOM 55 CG GLU A 4 -14.265 4.720 -4.147 1.00 0.00 C ATOM 56 CD GLU A 4 -13.238 5.816 -4.425 1.00 0.00 C ATOM 57 OE1 GLU A 4 -13.192 6.772 -3.621 1.00 0.00 O ATOM 58 OE2 GLU A 4 -12.503 5.664 -5.425 1.00 0.00 O ATOM 0 H GLU A 4 -12.925 2.747 -4.627 1.00 0.00 H new ATOM 0 HA GLU A 4 -11.844 4.364 -2.633 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -14.577 3.035 -2.842 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -14.203 4.528 -2.003 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -14.304 4.039 -4.997 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.254 5.169 -4.052 1.00 0.00 H new ATOM 65 N GLU A 5 -12.435 1.306 -1.615 1.00 0.00 N ATOM 66 CA GLU A 5 -12.177 0.371 -0.530 1.00 0.00 C ATOM 67 C GLU A 5 -10.699 0.479 -0.162 1.00 0.00 C ATOM 68 O GLU A 5 -10.323 0.705 0.986 1.00 0.00 O ATOM 69 CB GLU A 5 -12.490 -1.075 -0.940 1.00 0.00 C ATOM 70 CG GLU A 5 -13.974 -1.210 -1.259 1.00 0.00 C ATOM 71 CD GLU A 5 -14.367 -2.631 -1.649 1.00 0.00 C ATOM 72 OE1 GLU A 5 -14.496 -3.458 -0.722 1.00 0.00 O ATOM 73 OE2 GLU A 5 -14.563 -2.856 -2.864 1.00 0.00 O ATOM 0 H GLU A 5 -12.783 0.862 -2.465 1.00 0.00 H new ATOM 0 HA GLU A 5 -12.819 0.621 0.314 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -11.895 -1.353 -1.810 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.218 -1.758 -0.135 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -14.557 -0.902 -0.391 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.230 -0.531 -2.072 1.00 0.00 H new ATOM 80 N LEU A 6 -9.859 0.325 -1.186 1.00 0.00 N ATOM 81 CA LEU A 6 -8.413 0.355 -1.055 1.00 0.00 C ATOM 82 C LEU A 6 -7.965 1.750 -0.616 1.00 0.00 C ATOM 83 O LEU A 6 -6.990 1.883 0.115 1.00 0.00 O ATOM 84 CB LEU A 6 -7.744 -0.159 -2.337 1.00 0.00 C ATOM 85 CG LEU A 6 -7.938 -1.681 -2.522 1.00 0.00 C ATOM 86 CD1 LEU A 6 -7.564 -2.073 -3.955 1.00 0.00 C ATOM 87 CD2 LEU A 6 -7.095 -2.513 -1.547 1.00 0.00 C ATOM 0 H LEU A 6 -10.176 0.174 -2.144 1.00 0.00 H new ATOM 0 HA LEU A 6 -8.085 -0.328 -0.271 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.158 0.366 -3.198 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -6.679 0.069 -2.306 1.00 0.00 H new ATOM 0 HG LEU A 6 -8.987 -1.894 -2.316 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -7.701 -3.146 -4.086 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.203 -1.537 -4.657 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -6.522 -1.814 -4.143 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -7.274 -3.573 -1.725 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.039 -2.292 -1.700 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -7.373 -2.265 -0.523 1.00 0.00 H new ATOM 99 N LYS A 7 -8.679 2.795 -1.034 1.00 0.00 N ATOM 100 CA LYS A 7 -8.434 4.163 -0.607 1.00 0.00 C ATOM 101 C LYS A 7 -8.657 4.266 0.903 1.00 0.00 C ATOM 102 O LYS A 7 -7.803 4.774 1.628 1.00 0.00 O ATOM 103 CB LYS A 7 -9.354 5.095 -1.404 1.00 0.00 C ATOM 104 CG LYS A 7 -8.939 6.568 -1.328 1.00 0.00 C ATOM 105 CD LYS A 7 -9.842 7.390 -2.255 1.00 0.00 C ATOM 106 CE LYS A 7 -9.424 8.863 -2.250 1.00 0.00 C ATOM 107 NZ LYS A 7 -10.286 9.661 -3.139 1.00 0.00 N ATOM 0 H LYS A 7 -9.456 2.708 -1.690 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.404 4.462 -0.802 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.362 4.781 -2.448 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -10.374 4.992 -1.032 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -9.022 6.930 -0.303 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -7.895 6.681 -1.622 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -9.787 6.995 -3.269 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.880 7.300 -1.934 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -9.479 9.257 -1.235 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.386 8.951 -2.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -9.981 10.655 -3.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.213 9.298 -4.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.273 9.594 -2.817 1.00 0.00 H new ATOM 121 N GLY A 8 -9.799 3.767 1.382 1.00 0.00 N ATOM 122 CA GLY A 8 -10.131 3.761 2.796 1.00 0.00 C ATOM 123 C GLY A 8 -9.044 3.018 3.569 1.00 0.00 C ATOM 124 O GLY A 8 -8.502 3.535 4.540 1.00 0.00 O ATOM 0 H GLY A 8 -10.520 3.354 0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.220 4.783 3.164 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.097 3.280 2.952 1.00 0.00 H new ATOM 128 N ILE A 9 -8.720 1.806 3.120 1.00 0.00 N ATOM 129 CA ILE A 9 -7.691 0.948 3.700 1.00 0.00 C ATOM 130 C ILE A 9 -6.350 1.696 3.773 1.00 0.00 C ATOM 131 O ILE A 9 -5.723 1.775 4.829 1.00 0.00 O ATOM 132 CB ILE A 9 -7.617 -0.326 2.841 1.00 0.00 C ATOM 133 CG1 ILE A 9 -8.895 -1.178 2.963 1.00 0.00 C ATOM 134 CG2 ILE A 9 -6.354 -1.143 3.111 1.00 0.00 C ATOM 135 CD1 ILE A 9 -8.915 -2.110 4.173 1.00 0.00 C ATOM 0 H ILE A 9 -9.183 1.382 2.316 1.00 0.00 H new ATOM 0 HA ILE A 9 -7.934 0.670 4.725 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.552 0.004 1.804 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.757 -0.513 3.017 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.008 -1.774 2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -6.353 -2.031 2.479 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -5.475 -0.538 2.889 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -6.332 -1.444 4.158 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -9.849 -2.673 4.184 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -8.075 -2.802 4.113 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.836 -1.521 5.087 1.00 0.00 H new ATOM 147 N PHE A 10 -5.913 2.253 2.641 1.00 0.00 N ATOM 148 CA PHE A 10 -4.684 3.025 2.526 1.00 0.00 C ATOM 149 C PHE A 10 -4.685 4.110 3.596 1.00 0.00 C ATOM 150 O PHE A 10 -3.756 4.196 4.388 1.00 0.00 O ATOM 151 CB PHE A 10 -4.581 3.654 1.125 1.00 0.00 C ATOM 152 CG PHE A 10 -3.484 4.692 0.961 1.00 0.00 C ATOM 153 CD1 PHE A 10 -3.676 5.984 1.490 1.00 0.00 C ATOM 154 CD2 PHE A 10 -2.210 4.335 0.483 1.00 0.00 C ATOM 155 CE1 PHE A 10 -2.569 6.723 1.925 1.00 0.00 C ATOM 156 CE2 PHE A 10 -1.122 5.193 0.713 1.00 0.00 C ATOM 157 CZ PHE A 10 -1.283 6.318 1.539 1.00 0.00 C ATOM 0 H PHE A 10 -6.420 2.175 1.760 1.00 0.00 H new ATOM 0 HA PHE A 10 -3.823 2.372 2.669 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.418 2.858 0.398 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.537 4.117 0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -4.670 6.401 1.559 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -2.070 3.410 -0.056 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -2.704 7.594 2.550 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.165 4.989 0.256 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.418 6.870 1.876 1.00 0.00 H new ATOM 167 N GLU A 11 -5.732 4.941 3.609 1.00 0.00 N ATOM 168 CA GLU A 11 -5.852 6.049 4.542 1.00 0.00 C ATOM 169 C GLU A 11 -5.784 5.545 5.984 1.00 0.00 C ATOM 170 O GLU A 11 -5.052 6.100 6.803 1.00 0.00 O ATOM 171 CB GLU A 11 -7.152 6.816 4.252 1.00 0.00 C ATOM 172 CG GLU A 11 -7.180 8.199 4.922 1.00 0.00 C ATOM 173 CD GLU A 11 -6.153 9.180 4.353 1.00 0.00 C ATOM 174 OE1 GLU A 11 -5.726 8.969 3.196 1.00 0.00 O ATOM 175 OE2 GLU A 11 -5.842 10.146 5.081 1.00 0.00 O ATOM 0 H GLU A 11 -6.520 4.858 2.967 1.00 0.00 H new ATOM 0 HA GLU A 11 -5.017 6.738 4.411 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -7.267 6.935 3.175 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -8.002 6.229 4.601 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.177 8.626 4.812 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.001 8.079 5.990 1.00 0.00 H new ATOM 182 N LYS A 12 -6.549 4.491 6.284 1.00 0.00 N ATOM 183 CA LYS A 12 -6.615 3.875 7.597 1.00 0.00 C ATOM 184 C LYS A 12 -5.204 3.628 8.118 1.00 0.00 C ATOM 185 O LYS A 12 -4.887 4.052 9.223 1.00 0.00 O ATOM 186 CB LYS A 12 -7.439 2.579 7.543 1.00 0.00 C ATOM 187 CG LYS A 12 -7.752 2.024 8.941 1.00 0.00 C ATOM 188 CD LYS A 12 -8.236 0.566 8.881 1.00 0.00 C ATOM 189 CE LYS A 12 -9.435 0.341 7.951 1.00 0.00 C ATOM 190 NZ LYS A 12 -10.587 1.180 8.323 1.00 0.00 N ATOM 0 H LYS A 12 -7.152 4.037 5.598 1.00 0.00 H new ATOM 0 HA LYS A 12 -7.119 4.549 8.290 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -8.372 2.767 7.013 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.893 1.828 6.971 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -6.860 2.086 9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.515 2.641 9.415 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -7.411 -0.066 8.552 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -8.504 0.242 9.887 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -9.143 0.560 6.924 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -9.726 -0.709 7.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -11.402 0.936 7.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -10.829 1.015 9.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -10.345 2.182 8.187 1.00 0.00 H new ATOM 204 N TYR A 13 -4.353 2.954 7.339 1.00 0.00 N ATOM 205 CA TYR A 13 -2.993 2.697 7.787 1.00 0.00 C ATOM 206 C TYR A 13 -2.114 3.943 7.695 1.00 0.00 C ATOM 207 O TYR A 13 -1.389 4.224 8.645 1.00 0.00 O ATOM 208 CB TYR A 13 -2.411 1.470 7.089 1.00 0.00 C ATOM 209 CG TYR A 13 -2.894 0.189 7.736 1.00 0.00 C ATOM 210 CD1 TYR A 13 -4.213 -0.240 7.509 1.00 0.00 C ATOM 211 CD2 TYR A 13 -2.071 -0.520 8.635 1.00 0.00 C ATOM 212 CE1 TYR A 13 -4.704 -1.376 8.168 1.00 0.00 C ATOM 213 CE2 TYR A 13 -2.587 -1.623 9.336 1.00 0.00 C ATOM 214 CZ TYR A 13 -3.894 -2.068 9.083 1.00 0.00 C ATOM 215 OH TYR A 13 -4.363 -3.196 9.683 1.00 0.00 O ATOM 0 H TYR A 13 -4.580 2.586 6.415 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.021 2.454 8.849 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.695 1.478 6.037 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.322 1.510 7.125 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -4.848 0.305 6.827 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -1.046 -0.216 8.785 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -5.709 -1.720 7.971 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -1.977 -2.129 10.070 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.612 -3.707 10.051 1.00 0.00 H new ATOM 225 N ALA A 14 -2.156 4.712 6.601 1.00 0.00 N ATOM 226 CA ALA A 14 -1.337 5.917 6.491 1.00 0.00 C ATOM 227 C ALA A 14 -1.530 6.842 7.700 1.00 0.00 C ATOM 228 O ALA A 14 -0.599 7.510 8.136 1.00 0.00 O ATOM 229 CB ALA A 14 -1.653 6.626 5.179 1.00 0.00 C ATOM 0 H ALA A 14 -2.743 4.522 5.789 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.285 5.631 6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -1.043 7.525 5.095 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -1.435 5.960 4.344 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -2.708 6.900 5.158 1.00 0.00 H new ATOM 235 N ALA A 15 -2.739 6.879 8.266 1.00 0.00 N ATOM 236 CA ALA A 15 -3.042 7.683 9.439 1.00 0.00 C ATOM 237 C ALA A 15 -2.240 7.308 10.697 1.00 0.00 C ATOM 238 O ALA A 15 -2.232 8.099 11.637 1.00 0.00 O ATOM 239 CB ALA A 15 -4.546 7.615 9.720 1.00 0.00 C ATOM 0 H ALA A 15 -3.536 6.347 7.917 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.736 8.702 9.203 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.779 8.216 10.599 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.095 8.000 8.861 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.836 6.580 9.901 1.00 0.00 H new ATOM 245 N LYS A 16 -1.583 6.140 10.766 1.00 0.00 N ATOM 246 CA LYS A 16 -0.832 5.740 11.949 1.00 0.00 C ATOM 247 C LYS A 16 0.535 6.437 12.001 1.00 0.00 C ATOM 248 O LYS A 16 0.741 7.318 12.832 1.00 0.00 O ATOM 249 CB LYS A 16 -0.713 4.205 12.020 1.00 0.00 C ATOM 250 CG LYS A 16 -1.443 3.578 13.219 1.00 0.00 C ATOM 251 CD LYS A 16 -2.963 3.795 13.228 1.00 0.00 C ATOM 252 CE LYS A 16 -3.615 3.295 11.936 1.00 0.00 C ATOM 253 NZ LYS A 16 -5.079 3.433 11.987 1.00 0.00 N ATOM 0 H LYS A 16 -1.562 5.458 10.008 1.00 0.00 H new ATOM 0 HA LYS A 16 -1.379 6.064 12.834 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.111 3.777 11.100 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.342 3.934 12.067 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.242 2.507 13.230 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.025 3.990 14.138 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.400 3.275 14.081 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.178 4.856 13.357 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.224 3.857 11.088 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.352 2.250 11.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.437 3.687 11.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.502 2.532 12.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.334 4.178 12.666 1.00 0.00 H new ATOM 267 N GLU A 17 1.476 6.037 11.141 1.00 0.00 N ATOM 268 CA GLU A 17 2.825 6.586 11.101 1.00 0.00 C ATOM 269 C GLU A 17 2.991 7.515 9.907 1.00 0.00 C ATOM 270 O GLU A 17 2.397 7.323 8.852 1.00 0.00 O ATOM 271 CB GLU A 17 3.856 5.453 11.056 1.00 0.00 C ATOM 272 CG GLU A 17 5.315 5.925 11.119 1.00 0.00 C ATOM 273 CD GLU A 17 6.270 4.738 11.120 1.00 0.00 C ATOM 274 OE1 GLU A 17 6.615 4.291 10.004 1.00 0.00 O ATOM 275 OE2 GLU A 17 6.629 4.294 12.232 1.00 0.00 O ATOM 0 H GLU A 17 1.314 5.310 10.444 1.00 0.00 H new ATOM 0 HA GLU A 17 2.991 7.169 12.007 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.670 4.774 11.888 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.710 4.881 10.140 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.530 6.569 10.267 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.470 6.522 12.017 1.00 0.00 H new ATOM 282 N GLY A 18 3.842 8.516 10.098 1.00 0.00 N ATOM 283 CA GLY A 18 4.140 9.517 9.090 1.00 0.00 C ATOM 284 C GLY A 18 2.928 10.413 8.840 1.00 0.00 C ATOM 285 O GLY A 18 2.100 10.620 9.725 1.00 0.00 O ATOM 0 H GLY A 18 4.350 8.654 10.972 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.986 10.124 9.413 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.434 9.028 8.161 1.00 0.00 H new ATOM 289 N ASP A 19 2.826 10.959 7.628 1.00 0.00 N ATOM 290 CA ASP A 19 1.729 11.835 7.241 1.00 0.00 C ATOM 291 C ASP A 19 0.556 10.968 6.768 1.00 0.00 C ATOM 292 O ASP A 19 0.807 9.985 6.074 1.00 0.00 O ATOM 293 CB ASP A 19 2.217 12.751 6.110 1.00 0.00 C ATOM 294 CG ASP A 19 1.167 13.773 5.698 1.00 0.00 C ATOM 295 OD1 ASP A 19 0.184 13.348 5.053 1.00 0.00 O ATOM 296 OD2 ASP A 19 1.353 14.957 6.049 1.00 0.00 O ATOM 0 H ASP A 19 3.508 10.803 6.886 1.00 0.00 H new ATOM 0 HA ASP A 19 1.400 12.448 8.080 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.120 13.271 6.431 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.488 12.144 5.246 1.00 0.00 H new ATOM 301 N PRO A 20 -0.708 11.305 7.087 1.00 0.00 N ATOM 302 CA PRO A 20 -1.879 10.540 6.662 1.00 0.00 C ATOM 303 C PRO A 20 -1.965 10.276 5.152 1.00 0.00 C ATOM 304 O PRO A 20 -2.697 9.386 4.730 1.00 0.00 O ATOM 305 CB PRO A 20 -3.101 11.300 7.192 1.00 0.00 C ATOM 306 CG PRO A 20 -2.575 12.707 7.469 1.00 0.00 C ATOM 307 CD PRO A 20 -1.127 12.450 7.881 1.00 0.00 C ATOM 0 HA PRO A 20 -1.817 9.533 7.075 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -3.909 11.314 6.461 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -3.497 10.837 8.096 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -2.638 13.344 6.586 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -3.139 13.202 8.260 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -0.500 13.319 7.682 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -1.051 12.240 8.948 1.00 0.00 H new ATOM 315 N ASN A 21 -1.238 11.024 4.320 1.00 0.00 N ATOM 316 CA ASN A 21 -1.217 10.825 2.881 1.00 0.00 C ATOM 317 C ASN A 21 -0.207 9.749 2.462 1.00 0.00 C ATOM 318 O ASN A 21 -0.285 9.280 1.327 1.00 0.00 O ATOM 319 CB ASN A 21 -0.868 12.166 2.235 1.00 0.00 C ATOM 320 CG ASN A 21 -0.635 12.056 0.734 1.00 0.00 C ATOM 321 OD1 ASN A 21 -1.555 11.872 -0.048 1.00 0.00 O ATOM 322 ND2 ASN A 21 0.611 12.166 0.301 1.00 0.00 N ATOM 0 H ASN A 21 -0.644 11.791 4.635 1.00 0.00 H new ATOM 0 HA ASN A 21 -2.195 10.474 2.551 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -1.675 12.875 2.422 1.00 0.00 H new ATOM 0 HB3 ASN A 21 0.027 12.570 2.708 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.812 12.097 -0.697 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.370 12.320 0.965 1.00 0.00 H new ATOM 329 N GLN A 22 0.736 9.352 3.330 1.00 0.00 N ATOM 330 CA GLN A 22 1.777 8.385 2.991 1.00 0.00 C ATOM 331 C GLN A 22 1.773 7.081 3.791 1.00 0.00 C ATOM 332 O GLN A 22 1.479 7.050 4.978 1.00 0.00 O ATOM 333 CB GLN A 22 3.178 8.993 3.143 1.00 0.00 C ATOM 334 CG GLN A 22 3.598 9.995 2.061 1.00 0.00 C ATOM 335 CD GLN A 22 3.548 11.421 2.584 1.00 0.00 C ATOM 336 OE1 GLN A 22 2.739 12.232 2.154 1.00 0.00 O ATOM 337 NE2 GLN A 22 4.412 11.750 3.532 1.00 0.00 N ATOM 0 H GLN A 22 0.793 9.697 4.288 1.00 0.00 H new ATOM 0 HA GLN A 22 1.538 8.136 1.957 1.00 0.00 H new ATOM 0 HB2 GLN A 22 3.233 9.490 4.111 1.00 0.00 H new ATOM 0 HB3 GLN A 22 3.905 8.181 3.160 1.00 0.00 H new ATOM 0 HG2 GLN A 22 4.608 9.765 1.721 1.00 0.00 H new ATOM 0 HG3 GLN A 22 2.940 9.898 1.197 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.078 11.059 3.877 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.411 12.694 3.917 1.00 0.00 H new ATOM 346 N LEU A 23 2.162 6.001 3.107 1.00 0.00 N ATOM 347 CA LEU A 23 2.360 4.670 3.665 1.00 0.00 C ATOM 348 C LEU A 23 3.864 4.416 3.781 1.00 0.00 C ATOM 349 O LEU A 23 4.523 4.182 2.773 1.00 0.00 O ATOM 350 CB LEU A 23 1.794 3.612 2.714 1.00 0.00 C ATOM 351 CG LEU A 23 0.319 3.277 2.910 1.00 0.00 C ATOM 352 CD1 LEU A 23 -0.096 2.262 1.834 1.00 0.00 C ATOM 353 CD2 LEU A 23 -0.030 2.660 4.261 1.00 0.00 C ATOM 0 H LEU A 23 2.355 6.037 2.106 1.00 0.00 H new ATOM 0 HA LEU A 23 1.862 4.611 4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.938 3.955 1.689 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.375 2.697 2.829 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.208 4.229 2.846 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.149 2.010 1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.059 2.695 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.507 1.359 1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.100 2.458 4.303 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.520 1.728 4.388 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.240 3.353 5.058 1.00 0.00 H new ATOM 365 N SER A 24 4.437 4.434 4.981 1.00 0.00 N ATOM 366 CA SER A 24 5.855 4.123 5.124 1.00 0.00 C ATOM 367 C SER A 24 6.054 2.627 4.853 1.00 0.00 C ATOM 368 O SER A 24 5.087 1.871 4.806 1.00 0.00 O ATOM 369 CB SER A 24 6.345 4.499 6.528 1.00 0.00 C ATOM 370 OG SER A 24 5.805 3.618 7.494 1.00 0.00 O ATOM 0 H SER A 24 3.953 4.656 5.851 1.00 0.00 H new ATOM 0 HA SER A 24 6.439 4.701 4.408 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.434 4.462 6.562 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.054 5.524 6.759 1.00 0.00 H new ATOM 0 HG SER A 24 5.398 4.137 8.219 1.00 0.00 H new ATOM 376 N LYS A 25 7.298 2.170 4.692 1.00 0.00 N ATOM 377 CA LYS A 25 7.577 0.746 4.514 1.00 0.00 C ATOM 378 C LYS A 25 7.012 -0.004 5.722 1.00 0.00 C ATOM 379 O LYS A 25 6.271 -0.979 5.596 1.00 0.00 O ATOM 380 CB LYS A 25 9.090 0.554 4.292 1.00 0.00 C ATOM 381 CG LYS A 25 9.613 -0.831 4.713 1.00 0.00 C ATOM 382 CD LYS A 25 11.135 -1.012 4.603 1.00 0.00 C ATOM 383 CE LYS A 25 11.687 -0.905 3.176 1.00 0.00 C ATOM 384 NZ LYS A 25 11.980 0.488 2.801 1.00 0.00 N ATOM 0 H LYS A 25 8.126 2.766 4.681 1.00 0.00 H new ATOM 0 HA LYS A 25 7.091 0.332 3.630 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.315 0.711 3.237 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.629 1.320 4.850 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.314 -1.017 5.744 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.127 -1.588 4.098 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.623 -0.262 5.225 1.00 0.00 H new ATOM 0 HD3 LYS A 25 11.403 -1.987 5.010 1.00 0.00 H new ATOM 0 HE2 LYS A 25 12.596 -1.501 3.093 1.00 0.00 H new ATOM 0 HE3 LYS A 25 10.965 -1.325 2.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 11.361 0.773 2.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.812 1.110 3.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.974 0.566 2.505 1.00 0.00 H new ATOM 398 N GLU A 26 7.367 0.491 6.903 1.00 0.00 N ATOM 399 CA GLU A 26 6.893 -0.035 8.174 1.00 0.00 C ATOM 400 C GLU A 26 5.358 -0.082 8.174 1.00 0.00 C ATOM 401 O GLU A 26 4.763 -1.094 8.528 1.00 0.00 O ATOM 402 CB GLU A 26 7.449 0.829 9.314 1.00 0.00 C ATOM 403 CG GLU A 26 7.075 0.276 10.697 1.00 0.00 C ATOM 404 CD GLU A 26 7.646 1.115 11.839 1.00 0.00 C ATOM 405 OE1 GLU A 26 8.729 1.706 11.634 1.00 0.00 O ATOM 406 OE2 GLU A 26 6.994 1.131 12.905 1.00 0.00 O ATOM 0 H GLU A 26 8.003 1.282 7.003 1.00 0.00 H new ATOM 0 HA GLU A 26 7.248 -1.055 8.323 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.534 0.886 9.229 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.068 1.846 9.216 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.989 0.237 10.787 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.439 -0.748 10.786 1.00 0.00 H new ATOM 413 N GLU A 27 4.706 1.009 7.771 1.00 0.00 N ATOM 414 CA GLU A 27 3.253 1.069 7.733 1.00 0.00 C ATOM 415 C GLU A 27 2.678 0.021 6.775 1.00 0.00 C ATOM 416 O GLU A 27 1.740 -0.701 7.117 1.00 0.00 O ATOM 417 CB GLU A 27 2.824 2.494 7.362 1.00 0.00 C ATOM 418 CG GLU A 27 1.341 2.752 7.626 1.00 0.00 C ATOM 419 CD GLU A 27 1.014 2.695 9.112 1.00 0.00 C ATOM 420 OE1 GLU A 27 1.501 3.593 9.829 1.00 0.00 O ATOM 421 OE2 GLU A 27 0.297 1.752 9.508 1.00 0.00 O ATOM 0 H GLU A 27 5.169 1.865 7.466 1.00 0.00 H new ATOM 0 HA GLU A 27 2.851 0.831 8.718 1.00 0.00 H new ATOM 0 HB2 GLU A 27 3.420 3.208 7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 27 3.037 2.670 6.308 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.066 3.730 7.230 1.00 0.00 H new ATOM 0 HG3 GLU A 27 0.743 2.013 7.093 1.00 0.00 H new ATOM 428 N LEU A 28 3.242 -0.071 5.570 1.00 0.00 N ATOM 429 CA LEU A 28 2.806 -1.032 4.577 1.00 0.00 C ATOM 430 C LEU A 28 2.894 -2.436 5.160 1.00 0.00 C ATOM 431 O LEU A 28 1.991 -3.239 4.945 1.00 0.00 O ATOM 432 CB LEU A 28 3.688 -0.923 3.327 1.00 0.00 C ATOM 433 CG LEU A 28 3.240 -1.874 2.204 1.00 0.00 C ATOM 434 CD1 LEU A 28 1.935 -1.410 1.548 1.00 0.00 C ATOM 435 CD2 LEU A 28 4.346 -1.999 1.158 1.00 0.00 C ATOM 0 H LEU A 28 4.013 0.522 5.263 1.00 0.00 H new ATOM 0 HA LEU A 28 1.773 -0.824 4.297 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.667 0.103 2.960 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.721 -1.144 3.595 1.00 0.00 H new ATOM 0 HG LEU A 28 3.049 -2.850 2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.655 -2.110 0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.145 -1.372 2.298 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.076 -0.418 1.119 1.00 0.00 H new ATOM 0 HD21 LEU A 28 4.023 -2.674 0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.559 -1.017 0.735 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.247 -2.395 1.627 1.00 0.00 H new ATOM 447 N LYS A 29 3.971 -2.734 5.895 1.00 0.00 N ATOM 448 CA LYS A 29 4.142 -4.058 6.484 1.00 0.00 C ATOM 449 C LYS A 29 2.883 -4.435 7.258 1.00 0.00 C ATOM 450 O LYS A 29 2.187 -5.368 6.865 1.00 0.00 O ATOM 451 CB LYS A 29 5.405 -4.140 7.356 1.00 0.00 C ATOM 452 CG LYS A 29 5.433 -5.365 8.282 1.00 0.00 C ATOM 453 CD LYS A 29 5.414 -6.694 7.510 1.00 0.00 C ATOM 454 CE LYS A 29 5.247 -7.890 8.453 1.00 0.00 C ATOM 455 NZ LYS A 29 6.358 -7.997 9.415 1.00 0.00 N ATOM 0 H LYS A 29 4.729 -2.080 6.093 1.00 0.00 H new ATOM 0 HA LYS A 29 4.286 -4.783 5.683 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.282 -4.163 6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.479 -3.236 7.961 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.327 -5.324 8.905 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.575 -5.327 8.953 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.599 -6.684 6.786 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.340 -6.801 6.946 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.306 -7.795 8.995 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.186 -8.807 7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.249 -8.866 9.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.261 -8.029 8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.349 -7.172 10.048 1.00 0.00 H new ATOM 469 N LEU A 30 2.593 -3.722 8.349 1.00 0.00 N ATOM 470 CA LEU A 30 1.413 -3.991 9.155 1.00 0.00 C ATOM 471 C LEU A 30 0.154 -4.063 8.286 1.00 0.00 C ATOM 472 O LEU A 30 -0.642 -4.987 8.443 1.00 0.00 O ATOM 473 CB LEU A 30 1.227 -3.015 10.331 1.00 0.00 C ATOM 474 CG LEU A 30 2.143 -1.788 10.438 1.00 0.00 C ATOM 475 CD1 LEU A 30 1.478 -0.735 11.334 1.00 0.00 C ATOM 476 CD2 LEU A 30 3.490 -2.160 11.064 1.00 0.00 C ATOM 0 H LEU A 30 3.167 -2.951 8.691 1.00 0.00 H new ATOM 0 HA LEU A 30 1.579 -4.968 9.608 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.199 -2.655 10.299 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.336 -3.587 11.252 1.00 0.00 H new ATOM 0 HG LEU A 30 2.307 -1.400 9.433 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.126 0.138 11.412 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.522 -0.440 10.901 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.312 -1.154 12.327 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.119 -1.272 11.128 1.00 0.00 H new ATOM 0 HD22 LEU A 30 3.328 -2.562 12.064 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.983 -2.911 10.446 1.00 0.00 H new ATOM 488 N LEU A 31 -0.028 -3.103 7.375 1.00 0.00 N ATOM 489 CA LEU A 31 -1.174 -3.073 6.471 1.00 0.00 C ATOM 490 C LEU A 31 -1.376 -4.438 5.816 1.00 0.00 C ATOM 491 O LEU A 31 -2.419 -5.081 5.963 1.00 0.00 O ATOM 492 CB LEU A 31 -0.952 -1.995 5.395 1.00 0.00 C ATOM 493 CG LEU A 31 -2.229 -1.470 4.726 1.00 0.00 C ATOM 494 CD1 LEU A 31 -1.866 -0.619 3.512 1.00 0.00 C ATOM 495 CD2 LEU A 31 -3.227 -2.545 4.302 1.00 0.00 C ATOM 0 H LEU A 31 0.618 -2.325 7.246 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.070 -2.833 7.043 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.426 -1.155 5.848 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.298 -2.402 4.624 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.731 -0.881 5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.777 -0.249 3.041 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.253 0.225 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -1.308 -1.224 2.797 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.095 -2.074 3.840 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.755 -3.218 3.586 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -3.545 -3.112 5.177 1.00 0.00 H new ATOM 507 N LEU A 32 -0.356 -4.876 5.083 1.00 0.00 N ATOM 508 CA LEU A 32 -0.416 -6.116 4.341 1.00 0.00 C ATOM 509 C LEU A 32 -0.571 -7.296 5.284 1.00 0.00 C ATOM 510 O LEU A 32 -1.363 -8.196 5.024 1.00 0.00 O ATOM 511 CB LEU A 32 0.816 -6.287 3.451 1.00 0.00 C ATOM 512 CG LEU A 32 0.993 -5.158 2.430 1.00 0.00 C ATOM 513 CD1 LEU A 32 2.311 -5.381 1.691 1.00 0.00 C ATOM 514 CD2 LEU A 32 -0.151 -5.088 1.411 1.00 0.00 C ATOM 0 H LEU A 32 0.529 -4.378 4.992 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.291 -6.079 3.692 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.705 -6.340 4.080 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.743 -7.237 2.922 1.00 0.00 H new ATOM 0 HG LEU A 32 0.991 -4.213 2.974 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.456 -4.587 0.958 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.135 -5.371 2.405 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.284 -6.344 1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.031 -4.269 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.206 -6.027 0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.093 -4.918 1.933 1.00 0.00 H new ATOM 526 N GLN A 33 0.179 -7.295 6.382 1.00 0.00 N ATOM 527 CA GLN A 33 0.106 -8.364 7.360 1.00 0.00 C ATOM 528 C GLN A 33 -1.328 -8.530 7.872 1.00 0.00 C ATOM 529 O GLN A 33 -1.794 -9.651 8.049 1.00 0.00 O ATOM 530 CB GLN A 33 1.156 -8.143 8.463 1.00 0.00 C ATOM 531 CG GLN A 33 0.612 -7.961 9.885 1.00 0.00 C ATOM 532 CD GLN A 33 1.750 -7.808 10.889 1.00 0.00 C ATOM 533 OE1 GLN A 33 2.012 -6.729 11.402 1.00 0.00 O ATOM 534 NE2 GLN A 33 2.462 -8.883 11.188 1.00 0.00 N ATOM 0 H GLN A 33 0.846 -6.559 6.613 1.00 0.00 H new ATOM 0 HA GLN A 33 0.357 -9.317 6.895 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.838 -8.993 8.463 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.744 -7.262 8.205 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -0.032 -7.082 9.922 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -0.004 -8.819 10.155 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.238 -9.780 10.756 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.235 -8.815 11.850 1.00 0.00 H new ATOM 543 N THR A 34 -2.022 -7.416 8.110 1.00 0.00 N ATOM 544 CA THR A 34 -3.383 -7.454 8.618 1.00 0.00 C ATOM 545 C THR A 34 -4.405 -7.837 7.542 1.00 0.00 C ATOM 546 O THR A 34 -5.181 -8.768 7.737 1.00 0.00 O ATOM 547 CB THR A 34 -3.793 -6.101 9.237 1.00 0.00 C ATOM 548 OG1 THR A 34 -2.791 -5.527 10.055 1.00 0.00 O ATOM 549 CG2 THR A 34 -5.048 -6.286 10.102 1.00 0.00 C ATOM 0 H THR A 34 -1.657 -6.476 7.957 1.00 0.00 H new ATOM 0 HA THR A 34 -3.388 -8.226 9.387 1.00 0.00 H new ATOM 0 HB THR A 34 -3.970 -5.430 8.397 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.063 -5.190 9.492 1.00 0.00 H new ATOM 0 HG21 THR A 34 -5.334 -5.329 10.537 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.863 -6.662 9.484 1.00 0.00 H new ATOM 0 HG23 THR A 34 -4.838 -6.999 10.899 1.00 0.00 H new ATOM 557 N GLU A 35 -4.445 -7.089 6.432 1.00 0.00 N ATOM 558 CA GLU A 35 -5.497 -7.222 5.422 1.00 0.00 C ATOM 559 C GLU A 35 -5.115 -7.924 4.116 1.00 0.00 C ATOM 560 O GLU A 35 -5.998 -8.175 3.302 1.00 0.00 O ATOM 561 CB GLU A 35 -6.086 -5.825 5.185 1.00 0.00 C ATOM 562 CG GLU A 35 -6.762 -5.324 6.478 1.00 0.00 C ATOM 563 CD GLU A 35 -7.153 -3.854 6.415 1.00 0.00 C ATOM 564 OE1 GLU A 35 -6.330 -3.074 5.895 1.00 0.00 O ATOM 565 OE2 GLU A 35 -8.255 -3.534 6.909 1.00 0.00 O ATOM 0 H GLU A 35 -3.749 -6.376 6.211 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.239 -7.911 5.826 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.299 -5.134 4.882 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.812 -5.858 4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -7.652 -5.923 6.671 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.085 -5.478 7.318 1.00 0.00 H new ATOM 572 N PHE A 36 -3.843 -8.263 3.901 1.00 0.00 N ATOM 573 CA PHE A 36 -3.387 -8.974 2.707 1.00 0.00 C ATOM 574 C PHE A 36 -2.554 -10.224 3.063 1.00 0.00 C ATOM 575 O PHE A 36 -1.620 -10.539 2.324 1.00 0.00 O ATOM 576 CB PHE A 36 -2.548 -8.026 1.826 1.00 0.00 C ATOM 577 CG PHE A 36 -3.251 -6.860 1.143 1.00 0.00 C ATOM 578 CD1 PHE A 36 -3.745 -5.765 1.880 1.00 0.00 C ATOM 579 CD2 PHE A 36 -3.216 -6.777 -0.263 1.00 0.00 C ATOM 580 CE1 PHE A 36 -4.220 -4.620 1.216 1.00 0.00 C ATOM 581 CE2 PHE A 36 -3.684 -5.635 -0.926 1.00 0.00 C ATOM 582 CZ PHE A 36 -4.179 -4.549 -0.186 1.00 0.00 C ATOM 0 H PHE A 36 -3.093 -8.049 4.558 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.270 -9.307 2.162 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.750 -7.616 2.446 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.072 -8.627 1.051 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -3.759 -5.805 2.959 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.824 -7.604 -0.837 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.617 -3.793 1.786 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.664 -5.590 -2.005 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.527 -3.662 -0.694 1.00 0.00 H new ATOM 592 N PRO A 37 -2.834 -10.978 4.144 1.00 0.00 N ATOM 593 CA PRO A 37 -2.026 -12.139 4.495 1.00 0.00 C ATOM 594 C PRO A 37 -2.029 -13.166 3.362 1.00 0.00 C ATOM 595 O PRO A 37 -1.017 -13.802 3.087 1.00 0.00 O ATOM 596 CB PRO A 37 -2.609 -12.686 5.802 1.00 0.00 C ATOM 597 CG PRO A 37 -4.046 -12.168 5.805 1.00 0.00 C ATOM 598 CD PRO A 37 -3.923 -10.822 5.092 1.00 0.00 C ATOM 0 HA PRO A 37 -0.977 -11.879 4.639 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.576 -13.775 5.830 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.053 -12.328 6.669 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.721 -12.844 5.279 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.433 -12.055 6.818 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -4.851 -10.562 4.583 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -3.713 -10.021 5.801 1.00 0.00 H new ATOM 702 N THR A 45 9.152 -10.097 -1.419 1.00 0.00 N ATOM 703 CA THR A 45 9.572 -9.805 -0.058 1.00 0.00 C ATOM 704 C THR A 45 9.058 -8.405 0.257 1.00 0.00 C ATOM 705 O THR A 45 8.742 -7.652 -0.663 1.00 0.00 O ATOM 706 CB THR A 45 11.104 -9.832 0.080 1.00 0.00 C ATOM 707 OG1 THR A 45 11.679 -8.924 -0.835 1.00 0.00 O ATOM 708 CG2 THR A 45 11.712 -11.221 -0.128 1.00 0.00 C ATOM 0 HA THR A 45 9.176 -10.555 0.627 1.00 0.00 H new ATOM 0 HB THR A 45 11.329 -9.542 1.106 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.611 -9.287 -1.743 1.00 0.00 H new ATOM 0 HG21 THR A 45 12.795 -11.165 -0.016 1.00 0.00 H new ATOM 0 HG22 THR A 45 11.306 -11.910 0.612 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.469 -11.579 -1.129 1.00 0.00 H new ATOM 716 N LEU A 46 8.983 -8.041 1.540 1.00 0.00 N ATOM 717 CA LEU A 46 8.533 -6.721 1.968 1.00 0.00 C ATOM 718 C LEU A 46 9.277 -5.620 1.213 1.00 0.00 C ATOM 719 O LEU A 46 8.672 -4.664 0.746 1.00 0.00 O ATOM 720 CB LEU A 46 8.781 -6.567 3.476 1.00 0.00 C ATOM 721 CG LEU A 46 8.441 -5.168 4.028 1.00 0.00 C ATOM 722 CD1 LEU A 46 6.952 -4.836 3.879 1.00 0.00 C ATOM 723 CD2 LEU A 46 8.851 -5.092 5.502 1.00 0.00 C ATOM 0 H LEU A 46 9.235 -8.659 2.312 1.00 0.00 H new ATOM 0 HA LEU A 46 7.469 -6.627 1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.188 -7.310 4.009 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.828 -6.784 3.686 1.00 0.00 H new ATOM 0 HG LEU A 46 8.996 -4.432 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.759 -3.841 4.281 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.677 -4.861 2.824 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.359 -5.570 4.425 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.612 -4.104 5.896 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.310 -5.849 6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.923 -5.269 5.591 1.00 0.00 H new ATOM 735 N ASP A 47 10.597 -5.766 1.112 1.00 0.00 N ATOM 736 CA ASP A 47 11.504 -4.822 0.497 1.00 0.00 C ATOM 737 C ASP A 47 11.199 -4.715 -0.984 1.00 0.00 C ATOM 738 O ASP A 47 10.892 -3.632 -1.456 1.00 0.00 O ATOM 739 CB ASP A 47 12.955 -5.248 0.755 1.00 0.00 C ATOM 740 CG ASP A 47 13.259 -5.274 2.248 1.00 0.00 C ATOM 741 OD1 ASP A 47 12.977 -6.329 2.858 1.00 0.00 O ATOM 742 OD2 ASP A 47 13.735 -4.235 2.755 1.00 0.00 O ATOM 0 H ASP A 47 11.078 -6.588 1.477 1.00 0.00 H new ATOM 0 HA ASP A 47 11.369 -3.834 0.938 1.00 0.00 H new ATOM 0 HB2 ASP A 47 13.129 -6.235 0.327 1.00 0.00 H new ATOM 0 HB3 ASP A 47 13.635 -4.559 0.254 1.00 0.00 H new ATOM 747 N GLU A 48 11.264 -5.825 -1.721 1.00 0.00 N ATOM 748 CA GLU A 48 10.988 -5.816 -3.152 1.00 0.00 C ATOM 749 C GLU A 48 9.597 -5.239 -3.430 1.00 0.00 C ATOM 750 O GLU A 48 9.426 -4.393 -4.304 1.00 0.00 O ATOM 751 CB GLU A 48 11.105 -7.239 -3.699 1.00 0.00 C ATOM 752 CG GLU A 48 12.547 -7.758 -3.625 1.00 0.00 C ATOM 753 CD GLU A 48 12.611 -9.231 -4.017 1.00 0.00 C ATOM 754 OE1 GLU A 48 11.896 -10.015 -3.353 1.00 0.00 O ATOM 755 OE2 GLU A 48 13.357 -9.544 -4.968 1.00 0.00 O ATOM 0 H GLU A 48 11.506 -6.742 -1.346 1.00 0.00 H new ATOM 0 HA GLU A 48 11.717 -5.180 -3.654 1.00 0.00 H new ATOM 0 HB2 GLU A 48 10.450 -7.902 -3.133 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.763 -7.261 -4.734 1.00 0.00 H new ATOM 0 HG2 GLU A 48 13.184 -7.172 -4.288 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.934 -7.628 -2.614 1.00 0.00 H new ATOM 762 N LEU A 49 8.597 -5.696 -2.679 1.00 0.00 N ATOM 763 CA LEU A 49 7.224 -5.252 -2.821 1.00 0.00 C ATOM 764 C LEU A 49 7.111 -3.750 -2.569 1.00 0.00 C ATOM 765 O LEU A 49 6.677 -3.006 -3.446 1.00 0.00 O ATOM 766 CB LEU A 49 6.340 -6.089 -1.890 1.00 0.00 C ATOM 767 CG LEU A 49 4.899 -5.582 -1.808 1.00 0.00 C ATOM 768 CD1 LEU A 49 4.229 -5.464 -3.184 1.00 0.00 C ATOM 769 CD2 LEU A 49 4.087 -6.558 -0.954 1.00 0.00 C ATOM 0 H LEU A 49 8.726 -6.394 -1.947 1.00 0.00 H new ATOM 0 HA LEU A 49 6.876 -5.406 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 49 6.335 -7.122 -2.237 1.00 0.00 H new ATOM 0 HB3 LEU A 49 6.775 -6.090 -0.891 1.00 0.00 H new ATOM 0 HG LEU A 49 4.927 -4.584 -1.370 1.00 0.00 H new ATOM 0 HD11 LEU A 49 3.209 -5.100 -3.062 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.792 -4.766 -3.804 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.210 -6.442 -3.664 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.056 -6.211 -0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.107 -7.547 -1.413 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.519 -6.613 0.045 1.00 0.00 H new ATOM 781 N PHE A 50 7.507 -3.285 -1.382 1.00 0.00 N ATOM 782 CA PHE A 50 7.497 -1.885 -1.033 1.00 0.00 C ATOM 783 C PHE A 50 8.303 -1.121 -2.074 1.00 0.00 C ATOM 784 O PHE A 50 7.928 -0.011 -2.402 1.00 0.00 O ATOM 785 CB PHE A 50 8.089 -1.707 0.367 1.00 0.00 C ATOM 786 CG PHE A 50 8.451 -0.277 0.680 1.00 0.00 C ATOM 787 CD1 PHE A 50 7.485 0.640 1.126 1.00 0.00 C ATOM 788 CD2 PHE A 50 9.732 0.165 0.325 1.00 0.00 C ATOM 789 CE1 PHE A 50 7.853 1.980 1.354 1.00 0.00 C ATOM 790 CE2 PHE A 50 10.085 1.515 0.495 1.00 0.00 C ATOM 791 CZ PHE A 50 9.168 2.406 1.083 1.00 0.00 C ATOM 0 H PHE A 50 7.846 -3.889 -0.634 1.00 0.00 H new ATOM 0 HA PHE A 50 6.479 -1.497 -1.021 1.00 0.00 H new ATOM 0 HB2 PHE A 50 7.372 -2.064 1.106 1.00 0.00 H new ATOM 0 HB3 PHE A 50 8.979 -2.329 0.460 1.00 0.00 H new ATOM 0 HD1 PHE A 50 6.467 0.320 1.293 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.450 -0.533 -0.080 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.127 2.681 1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 50 11.055 1.867 0.176 1.00 0.00 H new ATOM 0 HZ PHE A 50 9.472 3.414 1.326 1.00 0.00 H new ATOM 801 N GLU A 51 9.395 -1.680 -2.601 1.00 0.00 N ATOM 802 CA GLU A 51 10.173 -0.983 -3.622 1.00 0.00 C ATOM 803 C GLU A 51 9.379 -0.841 -4.921 1.00 0.00 C ATOM 804 O GLU A 51 9.378 0.237 -5.506 1.00 0.00 O ATOM 805 CB GLU A 51 11.524 -1.667 -3.854 1.00 0.00 C ATOM 806 CG GLU A 51 12.503 -1.371 -2.708 1.00 0.00 C ATOM 807 CD GLU A 51 13.665 -2.358 -2.688 1.00 0.00 C ATOM 808 OE1 GLU A 51 14.149 -2.696 -3.790 1.00 0.00 O ATOM 809 OE2 GLU A 51 14.051 -2.760 -1.569 1.00 0.00 O ATOM 0 H GLU A 51 9.754 -2.599 -2.342 1.00 0.00 H new ATOM 0 HA GLU A 51 10.379 0.023 -3.256 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.379 -2.744 -3.942 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.950 -1.325 -4.797 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.889 -0.357 -2.812 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.973 -1.414 -1.757 1.00 0.00 H new ATOM 816 N GLU A 52 8.691 -1.896 -5.373 1.00 0.00 N ATOM 817 CA GLU A 52 7.862 -1.826 -6.573 1.00 0.00 C ATOM 818 C GLU A 52 6.853 -0.702 -6.361 1.00 0.00 C ATOM 819 O GLU A 52 6.670 0.177 -7.199 1.00 0.00 O ATOM 820 CB GLU A 52 7.154 -3.175 -6.791 1.00 0.00 C ATOM 821 CG GLU A 52 5.923 -3.085 -7.712 1.00 0.00 C ATOM 822 CD GLU A 52 6.244 -2.557 -9.109 1.00 0.00 C ATOM 823 OE1 GLU A 52 7.341 -2.886 -9.609 1.00 0.00 O ATOM 824 OE2 GLU A 52 5.373 -1.849 -9.658 1.00 0.00 O ATOM 0 H GLU A 52 8.695 -2.810 -4.921 1.00 0.00 H new ATOM 0 HA GLU A 52 8.462 -1.623 -7.460 1.00 0.00 H new ATOM 0 HB2 GLU A 52 7.864 -3.884 -7.217 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.846 -3.574 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 52 5.472 -4.074 -7.801 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.179 -2.436 -7.249 1.00 0.00 H new ATOM 831 N LEU A 53 6.202 -0.759 -5.204 1.00 0.00 N ATOM 832 CA LEU A 53 5.230 0.217 -4.768 1.00 0.00 C ATOM 833 C LEU A 53 5.827 1.625 -4.757 1.00 0.00 C ATOM 834 O LEU A 53 5.243 2.559 -5.292 1.00 0.00 O ATOM 835 CB LEU A 53 4.766 -0.181 -3.359 1.00 0.00 C ATOM 836 CG LEU A 53 3.496 -1.030 -3.407 1.00 0.00 C ATOM 837 CD1 LEU A 53 3.431 -1.947 -2.191 1.00 0.00 C ATOM 838 CD2 LEU A 53 2.289 -0.091 -3.391 1.00 0.00 C ATOM 0 H LEU A 53 6.346 -1.511 -4.529 1.00 0.00 H new ATOM 0 HA LEU A 53 4.387 0.233 -5.458 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.558 -0.737 -2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.583 0.716 -2.768 1.00 0.00 H new ATOM 0 HG LEU A 53 3.497 -1.641 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.522 -2.547 -2.236 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.300 -2.605 -2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.424 -1.346 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.371 -0.678 -3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.305 0.506 -2.479 1.00 0.00 H new ATOM 0 HD23 LEU A 53 2.330 0.569 -4.258 1.00 0.00 H new ATOM 850 N ASP A 54 6.992 1.783 -4.139 1.00 0.00 N ATOM 851 CA ASP A 54 7.694 3.035 -3.949 1.00 0.00 C ATOM 852 C ASP A 54 8.499 3.340 -5.209 1.00 0.00 C ATOM 853 O ASP A 54 9.716 3.486 -5.160 1.00 0.00 O ATOM 854 CB ASP A 54 8.555 2.902 -2.678 1.00 0.00 C ATOM 855 CG ASP A 54 9.063 4.230 -2.134 1.00 0.00 C ATOM 856 OD1 ASP A 54 9.912 4.849 -2.807 1.00 0.00 O ATOM 857 OD2 ASP A 54 8.601 4.617 -1.038 1.00 0.00 O ATOM 0 H ASP A 54 7.496 0.993 -3.736 1.00 0.00 H new ATOM 0 HA ASP A 54 7.019 3.878 -3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 54 7.969 2.404 -1.905 1.00 0.00 H new ATOM 0 HB3 ASP A 54 9.408 2.259 -2.895 1.00 0.00 H new ATOM 862 N LYS A 55 7.813 3.447 -6.352 1.00 0.00 N ATOM 863 CA LYS A 55 8.466 3.753 -7.619 1.00 0.00 C ATOM 864 C LYS A 55 9.255 5.059 -7.492 1.00 0.00 C ATOM 865 O LYS A 55 10.345 5.191 -8.040 1.00 0.00 O ATOM 866 CB LYS A 55 7.457 3.735 -8.783 1.00 0.00 C ATOM 867 CG LYS A 55 7.007 5.101 -9.311 1.00 0.00 C ATOM 868 CD LYS A 55 6.030 4.888 -10.477 1.00 0.00 C ATOM 869 CE LYS A 55 4.883 5.892 -10.379 1.00 0.00 C ATOM 870 NZ LYS A 55 3.955 5.768 -11.516 1.00 0.00 N ATOM 0 H LYS A 55 6.803 3.325 -6.420 1.00 0.00 H new ATOM 0 HA LYS A 55 9.190 2.975 -7.861 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.897 3.177 -9.609 1.00 0.00 H new ATOM 0 HB3 LYS A 55 6.573 3.184 -8.461 1.00 0.00 H new ATOM 0 HG2 LYS A 55 6.527 5.672 -8.517 1.00 0.00 H new ATOM 0 HG3 LYS A 55 7.869 5.679 -9.643 1.00 0.00 H new ATOM 0 HD2 LYS A 55 6.551 5.008 -11.427 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.639 3.871 -10.455 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.340 5.735 -9.447 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.286 6.904 -10.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.189 6.465 -11.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.468 5.942 -12.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.551 4.810 -11.532 1.00 0.00 H new ATOM 884 N ASN A 56 8.697 6.025 -6.753 1.00 0.00 N ATOM 885 CA ASN A 56 9.337 7.300 -6.479 1.00 0.00 C ATOM 886 C ASN A 56 8.741 7.892 -5.202 1.00 0.00 C ATOM 887 O ASN A 56 8.285 9.032 -5.191 1.00 0.00 O ATOM 888 CB ASN A 56 9.235 8.253 -7.682 1.00 0.00 C ATOM 889 CG ASN A 56 10.325 9.312 -7.657 1.00 0.00 C ATOM 890 OD1 ASN A 56 11.258 9.319 -8.448 1.00 0.00 O ATOM 891 ND2 ASN A 56 10.199 10.227 -6.728 1.00 0.00 N ATOM 0 H ASN A 56 7.775 5.934 -6.326 1.00 0.00 H new ATOM 0 HA ASN A 56 10.404 7.146 -6.318 1.00 0.00 H new ATOM 0 HB2 ASN A 56 9.306 7.680 -8.607 1.00 0.00 H new ATOM 0 HB3 ASN A 56 8.258 8.737 -7.681 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.890 10.973 -6.650 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.409 10.194 -6.083 1.00 0.00 H new ATOM 898 N GLY A 57 8.744 7.114 -4.118 1.00 0.00 N ATOM 899 CA GLY A 57 8.263 7.568 -2.821 1.00 0.00 C ATOM 900 C GLY A 57 9.465 8.205 -2.132 1.00 0.00 C ATOM 901 O GLY A 57 9.443 9.372 -1.759 1.00 0.00 O ATOM 0 H GLY A 57 9.081 6.151 -4.119 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.451 8.287 -2.935 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.872 6.736 -2.236 1.00 0.00 H new ATOM 905 N ASP A 58 10.524 7.402 -1.986 1.00 0.00 N ATOM 906 CA ASP A 58 11.855 7.762 -1.502 1.00 0.00 C ATOM 907 C ASP A 58 11.797 8.230 -0.059 1.00 0.00 C ATOM 908 O ASP A 58 12.473 9.157 0.371 1.00 0.00 O ATOM 909 CB ASP A 58 12.639 8.666 -2.477 1.00 0.00 C ATOM 910 CG ASP A 58 12.055 10.056 -2.725 1.00 0.00 C ATOM 911 OD1 ASP A 58 12.307 10.954 -1.894 1.00 0.00 O ATOM 912 OD2 ASP A 58 11.408 10.209 -3.786 1.00 0.00 O ATOM 0 H ASP A 58 10.466 6.411 -2.221 1.00 0.00 H new ATOM 0 HA ASP A 58 12.469 6.861 -1.485 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.653 8.784 -2.095 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.717 8.151 -3.435 1.00 0.00 H new ATOM 917 N GLY A 59 10.961 7.518 0.686 1.00 0.00 N ATOM 918 CA GLY A 59 10.713 7.733 2.090 1.00 0.00 C ATOM 919 C GLY A 59 9.470 6.937 2.438 1.00 0.00 C ATOM 920 O GLY A 59 9.483 6.135 3.367 1.00 0.00 O ATOM 0 H GLY A 59 10.418 6.744 0.304 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.563 7.405 2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.566 8.792 2.300 1.00 0.00 H new ATOM 924 N GLU A 60 8.391 7.153 1.677 1.00 0.00 N ATOM 925 CA GLU A 60 7.133 6.483 1.905 1.00 0.00 C ATOM 926 C GLU A 60 6.349 6.444 0.598 1.00 0.00 C ATOM 927 O GLU A 60 6.606 7.231 -0.308 1.00 0.00 O ATOM 928 CB GLU A 60 6.310 7.282 2.922 1.00 0.00 C ATOM 929 CG GLU A 60 7.003 7.706 4.221 1.00 0.00 C ATOM 930 CD GLU A 60 6.045 8.508 5.095 1.00 0.00 C ATOM 931 OE1 GLU A 60 5.881 9.714 4.798 1.00 0.00 O ATOM 932 OE2 GLU A 60 5.477 7.899 6.024 1.00 0.00 O ATOM 0 H GLU A 60 8.379 7.800 0.889 1.00 0.00 H new ATOM 0 HA GLU A 60 7.322 5.475 2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 60 5.946 8.182 2.426 1.00 0.00 H new ATOM 0 HB3 GLU A 60 5.435 6.688 3.187 1.00 0.00 H new ATOM 0 HG2 GLU A 60 7.348 6.825 4.762 1.00 0.00 H new ATOM 0 HG3 GLU A 60 7.885 8.305 3.992 1.00 0.00 H new ATOM 939 N VAL A 61 5.367 5.553 0.543 1.00 0.00 N ATOM 940 CA VAL A 61 4.422 5.375 -0.549 1.00 0.00 C ATOM 941 C VAL A 61 3.307 6.381 -0.258 1.00 0.00 C ATOM 942 O VAL A 61 3.302 7.000 0.800 1.00 0.00 O ATOM 943 CB VAL A 61 3.928 3.905 -0.532 1.00 0.00 C ATOM 944 CG1 VAL A 61 2.758 3.602 -1.474 1.00 0.00 C ATOM 945 CG2 VAL A 61 5.090 2.974 -0.901 1.00 0.00 C ATOM 0 H VAL A 61 5.200 4.897 1.306 1.00 0.00 H new ATOM 0 HA VAL A 61 4.837 5.550 -1.542 1.00 0.00 H new ATOM 0 HB VAL A 61 3.563 3.738 0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.486 2.550 -1.390 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.903 4.221 -1.203 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.052 3.820 -2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.745 1.940 -0.890 1.00 0.00 H new ATOM 0 HG22 VAL A 61 5.454 3.224 -1.897 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.897 3.095 -0.178 1.00 0.00 H new ATOM 955 N SER A 62 2.337 6.555 -1.149 1.00 0.00 N ATOM 956 CA SER A 62 1.184 7.418 -0.941 1.00 0.00 C ATOM 957 C SER A 62 0.055 6.802 -1.737 1.00 0.00 C ATOM 958 O SER A 62 0.316 5.919 -2.552 1.00 0.00 O ATOM 959 CB SER A 62 1.438 8.862 -1.383 1.00 0.00 C ATOM 960 OG SER A 62 1.498 8.917 -2.791 1.00 0.00 O ATOM 0 H SER A 62 2.332 6.088 -2.056 1.00 0.00 H new ATOM 0 HA SER A 62 0.949 7.482 0.121 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.643 9.511 -1.016 1.00 0.00 H new ATOM 0 HB3 SER A 62 2.371 9.227 -0.954 1.00 0.00 H new ATOM 0 HG SER A 62 1.659 9.841 -3.076 1.00 0.00 H new ATOM 966 N PHE A 63 -1.181 7.248 -1.535 1.00 0.00 N ATOM 967 CA PHE A 63 -2.282 6.700 -2.306 1.00 0.00 C ATOM 968 C PHE A 63 -2.051 6.901 -3.803 1.00 0.00 C ATOM 969 O PHE A 63 -2.497 6.084 -4.598 1.00 0.00 O ATOM 970 CB PHE A 63 -3.618 7.261 -1.831 1.00 0.00 C ATOM 971 CG PHE A 63 -4.813 6.797 -2.643 1.00 0.00 C ATOM 972 CD1 PHE A 63 -5.397 5.553 -2.348 1.00 0.00 C ATOM 973 CD2 PHE A 63 -5.190 7.478 -3.818 1.00 0.00 C ATOM 974 CE1 PHE A 63 -6.426 5.043 -3.160 1.00 0.00 C ATOM 975 CE2 PHE A 63 -6.163 6.924 -4.672 1.00 0.00 C ATOM 976 CZ PHE A 63 -6.857 5.765 -4.285 1.00 0.00 C ATOM 0 H PHE A 63 -1.438 7.969 -0.861 1.00 0.00 H new ATOM 0 HA PHE A 63 -2.323 5.624 -2.138 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -3.769 6.977 -0.789 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -3.573 8.350 -1.861 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -5.054 4.987 -1.495 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.732 8.425 -4.063 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -6.885 4.096 -2.918 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -6.376 7.389 -5.623 1.00 0.00 H new ATOM 0 HZ PHE A 63 -7.716 5.432 -4.849 1.00 0.00 H new ATOM 986 N GLU A 64 -1.331 7.962 -4.185 1.00 0.00 N ATOM 987 CA GLU A 64 -1.102 8.327 -5.573 1.00 0.00 C ATOM 988 C GLU A 64 -0.355 7.179 -6.231 1.00 0.00 C ATOM 989 O GLU A 64 -0.815 6.494 -7.139 1.00 0.00 O ATOM 990 CB GLU A 64 -0.260 9.622 -5.599 1.00 0.00 C ATOM 991 CG GLU A 64 -0.220 10.212 -7.012 1.00 0.00 C ATOM 992 CD GLU A 64 0.593 11.502 -7.046 1.00 0.00 C ATOM 993 OE1 GLU A 64 1.835 11.384 -7.106 1.00 0.00 O ATOM 994 OE2 GLU A 64 -0.043 12.577 -6.999 1.00 0.00 O ATOM 0 H GLU A 64 -0.887 8.597 -3.521 1.00 0.00 H new ATOM 0 HA GLU A 64 -2.034 8.506 -6.109 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.682 10.351 -4.907 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.754 9.410 -5.259 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.214 9.487 -7.700 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.235 10.409 -7.356 1.00 0.00 H new ATOM 1001 N GLU A 65 0.834 7.005 -5.683 1.00 0.00 N ATOM 1002 CA GLU A 65 1.830 6.034 -6.011 1.00 0.00 C ATOM 1003 C GLU A 65 1.195 4.638 -5.953 1.00 0.00 C ATOM 1004 O GLU A 65 1.277 3.853 -6.894 1.00 0.00 O ATOM 1005 CB GLU A 65 2.888 6.301 -4.937 1.00 0.00 C ATOM 1006 CG GLU A 65 3.939 5.232 -4.779 1.00 0.00 C ATOM 1007 CD GLU A 65 4.989 5.316 -5.881 1.00 0.00 C ATOM 1008 OE1 GLU A 65 4.631 4.963 -7.024 1.00 0.00 O ATOM 1009 OE2 GLU A 65 6.122 5.749 -5.572 1.00 0.00 O ATOM 0 H GLU A 65 1.145 7.608 -4.921 1.00 0.00 H new ATOM 0 HA GLU A 65 2.263 6.092 -7.010 1.00 0.00 H new ATOM 0 HB2 GLU A 65 3.385 7.243 -5.168 1.00 0.00 H new ATOM 0 HB3 GLU A 65 2.383 6.434 -3.980 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.421 5.335 -3.807 1.00 0.00 H new ATOM 0 HG3 GLU A 65 3.467 4.250 -4.799 1.00 0.00 H new ATOM 1016 N PHE A 66 0.538 4.344 -4.831 1.00 0.00 N ATOM 1017 CA PHE A 66 -0.152 3.088 -4.565 1.00 0.00 C ATOM 1018 C PHE A 66 -1.100 2.685 -5.698 1.00 0.00 C ATOM 1019 O PHE A 66 -1.303 1.486 -5.893 1.00 0.00 O ATOM 1020 CB PHE A 66 -0.859 3.228 -3.213 1.00 0.00 C ATOM 1021 CG PHE A 66 -1.834 2.145 -2.820 1.00 0.00 C ATOM 1022 CD1 PHE A 66 -1.399 0.820 -2.655 1.00 0.00 C ATOM 1023 CD2 PHE A 66 -3.175 2.475 -2.560 1.00 0.00 C ATOM 1024 CE1 PHE A 66 -2.338 -0.203 -2.442 1.00 0.00 C ATOM 1025 CE2 PHE A 66 -4.083 1.474 -2.181 1.00 0.00 C ATOM 1026 CZ PHE A 66 -3.675 0.129 -2.161 1.00 0.00 C ATOM 0 H PHE A 66 0.471 5.002 -4.054 1.00 0.00 H new ATOM 0 HA PHE A 66 0.567 2.270 -4.518 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -0.094 3.289 -2.439 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -1.393 4.178 -3.210 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -0.345 0.588 -2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -3.507 3.499 -2.652 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -2.035 -1.238 -2.494 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.094 1.737 -1.905 1.00 0.00 H new ATOM 0 HZ PHE A 66 -4.388 -0.649 -1.930 1.00 0.00 H new ATOM 1036 N GLN A 67 -1.660 3.627 -6.474 1.00 0.00 N ATOM 1037 CA GLN A 67 -2.513 3.229 -7.593 1.00 0.00 C ATOM 1038 C GLN A 67 -1.802 2.276 -8.551 1.00 0.00 C ATOM 1039 O GLN A 67 -2.455 1.467 -9.205 1.00 0.00 O ATOM 1040 CB GLN A 67 -3.252 4.386 -8.285 1.00 0.00 C ATOM 1041 CG GLN A 67 -4.027 5.277 -7.318 1.00 0.00 C ATOM 1042 CD GLN A 67 -4.877 4.422 -6.389 1.00 0.00 C ATOM 1043 OE1 GLN A 67 -5.957 3.968 -6.742 1.00 0.00 O ATOM 1044 NE2 GLN A 67 -4.394 4.177 -5.185 1.00 0.00 N ATOM 0 H GLN A 67 -1.541 4.633 -6.351 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.326 2.656 -7.146 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -2.530 4.995 -8.828 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.942 3.977 -9.022 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -3.334 5.884 -6.735 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.663 5.966 -7.875 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -3.492 4.564 -4.909 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.923 3.600 -4.531 1.00 0.00 H new ATOM 1053 N VAL A 68 -0.469 2.327 -8.608 1.00 0.00 N ATOM 1054 CA VAL A 68 0.292 1.379 -9.404 1.00 0.00 C ATOM 1055 C VAL A 68 -0.055 -0.035 -8.920 1.00 0.00 C ATOM 1056 O VAL A 68 -0.386 -0.896 -9.726 1.00 0.00 O ATOM 1057 CB VAL A 68 1.799 1.679 -9.310 1.00 0.00 C ATOM 1058 CG1 VAL A 68 2.638 0.604 -10.015 1.00 0.00 C ATOM 1059 CG2 VAL A 68 2.119 3.038 -9.949 1.00 0.00 C ATOM 0 H VAL A 68 0.098 3.015 -8.112 1.00 0.00 H new ATOM 0 HA VAL A 68 0.031 1.464 -10.459 1.00 0.00 H new ATOM 0 HB VAL A 68 2.053 1.690 -8.250 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.696 0.852 -9.926 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.452 -0.365 -9.551 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.363 0.561 -11.069 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.189 3.233 -9.873 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.826 3.024 -10.999 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.569 3.823 -9.429 1.00 0.00 H new ATOM 1069 N LEU A 69 -0.016 -0.277 -7.607 1.00 0.00 N ATOM 1070 CA LEU A 69 -0.331 -1.581 -7.028 1.00 0.00 C ATOM 1071 C LEU A 69 -1.824 -1.860 -7.239 1.00 0.00 C ATOM 1072 O LEU A 69 -2.191 -2.964 -7.641 1.00 0.00 O ATOM 1073 CB LEU A 69 0.091 -1.564 -5.550 1.00 0.00 C ATOM 1074 CG LEU A 69 0.235 -2.908 -4.807 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -1.066 -3.705 -4.747 1.00 0.00 C ATOM 1076 CD2 LEU A 69 1.343 -3.787 -5.395 1.00 0.00 C ATOM 0 H LEU A 69 0.236 0.429 -6.916 1.00 0.00 H new ATOM 0 HA LEU A 69 0.213 -2.393 -7.509 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.048 -1.046 -5.485 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.636 -0.961 -5.005 1.00 0.00 H new ATOM 0 HG LEU A 69 0.509 -2.631 -3.789 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.896 -4.639 -4.211 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.826 -3.122 -4.227 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.406 -3.924 -5.759 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.402 -4.721 -4.836 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.120 -4.003 -6.440 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.297 -3.263 -5.329 1.00 0.00 H new ATOM 1088 N VAL A 70 -2.691 -0.863 -6.997 1.00 0.00 N ATOM 1089 CA VAL A 70 -4.135 -1.020 -7.215 1.00 0.00 C ATOM 1090 C VAL A 70 -4.406 -1.498 -8.648 1.00 0.00 C ATOM 1091 O VAL A 70 -5.317 -2.286 -8.878 1.00 0.00 O ATOM 1092 CB VAL A 70 -4.931 0.254 -6.882 1.00 0.00 C ATOM 1093 CG1 VAL A 70 -6.437 0.044 -7.090 1.00 0.00 C ATOM 1094 CG2 VAL A 70 -4.708 0.675 -5.424 1.00 0.00 C ATOM 0 H VAL A 70 -2.416 0.057 -6.652 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.488 -1.782 -6.520 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.572 1.032 -7.556 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -6.970 0.963 -6.846 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -6.627 -0.220 -8.130 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -6.785 -0.760 -6.442 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.282 1.578 -5.214 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.035 -0.125 -4.760 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.649 0.872 -5.260 1.00 0.00 H new ATOM 1104 N LYS A 71 -3.623 -1.044 -9.624 1.00 0.00 N ATOM 1105 CA LYS A 71 -3.753 -1.526 -10.985 1.00 0.00 C ATOM 1106 C LYS A 71 -3.147 -2.935 -11.055 1.00 0.00 C ATOM 1107 O LYS A 71 -3.748 -3.858 -11.605 1.00 0.00 O ATOM 1108 CB LYS A 71 -3.039 -0.535 -11.911 1.00 0.00 C ATOM 1109 CG LYS A 71 -3.184 -0.897 -13.394 1.00 0.00 C ATOM 1110 CD LYS A 71 -2.302 0.018 -14.253 1.00 0.00 C ATOM 1111 CE LYS A 71 -2.816 1.462 -14.292 1.00 0.00 C ATOM 1112 NZ LYS A 71 -2.016 2.286 -15.216 1.00 0.00 N ATOM 0 H LYS A 71 -2.894 -0.343 -9.492 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.794 -1.593 -11.302 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -3.441 0.465 -11.745 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -1.981 -0.500 -11.652 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -2.901 -1.938 -13.551 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.226 -0.800 -13.699 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -1.285 0.008 -13.862 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -2.257 -0.376 -15.268 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -3.861 1.471 -14.603 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -2.778 1.892 -13.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.386 3.258 -15.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.024 2.295 -14.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -2.073 1.887 -16.175 1.00 0.00 H new ATOM 1126 N LYS A 72 -1.943 -3.106 -10.500 1.00 0.00 N ATOM 1127 CA LYS A 72 -1.185 -4.346 -10.541 1.00 0.00 C ATOM 1128 C LYS A 72 -1.895 -5.579 -9.991 1.00 0.00 C ATOM 1129 O LYS A 72 -1.667 -6.698 -10.448 1.00 0.00 O ATOM 1130 CB LYS A 72 0.260 -4.148 -10.082 1.00 0.00 C ATOM 1131 CG LYS A 72 0.819 -5.131 -9.050 1.00 0.00 C ATOM 1132 CD LYS A 72 1.356 -6.355 -9.795 1.00 0.00 C ATOM 1133 CE LYS A 72 1.425 -7.608 -8.916 1.00 0.00 C ATOM 1134 NZ LYS A 72 0.080 -8.050 -8.503 1.00 0.00 N ATOM 0 H LYS A 72 -1.461 -2.361 -9.997 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.121 -4.613 -11.596 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.900 -4.187 -10.963 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.346 -3.143 -9.669 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.613 -4.661 -8.469 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.041 -5.426 -8.346 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.720 -6.557 -10.657 1.00 0.00 H new ATOM 0 HD3 LYS A 72 2.351 -6.132 -10.179 1.00 0.00 H new ATOM 0 HE2 LYS A 72 1.922 -8.410 -9.462 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.029 -7.402 -8.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.040 -9.089 -8.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.122 -7.699 -7.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.628 -7.674 -9.166 1.00 0.00 H new ATOM 1148 N ILE A 73 -2.782 -5.402 -9.021 1.00 0.00 N ATOM 1149 CA ILE A 73 -3.559 -6.539 -8.519 1.00 0.00 C ATOM 1150 C ILE A 73 -4.374 -7.154 -9.669 1.00 0.00 C ATOM 1151 O ILE A 73 -4.675 -8.342 -9.637 1.00 0.00 O ATOM 1152 CB ILE A 73 -4.500 -6.170 -7.365 1.00 0.00 C ATOM 1153 CG1 ILE A 73 -5.232 -4.859 -7.649 1.00 0.00 C ATOM 1154 CG2 ILE A 73 -3.760 -6.095 -6.025 1.00 0.00 C ATOM 1155 CD1 ILE A 73 -6.591 -4.797 -6.962 1.00 0.00 C ATOM 0 H ILE A 73 -2.982 -4.508 -8.572 1.00 0.00 H new ATOM 0 HA ILE A 73 -2.842 -7.259 -8.124 1.00 0.00 H new ATOM 0 HB ILE A 73 -5.239 -6.968 -7.289 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.619 -4.023 -7.313 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.365 -4.745 -8.725 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.463 -5.831 -5.235 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.311 -7.063 -5.803 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.978 -5.337 -6.083 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -7.073 -3.847 -7.194 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.216 -5.617 -7.317 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -6.458 -4.883 -5.884 1.00 0.00 H new ATOM 1167 N SER A 74 -4.694 -6.368 -10.705 1.00 0.00 N ATOM 1168 CA SER A 74 -5.392 -6.828 -11.895 1.00 0.00 C ATOM 1169 C SER A 74 -4.342 -6.986 -12.998 1.00 0.00 C ATOM 1170 O SER A 74 -4.618 -6.749 -14.168 1.00 0.00 O ATOM 1171 CB SER A 74 -6.463 -5.803 -12.282 1.00 0.00 C ATOM 1172 OG SER A 74 -7.336 -5.582 -11.192 1.00 0.00 O ATOM 0 H SER A 74 -4.466 -5.374 -10.732 1.00 0.00 H new ATOM 0 HA SER A 74 -5.896 -7.780 -11.728 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.991 -4.866 -12.577 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.027 -6.161 -13.143 1.00 0.00 H new ATOM 0 HG SER A 74 -8.017 -4.924 -11.446 1.00 0.00 H new ATOM 1178 N GLN A 75 -3.116 -7.355 -12.618 1.00 0.00 N ATOM 1179 CA GLN A 75 -1.968 -7.523 -13.494 1.00 0.00 C ATOM 1180 C GLN A 75 -1.126 -8.703 -13.005 1.00 0.00 C ATOM 1181 O GLN A 75 0.103 -8.652 -13.000 1.00 0.00 O ATOM 1182 CB GLN A 75 -1.181 -6.199 -13.500 1.00 0.00 C ATOM 1183 CG GLN A 75 -0.493 -5.926 -14.836 1.00 0.00 C ATOM 1184 CD GLN A 75 -1.437 -5.349 -15.896 1.00 0.00 C ATOM 1185 OE1 GLN A 75 -0.988 -4.874 -16.929 1.00 0.00 O ATOM 1186 NE2 GLN A 75 -2.749 -5.357 -15.690 1.00 0.00 N ATOM 0 H GLN A 75 -2.893 -7.553 -11.643 1.00 0.00 H new ATOM 0 HA GLN A 75 -2.270 -7.750 -14.516 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -1.860 -5.377 -13.271 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -0.432 -6.223 -12.709 1.00 0.00 H new ATOM 0 HG2 GLN A 75 0.332 -5.231 -14.677 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -0.061 -6.854 -15.211 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -3.128 -5.752 -14.829 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -3.378 -4.968 -16.392 1.00 0.00 H new