USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 678 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 165 LYS NZ :NH3+ -123:sc= 0.803 (180deg=0.202) USER MOD Set 1.2: A 235 THR OG1 : rot -54:sc= 0.836 USER MOD Set 2.1: A 182 HIS :FLIP no HE2:sc= -3.99! C(o=-5.3!,f=-3.7!) USER MOD Set 2.2: A 192 THR OG1 : rot 131:sc= 0.251 USER MOD Single : A 159 MET CE :methyl -148:sc= -0.407 (180deg=-1.44!) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 180 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 181 GLN : amide:sc= -0.0183 K(o=-0.018,f=-0.75) USER MOD Single : A 187 ASN : amide:sc= -0.3 K(o=-0.3,f=-1.6) USER MOD Single : A 188 SER OG : rot 104:sc= 0.0421 USER MOD Single : A 190 TYR OH : rot -11:sc= 1.23 USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 HIS : no HE2:sc= 0.871 K(o=0.87,f=-5.7!) USER MOD Single : A 202 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 ASN : amide:sc= -0.497 K(o=-0.5,f=-2.3!) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 224 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 225 HIS : no HD1:sc= -3.43 K(o=-3.4,f=-5.2!) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 ASN : amide:sc= -0.109 K(o=-0.11,f=-2.2!) USER MOD Single : A 236 TYR OH : rot 180:sc= 0 USER MOD Single : A 240 TYR OH : rot 180:sc= 0 USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 245 LYS NZ :NH3+ 149:sc= 1.05 (180deg=-0.592) USER MOD ----------------------------------------------------------------- ATOM 50 N VAL A 158 -4.436 -0.940 -14.337 1.00 0.00 N ATOM 51 CA VAL A 158 -3.301 -0.886 -13.423 1.00 0.00 C ATOM 52 C VAL A 158 -2.700 0.515 -13.370 1.00 0.00 C ATOM 53 O VAL A 158 -2.294 1.065 -14.394 1.00 0.00 O ATOM 54 CB VAL A 158 -2.201 -1.889 -13.827 1.00 0.00 C ATOM 55 CG1 VAL A 158 -1.149 -1.999 -12.733 1.00 0.00 C ATOM 56 CG2 VAL A 158 -2.803 -3.253 -14.135 1.00 0.00 C ATOM 0 HA VAL A 158 -3.681 -1.153 -12.437 1.00 0.00 H new ATOM 0 HB VAL A 158 -1.717 -1.520 -14.731 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -0.382 -2.711 -13.036 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -0.693 -1.023 -12.567 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -1.618 -2.342 -11.811 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -2.010 -3.945 -14.418 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -3.317 -3.632 -13.252 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -3.513 -3.160 -14.956 1.00 0.00 H new ATOM 66 N MET A 159 -2.644 1.086 -12.170 1.00 0.00 N ATOM 67 CA MET A 159 -2.090 2.425 -11.985 1.00 0.00 C ATOM 68 C MET A 159 -1.007 2.425 -10.913 1.00 0.00 C ATOM 69 O MET A 159 -1.050 1.632 -9.972 1.00 0.00 O ATOM 70 CB MET A 159 -3.193 3.421 -11.616 1.00 0.00 C ATOM 71 CG MET A 159 -4.205 2.877 -10.618 1.00 0.00 C ATOM 72 SD MET A 159 -5.753 2.378 -11.397 1.00 0.00 S ATOM 73 CE MET A 159 -6.272 3.928 -12.131 1.00 0.00 C ATOM 0 H MET A 159 -2.975 0.644 -11.312 1.00 0.00 H new ATOM 0 HA MET A 159 -1.641 2.732 -12.929 1.00 0.00 H new ATOM 0 HB2 MET A 159 -2.735 4.319 -11.201 1.00 0.00 H new ATOM 0 HB3 MET A 159 -3.717 3.721 -12.524 1.00 0.00 H new ATOM 0 HG2 MET A 159 -3.773 2.022 -10.098 1.00 0.00 H new ATOM 0 HG3 MET A 159 -4.411 3.637 -9.865 1.00 0.00 H new ATOM 0 HE1 MET A 159 -7.361 3.980 -12.139 1.00 0.00 H new ATOM 0 HE2 MET A 159 -5.874 4.758 -11.548 1.00 0.00 H new ATOM 0 HE3 MET A 159 -5.898 3.990 -13.153 1.00 0.00 H new ATOM 83 N GLU A 160 -0.033 3.317 -11.065 1.00 0.00 N ATOM 84 CA GLU A 160 1.065 3.417 -10.112 1.00 0.00 C ATOM 85 C GLU A 160 0.817 4.527 -9.095 1.00 0.00 C ATOM 86 O GLU A 160 0.281 5.584 -9.431 1.00 0.00 O ATOM 87 CB GLU A 160 2.386 3.664 -10.845 1.00 0.00 C ATOM 88 CG GLU A 160 3.085 2.387 -11.286 1.00 0.00 C ATOM 89 CD GLU A 160 4.084 2.622 -12.400 1.00 0.00 C ATOM 90 OE1 GLU A 160 3.683 2.563 -13.581 1.00 0.00 O ATOM 91 OE2 GLU A 160 5.270 2.866 -12.093 1.00 0.00 O ATOM 0 H GLU A 160 0.018 3.980 -11.839 1.00 0.00 H new ATOM 0 HA GLU A 160 1.126 2.471 -9.574 1.00 0.00 H new ATOM 0 HB2 GLU A 160 2.196 4.285 -11.720 1.00 0.00 H new ATOM 0 HB3 GLU A 160 3.054 4.228 -10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 160 3.597 1.944 -10.432 1.00 0.00 H new ATOM 0 HG3 GLU A 160 2.339 1.666 -11.619 1.00 0.00 H new ATOM 98 N ILE A 161 1.220 4.280 -7.851 1.00 0.00 N ATOM 99 CA ILE A 161 1.053 5.252 -6.779 1.00 0.00 C ATOM 100 C ILE A 161 2.425 5.663 -6.233 1.00 0.00 C ATOM 101 O ILE A 161 3.194 4.832 -5.757 1.00 0.00 O ATOM 102 CB ILE A 161 0.103 4.676 -5.675 1.00 0.00 C ATOM 103 CG1 ILE A 161 -1.342 5.068 -6.003 1.00 0.00 C ATOM 104 CG2 ILE A 161 0.469 5.122 -4.257 1.00 0.00 C ATOM 105 CD1 ILE A 161 -2.363 4.577 -4.997 1.00 0.00 C ATOM 0 H ILE A 161 1.667 3.410 -7.562 1.00 0.00 H new ATOM 0 HA ILE A 161 0.578 6.155 -7.162 1.00 0.00 H new ATOM 0 HB ILE A 161 0.218 3.592 -5.684 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -1.406 6.154 -6.068 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.599 4.674 -6.986 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -0.232 4.685 -3.546 1.00 0.00 H new ATOM 0 HG22 ILE A 161 1.480 4.790 -4.021 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.420 6.209 -4.193 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -3.359 4.897 -5.303 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -2.331 3.489 -4.948 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -2.135 4.992 -4.015 1.00 0.00 H new ATOM 117 N LYS A 162 2.725 6.952 -6.334 1.00 0.00 N ATOM 118 CA LYS A 162 4.007 7.480 -5.887 1.00 0.00 C ATOM 119 C LYS A 162 3.903 8.154 -4.523 1.00 0.00 C ATOM 120 O LYS A 162 3.036 8.999 -4.297 1.00 0.00 O ATOM 121 CB LYS A 162 4.537 8.478 -6.918 1.00 0.00 C ATOM 122 CG LYS A 162 6.005 8.827 -6.741 1.00 0.00 C ATOM 123 CD LYS A 162 6.508 9.704 -7.877 1.00 0.00 C ATOM 124 CE LYS A 162 6.560 11.168 -7.469 1.00 0.00 C ATOM 125 NZ LYS A 162 7.632 11.909 -8.189 1.00 0.00 N ATOM 0 H LYS A 162 2.095 7.653 -6.723 1.00 0.00 H new ATOM 0 HA LYS A 162 4.696 6.641 -5.788 1.00 0.00 H new ATOM 0 HB2 LYS A 162 4.390 8.066 -7.916 1.00 0.00 H new ATOM 0 HB3 LYS A 162 3.947 9.393 -6.860 1.00 0.00 H new ATOM 0 HG2 LYS A 162 6.146 9.343 -5.791 1.00 0.00 H new ATOM 0 HG3 LYS A 162 6.595 7.912 -6.697 1.00 0.00 H new ATOM 0 HD2 LYS A 162 7.502 9.374 -8.180 1.00 0.00 H new ATOM 0 HD3 LYS A 162 5.856 9.589 -8.743 1.00 0.00 H new ATOM 0 HE2 LYS A 162 5.597 11.636 -7.672 1.00 0.00 H new ATOM 0 HE3 LYS A 162 6.729 11.239 -6.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 7.633 12.903 -7.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 8.555 11.479 -7.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 7.458 11.863 -9.213 1.00 0.00 H new ATOM 139 N LEU A 163 4.811 7.787 -3.621 1.00 0.00 N ATOM 140 CA LEU A 163 4.845 8.368 -2.282 1.00 0.00 C ATOM 141 C LEU A 163 6.269 8.788 -1.937 1.00 0.00 C ATOM 142 O LEU A 163 7.211 8.019 -2.125 1.00 0.00 O ATOM 143 CB LEU A 163 4.307 7.391 -1.213 1.00 0.00 C ATOM 144 CG LEU A 163 3.717 6.073 -1.727 1.00 0.00 C ATOM 145 CD1 LEU A 163 3.812 4.990 -0.653 1.00 0.00 C ATOM 146 CD2 LEU A 163 2.274 6.275 -2.166 1.00 0.00 C ATOM 0 H LEU A 163 5.534 7.089 -3.794 1.00 0.00 H new ATOM 0 HA LEU A 163 4.193 9.242 -2.283 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.120 7.156 -0.526 1.00 0.00 H new ATOM 0 HB3 LEU A 163 3.540 7.906 -0.635 1.00 0.00 H new ATOM 0 HG LEU A 163 4.295 5.746 -2.591 1.00 0.00 H new ATOM 0 HD11 LEU A 163 3.389 4.061 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU A 163 4.857 4.831 -0.388 1.00 0.00 H new ATOM 0 HD13 LEU A 163 3.258 5.305 0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 163 1.868 5.330 -2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 163 1.682 6.623 -1.320 1.00 0.00 H new ATOM 0 HD23 LEU A 163 2.237 7.016 -2.964 1.00 0.00 H new ATOM 158 N ILE A 164 6.430 10.007 -1.434 1.00 0.00 N ATOM 159 CA ILE A 164 7.753 10.497 -1.076 1.00 0.00 C ATOM 160 C ILE A 164 8.017 10.318 0.420 1.00 0.00 C ATOM 161 O ILE A 164 7.162 10.602 1.257 1.00 0.00 O ATOM 162 CB ILE A 164 7.960 11.977 -1.517 1.00 0.00 C ATOM 163 CG1 ILE A 164 9.437 12.232 -1.829 1.00 0.00 C ATOM 164 CG2 ILE A 164 7.458 12.975 -0.475 1.00 0.00 C ATOM 165 CD1 ILE A 164 10.335 12.144 -0.615 1.00 0.00 C ATOM 0 H ILE A 164 5.670 10.666 -1.267 1.00 0.00 H new ATOM 0 HA ILE A 164 8.483 9.897 -1.619 1.00 0.00 H new ATOM 0 HB ILE A 164 7.365 12.131 -2.417 1.00 0.00 H new ATOM 0 HG12 ILE A 164 9.773 11.509 -2.573 1.00 0.00 H new ATOM 0 HG13 ILE A 164 9.540 13.221 -2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 164 7.627 13.991 -0.833 1.00 0.00 H new ATOM 0 HG22 ILE A 164 6.392 12.821 -0.308 1.00 0.00 H new ATOM 0 HG23 ILE A 164 7.997 12.826 0.461 1.00 0.00 H new ATOM 0 HD11 ILE A 164 11.366 12.336 -0.911 1.00 0.00 H new ATOM 0 HD12 ILE A 164 10.025 12.885 0.121 1.00 0.00 H new ATOM 0 HD13 ILE A 164 10.262 11.147 -0.180 1.00 0.00 H new ATOM 177 N LYS A 165 9.206 9.830 0.730 1.00 0.00 N ATOM 178 CA LYS A 165 9.611 9.583 2.107 1.00 0.00 C ATOM 179 C LYS A 165 9.823 10.891 2.859 1.00 0.00 C ATOM 180 O LYS A 165 10.895 11.494 2.792 1.00 0.00 O ATOM 181 CB LYS A 165 10.897 8.747 2.122 1.00 0.00 C ATOM 182 CG LYS A 165 10.944 7.640 3.175 1.00 0.00 C ATOM 183 CD LYS A 165 9.653 6.826 3.260 1.00 0.00 C ATOM 184 CE LYS A 165 9.142 6.372 1.897 1.00 0.00 C ATOM 185 NZ LYS A 165 9.898 5.199 1.380 1.00 0.00 N ATOM 0 H LYS A 165 9.917 9.594 0.038 1.00 0.00 H new ATOM 0 HA LYS A 165 8.815 9.033 2.610 1.00 0.00 H new ATOM 0 HB2 LYS A 165 11.029 8.296 1.138 1.00 0.00 H new ATOM 0 HB3 LYS A 165 11.743 9.415 2.283 1.00 0.00 H new ATOM 0 HG2 LYS A 165 11.773 6.969 2.949 1.00 0.00 H new ATOM 0 HG3 LYS A 165 11.149 8.084 4.149 1.00 0.00 H new ATOM 0 HD2 LYS A 165 9.823 5.951 3.888 1.00 0.00 H new ATOM 0 HD3 LYS A 165 8.884 7.425 3.749 1.00 0.00 H new ATOM 0 HE2 LYS A 165 8.085 6.117 1.973 1.00 0.00 H new ATOM 0 HE3 LYS A 165 9.221 7.196 1.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 10.305 5.430 0.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 10.663 4.959 2.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 9.256 4.387 1.284 1.00 0.00 H new ATOM 199 N GLY A 166 8.797 11.316 3.580 1.00 0.00 N ATOM 200 CA GLY A 166 8.884 12.543 4.346 1.00 0.00 C ATOM 201 C GLY A 166 9.140 12.276 5.819 1.00 0.00 C ATOM 202 O GLY A 166 9.628 11.204 6.175 1.00 0.00 O ATOM 0 H GLY A 166 7.902 10.832 3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 166 9.685 13.165 3.946 1.00 0.00 H new ATOM 0 HA3 GLY A 166 7.957 13.106 4.235 1.00 0.00 H new ATOM 206 N PRO A 167 8.813 13.229 6.713 1.00 0.00 N ATOM 207 CA PRO A 167 9.018 13.049 8.154 1.00 0.00 C ATOM 208 C PRO A 167 8.170 11.914 8.726 1.00 0.00 C ATOM 209 O PRO A 167 8.472 11.382 9.795 1.00 0.00 O ATOM 210 CB PRO A 167 8.590 14.394 8.753 1.00 0.00 C ATOM 211 CG PRO A 167 7.697 15.005 7.730 1.00 0.00 C ATOM 212 CD PRO A 167 8.216 14.542 6.400 1.00 0.00 C ATOM 0 HA PRO A 167 10.048 12.777 8.384 1.00 0.00 H new ATOM 0 HB2 PRO A 167 8.069 14.256 9.700 1.00 0.00 H new ATOM 0 HB3 PRO A 167 9.453 15.029 8.954 1.00 0.00 H new ATOM 0 HG2 PRO A 167 6.663 14.691 7.876 1.00 0.00 H new ATOM 0 HG3 PRO A 167 7.712 16.093 7.798 1.00 0.00 H new ATOM 0 HD2 PRO A 167 7.417 14.456 5.663 1.00 0.00 H new ATOM 0 HD3 PRO A 167 8.953 15.233 5.992 1.00 0.00 H new ATOM 220 N LYS A 168 7.103 11.549 8.016 1.00 0.00 N ATOM 221 CA LYS A 168 6.215 10.481 8.465 1.00 0.00 C ATOM 222 C LYS A 168 6.478 9.160 7.734 1.00 0.00 C ATOM 223 O LYS A 168 5.834 8.152 8.032 1.00 0.00 O ATOM 224 CB LYS A 168 4.755 10.895 8.266 1.00 0.00 C ATOM 225 CG LYS A 168 4.369 12.155 9.025 1.00 0.00 C ATOM 226 CD LYS A 168 4.334 11.912 10.526 1.00 0.00 C ATOM 227 CE LYS A 168 4.641 13.181 11.310 1.00 0.00 C ATOM 228 NZ LYS A 168 5.893 13.053 12.105 1.00 0.00 N ATOM 0 H LYS A 168 6.834 11.977 7.130 1.00 0.00 H new ATOM 0 HA LYS A 168 6.416 10.319 9.524 1.00 0.00 H new ATOM 0 HB2 LYS A 168 4.572 11.051 7.203 1.00 0.00 H new ATOM 0 HB3 LYS A 168 4.108 10.077 8.584 1.00 0.00 H new ATOM 0 HG2 LYS A 168 5.081 12.949 8.800 1.00 0.00 H new ATOM 0 HG3 LYS A 168 3.391 12.499 8.688 1.00 0.00 H new ATOM 0 HD2 LYS A 168 3.351 11.537 10.811 1.00 0.00 H new ATOM 0 HD3 LYS A 168 5.058 11.139 10.786 1.00 0.00 H new ATOM 0 HE2 LYS A 168 4.733 14.020 10.621 1.00 0.00 H new ATOM 0 HE3 LYS A 168 3.809 13.406 11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 6.067 13.937 12.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 5.796 12.268 12.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 6.692 12.864 11.467 1.00 0.00 H new ATOM 242 N GLY A 169 7.411 9.157 6.778 1.00 0.00 N ATOM 243 CA GLY A 169 7.703 7.940 6.046 1.00 0.00 C ATOM 244 C GLY A 169 6.739 7.719 4.899 1.00 0.00 C ATOM 245 O GLY A 169 6.429 8.648 4.153 1.00 0.00 O ATOM 0 H GLY A 169 7.962 9.970 6.503 1.00 0.00 H new ATOM 0 HA2 GLY A 169 8.721 7.986 5.659 1.00 0.00 H new ATOM 0 HA3 GLY A 169 7.658 7.089 6.726 1.00 0.00 H new ATOM 249 N LEU A 170 6.265 6.486 4.754 1.00 0.00 N ATOM 250 CA LEU A 170 5.333 6.150 3.684 1.00 0.00 C ATOM 251 C LEU A 170 4.072 7.007 3.766 1.00 0.00 C ATOM 252 O LEU A 170 3.478 7.353 2.744 1.00 0.00 O ATOM 253 CB LEU A 170 4.961 4.668 3.750 1.00 0.00 C ATOM 254 CG LEU A 170 5.961 3.716 3.088 1.00 0.00 C ATOM 255 CD1 LEU A 170 5.982 3.917 1.579 1.00 0.00 C ATOM 256 CD2 LEU A 170 7.350 3.913 3.673 1.00 0.00 C ATOM 0 H LEU A 170 6.510 5.705 5.362 1.00 0.00 H new ATOM 0 HA LEU A 170 5.825 6.353 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 170 4.851 4.384 4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 170 3.988 4.533 3.279 1.00 0.00 H new ATOM 0 HG LEU A 170 5.643 2.693 3.289 1.00 0.00 H new ATOM 0 HD11 LEU A 170 6.700 3.230 1.130 1.00 0.00 H new ATOM 0 HD12 LEU A 170 4.990 3.722 1.172 1.00 0.00 H new ATOM 0 HD13 LEU A 170 6.272 4.943 1.353 1.00 0.00 H new ATOM 0 HD21 LEU A 170 8.048 3.228 3.191 1.00 0.00 H new ATOM 0 HD22 LEU A 170 7.674 4.940 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 170 7.326 3.712 4.744 1.00 0.00 H new ATOM 268 N GLY A 171 3.674 7.349 4.986 1.00 0.00 N ATOM 269 CA GLY A 171 2.490 8.166 5.178 1.00 0.00 C ATOM 270 C GLY A 171 1.205 7.371 5.058 1.00 0.00 C ATOM 271 O GLY A 171 0.183 7.895 4.613 1.00 0.00 O ATOM 0 H GLY A 171 4.150 7.075 5.846 1.00 0.00 H new ATOM 0 HA2 GLY A 171 2.532 8.634 6.161 1.00 0.00 H new ATOM 0 HA3 GLY A 171 2.485 8.970 4.442 1.00 0.00 H new ATOM 275 N PHE A 172 1.251 6.109 5.471 1.00 0.00 N ATOM 276 CA PHE A 172 0.079 5.243 5.422 1.00 0.00 C ATOM 277 C PHE A 172 0.381 3.885 6.060 1.00 0.00 C ATOM 278 O PHE A 172 1.456 3.678 6.620 1.00 0.00 O ATOM 279 CB PHE A 172 -0.423 5.087 3.974 1.00 0.00 C ATOM 280 CG PHE A 172 0.334 4.089 3.135 1.00 0.00 C ATOM 281 CD1 PHE A 172 1.579 4.401 2.614 1.00 0.00 C ATOM 282 CD2 PHE A 172 -0.210 2.844 2.865 1.00 0.00 C ATOM 283 CE1 PHE A 172 2.269 3.486 1.839 1.00 0.00 C ATOM 284 CE2 PHE A 172 0.474 1.928 2.090 1.00 0.00 C ATOM 285 CZ PHE A 172 1.714 2.249 1.576 1.00 0.00 C ATOM 0 H PHE A 172 2.089 5.663 5.844 1.00 0.00 H new ATOM 0 HA PHE A 172 -0.719 5.709 6.000 1.00 0.00 H new ATOM 0 HB2 PHE A 172 -1.472 4.793 4.000 1.00 0.00 H new ATOM 0 HB3 PHE A 172 -0.376 6.059 3.484 1.00 0.00 H new ATOM 0 HD1 PHE A 172 2.015 5.368 2.815 1.00 0.00 H new ATOM 0 HD2 PHE A 172 -1.180 2.587 3.265 1.00 0.00 H new ATOM 0 HE1 PHE A 172 3.240 3.739 1.440 1.00 0.00 H new ATOM 0 HE2 PHE A 172 0.039 0.961 1.886 1.00 0.00 H new ATOM 0 HZ PHE A 172 2.249 1.534 0.969 1.00 0.00 H new ATOM 295 N SER A 173 -0.578 2.971 5.979 1.00 0.00 N ATOM 296 CA SER A 173 -0.417 1.640 6.559 1.00 0.00 C ATOM 297 C SER A 173 -0.767 0.546 5.556 1.00 0.00 C ATOM 298 O SER A 173 -1.465 0.788 4.571 1.00 0.00 O ATOM 299 CB SER A 173 -1.292 1.501 7.806 1.00 0.00 C ATOM 300 OG SER A 173 -0.818 2.325 8.856 1.00 0.00 O ATOM 0 H SER A 173 -1.475 3.125 5.518 1.00 0.00 H new ATOM 0 HA SER A 173 0.631 1.522 6.834 1.00 0.00 H new ATOM 0 HB2 SER A 173 -2.320 1.770 7.564 1.00 0.00 H new ATOM 0 HB3 SER A 173 -1.303 0.461 8.132 1.00 0.00 H new ATOM 0 HG SER A 173 -1.395 2.219 9.641 1.00 0.00 H new ATOM 306 N ILE A 174 -0.280 -0.663 5.824 1.00 0.00 N ATOM 307 CA ILE A 174 -0.540 -1.807 4.959 1.00 0.00 C ATOM 308 C ILE A 174 -1.200 -2.938 5.742 1.00 0.00 C ATOM 309 O ILE A 174 -1.058 -3.030 6.960 1.00 0.00 O ATOM 310 CB ILE A 174 0.761 -2.339 4.303 1.00 0.00 C ATOM 311 CG1 ILE A 174 1.727 -2.902 5.361 1.00 0.00 C ATOM 312 CG2 ILE A 174 1.439 -1.244 3.488 1.00 0.00 C ATOM 313 CD1 ILE A 174 2.015 -4.381 5.195 1.00 0.00 C ATOM 0 H ILE A 174 0.299 -0.875 6.637 1.00 0.00 H new ATOM 0 HA ILE A 174 -1.212 -1.463 4.173 1.00 0.00 H new ATOM 0 HB ILE A 174 0.488 -3.152 3.630 1.00 0.00 H new ATOM 0 HG12 ILE A 174 2.666 -2.350 5.314 1.00 0.00 H new ATOM 0 HG13 ILE A 174 1.306 -2.731 6.352 1.00 0.00 H new ATOM 0 HG21 ILE A 174 2.350 -1.638 3.036 1.00 0.00 H new ATOM 0 HG22 ILE A 174 0.763 -0.903 2.704 1.00 0.00 H new ATOM 0 HG23 ILE A 174 1.690 -0.407 4.140 1.00 0.00 H new ATOM 0 HD11 ILE A 174 2.703 -4.708 5.975 1.00 0.00 H new ATOM 0 HD12 ILE A 174 1.085 -4.944 5.272 1.00 0.00 H new ATOM 0 HD13 ILE A 174 2.465 -4.557 4.218 1.00 0.00 H new ATOM 325 N ALA A 175 -1.899 -3.810 5.031 1.00 0.00 N ATOM 326 CA ALA A 175 -2.557 -4.951 5.649 1.00 0.00 C ATOM 327 C ALA A 175 -2.152 -6.219 4.917 1.00 0.00 C ATOM 328 O ALA A 175 -2.082 -6.229 3.694 1.00 0.00 O ATOM 329 CB ALA A 175 -4.065 -4.763 5.636 1.00 0.00 C ATOM 0 H ALA A 175 -2.025 -3.748 4.021 1.00 0.00 H new ATOM 0 HA ALA A 175 -2.246 -5.034 6.690 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -4.543 -5.625 6.102 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -4.324 -3.861 6.190 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -4.411 -4.668 4.607 1.00 0.00 H new ATOM 335 N GLY A 176 -1.870 -7.284 5.663 1.00 0.00 N ATOM 336 CA GLY A 176 -1.441 -8.521 5.033 1.00 0.00 C ATOM 337 C GLY A 176 -2.445 -9.635 5.140 1.00 0.00 C ATOM 338 O GLY A 176 -2.967 -9.925 6.216 1.00 0.00 O ATOM 0 H GLY A 176 -1.930 -7.314 6.681 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -1.235 -8.329 3.980 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -0.504 -8.844 5.487 1.00 0.00 H new ATOM 342 N GLY A 177 -2.714 -10.259 4.007 1.00 0.00 N ATOM 343 CA GLY A 177 -3.661 -11.347 3.969 1.00 0.00 C ATOM 344 C GLY A 177 -3.072 -12.684 4.405 1.00 0.00 C ATOM 345 O GLY A 177 -3.804 -13.584 4.817 1.00 0.00 O ATOM 0 H GLY A 177 -2.290 -10.029 3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -4.506 -11.105 4.613 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -4.050 -11.444 2.955 1.00 0.00 H new ATOM 349 N VAL A 178 -1.755 -12.831 4.294 1.00 0.00 N ATOM 350 CA VAL A 178 -1.095 -14.085 4.660 1.00 0.00 C ATOM 351 C VAL A 178 -0.660 -14.127 6.127 1.00 0.00 C ATOM 352 O VAL A 178 0.177 -13.339 6.563 1.00 0.00 O ATOM 353 CB VAL A 178 0.137 -14.352 3.774 1.00 0.00 C ATOM 354 CG1 VAL A 178 0.654 -15.767 3.990 1.00 0.00 C ATOM 355 CG2 VAL A 178 -0.193 -14.118 2.308 1.00 0.00 C ATOM 0 H VAL A 178 -1.125 -12.104 3.956 1.00 0.00 H new ATOM 0 HA VAL A 178 -1.844 -14.861 4.502 1.00 0.00 H new ATOM 0 HB VAL A 178 0.922 -13.653 4.061 1.00 0.00 H new ATOM 0 HG11 VAL A 178 1.524 -15.937 3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 178 0.936 -15.896 5.035 1.00 0.00 H new ATOM 0 HG13 VAL A 178 -0.127 -16.483 3.734 1.00 0.00 H new ATOM 0 HG21 VAL A 178 0.691 -14.312 1.701 1.00 0.00 H new ATOM 0 HG22 VAL A 178 -0.997 -14.789 2.004 1.00 0.00 H new ATOM 0 HG23 VAL A 178 -0.510 -13.085 2.167 1.00 0.00 H new ATOM 365 N GLY A 179 -1.221 -15.071 6.876 1.00 0.00 N ATOM 366 CA GLY A 179 -0.874 -15.230 8.279 1.00 0.00 C ATOM 367 C GLY A 179 -1.651 -14.304 9.186 1.00 0.00 C ATOM 368 O GLY A 179 -2.325 -14.747 10.114 1.00 0.00 O ATOM 0 H GLY A 179 -1.916 -15.735 6.534 1.00 0.00 H new ATOM 0 HA2 GLY A 179 -1.057 -16.262 8.579 1.00 0.00 H new ATOM 0 HA3 GLY A 179 0.193 -15.045 8.407 1.00 0.00 H new ATOM 372 N ASN A 180 -1.558 -13.016 8.905 1.00 0.00 N ATOM 373 CA ASN A 180 -2.258 -12.003 9.685 1.00 0.00 C ATOM 374 C ASN A 180 -3.338 -11.361 8.827 1.00 0.00 C ATOM 375 O ASN A 180 -3.387 -10.141 8.662 1.00 0.00 O ATOM 376 CB ASN A 180 -1.276 -10.945 10.191 1.00 0.00 C ATOM 377 CG ASN A 180 -0.495 -11.416 11.404 1.00 0.00 C ATOM 378 OD1 ASN A 180 -0.772 -11.008 12.532 1.00 0.00 O ATOM 379 ND2 ASN A 180 0.487 -12.281 11.176 1.00 0.00 N ATOM 0 H ASN A 180 -1.001 -12.642 8.137 1.00 0.00 H new ATOM 0 HA ASN A 180 -2.723 -12.475 10.551 1.00 0.00 H new ATOM 0 HB2 ASN A 180 -0.581 -10.686 9.392 1.00 0.00 H new ATOM 0 HB3 ASN A 180 -1.823 -10.037 10.444 1.00 0.00 H new ATOM 0 HD21 ASN A 180 1.046 -12.634 11.953 1.00 0.00 H new ATOM 0 HD22 ASN A 180 0.682 -12.592 10.224 1.00 0.00 H new ATOM 386 N GLN A 181 -4.184 -12.210 8.255 1.00 0.00 N ATOM 387 CA GLN A 181 -5.254 -11.780 7.378 1.00 0.00 C ATOM 388 C GLN A 181 -6.045 -10.594 7.914 1.00 0.00 C ATOM 389 O GLN A 181 -6.777 -10.700 8.898 1.00 0.00 O ATOM 390 CB GLN A 181 -6.193 -12.954 7.106 1.00 0.00 C ATOM 391 CG GLN A 181 -6.622 -13.051 5.659 1.00 0.00 C ATOM 392 CD GLN A 181 -6.973 -14.466 5.244 1.00 0.00 C ATOM 393 OE1 GLN A 181 -7.235 -15.325 6.086 1.00 0.00 O ATOM 394 NE2 GLN A 181 -6.982 -14.716 3.939 1.00 0.00 N ATOM 0 H GLN A 181 -4.142 -13.220 8.391 1.00 0.00 H new ATOM 0 HA GLN A 181 -4.785 -11.440 6.454 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -5.698 -13.881 7.394 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -7.078 -12.856 7.735 1.00 0.00 H new ATOM 0 HG2 GLN A 181 -7.485 -12.405 5.497 1.00 0.00 H new ATOM 0 HG3 GLN A 181 -5.820 -12.679 5.021 1.00 0.00 H new ATOM 0 HE21 GLN A 181 -6.758 -13.974 3.276 1.00 0.00 H new ATOM 0 HE22 GLN A 181 -7.213 -15.650 3.600 1.00 0.00 H new ATOM 403 N HIS A 182 -5.913 -9.476 7.214 1.00 0.00 N ATOM 404 CA HIS A 182 -6.630 -8.258 7.550 1.00 0.00 C ATOM 405 C HIS A 182 -7.809 -8.083 6.587 1.00 0.00 C ATOM 406 O HIS A 182 -8.804 -7.440 6.922 1.00 0.00 O ATOM 407 CB HIS A 182 -5.679 -7.049 7.482 1.00 0.00 C ATOM 408 CG HIS A 182 -6.364 -5.712 7.390 1.00 0.00 C ATOM 409 ND1 HIS A 182 -6.964 -5.110 6.328 1.00 0.00 N flip ATOM 410 CD2 HIS A 182 -6.485 -4.834 8.443 1.00 0.00 C flip ATOM 411 CE1 HIS A 182 -7.453 -3.869 6.725 1.00 0.00 C flip ATOM 412 NE2 HIS A 182 -7.142 -3.751 8.002 1.00 0.00 N flip ATOM 0 H HIS A 182 -5.306 -9.390 6.399 1.00 0.00 H new ATOM 0 HA HIS A 182 -7.015 -8.327 8.568 1.00 0.00 H new ATOM 0 HB2 HIS A 182 -5.042 -7.055 8.367 1.00 0.00 H new ATOM 0 HB3 HIS A 182 -5.025 -7.167 6.618 1.00 0.00 H new ATOM 0 HD1 HIS A 182 -7.043 -5.505 5.391 1.00 0.00 H new ATOM 0 HD2 HIS A 182 -6.116 -4.989 9.446 1.00 0.00 H new ATOM 0 HE1 HIS A 182 -7.979 -3.150 6.114 1.00 0.00 H new ATOM 420 N ILE A 183 -7.683 -8.656 5.388 1.00 0.00 N ATOM 421 CA ILE A 183 -8.730 -8.554 4.381 1.00 0.00 C ATOM 422 C ILE A 183 -9.632 -9.791 4.426 1.00 0.00 C ATOM 423 O ILE A 183 -9.135 -10.916 4.483 1.00 0.00 O ATOM 424 CB ILE A 183 -8.141 -8.410 2.957 1.00 0.00 C ATOM 425 CG1 ILE A 183 -6.869 -7.541 2.966 1.00 0.00 C ATOM 426 CG2 ILE A 183 -9.184 -7.828 2.014 1.00 0.00 C ATOM 427 CD1 ILE A 183 -5.609 -8.314 2.639 1.00 0.00 C ATOM 0 H ILE A 183 -6.867 -9.193 5.096 1.00 0.00 H new ATOM 0 HA ILE A 183 -9.311 -7.660 4.608 1.00 0.00 H new ATOM 0 HB ILE A 183 -7.862 -9.402 2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -6.986 -6.731 2.246 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -6.759 -7.081 3.948 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -8.758 -7.731 1.015 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -10.050 -8.489 1.977 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -9.492 -6.846 2.374 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -4.752 -7.640 2.663 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -5.468 -9.107 3.373 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -5.698 -8.752 1.645 1.00 0.00 H new ATOM 439 N PRO A 184 -10.969 -9.611 4.415 1.00 0.00 N ATOM 440 CA PRO A 184 -11.907 -10.736 4.472 1.00 0.00 C ATOM 441 C PRO A 184 -12.042 -11.468 3.140 1.00 0.00 C ATOM 442 O PRO A 184 -13.036 -11.311 2.430 1.00 0.00 O ATOM 443 CB PRO A 184 -13.228 -10.070 4.856 1.00 0.00 C ATOM 444 CG PRO A 184 -13.131 -8.694 4.297 1.00 0.00 C ATOM 445 CD PRO A 184 -11.676 -8.312 4.364 1.00 0.00 C ATOM 0 HA PRO A 184 -11.575 -11.503 5.172 1.00 0.00 H new ATOM 0 HB2 PRO A 184 -14.079 -10.608 4.439 1.00 0.00 H new ATOM 0 HB3 PRO A 184 -13.362 -10.050 5.938 1.00 0.00 H new ATOM 0 HG2 PRO A 184 -13.494 -8.665 3.269 1.00 0.00 H new ATOM 0 HG3 PRO A 184 -13.743 -7.997 4.870 1.00 0.00 H new ATOM 0 HD2 PRO A 184 -11.376 -7.728 3.494 1.00 0.00 H new ATOM 0 HD3 PRO A 184 -11.462 -7.706 5.244 1.00 0.00 H new ATOM 453 N GLY A 185 -11.041 -12.281 2.811 1.00 0.00 N ATOM 454 CA GLY A 185 -11.079 -13.035 1.571 1.00 0.00 C ATOM 455 C GLY A 185 -9.984 -12.638 0.600 1.00 0.00 C ATOM 456 O GLY A 185 -10.245 -12.430 -0.584 1.00 0.00 O ATOM 0 H GLY A 185 -10.207 -12.430 3.379 1.00 0.00 H new ATOM 0 HA2 GLY A 185 -10.989 -14.098 1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 185 -12.049 -12.891 1.095 1.00 0.00 H new ATOM 460 N ASP A 186 -8.756 -12.537 1.098 1.00 0.00 N ATOM 461 CA ASP A 186 -7.625 -12.167 0.253 1.00 0.00 C ATOM 462 C ASP A 186 -6.304 -12.367 0.991 1.00 0.00 C ATOM 463 O ASP A 186 -6.140 -11.915 2.125 1.00 0.00 O ATOM 464 CB ASP A 186 -7.767 -10.714 -0.214 1.00 0.00 C ATOM 465 CG ASP A 186 -7.788 -10.594 -1.726 1.00 0.00 C ATOM 466 OD1 ASP A 186 -8.745 -11.101 -2.349 1.00 0.00 O ATOM 467 OD2 ASP A 186 -6.847 -9.993 -2.288 1.00 0.00 O ATOM 0 H ASP A 186 -8.519 -12.705 2.076 1.00 0.00 H new ATOM 0 HA ASP A 186 -7.623 -12.817 -0.622 1.00 0.00 H new ATOM 0 HB2 ASP A 186 -8.685 -10.292 0.194 1.00 0.00 H new ATOM 0 HB3 ASP A 186 -6.941 -10.125 0.183 1.00 0.00 H new ATOM 472 N ASN A 187 -5.365 -13.046 0.339 1.00 0.00 N ATOM 473 CA ASN A 187 -4.058 -13.306 0.933 1.00 0.00 C ATOM 474 C ASN A 187 -3.000 -12.364 0.357 1.00 0.00 C ATOM 475 O ASN A 187 -1.818 -12.702 0.301 1.00 0.00 O ATOM 476 CB ASN A 187 -3.634 -14.765 0.711 1.00 0.00 C ATOM 477 CG ASN A 187 -4.788 -15.745 0.837 1.00 0.00 C ATOM 478 OD1 ASN A 187 -5.715 -15.737 0.027 1.00 0.00 O ATOM 479 ND2 ASN A 187 -4.736 -16.594 1.856 1.00 0.00 N ATOM 0 H ASN A 187 -5.485 -13.426 -0.600 1.00 0.00 H new ATOM 0 HA ASN A 187 -4.141 -13.126 2.005 1.00 0.00 H new ATOM 0 HB2 ASN A 187 -3.189 -14.861 -0.279 1.00 0.00 H new ATOM 0 HB3 ASN A 187 -2.862 -15.027 1.434 1.00 0.00 H new ATOM 0 HD21 ASN A 187 -5.483 -17.275 1.991 1.00 0.00 H new ATOM 0 HD22 ASN A 187 -3.949 -16.566 2.504 1.00 0.00 H new ATOM 486 N SER A 188 -3.434 -11.176 -0.070 1.00 0.00 N ATOM 487 CA SER A 188 -2.525 -10.185 -0.642 1.00 0.00 C ATOM 488 C SER A 188 -2.361 -8.992 0.301 1.00 0.00 C ATOM 489 O SER A 188 -2.679 -9.085 1.487 1.00 0.00 O ATOM 490 CB SER A 188 -3.046 -9.718 -2.004 1.00 0.00 C ATOM 491 OG SER A 188 -3.707 -10.769 -2.686 1.00 0.00 O ATOM 0 H SER A 188 -4.409 -10.879 -0.030 1.00 0.00 H new ATOM 0 HA SER A 188 -1.548 -10.650 -0.777 1.00 0.00 H new ATOM 0 HB2 SER A 188 -3.732 -8.882 -1.867 1.00 0.00 H new ATOM 0 HB3 SER A 188 -2.216 -9.354 -2.609 1.00 0.00 H new ATOM 0 HG SER A 188 -4.676 -10.637 -2.629 1.00 0.00 H new ATOM 497 N ILE A 189 -1.865 -7.870 -0.225 1.00 0.00 N ATOM 498 CA ILE A 189 -1.668 -6.675 0.583 1.00 0.00 C ATOM 499 C ILE A 189 -2.726 -5.620 0.249 1.00 0.00 C ATOM 500 O ILE A 189 -3.022 -5.361 -0.917 1.00 0.00 O ATOM 501 CB ILE A 189 -0.220 -6.114 0.399 1.00 0.00 C ATOM 502 CG1 ILE A 189 0.711 -6.734 1.447 1.00 0.00 C ATOM 503 CG2 ILE A 189 -0.156 -4.586 0.488 1.00 0.00 C ATOM 504 CD1 ILE A 189 0.491 -6.200 2.850 1.00 0.00 C ATOM 0 H ILE A 189 -1.595 -7.769 -1.203 1.00 0.00 H new ATOM 0 HA ILE A 189 -1.785 -6.943 1.633 1.00 0.00 H new ATOM 0 HB ILE A 189 0.103 -6.388 -0.605 1.00 0.00 H new ATOM 0 HG12 ILE A 189 0.569 -7.815 1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 189 1.745 -6.550 1.156 1.00 0.00 H new ATOM 0 HG21 ILE A 189 0.874 -4.256 0.353 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -0.782 -4.150 -0.290 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -0.515 -4.263 1.465 1.00 0.00 H new ATOM 0 HD11 ILE A 189 1.185 -6.684 3.537 1.00 0.00 H new ATOM 0 HD12 ILE A 189 0.662 -5.124 2.861 1.00 0.00 H new ATOM 0 HD13 ILE A 189 -0.532 -6.408 3.162 1.00 0.00 H new ATOM 516 N TYR A 190 -3.271 -5.008 1.291 1.00 0.00 N ATOM 517 CA TYR A 190 -4.277 -3.967 1.136 1.00 0.00 C ATOM 518 C TYR A 190 -3.980 -2.801 2.065 1.00 0.00 C ATOM 519 O TYR A 190 -3.413 -2.985 3.138 1.00 0.00 O ATOM 520 CB TYR A 190 -5.665 -4.520 1.436 1.00 0.00 C ATOM 521 CG TYR A 190 -6.240 -5.352 0.318 1.00 0.00 C ATOM 522 CD1 TYR A 190 -5.686 -6.582 -0.014 1.00 0.00 C ATOM 523 CD2 TYR A 190 -7.341 -4.912 -0.400 1.00 0.00 C ATOM 524 CE1 TYR A 190 -6.215 -7.350 -1.033 1.00 0.00 C ATOM 525 CE2 TYR A 190 -7.879 -5.674 -1.419 1.00 0.00 C ATOM 526 CZ TYR A 190 -7.313 -6.891 -1.732 1.00 0.00 C ATOM 527 OH TYR A 190 -7.845 -7.653 -2.746 1.00 0.00 O ATOM 0 H TYR A 190 -3.031 -5.217 2.260 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.249 -3.616 0.104 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.617 -5.126 2.341 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -6.340 -3.690 1.644 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.828 -6.943 0.533 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -7.786 -3.958 -0.159 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -5.772 -8.303 -1.281 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -8.739 -5.318 -1.967 1.00 0.00 H new ATOM 0 HH TYR A 190 -7.234 -8.389 -2.957 1.00 0.00 H new ATOM 537 N VAL A 191 -4.372 -1.603 1.659 1.00 0.00 N ATOM 538 CA VAL A 191 -4.148 -0.425 2.481 1.00 0.00 C ATOM 539 C VAL A 191 -5.221 -0.331 3.564 1.00 0.00 C ATOM 540 O VAL A 191 -6.394 -0.599 3.299 1.00 0.00 O ATOM 541 CB VAL A 191 -4.166 0.860 1.631 1.00 0.00 C ATOM 542 CG1 VAL A 191 -3.775 2.060 2.473 1.00 0.00 C ATOM 543 CG2 VAL A 191 -3.240 0.722 0.432 1.00 0.00 C ATOM 0 H VAL A 191 -4.843 -1.422 0.773 1.00 0.00 H new ATOM 0 HA VAL A 191 -3.165 -0.521 2.943 1.00 0.00 H new ATOM 0 HB VAL A 191 -5.180 1.015 1.263 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -3.793 2.959 1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -4.480 2.171 3.297 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -2.771 1.913 2.871 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -3.267 1.640 -0.156 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -2.222 0.542 0.777 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -3.567 -0.114 -0.186 1.00 0.00 H new ATOM 553 N THR A 192 -4.824 0.020 4.787 1.00 0.00 N ATOM 554 CA THR A 192 -5.781 0.105 5.892 1.00 0.00 C ATOM 555 C THR A 192 -5.802 1.481 6.560 1.00 0.00 C ATOM 556 O THR A 192 -6.757 1.808 7.264 1.00 0.00 O ATOM 557 CB THR A 192 -5.470 -0.968 6.936 1.00 0.00 C ATOM 558 OG1 THR A 192 -6.198 -0.734 8.130 1.00 0.00 O ATOM 559 CG2 THR A 192 -4.004 -1.040 7.301 1.00 0.00 C ATOM 0 H THR A 192 -3.861 0.247 5.037 1.00 0.00 H new ATOM 0 HA THR A 192 -6.770 -0.059 5.464 1.00 0.00 H new ATOM 0 HB THR A 192 -5.761 -1.912 6.474 1.00 0.00 H new ATOM 0 HG1 THR A 192 -6.648 -1.560 8.406 1.00 0.00 H new ATOM 0 HG21 THR A 192 -3.852 -1.821 8.046 1.00 0.00 H new ATOM 0 HG22 THR A 192 -3.418 -1.269 6.411 1.00 0.00 H new ATOM 0 HG23 THR A 192 -3.683 -0.082 7.710 1.00 0.00 H new ATOM 567 N LYS A 193 -4.759 2.283 6.360 1.00 0.00 N ATOM 568 CA LYS A 193 -4.709 3.607 6.977 1.00 0.00 C ATOM 569 C LYS A 193 -3.875 4.583 6.155 1.00 0.00 C ATOM 570 O LYS A 193 -2.774 4.263 5.721 1.00 0.00 O ATOM 571 CB LYS A 193 -4.138 3.505 8.394 1.00 0.00 C ATOM 572 CG LYS A 193 -4.775 4.473 9.377 1.00 0.00 C ATOM 573 CD LYS A 193 -5.957 3.841 10.095 1.00 0.00 C ATOM 574 CE LYS A 193 -6.549 4.785 11.130 1.00 0.00 C ATOM 575 NZ LYS A 193 -7.629 4.136 11.923 1.00 0.00 N ATOM 0 H LYS A 193 -3.950 2.046 5.786 1.00 0.00 H new ATOM 0 HA LYS A 193 -5.729 3.990 7.018 1.00 0.00 H new ATOM 0 HB2 LYS A 193 -4.274 2.487 8.759 1.00 0.00 H new ATOM 0 HB3 LYS A 193 -3.064 3.690 8.358 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -4.032 4.792 10.108 1.00 0.00 H new ATOM 0 HG3 LYS A 193 -5.105 5.367 8.847 1.00 0.00 H new ATOM 0 HD2 LYS A 193 -6.723 3.569 9.368 1.00 0.00 H new ATOM 0 HD3 LYS A 193 -5.638 2.919 10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 193 -5.761 5.127 11.802 1.00 0.00 H new ATOM 0 HE3 LYS A 193 -6.947 5.668 10.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 -8.005 4.813 12.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 -8.393 3.832 11.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 -7.244 3.308 12.421 1.00 0.00 H new ATOM 589 N ILE A 194 -4.414 5.782 5.950 1.00 0.00 N ATOM 590 CA ILE A 194 -3.726 6.818 5.186 1.00 0.00 C ATOM 591 C ILE A 194 -3.522 8.056 6.047 1.00 0.00 C ATOM 592 O ILE A 194 -4.436 8.490 6.748 1.00 0.00 O ATOM 593 CB ILE A 194 -4.493 7.238 3.910 1.00 0.00 C ATOM 594 CG1 ILE A 194 -5.356 6.097 3.365 1.00 0.00 C ATOM 595 CG2 ILE A 194 -3.519 7.724 2.845 1.00 0.00 C ATOM 596 CD1 ILE A 194 -4.559 4.909 2.880 1.00 0.00 C ATOM 0 H ILE A 194 -5.329 6.061 6.304 1.00 0.00 H new ATOM 0 HA ILE A 194 -2.771 6.388 4.883 1.00 0.00 H new ATOM 0 HB ILE A 194 -5.162 8.055 4.180 1.00 0.00 H new ATOM 0 HG12 ILE A 194 -6.042 5.768 4.145 1.00 0.00 H new ATOM 0 HG13 ILE A 194 -5.965 6.475 2.543 1.00 0.00 H new ATOM 0 HG21 ILE A 194 -4.072 8.016 1.952 1.00 0.00 H new ATOM 0 HG22 ILE A 194 -2.963 8.581 3.224 1.00 0.00 H new ATOM 0 HG23 ILE A 194 -2.824 6.923 2.595 1.00 0.00 H new ATOM 0 HD11 ILE A 194 -5.239 4.142 2.509 1.00 0.00 H new ATOM 0 HD12 ILE A 194 -3.892 5.222 2.077 1.00 0.00 H new ATOM 0 HD13 ILE A 194 -3.971 4.505 3.704 1.00 0.00 H new ATOM 608 N ILE A 195 -2.330 8.627 5.989 1.00 0.00 N ATOM 609 CA ILE A 195 -2.034 9.820 6.767 1.00 0.00 C ATOM 610 C ILE A 195 -2.577 11.053 6.052 1.00 0.00 C ATOM 611 O ILE A 195 -2.130 11.400 4.958 1.00 0.00 O ATOM 612 CB ILE A 195 -0.517 9.973 7.000 1.00 0.00 C ATOM 613 CG1 ILE A 195 0.045 8.698 7.633 1.00 0.00 C ATOM 614 CG2 ILE A 195 -0.224 11.181 7.876 1.00 0.00 C ATOM 615 CD1 ILE A 195 -0.460 8.444 9.038 1.00 0.00 C ATOM 0 H ILE A 195 -1.557 8.288 5.417 1.00 0.00 H new ATOM 0 HA ILE A 195 -2.517 9.720 7.739 1.00 0.00 H new ATOM 0 HB ILE A 195 -0.031 10.131 6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 195 -0.213 7.846 7.004 1.00 0.00 H new ATOM 0 HG13 ILE A 195 1.133 8.762 7.653 1.00 0.00 H new ATOM 0 HG21 ILE A 195 0.852 11.269 8.027 1.00 0.00 H new ATOM 0 HG22 ILE A 195 -0.597 12.082 7.390 1.00 0.00 H new ATOM 0 HG23 ILE A 195 -0.717 11.059 8.841 1.00 0.00 H new ATOM 0 HD11 ILE A 195 -0.019 7.524 9.422 1.00 0.00 H new ATOM 0 HD12 ILE A 195 -0.179 9.277 9.682 1.00 0.00 H new ATOM 0 HD13 ILE A 195 -1.546 8.348 9.023 1.00 0.00 H new ATOM 627 N GLU A 196 -3.574 11.691 6.678 1.00 0.00 N ATOM 628 CA GLU A 196 -4.245 12.878 6.128 1.00 0.00 C ATOM 629 C GLU A 196 -3.293 13.820 5.391 1.00 0.00 C ATOM 630 O GLU A 196 -2.552 14.586 6.006 1.00 0.00 O ATOM 631 CB GLU A 196 -4.959 13.641 7.246 1.00 0.00 C ATOM 632 CG GLU A 196 -5.759 14.837 6.751 1.00 0.00 C ATOM 633 CD GLU A 196 -7.064 15.017 7.503 1.00 0.00 C ATOM 634 OE1 GLU A 196 -7.997 14.220 7.272 1.00 0.00 O ATOM 635 OE2 GLU A 196 -7.153 15.956 8.321 1.00 0.00 O ATOM 0 H GLU A 196 -3.940 11.398 7.584 1.00 0.00 H new ATOM 0 HA GLU A 196 -4.966 12.516 5.395 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -5.628 12.959 7.771 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -4.220 13.983 7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -5.157 15.740 6.854 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -5.970 14.714 5.689 1.00 0.00 H new ATOM 642 N GLY A 197 -3.336 13.756 4.061 1.00 0.00 N ATOM 643 CA GLY A 197 -2.493 14.604 3.238 1.00 0.00 C ATOM 644 C GLY A 197 -1.022 14.533 3.613 1.00 0.00 C ATOM 645 O GLY A 197 -0.261 15.462 3.340 1.00 0.00 O ATOM 0 H GLY A 197 -3.945 13.127 3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 197 -2.609 14.316 2.193 1.00 0.00 H new ATOM 0 HA3 GLY A 197 -2.833 15.636 3.324 1.00 0.00 H new ATOM 649 N GLY A 198 -0.621 13.431 4.241 1.00 0.00 N ATOM 650 CA GLY A 198 0.765 13.272 4.641 1.00 0.00 C ATOM 651 C GLY A 198 1.679 13.004 3.463 1.00 0.00 C ATOM 652 O GLY A 198 1.956 13.900 2.667 1.00 0.00 O ATOM 0 H GLY A 198 -1.230 12.648 4.479 1.00 0.00 H new ATOM 0 HA2 GLY A 198 1.097 14.173 5.157 1.00 0.00 H new ATOM 0 HA3 GLY A 198 0.843 12.450 5.352 1.00 0.00 H new ATOM 656 N ALA A 199 2.148 11.766 3.349 1.00 0.00 N ATOM 657 CA ALA A 199 3.034 11.383 2.259 1.00 0.00 C ATOM 658 C ALA A 199 2.292 10.566 1.210 1.00 0.00 C ATOM 659 O ALA A 199 2.246 10.934 0.036 1.00 0.00 O ATOM 660 CB ALA A 199 4.224 10.595 2.796 1.00 0.00 C ATOM 0 H ALA A 199 1.928 11.011 3.999 1.00 0.00 H new ATOM 0 HA ALA A 199 3.398 12.294 1.784 1.00 0.00 H new ATOM 0 HB1 ALA A 199 4.878 10.315 1.970 1.00 0.00 H new ATOM 0 HB2 ALA A 199 4.778 11.210 3.505 1.00 0.00 H new ATOM 0 HB3 ALA A 199 3.868 9.695 3.298 1.00 0.00 H new ATOM 666 N ALA A 200 1.725 9.444 1.641 1.00 0.00 N ATOM 667 CA ALA A 200 1.000 8.562 0.740 1.00 0.00 C ATOM 668 C ALA A 200 -0.280 9.205 0.217 1.00 0.00 C ATOM 669 O ALA A 200 -0.553 9.161 -0.978 1.00 0.00 O ATOM 670 CB ALA A 200 0.685 7.245 1.437 1.00 0.00 C ATOM 0 H ALA A 200 1.755 9.126 2.610 1.00 0.00 H new ATOM 0 HA ALA A 200 1.642 8.371 -0.120 1.00 0.00 H new ATOM 0 HB1 ALA A 200 0.142 6.592 0.753 1.00 0.00 H new ATOM 0 HB2 ALA A 200 1.614 6.762 1.739 1.00 0.00 H new ATOM 0 HB3 ALA A 200 0.073 7.437 2.318 1.00 0.00 H new ATOM 676 N HIS A 201 -1.071 9.780 1.114 1.00 0.00 N ATOM 677 CA HIS A 201 -2.331 10.401 0.725 1.00 0.00 C ATOM 678 C HIS A 201 -2.143 11.514 -0.305 1.00 0.00 C ATOM 679 O HIS A 201 -2.754 11.488 -1.371 1.00 0.00 O ATOM 680 CB HIS A 201 -3.041 10.957 1.958 1.00 0.00 C ATOM 681 CG HIS A 201 -4.521 11.082 1.784 1.00 0.00 C ATOM 682 ND1 HIS A 201 -5.415 11.120 2.828 1.00 0.00 N ATOM 683 CD2 HIS A 201 -5.262 11.175 0.650 1.00 0.00 C ATOM 684 CE1 HIS A 201 -6.645 11.231 2.310 1.00 0.00 C ATOM 685 NE2 HIS A 201 -6.607 11.270 0.992 1.00 0.00 N ATOM 0 H HIS A 201 -0.864 9.829 2.112 1.00 0.00 H new ATOM 0 HA HIS A 201 -2.939 9.626 0.259 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -2.836 10.308 2.810 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -2.626 11.937 2.196 1.00 0.00 H new ATOM 0 HD1 HIS A 201 -5.183 11.072 3.820 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -4.870 11.175 -0.356 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -7.551 11.282 2.896 1.00 0.00 H new ATOM 693 N LYS A 202 -1.320 12.503 0.018 1.00 0.00 N ATOM 694 CA LYS A 202 -1.097 13.623 -0.891 1.00 0.00 C ATOM 695 C LYS A 202 -0.315 13.214 -2.140 1.00 0.00 C ATOM 696 O LYS A 202 -0.729 13.501 -3.263 1.00 0.00 O ATOM 697 CB LYS A 202 -0.361 14.752 -0.163 1.00 0.00 C ATOM 698 CG LYS A 202 -0.907 16.138 -0.477 1.00 0.00 C ATOM 699 CD LYS A 202 0.005 16.898 -1.429 1.00 0.00 C ATOM 700 CE LYS A 202 1.012 17.754 -0.675 1.00 0.00 C ATOM 701 NZ LYS A 202 0.618 19.191 -0.661 1.00 0.00 N ATOM 0 H LYS A 202 -0.800 12.554 0.894 1.00 0.00 H new ATOM 0 HA LYS A 202 -2.077 13.971 -1.219 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -0.423 14.581 0.912 1.00 0.00 H new ATOM 0 HB3 LYS A 202 0.695 14.718 -0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -1.900 16.047 -0.918 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -1.020 16.703 0.448 1.00 0.00 H new ATOM 0 HD2 LYS A 202 0.534 16.192 -2.069 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -0.596 17.531 -2.082 1.00 0.00 H new ATOM 0 HE2 LYS A 202 1.102 17.392 0.349 1.00 0.00 H new ATOM 0 HE3 LYS A 202 1.994 17.651 -1.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 1.329 19.741 -0.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 0.557 19.544 -1.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 -0.308 19.293 -0.198 1.00 0.00 H new ATOM 715 N ASP A 203 0.827 12.570 -1.935 1.00 0.00 N ATOM 716 CA ASP A 203 1.683 12.149 -3.042 1.00 0.00 C ATOM 717 C ASP A 203 1.134 10.941 -3.801 1.00 0.00 C ATOM 718 O ASP A 203 1.056 10.954 -5.029 1.00 0.00 O ATOM 719 CB ASP A 203 3.087 11.839 -2.523 1.00 0.00 C ATOM 720 CG ASP A 203 4.137 11.924 -3.613 1.00 0.00 C ATOM 721 OD1 ASP A 203 3.818 11.589 -4.773 1.00 0.00 O ATOM 722 OD2 ASP A 203 5.279 12.329 -3.307 1.00 0.00 O ATOM 0 H ASP A 203 1.184 12.326 -1.011 1.00 0.00 H new ATOM 0 HA ASP A 203 1.714 12.978 -3.749 1.00 0.00 H new ATOM 0 HB2 ASP A 203 3.339 12.537 -1.724 1.00 0.00 H new ATOM 0 HB3 ASP A 203 3.098 10.840 -2.088 1.00 0.00 H new ATOM 727 N GLY A 204 0.794 9.884 -3.070 1.00 0.00 N ATOM 728 CA GLY A 204 0.304 8.669 -3.704 1.00 0.00 C ATOM 729 C GLY A 204 -1.186 8.667 -3.987 1.00 0.00 C ATOM 730 O GLY A 204 -1.625 8.111 -4.994 1.00 0.00 O ATOM 0 H GLY A 204 0.848 9.845 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY A 204 0.840 8.522 -4.642 1.00 0.00 H new ATOM 0 HA3 GLY A 204 0.541 7.819 -3.064 1.00 0.00 H new ATOM 734 N ARG A 205 -1.970 9.267 -3.101 1.00 0.00 N ATOM 735 CA ARG A 205 -3.416 9.304 -3.266 1.00 0.00 C ATOM 736 C ARG A 205 -4.002 7.896 -3.183 1.00 0.00 C ATOM 737 O ARG A 205 -4.597 7.392 -4.135 1.00 0.00 O ATOM 738 CB ARG A 205 -3.785 9.982 -4.591 1.00 0.00 C ATOM 739 CG ARG A 205 -4.514 11.297 -4.398 1.00 0.00 C ATOM 740 CD ARG A 205 -6.021 11.098 -4.367 1.00 0.00 C ATOM 741 NE ARG A 205 -6.557 11.194 -3.010 1.00 0.00 N ATOM 742 CZ ARG A 205 -7.779 10.792 -2.661 1.00 0.00 C ATOM 743 NH1 ARG A 205 -8.600 10.258 -3.559 1.00 0.00 N ATOM 744 NH2 ARG A 205 -8.181 10.922 -1.406 1.00 0.00 N ATOM 0 H ARG A 205 -1.629 9.734 -2.261 1.00 0.00 H new ATOM 0 HA ARG A 205 -3.846 9.892 -2.455 1.00 0.00 H new ATOM 0 HB2 ARG A 205 -2.877 10.157 -5.169 1.00 0.00 H new ATOM 0 HB3 ARG A 205 -4.411 9.308 -5.176 1.00 0.00 H new ATOM 0 HG2 ARG A 205 -4.188 11.762 -3.468 1.00 0.00 H new ATOM 0 HG3 ARG A 205 -4.253 11.981 -5.205 1.00 0.00 H new ATOM 0 HD2 ARG A 205 -6.499 11.846 -5.000 1.00 0.00 H new ATOM 0 HD3 ARG A 205 -6.267 10.122 -4.786 1.00 0.00 H new ATOM 0 HE ARG A 205 -5.959 11.593 -2.286 1.00 0.00 H new ATOM 0 HH11 ARG A 205 -8.297 10.152 -4.527 1.00 0.00 H new ATOM 0 HH12 ARG A 205 -9.533 9.954 -3.280 1.00 0.00 H new ATOM 0 HH21 ARG A 205 -7.556 11.329 -0.710 1.00 0.00 H new ATOM 0 HH22 ARG A 205 -9.115 10.615 -1.135 1.00 0.00 H new ATOM 758 N LEU A 206 -3.827 7.265 -2.024 1.00 0.00 N ATOM 759 CA LEU A 206 -4.334 5.918 -1.797 1.00 0.00 C ATOM 760 C LEU A 206 -5.274 5.885 -0.596 1.00 0.00 C ATOM 761 O LEU A 206 -4.962 6.429 0.463 1.00 0.00 O ATOM 762 CB LEU A 206 -3.174 4.945 -1.575 1.00 0.00 C ATOM 763 CG LEU A 206 -2.094 5.436 -0.609 1.00 0.00 C ATOM 764 CD1 LEU A 206 -1.534 4.279 0.204 1.00 0.00 C ATOM 765 CD2 LEU A 206 -0.981 6.141 -1.370 1.00 0.00 C ATOM 0 H LEU A 206 -3.336 7.669 -1.226 1.00 0.00 H new ATOM 0 HA LEU A 206 -4.892 5.614 -2.682 1.00 0.00 H new ATOM 0 HB2 LEU A 206 -3.576 4.004 -1.199 1.00 0.00 H new ATOM 0 HB3 LEU A 206 -2.709 4.731 -2.538 1.00 0.00 H new ATOM 0 HG LEU A 206 -2.548 6.149 0.079 1.00 0.00 H new ATOM 0 HD11 LEU A 206 -0.768 4.650 0.885 1.00 0.00 H new ATOM 0 HD12 LEU A 206 -2.336 3.816 0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 206 -1.096 3.541 -0.468 1.00 0.00 H new ATOM 0 HD21 LEU A 206 -0.221 6.484 -0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 206 -0.532 5.448 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 206 -1.392 6.996 -1.906 1.00 0.00 H new ATOM 777 N GLN A 207 -6.427 5.242 -0.766 1.00 0.00 N ATOM 778 CA GLN A 207 -7.409 5.139 0.307 1.00 0.00 C ATOM 779 C GLN A 207 -7.536 3.698 0.795 1.00 0.00 C ATOM 780 O GLN A 207 -7.071 2.768 0.135 1.00 0.00 O ATOM 781 CB GLN A 207 -8.768 5.655 -0.164 1.00 0.00 C ATOM 782 CG GLN A 207 -9.242 5.024 -1.463 1.00 0.00 C ATOM 783 CD GLN A 207 -10.753 4.922 -1.545 1.00 0.00 C ATOM 784 OE1 GLN A 207 -11.459 5.928 -1.486 1.00 0.00 O ATOM 785 NE2 GLN A 207 -11.256 3.701 -1.686 1.00 0.00 N ATOM 0 H GLN A 207 -6.703 4.786 -1.636 1.00 0.00 H new ATOM 0 HA GLN A 207 -7.066 5.754 1.139 1.00 0.00 H new ATOM 0 HB2 GLN A 207 -9.508 5.466 0.613 1.00 0.00 H new ATOM 0 HB3 GLN A 207 -8.712 6.736 -0.294 1.00 0.00 H new ATOM 0 HG2 GLN A 207 -8.875 5.613 -2.304 1.00 0.00 H new ATOM 0 HG3 GLN A 207 -8.809 4.028 -1.558 1.00 0.00 H new ATOM 0 HE21 GLN A 207 -10.633 2.895 -1.730 1.00 0.00 H new ATOM 0 HE22 GLN A 207 -12.265 3.570 -1.750 1.00 0.00 H new ATOM 794 N ILE A 208 -8.170 3.520 1.951 1.00 0.00 N ATOM 795 CA ILE A 208 -8.356 2.191 2.521 1.00 0.00 C ATOM 796 C ILE A 208 -9.237 1.332 1.621 1.00 0.00 C ATOM 797 O ILE A 208 -10.433 1.589 1.480 1.00 0.00 O ATOM 798 CB ILE A 208 -8.989 2.258 3.928 1.00 0.00 C ATOM 799 CG1 ILE A 208 -8.207 3.224 4.822 1.00 0.00 C ATOM 800 CG2 ILE A 208 -9.042 0.870 4.555 1.00 0.00 C ATOM 801 CD1 ILE A 208 -8.773 3.346 6.223 1.00 0.00 C ATOM 0 H ILE A 208 -8.562 4.278 2.509 1.00 0.00 H new ATOM 0 HA ILE A 208 -7.367 1.741 2.602 1.00 0.00 H new ATOM 0 HB ILE A 208 -10.009 2.630 3.831 1.00 0.00 H new ATOM 0 HG12 ILE A 208 -7.171 2.890 4.885 1.00 0.00 H new ATOM 0 HG13 ILE A 208 -8.196 4.209 4.356 1.00 0.00 H new ATOM 0 HG21 ILE A 208 -9.491 0.935 5.546 1.00 0.00 H new ATOM 0 HG22 ILE A 208 -9.642 0.210 3.928 1.00 0.00 H new ATOM 0 HG23 ILE A 208 -8.031 0.470 4.640 1.00 0.00 H new ATOM 0 HD11 ILE A 208 -8.169 4.046 6.800 1.00 0.00 H new ATOM 0 HD12 ILE A 208 -9.799 3.710 6.170 1.00 0.00 H new ATOM 0 HD13 ILE A 208 -8.758 2.370 6.708 1.00 0.00 H new ATOM 813 N GLY A 209 -8.642 0.310 1.015 1.00 0.00 N ATOM 814 CA GLY A 209 -9.394 -0.568 0.140 1.00 0.00 C ATOM 815 C GLY A 209 -8.617 -0.990 -1.097 1.00 0.00 C ATOM 816 O GLY A 209 -9.018 -1.922 -1.794 1.00 0.00 O ATOM 0 H GLY A 209 -7.654 0.075 1.114 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -9.690 -1.457 0.696 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -10.310 -0.065 -0.169 1.00 0.00 H new ATOM 820 N ASP A 210 -7.507 -0.308 -1.379 1.00 0.00 N ATOM 821 CA ASP A 210 -6.693 -0.632 -2.547 1.00 0.00 C ATOM 822 C ASP A 210 -5.793 -1.832 -2.266 1.00 0.00 C ATOM 823 O ASP A 210 -5.420 -2.085 -1.120 1.00 0.00 O ATOM 824 CB ASP A 210 -5.844 0.579 -2.945 1.00 0.00 C ATOM 825 CG ASP A 210 -6.485 1.397 -4.048 1.00 0.00 C ATOM 826 OD1 ASP A 210 -7.722 1.314 -4.207 1.00 0.00 O ATOM 827 OD2 ASP A 210 -5.752 2.122 -4.752 1.00 0.00 O ATOM 0 H ASP A 210 -7.154 0.467 -0.818 1.00 0.00 H new ATOM 0 HA ASP A 210 -7.360 -0.889 -3.370 1.00 0.00 H new ATOM 0 HB2 ASP A 210 -5.687 1.212 -2.072 1.00 0.00 H new ATOM 0 HB3 ASP A 210 -4.862 0.239 -3.273 1.00 0.00 H new ATOM 832 N LYS A 211 -5.437 -2.564 -3.321 1.00 0.00 N ATOM 833 CA LYS A 211 -4.570 -3.728 -3.182 1.00 0.00 C ATOM 834 C LYS A 211 -3.242 -3.483 -3.885 1.00 0.00 C ATOM 835 O LYS A 211 -3.206 -3.081 -5.043 1.00 0.00 O ATOM 836 CB LYS A 211 -5.247 -4.971 -3.765 1.00 0.00 C ATOM 837 CG LYS A 211 -5.607 -4.835 -5.238 1.00 0.00 C ATOM 838 CD LYS A 211 -4.733 -5.716 -6.118 1.00 0.00 C ATOM 839 CE LYS A 211 -5.433 -7.019 -6.469 1.00 0.00 C ATOM 840 NZ LYS A 211 -4.479 -8.041 -6.979 1.00 0.00 N ATOM 0 H LYS A 211 -5.735 -2.371 -4.277 1.00 0.00 H new ATOM 0 HA LYS A 211 -4.384 -3.895 -2.121 1.00 0.00 H new ATOM 0 HB2 LYS A 211 -4.585 -5.828 -3.639 1.00 0.00 H new ATOM 0 HB3 LYS A 211 -6.153 -5.182 -3.196 1.00 0.00 H new ATOM 0 HG2 LYS A 211 -6.654 -5.102 -5.382 1.00 0.00 H new ATOM 0 HG3 LYS A 211 -5.498 -3.794 -5.544 1.00 0.00 H new ATOM 0 HD2 LYS A 211 -4.478 -5.180 -7.033 1.00 0.00 H new ATOM 0 HD3 LYS A 211 -3.797 -5.932 -5.604 1.00 0.00 H new ATOM 0 HE2 LYS A 211 -5.943 -7.406 -5.587 1.00 0.00 H new ATOM 0 HE3 LYS A 211 -6.198 -6.829 -7.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 -4.995 -8.915 -7.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 -4.011 -7.682 -7.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 -3.763 -8.242 -6.251 1.00 0.00 H new ATOM 854 N ILE A 212 -2.150 -3.724 -3.176 1.00 0.00 N ATOM 855 CA ILE A 212 -0.822 -3.514 -3.734 1.00 0.00 C ATOM 856 C ILE A 212 -0.293 -4.774 -4.412 1.00 0.00 C ATOM 857 O ILE A 212 -0.195 -5.832 -3.792 1.00 0.00 O ATOM 858 CB ILE A 212 0.161 -3.064 -2.638 1.00 0.00 C ATOM 859 CG1 ILE A 212 -0.404 -1.854 -1.893 1.00 0.00 C ATOM 860 CG2 ILE A 212 1.525 -2.736 -3.232 1.00 0.00 C ATOM 861 CD1 ILE A 212 -0.681 -0.666 -2.788 1.00 0.00 C ATOM 0 H ILE A 212 -2.156 -4.065 -2.215 1.00 0.00 H new ATOM 0 HA ILE A 212 -0.906 -2.730 -4.487 1.00 0.00 H new ATOM 0 HB ILE A 212 0.290 -3.884 -1.932 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -1.328 -2.145 -1.393 1.00 0.00 H new ATOM 0 HG13 ILE A 212 0.299 -1.556 -1.115 1.00 0.00 H new ATOM 0 HG21 ILE A 212 2.201 -2.421 -2.438 1.00 0.00 H new ATOM 0 HG22 ILE A 212 1.930 -3.621 -3.724 1.00 0.00 H new ATOM 0 HG23 ILE A 212 1.421 -1.932 -3.960 1.00 0.00 H new ATOM 0 HD11 ILE A 212 -1.080 0.154 -2.191 1.00 0.00 H new ATOM 0 HD12 ILE A 212 0.245 -0.349 -3.268 1.00 0.00 H new ATOM 0 HD13 ILE A 212 -1.408 -0.946 -3.550 1.00 0.00 H new ATOM 873 N LEU A 213 0.046 -4.646 -5.691 1.00 0.00 N ATOM 874 CA LEU A 213 0.567 -5.770 -6.462 1.00 0.00 C ATOM 875 C LEU A 213 2.098 -5.839 -6.376 1.00 0.00 C ATOM 876 O LEU A 213 2.687 -6.910 -6.509 1.00 0.00 O ATOM 877 CB LEU A 213 0.065 -5.672 -7.925 1.00 0.00 C ATOM 878 CG LEU A 213 1.055 -6.063 -9.034 1.00 0.00 C ATOM 879 CD1 LEU A 213 1.471 -7.520 -8.896 1.00 0.00 C ATOM 880 CD2 LEU A 213 0.449 -5.805 -10.405 1.00 0.00 C ATOM 0 H LEU A 213 -0.031 -3.775 -6.216 1.00 0.00 H new ATOM 0 HA LEU A 213 0.193 -6.702 -6.037 1.00 0.00 H new ATOM 0 HB2 LEU A 213 -0.818 -6.303 -8.022 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -0.255 -4.646 -8.104 1.00 0.00 H new ATOM 0 HG LEU A 213 1.946 -5.444 -8.931 1.00 0.00 H new ATOM 0 HD11 LEU A 213 2.172 -7.775 -9.691 1.00 0.00 H new ATOM 0 HD12 LEU A 213 1.949 -7.672 -7.928 1.00 0.00 H new ATOM 0 HD13 LEU A 213 0.591 -8.158 -8.970 1.00 0.00 H new ATOM 0 HD21 LEU A 213 1.164 -6.088 -11.178 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -0.460 -6.396 -10.518 1.00 0.00 H new ATOM 0 HD23 LEU A 213 0.208 -4.746 -10.503 1.00 0.00 H new ATOM 892 N ALA A 214 2.728 -4.692 -6.157 1.00 0.00 N ATOM 893 CA ALA A 214 4.188 -4.611 -6.055 1.00 0.00 C ATOM 894 C ALA A 214 4.636 -3.169 -5.874 1.00 0.00 C ATOM 895 O ALA A 214 3.984 -2.241 -6.353 1.00 0.00 O ATOM 896 CB ALA A 214 4.851 -5.208 -7.291 1.00 0.00 C ATOM 0 H ALA A 214 2.251 -3.797 -6.045 1.00 0.00 H new ATOM 0 HA ALA A 214 4.494 -5.186 -5.181 1.00 0.00 H new ATOM 0 HB1 ALA A 214 5.934 -5.137 -7.193 1.00 0.00 H new ATOM 0 HB2 ALA A 214 4.563 -6.255 -7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 214 4.530 -4.660 -8.177 1.00 0.00 H new ATOM 902 N VAL A 215 5.756 -2.986 -5.187 1.00 0.00 N ATOM 903 CA VAL A 215 6.293 -1.651 -4.953 1.00 0.00 C ATOM 904 C VAL A 215 7.649 -1.507 -5.635 1.00 0.00 C ATOM 905 O VAL A 215 8.582 -2.245 -5.323 1.00 0.00 O ATOM 906 CB VAL A 215 6.440 -1.345 -3.443 1.00 0.00 C ATOM 907 CG1 VAL A 215 6.454 0.154 -3.218 1.00 0.00 C ATOM 908 CG2 VAL A 215 5.327 -2.002 -2.628 1.00 0.00 C ATOM 0 H VAL A 215 6.309 -3.742 -4.783 1.00 0.00 H new ATOM 0 HA VAL A 215 5.587 -0.936 -5.375 1.00 0.00 H new ATOM 0 HB VAL A 215 7.386 -1.765 -3.102 1.00 0.00 H new ATOM 0 HG11 VAL A 215 6.558 0.361 -2.153 1.00 0.00 H new ATOM 0 HG12 VAL A 215 7.293 0.595 -3.757 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.522 0.585 -3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 215 5.461 -1.766 -1.572 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.360 -1.627 -2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 215 5.364 -3.083 -2.766 1.00 0.00 H new ATOM 918 N ASN A 216 7.746 -0.565 -6.577 1.00 0.00 N ATOM 919 CA ASN A 216 8.987 -0.341 -7.325 1.00 0.00 C ATOM 920 C ASN A 216 9.433 -1.637 -8.016 1.00 0.00 C ATOM 921 O ASN A 216 9.087 -1.881 -9.171 1.00 0.00 O ATOM 922 CB ASN A 216 10.087 0.201 -6.401 1.00 0.00 C ATOM 923 CG ASN A 216 10.379 1.666 -6.646 1.00 0.00 C ATOM 924 OD1 ASN A 216 10.253 2.157 -7.768 1.00 0.00 O ATOM 925 ND2 ASN A 216 10.777 2.373 -5.594 1.00 0.00 N ATOM 0 H ASN A 216 6.980 0.055 -6.840 1.00 0.00 H new ATOM 0 HA ASN A 216 8.800 0.408 -8.095 1.00 0.00 H new ATOM 0 HB2 ASN A 216 9.786 0.062 -5.363 1.00 0.00 H new ATOM 0 HB3 ASN A 216 10.999 -0.378 -6.548 1.00 0.00 H new ATOM 0 HD21 ASN A 216 10.992 3.365 -5.698 1.00 0.00 H new ATOM 0 HD22 ASN A 216 10.867 1.924 -4.683 1.00 0.00 H new ATOM 932 N SER A 217 10.176 -2.475 -7.295 1.00 0.00 N ATOM 933 CA SER A 217 10.637 -3.751 -7.824 1.00 0.00 C ATOM 934 C SER A 217 10.469 -4.871 -6.788 1.00 0.00 C ATOM 935 O SER A 217 10.986 -5.973 -6.971 1.00 0.00 O ATOM 936 CB SER A 217 12.104 -3.653 -8.245 1.00 0.00 C ATOM 937 OG SER A 217 12.225 -3.122 -9.552 1.00 0.00 O ATOM 0 H SER A 217 10.472 -2.288 -6.337 1.00 0.00 H new ATOM 0 HA SER A 217 10.028 -3.992 -8.695 1.00 0.00 H new ATOM 0 HB2 SER A 217 12.646 -3.022 -7.541 1.00 0.00 H new ATOM 0 HB3 SER A 217 12.563 -4.641 -8.206 1.00 0.00 H new ATOM 0 HG SER A 217 13.172 -3.068 -9.797 1.00 0.00 H new ATOM 943 N VAL A 218 9.746 -4.585 -5.699 1.00 0.00 N ATOM 944 CA VAL A 218 9.520 -5.558 -4.651 1.00 0.00 C ATOM 945 C VAL A 218 8.068 -6.025 -4.651 1.00 0.00 C ATOM 946 O VAL A 218 7.151 -5.233 -4.867 1.00 0.00 O ATOM 947 CB VAL A 218 9.884 -4.970 -3.273 1.00 0.00 C ATOM 948 CG1 VAL A 218 9.050 -3.734 -2.966 1.00 0.00 C ATOM 949 CG2 VAL A 218 9.729 -6.016 -2.184 1.00 0.00 C ATOM 0 H VAL A 218 9.310 -3.679 -5.530 1.00 0.00 H new ATOM 0 HA VAL A 218 10.163 -6.416 -4.846 1.00 0.00 H new ATOM 0 HB VAL A 218 10.930 -4.665 -3.303 1.00 0.00 H new ATOM 0 HG11 VAL A 218 9.328 -3.341 -1.988 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.231 -2.975 -3.727 1.00 0.00 H new ATOM 0 HG13 VAL A 218 7.993 -4.000 -2.963 1.00 0.00 H new ATOM 0 HG21 VAL A 218 9.991 -5.579 -1.220 1.00 0.00 H new ATOM 0 HG22 VAL A 218 8.696 -6.362 -2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 218 10.389 -6.858 -2.392 1.00 0.00 H new ATOM 959 N GLY A 219 7.866 -7.315 -4.422 1.00 0.00 N ATOM 960 CA GLY A 219 6.525 -7.860 -4.411 1.00 0.00 C ATOM 961 C GLY A 219 6.052 -8.244 -3.024 1.00 0.00 C ATOM 962 O GLY A 219 6.202 -9.392 -2.607 1.00 0.00 O ATOM 0 H GLY A 219 8.607 -7.993 -4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 219 5.838 -7.127 -4.833 1.00 0.00 H new ATOM 0 HA3 GLY A 219 6.490 -8.738 -5.056 1.00 0.00 H new ATOM 966 N LEU A 220 5.449 -7.291 -2.315 1.00 0.00 N ATOM 967 CA LEU A 220 4.925 -7.561 -0.977 1.00 0.00 C ATOM 968 C LEU A 220 3.733 -8.511 -1.041 1.00 0.00 C ATOM 969 O LEU A 220 3.304 -9.052 -0.026 1.00 0.00 O ATOM 970 CB LEU A 220 4.506 -6.274 -0.267 1.00 0.00 C ATOM 971 CG LEU A 220 3.792 -5.234 -1.135 1.00 0.00 C ATOM 972 CD1 LEU A 220 2.598 -5.853 -1.845 1.00 0.00 C ATOM 973 CD2 LEU A 220 3.352 -4.051 -0.286 1.00 0.00 C ATOM 0 H LEU A 220 5.312 -6.334 -2.640 1.00 0.00 H new ATOM 0 HA LEU A 220 5.730 -8.027 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 220 3.851 -6.537 0.564 1.00 0.00 H new ATOM 0 HB3 LEU A 220 5.395 -5.812 0.162 1.00 0.00 H new ATOM 0 HG LEU A 220 4.491 -4.879 -1.892 1.00 0.00 H new ATOM 0 HD11 LEU A 220 2.106 -5.096 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 220 2.937 -6.670 -2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 220 1.894 -6.237 -1.106 1.00 0.00 H new ATOM 0 HD21 LEU A 220 2.846 -3.319 -0.916 1.00 0.00 H new ATOM 0 HD22 LEU A 220 2.669 -4.395 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 220 4.225 -3.590 0.176 1.00 0.00 H new ATOM 985 N GLU A 221 3.197 -8.702 -2.236 1.00 0.00 N ATOM 986 CA GLU A 221 2.062 -9.580 -2.435 1.00 0.00 C ATOM 987 C GLU A 221 2.423 -11.016 -2.080 1.00 0.00 C ATOM 988 O GLU A 221 3.591 -11.349 -1.881 1.00 0.00 O ATOM 989 CB GLU A 221 1.602 -9.514 -3.890 1.00 0.00 C ATOM 990 CG GLU A 221 2.752 -9.598 -4.879 1.00 0.00 C ATOM 991 CD GLU A 221 2.364 -10.276 -6.179 1.00 0.00 C ATOM 992 OE1 GLU A 221 1.208 -10.100 -6.618 1.00 0.00 O ATOM 993 OE2 GLU A 221 3.214 -10.985 -6.756 1.00 0.00 O ATOM 0 H GLU A 221 3.536 -8.255 -3.088 1.00 0.00 H new ATOM 0 HA GLU A 221 1.254 -9.250 -1.782 1.00 0.00 H new ATOM 0 HB2 GLU A 221 0.904 -10.329 -4.082 1.00 0.00 H new ATOM 0 HB3 GLU A 221 1.058 -8.583 -4.052 1.00 0.00 H new ATOM 0 HG2 GLU A 221 3.114 -8.593 -5.093 1.00 0.00 H new ATOM 0 HG3 GLU A 221 3.578 -10.144 -4.423 1.00 0.00 H new ATOM 1000 N ASP A 222 1.404 -11.860 -2.020 1.00 0.00 N ATOM 1001 CA ASP A 222 1.574 -13.278 -1.708 1.00 0.00 C ATOM 1002 C ASP A 222 2.431 -13.512 -0.465 1.00 0.00 C ATOM 1003 O ASP A 222 3.019 -14.582 -0.306 1.00 0.00 O ATOM 1004 CB ASP A 222 2.179 -14.013 -2.905 1.00 0.00 C ATOM 1005 CG ASP A 222 1.152 -14.313 -3.979 1.00 0.00 C ATOM 1006 OD1 ASP A 222 0.367 -13.403 -4.321 1.00 0.00 O ATOM 1007 OD2 ASP A 222 1.132 -15.458 -4.477 1.00 0.00 O ATOM 0 H ASP A 222 0.436 -11.585 -2.185 1.00 0.00 H new ATOM 0 HA ASP A 222 0.582 -13.675 -1.493 1.00 0.00 H new ATOM 0 HB2 ASP A 222 2.980 -13.409 -3.331 1.00 0.00 H new ATOM 0 HB3 ASP A 222 2.629 -14.946 -2.565 1.00 0.00 H new ATOM 1012 N VAL A 223 2.485 -12.526 0.423 1.00 0.00 N ATOM 1013 CA VAL A 223 3.257 -12.667 1.654 1.00 0.00 C ATOM 1014 C VAL A 223 2.566 -11.946 2.812 1.00 0.00 C ATOM 1015 O VAL A 223 1.768 -11.034 2.595 1.00 0.00 O ATOM 1016 CB VAL A 223 4.723 -12.188 1.471 1.00 0.00 C ATOM 1017 CG1 VAL A 223 4.857 -10.664 1.494 1.00 0.00 C ATOM 1018 CG2 VAL A 223 5.622 -12.837 2.515 1.00 0.00 C ATOM 0 H VAL A 223 2.010 -11.630 0.317 1.00 0.00 H new ATOM 0 HA VAL A 223 3.302 -13.728 1.901 1.00 0.00 H new ATOM 0 HB VAL A 223 5.045 -12.505 0.479 1.00 0.00 H new ATOM 0 HG11 VAL A 223 5.903 -10.389 1.362 1.00 0.00 H new ATOM 0 HG12 VAL A 223 4.264 -10.234 0.687 1.00 0.00 H new ATOM 0 HG13 VAL A 223 4.499 -10.282 2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 223 6.647 -12.494 2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 223 5.279 -12.562 3.512 1.00 0.00 H new ATOM 0 HG23 VAL A 223 5.584 -13.921 2.404 1.00 0.00 H new ATOM 1028 N MET A 224 2.852 -12.371 4.039 1.00 0.00 N ATOM 1029 CA MET A 224 2.228 -11.773 5.211 1.00 0.00 C ATOM 1030 C MET A 224 2.460 -10.279 5.295 1.00 0.00 C ATOM 1031 O MET A 224 3.305 -9.712 4.604 1.00 0.00 O ATOM 1032 CB MET A 224 2.750 -12.403 6.500 1.00 0.00 C ATOM 1033 CG MET A 224 2.866 -13.918 6.448 1.00 0.00 C ATOM 1034 SD MET A 224 4.576 -14.489 6.352 1.00 0.00 S ATOM 1035 CE MET A 224 4.735 -15.351 7.916 1.00 0.00 C ATOM 0 H MET A 224 3.509 -13.124 4.245 1.00 0.00 H new ATOM 0 HA MET A 224 1.160 -11.962 5.101 1.00 0.00 H new ATOM 0 HB2 MET A 224 3.729 -11.982 6.727 1.00 0.00 H new ATOM 0 HB3 MET A 224 2.087 -12.128 7.320 1.00 0.00 H new ATOM 0 HG2 MET A 224 2.395 -14.344 7.334 1.00 0.00 H new ATOM 0 HG3 MET A 224 2.315 -14.290 5.584 1.00 0.00 H new ATOM 0 HE1 MET A 224 5.741 -15.761 8.005 1.00 0.00 H new ATOM 0 HE2 MET A 224 4.554 -14.655 8.735 1.00 0.00 H new ATOM 0 HE3 MET A 224 4.007 -16.161 7.960 1.00 0.00 H new ATOM 1045 N HIS A 225 1.702 -9.664 6.188 1.00 0.00 N ATOM 1046 CA HIS A 225 1.790 -8.240 6.445 1.00 0.00 C ATOM 1047 C HIS A 225 3.214 -7.852 6.865 1.00 0.00 C ATOM 1048 O HIS A 225 3.683 -6.762 6.547 1.00 0.00 O ATOM 1049 CB HIS A 225 0.782 -7.883 7.553 1.00 0.00 C ATOM 1050 CG HIS A 225 0.963 -6.535 8.174 1.00 0.00 C ATOM 1051 ND1 HIS A 225 0.614 -5.346 7.578 1.00 0.00 N ATOM 1052 CD2 HIS A 225 1.471 -6.216 9.383 1.00 0.00 C ATOM 1053 CE1 HIS A 225 0.920 -4.357 8.429 1.00 0.00 C ATOM 1054 NE2 HIS A 225 1.443 -4.834 9.543 1.00 0.00 N ATOM 0 H HIS A 225 1.005 -10.144 6.757 1.00 0.00 H new ATOM 0 HA HIS A 225 1.553 -7.686 5.537 1.00 0.00 H new ATOM 0 HB2 HIS A 225 -0.224 -7.941 7.138 1.00 0.00 H new ATOM 0 HB3 HIS A 225 0.847 -8.637 8.337 1.00 0.00 H new ATOM 0 HD2 HIS A 225 1.841 -6.922 10.112 1.00 0.00 H new ATOM 0 HE1 HIS A 225 0.760 -3.308 8.230 1.00 0.00 H new ATOM 0 HE2 HIS A 225 1.760 -4.301 10.352 1.00 0.00 H new ATOM 1062 N GLU A 226 3.882 -8.741 7.599 1.00 0.00 N ATOM 1063 CA GLU A 226 5.236 -8.471 8.086 1.00 0.00 C ATOM 1064 C GLU A 226 6.245 -8.377 6.946 1.00 0.00 C ATOM 1065 O GLU A 226 6.994 -7.401 6.837 1.00 0.00 O ATOM 1066 CB GLU A 226 5.663 -9.563 9.069 1.00 0.00 C ATOM 1067 CG GLU A 226 6.443 -9.034 10.261 1.00 0.00 C ATOM 1068 CD GLU A 226 7.752 -8.384 9.859 1.00 0.00 C ATOM 1069 OE1 GLU A 226 8.585 -9.067 9.227 1.00 0.00 O ATOM 1070 OE2 GLU A 226 7.945 -7.191 10.176 1.00 0.00 O ATOM 0 H GLU A 226 3.510 -9.652 7.869 1.00 0.00 H new ATOM 0 HA GLU A 226 5.218 -7.505 8.591 1.00 0.00 H new ATOM 0 HB2 GLU A 226 4.776 -10.085 9.428 1.00 0.00 H new ATOM 0 HB3 GLU A 226 6.273 -10.297 8.542 1.00 0.00 H new ATOM 0 HG2 GLU A 226 5.831 -8.309 10.798 1.00 0.00 H new ATOM 0 HG3 GLU A 226 6.645 -9.853 10.951 1.00 0.00 H new ATOM 1077 N ASP A 227 6.258 -9.389 6.092 1.00 0.00 N ATOM 1078 CA ASP A 227 7.171 -9.413 4.958 1.00 0.00 C ATOM 1079 C ASP A 227 6.897 -8.231 4.038 1.00 0.00 C ATOM 1080 O ASP A 227 7.817 -7.647 3.462 1.00 0.00 O ATOM 1081 CB ASP A 227 7.026 -10.723 4.196 1.00 0.00 C ATOM 1082 CG ASP A 227 7.706 -11.883 4.896 1.00 0.00 C ATOM 1083 OD1 ASP A 227 8.945 -11.999 4.788 1.00 0.00 O ATOM 1084 OD2 ASP A 227 7.000 -12.677 5.554 1.00 0.00 O ATOM 0 H ASP A 227 5.648 -10.204 6.162 1.00 0.00 H new ATOM 0 HA ASP A 227 8.194 -9.336 5.327 1.00 0.00 H new ATOM 0 HB2 ASP A 227 5.967 -10.950 4.069 1.00 0.00 H new ATOM 0 HB3 ASP A 227 7.449 -10.607 3.198 1.00 0.00 H new ATOM 1089 N ALA A 228 5.621 -7.869 3.923 1.00 0.00 N ATOM 1090 CA ALA A 228 5.225 -6.745 3.092 1.00 0.00 C ATOM 1091 C ALA A 228 5.845 -5.466 3.628 1.00 0.00 C ATOM 1092 O ALA A 228 6.300 -4.614 2.866 1.00 0.00 O ATOM 1093 CB ALA A 228 3.713 -6.634 3.033 1.00 0.00 C ATOM 0 H ALA A 228 4.849 -8.339 4.395 1.00 0.00 H new ATOM 0 HA ALA A 228 5.587 -6.907 2.077 1.00 0.00 H new ATOM 0 HB1 ALA A 228 3.435 -5.787 2.406 1.00 0.00 H new ATOM 0 HB2 ALA A 228 3.297 -7.549 2.612 1.00 0.00 H new ATOM 0 HB3 ALA A 228 3.320 -6.486 4.039 1.00 0.00 H new ATOM 1099 N VAL A 229 5.894 -5.354 4.958 1.00 0.00 N ATOM 1100 CA VAL A 229 6.500 -4.195 5.601 1.00 0.00 C ATOM 1101 C VAL A 229 7.953 -4.085 5.167 1.00 0.00 C ATOM 1102 O VAL A 229 8.449 -2.999 4.868 1.00 0.00 O ATOM 1103 CB VAL A 229 6.433 -4.289 7.137 1.00 0.00 C ATOM 1104 CG1 VAL A 229 6.891 -2.984 7.769 1.00 0.00 C ATOM 1105 CG2 VAL A 229 5.025 -4.652 7.592 1.00 0.00 C ATOM 0 H VAL A 229 5.522 -6.050 5.604 1.00 0.00 H new ATOM 0 HA VAL A 229 5.940 -3.311 5.296 1.00 0.00 H new ATOM 0 HB VAL A 229 7.106 -5.080 7.466 1.00 0.00 H new ATOM 0 HG11 VAL A 229 6.838 -3.067 8.855 1.00 0.00 H new ATOM 0 HG12 VAL A 229 7.919 -2.776 7.471 1.00 0.00 H new ATOM 0 HG13 VAL A 229 6.245 -2.172 7.435 1.00 0.00 H new ATOM 0 HG21 VAL A 229 4.999 -4.713 8.680 1.00 0.00 H new ATOM 0 HG22 VAL A 229 4.325 -3.887 7.255 1.00 0.00 H new ATOM 0 HG23 VAL A 229 4.742 -5.615 7.167 1.00 0.00 H new ATOM 1115 N ALA A 230 8.621 -5.236 5.105 1.00 0.00 N ATOM 1116 CA ALA A 230 10.010 -5.287 4.673 1.00 0.00 C ATOM 1117 C ALA A 230 10.134 -4.767 3.247 1.00 0.00 C ATOM 1118 O ALA A 230 11.114 -4.114 2.890 1.00 0.00 O ATOM 1119 CB ALA A 230 10.550 -6.704 4.772 1.00 0.00 C ATOM 0 H ALA A 230 8.221 -6.142 5.349 1.00 0.00 H new ATOM 0 HA ALA A 230 10.602 -4.651 5.330 1.00 0.00 H new ATOM 0 HB1 ALA A 230 11.590 -6.721 4.445 1.00 0.00 H new ATOM 0 HB2 ALA A 230 10.489 -7.045 5.805 1.00 0.00 H new ATOM 0 HB3 ALA A 230 9.959 -7.364 4.137 1.00 0.00 H new ATOM 1125 N ALA A 231 9.116 -5.051 2.446 1.00 0.00 N ATOM 1126 CA ALA A 231 9.088 -4.602 1.059 1.00 0.00 C ATOM 1127 C ALA A 231 9.061 -3.079 0.996 1.00 0.00 C ATOM 1128 O ALA A 231 9.717 -2.470 0.151 1.00 0.00 O ATOM 1129 CB ALA A 231 7.887 -5.189 0.317 1.00 0.00 C ATOM 0 H ALA A 231 8.299 -5.590 2.732 1.00 0.00 H new ATOM 0 HA ALA A 231 9.994 -4.957 0.568 1.00 0.00 H new ATOM 0 HB1 ALA A 231 7.890 -4.838 -0.715 1.00 0.00 H new ATOM 0 HB2 ALA A 231 7.947 -6.277 0.331 1.00 0.00 H new ATOM 0 HB3 ALA A 231 6.966 -4.871 0.806 1.00 0.00 H new ATOM 1135 N LEU A 232 8.299 -2.471 1.902 1.00 0.00 N ATOM 1136 CA LEU A 232 8.187 -1.019 1.957 1.00 0.00 C ATOM 1137 C LEU A 232 9.462 -0.388 2.515 1.00 0.00 C ATOM 1138 O LEU A 232 9.951 0.612 1.990 1.00 0.00 O ATOM 1139 CB LEU A 232 6.987 -0.616 2.820 1.00 0.00 C ATOM 1140 CG LEU A 232 5.689 -1.371 2.523 1.00 0.00 C ATOM 1141 CD1 LEU A 232 4.745 -1.302 3.714 1.00 0.00 C ATOM 1142 CD2 LEU A 232 5.019 -0.808 1.280 1.00 0.00 C ATOM 0 H LEU A 232 7.751 -2.963 2.607 1.00 0.00 H new ATOM 0 HA LEU A 232 8.041 -0.653 0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 232 7.246 -0.768 3.868 1.00 0.00 H new ATOM 0 HB3 LEU A 232 6.807 0.451 2.688 1.00 0.00 H new ATOM 0 HG LEU A 232 5.934 -2.417 2.340 1.00 0.00 H new ATOM 0 HD11 LEU A 232 3.828 -1.844 3.483 1.00 0.00 H new ATOM 0 HD12 LEU A 232 5.224 -1.752 4.584 1.00 0.00 H new ATOM 0 HD13 LEU A 232 4.506 -0.260 3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 232 4.098 -1.356 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 232 4.788 0.246 1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 232 5.690 -0.909 0.427 1.00 0.00 H new ATOM 1154 N LYS A 233 9.991 -0.973 3.587 1.00 0.00 N ATOM 1155 CA LYS A 233 11.205 -0.464 4.225 1.00 0.00 C ATOM 1156 C LYS A 233 12.367 -0.389 3.240 1.00 0.00 C ATOM 1157 O LYS A 233 13.183 0.531 3.289 1.00 0.00 O ATOM 1158 CB LYS A 233 11.583 -1.347 5.422 1.00 0.00 C ATOM 1159 CG LYS A 233 11.861 -0.563 6.698 1.00 0.00 C ATOM 1160 CD LYS A 233 10.822 -0.845 7.776 1.00 0.00 C ATOM 1161 CE LYS A 233 11.051 -2.193 8.447 1.00 0.00 C ATOM 1162 NZ LYS A 233 11.282 -2.051 9.912 1.00 0.00 N ATOM 0 H LYS A 233 9.598 -1.802 4.034 1.00 0.00 H new ATOM 0 HA LYS A 233 10.999 0.548 4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 233 10.775 -2.055 5.610 1.00 0.00 H new ATOM 0 HB3 LYS A 233 12.466 -1.932 5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 233 12.852 -0.819 7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 233 11.871 0.504 6.474 1.00 0.00 H new ATOM 0 HD2 LYS A 233 10.855 -0.056 8.527 1.00 0.00 H new ATOM 0 HD3 LYS A 233 9.826 -0.824 7.334 1.00 0.00 H new ATOM 0 HE2 LYS A 233 10.187 -2.835 8.276 1.00 0.00 H new ATOM 0 HE3 LYS A 233 11.909 -2.685 7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 11.434 -2.990 10.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 12.121 -1.459 10.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 10.452 -1.605 10.353 1.00 0.00 H new ATOM 1176 N ASN A 234 12.430 -1.367 2.355 1.00 0.00 N ATOM 1177 CA ASN A 234 13.489 -1.436 1.350 1.00 0.00 C ATOM 1178 C ASN A 234 13.446 -0.244 0.393 1.00 0.00 C ATOM 1179 O ASN A 234 14.437 0.061 -0.271 1.00 0.00 O ATOM 1180 CB ASN A 234 13.374 -2.739 0.553 1.00 0.00 C ATOM 1181 CG ASN A 234 14.097 -3.892 1.219 1.00 0.00 C ATOM 1182 OD1 ASN A 234 14.809 -3.707 2.206 1.00 0.00 O ATOM 1183 ND2 ASN A 234 13.918 -5.091 0.679 1.00 0.00 N ATOM 0 H ASN A 234 11.757 -2.132 2.308 1.00 0.00 H new ATOM 0 HA ASN A 234 14.442 -1.408 1.878 1.00 0.00 H new ATOM 0 HB2 ASN A 234 12.322 -2.996 0.432 1.00 0.00 H new ATOM 0 HB3 ASN A 234 13.782 -2.587 -0.446 1.00 0.00 H new ATOM 0 HD21 ASN A 234 14.380 -5.906 1.082 1.00 0.00 H new ATOM 0 HD22 ASN A 234 13.319 -5.197 -0.139 1.00 0.00 H new ATOM 1190 N THR A 235 12.296 0.420 0.312 1.00 0.00 N ATOM 1191 CA THR A 235 12.136 1.566 -0.579 1.00 0.00 C ATOM 1192 C THR A 235 13.026 2.732 -0.150 1.00 0.00 C ATOM 1193 O THR A 235 13.820 2.608 0.783 1.00 0.00 O ATOM 1194 CB THR A 235 10.670 1.999 -0.624 1.00 0.00 C ATOM 1195 OG1 THR A 235 10.292 2.631 0.586 1.00 0.00 O ATOM 1196 CG2 THR A 235 9.714 0.848 -0.866 1.00 0.00 C ATOM 0 H THR A 235 11.463 0.185 0.851 1.00 0.00 H new ATOM 0 HA THR A 235 12.446 1.263 -1.579 1.00 0.00 H new ATOM 0 HB THR A 235 10.599 2.691 -1.464 1.00 0.00 H new ATOM 0 HG1 THR A 235 10.497 2.041 1.341 1.00 0.00 H new ATOM 0 HG21 THR A 235 8.691 1.223 -0.887 1.00 0.00 H new ATOM 0 HG22 THR A 235 9.947 0.376 -1.821 1.00 0.00 H new ATOM 0 HG23 THR A 235 9.816 0.116 -0.065 1.00 0.00 H new ATOM 1204 N TYR A 236 12.893 3.862 -0.842 1.00 0.00 N ATOM 1205 CA TYR A 236 13.688 5.045 -0.543 1.00 0.00 C ATOM 1206 C TYR A 236 12.806 6.297 -0.572 1.00 0.00 C ATOM 1207 O TYR A 236 11.615 6.215 -0.272 1.00 0.00 O ATOM 1208 CB TYR A 236 14.852 5.145 -1.539 1.00 0.00 C ATOM 1209 CG TYR A 236 16.156 5.575 -0.904 1.00 0.00 C ATOM 1210 CD1 TYR A 236 16.807 4.755 0.009 1.00 0.00 C ATOM 1211 CD2 TYR A 236 16.735 6.798 -1.218 1.00 0.00 C ATOM 1212 CE1 TYR A 236 18.000 5.143 0.592 1.00 0.00 C ATOM 1213 CE2 TYR A 236 17.928 7.192 -0.641 1.00 0.00 C ATOM 1214 CZ TYR A 236 18.555 6.361 0.263 1.00 0.00 C ATOM 1215 OH TYR A 236 19.743 6.750 0.840 1.00 0.00 O ATOM 0 H TYR A 236 12.239 3.980 -1.616 1.00 0.00 H new ATOM 0 HA TYR A 236 14.106 4.964 0.460 1.00 0.00 H new ATOM 0 HB2 TYR A 236 14.993 4.177 -2.019 1.00 0.00 H new ATOM 0 HB3 TYR A 236 14.588 5.854 -2.324 1.00 0.00 H new ATOM 0 HD1 TYR A 236 16.375 3.800 0.268 1.00 0.00 H new ATOM 0 HD2 TYR A 236 16.245 7.452 -1.924 1.00 0.00 H new ATOM 0 HE1 TYR A 236 18.494 4.495 1.301 1.00 0.00 H new ATOM 0 HE2 TYR A 236 18.366 8.145 -0.897 1.00 0.00 H new ATOM 0 HH TYR A 236 19.998 7.633 0.500 1.00 0.00 H new ATOM 1225 N ASP A 237 13.379 7.455 -0.929 1.00 0.00 N ATOM 1226 CA ASP A 237 12.629 8.713 -0.990 1.00 0.00 C ATOM 1227 C ASP A 237 11.275 8.519 -1.670 1.00 0.00 C ATOM 1228 O ASP A 237 10.259 8.360 -1.002 1.00 0.00 O ATOM 1229 CB ASP A 237 13.445 9.776 -1.730 1.00 0.00 C ATOM 1230 CG ASP A 237 14.280 10.623 -0.790 1.00 0.00 C ATOM 1231 OD1 ASP A 237 13.693 11.288 0.090 1.00 0.00 O ATOM 1232 OD2 ASP A 237 15.520 10.623 -0.935 1.00 0.00 O ATOM 0 H ASP A 237 14.363 7.544 -1.180 1.00 0.00 H new ATOM 0 HA ASP A 237 12.447 9.048 0.031 1.00 0.00 H new ATOM 0 HB2 ASP A 237 14.099 9.289 -2.454 1.00 0.00 H new ATOM 0 HB3 ASP A 237 12.770 10.421 -2.293 1.00 0.00 H new ATOM 1237 N VAL A 238 11.262 8.507 -2.990 1.00 0.00 N ATOM 1238 CA VAL A 238 10.019 8.316 -3.718 1.00 0.00 C ATOM 1239 C VAL A 238 9.819 6.843 -4.066 1.00 0.00 C ATOM 1240 O VAL A 238 10.663 6.230 -4.721 1.00 0.00 O ATOM 1241 CB VAL A 238 9.957 9.213 -4.985 1.00 0.00 C ATOM 1242 CG1 VAL A 238 10.522 8.526 -6.220 1.00 0.00 C ATOM 1243 CG2 VAL A 238 8.532 9.669 -5.231 1.00 0.00 C ATOM 0 H VAL A 238 12.088 8.626 -3.576 1.00 0.00 H new ATOM 0 HA VAL A 238 9.199 8.623 -3.068 1.00 0.00 H new ATOM 0 HB VAL A 238 10.588 10.082 -4.796 1.00 0.00 H new ATOM 0 HG11 VAL A 238 10.453 9.199 -7.074 1.00 0.00 H new ATOM 0 HG12 VAL A 238 11.566 8.266 -6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 238 9.952 7.620 -6.425 1.00 0.00 H new ATOM 0 HG21 VAL A 238 8.500 10.297 -6.121 1.00 0.00 H new ATOM 0 HG22 VAL A 238 7.892 8.799 -5.377 1.00 0.00 H new ATOM 0 HG23 VAL A 238 8.179 10.239 -4.372 1.00 0.00 H new ATOM 1253 N VAL A 239 8.707 6.283 -3.623 1.00 0.00 N ATOM 1254 CA VAL A 239 8.409 4.888 -3.889 1.00 0.00 C ATOM 1255 C VAL A 239 7.125 4.742 -4.696 1.00 0.00 C ATOM 1256 O VAL A 239 6.121 5.394 -4.411 1.00 0.00 O ATOM 1257 CB VAL A 239 8.304 4.080 -2.581 1.00 0.00 C ATOM 1258 CG1 VAL A 239 7.094 4.495 -1.758 1.00 0.00 C ATOM 1259 CG2 VAL A 239 8.256 2.601 -2.891 1.00 0.00 C ATOM 0 H VAL A 239 7.997 6.772 -3.078 1.00 0.00 H new ATOM 0 HA VAL A 239 9.235 4.488 -4.477 1.00 0.00 H new ATOM 0 HB VAL A 239 9.190 4.291 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 239 7.055 3.902 -0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 239 7.173 5.552 -1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 239 6.186 4.329 -2.337 1.00 0.00 H new ATOM 0 HG21 VAL A 239 8.182 2.037 -1.961 1.00 0.00 H new ATOM 0 HG22 VAL A 239 7.388 2.388 -3.515 1.00 0.00 H new ATOM 0 HG23 VAL A 239 9.163 2.311 -3.420 1.00 0.00 H new ATOM 1269 N TYR A 240 7.167 3.885 -5.706 1.00 0.00 N ATOM 1270 CA TYR A 240 6.009 3.656 -6.552 1.00 0.00 C ATOM 1271 C TYR A 240 5.320 2.346 -6.190 1.00 0.00 C ATOM 1272 O TYR A 240 5.973 1.318 -6.008 1.00 0.00 O ATOM 1273 CB TYR A 240 6.422 3.626 -8.022 1.00 0.00 C ATOM 1274 CG TYR A 240 7.309 4.778 -8.427 1.00 0.00 C ATOM 1275 CD1 TYR A 240 8.645 4.816 -8.051 1.00 0.00 C ATOM 1276 CD2 TYR A 240 6.810 5.826 -9.190 1.00 0.00 C ATOM 1277 CE1 TYR A 240 9.459 5.868 -8.422 1.00 0.00 C ATOM 1278 CE2 TYR A 240 7.619 6.881 -9.566 1.00 0.00 C ATOM 1279 CZ TYR A 240 8.942 6.898 -9.179 1.00 0.00 C ATOM 1280 OH TYR A 240 9.750 7.947 -9.551 1.00 0.00 O ATOM 0 H TYR A 240 7.990 3.338 -5.958 1.00 0.00 H new ATOM 0 HA TYR A 240 5.309 4.476 -6.390 1.00 0.00 H new ATOM 0 HB2 TYR A 240 6.942 2.690 -8.225 1.00 0.00 H new ATOM 0 HB3 TYR A 240 5.526 3.634 -8.642 1.00 0.00 H new ATOM 0 HD1 TYR A 240 9.054 4.010 -7.459 1.00 0.00 H new ATOM 0 HD2 TYR A 240 5.774 5.816 -9.494 1.00 0.00 H new ATOM 0 HE1 TYR A 240 10.496 5.884 -8.121 1.00 0.00 H new ATOM 0 HE2 TYR A 240 7.217 7.688 -10.160 1.00 0.00 H new ATOM 0 HH TYR A 240 9.231 8.587 -10.082 1.00 0.00 H new ATOM 1290 N LEU A 241 4.001 2.389 -6.107 1.00 0.00 N ATOM 1291 CA LEU A 241 3.212 1.210 -5.790 1.00 0.00 C ATOM 1292 C LEU A 241 2.371 0.828 -6.997 1.00 0.00 C ATOM 1293 O LEU A 241 1.770 1.688 -7.631 1.00 0.00 O ATOM 1294 CB LEU A 241 2.308 1.477 -4.583 1.00 0.00 C ATOM 1295 CG LEU A 241 3.041 1.697 -3.255 1.00 0.00 C ATOM 1296 CD1 LEU A 241 2.384 2.815 -2.457 1.00 0.00 C ATOM 1297 CD2 LEU A 241 3.071 0.410 -2.441 1.00 0.00 C ATOM 0 H LEU A 241 3.450 3.235 -6.256 1.00 0.00 H new ATOM 0 HA LEU A 241 3.884 0.389 -5.539 1.00 0.00 H new ATOM 0 HB2 LEU A 241 1.698 2.356 -4.793 1.00 0.00 H new ATOM 0 HB3 LEU A 241 1.625 0.635 -4.468 1.00 0.00 H new ATOM 0 HG LEU A 241 4.067 1.990 -3.476 1.00 0.00 H new ATOM 0 HD11 LEU A 241 2.920 2.955 -1.518 1.00 0.00 H new ATOM 0 HD12 LEU A 241 2.414 3.740 -3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 241 1.347 2.552 -2.248 1.00 0.00 H new ATOM 0 HD21 LEU A 241 3.595 0.586 -1.502 1.00 0.00 H new ATOM 0 HD22 LEU A 241 2.051 0.088 -2.232 1.00 0.00 H new ATOM 0 HD23 LEU A 241 3.588 -0.366 -3.006 1.00 0.00 H new ATOM 1309 N LYS A 242 2.332 -0.454 -7.322 1.00 0.00 N ATOM 1310 CA LYS A 242 1.564 -0.915 -8.468 1.00 0.00 C ATOM 1311 C LYS A 242 0.305 -1.638 -8.001 1.00 0.00 C ATOM 1312 O LYS A 242 0.374 -2.652 -7.308 1.00 0.00 O ATOM 1313 CB LYS A 242 2.438 -1.817 -9.345 1.00 0.00 C ATOM 1314 CG LYS A 242 1.684 -2.507 -10.476 1.00 0.00 C ATOM 1315 CD LYS A 242 2.345 -2.272 -11.826 1.00 0.00 C ATOM 1316 CE LYS A 242 3.739 -2.876 -11.877 1.00 0.00 C ATOM 1317 NZ LYS A 242 3.713 -4.297 -12.321 1.00 0.00 N ATOM 0 H LYS A 242 2.820 -1.190 -6.812 1.00 0.00 H new ATOM 0 HA LYS A 242 1.251 -0.059 -9.066 1.00 0.00 H new ATOM 0 HB2 LYS A 242 3.244 -1.220 -9.772 1.00 0.00 H new ATOM 0 HB3 LYS A 242 2.903 -2.577 -8.716 1.00 0.00 H new ATOM 0 HG2 LYS A 242 1.634 -3.578 -10.278 1.00 0.00 H new ATOM 0 HG3 LYS A 242 0.658 -2.140 -10.505 1.00 0.00 H new ATOM 0 HD2 LYS A 242 1.730 -2.707 -12.614 1.00 0.00 H new ATOM 0 HD3 LYS A 242 2.404 -1.201 -12.022 1.00 0.00 H new ATOM 0 HE2 LYS A 242 4.362 -2.295 -12.557 1.00 0.00 H new ATOM 0 HE3 LYS A 242 4.198 -2.812 -10.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 4.683 -4.672 -12.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 3.140 -4.857 -11.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 3.298 -4.356 -13.273 1.00 0.00 H new ATOM 1331 N VAL A 243 -0.845 -1.079 -8.366 1.00 0.00 N ATOM 1332 CA VAL A 243 -2.135 -1.629 -7.973 1.00 0.00 C ATOM 1333 C VAL A 243 -3.057 -1.791 -9.182 1.00 0.00 C ATOM 1334 O VAL A 243 -3.003 -1.009 -10.132 1.00 0.00 O ATOM 1335 CB VAL A 243 -2.806 -0.702 -6.925 1.00 0.00 C ATOM 1336 CG1 VAL A 243 -4.237 -1.134 -6.602 1.00 0.00 C ATOM 1337 CG2 VAL A 243 -1.960 -0.624 -5.658 1.00 0.00 C ATOM 0 H VAL A 243 -0.908 -0.237 -8.939 1.00 0.00 H new ATOM 0 HA VAL A 243 -1.965 -2.613 -7.537 1.00 0.00 H new ATOM 0 HB VAL A 243 -2.868 0.293 -7.365 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -4.664 -0.455 -5.864 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -4.839 -1.108 -7.510 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.229 -2.147 -6.201 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -2.447 0.031 -4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -1.853 -1.621 -5.230 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -0.975 -0.226 -5.902 1.00 0.00 H new ATOM 1347 N ALA A 244 -3.921 -2.798 -9.119 1.00 0.00 N ATOM 1348 CA ALA A 244 -4.880 -3.060 -10.181 1.00 0.00 C ATOM 1349 C ALA A 244 -6.295 -3.045 -9.619 1.00 0.00 C ATOM 1350 O ALA A 244 -6.619 -3.812 -8.712 1.00 0.00 O ATOM 1351 CB ALA A 244 -4.585 -4.393 -10.851 1.00 0.00 C ATOM 0 H ALA A 244 -3.975 -3.450 -8.336 1.00 0.00 H new ATOM 0 HA ALA A 244 -4.793 -2.276 -10.933 1.00 0.00 H new ATOM 0 HB1 ALA A 244 -5.313 -4.571 -11.643 1.00 0.00 H new ATOM 0 HB2 ALA A 244 -3.582 -4.372 -11.278 1.00 0.00 H new ATOM 0 HB3 ALA A 244 -4.648 -5.193 -10.113 1.00 0.00 H new ATOM 1357 N LYS A 245 -7.134 -2.161 -10.148 1.00 0.00 N ATOM 1358 CA LYS A 245 -8.509 -2.042 -9.681 1.00 0.00 C ATOM 1359 C LYS A 245 -9.458 -2.891 -10.533 1.00 0.00 C ATOM 1360 O LYS A 245 -9.391 -2.852 -11.761 1.00 0.00 O ATOM 1361 CB LYS A 245 -8.953 -0.576 -9.713 1.00 0.00 C ATOM 1362 CG LYS A 245 -8.787 0.139 -8.379 1.00 0.00 C ATOM 1363 CD LYS A 245 -7.598 1.088 -8.390 1.00 0.00 C ATOM 1364 CE LYS A 245 -7.240 1.548 -6.986 1.00 0.00 C ATOM 1365 NZ LYS A 245 -8.198 2.566 -6.474 1.00 0.00 N ATOM 0 H LYS A 245 -6.886 -1.517 -10.899 1.00 0.00 H new ATOM 0 HA LYS A 245 -8.548 -2.409 -8.655 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -8.378 -0.047 -10.473 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -10.000 -0.528 -10.014 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -9.695 0.697 -8.150 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -8.657 -0.597 -7.586 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -6.739 0.592 -8.842 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -7.828 1.954 -9.010 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -7.229 0.690 -6.314 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -6.233 1.965 -6.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -8.278 2.479 -5.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -7.855 3.518 -6.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -9.131 2.414 -6.907 1.00 0.00 H new