USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 793 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 162 GLN : amide:sc= 0.204 K(o=-0.16,f=-1.3) USER MOD Set 1.2: A 246 CYS SG : rot 109:sc= -0.365! USER MOD Set 2.1: A 201 LYS NZ :NH3+ -167:sc= 0.657 (180deg=0.141!) USER MOD Set 2.2: A 239 CYS SG : rot -105:sc= 0.211 USER MOD Set 3.1: A 226 GLN : amide:sc= -0.415 X(o=-0.37,f=-0.13) USER MOD Set 3.2: A 229 GLN : amide:sc= 0.0484 X(o=-0.37,f=-0.13) USER MOD Set 4.1: A 178 SER OG : rot -160:sc= 1.05 USER MOD Set 4.2: A 186 SER OG : rot -137:sc= 1.03 USER MOD Set 4.3: A 202 HIS : no HD1:sc= 0.119 K(o=2.2,f=0.66) USER MOD Set 5.1: A 180 THR OG1 : rot 180:sc= 0.128 USER MOD Set 5.2: A 181 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 165 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 168 ASN : amide:sc= 0.00207 X(o=0.0021,f=-0.022) USER MOD Single : A 153 LYS NZ :NH3+ -167:sc= 0.923 (180deg=0.383) USER MOD Single : A 157 LYS NZ :NH3+ 132:sc= 0.589 (180deg=-0.189!) USER MOD Single : A 172 THR OG1 : rot -20:sc= -0.0235 USER MOD Single : A 182 LYS NZ :NH3+ 159:sc= -0.116 (180deg=-0.633) USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 SER OG : rot 160:sc= 0 USER MOD Single : A 195 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 196 LYS NZ :NH3+ 165:sc= 0.825 (180deg=0.187) USER MOD Single : A 199 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 203 TYR OH : rot 60:sc= -0.425 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 210 ASN : amide:sc= -0.0905 X(o=-0.09,f=-0.29) USER MOD Single : A 213 TYR OH : rot 180:sc= 0 USER MOD Single : A 214 TYR OH : rot 180:sc= 0 USER MOD Single : A 216 THR OG1 : rot 180:sc= 0.163 USER MOD Single : A 217 THR OG1 : rot 180:sc= 0.0445 USER MOD Single : A 220 GLN : amide:sc= -1.4 K(o=-1.4,f=-0.032) USER MOD Single : A 223 THR OG1 : rot 180:sc= -0.0134 USER MOD Single : A 225 GLN : amide:sc= 0.199 X(o=0.2,f=-0.002) USER MOD Single : A 230 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 231 TYR OH : rot 130:sc= -0.185 USER MOD Single : A 232 SER OG : rot 86:sc= 1.28 USER MOD Single : A 240 CYS SG : rot -50:sc= -0.315 USER MOD Single : A 247 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 248 LYS NZ :NH3+ -133:sc= -0.188 (180deg=-1.28) USER MOD ----------------------------------------------------------------- ATOM 46 N PHE A 151 7.673 2.683 -0.704 1.00 0.00 N ATOM 47 CA PHE A 151 6.710 3.307 0.141 1.00 0.00 C ATOM 48 C PHE A 151 6.879 2.879 1.548 1.00 0.00 C ATOM 49 O PHE A 151 6.019 3.148 2.365 1.00 0.00 O ATOM 50 CB PHE A 151 5.293 3.077 -0.324 1.00 0.00 C ATOM 51 CG PHE A 151 4.949 3.838 -1.540 1.00 0.00 C ATOM 52 CD1 PHE A 151 4.931 5.218 -1.512 1.00 0.00 C ATOM 53 CD2 PHE A 151 4.622 3.190 -2.701 1.00 0.00 C ATOM 54 CE1 PHE A 151 4.595 5.931 -2.633 1.00 0.00 C ATOM 55 CE2 PHE A 151 4.286 3.900 -3.829 1.00 0.00 C ATOM 56 CZ PHE A 151 4.275 5.270 -3.792 1.00 0.00 C ATOM 0 HA PHE A 151 6.892 4.380 0.081 1.00 0.00 H new ATOM 0 HB2 PHE A 151 5.149 2.014 -0.516 1.00 0.00 H new ATOM 0 HB3 PHE A 151 4.606 3.353 0.476 1.00 0.00 H new ATOM 0 HD1 PHE A 151 5.183 5.739 -0.600 1.00 0.00 H new ATOM 0 HD2 PHE A 151 4.628 2.110 -2.731 1.00 0.00 H new ATOM 0 HE1 PHE A 151 4.582 7.011 -2.604 1.00 0.00 H new ATOM 0 HE2 PHE A 151 4.032 3.380 -4.741 1.00 0.00 H new ATOM 0 HZ PHE A 151 4.014 5.831 -4.677 1.00 0.00 H new ATOM 66 N GLY A 152 8.024 2.267 1.852 1.00 0.00 N ATOM 67 CA GLY A 152 8.176 1.550 3.088 1.00 0.00 C ATOM 68 C GLY A 152 8.408 2.458 4.276 1.00 0.00 C ATOM 69 O GLY A 152 7.812 3.503 4.326 1.00 0.00 O ATOM 0 H GLY A 152 8.849 2.262 1.252 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.283 0.950 3.265 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.013 0.857 2.999 1.00 0.00 H new ATOM 73 N LYS A 153 9.289 2.100 5.180 1.00 0.00 N ATOM 74 CA LYS A 153 9.336 2.696 6.538 1.00 0.00 C ATOM 75 C LYS A 153 9.267 4.226 6.592 1.00 0.00 C ATOM 76 O LYS A 153 10.265 4.936 6.428 1.00 0.00 O ATOM 77 CB LYS A 153 10.558 2.204 7.312 1.00 0.00 C ATOM 78 CG LYS A 153 10.565 2.614 8.784 1.00 0.00 C ATOM 79 CD LYS A 153 11.791 2.089 9.524 1.00 0.00 C ATOM 80 CE LYS A 153 11.935 0.590 9.349 1.00 0.00 C ATOM 81 NZ LYS A 153 12.959 0.012 10.231 1.00 0.00 N ATOM 0 H LYS A 153 10.002 1.390 5.017 1.00 0.00 H new ATOM 0 HA LYS A 153 8.418 2.347 7.012 1.00 0.00 H new ATOM 0 HB2 LYS A 153 10.603 1.117 7.248 1.00 0.00 H new ATOM 0 HB3 LYS A 153 11.458 2.589 6.833 1.00 0.00 H new ATOM 0 HG2 LYS A 153 10.537 3.701 8.856 1.00 0.00 H new ATOM 0 HG3 LYS A 153 9.663 2.239 9.268 1.00 0.00 H new ATOM 0 HD2 LYS A 153 12.685 2.589 9.152 1.00 0.00 H new ATOM 0 HD3 LYS A 153 11.709 2.328 10.584 1.00 0.00 H new ATOM 0 HE2 LYS A 153 10.977 0.111 9.549 1.00 0.00 H new ATOM 0 HE3 LYS A 153 12.190 0.372 8.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 13.174 -0.958 9.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 13.823 0.589 10.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 12.606 -0.004 11.209 1.00 0.00 H new ATOM 95 N LEU A 154 8.054 4.709 6.755 1.00 0.00 N ATOM 96 CA LEU A 154 7.787 6.109 6.975 1.00 0.00 C ATOM 97 C LEU A 154 6.693 6.209 7.994 1.00 0.00 C ATOM 98 O LEU A 154 6.089 5.188 8.363 1.00 0.00 O ATOM 99 CB LEU A 154 7.422 6.901 5.679 1.00 0.00 C ATOM 100 CG LEU A 154 5.997 6.805 5.089 1.00 0.00 C ATOM 101 CD1 LEU A 154 5.966 7.418 3.727 1.00 0.00 C ATOM 102 CD2 LEU A 154 5.474 5.414 5.037 1.00 0.00 C ATOM 0 H LEU A 154 7.215 4.129 6.738 1.00 0.00 H new ATOM 0 HA LEU A 154 8.705 6.577 7.331 1.00 0.00 H new ATOM 0 HB2 LEU A 154 7.621 7.954 5.876 1.00 0.00 H new ATOM 0 HB3 LEU A 154 8.117 6.586 4.900 1.00 0.00 H new ATOM 0 HG LEU A 154 5.342 7.357 5.763 1.00 0.00 H new ATOM 0 HD11 LEU A 154 4.958 7.346 3.318 1.00 0.00 H new ATOM 0 HD12 LEU A 154 6.257 8.466 3.793 1.00 0.00 H new ATOM 0 HD13 LEU A 154 6.661 6.889 3.074 1.00 0.00 H new ATOM 0 HD21 LEU A 154 4.470 5.418 4.613 1.00 0.00 H new ATOM 0 HD22 LEU A 154 6.128 4.802 4.415 1.00 0.00 H new ATOM 0 HD23 LEU A 154 5.440 5.000 6.045 1.00 0.00 H new ATOM 114 N GLY A 155 6.451 7.376 8.449 1.00 0.00 N ATOM 115 CA GLY A 155 5.459 7.561 9.443 1.00 0.00 C ATOM 116 C GLY A 155 4.128 7.885 8.831 1.00 0.00 C ATOM 117 O GLY A 155 4.039 8.186 7.623 1.00 0.00 O ATOM 0 H GLY A 155 6.928 8.227 8.149 1.00 0.00 H new ATOM 0 HA2 GLY A 155 5.374 6.658 10.047 1.00 0.00 H new ATOM 0 HA3 GLY A 155 5.759 8.366 10.114 1.00 0.00 H new ATOM 121 N ARG A 156 3.114 7.840 9.657 1.00 0.00 N ATOM 122 CA ARG A 156 1.725 8.118 9.305 1.00 0.00 C ATOM 123 C ARG A 156 1.551 9.376 8.417 1.00 0.00 C ATOM 124 O ARG A 156 0.934 9.308 7.364 1.00 0.00 O ATOM 125 CB ARG A 156 0.907 8.272 10.600 1.00 0.00 C ATOM 126 CG ARG A 156 1.527 9.278 11.564 1.00 0.00 C ATOM 127 CD ARG A 156 0.702 9.522 12.791 1.00 0.00 C ATOM 128 NE ARG A 156 1.309 10.575 13.609 1.00 0.00 N ATOM 129 CZ ARG A 156 0.653 11.564 14.221 1.00 0.00 C ATOM 130 NH1 ARG A 156 -0.675 11.624 14.176 1.00 0.00 N ATOM 131 NH2 ARG A 156 1.331 12.497 14.878 1.00 0.00 N ATOM 0 H ARG A 156 3.229 7.598 10.641 1.00 0.00 H new ATOM 0 HA ARG A 156 1.366 7.277 8.711 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -0.106 8.588 10.351 1.00 0.00 H new ATOM 0 HB3 ARG A 156 0.826 7.303 11.093 1.00 0.00 H new ATOM 0 HG2 ARG A 156 2.512 8.921 11.864 1.00 0.00 H new ATOM 0 HG3 ARG A 156 1.676 10.224 11.043 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -0.310 9.811 12.506 1.00 0.00 H new ATOM 0 HD3 ARG A 156 0.620 8.603 13.371 1.00 0.00 H new ATOM 0 HE ARG A 156 2.323 10.550 13.721 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -1.201 10.911 13.671 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -1.167 12.383 14.647 1.00 0.00 H new ATOM 0 HH21 ARG A 156 2.350 12.457 14.914 1.00 0.00 H new ATOM 0 HH22 ARG A 156 0.833 13.254 15.347 1.00 0.00 H new ATOM 145 N LYS A 157 2.161 10.489 8.807 1.00 0.00 N ATOM 146 CA LYS A 157 1.944 11.755 8.136 1.00 0.00 C ATOM 147 C LYS A 157 2.754 11.896 6.878 1.00 0.00 C ATOM 148 O LYS A 157 2.410 12.713 6.007 1.00 0.00 O ATOM 149 CB LYS A 157 2.160 12.934 9.085 1.00 0.00 C ATOM 150 CG LYS A 157 1.147 12.996 10.221 1.00 0.00 C ATOM 151 CD LYS A 157 -0.272 13.167 9.687 1.00 0.00 C ATOM 152 CE LYS A 157 -1.309 13.196 10.797 1.00 0.00 C ATOM 153 NZ LYS A 157 -2.685 13.216 10.248 1.00 0.00 N ATOM 0 H LYS A 157 2.813 10.535 9.590 1.00 0.00 H new ATOM 0 HA LYS A 157 0.899 11.766 7.825 1.00 0.00 H new ATOM 0 HB2 LYS A 157 3.163 12.871 9.507 1.00 0.00 H new ATOM 0 HB3 LYS A 157 2.112 13.862 8.515 1.00 0.00 H new ATOM 0 HG2 LYS A 157 1.207 12.084 10.815 1.00 0.00 H new ATOM 0 HG3 LYS A 157 1.391 13.826 10.884 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -0.332 14.092 9.113 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -0.500 12.351 9.002 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -1.183 12.323 11.438 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -1.152 14.075 11.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -3.264 12.502 10.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -3.103 14.157 10.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -2.656 13.002 9.231 1.00 0.00 H new ATOM 167 N ASP A 158 3.812 11.112 6.752 1.00 0.00 N ATOM 168 CA ASP A 158 4.599 11.146 5.545 1.00 0.00 C ATOM 169 C ASP A 158 3.815 10.375 4.489 1.00 0.00 C ATOM 170 O ASP A 158 3.765 10.748 3.333 1.00 0.00 O ATOM 171 CB ASP A 158 5.971 10.504 5.772 1.00 0.00 C ATOM 172 CG ASP A 158 7.009 10.888 4.724 1.00 0.00 C ATOM 173 OD1 ASP A 158 6.684 11.028 3.540 1.00 0.00 O ATOM 174 OD2 ASP A 158 8.190 11.111 5.086 1.00 0.00 O ATOM 0 H ASP A 158 4.137 10.456 7.462 1.00 0.00 H new ATOM 0 HA ASP A 158 4.777 12.173 5.228 1.00 0.00 H new ATOM 0 HB2 ASP A 158 6.338 10.792 6.757 1.00 0.00 H new ATOM 0 HB3 ASP A 158 5.858 9.420 5.778 1.00 0.00 H new ATOM 179 N ALA A 159 3.149 9.320 4.935 1.00 0.00 N ATOM 180 CA ALA A 159 2.297 8.516 4.077 1.00 0.00 C ATOM 181 C ALA A 159 1.050 9.306 3.662 1.00 0.00 C ATOM 182 O ALA A 159 0.736 9.404 2.474 1.00 0.00 O ATOM 183 CB ALA A 159 1.897 7.226 4.786 1.00 0.00 C ATOM 0 H ALA A 159 3.185 8.999 5.902 1.00 0.00 H new ATOM 0 HA ALA A 159 2.857 8.260 3.177 1.00 0.00 H new ATOM 0 HB1 ALA A 159 1.258 6.634 4.131 1.00 0.00 H new ATOM 0 HB2 ALA A 159 2.792 6.655 5.034 1.00 0.00 H new ATOM 0 HB3 ALA A 159 1.355 7.467 5.700 1.00 0.00 H new ATOM 189 N GLU A 160 0.357 9.873 4.654 1.00 0.00 N ATOM 190 CA GLU A 160 -0.852 10.669 4.434 1.00 0.00 C ATOM 191 C GLU A 160 -0.661 11.767 3.391 1.00 0.00 C ATOM 192 O GLU A 160 -1.446 11.867 2.449 1.00 0.00 O ATOM 193 CB GLU A 160 -1.399 11.258 5.753 1.00 0.00 C ATOM 194 CG GLU A 160 -2.012 10.227 6.707 1.00 0.00 C ATOM 195 CD GLU A 160 -2.484 10.817 8.025 1.00 0.00 C ATOM 196 OE1 GLU A 160 -3.389 11.678 8.029 1.00 0.00 O ATOM 197 OE2 GLU A 160 -1.978 10.409 9.093 1.00 0.00 O ATOM 0 H GLU A 160 0.621 9.792 5.636 1.00 0.00 H new ATOM 0 HA GLU A 160 -1.594 9.977 4.035 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -0.589 11.774 6.269 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -2.154 12.007 5.515 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -2.855 9.745 6.213 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -1.275 9.450 6.910 1.00 0.00 H new ATOM 204 N ARG A 161 0.409 12.533 3.522 1.00 0.00 N ATOM 205 CA ARG A 161 0.674 13.651 2.607 1.00 0.00 C ATOM 206 C ARG A 161 0.872 13.166 1.161 1.00 0.00 C ATOM 207 O ARG A 161 0.534 13.863 0.236 1.00 0.00 O ATOM 208 CB ARG A 161 1.898 14.465 3.057 1.00 0.00 C ATOM 209 CG ARG A 161 3.203 13.708 2.953 1.00 0.00 C ATOM 210 CD ARG A 161 4.381 14.537 3.367 1.00 0.00 C ATOM 211 NE ARG A 161 5.628 13.778 3.262 1.00 0.00 N ATOM 212 CZ ARG A 161 6.839 14.312 3.093 1.00 0.00 C ATOM 213 NH1 ARG A 161 6.983 15.618 2.913 1.00 0.00 N ATOM 214 NH2 ARG A 161 7.894 13.530 3.085 1.00 0.00 N ATOM 0 H ARG A 161 1.113 12.408 4.250 1.00 0.00 H new ATOM 0 HA ARG A 161 -0.204 14.296 2.636 1.00 0.00 H new ATOM 0 HB2 ARG A 161 1.964 15.370 2.453 1.00 0.00 H new ATOM 0 HB3 ARG A 161 1.753 14.782 4.090 1.00 0.00 H new ATOM 0 HG2 ARG A 161 3.153 12.816 3.578 1.00 0.00 H new ATOM 0 HG3 ARG A 161 3.343 13.371 1.926 1.00 0.00 H new ATOM 0 HD2 ARG A 161 4.440 15.427 2.740 1.00 0.00 H new ATOM 0 HD3 ARG A 161 4.246 14.878 4.393 1.00 0.00 H new ATOM 0 HE ARG A 161 5.566 12.762 3.323 1.00 0.00 H new ATOM 0 HH11 ARG A 161 6.163 16.225 2.903 1.00 0.00 H new ATOM 0 HH12 ARG A 161 7.914 16.016 2.785 1.00 0.00 H new ATOM 0 HH21 ARG A 161 7.784 12.523 3.207 1.00 0.00 H new ATOM 0 HH22 ARG A 161 8.824 13.929 2.956 1.00 0.00 H new ATOM 228 N GLN A 162 1.366 11.943 0.997 1.00 0.00 N ATOM 229 CA GLN A 162 1.650 11.393 -0.329 1.00 0.00 C ATOM 230 C GLN A 162 0.377 10.975 -1.018 1.00 0.00 C ATOM 231 O GLN A 162 0.288 10.966 -2.246 1.00 0.00 O ATOM 232 CB GLN A 162 2.578 10.175 -0.232 1.00 0.00 C ATOM 233 CG GLN A 162 3.999 10.475 0.200 1.00 0.00 C ATOM 234 CD GLN A 162 4.779 11.330 -0.790 1.00 0.00 C ATOM 235 OE1 GLN A 162 5.663 12.088 -0.398 1.00 0.00 O ATOM 236 NE2 GLN A 162 4.499 11.198 -2.066 1.00 0.00 N ATOM 0 H GLN A 162 1.580 11.310 1.768 1.00 0.00 H new ATOM 0 HA GLN A 162 2.140 12.177 -0.906 1.00 0.00 H new ATOM 0 HB2 GLN A 162 2.145 9.464 0.471 1.00 0.00 H new ATOM 0 HB3 GLN A 162 2.608 9.683 -1.204 1.00 0.00 H new ATOM 0 HG2 GLN A 162 3.975 10.983 1.164 1.00 0.00 H new ATOM 0 HG3 GLN A 162 4.529 9.534 0.349 1.00 0.00 H new ATOM 0 HE21 GLN A 162 3.760 10.561 -2.363 1.00 0.00 H new ATOM 0 HE22 GLN A 162 5.021 11.732 -2.761 1.00 0.00 H new ATOM 245 N LEU A 163 -0.590 10.601 -0.235 1.00 0.00 N ATOM 246 CA LEU A 163 -1.840 10.142 -0.747 1.00 0.00 C ATOM 247 C LEU A 163 -2.776 11.301 -0.990 1.00 0.00 C ATOM 248 O LEU A 163 -3.340 11.447 -2.073 1.00 0.00 O ATOM 249 CB LEU A 163 -2.450 9.154 0.242 1.00 0.00 C ATOM 250 CG LEU A 163 -1.620 7.897 0.500 1.00 0.00 C ATOM 251 CD1 LEU A 163 -2.190 7.103 1.647 1.00 0.00 C ATOM 252 CD2 LEU A 163 -1.551 7.038 -0.748 1.00 0.00 C ATOM 0 H LEU A 163 -0.530 10.607 0.783 1.00 0.00 H new ATOM 0 HA LEU A 163 -1.678 9.643 -1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -2.610 9.666 1.191 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -3.431 8.853 -0.127 1.00 0.00 H new ATOM 0 HG LEU A 163 -0.610 8.209 0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -1.582 6.213 1.811 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -2.189 7.715 2.549 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -3.212 6.806 1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -0.956 6.148 -0.545 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -2.558 6.742 -1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -1.089 7.606 -1.556 1.00 0.00 H new ATOM 264 N LEU A 164 -2.874 12.153 0.001 1.00 0.00 N ATOM 265 CA LEU A 164 -3.838 13.239 0.017 1.00 0.00 C ATOM 266 C LEU A 164 -3.354 14.469 -0.764 1.00 0.00 C ATOM 267 O LEU A 164 -4.091 15.464 -0.878 1.00 0.00 O ATOM 268 CB LEU A 164 -4.143 13.613 1.474 1.00 0.00 C ATOM 269 CG LEU A 164 -4.553 12.442 2.389 1.00 0.00 C ATOM 270 CD1 LEU A 164 -4.774 12.903 3.806 1.00 0.00 C ATOM 271 CD2 LEU A 164 -5.778 11.721 1.862 1.00 0.00 C ATOM 0 H LEU A 164 -2.282 12.116 0.831 1.00 0.00 H new ATOM 0 HA LEU A 164 -4.744 12.894 -0.482 1.00 0.00 H new ATOM 0 HB2 LEU A 164 -3.261 14.092 1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 164 -4.943 14.353 1.481 1.00 0.00 H new ATOM 0 HG LEU A 164 -3.725 11.733 2.390 1.00 0.00 H new ATOM 0 HD11 LEU A 164 -5.062 12.053 4.424 1.00 0.00 H new ATOM 0 HD12 LEU A 164 -3.854 13.339 4.194 1.00 0.00 H new ATOM 0 HD13 LEU A 164 -5.567 13.651 3.826 1.00 0.00 H new ATOM 0 HD21 LEU A 164 -6.036 10.902 2.534 1.00 0.00 H new ATOM 0 HD22 LEU A 164 -6.613 12.419 1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 164 -5.567 11.323 0.870 1.00 0.00 H new ATOM 283 N SER A 165 -2.132 14.412 -1.274 1.00 0.00 N ATOM 284 CA SER A 165 -1.560 15.490 -2.058 1.00 0.00 C ATOM 285 C SER A 165 -2.367 15.725 -3.334 1.00 0.00 C ATOM 286 O SER A 165 -2.702 14.755 -4.054 1.00 0.00 O ATOM 287 CB SER A 165 -0.112 15.155 -2.404 1.00 0.00 C ATOM 288 OG SER A 165 -0.026 13.874 -3.017 1.00 0.00 O ATOM 0 H SER A 165 -1.510 13.613 -1.154 1.00 0.00 H new ATOM 0 HA SER A 165 -1.590 16.406 -1.468 1.00 0.00 H new ATOM 0 HB2 SER A 165 0.292 15.913 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 165 0.497 15.173 -1.500 1.00 0.00 H new ATOM 0 HG SER A 165 0.909 13.677 -3.233 1.00 0.00 H new ATOM 294 N PHE A 166 -2.688 16.986 -3.607 1.00 0.00 N ATOM 295 CA PHE A 166 -3.442 17.347 -4.798 1.00 0.00 C ATOM 296 C PHE A 166 -2.725 16.908 -6.069 1.00 0.00 C ATOM 297 O PHE A 166 -1.489 16.845 -6.120 1.00 0.00 O ATOM 298 CB PHE A 166 -3.825 18.844 -4.826 1.00 0.00 C ATOM 299 CG PHE A 166 -2.679 19.823 -4.705 1.00 0.00 C ATOM 300 CD1 PHE A 166 -2.033 20.299 -5.831 1.00 0.00 C ATOM 301 CD2 PHE A 166 -2.272 20.287 -3.463 1.00 0.00 C ATOM 302 CE1 PHE A 166 -1.004 21.210 -5.726 1.00 0.00 C ATOM 303 CE2 PHE A 166 -1.240 21.195 -3.349 1.00 0.00 C ATOM 304 CZ PHE A 166 -0.605 21.660 -4.481 1.00 0.00 C ATOM 0 H PHE A 166 -2.435 17.777 -3.015 1.00 0.00 H new ATOM 0 HA PHE A 166 -4.383 16.798 -4.755 1.00 0.00 H new ATOM 0 HB2 PHE A 166 -4.353 19.046 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE A 166 -4.527 19.034 -4.014 1.00 0.00 H new ATOM 0 HD1 PHE A 166 -2.339 19.952 -6.807 1.00 0.00 H new ATOM 0 HD2 PHE A 166 -2.770 19.932 -2.573 1.00 0.00 H new ATOM 0 HE1 PHE A 166 -0.510 21.572 -6.615 1.00 0.00 H new ATOM 0 HE2 PHE A 166 -0.930 21.541 -2.374 1.00 0.00 H new ATOM 0 HZ PHE A 166 0.201 22.373 -4.396 1.00 0.00 H new ATOM 314 N GLY A 167 -3.493 16.578 -7.061 1.00 0.00 N ATOM 315 CA GLY A 167 -2.958 16.035 -8.279 1.00 0.00 C ATOM 316 C GLY A 167 -3.300 14.569 -8.367 1.00 0.00 C ATOM 317 O GLY A 167 -3.350 13.986 -9.447 1.00 0.00 O ATOM 0 H GLY A 167 -4.508 16.676 -7.053 1.00 0.00 H new ATOM 0 HA2 GLY A 167 -3.367 16.567 -9.138 1.00 0.00 H new ATOM 0 HA3 GLY A 167 -1.877 16.170 -8.306 1.00 0.00 H new ATOM 321 N ASN A 168 -3.553 13.975 -7.216 1.00 0.00 N ATOM 322 CA ASN A 168 -3.962 12.588 -7.137 1.00 0.00 C ATOM 323 C ASN A 168 -5.451 12.574 -6.893 1.00 0.00 C ATOM 324 O ASN A 168 -5.941 13.405 -6.132 1.00 0.00 O ATOM 325 CB ASN A 168 -3.310 11.858 -5.930 1.00 0.00 C ATOM 326 CG ASN A 168 -1.795 11.837 -5.903 1.00 0.00 C ATOM 327 OD1 ASN A 168 -1.128 11.861 -6.936 1.00 0.00 O ATOM 328 ND2 ASN A 168 -1.241 11.768 -4.715 1.00 0.00 N ATOM 0 H ASN A 168 -3.481 14.441 -6.311 1.00 0.00 H new ATOM 0 HA ASN A 168 -3.665 12.089 -8.059 1.00 0.00 H new ATOM 0 HB2 ASN A 168 -3.663 12.329 -5.013 1.00 0.00 H new ATOM 0 HB3 ASN A 168 -3.668 10.828 -5.918 1.00 0.00 H new ATOM 0 HD21 ASN A 168 -0.225 11.732 -4.627 1.00 0.00 H new ATOM 0 HD22 ASN A 168 -1.826 11.750 -3.880 1.00 0.00 H new ATOM 335 N PRO A 169 -6.209 11.699 -7.544 1.00 0.00 N ATOM 336 CA PRO A 169 -7.617 11.500 -7.212 1.00 0.00 C ATOM 337 C PRO A 169 -7.725 10.497 -6.064 1.00 0.00 C ATOM 338 O PRO A 169 -6.723 9.871 -5.703 1.00 0.00 O ATOM 339 CB PRO A 169 -8.193 10.888 -8.483 1.00 0.00 C ATOM 340 CG PRO A 169 -7.048 10.145 -9.099 1.00 0.00 C ATOM 341 CD PRO A 169 -5.784 10.856 -8.675 1.00 0.00 C ATOM 0 HA PRO A 169 -8.128 12.413 -6.905 1.00 0.00 H new ATOM 0 HB2 PRO A 169 -9.024 10.220 -8.259 1.00 0.00 H new ATOM 0 HB3 PRO A 169 -8.574 11.657 -9.155 1.00 0.00 H new ATOM 0 HG2 PRO A 169 -7.037 9.107 -8.766 1.00 0.00 H new ATOM 0 HG3 PRO A 169 -7.137 10.130 -10.185 1.00 0.00 H new ATOM 0 HD2 PRO A 169 -5.010 10.149 -8.377 1.00 0.00 H new ATOM 0 HD3 PRO A 169 -5.372 11.456 -9.487 1.00 0.00 H new ATOM 349 N ARG A 170 -8.893 10.344 -5.477 1.00 0.00 N ATOM 350 CA ARG A 170 -9.059 9.357 -4.436 1.00 0.00 C ATOM 351 C ARG A 170 -8.833 7.941 -4.973 1.00 0.00 C ATOM 352 O ARG A 170 -9.026 7.689 -6.163 1.00 0.00 O ATOM 353 CB ARG A 170 -10.389 9.520 -3.655 1.00 0.00 C ATOM 354 CG ARG A 170 -11.681 9.724 -4.473 1.00 0.00 C ATOM 355 CD ARG A 170 -11.978 8.589 -5.434 1.00 0.00 C ATOM 356 NE ARG A 170 -13.339 8.657 -5.944 1.00 0.00 N ATOM 357 CZ ARG A 170 -13.874 7.822 -6.835 1.00 0.00 C ATOM 358 NH1 ARG A 170 -13.101 6.989 -7.529 1.00 0.00 N ATOM 359 NH2 ARG A 170 -15.174 7.870 -7.078 1.00 0.00 N ATOM 0 H ARG A 170 -9.730 10.883 -5.700 1.00 0.00 H new ATOM 0 HA ARG A 170 -8.281 9.535 -3.693 1.00 0.00 H new ATOM 0 HB2 ARG A 170 -10.523 8.636 -3.032 1.00 0.00 H new ATOM 0 HB3 ARG A 170 -10.281 10.370 -2.982 1.00 0.00 H new ATOM 0 HG2 ARG A 170 -12.521 9.837 -3.787 1.00 0.00 H new ATOM 0 HG3 ARG A 170 -11.601 10.654 -5.036 1.00 0.00 H new ATOM 0 HD2 ARG A 170 -11.275 8.624 -6.267 1.00 0.00 H new ATOM 0 HD3 ARG A 170 -11.826 7.635 -4.929 1.00 0.00 H new ATOM 0 HE ARG A 170 -13.934 9.406 -5.590 1.00 0.00 H new ATOM 0 HH11 ARG A 170 -12.092 6.987 -7.381 1.00 0.00 H new ATOM 0 HH12 ARG A 170 -13.518 6.353 -8.209 1.00 0.00 H new ATOM 0 HH21 ARG A 170 -15.761 8.543 -6.585 1.00 0.00 H new ATOM 0 HH22 ARG A 170 -15.589 7.234 -7.759 1.00 0.00 H new ATOM 373 N GLY A 171 -8.426 7.044 -4.114 1.00 0.00 N ATOM 374 CA GLY A 171 -8.076 5.715 -4.551 1.00 0.00 C ATOM 375 C GLY A 171 -6.573 5.582 -4.763 1.00 0.00 C ATOM 376 O GLY A 171 -6.108 4.682 -5.476 1.00 0.00 O ATOM 0 H GLY A 171 -8.328 7.206 -3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 171 -8.407 4.987 -3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 171 -8.599 5.485 -5.480 1.00 0.00 H new ATOM 380 N THR A 172 -5.823 6.519 -4.187 1.00 0.00 N ATOM 381 CA THR A 172 -4.368 6.498 -4.234 1.00 0.00 C ATOM 382 C THR A 172 -3.886 5.477 -3.198 1.00 0.00 C ATOM 383 O THR A 172 -4.507 5.355 -2.141 1.00 0.00 O ATOM 384 CB THR A 172 -3.808 7.884 -3.826 1.00 0.00 C ATOM 385 OG1 THR A 172 -4.628 8.921 -4.372 1.00 0.00 O ATOM 386 CG2 THR A 172 -2.378 8.075 -4.334 1.00 0.00 C ATOM 0 H THR A 172 -6.209 7.312 -3.676 1.00 0.00 H new ATOM 0 HA THR A 172 -4.033 6.247 -5.240 1.00 0.00 H new ATOM 0 HB THR A 172 -3.808 7.934 -2.737 1.00 0.00 H new ATOM 0 HG1 THR A 172 -5.147 8.566 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 172 -2.013 9.057 -4.032 1.00 0.00 H new ATOM 0 HG22 THR A 172 -1.735 7.303 -3.911 1.00 0.00 H new ATOM 0 HG23 THR A 172 -2.365 8.002 -5.421 1.00 0.00 H new ATOM 394 N PHE A 173 -2.828 4.751 -3.475 1.00 0.00 N ATOM 395 CA PHE A 173 -2.341 3.799 -2.501 1.00 0.00 C ATOM 396 C PHE A 173 -0.831 3.811 -2.394 1.00 0.00 C ATOM 397 O PHE A 173 -0.120 4.268 -3.316 1.00 0.00 O ATOM 398 CB PHE A 173 -2.825 2.375 -2.817 1.00 0.00 C ATOM 399 CG PHE A 173 -2.192 1.720 -4.036 1.00 0.00 C ATOM 400 CD1 PHE A 173 -2.671 1.967 -5.307 1.00 0.00 C ATOM 401 CD2 PHE A 173 -1.124 0.837 -3.891 1.00 0.00 C ATOM 402 CE1 PHE A 173 -2.103 1.355 -6.411 1.00 0.00 C ATOM 403 CE2 PHE A 173 -0.553 0.226 -4.987 1.00 0.00 C ATOM 404 CZ PHE A 173 -1.043 0.485 -6.250 1.00 0.00 C ATOM 0 H PHE A 173 -2.298 4.797 -4.345 1.00 0.00 H new ATOM 0 HA PHE A 173 -2.752 4.109 -1.540 1.00 0.00 H new ATOM 0 HB2 PHE A 173 -2.634 1.745 -1.948 1.00 0.00 H new ATOM 0 HB3 PHE A 173 -3.905 2.401 -2.961 1.00 0.00 H new ATOM 0 HD1 PHE A 173 -3.500 2.646 -5.442 1.00 0.00 H new ATOM 0 HD2 PHE A 173 -0.737 0.628 -2.904 1.00 0.00 H new ATOM 0 HE1 PHE A 173 -2.489 1.558 -7.399 1.00 0.00 H new ATOM 0 HE2 PHE A 173 0.276 -0.454 -4.857 1.00 0.00 H new ATOM 0 HZ PHE A 173 -0.599 0.008 -7.111 1.00 0.00 H new ATOM 414 N LEU A 174 -0.364 3.332 -1.267 1.00 0.00 N ATOM 415 CA LEU A 174 1.023 3.104 -1.005 1.00 0.00 C ATOM 416 C LEU A 174 1.114 2.000 0.031 1.00 0.00 C ATOM 417 O LEU A 174 0.144 1.736 0.737 1.00 0.00 O ATOM 418 CB LEU A 174 1.752 4.411 -0.559 1.00 0.00 C ATOM 419 CG LEU A 174 1.405 5.068 0.799 1.00 0.00 C ATOM 420 CD1 LEU A 174 2.063 4.351 1.982 1.00 0.00 C ATOM 421 CD2 LEU A 174 1.804 6.530 0.788 1.00 0.00 C ATOM 0 H LEU A 174 -0.967 3.083 -0.483 1.00 0.00 H new ATOM 0 HA LEU A 174 1.536 2.793 -1.915 1.00 0.00 H new ATOM 0 HB2 LEU A 174 2.821 4.199 -0.552 1.00 0.00 H new ATOM 0 HB3 LEU A 174 1.580 5.158 -1.334 1.00 0.00 H new ATOM 0 HG LEU A 174 0.326 4.983 0.931 1.00 0.00 H new ATOM 0 HD11 LEU A 174 1.787 4.852 2.910 1.00 0.00 H new ATOM 0 HD12 LEU A 174 1.724 3.315 2.014 1.00 0.00 H new ATOM 0 HD13 LEU A 174 3.146 4.375 1.865 1.00 0.00 H new ATOM 0 HD21 LEU A 174 1.555 6.982 1.748 1.00 0.00 H new ATOM 0 HD22 LEU A 174 2.877 6.613 0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 174 1.267 7.048 -0.007 1.00 0.00 H new ATOM 433 N ILE A 175 2.232 1.359 0.123 1.00 0.00 N ATOM 434 CA ILE A 175 2.415 0.284 1.074 1.00 0.00 C ATOM 435 C ILE A 175 3.610 0.579 1.932 1.00 0.00 C ATOM 436 O ILE A 175 4.727 0.585 1.441 1.00 0.00 O ATOM 437 CB ILE A 175 2.593 -1.095 0.371 1.00 0.00 C ATOM 438 CG1 ILE A 175 1.310 -1.481 -0.361 1.00 0.00 C ATOM 439 CG2 ILE A 175 2.992 -2.182 1.364 1.00 0.00 C ATOM 440 CD1 ILE A 175 1.362 -2.828 -1.032 1.00 0.00 C ATOM 0 H ILE A 175 3.051 1.556 -0.453 1.00 0.00 H new ATOM 0 HA ILE A 175 1.517 0.222 1.689 1.00 0.00 H new ATOM 0 HB ILE A 175 3.401 -1.001 -0.355 1.00 0.00 H new ATOM 0 HG12 ILE A 175 0.484 -1.474 0.350 1.00 0.00 H new ATOM 0 HG13 ILE A 175 1.091 -0.722 -1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 175 3.107 -3.130 0.839 1.00 0.00 H new ATOM 0 HG22 ILE A 175 3.936 -1.913 1.838 1.00 0.00 H new ATOM 0 HG23 ILE A 175 2.218 -2.281 2.125 1.00 0.00 H new ATOM 0 HD11 ILE A 175 0.412 -3.024 -1.528 1.00 0.00 H new ATOM 0 HD12 ILE A 175 2.165 -2.836 -1.769 1.00 0.00 H new ATOM 0 HD13 ILE A 175 1.547 -3.600 -0.285 1.00 0.00 H new ATOM 452 N ARG A 176 3.388 0.830 3.193 1.00 0.00 N ATOM 453 CA ARG A 176 4.495 1.161 4.049 1.00 0.00 C ATOM 454 C ARG A 176 4.878 -0.025 4.899 1.00 0.00 C ATOM 455 O ARG A 176 4.098 -0.978 5.054 1.00 0.00 O ATOM 456 CB ARG A 176 4.167 2.361 4.940 1.00 0.00 C ATOM 457 CG ARG A 176 3.315 2.048 6.141 1.00 0.00 C ATOM 458 CD ARG A 176 2.685 3.293 6.715 1.00 0.00 C ATOM 459 NE ARG A 176 1.914 3.010 7.932 1.00 0.00 N ATOM 460 CZ ARG A 176 0.718 3.537 8.229 1.00 0.00 C ATOM 461 NH1 ARG A 176 -0.002 4.154 7.287 1.00 0.00 N ATOM 462 NH2 ARG A 176 0.205 3.374 9.446 1.00 0.00 N ATOM 0 H ARG A 176 2.473 0.813 3.644 1.00 0.00 H new ATOM 0 HA ARG A 176 5.339 1.429 3.413 1.00 0.00 H new ATOM 0 HB2 ARG A 176 5.101 2.806 5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 176 3.657 3.113 4.338 1.00 0.00 H new ATOM 0 HG2 ARG A 176 2.534 1.341 5.860 1.00 0.00 H new ATOM 0 HG3 ARG A 176 3.924 1.563 6.904 1.00 0.00 H new ATOM 0 HD2 ARG A 176 3.463 4.022 6.941 1.00 0.00 H new ATOM 0 HD3 ARG A 176 2.031 3.745 5.969 1.00 0.00 H new ATOM 0 HE ARG A 176 2.321 2.361 8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 176 0.358 4.226 6.335 1.00 0.00 H new ATOM 0 HH12 ARG A 176 -0.911 4.553 7.520 1.00 0.00 H new ATOM 0 HH21 ARG A 176 0.722 2.849 10.151 1.00 0.00 H new ATOM 0 HH22 ARG A 176 -0.705 3.774 9.674 1.00 0.00 H new ATOM 476 N GLU A 177 6.059 0.050 5.441 1.00 0.00 N ATOM 477 CA GLU A 177 6.585 -0.950 6.330 1.00 0.00 C ATOM 478 C GLU A 177 5.970 -0.795 7.693 1.00 0.00 C ATOM 479 O GLU A 177 5.880 0.318 8.221 1.00 0.00 O ATOM 480 CB GLU A 177 8.092 -0.822 6.435 1.00 0.00 C ATOM 481 CG GLU A 177 8.844 -1.300 5.216 1.00 0.00 C ATOM 482 CD GLU A 177 10.327 -1.143 5.373 1.00 0.00 C ATOM 483 OE1 GLU A 177 10.976 -2.061 5.907 1.00 0.00 O ATOM 484 OE2 GLU A 177 10.872 -0.097 4.975 1.00 0.00 O ATOM 0 H GLU A 177 6.700 0.826 5.274 1.00 0.00 H new ATOM 0 HA GLU A 177 6.341 -1.935 5.931 1.00 0.00 H new ATOM 0 HB2 GLU A 177 8.344 0.223 6.616 1.00 0.00 H new ATOM 0 HB3 GLU A 177 8.433 -1.387 7.302 1.00 0.00 H new ATOM 0 HG2 GLU A 177 8.608 -2.348 5.032 1.00 0.00 H new ATOM 0 HG3 GLU A 177 8.511 -0.740 4.342 1.00 0.00 H new ATOM 491 N SER A 178 5.547 -1.876 8.247 1.00 0.00 N ATOM 492 CA SER A 178 4.936 -1.870 9.519 1.00 0.00 C ATOM 493 C SER A 178 5.757 -2.666 10.512 1.00 0.00 C ATOM 494 O SER A 178 5.800 -3.894 10.457 1.00 0.00 O ATOM 495 CB SER A 178 3.534 -2.433 9.388 1.00 0.00 C ATOM 496 OG SER A 178 2.785 -1.639 8.478 1.00 0.00 O ATOM 0 H SER A 178 5.619 -2.799 7.820 1.00 0.00 H new ATOM 0 HA SER A 178 4.879 -0.849 9.895 1.00 0.00 H new ATOM 0 HB2 SER A 178 3.577 -3.464 9.037 1.00 0.00 H new ATOM 0 HB3 SER A 178 3.045 -2.448 10.362 1.00 0.00 H new ATOM 0 HG SER A 178 1.828 -1.793 8.621 1.00 0.00 H new ATOM 502 N GLU A 179 6.457 -1.952 11.377 1.00 0.00 N ATOM 503 CA GLU A 179 7.219 -2.575 12.446 1.00 0.00 C ATOM 504 C GLU A 179 6.406 -2.605 13.708 1.00 0.00 C ATOM 505 O GLU A 179 6.763 -3.257 14.695 1.00 0.00 O ATOM 506 CB GLU A 179 8.519 -1.859 12.697 1.00 0.00 C ATOM 507 CG GLU A 179 9.520 -2.004 11.582 1.00 0.00 C ATOM 508 CD GLU A 179 10.892 -1.585 12.000 1.00 0.00 C ATOM 509 OE1 GLU A 179 11.130 -0.382 12.204 1.00 0.00 O ATOM 510 OE2 GLU A 179 11.773 -2.467 12.128 1.00 0.00 O ATOM 0 H GLU A 179 6.513 -0.934 11.359 1.00 0.00 H new ATOM 0 HA GLU A 179 7.452 -3.593 12.133 1.00 0.00 H new ATOM 0 HB2 GLU A 179 8.315 -0.800 12.853 1.00 0.00 H new ATOM 0 HB3 GLU A 179 8.959 -2.238 13.619 1.00 0.00 H new ATOM 0 HG2 GLU A 179 9.544 -3.042 11.250 1.00 0.00 H new ATOM 0 HG3 GLU A 179 9.202 -1.404 10.730 1.00 0.00 H new ATOM 517 N THR A 180 5.321 -1.897 13.666 1.00 0.00 N ATOM 518 CA THR A 180 4.378 -1.848 14.725 1.00 0.00 C ATOM 519 C THR A 180 3.548 -3.132 14.694 1.00 0.00 C ATOM 520 O THR A 180 3.056 -3.641 15.719 1.00 0.00 O ATOM 521 CB THR A 180 3.549 -0.605 14.507 1.00 0.00 C ATOM 522 OG1 THR A 180 3.207 -0.546 13.103 1.00 0.00 O ATOM 523 CG2 THR A 180 4.374 0.621 14.874 1.00 0.00 C ATOM 0 H THR A 180 5.064 -1.320 12.865 1.00 0.00 H new ATOM 0 HA THR A 180 4.840 -1.793 15.711 1.00 0.00 H new ATOM 0 HB THR A 180 2.650 -0.629 15.123 1.00 0.00 H new ATOM 0 HG1 THR A 180 2.665 0.253 12.931 1.00 0.00 H new ATOM 0 HG21 THR A 180 3.778 1.520 14.718 1.00 0.00 H new ATOM 0 HG22 THR A 180 4.671 0.560 15.921 1.00 0.00 H new ATOM 0 HG23 THR A 180 5.264 0.662 14.246 1.00 0.00 H new ATOM 531 N THR A 181 3.421 -3.639 13.505 1.00 0.00 N ATOM 532 CA THR A 181 2.897 -4.926 13.246 1.00 0.00 C ATOM 533 C THR A 181 4.143 -5.805 13.097 1.00 0.00 C ATOM 534 O THR A 181 5.204 -5.282 12.780 1.00 0.00 O ATOM 535 CB THR A 181 2.134 -4.896 11.926 1.00 0.00 C ATOM 536 OG1 THR A 181 1.289 -3.725 11.900 1.00 0.00 O ATOM 537 CG2 THR A 181 1.279 -6.141 11.775 1.00 0.00 C ATOM 0 H THR A 181 3.694 -3.138 12.660 1.00 0.00 H new ATOM 0 HA THR A 181 2.217 -5.280 14.021 1.00 0.00 H new ATOM 0 HB THR A 181 2.847 -4.864 11.102 1.00 0.00 H new ATOM 0 HG1 THR A 181 0.796 -3.696 11.054 1.00 0.00 H new ATOM 0 HG21 THR A 181 0.742 -6.101 10.827 1.00 0.00 H new ATOM 0 HG22 THR A 181 1.917 -7.025 11.794 1.00 0.00 H new ATOM 0 HG23 THR A 181 0.563 -6.192 12.595 1.00 0.00 H new ATOM 545 N LYS A 182 4.067 -7.069 13.360 1.00 0.00 N ATOM 546 CA LYS A 182 5.264 -7.878 13.286 1.00 0.00 C ATOM 547 C LYS A 182 5.705 -8.144 11.851 1.00 0.00 C ATOM 548 O LYS A 182 5.177 -9.058 11.193 1.00 0.00 O ATOM 549 CB LYS A 182 5.089 -9.180 14.002 1.00 0.00 C ATOM 550 CG LYS A 182 6.375 -9.988 14.080 1.00 0.00 C ATOM 551 CD LYS A 182 6.186 -11.276 14.827 1.00 0.00 C ATOM 552 CE LYS A 182 7.512 -11.971 15.061 1.00 0.00 C ATOM 553 NZ LYS A 182 8.436 -11.142 15.868 1.00 0.00 N ATOM 0 H LYS A 182 3.215 -7.565 13.623 1.00 0.00 H new ATOM 0 HA LYS A 182 6.046 -7.299 13.777 1.00 0.00 H new ATOM 0 HB2 LYS A 182 4.724 -8.988 15.011 1.00 0.00 H new ATOM 0 HB3 LYS A 182 4.326 -9.769 13.494 1.00 0.00 H new ATOM 0 HG2 LYS A 182 6.730 -10.202 13.072 1.00 0.00 H new ATOM 0 HG3 LYS A 182 7.147 -9.395 14.570 1.00 0.00 H new ATOM 0 HD2 LYS A 182 5.702 -11.078 15.783 1.00 0.00 H new ATOM 0 HD3 LYS A 182 5.522 -11.932 14.264 1.00 0.00 H new ATOM 0 HE2 LYS A 182 7.340 -12.920 15.568 1.00 0.00 H new ATOM 0 HE3 LYS A 182 7.975 -12.201 14.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 9.159 -11.751 16.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 8.898 -10.440 15.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 7.902 -10.652 16.614 1.00 0.00 H new ATOM 567 N GLY A 183 6.627 -7.304 11.374 1.00 0.00 N ATOM 568 CA GLY A 183 7.244 -7.467 10.067 1.00 0.00 C ATOM 569 C GLY A 183 6.236 -7.506 8.956 1.00 0.00 C ATOM 570 O GLY A 183 6.357 -8.297 8.015 1.00 0.00 O ATOM 0 H GLY A 183 6.964 -6.491 11.890 1.00 0.00 H new ATOM 0 HA2 GLY A 183 7.940 -6.647 9.893 1.00 0.00 H new ATOM 0 HA3 GLY A 183 7.827 -8.388 10.056 1.00 0.00 H new ATOM 574 N ALA A 184 5.247 -6.672 9.052 1.00 0.00 N ATOM 575 CA ALA A 184 4.202 -6.673 8.089 1.00 0.00 C ATOM 576 C ALA A 184 4.212 -5.378 7.305 1.00 0.00 C ATOM 577 O ALA A 184 5.124 -4.553 7.458 1.00 0.00 O ATOM 578 CB ALA A 184 2.875 -6.905 8.784 1.00 0.00 C ATOM 0 H ALA A 184 5.146 -5.980 9.794 1.00 0.00 H new ATOM 0 HA ALA A 184 4.356 -7.483 7.376 1.00 0.00 H new ATOM 0 HB1 ALA A 184 2.073 -6.906 8.046 1.00 0.00 H new ATOM 0 HB2 ALA A 184 2.896 -7.866 9.298 1.00 0.00 H new ATOM 0 HB3 ALA A 184 2.700 -6.110 9.509 1.00 0.00 H new ATOM 584 N TYR A 185 3.236 -5.201 6.467 1.00 0.00 N ATOM 585 CA TYR A 185 3.120 -4.008 5.674 1.00 0.00 C ATOM 586 C TYR A 185 1.729 -3.453 5.823 1.00 0.00 C ATOM 587 O TYR A 185 0.834 -4.149 6.288 1.00 0.00 O ATOM 588 CB TYR A 185 3.431 -4.290 4.189 1.00 0.00 C ATOM 589 CG TYR A 185 4.863 -4.688 3.919 1.00 0.00 C ATOM 590 CD1 TYR A 185 5.837 -3.724 3.705 1.00 0.00 C ATOM 591 CD2 TYR A 185 5.247 -6.021 3.902 1.00 0.00 C ATOM 592 CE1 TYR A 185 7.151 -4.077 3.479 1.00 0.00 C ATOM 593 CE2 TYR A 185 6.558 -6.378 3.684 1.00 0.00 C ATOM 594 CZ TYR A 185 7.505 -5.404 3.474 1.00 0.00 C ATOM 595 OH TYR A 185 8.816 -5.766 3.262 1.00 0.00 O ATOM 0 H TYR A 185 2.492 -5.882 6.311 1.00 0.00 H new ATOM 0 HA TYR A 185 3.848 -3.278 6.027 1.00 0.00 H new ATOM 0 HB2 TYR A 185 2.773 -5.084 3.836 1.00 0.00 H new ATOM 0 HB3 TYR A 185 3.197 -3.400 3.605 1.00 0.00 H new ATOM 0 HD1 TYR A 185 5.562 -2.680 3.716 1.00 0.00 H new ATOM 0 HD2 TYR A 185 4.506 -6.790 4.062 1.00 0.00 H new ATOM 0 HE1 TYR A 185 7.897 -3.315 3.307 1.00 0.00 H new ATOM 0 HE2 TYR A 185 6.842 -7.420 3.678 1.00 0.00 H new ATOM 0 HH TYR A 185 8.895 -6.742 3.291 1.00 0.00 H new ATOM 605 N SER A 186 1.549 -2.223 5.472 1.00 0.00 N ATOM 606 CA SER A 186 0.252 -1.614 5.519 1.00 0.00 C ATOM 607 C SER A 186 -0.087 -0.964 4.201 1.00 0.00 C ATOM 608 O SER A 186 0.615 -0.040 3.746 1.00 0.00 O ATOM 609 CB SER A 186 0.157 -0.592 6.654 1.00 0.00 C ATOM 610 OG SER A 186 0.234 -1.211 7.925 1.00 0.00 O ATOM 0 H SER A 186 2.294 -1.608 5.144 1.00 0.00 H new ATOM 0 HA SER A 186 -0.473 -2.405 5.713 1.00 0.00 H new ATOM 0 HB2 SER A 186 0.961 0.137 6.555 1.00 0.00 H new ATOM 0 HB3 SER A 186 -0.782 -0.044 6.573 1.00 0.00 H new ATOM 0 HG SER A 186 -0.431 -0.812 8.524 1.00 0.00 H new ATOM 616 N LEU A 187 -1.154 -1.433 3.597 1.00 0.00 N ATOM 617 CA LEU A 187 -1.652 -0.872 2.374 1.00 0.00 C ATOM 618 C LEU A 187 -2.434 0.354 2.745 1.00 0.00 C ATOM 619 O LEU A 187 -3.543 0.268 3.263 1.00 0.00 O ATOM 620 CB LEU A 187 -2.540 -1.884 1.619 1.00 0.00 C ATOM 621 CG LEU A 187 -3.195 -1.401 0.309 1.00 0.00 C ATOM 622 CD1 LEU A 187 -2.160 -0.941 -0.694 1.00 0.00 C ATOM 623 CD2 LEU A 187 -4.053 -2.499 -0.294 1.00 0.00 C ATOM 0 H LEU A 187 -1.701 -2.220 3.947 1.00 0.00 H new ATOM 0 HA LEU A 187 -0.830 -0.620 1.704 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -1.935 -2.762 1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -3.332 -2.209 2.294 1.00 0.00 H new ATOM 0 HG LEU A 187 -3.828 -0.548 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -2.658 -0.608 -1.604 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -1.586 -0.116 -0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -1.489 -1.767 -0.929 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -4.507 -2.140 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -3.432 -3.369 -0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -4.836 -2.777 0.411 1.00 0.00 H new ATOM 635 N SER A 188 -1.820 1.468 2.562 1.00 0.00 N ATOM 636 CA SER A 188 -2.388 2.715 2.913 1.00 0.00 C ATOM 637 C SER A 188 -3.101 3.254 1.693 1.00 0.00 C ATOM 638 O SER A 188 -2.468 3.611 0.697 1.00 0.00 O ATOM 639 CB SER A 188 -1.256 3.632 3.363 1.00 0.00 C ATOM 640 OG SER A 188 -0.461 2.974 4.355 1.00 0.00 O ATOM 0 H SER A 188 -0.887 1.537 2.155 1.00 0.00 H new ATOM 0 HA SER A 188 -3.108 2.633 3.727 1.00 0.00 H new ATOM 0 HB2 SER A 188 -0.636 3.904 2.509 1.00 0.00 H new ATOM 0 HB3 SER A 188 -1.665 4.558 3.768 1.00 0.00 H new ATOM 0 HG SER A 188 0.418 3.404 4.408 1.00 0.00 H new ATOM 646 N ILE A 189 -4.403 3.247 1.750 1.00 0.00 N ATOM 647 CA ILE A 189 -5.211 3.662 0.649 1.00 0.00 C ATOM 648 C ILE A 189 -5.903 4.953 1.010 1.00 0.00 C ATOM 649 O ILE A 189 -6.278 5.174 2.174 1.00 0.00 O ATOM 650 CB ILE A 189 -6.303 2.598 0.307 1.00 0.00 C ATOM 651 CG1 ILE A 189 -5.680 1.212 0.127 1.00 0.00 C ATOM 652 CG2 ILE A 189 -7.071 2.991 -0.966 1.00 0.00 C ATOM 653 CD1 ILE A 189 -6.691 0.119 -0.171 1.00 0.00 C ATOM 0 H ILE A 189 -4.933 2.950 2.570 1.00 0.00 H new ATOM 0 HA ILE A 189 -4.563 3.789 -0.218 1.00 0.00 H new ATOM 0 HB ILE A 189 -7.001 2.563 1.143 1.00 0.00 H new ATOM 0 HG12 ILE A 189 -4.954 1.253 -0.685 1.00 0.00 H new ATOM 0 HG13 ILE A 189 -5.132 0.950 1.032 1.00 0.00 H new ATOM 0 HG21 ILE A 189 -7.826 2.235 -1.184 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -7.556 3.955 -0.815 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -6.376 3.062 -1.803 1.00 0.00 H new ATOM 0 HD11 ILE A 189 -6.174 -0.834 -0.286 1.00 0.00 H new ATOM 0 HD12 ILE A 189 -7.404 0.049 0.651 1.00 0.00 H new ATOM 0 HD13 ILE A 189 -7.222 0.356 -1.093 1.00 0.00 H new ATOM 665 N ARG A 190 -6.017 5.812 0.052 1.00 0.00 N ATOM 666 CA ARG A 190 -6.776 7.002 0.191 1.00 0.00 C ATOM 667 C ARG A 190 -8.226 6.621 -0.041 1.00 0.00 C ATOM 668 O ARG A 190 -8.667 6.430 -1.190 1.00 0.00 O ATOM 669 CB ARG A 190 -6.301 8.034 -0.817 1.00 0.00 C ATOM 670 CG ARG A 190 -6.947 9.393 -0.697 1.00 0.00 C ATOM 671 CD ARG A 190 -6.310 10.345 -1.678 1.00 0.00 C ATOM 672 NE ARG A 190 -6.851 11.696 -1.605 1.00 0.00 N ATOM 673 CZ ARG A 190 -6.790 12.578 -2.589 1.00 0.00 C ATOM 674 NH1 ARG A 190 -6.206 12.258 -3.729 1.00 0.00 N ATOM 675 NH2 ARG A 190 -7.296 13.782 -2.411 1.00 0.00 N ATOM 0 H ARG A 190 -5.577 5.702 -0.862 1.00 0.00 H new ATOM 0 HA ARG A 190 -6.659 7.446 1.180 1.00 0.00 H new ATOM 0 HB2 ARG A 190 -5.222 8.151 -0.712 1.00 0.00 H new ATOM 0 HB3 ARG A 190 -6.484 7.650 -1.820 1.00 0.00 H new ATOM 0 HG2 ARG A 190 -8.017 9.317 -0.891 1.00 0.00 H new ATOM 0 HG3 ARG A 190 -6.834 9.772 0.319 1.00 0.00 H new ATOM 0 HD2 ARG A 190 -5.236 10.381 -1.494 1.00 0.00 H new ATOM 0 HD3 ARG A 190 -6.448 9.960 -2.689 1.00 0.00 H new ATOM 0 HE ARG A 190 -7.307 11.980 -0.738 1.00 0.00 H new ATOM 0 HH11 ARG A 190 -5.801 11.330 -3.852 1.00 0.00 H new ATOM 0 HH12 ARG A 190 -6.160 12.939 -4.487 1.00 0.00 H new ATOM 0 HH21 ARG A 190 -7.730 14.026 -1.521 1.00 0.00 H new ATOM 0 HH22 ARG A 190 -7.254 14.469 -3.164 1.00 0.00 H new ATOM 689 N ASP A 191 -8.931 6.484 1.037 1.00 0.00 N ATOM 690 CA ASP A 191 -10.289 5.994 1.056 1.00 0.00 C ATOM 691 C ASP A 191 -11.216 7.175 0.953 1.00 0.00 C ATOM 692 O ASP A 191 -10.858 8.300 1.375 1.00 0.00 O ATOM 693 CB ASP A 191 -10.514 5.240 2.378 1.00 0.00 C ATOM 694 CG ASP A 191 -11.887 4.609 2.536 1.00 0.00 C ATOM 695 OD1 ASP A 191 -12.839 5.308 2.891 1.00 0.00 O ATOM 696 OD2 ASP A 191 -12.010 3.382 2.419 1.00 0.00 O ATOM 0 H ASP A 191 -8.573 6.716 1.964 1.00 0.00 H new ATOM 0 HA ASP A 191 -10.480 5.316 0.224 1.00 0.00 H new ATOM 0 HB2 ASP A 191 -9.760 4.458 2.465 1.00 0.00 H new ATOM 0 HB3 ASP A 191 -10.352 5.932 3.205 1.00 0.00 H new ATOM 701 N TRP A 192 -12.364 6.974 0.376 1.00 0.00 N ATOM 702 CA TRP A 192 -13.247 8.058 0.181 1.00 0.00 C ATOM 703 C TRP A 192 -14.675 7.733 0.622 1.00 0.00 C ATOM 704 O TRP A 192 -15.233 6.665 0.324 1.00 0.00 O ATOM 705 CB TRP A 192 -13.202 8.545 -1.275 1.00 0.00 C ATOM 706 CG TRP A 192 -13.996 9.785 -1.481 1.00 0.00 C ATOM 707 CD1 TRP A 192 -13.577 11.064 -1.294 1.00 0.00 C ATOM 708 CD2 TRP A 192 -15.357 9.859 -1.880 1.00 0.00 C ATOM 709 NE1 TRP A 192 -14.605 11.928 -1.524 1.00 0.00 N ATOM 710 CE2 TRP A 192 -15.711 11.213 -1.899 1.00 0.00 C ATOM 711 CE3 TRP A 192 -16.316 8.904 -2.214 1.00 0.00 C ATOM 712 CZ2 TRP A 192 -16.985 11.637 -2.237 1.00 0.00 C ATOM 713 CZ3 TRP A 192 -17.570 9.325 -2.549 1.00 0.00 C ATOM 714 CH2 TRP A 192 -17.894 10.680 -2.557 1.00 0.00 C ATOM 0 H TRP A 192 -12.699 6.072 0.038 1.00 0.00 H new ATOM 0 HA TRP A 192 -12.905 8.872 0.821 1.00 0.00 H new ATOM 0 HB2 TRP A 192 -12.167 8.727 -1.563 1.00 0.00 H new ATOM 0 HB3 TRP A 192 -13.581 7.761 -1.930 1.00 0.00 H new ATOM 0 HD1 TRP A 192 -12.577 11.353 -1.006 1.00 0.00 H new ATOM 0 HE1 TRP A 192 -14.558 12.943 -1.432 1.00 0.00 H new ATOM 0 HE3 TRP A 192 -16.071 7.852 -2.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 192 -17.245 12.685 -2.246 1.00 0.00 H new ATOM 0 HZ3 TRP A 192 -18.323 8.597 -2.812 1.00 0.00 H new ATOM 0 HH2 TRP A 192 -18.897 10.978 -2.825 1.00 0.00 H new ATOM 725 N ASP A 193 -15.239 8.670 1.321 1.00 0.00 N ATOM 726 CA ASP A 193 -16.611 8.647 1.801 1.00 0.00 C ATOM 727 C ASP A 193 -17.174 9.988 1.399 1.00 0.00 C ATOM 728 O ASP A 193 -16.411 10.869 1.046 1.00 0.00 O ATOM 729 CB ASP A 193 -16.601 8.578 3.314 1.00 0.00 C ATOM 730 CG ASP A 193 -17.964 8.365 3.973 1.00 0.00 C ATOM 731 OD1 ASP A 193 -18.679 9.366 4.215 1.00 0.00 O ATOM 732 OD2 ASP A 193 -18.322 7.213 4.325 1.00 0.00 O ATOM 0 H ASP A 193 -14.741 9.518 1.592 1.00 0.00 H new ATOM 0 HA ASP A 193 -17.178 7.804 1.406 1.00 0.00 H new ATOM 0 HB2 ASP A 193 -15.939 7.767 3.619 1.00 0.00 H new ATOM 0 HB3 ASP A 193 -16.171 9.503 3.699 1.00 0.00 H new ATOM 737 N ASP A 194 -18.439 10.177 1.479 1.00 0.00 N ATOM 738 CA ASP A 194 -19.005 11.464 1.092 1.00 0.00 C ATOM 739 C ASP A 194 -18.748 12.486 2.174 1.00 0.00 C ATOM 740 O ASP A 194 -18.217 13.569 1.907 1.00 0.00 O ATOM 741 CB ASP A 194 -20.505 11.396 0.773 1.00 0.00 C ATOM 742 CG ASP A 194 -20.832 10.664 -0.507 1.00 0.00 C ATOM 743 OD1 ASP A 194 -20.904 11.310 -1.592 1.00 0.00 O ATOM 744 OD2 ASP A 194 -21.068 9.441 -0.454 1.00 0.00 O ATOM 0 H ASP A 194 -19.114 9.483 1.801 1.00 0.00 H new ATOM 0 HA ASP A 194 -18.506 11.762 0.170 1.00 0.00 H new ATOM 0 HB2 ASP A 194 -21.019 10.907 1.600 1.00 0.00 H new ATOM 0 HB3 ASP A 194 -20.898 12.411 0.709 1.00 0.00 H new ATOM 749 N MET A 195 -19.069 12.122 3.397 1.00 0.00 N ATOM 750 CA MET A 195 -18.906 13.010 4.531 1.00 0.00 C ATOM 751 C MET A 195 -17.508 12.884 5.095 1.00 0.00 C ATOM 752 O MET A 195 -16.887 13.867 5.457 1.00 0.00 O ATOM 753 CB MET A 195 -19.925 12.715 5.655 1.00 0.00 C ATOM 754 CG MET A 195 -21.397 12.812 5.258 1.00 0.00 C ATOM 755 SD MET A 195 -21.937 11.462 4.182 1.00 0.00 S ATOM 756 CE MET A 195 -23.629 11.936 3.854 1.00 0.00 C ATOM 0 H MET A 195 -19.449 11.206 3.634 1.00 0.00 H new ATOM 0 HA MET A 195 -19.080 14.023 4.168 1.00 0.00 H new ATOM 0 HB2 MET A 195 -19.736 11.712 6.037 1.00 0.00 H new ATOM 0 HB3 MET A 195 -19.743 13.408 6.476 1.00 0.00 H new ATOM 0 HG2 MET A 195 -22.010 12.817 6.159 1.00 0.00 H new ATOM 0 HG3 MET A 195 -21.568 13.762 4.751 1.00 0.00 H new ATOM 0 HE1 MET A 195 -24.094 11.197 3.201 1.00 0.00 H new ATOM 0 HE2 MET A 195 -24.180 11.989 4.793 1.00 0.00 H new ATOM 0 HE3 MET A 195 -23.646 12.911 3.368 1.00 0.00 H new ATOM 766 N LYS A 196 -17.002 11.664 5.121 1.00 0.00 N ATOM 767 CA LYS A 196 -15.686 11.366 5.723 1.00 0.00 C ATOM 768 C LYS A 196 -14.599 11.375 4.642 1.00 0.00 C ATOM 769 O LYS A 196 -13.525 10.799 4.836 1.00 0.00 O ATOM 770 CB LYS A 196 -15.696 9.962 6.346 1.00 0.00 C ATOM 771 CG LYS A 196 -16.939 9.598 7.128 1.00 0.00 C ATOM 772 CD LYS A 196 -16.868 8.145 7.571 1.00 0.00 C ATOM 773 CE LYS A 196 -18.220 7.618 8.011 1.00 0.00 C ATOM 774 NZ LYS A 196 -19.210 7.679 6.910 1.00 0.00 N ATOM 0 H LYS A 196 -17.476 10.848 4.733 1.00 0.00 H new ATOM 0 HA LYS A 196 -15.484 12.123 6.481 1.00 0.00 H new ATOM 0 HB2 LYS A 196 -15.564 9.230 5.549 1.00 0.00 H new ATOM 0 HB3 LYS A 196 -14.834 9.872 7.007 1.00 0.00 H new ATOM 0 HG2 LYS A 196 -17.035 10.248 7.998 1.00 0.00 H new ATOM 0 HG3 LYS A 196 -17.825 9.756 6.513 1.00 0.00 H new ATOM 0 HD2 LYS A 196 -16.490 7.534 6.751 1.00 0.00 H new ATOM 0 HD3 LYS A 196 -16.158 8.051 8.392 1.00 0.00 H new ATOM 0 HE2 LYS A 196 -18.117 6.588 8.353 1.00 0.00 H new ATOM 0 HE3 LYS A 196 -18.581 8.200 8.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 196 -20.033 7.091 7.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 196 -19.516 8.663 6.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 196 -18.776 7.326 6.033 1.00 0.00 H new ATOM 788 N GLY A 197 -14.888 12.038 3.531 1.00 0.00 N ATOM 789 CA GLY A 197 -14.030 12.049 2.354 1.00 0.00 C ATOM 790 C GLY A 197 -12.594 12.443 2.605 1.00 0.00 C ATOM 791 O GLY A 197 -12.302 13.197 3.550 1.00 0.00 O ATOM 0 H GLY A 197 -15.738 12.592 3.420 1.00 0.00 H new ATOM 0 HA2 GLY A 197 -14.044 11.056 1.906 1.00 0.00 H new ATOM 0 HA3 GLY A 197 -14.455 12.735 1.621 1.00 0.00 H new ATOM 795 N ASP A 198 -11.707 11.909 1.755 1.00 0.00 N ATOM 796 CA ASP A 198 -10.272 12.197 1.757 1.00 0.00 C ATOM 797 C ASP A 198 -9.645 11.787 3.087 1.00 0.00 C ATOM 798 O ASP A 198 -9.392 12.607 3.984 1.00 0.00 O ATOM 799 CB ASP A 198 -9.999 13.667 1.375 1.00 0.00 C ATOM 800 CG ASP A 198 -8.542 13.997 1.150 1.00 0.00 C ATOM 801 OD1 ASP A 198 -7.946 13.457 0.211 1.00 0.00 O ATOM 802 OD2 ASP A 198 -7.985 14.853 1.884 1.00 0.00 O ATOM 0 H ASP A 198 -11.978 11.247 1.028 1.00 0.00 H new ATOM 0 HA ASP A 198 -9.787 11.595 0.988 1.00 0.00 H new ATOM 0 HB2 ASP A 198 -10.556 13.903 0.468 1.00 0.00 H new ATOM 0 HB3 ASP A 198 -10.387 14.312 2.164 1.00 0.00 H new ATOM 807 N HIS A 199 -9.487 10.500 3.228 1.00 0.00 N ATOM 808 CA HIS A 199 -9.028 9.878 4.442 1.00 0.00 C ATOM 809 C HIS A 199 -8.056 8.768 4.092 1.00 0.00 C ATOM 810 O HIS A 199 -8.192 8.132 3.058 1.00 0.00 O ATOM 811 CB HIS A 199 -10.272 9.317 5.182 1.00 0.00 C ATOM 812 CG HIS A 199 -10.020 8.443 6.385 1.00 0.00 C ATOM 813 ND1 HIS A 199 -10.661 7.246 6.583 1.00 0.00 N ATOM 814 CD2 HIS A 199 -9.211 8.612 7.457 1.00 0.00 C ATOM 815 CE1 HIS A 199 -10.240 6.729 7.729 1.00 0.00 C ATOM 816 NE2 HIS A 199 -9.356 7.518 8.309 1.00 0.00 N ATOM 0 H HIS A 199 -9.679 9.834 2.480 1.00 0.00 H new ATOM 0 HA HIS A 199 -8.512 10.590 5.086 1.00 0.00 H new ATOM 0 HB2 HIS A 199 -10.886 10.160 5.499 1.00 0.00 H new ATOM 0 HB3 HIS A 199 -10.862 8.745 4.466 1.00 0.00 H new ATOM 0 HD2 HIS A 199 -8.559 9.457 7.625 1.00 0.00 H new ATOM 0 HE1 HIS A 199 -10.576 5.786 8.134 1.00 0.00 H new ATOM 0 HE2 HIS A 199 -8.878 7.360 9.196 1.00 0.00 H new ATOM 824 N VAL A 200 -7.069 8.574 4.913 1.00 0.00 N ATOM 825 CA VAL A 200 -6.131 7.506 4.708 1.00 0.00 C ATOM 826 C VAL A 200 -6.502 6.350 5.592 1.00 0.00 C ATOM 827 O VAL A 200 -6.617 6.497 6.814 1.00 0.00 O ATOM 828 CB VAL A 200 -4.689 7.950 4.992 1.00 0.00 C ATOM 829 CG1 VAL A 200 -3.705 6.788 4.849 1.00 0.00 C ATOM 830 CG2 VAL A 200 -4.321 9.073 4.057 1.00 0.00 C ATOM 0 H VAL A 200 -6.889 9.145 5.739 1.00 0.00 H new ATOM 0 HA VAL A 200 -6.176 7.205 3.661 1.00 0.00 H new ATOM 0 HB VAL A 200 -4.630 8.298 6.023 1.00 0.00 H new ATOM 0 HG11 VAL A 200 -2.694 7.139 5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 200 -3.968 6.000 5.555 1.00 0.00 H new ATOM 0 HG13 VAL A 200 -3.751 6.396 3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 200 -3.298 9.391 4.256 1.00 0.00 H new ATOM 0 HG22 VAL A 200 -4.400 8.729 3.026 1.00 0.00 H new ATOM 0 HG23 VAL A 200 -4.999 9.913 4.212 1.00 0.00 H new ATOM 840 N LYS A 201 -6.700 5.233 4.991 1.00 0.00 N ATOM 841 CA LYS A 201 -7.073 4.044 5.678 1.00 0.00 C ATOM 842 C LYS A 201 -6.061 2.990 5.330 1.00 0.00 C ATOM 843 O LYS A 201 -5.736 2.810 4.155 1.00 0.00 O ATOM 844 CB LYS A 201 -8.470 3.637 5.232 1.00 0.00 C ATOM 845 CG LYS A 201 -9.059 2.416 5.929 1.00 0.00 C ATOM 846 CD LYS A 201 -10.469 2.132 5.425 1.00 0.00 C ATOM 847 CE LYS A 201 -11.445 3.251 5.779 1.00 0.00 C ATOM 848 NZ LYS A 201 -12.741 3.073 5.106 1.00 0.00 N ATOM 0 H LYS A 201 -6.605 5.114 3.982 1.00 0.00 H new ATOM 0 HA LYS A 201 -7.092 4.187 6.758 1.00 0.00 H new ATOM 0 HB2 LYS A 201 -9.142 4.481 5.389 1.00 0.00 H new ATOM 0 HB3 LYS A 201 -8.447 3.444 4.160 1.00 0.00 H new ATOM 0 HG2 LYS A 201 -8.423 1.549 5.752 1.00 0.00 H new ATOM 0 HG3 LYS A 201 -9.080 2.581 7.006 1.00 0.00 H new ATOM 0 HD2 LYS A 201 -10.447 2.001 4.343 1.00 0.00 H new ATOM 0 HD3 LYS A 201 -10.824 1.194 5.853 1.00 0.00 H new ATOM 0 HE2 LYS A 201 -11.595 3.275 6.858 1.00 0.00 H new ATOM 0 HE3 LYS A 201 -11.016 4.212 5.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 -13.297 3.948 5.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 -12.583 2.855 4.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 -13.260 2.290 5.553 1.00 0.00 H new ATOM 862 N HIS A 202 -5.539 2.320 6.309 1.00 0.00 N ATOM 863 CA HIS A 202 -4.520 1.347 6.034 1.00 0.00 C ATOM 864 C HIS A 202 -4.974 -0.041 6.397 1.00 0.00 C ATOM 865 O HIS A 202 -5.518 -0.279 7.484 1.00 0.00 O ATOM 866 CB HIS A 202 -3.142 1.700 6.661 1.00 0.00 C ATOM 867 CG HIS A 202 -3.040 1.609 8.165 1.00 0.00 C ATOM 868 ND1 HIS A 202 -2.168 0.760 8.827 1.00 0.00 N ATOM 869 CD2 HIS A 202 -3.676 2.312 9.130 1.00 0.00 C ATOM 870 CE1 HIS A 202 -2.300 0.972 10.132 1.00 0.00 C ATOM 871 NE2 HIS A 202 -3.206 1.909 10.374 1.00 0.00 N ATOM 0 H HIS A 202 -5.793 2.423 7.291 1.00 0.00 H new ATOM 0 HA HIS A 202 -4.359 1.370 4.956 1.00 0.00 H new ATOM 0 HB2 HIS A 202 -2.391 1.039 6.228 1.00 0.00 H new ATOM 0 HB3 HIS A 202 -2.882 2.716 6.363 1.00 0.00 H new ATOM 0 HD2 HIS A 202 -4.430 3.067 8.960 1.00 0.00 H new ATOM 0 HE1 HIS A 202 -1.742 0.450 10.895 1.00 0.00 H new ATOM 0 HE2 HIS A 202 -3.498 2.262 11.286 1.00 0.00 H new ATOM 879 N TYR A 203 -4.784 -0.928 5.474 1.00 0.00 N ATOM 880 CA TYR A 203 -5.144 -2.302 5.624 1.00 0.00 C ATOM 881 C TYR A 203 -3.866 -3.074 5.872 1.00 0.00 C ATOM 882 O TYR A 203 -2.900 -2.932 5.108 1.00 0.00 O ATOM 883 CB TYR A 203 -5.827 -2.806 4.341 1.00 0.00 C ATOM 884 CG TYR A 203 -7.073 -2.018 3.923 1.00 0.00 C ATOM 885 CD1 TYR A 203 -6.970 -0.749 3.354 1.00 0.00 C ATOM 886 CD2 TYR A 203 -8.343 -2.547 4.089 1.00 0.00 C ATOM 887 CE1 TYR A 203 -8.090 -0.042 2.969 1.00 0.00 C ATOM 888 CE2 TYR A 203 -9.470 -1.842 3.695 1.00 0.00 C ATOM 889 CZ TYR A 203 -9.334 -0.593 3.136 1.00 0.00 C ATOM 890 OH TYR A 203 -10.457 0.111 2.742 1.00 0.00 O ATOM 0 H TYR A 203 -4.363 -0.711 4.571 1.00 0.00 H new ATOM 0 HA TYR A 203 -5.841 -2.435 6.452 1.00 0.00 H new ATOM 0 HB2 TYR A 203 -5.104 -2.775 3.526 1.00 0.00 H new ATOM 0 HB3 TYR A 203 -6.105 -3.851 4.481 1.00 0.00 H new ATOM 0 HD1 TYR A 203 -5.993 -0.311 3.212 1.00 0.00 H new ATOM 0 HD2 TYR A 203 -8.457 -3.525 4.533 1.00 0.00 H new ATOM 0 HE1 TYR A 203 -7.987 0.943 2.537 1.00 0.00 H new ATOM 0 HE2 TYR A 203 -10.452 -2.272 3.827 1.00 0.00 H new ATOM 0 HH TYR A 203 -10.406 0.298 1.781 1.00 0.00 H new ATOM 900 N LYS A 204 -3.831 -3.847 6.923 1.00 0.00 N ATOM 901 CA LYS A 204 -2.631 -4.579 7.272 1.00 0.00 C ATOM 902 C LYS A 204 -2.400 -5.745 6.318 1.00 0.00 C ATOM 903 O LYS A 204 -3.322 -6.515 6.003 1.00 0.00 O ATOM 904 CB LYS A 204 -2.655 -5.045 8.745 1.00 0.00 C ATOM 905 CG LYS A 204 -3.788 -6.008 9.096 1.00 0.00 C ATOM 906 CD LYS A 204 -3.813 -6.366 10.582 1.00 0.00 C ATOM 907 CE LYS A 204 -2.533 -7.058 11.040 1.00 0.00 C ATOM 908 NZ LYS A 204 -2.609 -7.470 12.459 1.00 0.00 N ATOM 0 H LYS A 204 -4.617 -3.990 7.557 1.00 0.00 H new ATOM 0 HA LYS A 204 -1.788 -3.896 7.167 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -1.704 -5.526 8.974 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -2.731 -4.168 9.387 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -4.741 -5.559 8.818 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -3.681 -6.919 8.508 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -3.961 -5.459 11.168 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -4.665 -7.017 10.781 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -2.350 -7.933 10.417 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -1.687 -6.385 10.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -1.721 -7.936 12.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -2.759 -6.632 13.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -3.401 -8.132 12.586 1.00 0.00 H new ATOM 922 N ILE A 205 -1.203 -5.835 5.832 1.00 0.00 N ATOM 923 CA ILE A 205 -0.799 -6.886 4.954 1.00 0.00 C ATOM 924 C ILE A 205 0.006 -7.857 5.766 1.00 0.00 C ATOM 925 O ILE A 205 1.094 -7.524 6.251 1.00 0.00 O ATOM 926 CB ILE A 205 0.094 -6.366 3.807 1.00 0.00 C ATOM 927 CG1 ILE A 205 -0.565 -5.176 3.104 1.00 0.00 C ATOM 928 CG2 ILE A 205 0.375 -7.494 2.810 1.00 0.00 C ATOM 929 CD1 ILE A 205 0.265 -4.578 2.002 1.00 0.00 C ATOM 0 H ILE A 205 -0.463 -5.165 6.039 1.00 0.00 H new ATOM 0 HA ILE A 205 -1.687 -7.340 4.513 1.00 0.00 H new ATOM 0 HB ILE A 205 1.040 -6.026 4.228 1.00 0.00 H new ATOM 0 HG12 ILE A 205 -1.522 -5.496 2.691 1.00 0.00 H new ATOM 0 HG13 ILE A 205 -0.779 -4.404 3.843 1.00 0.00 H new ATOM 0 HG21 ILE A 205 1.006 -7.119 2.004 1.00 0.00 H new ATOM 0 HG22 ILE A 205 0.886 -8.311 3.320 1.00 0.00 H new ATOM 0 HG23 ILE A 205 -0.566 -7.856 2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 205 -0.272 -3.741 1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 205 1.212 -4.225 2.410 1.00 0.00 H new ATOM 0 HD13 ILE A 205 0.458 -5.334 1.240 1.00 0.00 H new ATOM 941 N ARG A 206 -0.518 -9.014 5.943 1.00 0.00 N ATOM 942 CA ARG A 206 0.137 -10.016 6.706 1.00 0.00 C ATOM 943 C ARG A 206 0.888 -10.922 5.742 1.00 0.00 C ATOM 944 O ARG A 206 0.573 -10.959 4.549 1.00 0.00 O ATOM 945 CB ARG A 206 -0.907 -10.792 7.516 1.00 0.00 C ATOM 946 CG ARG A 206 -0.358 -11.834 8.471 1.00 0.00 C ATOM 947 CD ARG A 206 0.537 -11.232 9.542 1.00 0.00 C ATOM 948 NE ARG A 206 1.073 -12.267 10.423 1.00 0.00 N ATOM 949 CZ ARG A 206 2.159 -12.156 11.199 1.00 0.00 C ATOM 950 NH1 ARG A 206 2.869 -11.019 11.217 1.00 0.00 N ATOM 951 NH2 ARG A 206 2.537 -13.190 11.946 1.00 0.00 N ATOM 0 H ARG A 206 -1.420 -9.296 5.560 1.00 0.00 H new ATOM 0 HA ARG A 206 0.848 -9.582 7.410 1.00 0.00 H new ATOM 0 HB2 ARG A 206 -1.500 -10.078 8.088 1.00 0.00 H new ATOM 0 HB3 ARG A 206 -1.586 -11.285 6.821 1.00 0.00 H new ATOM 0 HG2 ARG A 206 -1.187 -12.357 8.948 1.00 0.00 H new ATOM 0 HG3 ARG A 206 0.206 -12.577 7.907 1.00 0.00 H new ATOM 0 HD2 ARG A 206 1.357 -10.690 9.072 1.00 0.00 H new ATOM 0 HD3 ARG A 206 -0.029 -10.508 10.129 1.00 0.00 H new ATOM 0 HE ARG A 206 0.574 -13.156 10.450 1.00 0.00 H new ATOM 0 HH11 ARG A 206 2.583 -10.230 10.637 1.00 0.00 H new ATOM 0 HH12 ARG A 206 3.695 -10.943 11.811 1.00 0.00 H new ATOM 0 HH21 ARG A 206 2.001 -14.058 11.924 1.00 0.00 H new ATOM 0 HH22 ARG A 206 3.363 -13.115 12.540 1.00 0.00 H new ATOM 965 N LYS A 207 1.864 -11.616 6.232 1.00 0.00 N ATOM 966 CA LYS A 207 2.637 -12.487 5.414 1.00 0.00 C ATOM 967 C LYS A 207 2.591 -13.869 6.009 1.00 0.00 C ATOM 968 O LYS A 207 2.673 -14.026 7.230 1.00 0.00 O ATOM 969 CB LYS A 207 4.097 -12.004 5.322 1.00 0.00 C ATOM 970 CG LYS A 207 4.952 -12.790 4.322 1.00 0.00 C ATOM 971 CD LYS A 207 6.424 -12.375 4.346 1.00 0.00 C ATOM 972 CE LYS A 207 7.108 -12.773 5.655 1.00 0.00 C ATOM 973 NZ LYS A 207 8.548 -12.422 5.671 1.00 0.00 N ATOM 0 H LYS A 207 2.146 -11.593 7.212 1.00 0.00 H new ATOM 0 HA LYS A 207 2.223 -12.495 4.406 1.00 0.00 H new ATOM 0 HB2 LYS A 207 4.103 -10.951 5.041 1.00 0.00 H new ATOM 0 HB3 LYS A 207 4.555 -12.073 6.309 1.00 0.00 H new ATOM 0 HG2 LYS A 207 4.876 -13.855 4.544 1.00 0.00 H new ATOM 0 HG3 LYS A 207 4.554 -12.644 3.318 1.00 0.00 H new ATOM 0 HD2 LYS A 207 6.945 -12.838 3.509 1.00 0.00 H new ATOM 0 HD3 LYS A 207 6.499 -11.296 4.211 1.00 0.00 H new ATOM 0 HE2 LYS A 207 6.607 -12.279 6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 207 6.997 -13.847 5.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 8.966 -12.712 6.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 9.034 -12.913 4.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 8.656 -11.394 5.553 1.00 0.00 H new ATOM 987 N LEU A 208 2.416 -14.838 5.170 1.00 0.00 N ATOM 988 CA LEU A 208 2.459 -16.208 5.559 1.00 0.00 C ATOM 989 C LEU A 208 3.902 -16.582 5.765 1.00 0.00 C ATOM 990 O LEU A 208 4.764 -16.191 4.975 1.00 0.00 O ATOM 991 CB LEU A 208 1.863 -17.096 4.465 1.00 0.00 C ATOM 992 CG LEU A 208 0.369 -16.949 4.183 1.00 0.00 C ATOM 993 CD1 LEU A 208 -0.001 -17.710 2.923 1.00 0.00 C ATOM 994 CD2 LEU A 208 -0.445 -17.475 5.358 1.00 0.00 C ATOM 0 H LEU A 208 2.236 -14.695 4.176 1.00 0.00 H new ATOM 0 HA LEU A 208 1.881 -16.350 6.472 1.00 0.00 H new ATOM 0 HB2 LEU A 208 2.403 -16.899 3.539 1.00 0.00 H new ATOM 0 HB3 LEU A 208 2.056 -18.135 4.731 1.00 0.00 H new ATOM 0 HG LEU A 208 0.145 -15.892 4.042 1.00 0.00 H new ATOM 0 HD11 LEU A 208 -1.068 -17.599 2.731 1.00 0.00 H new ATOM 0 HD12 LEU A 208 0.563 -17.313 2.079 1.00 0.00 H new ATOM 0 HD13 LEU A 208 0.236 -18.766 3.053 1.00 0.00 H new ATOM 0 HD21 LEU A 208 -1.508 -17.364 5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 208 -0.215 -18.529 5.517 1.00 0.00 H new ATOM 0 HD23 LEU A 208 -0.195 -16.909 6.256 1.00 0.00 H new ATOM 1006 N ASP A 209 4.178 -17.321 6.799 1.00 0.00 N ATOM 1007 CA ASP A 209 5.544 -17.739 7.072 1.00 0.00 C ATOM 1008 C ASP A 209 5.905 -18.871 6.117 1.00 0.00 C ATOM 1009 O ASP A 209 7.061 -19.097 5.794 1.00 0.00 O ATOM 1010 CB ASP A 209 5.713 -18.192 8.543 1.00 0.00 C ATOM 1011 CG ASP A 209 5.153 -19.576 8.842 1.00 0.00 C ATOM 1012 OD1 ASP A 209 3.919 -19.723 8.982 1.00 0.00 O ATOM 1013 OD2 ASP A 209 5.940 -20.543 8.935 1.00 0.00 O ATOM 0 H ASP A 209 3.486 -17.652 7.472 1.00 0.00 H new ATOM 0 HA ASP A 209 6.215 -16.894 6.918 1.00 0.00 H new ATOM 0 HB2 ASP A 209 6.773 -18.180 8.795 1.00 0.00 H new ATOM 0 HB3 ASP A 209 5.223 -17.467 9.193 1.00 0.00 H new ATOM 1018 N ASN A 210 4.886 -19.544 5.639 1.00 0.00 N ATOM 1019 CA ASN A 210 5.045 -20.659 4.732 1.00 0.00 C ATOM 1020 C ASN A 210 4.581 -20.245 3.330 1.00 0.00 C ATOM 1021 O ASN A 210 4.435 -21.067 2.434 1.00 0.00 O ATOM 1022 CB ASN A 210 4.216 -21.845 5.269 1.00 0.00 C ATOM 1023 CG ASN A 210 4.451 -23.173 4.575 1.00 0.00 C ATOM 1024 OD1 ASN A 210 3.769 -23.526 3.606 1.00 0.00 O ATOM 1025 ND2 ASN A 210 5.379 -23.929 5.079 1.00 0.00 N ATOM 0 H ASN A 210 3.915 -19.333 5.869 1.00 0.00 H new ATOM 0 HA ASN A 210 6.091 -20.959 4.665 1.00 0.00 H new ATOM 0 HB2 ASN A 210 4.433 -21.966 6.330 1.00 0.00 H new ATOM 0 HB3 ASN A 210 3.159 -21.594 5.186 1.00 0.00 H new ATOM 0 HD21 ASN A 210 5.565 -24.847 4.675 1.00 0.00 H new ATOM 0 HD22 ASN A 210 5.922 -23.605 5.879 1.00 0.00 H new ATOM 1032 N GLY A 211 4.383 -18.958 3.123 1.00 0.00 N ATOM 1033 CA GLY A 211 3.870 -18.528 1.844 1.00 0.00 C ATOM 1034 C GLY A 211 4.123 -17.077 1.527 1.00 0.00 C ATOM 1035 O GLY A 211 5.209 -16.549 1.790 1.00 0.00 O ATOM 0 H GLY A 211 4.563 -18.216 3.800 1.00 0.00 H new ATOM 0 HA2 GLY A 211 4.318 -19.141 1.062 1.00 0.00 H new ATOM 0 HA3 GLY A 211 2.796 -18.711 1.817 1.00 0.00 H new ATOM 1039 N GLY A 212 3.104 -16.429 1.006 1.00 0.00 N ATOM 1040 CA GLY A 212 3.233 -15.073 0.535 1.00 0.00 C ATOM 1041 C GLY A 212 2.473 -14.075 1.374 1.00 0.00 C ATOM 1042 O GLY A 212 2.283 -14.271 2.563 1.00 0.00 O ATOM 0 H GLY A 212 2.171 -16.826 0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 212 4.288 -14.799 0.523 1.00 0.00 H new ATOM 0 HA3 GLY A 212 2.878 -15.018 -0.494 1.00 0.00 H new ATOM 1046 N TYR A 213 2.001 -13.031 0.745 1.00 0.00 N ATOM 1047 CA TYR A 213 1.352 -11.932 1.445 1.00 0.00 C ATOM 1048 C TYR A 213 -0.149 -12.028 1.290 1.00 0.00 C ATOM 1049 O TYR A 213 -0.641 -12.514 0.262 1.00 0.00 O ATOM 1050 CB TYR A 213 1.814 -10.590 0.867 1.00 0.00 C ATOM 1051 CG TYR A 213 3.312 -10.365 0.876 1.00 0.00 C ATOM 1052 CD1 TYR A 213 4.101 -10.827 -0.163 1.00 0.00 C ATOM 1053 CD2 TYR A 213 3.932 -9.676 1.905 1.00 0.00 C ATOM 1054 CE1 TYR A 213 5.457 -10.620 -0.184 1.00 0.00 C ATOM 1055 CE2 TYR A 213 5.296 -9.459 1.894 1.00 0.00 C ATOM 1056 CZ TYR A 213 6.054 -9.936 0.844 1.00 0.00 C ATOM 1057 OH TYR A 213 7.413 -9.725 0.826 1.00 0.00 O ATOM 0 H TYR A 213 2.051 -12.910 -0.267 1.00 0.00 H new ATOM 0 HA TYR A 213 1.621 -11.995 2.499 1.00 0.00 H new ATOM 0 HB2 TYR A 213 1.457 -10.513 -0.160 1.00 0.00 H new ATOM 0 HB3 TYR A 213 1.339 -9.787 1.430 1.00 0.00 H new ATOM 0 HD1 TYR A 213 3.638 -11.364 -0.978 1.00 0.00 H new ATOM 0 HD2 TYR A 213 3.340 -9.303 2.728 1.00 0.00 H new ATOM 0 HE1 TYR A 213 6.051 -10.993 -1.005 1.00 0.00 H new ATOM 0 HE2 TYR A 213 5.767 -8.919 2.702 1.00 0.00 H new ATOM 0 HH TYR A 213 7.677 -9.224 1.626 1.00 0.00 H new ATOM 1067 N TYR A 214 -0.872 -11.577 2.286 1.00 0.00 N ATOM 1068 CA TYR A 214 -2.306 -11.558 2.220 1.00 0.00 C ATOM 1069 C TYR A 214 -2.873 -10.480 3.126 1.00 0.00 C ATOM 1070 O TYR A 214 -2.392 -10.254 4.236 1.00 0.00 O ATOM 1071 CB TYR A 214 -2.916 -12.940 2.564 1.00 0.00 C ATOM 1072 CG TYR A 214 -2.740 -13.416 3.999 1.00 0.00 C ATOM 1073 CD1 TYR A 214 -1.488 -13.740 4.506 1.00 0.00 C ATOM 1074 CD2 TYR A 214 -3.838 -13.546 4.839 1.00 0.00 C ATOM 1075 CE1 TYR A 214 -1.339 -14.175 5.802 1.00 0.00 C ATOM 1076 CE2 TYR A 214 -3.695 -13.985 6.135 1.00 0.00 C ATOM 1077 CZ TYR A 214 -2.444 -14.300 6.612 1.00 0.00 C ATOM 1078 OH TYR A 214 -2.301 -14.744 7.905 1.00 0.00 O ATOM 0 H TYR A 214 -0.483 -11.216 3.157 1.00 0.00 H new ATOM 0 HA TYR A 214 -2.582 -11.326 1.191 1.00 0.00 H new ATOM 0 HB2 TYR A 214 -3.983 -12.908 2.343 1.00 0.00 H new ATOM 0 HB3 TYR A 214 -2.475 -13.684 1.900 1.00 0.00 H new ATOM 0 HD1 TYR A 214 -0.618 -13.649 3.873 1.00 0.00 H new ATOM 0 HD2 TYR A 214 -4.822 -13.298 4.468 1.00 0.00 H new ATOM 0 HE1 TYR A 214 -0.358 -14.418 6.183 1.00 0.00 H new ATOM 0 HE2 TYR A 214 -4.560 -14.082 6.774 1.00 0.00 H new ATOM 0 HH TYR A 214 -3.179 -14.773 8.340 1.00 0.00 H new ATOM 1088 N ILE A 215 -3.854 -9.796 2.628 1.00 0.00 N ATOM 1089 CA ILE A 215 -4.574 -8.803 3.394 1.00 0.00 C ATOM 1090 C ILE A 215 -5.809 -9.435 4.014 1.00 0.00 C ATOM 1091 O ILE A 215 -6.234 -9.086 5.123 1.00 0.00 O ATOM 1092 CB ILE A 215 -4.924 -7.570 2.502 1.00 0.00 C ATOM 1093 CG1 ILE A 215 -3.807 -6.539 2.599 1.00 0.00 C ATOM 1094 CG2 ILE A 215 -6.289 -6.939 2.829 1.00 0.00 C ATOM 1095 CD1 ILE A 215 -4.040 -5.315 1.759 1.00 0.00 C ATOM 0 H ILE A 215 -4.188 -9.905 1.670 1.00 0.00 H new ATOM 0 HA ILE A 215 -3.944 -8.437 4.204 1.00 0.00 H new ATOM 0 HB ILE A 215 -5.009 -7.930 1.477 1.00 0.00 H new ATOM 0 HG12 ILE A 215 -3.692 -6.238 3.640 1.00 0.00 H new ATOM 0 HG13 ILE A 215 -2.869 -7.003 2.296 1.00 0.00 H new ATOM 0 HG21 ILE A 215 -6.464 -6.089 2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 215 -7.076 -7.679 2.683 1.00 0.00 H new ATOM 0 HG23 ILE A 215 -6.295 -6.602 3.866 1.00 0.00 H new ATOM 0 HD11 ILE A 215 -3.204 -4.627 1.879 1.00 0.00 H new ATOM 0 HD12 ILE A 215 -4.125 -5.603 0.711 1.00 0.00 H new ATOM 0 HD13 ILE A 215 -4.961 -4.826 2.076 1.00 0.00 H new ATOM 1107 N THR A 216 -6.340 -10.382 3.319 1.00 0.00 N ATOM 1108 CA THR A 216 -7.509 -11.073 3.730 1.00 0.00 C ATOM 1109 C THR A 216 -7.258 -12.558 3.600 1.00 0.00 C ATOM 1110 O THR A 216 -6.403 -12.985 2.818 1.00 0.00 O ATOM 1111 CB THR A 216 -8.741 -10.636 2.874 1.00 0.00 C ATOM 1112 OG1 THR A 216 -9.885 -11.449 3.168 1.00 0.00 O ATOM 1113 CG2 THR A 216 -8.436 -10.715 1.390 1.00 0.00 C ATOM 0 H THR A 216 -5.962 -10.703 2.428 1.00 0.00 H new ATOM 0 HA THR A 216 -7.736 -10.831 4.768 1.00 0.00 H new ATOM 0 HB THR A 216 -8.962 -9.601 3.134 1.00 0.00 H new ATOM 0 HG1 THR A 216 -10.644 -11.156 2.622 1.00 0.00 H new ATOM 0 HG21 THR A 216 -9.313 -10.405 0.821 1.00 0.00 H new ATOM 0 HG22 THR A 216 -7.599 -10.057 1.155 1.00 0.00 H new ATOM 0 HG23 THR A 216 -8.176 -11.740 1.126 1.00 0.00 H new ATOM 1121 N THR A 217 -7.982 -13.331 4.349 1.00 0.00 N ATOM 1122 CA THR A 217 -7.853 -14.754 4.327 1.00 0.00 C ATOM 1123 C THR A 217 -8.660 -15.366 3.191 1.00 0.00 C ATOM 1124 O THR A 217 -8.608 -16.582 2.960 1.00 0.00 O ATOM 1125 CB THR A 217 -8.303 -15.348 5.658 1.00 0.00 C ATOM 1126 OG1 THR A 217 -9.542 -14.726 6.068 1.00 0.00 O ATOM 1127 CG2 THR A 217 -7.237 -15.160 6.720 1.00 0.00 C ATOM 0 H THR A 217 -8.687 -12.987 5.000 1.00 0.00 H new ATOM 0 HA THR A 217 -6.801 -14.989 4.164 1.00 0.00 H new ATOM 0 HB THR A 217 -8.463 -16.419 5.532 1.00 0.00 H new ATOM 0 HG1 THR A 217 -9.833 -15.108 6.922 1.00 0.00 H new ATOM 0 HG21 THR A 217 -7.580 -15.591 7.660 1.00 0.00 H new ATOM 0 HG22 THR A 217 -6.319 -15.657 6.406 1.00 0.00 H new ATOM 0 HG23 THR A 217 -7.044 -14.096 6.858 1.00 0.00 H new ATOM 1135 N ARG A 218 -9.416 -14.529 2.490 1.00 0.00 N ATOM 1136 CA ARG A 218 -10.218 -15.003 1.378 1.00 0.00 C ATOM 1137 C ARG A 218 -9.324 -15.465 0.228 1.00 0.00 C ATOM 1138 O ARG A 218 -9.670 -16.390 -0.509 1.00 0.00 O ATOM 1139 CB ARG A 218 -11.220 -13.953 0.892 1.00 0.00 C ATOM 1140 CG ARG A 218 -10.652 -12.866 0.035 1.00 0.00 C ATOM 1141 CD ARG A 218 -11.739 -12.000 -0.540 1.00 0.00 C ATOM 1142 NE ARG A 218 -12.643 -12.763 -1.409 1.00 0.00 N ATOM 1143 CZ ARG A 218 -13.505 -12.236 -2.285 1.00 0.00 C ATOM 1144 NH1 ARG A 218 -13.619 -10.921 -2.414 1.00 0.00 N ATOM 1145 NH2 ARG A 218 -14.241 -13.035 -3.038 1.00 0.00 N ATOM 0 H ARG A 218 -9.488 -13.528 2.673 1.00 0.00 H new ATOM 0 HA ARG A 218 -10.796 -15.853 1.741 1.00 0.00 H new ATOM 0 HB2 ARG A 218 -12.007 -14.459 0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 218 -11.691 -13.496 1.762 1.00 0.00 H new ATOM 0 HG2 ARG A 218 -9.970 -12.254 0.625 1.00 0.00 H new ATOM 0 HG3 ARG A 218 -10.068 -13.305 -0.774 1.00 0.00 H new ATOM 0 HD2 ARG A 218 -12.310 -11.548 0.271 1.00 0.00 H new ATOM 0 HD3 ARG A 218 -11.291 -11.184 -1.108 1.00 0.00 H new ATOM 0 HE ARG A 218 -12.611 -13.780 -1.339 1.00 0.00 H new ATOM 0 HH11 ARG A 218 -13.046 -10.301 -1.842 1.00 0.00 H new ATOM 0 HH12 ARG A 218 -14.280 -10.530 -3.085 1.00 0.00 H new ATOM 0 HH21 ARG A 218 -14.150 -14.047 -2.949 1.00 0.00 H new ATOM 0 HH22 ARG A 218 -14.900 -12.640 -3.708 1.00 0.00 H new ATOM 1159 N ALA A 219 -8.170 -14.833 0.109 1.00 0.00 N ATOM 1160 CA ALA A 219 -7.214 -15.144 -0.922 1.00 0.00 C ATOM 1161 C ALA A 219 -5.860 -14.602 -0.531 1.00 0.00 C ATOM 1162 O ALA A 219 -5.749 -13.451 -0.110 1.00 0.00 O ATOM 1163 CB ALA A 219 -7.647 -14.536 -2.257 1.00 0.00 C ATOM 0 H ALA A 219 -7.874 -14.084 0.734 1.00 0.00 H new ATOM 0 HA ALA A 219 -7.158 -16.227 -1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 219 -6.912 -14.782 -3.024 1.00 0.00 H new ATOM 0 HB2 ALA A 219 -8.618 -14.940 -2.543 1.00 0.00 H new ATOM 0 HB3 ALA A 219 -7.719 -13.453 -2.157 1.00 0.00 H new ATOM 1169 N GLN A 220 -4.851 -15.432 -0.624 1.00 0.00 N ATOM 1170 CA GLN A 220 -3.494 -14.990 -0.389 1.00 0.00 C ATOM 1171 C GLN A 220 -2.803 -14.853 -1.722 1.00 0.00 C ATOM 1172 O GLN A 220 -3.277 -15.411 -2.712 1.00 0.00 O ATOM 1173 CB GLN A 220 -2.699 -15.909 0.580 1.00 0.00 C ATOM 1174 CG GLN A 220 -2.753 -17.408 0.284 1.00 0.00 C ATOM 1175 CD GLN A 220 -3.797 -18.166 1.120 1.00 0.00 C ATOM 1176 OE1 GLN A 220 -3.627 -19.358 1.407 1.00 0.00 O ATOM 1177 NE2 GLN A 220 -4.836 -17.488 1.568 1.00 0.00 N ATOM 0 H GLN A 220 -4.941 -16.420 -0.861 1.00 0.00 H new ATOM 0 HA GLN A 220 -3.532 -14.025 0.117 1.00 0.00 H new ATOM 0 HB2 GLN A 220 -1.655 -15.595 0.571 1.00 0.00 H new ATOM 0 HB3 GLN A 220 -3.072 -15.746 1.591 1.00 0.00 H new ATOM 0 HG2 GLN A 220 -2.973 -17.553 -0.774 1.00 0.00 H new ATOM 0 HG3 GLN A 220 -1.770 -17.841 0.467 1.00 0.00 H new ATOM 0 HE21 GLN A 220 -4.952 -16.506 1.316 1.00 0.00 H new ATOM 0 HE22 GLN A 220 -5.524 -17.945 2.167 1.00 0.00 H new ATOM 1186 N PHE A 221 -1.725 -14.119 -1.776 1.00 0.00 N ATOM 1187 CA PHE A 221 -1.052 -13.866 -3.018 1.00 0.00 C ATOM 1188 C PHE A 221 0.366 -14.359 -2.997 1.00 0.00 C ATOM 1189 O PHE A 221 0.967 -14.512 -1.929 1.00 0.00 O ATOM 1190 CB PHE A 221 -1.098 -12.380 -3.348 1.00 0.00 C ATOM 1191 CG PHE A 221 -2.476 -11.893 -3.668 1.00 0.00 C ATOM 1192 CD1 PHE A 221 -3.361 -11.547 -2.654 1.00 0.00 C ATOM 1193 CD2 PHE A 221 -2.896 -11.809 -4.979 1.00 0.00 C ATOM 1194 CE1 PHE A 221 -4.636 -11.122 -2.948 1.00 0.00 C ATOM 1195 CE2 PHE A 221 -4.170 -11.389 -5.276 1.00 0.00 C ATOM 1196 CZ PHE A 221 -5.042 -11.045 -4.259 1.00 0.00 C ATOM 0 H PHE A 221 -1.291 -13.682 -0.963 1.00 0.00 H new ATOM 0 HA PHE A 221 -1.576 -14.420 -3.797 1.00 0.00 H new ATOM 0 HB2 PHE A 221 -0.706 -11.814 -2.503 1.00 0.00 H new ATOM 0 HB3 PHE A 221 -0.443 -12.182 -4.196 1.00 0.00 H new ATOM 0 HD1 PHE A 221 -3.044 -11.612 -1.624 1.00 0.00 H new ATOM 0 HD2 PHE A 221 -2.219 -12.075 -5.777 1.00 0.00 H new ATOM 0 HE1 PHE A 221 -5.314 -10.850 -2.153 1.00 0.00 H new ATOM 0 HE2 PHE A 221 -4.491 -11.327 -6.305 1.00 0.00 H new ATOM 0 HZ PHE A 221 -6.043 -10.716 -4.495 1.00 0.00 H new ATOM 1206 N GLU A 222 0.898 -14.585 -4.186 1.00 0.00 N ATOM 1207 CA GLU A 222 2.252 -15.078 -4.370 1.00 0.00 C ATOM 1208 C GLU A 222 3.236 -14.033 -3.857 1.00 0.00 C ATOM 1209 O GLU A 222 4.184 -14.342 -3.137 1.00 0.00 O ATOM 1210 CB GLU A 222 2.509 -15.317 -5.862 1.00 0.00 C ATOM 1211 CG GLU A 222 3.823 -16.015 -6.182 1.00 0.00 C ATOM 1212 CD GLU A 222 3.819 -17.468 -5.781 1.00 0.00 C ATOM 1213 OE1 GLU A 222 3.265 -18.289 -6.543 1.00 0.00 O ATOM 1214 OE2 GLU A 222 4.387 -17.825 -4.720 1.00 0.00 O ATOM 0 H GLU A 222 0.396 -14.430 -5.060 1.00 0.00 H new ATOM 0 HA GLU A 222 2.380 -16.011 -3.822 1.00 0.00 H new ATOM 0 HB2 GLU A 222 1.690 -15.912 -6.266 1.00 0.00 H new ATOM 0 HB3 GLU A 222 2.489 -14.357 -6.378 1.00 0.00 H new ATOM 0 HG2 GLU A 222 4.021 -15.937 -7.251 1.00 0.00 H new ATOM 0 HG3 GLU A 222 4.637 -15.502 -5.669 1.00 0.00 H new ATOM 1221 N THR A 223 2.979 -12.791 -4.211 1.00 0.00 N ATOM 1222 CA THR A 223 3.825 -11.712 -3.830 1.00 0.00 C ATOM 1223 C THR A 223 2.987 -10.453 -3.603 1.00 0.00 C ATOM 1224 O THR A 223 1.779 -10.429 -3.914 1.00 0.00 O ATOM 1225 CB THR A 223 4.978 -11.469 -4.869 1.00 0.00 C ATOM 1226 OG1 THR A 223 5.826 -10.398 -4.448 1.00 0.00 O ATOM 1227 CG2 THR A 223 4.440 -11.169 -6.255 1.00 0.00 C ATOM 0 H THR A 223 2.173 -12.515 -4.772 1.00 0.00 H new ATOM 0 HA THR A 223 4.315 -11.976 -2.893 1.00 0.00 H new ATOM 0 HB THR A 223 5.555 -12.392 -4.918 1.00 0.00 H new ATOM 0 HG1 THR A 223 6.538 -10.265 -5.109 1.00 0.00 H new ATOM 0 HG21 THR A 223 5.272 -11.008 -6.941 1.00 0.00 H new ATOM 0 HG22 THR A 223 3.841 -12.010 -6.603 1.00 0.00 H new ATOM 0 HG23 THR A 223 3.821 -10.273 -6.219 1.00 0.00 H new ATOM 1235 N LEU A 224 3.636 -9.418 -3.120 1.00 0.00 N ATOM 1236 CA LEU A 224 3.010 -8.171 -2.720 1.00 0.00 C ATOM 1237 C LEU A 224 2.488 -7.453 -3.969 1.00 0.00 C ATOM 1238 O LEU A 224 1.433 -6.819 -3.950 1.00 0.00 O ATOM 1239 CB LEU A 224 4.073 -7.333 -1.976 1.00 0.00 C ATOM 1240 CG LEU A 224 3.598 -6.188 -1.074 1.00 0.00 C ATOM 1241 CD1 LEU A 224 2.737 -6.709 0.055 1.00 0.00 C ATOM 1242 CD2 LEU A 224 4.794 -5.427 -0.522 1.00 0.00 C ATOM 0 H LEU A 224 4.648 -9.418 -2.989 1.00 0.00 H new ATOM 0 HA LEU A 224 2.161 -8.337 -2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 224 4.664 -8.014 -1.364 1.00 0.00 H new ATOM 0 HB3 LEU A 224 4.745 -6.910 -2.723 1.00 0.00 H new ATOM 0 HG LEU A 224 2.992 -5.508 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 224 2.413 -5.877 0.680 1.00 0.00 H new ATOM 0 HD12 LEU A 224 1.864 -7.214 -0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 224 3.313 -7.412 0.657 1.00 0.00 H new ATOM 0 HD21 LEU A 224 4.446 -4.616 0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 224 5.419 -6.104 0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 224 5.375 -5.015 -1.347 1.00 0.00 H new ATOM 1254 N GLN A 225 3.207 -7.645 -5.071 1.00 0.00 N ATOM 1255 CA GLN A 225 2.854 -7.073 -6.365 1.00 0.00 C ATOM 1256 C GLN A 225 1.517 -7.659 -6.863 1.00 0.00 C ATOM 1257 O GLN A 225 0.725 -6.967 -7.496 1.00 0.00 O ATOM 1258 CB GLN A 225 4.027 -7.317 -7.361 1.00 0.00 C ATOM 1259 CG GLN A 225 3.945 -6.624 -8.742 1.00 0.00 C ATOM 1260 CD GLN A 225 3.216 -7.419 -9.835 1.00 0.00 C ATOM 1261 OE1 GLN A 225 3.824 -8.208 -10.544 1.00 0.00 O ATOM 1262 NE2 GLN A 225 1.936 -7.210 -9.989 1.00 0.00 N ATOM 0 H GLN A 225 4.058 -8.207 -5.090 1.00 0.00 H new ATOM 0 HA GLN A 225 2.706 -5.997 -6.278 1.00 0.00 H new ATOM 0 HB2 GLN A 225 4.951 -6.998 -6.878 1.00 0.00 H new ATOM 0 HB3 GLN A 225 4.109 -8.391 -7.528 1.00 0.00 H new ATOM 0 HG2 GLN A 225 3.443 -5.664 -8.619 1.00 0.00 H new ATOM 0 HG3 GLN A 225 4.958 -6.413 -9.084 1.00 0.00 H new ATOM 0 HE21 GLN A 225 1.451 -6.547 -9.385 1.00 0.00 H new ATOM 0 HE22 GLN A 225 1.421 -7.710 -10.714 1.00 0.00 H new ATOM 1271 N GLN A 226 1.246 -8.914 -6.514 1.00 0.00 N ATOM 1272 CA GLN A 226 0.015 -9.579 -6.949 1.00 0.00 C ATOM 1273 C GLN A 226 -1.169 -9.045 -6.176 1.00 0.00 C ATOM 1274 O GLN A 226 -2.212 -8.759 -6.749 1.00 0.00 O ATOM 1275 CB GLN A 226 0.101 -11.113 -6.802 1.00 0.00 C ATOM 1276 CG GLN A 226 1.188 -11.756 -7.636 1.00 0.00 C ATOM 1277 CD GLN A 226 0.998 -11.524 -9.117 1.00 0.00 C ATOM 1278 OE1 GLN A 226 0.371 -12.303 -9.810 1.00 0.00 O ATOM 1279 NE2 GLN A 226 1.499 -10.431 -9.590 1.00 0.00 N ATOM 0 H GLN A 226 1.856 -9.490 -5.935 1.00 0.00 H new ATOM 0 HA GLN A 226 -0.117 -9.360 -8.009 1.00 0.00 H new ATOM 0 HB2 GLN A 226 0.271 -11.357 -5.753 1.00 0.00 H new ATOM 0 HB3 GLN A 226 -0.859 -11.548 -7.079 1.00 0.00 H new ATOM 0 HG2 GLN A 226 2.157 -11.360 -7.331 1.00 0.00 H new ATOM 0 HG3 GLN A 226 1.206 -12.828 -7.439 1.00 0.00 H new ATOM 0 HE21 GLN A 226 2.019 -9.802 -8.978 1.00 0.00 H new ATOM 0 HE22 GLN A 226 1.374 -10.197 -10.575 1.00 0.00 H new ATOM 1288 N LEU A 227 -0.972 -8.862 -4.879 1.00 0.00 N ATOM 1289 CA LEU A 227 -2.019 -8.367 -3.990 1.00 0.00 C ATOM 1290 C LEU A 227 -2.570 -7.019 -4.438 1.00 0.00 C ATOM 1291 O LEU A 227 -3.779 -6.803 -4.441 1.00 0.00 O ATOM 1292 CB LEU A 227 -1.524 -8.357 -2.512 1.00 0.00 C ATOM 1293 CG LEU A 227 -2.347 -7.605 -1.486 1.00 0.00 C ATOM 1294 CD1 LEU A 227 -2.199 -8.290 -0.148 1.00 0.00 C ATOM 1295 CD2 LEU A 227 -1.863 -6.159 -1.355 1.00 0.00 C ATOM 0 H LEU A 227 -0.085 -9.051 -4.412 1.00 0.00 H new ATOM 0 HA LEU A 227 -2.861 -9.057 -4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -1.444 -9.392 -2.181 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -0.517 -7.940 -2.501 1.00 0.00 H new ATOM 0 HG LEU A 227 -3.389 -7.600 -1.806 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -2.787 -7.758 0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -2.553 -9.318 -0.224 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -1.150 -8.289 0.147 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -2.468 -5.638 -0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -0.819 -6.152 -1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -1.956 -5.656 -2.317 1.00 0.00 H new ATOM 1307 N VAL A 228 -1.700 -6.156 -4.899 1.00 0.00 N ATOM 1308 CA VAL A 228 -2.130 -4.823 -5.273 1.00 0.00 C ATOM 1309 C VAL A 228 -2.794 -4.842 -6.615 1.00 0.00 C ATOM 1310 O VAL A 228 -3.723 -4.091 -6.868 1.00 0.00 O ATOM 1311 CB VAL A 228 -1.005 -3.757 -5.246 1.00 0.00 C ATOM 1312 CG1 VAL A 228 -0.462 -3.599 -3.852 1.00 0.00 C ATOM 1313 CG2 VAL A 228 0.120 -4.065 -6.224 1.00 0.00 C ATOM 0 H VAL A 228 -0.705 -6.343 -5.025 1.00 0.00 H new ATOM 0 HA VAL A 228 -2.844 -4.521 -4.507 1.00 0.00 H new ATOM 0 HB VAL A 228 -1.453 -2.816 -5.566 1.00 0.00 H new ATOM 0 HG11 VAL A 228 0.327 -2.847 -3.852 1.00 0.00 H new ATOM 0 HG12 VAL A 228 -1.263 -3.285 -3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 228 -0.056 -4.551 -3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 228 0.879 -3.286 -6.162 1.00 0.00 H new ATOM 0 HG22 VAL A 228 0.566 -5.027 -5.974 1.00 0.00 H new ATOM 0 HG23 VAL A 228 -0.279 -4.103 -7.238 1.00 0.00 H new ATOM 1323 N GLN A 229 -2.358 -5.753 -7.439 1.00 0.00 N ATOM 1324 CA GLN A 229 -2.869 -5.920 -8.757 1.00 0.00 C ATOM 1325 C GLN A 229 -4.343 -6.352 -8.725 1.00 0.00 C ATOM 1326 O GLN A 229 -5.149 -5.906 -9.545 1.00 0.00 O ATOM 1327 CB GLN A 229 -1.976 -6.924 -9.468 1.00 0.00 C ATOM 1328 CG GLN A 229 -2.687 -7.875 -10.367 1.00 0.00 C ATOM 1329 CD GLN A 229 -1.755 -8.887 -10.951 1.00 0.00 C ATOM 1330 OE1 GLN A 229 -1.168 -8.672 -12.007 1.00 0.00 O ATOM 1331 NE2 GLN A 229 -1.633 -9.996 -10.296 1.00 0.00 N ATOM 0 H GLN A 229 -1.618 -6.413 -7.200 1.00 0.00 H new ATOM 0 HA GLN A 229 -2.854 -4.978 -9.305 1.00 0.00 H new ATOM 0 HB2 GLN A 229 -1.236 -6.378 -10.054 1.00 0.00 H new ATOM 0 HB3 GLN A 229 -1.430 -7.496 -8.718 1.00 0.00 H new ATOM 0 HG2 GLN A 229 -3.473 -8.384 -9.809 1.00 0.00 H new ATOM 0 HG3 GLN A 229 -3.173 -7.322 -11.171 1.00 0.00 H new ATOM 0 HE21 GLN A 229 -2.141 -10.130 -9.422 1.00 0.00 H new ATOM 0 HE22 GLN A 229 -1.029 -10.736 -10.654 1.00 0.00 H new ATOM 1340 N HIS A 230 -4.692 -7.167 -7.749 1.00 0.00 N ATOM 1341 CA HIS A 230 -6.055 -7.651 -7.623 1.00 0.00 C ATOM 1342 C HIS A 230 -6.955 -6.516 -7.164 1.00 0.00 C ATOM 1343 O HIS A 230 -8.044 -6.301 -7.711 1.00 0.00 O ATOM 1344 CB HIS A 230 -6.116 -8.825 -6.650 1.00 0.00 C ATOM 1345 CG HIS A 230 -7.398 -9.618 -6.687 1.00 0.00 C ATOM 1346 ND1 HIS A 230 -7.534 -10.819 -7.355 1.00 0.00 N ATOM 1347 CD2 HIS A 230 -8.601 -9.379 -6.108 1.00 0.00 C ATOM 1348 CE1 HIS A 230 -8.774 -11.259 -7.170 1.00 0.00 C ATOM 1349 NE2 HIS A 230 -9.472 -10.423 -6.416 1.00 0.00 N ATOM 0 H HIS A 230 -4.052 -7.508 -7.032 1.00 0.00 H new ATOM 0 HA HIS A 230 -6.404 -8.005 -8.593 1.00 0.00 H new ATOM 0 HB2 HIS A 230 -5.285 -9.497 -6.863 1.00 0.00 H new ATOM 0 HB3 HIS A 230 -5.970 -8.447 -5.638 1.00 0.00 H new ATOM 0 HD2 HIS A 230 -8.845 -8.517 -5.505 1.00 0.00 H new ATOM 0 HE1 HIS A 230 -9.162 -12.179 -7.581 1.00 0.00 H new ATOM 0 HE2 HIS A 230 -10.444 -10.522 -6.122 1.00 0.00 H new ATOM 1357 N TYR A 231 -6.474 -5.740 -6.209 1.00 0.00 N ATOM 1358 CA TYR A 231 -7.245 -4.623 -5.697 1.00 0.00 C ATOM 1359 C TYR A 231 -7.245 -3.448 -6.681 1.00 0.00 C ATOM 1360 O TYR A 231 -7.943 -2.456 -6.482 1.00 0.00 O ATOM 1361 CB TYR A 231 -6.760 -4.187 -4.317 1.00 0.00 C ATOM 1362 CG TYR A 231 -6.846 -5.263 -3.255 1.00 0.00 C ATOM 1363 CD1 TYR A 231 -8.005 -6.019 -3.085 1.00 0.00 C ATOM 1364 CD2 TYR A 231 -5.771 -5.525 -2.424 1.00 0.00 C ATOM 1365 CE1 TYR A 231 -8.081 -7.001 -2.113 1.00 0.00 C ATOM 1366 CE2 TYR A 231 -5.842 -6.503 -1.454 1.00 0.00 C ATOM 1367 CZ TYR A 231 -6.995 -7.236 -1.302 1.00 0.00 C ATOM 1368 OH TYR A 231 -7.061 -8.206 -0.324 1.00 0.00 O ATOM 0 H TYR A 231 -5.559 -5.862 -5.775 1.00 0.00 H new ATOM 0 HA TYR A 231 -8.274 -4.965 -5.587 1.00 0.00 H new ATOM 0 HB2 TYR A 231 -5.725 -3.855 -4.397 1.00 0.00 H new ATOM 0 HB3 TYR A 231 -7.347 -3.327 -3.994 1.00 0.00 H new ATOM 0 HD1 TYR A 231 -8.857 -5.835 -3.722 1.00 0.00 H new ATOM 0 HD2 TYR A 231 -4.861 -4.954 -2.537 1.00 0.00 H new ATOM 0 HE1 TYR A 231 -8.986 -7.578 -1.992 1.00 0.00 H new ATOM 0 HE2 TYR A 231 -4.993 -6.693 -0.815 1.00 0.00 H new ATOM 0 HH TYR A 231 -6.279 -8.793 -0.392 1.00 0.00 H new ATOM 1378 N SER A 232 -6.467 -3.569 -7.748 1.00 0.00 N ATOM 1379 CA SER A 232 -6.449 -2.576 -8.797 1.00 0.00 C ATOM 1380 C SER A 232 -7.653 -2.759 -9.725 1.00 0.00 C ATOM 1381 O SER A 232 -7.949 -1.905 -10.548 1.00 0.00 O ATOM 1382 CB SER A 232 -5.138 -2.638 -9.591 1.00 0.00 C ATOM 1383 OG SER A 232 -4.016 -2.294 -8.775 1.00 0.00 O ATOM 0 H SER A 232 -5.837 -4.356 -7.904 1.00 0.00 H new ATOM 0 HA SER A 232 -6.514 -1.591 -8.335 1.00 0.00 H new ATOM 0 HB2 SER A 232 -5.002 -3.642 -9.994 1.00 0.00 H new ATOM 0 HB3 SER A 232 -5.193 -1.958 -10.441 1.00 0.00 H new ATOM 0 HG SER A 232 -3.702 -3.090 -8.298 1.00 0.00 H new ATOM 1389 N GLU A 233 -8.356 -3.860 -9.557 1.00 0.00 N ATOM 1390 CA GLU A 233 -9.521 -4.160 -10.350 1.00 0.00 C ATOM 1391 C GLU A 233 -10.754 -3.712 -9.611 1.00 0.00 C ATOM 1392 O GLU A 233 -11.502 -2.860 -10.081 1.00 0.00 O ATOM 1393 CB GLU A 233 -9.595 -5.656 -10.610 1.00 0.00 C ATOM 1394 CG GLU A 233 -8.468 -6.185 -11.463 1.00 0.00 C ATOM 1395 CD GLU A 233 -8.542 -5.665 -12.870 1.00 0.00 C ATOM 1396 OE1 GLU A 233 -9.457 -6.069 -13.615 1.00 0.00 O ATOM 1397 OE2 GLU A 233 -7.689 -4.849 -13.271 1.00 0.00 O ATOM 0 H GLU A 233 -8.131 -4.572 -8.863 1.00 0.00 H new ATOM 0 HA GLU A 233 -9.456 -3.636 -11.304 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -9.592 -6.181 -9.655 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -10.543 -5.884 -11.096 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -7.513 -5.901 -11.020 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -8.502 -7.274 -11.476 1.00 0.00 H new ATOM 1404 N ARG A 234 -10.931 -4.261 -8.443 1.00 0.00 N ATOM 1405 CA ARG A 234 -12.053 -3.960 -7.609 1.00 0.00 C ATOM 1406 C ARG A 234 -11.605 -4.036 -6.179 1.00 0.00 C ATOM 1407 O ARG A 234 -10.546 -4.591 -5.904 1.00 0.00 O ATOM 1408 CB ARG A 234 -13.218 -4.929 -7.877 1.00 0.00 C ATOM 1409 CG ARG A 234 -12.904 -6.395 -7.628 1.00 0.00 C ATOM 1410 CD ARG A 234 -14.126 -7.262 -7.857 1.00 0.00 C ATOM 1411 NE ARG A 234 -15.219 -6.942 -6.920 1.00 0.00 N ATOM 1412 CZ ARG A 234 -16.467 -7.433 -6.971 1.00 0.00 C ATOM 1413 NH1 ARG A 234 -16.846 -8.225 -7.965 1.00 0.00 N ATOM 1414 NH2 ARG A 234 -17.334 -7.107 -6.027 1.00 0.00 N ATOM 0 H ARG A 234 -10.287 -4.941 -8.039 1.00 0.00 H new ATOM 0 HA ARG A 234 -12.420 -2.958 -7.829 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -14.061 -4.642 -7.249 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -13.537 -4.812 -8.913 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -12.098 -6.715 -8.289 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -12.548 -6.525 -6.606 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -14.477 -7.130 -8.881 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -13.851 -8.311 -7.747 1.00 0.00 H new ATOM 0 HE ARG A 234 -15.007 -6.289 -6.166 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -16.186 -8.468 -8.703 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -17.798 -8.591 -7.991 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -17.052 -6.487 -5.268 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -18.285 -7.476 -6.058 1.00 0.00 H new ATOM 1428 N ALA A 235 -12.382 -3.448 -5.295 1.00 0.00 N ATOM 1429 CA ALA A 235 -12.093 -3.432 -3.863 1.00 0.00 C ATOM 1430 C ALA A 235 -11.979 -4.843 -3.289 1.00 0.00 C ATOM 1431 O ALA A 235 -11.214 -5.069 -2.366 1.00 0.00 O ATOM 1432 CB ALA A 235 -13.148 -2.627 -3.128 1.00 0.00 C ATOM 0 H ALA A 235 -13.242 -2.961 -5.545 1.00 0.00 H new ATOM 0 HA ALA A 235 -11.124 -2.954 -3.721 1.00 0.00 H new ATOM 0 HB1 ALA A 235 -12.924 -2.621 -2.061 1.00 0.00 H new ATOM 0 HB2 ALA A 235 -13.152 -1.604 -3.504 1.00 0.00 H new ATOM 0 HB3 ALA A 235 -14.127 -3.077 -3.290 1.00 0.00 H new ATOM 1438 N ALA A 236 -12.791 -5.764 -3.818 1.00 0.00 N ATOM 1439 CA ALA A 236 -12.745 -7.205 -3.471 1.00 0.00 C ATOM 1440 C ALA A 236 -12.941 -7.471 -1.965 1.00 0.00 C ATOM 1441 O ALA A 236 -12.545 -8.528 -1.443 1.00 0.00 O ATOM 1442 CB ALA A 236 -11.440 -7.829 -3.969 1.00 0.00 C ATOM 0 H ALA A 236 -13.509 -5.537 -4.506 1.00 0.00 H new ATOM 0 HA ALA A 236 -13.587 -7.679 -3.976 1.00 0.00 H new ATOM 0 HB1 ALA A 236 -11.420 -8.887 -3.707 1.00 0.00 H new ATOM 0 HB2 ALA A 236 -11.375 -7.722 -5.052 1.00 0.00 H new ATOM 0 HB3 ALA A 236 -10.594 -7.324 -3.503 1.00 0.00 H new ATOM 1448 N GLY A 237 -13.633 -6.572 -1.305 1.00 0.00 N ATOM 1449 CA GLY A 237 -13.864 -6.695 0.109 1.00 0.00 C ATOM 1450 C GLY A 237 -13.251 -5.559 0.891 1.00 0.00 C ATOM 1451 O GLY A 237 -13.449 -5.457 2.105 1.00 0.00 O ATOM 0 H GLY A 237 -14.047 -5.743 -1.731 1.00 0.00 H new ATOM 0 HA2 GLY A 237 -14.937 -6.726 0.298 1.00 0.00 H new ATOM 0 HA3 GLY A 237 -13.451 -7.640 0.461 1.00 0.00 H new ATOM 1455 N LEU A 238 -12.505 -4.706 0.214 1.00 0.00 N ATOM 1456 CA LEU A 238 -11.964 -3.513 0.850 1.00 0.00 C ATOM 1457 C LEU A 238 -12.982 -2.384 0.716 1.00 0.00 C ATOM 1458 O LEU A 238 -13.992 -2.536 0.024 1.00 0.00 O ATOM 1459 CB LEU A 238 -10.634 -3.075 0.211 1.00 0.00 C ATOM 1460 CG LEU A 238 -9.506 -4.114 0.137 1.00 0.00 C ATOM 1461 CD1 LEU A 238 -8.243 -3.471 -0.401 1.00 0.00 C ATOM 1462 CD2 LEU A 238 -9.241 -4.760 1.486 1.00 0.00 C ATOM 0 H LEU A 238 -12.259 -4.813 -0.770 1.00 0.00 H new ATOM 0 HA LEU A 238 -11.769 -3.742 1.898 1.00 0.00 H new ATOM 0 HB2 LEU A 238 -10.844 -2.734 -0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 238 -10.262 -2.214 0.766 1.00 0.00 H new ATOM 0 HG LEU A 238 -9.825 -4.904 -0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 238 -7.448 -4.215 -0.450 1.00 0.00 H new ATOM 0 HD12 LEU A 238 -8.432 -3.076 -1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 238 -7.939 -2.658 0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 238 -8.436 -5.488 1.389 1.00 0.00 H new ATOM 0 HD22 LEU A 238 -8.952 -3.994 2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 238 -10.144 -5.262 1.833 1.00 0.00 H new ATOM 1474 N CYS A 239 -12.723 -1.264 1.349 1.00 0.00 N ATOM 1475 CA CYS A 239 -13.635 -0.137 1.286 1.00 0.00 C ATOM 1476 C CYS A 239 -13.279 0.795 0.112 1.00 0.00 C ATOM 1477 O CYS A 239 -14.059 1.675 -0.267 1.00 0.00 O ATOM 1478 CB CYS A 239 -13.626 0.603 2.627 1.00 0.00 C ATOM 1479 SG CYS A 239 -14.672 2.069 2.728 1.00 0.00 S ATOM 0 H CYS A 239 -11.889 -1.105 1.915 1.00 0.00 H new ATOM 0 HA CYS A 239 -14.646 -0.501 1.103 1.00 0.00 H new ATOM 0 HB2 CYS A 239 -13.935 -0.094 3.406 1.00 0.00 H new ATOM 0 HB3 CYS A 239 -12.600 0.897 2.851 1.00 0.00 H new ATOM 0 HG CYS A 239 -13.930 3.136 2.679 1.00 0.00 H new ATOM 1485 N CYS A 240 -12.136 0.573 -0.488 1.00 0.00 N ATOM 1486 CA CYS A 240 -11.693 1.372 -1.604 1.00 0.00 C ATOM 1487 C CYS A 240 -10.780 0.509 -2.439 1.00 0.00 C ATOM 1488 O CYS A 240 -10.144 -0.406 -1.901 1.00 0.00 O ATOM 1489 CB CYS A 240 -10.938 2.619 -1.095 1.00 0.00 C ATOM 1490 SG CYS A 240 -10.490 3.838 -2.362 1.00 0.00 S ATOM 0 H CYS A 240 -11.487 -0.166 -0.217 1.00 0.00 H new ATOM 0 HA CYS A 240 -12.541 1.715 -2.197 1.00 0.00 H new ATOM 0 HB2 CYS A 240 -11.554 3.113 -0.344 1.00 0.00 H new ATOM 0 HB3 CYS A 240 -10.027 2.291 -0.595 1.00 0.00 H new ATOM 0 HG CYS A 240 -9.890 3.239 -3.347 1.00 0.00 H new ATOM 1496 N ARG A 241 -10.742 0.745 -3.725 1.00 0.00 N ATOM 1497 CA ARG A 241 -9.858 -0.001 -4.584 1.00 0.00 C ATOM 1498 C ARG A 241 -8.704 0.828 -5.041 1.00 0.00 C ATOM 1499 O ARG A 241 -8.736 2.059 -4.975 1.00 0.00 O ATOM 1500 CB ARG A 241 -10.572 -0.747 -5.745 1.00 0.00 C ATOM 1501 CG ARG A 241 -11.507 0.050 -6.657 1.00 0.00 C ATOM 1502 CD ARG A 241 -10.821 1.067 -7.552 1.00 0.00 C ATOM 1503 NE ARG A 241 -10.080 0.443 -8.680 1.00 0.00 N ATOM 1504 CZ ARG A 241 -10.116 0.901 -9.961 1.00 0.00 C ATOM 1505 NH1 ARG A 241 -10.831 1.980 -10.268 1.00 0.00 N ATOM 1506 NH2 ARG A 241 -9.438 0.281 -10.922 1.00 0.00 N ATOM 0 H ARG A 241 -11.311 1.446 -4.200 1.00 0.00 H new ATOM 0 HA ARG A 241 -9.453 -0.802 -3.966 1.00 0.00 H new ATOM 0 HB2 ARG A 241 -9.803 -1.199 -6.372 1.00 0.00 H new ATOM 0 HB3 ARG A 241 -11.149 -1.563 -5.310 1.00 0.00 H new ATOM 0 HG2 ARG A 241 -12.060 -0.649 -7.285 1.00 0.00 H new ATOM 0 HG3 ARG A 241 -12.238 0.569 -6.037 1.00 0.00 H new ATOM 0 HD2 ARG A 241 -11.568 1.754 -7.951 1.00 0.00 H new ATOM 0 HD3 ARG A 241 -10.129 1.660 -6.954 1.00 0.00 H new ATOM 0 HE ARG A 241 -9.510 -0.379 -8.481 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -11.355 2.468 -9.542 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -10.855 2.319 -11.230 1.00 0.00 H new ATOM 0 HH21 ARG A 241 -8.884 -0.547 -10.703 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -9.472 0.633 -11.879 1.00 0.00 H new ATOM 1520 N LEU A 242 -7.704 0.168 -5.521 1.00 0.00 N ATOM 1521 CA LEU A 242 -6.503 0.816 -5.917 1.00 0.00 C ATOM 1522 C LEU A 242 -6.667 1.325 -7.320 1.00 0.00 C ATOM 1523 O LEU A 242 -6.623 0.548 -8.279 1.00 0.00 O ATOM 1524 CB LEU A 242 -5.332 -0.169 -5.854 1.00 0.00 C ATOM 1525 CG LEU A 242 -5.207 -0.987 -4.567 1.00 0.00 C ATOM 1526 CD1 LEU A 242 -3.949 -1.812 -4.579 1.00 0.00 C ATOM 1527 CD2 LEU A 242 -5.243 -0.110 -3.349 1.00 0.00 C ATOM 0 H LEU A 242 -7.699 -0.844 -5.650 1.00 0.00 H new ATOM 0 HA LEU A 242 -6.295 1.648 -5.244 1.00 0.00 H new ATOM 0 HB2 LEU A 242 -5.420 -0.860 -6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 242 -4.407 0.389 -5.997 1.00 0.00 H new ATOM 0 HG LEU A 242 -6.065 -1.657 -4.523 1.00 0.00 H new ATOM 0 HD11 LEU A 242 -3.881 -2.385 -3.654 1.00 0.00 H new ATOM 0 HD12 LEU A 242 -3.970 -2.495 -5.429 1.00 0.00 H new ATOM 0 HD13 LEU A 242 -3.084 -1.155 -4.663 1.00 0.00 H new ATOM 0 HD21 LEU A 242 -5.152 -0.726 -2.454 1.00 0.00 H new ATOM 0 HD22 LEU A 242 -4.416 0.600 -3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 242 -6.187 0.434 -3.320 1.00 0.00 H new ATOM 1539 N VAL A 243 -6.941 2.589 -7.457 1.00 0.00 N ATOM 1540 CA VAL A 243 -7.068 3.132 -8.774 1.00 0.00 C ATOM 1541 C VAL A 243 -5.717 3.657 -9.253 1.00 0.00 C ATOM 1542 O VAL A 243 -5.309 3.386 -10.390 1.00 0.00 O ATOM 1543 CB VAL A 243 -8.195 4.210 -8.900 1.00 0.00 C ATOM 1544 CG1 VAL A 243 -7.863 5.480 -8.161 1.00 0.00 C ATOM 1545 CG2 VAL A 243 -8.516 4.500 -10.358 1.00 0.00 C ATOM 0 H VAL A 243 -7.078 3.249 -6.692 1.00 0.00 H new ATOM 0 HA VAL A 243 -7.383 2.320 -9.429 1.00 0.00 H new ATOM 0 HB VAL A 243 -9.083 3.790 -8.428 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -8.678 6.194 -8.281 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -7.726 5.260 -7.102 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -6.944 5.906 -8.564 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -9.302 5.253 -10.415 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -7.622 4.870 -10.861 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -8.853 3.585 -10.845 1.00 0.00 H new ATOM 1555 N VAL A 244 -4.988 4.334 -8.373 1.00 0.00 N ATOM 1556 CA VAL A 244 -3.712 4.914 -8.734 1.00 0.00 C ATOM 1557 C VAL A 244 -2.692 4.781 -7.626 1.00 0.00 C ATOM 1558 O VAL A 244 -3.011 4.916 -6.442 1.00 0.00 O ATOM 1559 CB VAL A 244 -3.802 6.420 -9.140 1.00 0.00 C ATOM 1560 CG1 VAL A 244 -4.561 6.604 -10.426 1.00 0.00 C ATOM 1561 CG2 VAL A 244 -4.407 7.269 -8.031 1.00 0.00 C ATOM 0 H VAL A 244 -5.265 4.492 -7.404 1.00 0.00 H new ATOM 0 HA VAL A 244 -3.393 4.341 -9.605 1.00 0.00 H new ATOM 0 HB VAL A 244 -2.780 6.763 -9.302 1.00 0.00 H new ATOM 0 HG11 VAL A 244 -4.602 7.664 -10.676 1.00 0.00 H new ATOM 0 HG12 VAL A 244 -4.057 6.062 -11.227 1.00 0.00 H new ATOM 0 HG13 VAL A 244 -5.574 6.219 -10.309 1.00 0.00 H new ATOM 0 HG21 VAL A 244 -4.452 8.309 -8.353 1.00 0.00 H new ATOM 0 HG22 VAL A 244 -5.413 6.914 -7.809 1.00 0.00 H new ATOM 0 HG23 VAL A 244 -3.789 7.192 -7.136 1.00 0.00 H new ATOM 1571 N PRO A 245 -1.465 4.484 -7.984 1.00 0.00 N ATOM 1572 CA PRO A 245 -0.372 4.469 -7.045 1.00 0.00 C ATOM 1573 C PRO A 245 0.168 5.886 -6.850 1.00 0.00 C ATOM 1574 O PRO A 245 -0.057 6.779 -7.697 1.00 0.00 O ATOM 1575 CB PRO A 245 0.674 3.594 -7.743 1.00 0.00 C ATOM 1576 CG PRO A 245 0.441 3.821 -9.200 1.00 0.00 C ATOM 1577 CD PRO A 245 -1.034 4.107 -9.351 1.00 0.00 C ATOM 0 HA PRO A 245 -0.652 4.100 -6.058 1.00 0.00 H new ATOM 0 HB2 PRO A 245 1.686 3.878 -7.454 1.00 0.00 H new ATOM 0 HB3 PRO A 245 0.551 2.543 -7.481 1.00 0.00 H new ATOM 0 HG2 PRO A 245 1.039 4.656 -9.564 1.00 0.00 H new ATOM 0 HG3 PRO A 245 0.729 2.945 -9.781 1.00 0.00 H new ATOM 0 HD2 PRO A 245 -1.214 4.912 -10.063 1.00 0.00 H new ATOM 0 HD3 PRO A 245 -1.575 3.233 -9.714 1.00 0.00 H new ATOM 1585 N CYS A 246 0.820 6.114 -5.750 1.00 0.00 N ATOM 1586 CA CYS A 246 1.461 7.377 -5.534 1.00 0.00 C ATOM 1587 C CYS A 246 2.807 7.340 -6.266 1.00 0.00 C ATOM 1588 O CYS A 246 3.358 6.252 -6.517 1.00 0.00 O ATOM 1589 CB CYS A 246 1.641 7.633 -4.026 1.00 0.00 C ATOM 1590 SG CYS A 246 2.392 9.224 -3.602 1.00 0.00 S ATOM 0 H CYS A 246 0.922 5.443 -4.988 1.00 0.00 H new ATOM 0 HA CYS A 246 0.855 8.195 -5.922 1.00 0.00 H new ATOM 0 HB2 CYS A 246 0.666 7.569 -3.543 1.00 0.00 H new ATOM 0 HB3 CYS A 246 2.256 6.836 -3.609 1.00 0.00 H new ATOM 0 HG CYS A 246 1.496 9.997 -3.063 1.00 0.00 H new ATOM 1596 N HIS A 247 3.310 8.474 -6.651 1.00 0.00 N ATOM 1597 CA HIS A 247 4.566 8.514 -7.342 1.00 0.00 C ATOM 1598 C HIS A 247 5.606 9.309 -6.569 1.00 0.00 C ATOM 1599 O HIS A 247 5.451 10.513 -6.330 1.00 0.00 O ATOM 1600 CB HIS A 247 4.400 9.039 -8.782 1.00 0.00 C ATOM 1601 CG HIS A 247 5.678 9.088 -9.584 1.00 0.00 C ATOM 1602 ND1 HIS A 247 6.226 8.004 -10.245 1.00 0.00 N ATOM 1603 CD2 HIS A 247 6.506 10.127 -9.830 1.00 0.00 C ATOM 1604 CE1 HIS A 247 7.338 8.410 -10.857 1.00 0.00 C ATOM 1605 NE2 HIS A 247 7.559 9.698 -10.639 1.00 0.00 N ATOM 0 H HIS A 247 2.872 9.383 -6.500 1.00 0.00 H new ATOM 0 HA HIS A 247 4.933 7.490 -7.411 1.00 0.00 H new ATOM 0 HB2 HIS A 247 3.682 8.407 -9.305 1.00 0.00 H new ATOM 0 HB3 HIS A 247 3.973 10.041 -8.742 1.00 0.00 H new ATOM 0 HD2 HIS A 247 6.374 11.132 -9.459 1.00 0.00 H new ATOM 0 HE1 HIS A 247 7.975 7.773 -11.452 1.00 0.00 H new ATOM 0 HE2 HIS A 247 8.336 10.259 -10.989 1.00 0.00 H new ATOM 1613 N LYS A 248 6.625 8.609 -6.153 1.00 0.00 N ATOM 1614 CA LYS A 248 7.777 9.163 -5.502 1.00 0.00 C ATOM 1615 C LYS A 248 8.968 8.969 -6.410 1.00 0.00 C ATOM 1616 O LYS A 248 9.423 9.939 -7.038 1.00 0.00 O ATOM 1617 CB LYS A 248 8.015 8.471 -4.162 1.00 0.00 C ATOM 1618 CG LYS A 248 6.974 8.804 -3.121 1.00 0.00 C ATOM 1619 CD LYS A 248 7.131 8.026 -1.798 1.00 0.00 C ATOM 1620 CE LYS A 248 8.525 8.102 -1.168 1.00 0.00 C ATOM 1621 NZ LYS A 248 9.484 7.124 -1.759 1.00 0.00 N ATOM 1622 OXT LYS A 248 9.406 7.816 -6.569 1.00 0.00 O ATOM 0 H LYS A 248 6.676 7.596 -6.263 1.00 0.00 H new ATOM 0 HA LYS A 248 7.622 10.224 -5.307 1.00 0.00 H new ATOM 0 HB2 LYS A 248 8.031 7.392 -4.317 1.00 0.00 H new ATOM 0 HB3 LYS A 248 8.998 8.754 -3.785 1.00 0.00 H new ATOM 0 HG2 LYS A 248 7.018 9.872 -2.909 1.00 0.00 H new ATOM 0 HG3 LYS A 248 5.986 8.601 -3.534 1.00 0.00 H new ATOM 0 HD2 LYS A 248 6.403 8.406 -1.081 1.00 0.00 H new ATOM 0 HD3 LYS A 248 6.886 6.979 -1.977 1.00 0.00 H new ATOM 0 HE2 LYS A 248 8.920 9.110 -1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 248 8.444 7.921 -0.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 248 9.991 6.631 -0.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 248 8.963 6.430 -2.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 248 10.167 7.628 -2.360 1.00 0.00 H new