USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 717 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 218 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 222 SER OG : rot 152:sc= 0.32 USER MOD Set 2.1: A 132 SER OG : rot 180:sc= 0.182 USER MOD Set 2.2: A 134 MET CE :methyl -153:sc= -0.0755 (180deg=-0.327) USER MOD Set 2.3: A 217 GLN : amide:sc= 0.0155 K(o=0.12,f=-4!) USER MOD Set 3.1: A 204 LYS NZ :NH3+ -135:sc= 0.507 (180deg=-1.43) USER MOD Set 3.2: A 205 MET CE :methyl -176:sc= -0.0645 (180deg=-0.0754) USER MOD Set 4.1: A 192 THR OG1 : rot -23:sc= 0.212 USER MOD Set 4.2: A 197 ASN : amide:sc= -1.78! C(o=-1.6!,f=-2.1!) USER MOD Set 5.1: A 185 LYS NZ :NH3+ -135:sc= 1.18 (180deg=0) USER MOD Set 5.2: A 186 GLN : amide:sc= 0.61 K(o=1.8,f=-10!) USER MOD Set 5.3: A 190 THR OG1 : rot -160:sc=-0.000253 USER MOD Set 6.1: A 179 CYS SG : rot 2:sc= -0.0928 USER MOD Set 6.2: A 214 CYS SG : rot -165:sc= 0.791 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -117:sc= -0.894 (180deg=-1.78) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -179:sc= -0.0517 (180deg=-0.0538) USER MOD Single : A 140 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.1) USER MOD Single : A 143 ASN : amide:sc= -0.588 K(o=-0.59,f=-1.5) USER MOD Single : A 149 TYR OH : rot 2:sc= 1.27 USER MOD Single : A 150 TYR OH : rot 152:sc= 0.758 USER MOD Single : A 153 ASN : amide:sc= 1.44 K(o=1.4,f=-4.2!) USER MOD Single : A 154 MET CE :methyl -147:sc=-0.00691 (180deg=-0.819) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 21:sc= 1.23 USER MOD Single : A 159 ASN : amide:sc= -0.0694 K(o=-0.069,f=-1.3!) USER MOD Single : A 160 GLN : amide:sc= -0.479 X(o=-0.48,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot -145:sc= 1.29 USER MOD Single : A 172 GLN : amide:sc= -0.0159 X(o=-0.016,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 82:sc= 1.7 USER MOD Single : A 187 HIS : no HD1:sc=-0.00461 X(o=-0.0046,f=-0.0045) USER MOD Single : A 188 THR OG1 : rot 73:sc= 1.18 USER MOD Single : A 191 THR OG1 : rot -170:sc= -0.175 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.33) USER MOD Single : A 199 THR OG1 : rot 47:sc= 0.155 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 MET CE :methyl -169:sc= -4.58! (180deg=-5.73!) USER MOD Single : A 212 GLN : amide:sc=-0.00318 K(o=-0.0032,f=-1.6!) USER MOD Single : A 213 MET CE :methyl 154:sc= -0.495 (180deg=-0.654) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc=-0.00175 X(o=-0.0018,f=-0.31) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 80 N TYR A 128 16.149 -4.086 7.965 1.00 0.00 N ATOM 81 CA TYR A 128 15.610 -3.050 7.082 1.00 0.00 C ATOM 82 C TYR A 128 14.785 -2.107 7.957 1.00 0.00 C ATOM 83 O TYR A 128 13.924 -2.566 8.715 1.00 0.00 O ATOM 84 CB TYR A 128 14.752 -3.631 5.936 1.00 0.00 C ATOM 85 CG TYR A 128 15.462 -4.427 4.833 1.00 0.00 C ATOM 86 CD1 TYR A 128 16.414 -5.410 5.163 1.00 0.00 C ATOM 87 CD2 TYR A 128 15.082 -4.302 3.478 1.00 0.00 C ATOM 88 CE1 TYR A 128 16.931 -6.290 4.215 1.00 0.00 C ATOM 89 CE2 TYR A 128 15.631 -5.160 2.496 1.00 0.00 C ATOM 90 CZ TYR A 128 16.546 -6.174 2.872 1.00 0.00 C ATOM 91 OH TYR A 128 17.054 -7.075 1.991 1.00 0.00 O ATOM 0 HA TYR A 128 16.430 -2.524 6.593 1.00 0.00 H new ATOM 0 HB2 TYR A 128 13.996 -4.279 6.381 1.00 0.00 H new ATOM 0 HB3 TYR A 128 14.224 -2.803 5.462 1.00 0.00 H new ATOM 0 HD1 TYR A 128 16.755 -5.484 6.185 1.00 0.00 H new ATOM 0 HD2 TYR A 128 14.367 -3.546 3.190 1.00 0.00 H new ATOM 0 HE1 TYR A 128 17.627 -7.060 4.514 1.00 0.00 H new ATOM 0 HE2 TYR A 128 15.352 -5.042 1.459 1.00 0.00 H new ATOM 0 HH TYR A 128 16.708 -6.886 1.094 1.00 0.00 H new ATOM 101 N MET A 129 15.095 -0.815 7.885 1.00 0.00 N ATOM 102 CA MET A 129 14.409 0.238 8.610 1.00 0.00 C ATOM 103 C MET A 129 12.974 0.227 8.123 1.00 0.00 C ATOM 104 O MET A 129 12.761 0.360 6.924 1.00 0.00 O ATOM 105 CB MET A 129 15.058 1.600 8.306 1.00 0.00 C ATOM 106 CG MET A 129 16.141 2.015 9.305 1.00 0.00 C ATOM 107 SD MET A 129 17.344 0.764 9.813 1.00 0.00 S ATOM 108 CE MET A 129 18.238 0.572 8.256 1.00 0.00 C ATOM 0 H MET A 129 15.855 -0.467 7.301 1.00 0.00 H new ATOM 0 HA MET A 129 14.464 0.077 9.687 1.00 0.00 H new ATOM 0 HB2 MET A 129 15.494 1.568 7.307 1.00 0.00 H new ATOM 0 HB3 MET A 129 14.281 2.365 8.290 1.00 0.00 H new ATOM 0 HG2 MET A 129 16.690 2.852 8.875 1.00 0.00 H new ATOM 0 HG3 MET A 129 15.645 2.386 10.202 1.00 0.00 H new ATOM 0 HE1 MET A 129 18.114 -0.447 7.888 1.00 0.00 H new ATOM 0 HE2 MET A 129 17.844 1.274 7.521 1.00 0.00 H new ATOM 0 HE3 MET A 129 19.297 0.773 8.417 1.00 0.00 H new ATOM 118 N LEU A 130 12.007 0.095 9.029 1.00 0.00 N ATOM 119 CA LEU A 130 10.575 0.150 8.727 1.00 0.00 C ATOM 120 C LEU A 130 10.050 1.596 8.851 1.00 0.00 C ATOM 121 O LEU A 130 8.852 1.848 8.941 1.00 0.00 O ATOM 122 CB LEU A 130 9.852 -0.921 9.571 1.00 0.00 C ATOM 123 CG LEU A 130 8.320 -1.019 9.411 1.00 0.00 C ATOM 124 CD1 LEU A 130 7.873 -1.132 7.950 1.00 0.00 C ATOM 125 CD2 LEU A 130 7.797 -2.233 10.187 1.00 0.00 C ATOM 0 H LEU A 130 12.201 -0.057 10.019 1.00 0.00 H new ATOM 0 HA LEU A 130 10.364 -0.106 7.689 1.00 0.00 H new ATOM 0 HB2 LEU A 130 10.281 -1.893 9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 130 10.072 -0.731 10.621 1.00 0.00 H new ATOM 0 HG LEU A 130 7.905 -0.093 9.808 1.00 0.00 H new ATOM 0 HD11 LEU A 130 6.786 -1.197 7.906 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.206 -0.253 7.399 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.309 -2.026 7.504 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.715 -2.300 10.072 1.00 0.00 H new ATOM 0 HD22 LEU A 130 8.260 -3.140 9.798 1.00 0.00 H new ATOM 0 HD23 LEU A 130 8.044 -2.124 11.243 1.00 0.00 H new ATOM 137 N GLY A 131 10.947 2.579 8.846 1.00 0.00 N ATOM 138 CA GLY A 131 10.623 3.983 8.672 1.00 0.00 C ATOM 139 C GLY A 131 9.688 4.493 9.764 1.00 0.00 C ATOM 140 O GLY A 131 9.937 4.299 10.960 1.00 0.00 O ATOM 0 H GLY A 131 11.946 2.411 8.967 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.541 4.570 8.677 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.157 4.129 7.698 1.00 0.00 H new ATOM 144 N SER A 132 8.598 5.137 9.358 1.00 0.00 N ATOM 145 CA SER A 132 7.628 5.746 10.255 1.00 0.00 C ATOM 146 C SER A 132 6.227 5.458 9.735 1.00 0.00 C ATOM 147 O SER A 132 6.021 5.435 8.524 1.00 0.00 O ATOM 148 CB SER A 132 7.825 7.269 10.308 1.00 0.00 C ATOM 149 OG SER A 132 9.169 7.715 10.171 1.00 0.00 O ATOM 0 H SER A 132 8.361 5.251 8.372 1.00 0.00 H new ATOM 0 HA SER A 132 7.764 5.332 11.254 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.227 7.724 9.518 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.433 7.636 11.256 1.00 0.00 H new ATOM 0 HG SER A 132 9.195 8.694 10.215 1.00 0.00 H new ATOM 155 N ALA A 133 5.246 5.312 10.628 1.00 0.00 N ATOM 156 CA ALA A 133 3.855 5.449 10.222 1.00 0.00 C ATOM 157 C ALA A 133 3.674 6.875 9.698 1.00 0.00 C ATOM 158 O ALA A 133 4.167 7.827 10.317 1.00 0.00 O ATOM 159 CB ALA A 133 2.921 5.156 11.401 1.00 0.00 C ATOM 0 H ALA A 133 5.388 5.103 11.616 1.00 0.00 H new ATOM 0 HA ALA A 133 3.603 4.733 9.440 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.885 5.263 11.080 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.088 4.138 11.754 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.125 5.858 12.210 1.00 0.00 H new ATOM 165 N MET A 134 2.992 7.018 8.567 1.00 0.00 N ATOM 166 CA MET A 134 2.793 8.299 7.892 1.00 0.00 C ATOM 167 C MET A 134 1.302 8.639 7.860 1.00 0.00 C ATOM 168 O MET A 134 0.468 7.765 8.122 1.00 0.00 O ATOM 169 CB MET A 134 3.366 8.282 6.466 1.00 0.00 C ATOM 170 CG MET A 134 4.872 8.042 6.372 1.00 0.00 C ATOM 171 SD MET A 134 5.496 8.588 4.764 1.00 0.00 S ATOM 172 CE MET A 134 7.223 8.164 5.026 1.00 0.00 C ATOM 0 H MET A 134 2.553 6.234 8.084 1.00 0.00 H new ATOM 0 HA MET A 134 3.329 9.065 8.453 1.00 0.00 H new ATOM 0 HB2 MET A 134 2.855 7.507 5.896 1.00 0.00 H new ATOM 0 HB3 MET A 134 3.136 9.234 5.988 1.00 0.00 H new ATOM 0 HG2 MET A 134 5.383 8.580 7.170 1.00 0.00 H new ATOM 0 HG3 MET A 134 5.088 6.983 6.513 1.00 0.00 H new ATOM 0 HE1 MET A 134 7.853 8.811 4.416 1.00 0.00 H new ATOM 0 HE2 MET A 134 7.475 8.299 6.078 1.00 0.00 H new ATOM 0 HE3 MET A 134 7.389 7.124 4.744 1.00 0.00 H new ATOM 182 N SER A 135 0.975 9.877 7.483 1.00 0.00 N ATOM 183 CA SER A 135 -0.318 10.240 6.916 1.00 0.00 C ATOM 184 C SER A 135 -0.370 9.743 5.462 1.00 0.00 C ATOM 185 O SER A 135 0.642 9.303 4.908 1.00 0.00 O ATOM 186 CB SER A 135 -0.463 11.768 6.996 1.00 0.00 C ATOM 187 OG SER A 135 -1.764 12.225 6.669 1.00 0.00 O ATOM 0 H SER A 135 1.615 10.667 7.566 1.00 0.00 H new ATOM 0 HA SER A 135 -1.142 9.782 7.464 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.212 12.098 8.004 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.257 12.230 6.321 1.00 0.00 H new ATOM 0 HG SER A 135 -1.795 13.202 6.739 1.00 0.00 H new ATOM 193 N ARG A 136 -1.538 9.848 4.822 1.00 0.00 N ATOM 194 CA ARG A 136 -1.704 9.479 3.416 1.00 0.00 C ATOM 195 C ARG A 136 -0.822 10.361 2.521 1.00 0.00 C ATOM 196 O ARG A 136 -0.906 11.587 2.633 1.00 0.00 O ATOM 197 CB ARG A 136 -3.187 9.509 2.997 1.00 0.00 C ATOM 198 CG ARG A 136 -3.936 10.840 3.183 1.00 0.00 C ATOM 199 CD ARG A 136 -3.931 11.802 1.976 1.00 0.00 C ATOM 200 NE ARG A 136 -3.354 13.099 2.361 1.00 0.00 N ATOM 201 CZ ARG A 136 -3.945 14.290 2.501 1.00 0.00 C ATOM 202 NH1 ARG A 136 -5.140 14.537 1.979 1.00 0.00 N ATOM 203 NH2 ARG A 136 -3.323 15.235 3.195 1.00 0.00 N ATOM 0 H ARG A 136 -2.392 10.190 5.263 1.00 0.00 H new ATOM 0 HA ARG A 136 -1.370 8.449 3.287 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.248 9.229 1.945 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.715 8.741 3.562 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -4.972 10.617 3.438 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -3.502 11.360 4.037 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.355 11.368 1.159 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.948 11.943 1.610 1.00 0.00 H new ATOM 0 HE ARG A 136 -2.352 13.088 2.550 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.629 13.810 1.457 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.570 15.454 2.100 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -2.411 15.046 3.610 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -3.757 16.150 3.313 1.00 0.00 H new ATOM 217 N PRO A 137 -0.001 9.785 1.633 1.00 0.00 N ATOM 218 CA PRO A 137 0.652 10.511 0.557 1.00 0.00 C ATOM 219 C PRO A 137 -0.367 10.870 -0.528 1.00 0.00 C ATOM 220 O PRO A 137 -1.500 10.373 -0.537 1.00 0.00 O ATOM 221 CB PRO A 137 1.736 9.572 0.027 1.00 0.00 C ATOM 222 CG PRO A 137 1.148 8.198 0.294 1.00 0.00 C ATOM 223 CD PRO A 137 0.335 8.379 1.573 1.00 0.00 C ATOM 0 HA PRO A 137 1.086 11.452 0.894 1.00 0.00 H new ATOM 0 HB2 PRO A 137 1.926 9.732 -1.034 1.00 0.00 H new ATOM 0 HB3 PRO A 137 2.684 9.714 0.546 1.00 0.00 H new ATOM 0 HG2 PRO A 137 0.520 7.866 -0.533 1.00 0.00 H new ATOM 0 HG3 PRO A 137 1.929 7.449 0.422 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -0.564 7.763 1.555 1.00 0.00 H new ATOM 0 HD3 PRO A 137 0.911 8.077 2.448 1.00 0.00 H new ATOM 231 N MET A 138 0.067 11.707 -1.468 1.00 0.00 N ATOM 232 CA MET A 138 -0.758 12.308 -2.505 1.00 0.00 C ATOM 233 C MET A 138 -0.544 11.566 -3.821 1.00 0.00 C ATOM 234 O MET A 138 0.329 11.901 -4.624 1.00 0.00 O ATOM 235 CB MET A 138 -0.473 13.812 -2.609 1.00 0.00 C ATOM 236 CG MET A 138 1.013 14.151 -2.796 1.00 0.00 C ATOM 237 SD MET A 138 1.751 15.233 -1.535 1.00 0.00 S ATOM 238 CE MET A 138 1.526 14.245 -0.027 1.00 0.00 C ATOM 0 H MET A 138 1.044 11.995 -1.527 1.00 0.00 H new ATOM 0 HA MET A 138 -1.813 12.212 -2.248 1.00 0.00 H new ATOM 0 HB2 MET A 138 -1.038 14.222 -3.446 1.00 0.00 H new ATOM 0 HB3 MET A 138 -0.837 14.304 -1.707 1.00 0.00 H new ATOM 0 HG2 MET A 138 1.577 13.219 -2.821 1.00 0.00 H new ATOM 0 HG3 MET A 138 1.137 14.625 -3.770 1.00 0.00 H new ATOM 0 HE1 MET A 138 1.917 14.794 0.830 1.00 0.00 H new ATOM 0 HE2 MET A 138 0.465 14.046 0.123 1.00 0.00 H new ATOM 0 HE3 MET A 138 2.061 13.301 -0.127 1.00 0.00 H new ATOM 248 N ILE A 139 -1.320 10.511 -4.025 1.00 0.00 N ATOM 249 CA ILE A 139 -1.259 9.691 -5.229 1.00 0.00 C ATOM 250 C ILE A 139 -2.164 10.327 -6.285 1.00 0.00 C ATOM 251 O ILE A 139 -3.201 10.903 -5.946 1.00 0.00 O ATOM 252 CB ILE A 139 -1.651 8.226 -4.917 1.00 0.00 C ATOM 253 CG1 ILE A 139 -0.962 7.650 -3.657 1.00 0.00 C ATOM 254 CG2 ILE A 139 -1.323 7.346 -6.134 1.00 0.00 C ATOM 255 CD1 ILE A 139 0.553 7.586 -3.785 1.00 0.00 C ATOM 0 H ILE A 139 -2.018 10.196 -3.352 1.00 0.00 H new ATOM 0 HA ILE A 139 -0.241 9.654 -5.616 1.00 0.00 H new ATOM 0 HB ILE A 139 -2.721 8.224 -4.707 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -1.223 8.263 -2.795 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -1.348 6.649 -3.464 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -1.597 6.313 -5.920 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -1.884 7.698 -7.000 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -0.255 7.402 -6.346 1.00 0.00 H new ATOM 0 HD11 ILE A 139 0.978 7.174 -2.870 1.00 0.00 H new ATOM 0 HD12 ILE A 139 0.820 6.949 -4.629 1.00 0.00 H new ATOM 0 HD13 ILE A 139 0.947 8.589 -3.948 1.00 0.00 H new ATOM 267 N HIS A 140 -1.804 10.203 -7.563 1.00 0.00 N ATOM 268 CA HIS A 140 -2.572 10.733 -8.681 1.00 0.00 C ATOM 269 C HIS A 140 -2.447 9.748 -9.841 1.00 0.00 C ATOM 270 O HIS A 140 -1.538 9.863 -10.661 1.00 0.00 O ATOM 271 CB HIS A 140 -2.075 12.148 -9.021 1.00 0.00 C ATOM 272 CG HIS A 140 -2.486 13.149 -7.970 1.00 0.00 C ATOM 273 ND1 HIS A 140 -3.766 13.614 -7.780 1.00 0.00 N ATOM 274 CD2 HIS A 140 -1.702 13.666 -6.973 1.00 0.00 C ATOM 275 CE1 HIS A 140 -3.755 14.396 -6.692 1.00 0.00 C ATOM 276 NE2 HIS A 140 -2.521 14.463 -6.162 1.00 0.00 N ATOM 0 H HIS A 140 -0.953 9.721 -7.852 1.00 0.00 H new ATOM 0 HA HIS A 140 -3.630 10.834 -8.439 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -0.989 12.141 -9.112 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -2.474 12.451 -9.989 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -0.645 13.491 -6.837 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -4.621 14.904 -6.294 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -2.238 14.989 -5.335 1.00 0.00 H new ATOM 284 N PHE A 141 -3.320 8.738 -9.890 1.00 0.00 N ATOM 285 CA PHE A 141 -3.300 7.650 -10.878 1.00 0.00 C ATOM 286 C PHE A 141 -3.543 8.130 -12.315 1.00 0.00 C ATOM 287 O PHE A 141 -3.344 7.369 -13.263 1.00 0.00 O ATOM 288 CB PHE A 141 -4.344 6.585 -10.499 1.00 0.00 C ATOM 289 CG PHE A 141 -4.098 5.968 -9.132 1.00 0.00 C ATOM 290 CD1 PHE A 141 -4.607 6.561 -7.959 1.00 0.00 C ATOM 291 CD2 PHE A 141 -3.287 4.823 -9.032 1.00 0.00 C ATOM 292 CE1 PHE A 141 -4.284 6.020 -6.702 1.00 0.00 C ATOM 293 CE2 PHE A 141 -3.001 4.255 -7.780 1.00 0.00 C ATOM 294 CZ PHE A 141 -3.489 4.865 -6.614 1.00 0.00 C ATOM 0 H PHE A 141 -4.086 8.650 -9.222 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.297 7.224 -10.857 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -5.336 7.036 -10.514 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -4.341 5.797 -11.252 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -5.245 7.430 -8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -2.880 4.376 -9.927 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -4.648 6.493 -5.802 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.409 3.354 -7.715 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.253 4.446 -5.647 1.00 0.00 H new ATOM 304 N GLY A 142 -3.985 9.377 -12.487 1.00 0.00 N ATOM 305 CA GLY A 142 -4.395 9.921 -13.769 1.00 0.00 C ATOM 306 C GLY A 142 -5.854 9.589 -14.077 1.00 0.00 C ATOM 307 O GLY A 142 -6.287 9.781 -15.213 1.00 0.00 O ATOM 0 H GLY A 142 -4.067 10.044 -11.720 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -4.260 11.003 -13.767 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -3.756 9.521 -14.556 1.00 0.00 H new ATOM 311 N ASN A 143 -6.606 9.043 -13.116 1.00 0.00 N ATOM 312 CA ASN A 143 -8.021 8.739 -13.214 1.00 0.00 C ATOM 313 C ASN A 143 -8.752 9.538 -12.145 1.00 0.00 C ATOM 314 O ASN A 143 -8.130 10.094 -11.237 1.00 0.00 O ATOM 315 CB ASN A 143 -8.267 7.262 -12.885 1.00 0.00 C ATOM 316 CG ASN A 143 -7.399 6.264 -13.630 1.00 0.00 C ATOM 317 OD1 ASN A 143 -6.181 6.241 -13.524 1.00 0.00 O ATOM 318 ND2 ASN A 143 -8.025 5.397 -14.382 1.00 0.00 N ATOM 0 H ASN A 143 -6.217 8.792 -12.207 1.00 0.00 H new ATOM 0 HA ASN A 143 -8.364 8.973 -14.222 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.116 7.118 -11.815 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -9.312 7.032 -13.093 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -7.497 4.688 -14.891 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -9.042 5.429 -14.460 1.00 0.00 H new ATOM 325 N ASP A 144 -10.079 9.450 -12.163 1.00 0.00 N ATOM 326 CA ASP A 144 -10.927 9.904 -11.062 1.00 0.00 C ATOM 327 C ASP A 144 -11.388 8.706 -10.253 1.00 0.00 C ATOM 328 O ASP A 144 -11.456 8.781 -9.023 1.00 0.00 O ATOM 329 CB ASP A 144 -12.158 10.669 -11.569 1.00 0.00 C ATOM 330 CG ASP A 144 -11.782 11.964 -12.268 1.00 0.00 C ATOM 331 OD1 ASP A 144 -11.417 12.947 -11.582 1.00 0.00 O ATOM 332 OD2 ASP A 144 -11.782 11.966 -13.518 1.00 0.00 O ATOM 0 H ASP A 144 -10.601 9.059 -12.947 1.00 0.00 H new ATOM 0 HA ASP A 144 -10.337 10.580 -10.444 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -12.719 10.036 -12.257 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -12.818 10.890 -10.730 1.00 0.00 H new ATOM 337 N TRP A 145 -11.707 7.590 -10.917 1.00 0.00 N ATOM 338 CA TRP A 145 -12.265 6.450 -10.215 1.00 0.00 C ATOM 339 C TRP A 145 -11.241 5.837 -9.252 1.00 0.00 C ATOM 340 O TRP A 145 -11.567 5.584 -8.094 1.00 0.00 O ATOM 341 CB TRP A 145 -12.970 5.468 -11.147 1.00 0.00 C ATOM 342 CG TRP A 145 -12.168 4.284 -11.515 1.00 0.00 C ATOM 343 CD1 TRP A 145 -11.162 4.288 -12.399 1.00 0.00 C ATOM 344 CD2 TRP A 145 -12.165 2.977 -10.891 1.00 0.00 C ATOM 345 NE1 TRP A 145 -10.597 3.029 -12.466 1.00 0.00 N ATOM 346 CE2 TRP A 145 -11.101 2.225 -11.461 1.00 0.00 C ATOM 347 CE3 TRP A 145 -12.899 2.393 -9.841 1.00 0.00 C ATOM 348 CZ2 TRP A 145 -10.727 0.985 -10.935 1.00 0.00 C ATOM 349 CZ3 TRP A 145 -12.612 1.090 -9.402 1.00 0.00 C ATOM 350 CH2 TRP A 145 -11.498 0.406 -9.912 1.00 0.00 C ATOM 0 H TRP A 145 -11.588 7.461 -11.922 1.00 0.00 H new ATOM 0 HA TRP A 145 -13.074 6.802 -9.576 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -13.891 5.132 -10.670 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -13.256 5.994 -12.058 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -10.841 5.145 -12.972 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -9.907 2.735 -13.158 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -13.692 2.953 -9.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -9.852 0.476 -11.312 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -13.249 0.614 -8.671 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -11.233 -0.564 -9.519 1.00 0.00 H new ATOM 361 N GLU A 146 -9.994 5.687 -9.708 1.00 0.00 N ATOM 362 CA GLU A 146 -8.895 5.124 -8.929 1.00 0.00 C ATOM 363 C GLU A 146 -8.529 6.038 -7.757 1.00 0.00 C ATOM 364 O GLU A 146 -8.181 5.587 -6.670 1.00 0.00 O ATOM 365 CB GLU A 146 -7.671 4.953 -9.840 1.00 0.00 C ATOM 366 CG GLU A 146 -7.920 3.904 -10.929 1.00 0.00 C ATOM 367 CD GLU A 146 -6.763 2.927 -11.074 1.00 0.00 C ATOM 368 OE1 GLU A 146 -5.633 3.378 -11.353 1.00 0.00 O ATOM 369 OE2 GLU A 146 -6.940 1.701 -10.875 1.00 0.00 O ATOM 0 H GLU A 146 -9.718 5.961 -10.651 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.209 4.160 -8.529 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -7.426 5.908 -10.304 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.809 4.659 -9.241 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -8.830 3.352 -10.695 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -8.088 4.407 -11.881 1.00 0.00 H new ATOM 376 N ASP A 147 -8.631 7.351 -7.970 1.00 0.00 N ATOM 377 CA ASP A 147 -8.311 8.353 -6.958 1.00 0.00 C ATOM 378 C ASP A 147 -9.301 8.296 -5.795 1.00 0.00 C ATOM 379 O ASP A 147 -8.984 8.674 -4.669 1.00 0.00 O ATOM 380 CB ASP A 147 -8.324 9.738 -7.624 1.00 0.00 C ATOM 381 CG ASP A 147 -7.665 10.829 -6.780 1.00 0.00 C ATOM 382 OD1 ASP A 147 -6.983 10.522 -5.784 1.00 0.00 O ATOM 383 OD2 ASP A 147 -7.807 12.029 -7.108 1.00 0.00 O ATOM 0 H ASP A 147 -8.940 7.749 -8.857 1.00 0.00 H new ATOM 0 HA ASP A 147 -7.322 8.153 -6.545 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -7.813 9.675 -8.585 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -9.356 10.023 -7.830 1.00 0.00 H new ATOM 388 N ARG A 148 -10.520 7.817 -6.043 1.00 0.00 N ATOM 389 CA ARG A 148 -11.490 7.507 -5.014 1.00 0.00 C ATOM 390 C ARG A 148 -11.216 6.115 -4.439 1.00 0.00 C ATOM 391 O ARG A 148 -11.163 6.014 -3.219 1.00 0.00 O ATOM 392 CB ARG A 148 -12.871 7.661 -5.647 1.00 0.00 C ATOM 393 CG ARG A 148 -13.983 7.263 -4.692 1.00 0.00 C ATOM 394 CD ARG A 148 -15.344 7.510 -5.346 1.00 0.00 C ATOM 395 NE ARG A 148 -16.413 7.598 -4.349 1.00 0.00 N ATOM 396 CZ ARG A 148 -17.082 8.699 -3.994 1.00 0.00 C ATOM 397 NH1 ARG A 148 -16.777 9.902 -4.469 1.00 0.00 N ATOM 398 NH2 ARG A 148 -18.084 8.567 -3.140 1.00 0.00 N ATOM 0 H ARG A 148 -10.860 7.633 -6.987 1.00 0.00 H new ATOM 0 HA ARG A 148 -11.427 8.183 -4.161 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -13.014 8.696 -5.958 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -12.928 7.047 -6.546 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -13.884 6.211 -4.423 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -13.904 7.837 -3.769 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -15.308 8.433 -5.924 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -15.564 6.704 -6.046 1.00 0.00 H new ATOM 0 HE ARG A 148 -16.673 6.731 -3.878 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -16.007 10.009 -5.130 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -17.313 10.718 -4.173 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -18.324 7.646 -2.774 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -18.616 9.387 -2.847 1.00 0.00 H new ATOM 412 N TYR A 149 -10.962 5.099 -5.273 1.00 0.00 N ATOM 413 CA TYR A 149 -10.675 3.719 -4.863 1.00 0.00 C ATOM 414 C TYR A 149 -9.610 3.674 -3.765 1.00 0.00 C ATOM 415 O TYR A 149 -9.759 2.954 -2.776 1.00 0.00 O ATOM 416 CB TYR A 149 -10.226 2.913 -6.086 1.00 0.00 C ATOM 417 CG TYR A 149 -10.084 1.410 -5.911 1.00 0.00 C ATOM 418 CD1 TYR A 149 -8.955 0.851 -5.280 1.00 0.00 C ATOM 419 CD2 TYR A 149 -11.020 0.560 -6.523 1.00 0.00 C ATOM 420 CE1 TYR A 149 -8.749 -0.540 -5.294 1.00 0.00 C ATOM 421 CE2 TYR A 149 -10.796 -0.824 -6.594 1.00 0.00 C ATOM 422 CZ TYR A 149 -9.655 -1.382 -5.980 1.00 0.00 C ATOM 423 OH TYR A 149 -9.453 -2.723 -6.075 1.00 0.00 O ATOM 0 H TYR A 149 -10.950 5.219 -6.286 1.00 0.00 H new ATOM 0 HA TYR A 149 -11.583 3.279 -4.451 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -10.939 3.094 -6.891 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -9.265 3.307 -6.417 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -8.244 1.494 -4.783 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -11.923 0.976 -6.944 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -7.899 -0.965 -4.781 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -11.495 -1.460 -7.117 1.00 0.00 H new ATOM 0 HH TYR A 149 -8.640 -2.967 -5.585 1.00 0.00 H new ATOM 433 N TYR A 150 -8.555 4.476 -3.920 1.00 0.00 N ATOM 434 CA TYR A 150 -7.510 4.694 -2.931 1.00 0.00 C ATOM 435 C TYR A 150 -8.100 5.063 -1.566 1.00 0.00 C ATOM 436 O TYR A 150 -7.852 4.387 -0.568 1.00 0.00 O ATOM 437 CB TYR A 150 -6.588 5.798 -3.469 1.00 0.00 C ATOM 438 CG TYR A 150 -5.496 6.263 -2.525 1.00 0.00 C ATOM 439 CD1 TYR A 150 -4.517 5.362 -2.064 1.00 0.00 C ATOM 440 CD2 TYR A 150 -5.441 7.613 -2.131 1.00 0.00 C ATOM 441 CE1 TYR A 150 -3.474 5.817 -1.237 1.00 0.00 C ATOM 442 CE2 TYR A 150 -4.390 8.074 -1.322 1.00 0.00 C ATOM 443 CZ TYR A 150 -3.387 7.185 -0.892 1.00 0.00 C ATOM 444 OH TYR A 150 -2.331 7.662 -0.181 1.00 0.00 O ATOM 0 H TYR A 150 -8.404 5.011 -4.775 1.00 0.00 H new ATOM 0 HA TYR A 150 -6.941 3.778 -2.774 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -6.121 5.440 -4.387 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -7.201 6.658 -3.738 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -4.567 4.321 -2.346 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -6.211 8.298 -2.453 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -2.738 5.120 -0.865 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -4.351 9.113 -1.029 1.00 0.00 H new ATOM 0 HH TYR A 150 -2.185 8.605 -0.405 1.00 0.00 H new ATOM 454 N ARG A 151 -8.918 6.116 -1.517 1.00 0.00 N ATOM 455 CA ARG A 151 -9.476 6.671 -0.283 1.00 0.00 C ATOM 456 C ARG A 151 -10.443 5.722 0.414 1.00 0.00 C ATOM 457 O ARG A 151 -10.799 5.969 1.571 1.00 0.00 O ATOM 458 CB ARG A 151 -10.196 7.987 -0.595 1.00 0.00 C ATOM 459 CG ARG A 151 -9.205 9.115 -0.916 1.00 0.00 C ATOM 460 CD ARG A 151 -9.953 10.364 -1.380 1.00 0.00 C ATOM 461 NE ARG A 151 -10.353 10.237 -2.784 1.00 0.00 N ATOM 462 CZ ARG A 151 -11.281 10.952 -3.424 1.00 0.00 C ATOM 463 NH1 ARG A 151 -12.086 11.780 -2.768 1.00 0.00 N ATOM 464 NH2 ARG A 151 -11.389 10.822 -4.739 1.00 0.00 N ATOM 0 H ARG A 151 -9.217 6.618 -2.353 1.00 0.00 H new ATOM 0 HA ARG A 151 -8.641 6.836 0.398 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -10.869 7.842 -1.440 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -10.812 8.275 0.257 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -8.609 9.347 -0.033 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -8.512 8.789 -1.692 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -10.835 10.518 -0.758 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -9.318 11.241 -1.256 1.00 0.00 H new ATOM 0 HE ARG A 151 -9.870 9.525 -3.332 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -12.002 11.879 -1.756 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -12.789 12.317 -3.276 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -10.770 10.185 -5.241 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.091 11.359 -5.249 1.00 0.00 H new ATOM 478 N GLU A 152 -10.882 4.659 -0.250 1.00 0.00 N ATOM 479 CA GLU A 152 -11.820 3.685 0.299 1.00 0.00 C ATOM 480 C GLU A 152 -11.139 2.331 0.530 1.00 0.00 C ATOM 481 O GLU A 152 -11.798 1.335 0.829 1.00 0.00 O ATOM 482 CB GLU A 152 -13.118 3.674 -0.516 1.00 0.00 C ATOM 483 CG GLU A 152 -12.949 3.246 -1.975 1.00 0.00 C ATOM 484 CD GLU A 152 -14.176 3.549 -2.847 1.00 0.00 C ATOM 485 OE1 GLU A 152 -15.290 3.741 -2.302 1.00 0.00 O ATOM 486 OE2 GLU A 152 -14.020 3.655 -4.078 1.00 0.00 O ATOM 0 H GLU A 152 -10.591 4.445 -1.204 1.00 0.00 H new ATOM 0 HA GLU A 152 -12.137 3.980 1.299 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -13.829 3.003 -0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -13.555 4.672 -0.492 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -12.080 3.752 -2.396 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -12.743 2.176 -2.010 1.00 0.00 H new ATOM 493 N ASN A 153 -9.807 2.291 0.438 1.00 0.00 N ATOM 494 CA ASN A 153 -8.995 1.100 0.676 1.00 0.00 C ATOM 495 C ASN A 153 -7.733 1.368 1.494 1.00 0.00 C ATOM 496 O ASN A 153 -7.111 0.410 1.950 1.00 0.00 O ATOM 497 CB ASN A 153 -8.605 0.502 -0.676 1.00 0.00 C ATOM 498 CG ASN A 153 -9.739 -0.333 -1.228 1.00 0.00 C ATOM 499 OD1 ASN A 153 -9.930 -1.476 -0.815 1.00 0.00 O ATOM 500 ND2 ASN A 153 -10.524 0.209 -2.143 1.00 0.00 N ATOM 0 H ASN A 153 -9.251 3.109 0.189 1.00 0.00 H new ATOM 0 HA ASN A 153 -9.600 0.410 1.265 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -8.358 1.300 -1.376 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -7.712 -0.113 -0.565 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -11.308 -0.322 -2.522 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -10.346 1.159 -2.470 1.00 0.00 H new ATOM 507 N MET A 154 -7.348 2.631 1.699 1.00 0.00 N ATOM 508 CA MET A 154 -6.046 3.035 2.232 1.00 0.00 C ATOM 509 C MET A 154 -5.704 2.395 3.584 1.00 0.00 C ATOM 510 O MET A 154 -4.534 2.146 3.876 1.00 0.00 O ATOM 511 CB MET A 154 -5.961 4.571 2.274 1.00 0.00 C ATOM 512 CG MET A 154 -6.857 5.222 3.339 1.00 0.00 C ATOM 513 SD MET A 154 -7.629 6.813 2.918 1.00 0.00 S ATOM 514 CE MET A 154 -6.221 7.707 2.214 1.00 0.00 C ATOM 0 H MET A 154 -7.954 3.425 1.492 1.00 0.00 H new ATOM 0 HA MET A 154 -5.283 2.654 1.553 1.00 0.00 H new ATOM 0 HB2 MET A 154 -4.927 4.862 2.458 1.00 0.00 H new ATOM 0 HB3 MET A 154 -6.233 4.966 1.295 1.00 0.00 H new ATOM 0 HG2 MET A 154 -7.650 4.518 3.589 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.261 5.364 4.241 1.00 0.00 H new ATOM 0 HE1 MET A 154 -6.313 8.769 2.443 1.00 0.00 H new ATOM 0 HE2 MET A 154 -5.295 7.323 2.642 1.00 0.00 H new ATOM 0 HE3 MET A 154 -6.206 7.569 1.133 1.00 0.00 H new ATOM 524 N TYR A 155 -6.711 2.059 4.397 1.00 0.00 N ATOM 525 CA TYR A 155 -6.513 1.394 5.682 1.00 0.00 C ATOM 526 C TYR A 155 -5.805 0.035 5.545 1.00 0.00 C ATOM 527 O TYR A 155 -5.078 -0.370 6.453 1.00 0.00 O ATOM 528 CB TYR A 155 -7.858 1.277 6.415 1.00 0.00 C ATOM 529 CG TYR A 155 -8.769 0.163 5.933 1.00 0.00 C ATOM 530 CD1 TYR A 155 -9.657 0.366 4.857 1.00 0.00 C ATOM 531 CD2 TYR A 155 -8.686 -1.105 6.539 1.00 0.00 C ATOM 532 CE1 TYR A 155 -10.440 -0.702 4.379 1.00 0.00 C ATOM 533 CE2 TYR A 155 -9.479 -2.168 6.079 1.00 0.00 C ATOM 534 CZ TYR A 155 -10.362 -1.975 4.995 1.00 0.00 C ATOM 535 OH TYR A 155 -11.082 -3.017 4.501 1.00 0.00 O ATOM 0 H TYR A 155 -7.690 2.243 4.178 1.00 0.00 H new ATOM 0 HA TYR A 155 -5.841 2.009 6.282 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -7.662 1.129 7.477 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -8.388 2.224 6.318 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -9.737 1.341 4.399 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -8.007 -1.261 7.364 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -11.102 -0.550 3.540 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -9.413 -3.135 6.555 1.00 0.00 H new ATOM 0 HH TYR A 155 -10.912 -3.817 5.041 1.00 0.00 H new ATOM 545 N ARG A 156 -5.988 -0.656 4.413 1.00 0.00 N ATOM 546 CA ARG A 156 -5.465 -2.000 4.147 1.00 0.00 C ATOM 547 C ARG A 156 -3.977 -1.959 3.800 1.00 0.00 C ATOM 548 O ARG A 156 -3.298 -2.986 3.881 1.00 0.00 O ATOM 549 CB ARG A 156 -6.259 -2.631 2.981 1.00 0.00 C ATOM 550 CG ARG A 156 -7.760 -2.744 3.281 1.00 0.00 C ATOM 551 CD ARG A 156 -8.636 -3.014 2.054 1.00 0.00 C ATOM 552 NE ARG A 156 -8.681 -4.435 1.672 1.00 0.00 N ATOM 553 CZ ARG A 156 -9.514 -4.950 0.755 1.00 0.00 C ATOM 554 NH1 ARG A 156 -10.269 -4.161 -0.009 1.00 0.00 N ATOM 555 NH2 ARG A 156 -9.566 -6.265 0.600 1.00 0.00 N ATOM 0 H ARG A 156 -6.523 -0.281 3.630 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.581 -2.602 5.048 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -6.116 -2.031 2.082 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -5.859 -3.623 2.769 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -7.913 -3.545 4.004 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -8.094 -1.820 3.753 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -9.649 -2.667 2.256 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -8.261 -2.431 1.213 1.00 0.00 H new ATOM 0 HE ARG A 156 -8.034 -5.072 2.137 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -10.219 -3.148 0.098 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -10.897 -4.570 -0.701 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -8.978 -6.870 1.174 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -10.194 -6.672 -0.093 1.00 0.00 H new ATOM 569 N TYR A 157 -3.473 -0.806 3.370 1.00 0.00 N ATOM 570 CA TYR A 157 -2.120 -0.627 2.865 1.00 0.00 C ATOM 571 C TYR A 157 -1.173 -0.361 4.049 1.00 0.00 C ATOM 572 O TYR A 157 -1.644 -0.125 5.168 1.00 0.00 O ATOM 573 CB TYR A 157 -2.185 0.500 1.816 1.00 0.00 C ATOM 574 CG TYR A 157 -3.171 0.297 0.668 1.00 0.00 C ATOM 575 CD1 TYR A 157 -3.593 -0.989 0.270 1.00 0.00 C ATOM 576 CD2 TYR A 157 -3.659 1.418 -0.030 1.00 0.00 C ATOM 577 CE1 TYR A 157 -4.510 -1.158 -0.779 1.00 0.00 C ATOM 578 CE2 TYR A 157 -4.593 1.261 -1.069 1.00 0.00 C ATOM 579 CZ TYR A 157 -5.031 -0.026 -1.447 1.00 0.00 C ATOM 580 OH TYR A 157 -5.932 -0.141 -2.460 1.00 0.00 O ATOM 0 H TYR A 157 -4.016 0.058 3.364 1.00 0.00 H new ATOM 0 HA TYR A 157 -1.716 -1.511 2.372 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -2.440 1.429 2.326 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -1.189 0.632 1.393 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -3.204 -1.857 0.781 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -3.313 2.406 0.235 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -4.817 -2.150 -1.075 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -4.978 2.131 -1.581 1.00 0.00 H new ATOM 0 HH TYR A 157 -6.380 -1.011 -2.402 1.00 0.00 H new ATOM 590 N PRO A 158 0.162 -0.435 3.881 1.00 0.00 N ATOM 591 CA PRO A 158 1.081 -0.213 4.993 1.00 0.00 C ATOM 592 C PRO A 158 1.019 1.245 5.453 1.00 0.00 C ATOM 593 O PRO A 158 0.796 2.137 4.636 1.00 0.00 O ATOM 594 CB PRO A 158 2.473 -0.572 4.466 1.00 0.00 C ATOM 595 CG PRO A 158 2.343 -0.324 2.968 1.00 0.00 C ATOM 596 CD PRO A 158 0.913 -0.778 2.682 1.00 0.00 C ATOM 0 HA PRO A 158 0.824 -0.822 5.859 1.00 0.00 H new ATOM 0 HB2 PRO A 158 3.248 0.051 4.913 1.00 0.00 H new ATOM 0 HB3 PRO A 158 2.733 -1.608 4.683 1.00 0.00 H new ATOM 0 HG2 PRO A 158 2.494 0.726 2.716 1.00 0.00 H new ATOM 0 HG3 PRO A 158 3.073 -0.897 2.397 1.00 0.00 H new ATOM 0 HD2 PRO A 158 0.507 -0.275 1.805 1.00 0.00 H new ATOM 0 HD3 PRO A 158 0.871 -1.849 2.483 1.00 0.00 H new ATOM 604 N ASN A 159 1.295 1.517 6.734 1.00 0.00 N ATOM 605 CA ASN A 159 1.447 2.904 7.186 1.00 0.00 C ATOM 606 C ASN A 159 2.875 3.390 6.955 1.00 0.00 C ATOM 607 O ASN A 159 3.095 4.601 6.977 1.00 0.00 O ATOM 608 CB ASN A 159 1.129 3.077 8.684 1.00 0.00 C ATOM 609 CG ASN A 159 -0.312 3.449 9.000 1.00 0.00 C ATOM 610 OD1 ASN A 159 -1.057 3.976 8.181 1.00 0.00 O ATOM 611 ND2 ASN A 159 -0.722 3.224 10.230 1.00 0.00 N ATOM 0 H ASN A 159 1.415 0.812 7.461 1.00 0.00 H new ATOM 0 HA ASN A 159 0.736 3.489 6.603 1.00 0.00 H new ATOM 0 HB2 ASN A 159 1.369 2.147 9.200 1.00 0.00 H new ATOM 0 HB3 ASN A 159 1.784 3.847 9.092 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.667 3.488 10.509 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.095 2.785 10.904 1.00 0.00 H new ATOM 618 N GLN A 160 3.831 2.462 6.825 1.00 0.00 N ATOM 619 CA GLN A 160 5.272 2.686 6.842 1.00 0.00 C ATOM 620 C GLN A 160 5.935 2.014 5.630 1.00 0.00 C ATOM 621 O GLN A 160 5.232 1.491 4.765 1.00 0.00 O ATOM 622 CB GLN A 160 5.914 2.209 8.166 1.00 0.00 C ATOM 623 CG GLN A 160 4.978 1.987 9.367 1.00 0.00 C ATOM 624 CD GLN A 160 5.686 1.584 10.660 1.00 0.00 C ATOM 625 OE1 GLN A 160 5.121 0.859 11.479 1.00 0.00 O ATOM 626 NE2 GLN A 160 6.885 2.074 10.919 1.00 0.00 N ATOM 0 H GLN A 160 3.599 1.477 6.698 1.00 0.00 H new ATOM 0 HA GLN A 160 5.441 3.761 6.776 1.00 0.00 H new ATOM 0 HB2 GLN A 160 6.437 1.273 7.969 1.00 0.00 H new ATOM 0 HB3 GLN A 160 6.668 2.940 8.457 1.00 0.00 H new ATOM 0 HG2 GLN A 160 4.416 2.903 9.547 1.00 0.00 H new ATOM 0 HG3 GLN A 160 4.254 1.214 9.109 1.00 0.00 H new ATOM 0 HE21 GLN A 160 7.349 2.674 10.237 1.00 0.00 H new ATOM 0 HE22 GLN A 160 7.347 1.852 11.801 1.00 0.00 H new ATOM 635 N VAL A 161 7.270 2.032 5.552 1.00 0.00 N ATOM 636 CA VAL A 161 8.036 1.538 4.411 1.00 0.00 C ATOM 637 C VAL A 161 9.370 0.961 4.900 1.00 0.00 C ATOM 638 O VAL A 161 9.964 1.508 5.829 1.00 0.00 O ATOM 639 CB VAL A 161 8.221 2.671 3.365 1.00 0.00 C ATOM 640 CG1 VAL A 161 7.235 2.443 2.216 1.00 0.00 C ATOM 641 CG2 VAL A 161 8.053 4.114 3.902 1.00 0.00 C ATOM 0 H VAL A 161 7.858 2.400 6.300 1.00 0.00 H new ATOM 0 HA VAL A 161 7.495 0.733 3.914 1.00 0.00 H new ATOM 0 HB VAL A 161 9.260 2.607 3.043 1.00 0.00 H new ATOM 0 HG11 VAL A 161 7.353 3.232 1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 161 7.433 1.476 1.753 1.00 0.00 H new ATOM 0 HG13 VAL A 161 6.216 2.459 2.603 1.00 0.00 H new ATOM 0 HG21 VAL A 161 8.203 4.824 3.089 1.00 0.00 H new ATOM 0 HG22 VAL A 161 7.050 4.236 4.310 1.00 0.00 H new ATOM 0 HG23 VAL A 161 8.788 4.299 4.685 1.00 0.00 H new ATOM 651 N TYR A 162 9.811 -0.150 4.296 1.00 0.00 N ATOM 652 CA TYR A 162 11.008 -0.913 4.615 1.00 0.00 C ATOM 653 C TYR A 162 12.118 -0.583 3.633 1.00 0.00 C ATOM 654 O TYR A 162 11.875 -0.612 2.431 1.00 0.00 O ATOM 655 CB TYR A 162 10.755 -2.406 4.432 1.00 0.00 C ATOM 656 CG TYR A 162 10.192 -3.139 5.617 1.00 0.00 C ATOM 657 CD1 TYR A 162 10.920 -3.207 6.819 1.00 0.00 C ATOM 658 CD2 TYR A 162 8.976 -3.822 5.490 1.00 0.00 C ATOM 659 CE1 TYR A 162 10.455 -3.999 7.881 1.00 0.00 C ATOM 660 CE2 TYR A 162 8.516 -4.624 6.540 1.00 0.00 C ATOM 661 CZ TYR A 162 9.267 -4.754 7.730 1.00 0.00 C ATOM 662 OH TYR A 162 8.870 -5.638 8.691 1.00 0.00 O ATOM 0 H TYR A 162 9.298 -0.562 3.517 1.00 0.00 H new ATOM 0 HA TYR A 162 11.276 -0.666 5.642 1.00 0.00 H new ATOM 0 HB2 TYR A 162 10.071 -2.536 3.593 1.00 0.00 H new ATOM 0 HB3 TYR A 162 11.696 -2.880 4.153 1.00 0.00 H new ATOM 0 HD1 TYR A 162 11.838 -2.649 6.925 1.00 0.00 H new ATOM 0 HD2 TYR A 162 8.395 -3.730 4.584 1.00 0.00 H new ATOM 0 HE1 TYR A 162 11.003 -4.032 8.811 1.00 0.00 H new ATOM 0 HE2 TYR A 162 7.578 -5.149 6.440 1.00 0.00 H new ATOM 0 HH TYR A 162 8.031 -6.065 8.417 1.00 0.00 H new ATOM 672 N TYR A 163 13.346 -0.390 4.108 1.00 0.00 N ATOM 673 CA TYR A 163 14.482 -0.045 3.257 1.00 0.00 C ATOM 674 C TYR A 163 15.819 -0.280 3.965 1.00 0.00 C ATOM 675 O TYR A 163 15.882 -0.306 5.195 1.00 0.00 O ATOM 676 CB TYR A 163 14.372 1.435 2.859 1.00 0.00 C ATOM 677 CG TYR A 163 14.329 2.404 4.028 1.00 0.00 C ATOM 678 CD1 TYR A 163 13.153 2.531 4.788 1.00 0.00 C ATOM 679 CD2 TYR A 163 15.440 3.201 4.348 1.00 0.00 C ATOM 680 CE1 TYR A 163 13.075 3.427 5.859 1.00 0.00 C ATOM 681 CE2 TYR A 163 15.368 4.119 5.407 1.00 0.00 C ATOM 682 CZ TYR A 163 14.188 4.240 6.178 1.00 0.00 C ATOM 683 OH TYR A 163 14.115 5.152 7.189 1.00 0.00 O ATOM 0 H TYR A 163 13.582 -0.469 5.097 1.00 0.00 H new ATOM 0 HA TYR A 163 14.455 -0.687 2.377 1.00 0.00 H new ATOM 0 HB2 TYR A 163 15.220 1.691 2.224 1.00 0.00 H new ATOM 0 HB3 TYR A 163 13.472 1.570 2.259 1.00 0.00 H new ATOM 0 HD1 TYR A 163 12.294 1.925 4.540 1.00 0.00 H new ATOM 0 HD2 TYR A 163 16.352 3.107 3.778 1.00 0.00 H new ATOM 0 HE1 TYR A 163 12.168 3.498 6.441 1.00 0.00 H new ATOM 0 HE2 TYR A 163 16.222 4.739 5.636 1.00 0.00 H new ATOM 0 HH TYR A 163 14.643 5.943 6.954 1.00 0.00 H new ATOM 693 N ARG A 164 16.901 -0.402 3.187 1.00 0.00 N ATOM 694 CA ARG A 164 18.276 -0.351 3.692 1.00 0.00 C ATOM 695 C ARG A 164 18.757 1.108 3.815 1.00 0.00 C ATOM 696 O ARG A 164 18.344 1.924 2.983 1.00 0.00 O ATOM 697 CB ARG A 164 19.203 -1.279 2.881 1.00 0.00 C ATOM 698 CG ARG A 164 19.922 -0.650 1.686 1.00 0.00 C ATOM 699 CD ARG A 164 18.968 -0.358 0.534 1.00 0.00 C ATOM 700 NE ARG A 164 18.675 -1.545 -0.280 1.00 0.00 N ATOM 701 CZ ARG A 164 19.449 -2.083 -1.231 1.00 0.00 C ATOM 702 NH1 ARG A 164 20.598 -1.515 -1.578 1.00 0.00 N ATOM 703 NH2 ARG A 164 19.066 -3.200 -1.830 1.00 0.00 N ATOM 0 H ARG A 164 16.845 -0.540 2.178 1.00 0.00 H new ATOM 0 HA ARG A 164 18.308 -0.749 4.706 1.00 0.00 H new ATOM 0 HB2 ARG A 164 19.956 -1.685 3.557 1.00 0.00 H new ATOM 0 HB3 ARG A 164 18.612 -2.120 2.519 1.00 0.00 H new ATOM 0 HG2 ARG A 164 20.405 0.275 2.000 1.00 0.00 H new ATOM 0 HG3 ARG A 164 20.710 -1.321 1.343 1.00 0.00 H new ATOM 0 HD2 ARG A 164 18.036 0.042 0.933 1.00 0.00 H new ATOM 0 HD3 ARG A 164 19.400 0.415 -0.102 1.00 0.00 H new ATOM 0 HE ARG A 164 17.785 -2.010 -0.101 1.00 0.00 H new ATOM 0 HH11 ARG A 164 20.902 -0.657 -1.118 1.00 0.00 H new ATOM 0 HH12 ARG A 164 21.177 -1.937 -2.304 1.00 0.00 H new ATOM 0 HH21 ARG A 164 18.187 -3.645 -1.566 1.00 0.00 H new ATOM 0 HH22 ARG A 164 19.650 -3.616 -2.555 1.00 0.00 H new ATOM 717 N PRO A 165 19.642 1.436 4.776 1.00 0.00 N ATOM 718 CA PRO A 165 20.034 2.803 5.131 1.00 0.00 C ATOM 719 C PRO A 165 20.700 3.511 3.974 1.00 0.00 C ATOM 720 O PRO A 165 21.297 2.901 3.088 1.00 0.00 O ATOM 721 CB PRO A 165 20.979 2.665 6.328 1.00 0.00 C ATOM 722 CG PRO A 165 21.583 1.277 6.133 1.00 0.00 C ATOM 723 CD PRO A 165 20.430 0.482 5.540 1.00 0.00 C ATOM 0 HA PRO A 165 19.165 3.412 5.380 1.00 0.00 H new ATOM 0 HB2 PRO A 165 21.744 3.441 6.329 1.00 0.00 H new ATOM 0 HB3 PRO A 165 20.445 2.743 7.275 1.00 0.00 H new ATOM 0 HG2 PRO A 165 22.443 1.301 5.463 1.00 0.00 H new ATOM 0 HG3 PRO A 165 21.925 0.850 7.076 1.00 0.00 H new ATOM 0 HD2 PRO A 165 20.797 -0.322 4.902 1.00 0.00 H new ATOM 0 HD3 PRO A 165 19.831 0.019 6.324 1.00 0.00 H new ATOM 731 N VAL A 166 20.551 4.828 3.989 1.00 0.00 N ATOM 732 CA VAL A 166 21.048 5.734 2.983 1.00 0.00 C ATOM 733 C VAL A 166 22.583 5.658 3.001 1.00 0.00 C ATOM 734 O VAL A 166 23.152 5.160 2.034 1.00 0.00 O ATOM 735 CB VAL A 166 20.348 7.096 3.227 1.00 0.00 C ATOM 736 CG1 VAL A 166 21.237 8.325 3.117 1.00 0.00 C ATOM 737 CG2 VAL A 166 19.160 7.246 2.264 1.00 0.00 C ATOM 0 H VAL A 166 20.056 5.308 4.741 1.00 0.00 H new ATOM 0 HA VAL A 166 20.806 5.494 1.948 1.00 0.00 H new ATOM 0 HB VAL A 166 20.028 7.063 4.269 1.00 0.00 H new ATOM 0 HG11 VAL A 166 20.645 9.220 3.306 1.00 0.00 H new ATOM 0 HG12 VAL A 166 22.040 8.260 3.851 1.00 0.00 H new ATOM 0 HG13 VAL A 166 21.664 8.377 2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 166 18.670 8.204 2.437 1.00 0.00 H new ATOM 0 HG22 VAL A 166 19.518 7.202 1.235 1.00 0.00 H new ATOM 0 HG23 VAL A 166 18.449 6.438 2.435 1.00 0.00 H new ATOM 822 N GLN A 172 19.776 5.073 -6.225 1.00 0.00 N ATOM 823 CA GLN A 172 18.468 5.308 -5.619 1.00 0.00 C ATOM 824 C GLN A 172 17.419 4.389 -6.228 1.00 0.00 C ATOM 825 O GLN A 172 16.617 3.823 -5.505 1.00 0.00 O ATOM 826 CB GLN A 172 18.034 6.783 -5.646 1.00 0.00 C ATOM 827 CG GLN A 172 17.097 7.277 -6.765 1.00 0.00 C ATOM 828 CD GLN A 172 16.494 8.635 -6.421 1.00 0.00 C ATOM 829 OE1 GLN A 172 17.116 9.677 -6.619 1.00 0.00 O ATOM 830 NE2 GLN A 172 15.258 8.652 -5.946 1.00 0.00 N ATOM 0 HA GLN A 172 18.565 5.061 -4.562 1.00 0.00 H new ATOM 0 HB2 GLN A 172 17.548 6.998 -4.694 1.00 0.00 H new ATOM 0 HB3 GLN A 172 18.939 7.389 -5.686 1.00 0.00 H new ATOM 0 HG2 GLN A 172 17.651 7.349 -7.701 1.00 0.00 H new ATOM 0 HG3 GLN A 172 16.299 6.551 -6.922 1.00 0.00 H new ATOM 0 HE21 GLN A 172 14.760 7.776 -5.789 1.00 0.00 H new ATOM 0 HE22 GLN A 172 14.804 9.541 -5.737 1.00 0.00 H new ATOM 839 N ASN A 173 17.384 4.247 -7.552 1.00 0.00 N ATOM 840 CA ASN A 173 16.271 3.581 -8.223 1.00 0.00 C ATOM 841 C ASN A 173 16.213 2.105 -7.859 1.00 0.00 C ATOM 842 O ASN A 173 15.162 1.555 -7.555 1.00 0.00 O ATOM 843 CB ASN A 173 16.404 3.702 -9.735 1.00 0.00 C ATOM 844 CG ASN A 173 15.217 2.977 -10.345 1.00 0.00 C ATOM 845 OD1 ASN A 173 14.072 3.392 -10.211 1.00 0.00 O ATOM 846 ND2 ASN A 173 15.457 1.820 -10.918 1.00 0.00 N ATOM 0 H ASN A 173 18.113 4.584 -8.180 1.00 0.00 H new ATOM 0 HA ASN A 173 15.356 4.071 -7.891 1.00 0.00 H new ATOM 0 HB2 ASN A 173 16.414 4.749 -10.039 1.00 0.00 H new ATOM 0 HB3 ASN A 173 17.341 3.262 -10.076 1.00 0.00 H new ATOM 0 HD21 ASN A 173 14.683 1.250 -11.260 1.00 0.00 H new ATOM 0 HD22 ASN A 173 16.417 1.491 -11.021 1.00 0.00 H new ATOM 853 N ASN A 174 17.382 1.480 -7.878 1.00 0.00 N ATOM 854 CA ASN A 174 17.589 0.113 -7.424 1.00 0.00 C ATOM 855 C ASN A 174 17.047 -0.085 -6.008 1.00 0.00 C ATOM 856 O ASN A 174 16.355 -1.067 -5.746 1.00 0.00 O ATOM 857 CB ASN A 174 19.093 -0.168 -7.490 1.00 0.00 C ATOM 858 CG ASN A 174 19.427 -1.644 -7.445 1.00 0.00 C ATOM 859 OD1 ASN A 174 19.248 -2.316 -6.435 1.00 0.00 O ATOM 860 ND2 ASN A 174 20.032 -2.146 -8.503 1.00 0.00 N ATOM 0 H ASN A 174 18.235 1.922 -8.219 1.00 0.00 H new ATOM 0 HA ASN A 174 17.047 -0.586 -8.061 1.00 0.00 H new ATOM 0 HB2 ASN A 174 19.496 0.261 -8.407 1.00 0.00 H new ATOM 0 HB3 ASN A 174 19.587 0.335 -6.659 1.00 0.00 H new ATOM 0 HD21 ASN A 174 20.362 -3.111 -8.492 1.00 0.00 H new ATOM 0 HD22 ASN A 174 20.171 -1.569 -9.333 1.00 0.00 H new ATOM 867 N PHE A 175 17.328 0.870 -5.118 1.00 0.00 N ATOM 868 CA PHE A 175 16.762 0.942 -3.780 1.00 0.00 C ATOM 869 C PHE A 175 15.245 1.128 -3.824 1.00 0.00 C ATOM 870 O PHE A 175 14.566 0.427 -3.086 1.00 0.00 O ATOM 871 CB PHE A 175 17.502 2.034 -2.988 1.00 0.00 C ATOM 872 CG PHE A 175 16.745 2.764 -1.889 1.00 0.00 C ATOM 873 CD1 PHE A 175 15.742 3.702 -2.199 1.00 0.00 C ATOM 874 CD2 PHE A 175 17.099 2.569 -0.544 1.00 0.00 C ATOM 875 CE1 PHE A 175 15.021 4.337 -1.179 1.00 0.00 C ATOM 876 CE2 PHE A 175 16.437 3.266 0.477 1.00 0.00 C ATOM 877 CZ PHE A 175 15.368 4.116 0.163 1.00 0.00 C ATOM 0 H PHE A 175 17.974 1.633 -5.320 1.00 0.00 H new ATOM 0 HA PHE A 175 16.909 -0.002 -3.256 1.00 0.00 H new ATOM 0 HB2 PHE A 175 18.384 1.579 -2.538 1.00 0.00 H new ATOM 0 HB3 PHE A 175 17.856 2.780 -3.700 1.00 0.00 H new ATOM 0 HD1 PHE A 175 15.526 3.934 -3.232 1.00 0.00 H new ATOM 0 HD2 PHE A 175 17.888 1.876 -0.294 1.00 0.00 H new ATOM 0 HE1 PHE A 175 14.200 4.995 -1.425 1.00 0.00 H new ATOM 0 HE2 PHE A 175 16.751 3.148 1.504 1.00 0.00 H new ATOM 0 HZ PHE A 175 14.812 4.600 0.952 1.00 0.00 H new ATOM 887 N VAL A 176 14.703 2.011 -4.673 1.00 0.00 N ATOM 888 CA VAL A 176 13.268 2.269 -4.777 1.00 0.00 C ATOM 889 C VAL A 176 12.575 0.950 -5.103 1.00 0.00 C ATOM 890 O VAL A 176 11.641 0.564 -4.410 1.00 0.00 O ATOM 891 CB VAL A 176 12.933 3.406 -5.773 1.00 0.00 C ATOM 892 CG1 VAL A 176 11.427 3.488 -6.066 1.00 0.00 C ATOM 893 CG2 VAL A 176 13.355 4.779 -5.218 1.00 0.00 C ATOM 0 H VAL A 176 15.261 2.573 -5.315 1.00 0.00 H new ATOM 0 HA VAL A 176 12.891 2.641 -3.824 1.00 0.00 H new ATOM 0 HB VAL A 176 13.482 3.170 -6.685 1.00 0.00 H new ATOM 0 HG11 VAL A 176 11.237 4.299 -6.769 1.00 0.00 H new ATOM 0 HG12 VAL A 176 11.089 2.546 -6.498 1.00 0.00 H new ATOM 0 HG13 VAL A 176 10.886 3.677 -5.139 1.00 0.00 H new ATOM 0 HG21 VAL A 176 13.106 5.556 -5.941 1.00 0.00 H new ATOM 0 HG22 VAL A 176 12.828 4.971 -4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 176 14.430 4.783 -5.036 1.00 0.00 H new ATOM 903 N HIS A 177 13.043 0.222 -6.113 1.00 0.00 N ATOM 904 CA HIS A 177 12.425 -1.047 -6.452 1.00 0.00 C ATOM 905 C HIS A 177 12.518 -2.034 -5.289 1.00 0.00 C ATOM 906 O HIS A 177 11.593 -2.804 -5.048 1.00 0.00 O ATOM 907 CB HIS A 177 13.067 -1.621 -7.716 1.00 0.00 C ATOM 908 CG HIS A 177 12.017 -2.248 -8.595 1.00 0.00 C ATOM 909 ND1 HIS A 177 11.572 -1.726 -9.786 1.00 0.00 N ATOM 910 CD2 HIS A 177 11.181 -3.276 -8.252 1.00 0.00 C ATOM 911 CE1 HIS A 177 10.481 -2.409 -10.162 1.00 0.00 C ATOM 912 NE2 HIS A 177 10.193 -3.353 -9.248 1.00 0.00 N ATOM 0 H HIS A 177 13.835 0.486 -6.699 1.00 0.00 H new ATOM 0 HA HIS A 177 11.367 -0.875 -6.648 1.00 0.00 H new ATOM 0 HB2 HIS A 177 13.583 -0.831 -8.261 1.00 0.00 H new ATOM 0 HB3 HIS A 177 13.817 -2.365 -7.446 1.00 0.00 H new ATOM 0 HD2 HIS A 177 11.265 -3.908 -7.381 1.00 0.00 H new ATOM 0 HE1 HIS A 177 9.917 -2.228 -11.065 1.00 0.00 H new ATOM 0 HE2 HIS A 177 9.406 -4.002 -9.273 1.00 0.00 H new ATOM 920 N ASP A 178 13.632 -2.019 -4.560 1.00 0.00 N ATOM 921 CA ASP A 178 13.885 -2.976 -3.500 1.00 0.00 C ATOM 922 C ASP A 178 13.001 -2.727 -2.274 1.00 0.00 C ATOM 923 O ASP A 178 12.379 -3.664 -1.773 1.00 0.00 O ATOM 924 CB ASP A 178 15.369 -2.934 -3.137 1.00 0.00 C ATOM 925 CG ASP A 178 15.742 -4.017 -2.129 1.00 0.00 C ATOM 926 OD1 ASP A 178 15.464 -5.211 -2.386 1.00 0.00 O ATOM 927 OD2 ASP A 178 16.414 -3.706 -1.117 1.00 0.00 O ATOM 0 H ASP A 178 14.382 -1.340 -4.692 1.00 0.00 H new ATOM 0 HA ASP A 178 13.628 -3.972 -3.860 1.00 0.00 H new ATOM 0 HB2 ASP A 178 15.967 -3.058 -4.040 1.00 0.00 H new ATOM 0 HB3 ASP A 178 15.614 -1.955 -2.725 1.00 0.00 H new ATOM 932 N CYS A 179 12.891 -1.481 -1.799 1.00 0.00 N ATOM 933 CA CYS A 179 11.971 -1.133 -0.716 1.00 0.00 C ATOM 934 C CYS A 179 10.536 -1.392 -1.128 1.00 0.00 C ATOM 935 O CYS A 179 9.750 -1.920 -0.334 1.00 0.00 O ATOM 936 CB CYS A 179 12.055 0.339 -0.302 1.00 0.00 C ATOM 937 SG CYS A 179 12.038 1.568 -1.612 1.00 0.00 S ATOM 0 H CYS A 179 13.434 -0.693 -2.153 1.00 0.00 H new ATOM 0 HA CYS A 179 12.269 -1.759 0.125 1.00 0.00 H new ATOM 0 HB2 CYS A 179 11.221 0.549 0.368 1.00 0.00 H new ATOM 0 HB3 CYS A 179 12.969 0.475 0.276 1.00 0.00 H new ATOM 0 HG CYS A 179 11.902 0.976 -2.761 1.00 0.00 H new ATOM 942 N VAL A 180 10.186 -0.997 -2.353 1.00 0.00 N ATOM 943 CA VAL A 180 8.838 -1.146 -2.845 1.00 0.00 C ATOM 944 C VAL A 180 8.491 -2.625 -2.902 1.00 0.00 C ATOM 945 O VAL A 180 7.384 -2.972 -2.509 1.00 0.00 O ATOM 946 CB VAL A 180 8.649 -0.388 -4.171 1.00 0.00 C ATOM 947 CG1 VAL A 180 7.273 -0.616 -4.804 1.00 0.00 C ATOM 948 CG2 VAL A 180 8.733 1.131 -3.930 1.00 0.00 C ATOM 0 H VAL A 180 10.831 -0.570 -3.018 1.00 0.00 H new ATOM 0 HA VAL A 180 8.124 -0.685 -2.162 1.00 0.00 H new ATOM 0 HB VAL A 180 9.433 -0.763 -4.829 1.00 0.00 H new ATOM 0 HG11 VAL A 180 7.203 -0.054 -5.736 1.00 0.00 H new ATOM 0 HG12 VAL A 180 7.139 -1.678 -5.010 1.00 0.00 H new ATOM 0 HG13 VAL A 180 6.496 -0.278 -4.118 1.00 0.00 H new ATOM 0 HG21 VAL A 180 8.598 1.657 -4.875 1.00 0.00 H new ATOM 0 HG22 VAL A 180 7.952 1.432 -3.232 1.00 0.00 H new ATOM 0 HG23 VAL A 180 9.709 1.380 -3.512 1.00 0.00 H new ATOM 958 N ASN A 181 9.429 -3.497 -3.279 1.00 0.00 N ATOM 959 CA ASN A 181 9.215 -4.923 -3.387 1.00 0.00 C ATOM 960 C ASN A 181 9.051 -5.468 -1.996 1.00 0.00 C ATOM 961 O ASN A 181 8.052 -6.104 -1.734 1.00 0.00 O ATOM 962 CB ASN A 181 10.374 -5.646 -4.073 1.00 0.00 C ATOM 963 CG ASN A 181 10.109 -7.149 -4.035 1.00 0.00 C ATOM 964 OD1 ASN A 181 9.099 -7.622 -4.547 1.00 0.00 O ATOM 965 ND2 ASN A 181 10.959 -7.931 -3.395 1.00 0.00 N ATOM 0 H ASN A 181 10.378 -3.213 -3.521 1.00 0.00 H new ATOM 0 HA ASN A 181 8.329 -5.090 -4.000 1.00 0.00 H new ATOM 0 HB2 ASN A 181 10.473 -5.306 -5.104 1.00 0.00 H new ATOM 0 HB3 ASN A 181 11.313 -5.416 -3.570 1.00 0.00 H new ATOM 0 HD21 ASN A 181 10.777 -8.932 -3.325 1.00 0.00 H new ATOM 0 HD22 ASN A 181 11.797 -7.534 -2.971 1.00 0.00 H new ATOM 972 N ILE A 182 9.994 -5.215 -1.092 1.00 0.00 N ATOM 973 CA ILE A 182 9.953 -5.768 0.249 1.00 0.00 C ATOM 974 C ILE A 182 8.723 -5.289 1.014 1.00 0.00 C ATOM 975 O ILE A 182 8.146 -6.105 1.720 1.00 0.00 O ATOM 976 CB ILE A 182 11.276 -5.433 0.964 1.00 0.00 C ATOM 977 CG1 ILE A 182 12.458 -6.215 0.357 1.00 0.00 C ATOM 978 CG2 ILE A 182 11.187 -5.662 2.477 1.00 0.00 C ATOM 979 CD1 ILE A 182 12.330 -7.741 0.411 1.00 0.00 C ATOM 0 H ILE A 182 10.804 -4.622 -1.273 1.00 0.00 H new ATOM 0 HA ILE A 182 9.857 -6.853 0.200 1.00 0.00 H new ATOM 0 HB ILE A 182 11.459 -4.370 0.807 1.00 0.00 H new ATOM 0 HG12 ILE A 182 12.576 -5.913 -0.684 1.00 0.00 H new ATOM 0 HG13 ILE A 182 13.370 -5.925 0.878 1.00 0.00 H new ATOM 0 HG21 ILE A 182 12.142 -5.413 2.939 1.00 0.00 H new ATOM 0 HG22 ILE A 182 10.405 -5.028 2.896 1.00 0.00 H new ATOM 0 HG23 ILE A 182 10.950 -6.708 2.673 1.00 0.00 H new ATOM 0 HD11 ILE A 182 13.211 -8.196 -0.041 1.00 0.00 H new ATOM 0 HD12 ILE A 182 12.247 -8.063 1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 182 11.440 -8.051 -0.137 1.00 0.00 H new ATOM 991 N THR A 183 8.307 -4.028 0.925 1.00 0.00 N ATOM 992 CA THR A 183 7.140 -3.557 1.672 1.00 0.00 C ATOM 993 C THR A 183 5.850 -4.116 1.049 1.00 0.00 C ATOM 994 O THR A 183 4.919 -4.471 1.778 1.00 0.00 O ATOM 995 CB THR A 183 7.125 -2.025 1.689 1.00 0.00 C ATOM 996 OG1 THR A 183 8.389 -1.472 2.009 1.00 0.00 O ATOM 997 CG2 THR A 183 6.088 -1.470 2.668 1.00 0.00 C ATOM 0 H THR A 183 8.756 -3.317 0.348 1.00 0.00 H new ATOM 0 HA THR A 183 7.198 -3.915 2.700 1.00 0.00 H new ATOM 0 HB THR A 183 6.858 -1.732 0.674 1.00 0.00 H new ATOM 0 HG1 THR A 183 8.950 -1.451 1.206 1.00 0.00 H new ATOM 0 HG21 THR A 183 6.113 -0.381 2.646 1.00 0.00 H new ATOM 0 HG22 THR A 183 5.095 -1.816 2.381 1.00 0.00 H new ATOM 0 HG23 THR A 183 6.316 -1.818 3.675 1.00 0.00 H new ATOM 1005 N ILE A 184 5.774 -4.232 -0.285 1.00 0.00 N ATOM 1006 CA ILE A 184 4.706 -4.977 -0.951 1.00 0.00 C ATOM 1007 C ILE A 184 4.727 -6.393 -0.417 1.00 0.00 C ATOM 1008 O ILE A 184 3.757 -6.814 0.206 1.00 0.00 O ATOM 1009 CB ILE A 184 4.833 -4.847 -2.487 1.00 0.00 C ATOM 1010 CG1 ILE A 184 4.007 -3.604 -2.870 1.00 0.00 C ATOM 1011 CG2 ILE A 184 4.437 -6.068 -3.322 1.00 0.00 C ATOM 1012 CD1 ILE A 184 4.282 -3.087 -4.271 1.00 0.00 C ATOM 0 H ILE A 184 6.449 -3.813 -0.925 1.00 0.00 H new ATOM 0 HA ILE A 184 3.720 -4.569 -0.730 1.00 0.00 H new ATOM 0 HB ILE A 184 5.892 -4.757 -2.728 1.00 0.00 H new ATOM 0 HG12 ILE A 184 2.947 -3.844 -2.784 1.00 0.00 H new ATOM 0 HG13 ILE A 184 4.213 -2.809 -2.153 1.00 0.00 H new ATOM 0 HG21 ILE A 184 4.573 -5.845 -4.380 1.00 0.00 H new ATOM 0 HG22 ILE A 184 5.064 -6.916 -3.047 1.00 0.00 H new ATOM 0 HG23 ILE A 184 3.392 -6.314 -3.134 1.00 0.00 H new ATOM 0 HD11 ILE A 184 3.662 -2.212 -4.464 1.00 0.00 H new ATOM 0 HD12 ILE A 184 5.333 -2.813 -4.358 1.00 0.00 H new ATOM 0 HD13 ILE A 184 4.048 -3.865 -4.998 1.00 0.00 H new ATOM 1024 N LYS A 185 5.844 -7.090 -0.587 1.00 0.00 N ATOM 1025 CA LYS A 185 6.073 -8.460 -0.195 1.00 0.00 C ATOM 1026 C LYS A 185 5.604 -8.619 1.232 1.00 0.00 C ATOM 1027 O LYS A 185 4.757 -9.459 1.458 1.00 0.00 O ATOM 1028 CB LYS A 185 7.536 -8.887 -0.453 1.00 0.00 C ATOM 1029 CG LYS A 185 7.919 -10.151 0.331 1.00 0.00 C ATOM 1030 CD LYS A 185 8.772 -9.914 1.576 1.00 0.00 C ATOM 1031 CE LYS A 185 10.205 -10.427 1.425 1.00 0.00 C ATOM 1032 NZ LYS A 185 10.887 -10.479 2.735 1.00 0.00 N ATOM 0 H LYS A 185 6.664 -6.678 -1.033 1.00 0.00 H new ATOM 0 HA LYS A 185 5.494 -9.149 -0.809 1.00 0.00 H new ATOM 0 HB2 LYS A 185 7.678 -9.066 -1.519 1.00 0.00 H new ATOM 0 HB3 LYS A 185 8.205 -8.072 -0.175 1.00 0.00 H new ATOM 0 HG2 LYS A 185 7.005 -10.664 0.629 1.00 0.00 H new ATOM 0 HG3 LYS A 185 8.459 -10.823 -0.336 1.00 0.00 H new ATOM 0 HD2 LYS A 185 8.795 -8.847 1.796 1.00 0.00 H new ATOM 0 HD3 LYS A 185 8.304 -10.405 2.429 1.00 0.00 H new ATOM 0 HE2 LYS A 185 10.195 -11.420 0.976 1.00 0.00 H new ATOM 0 HE3 LYS A 185 10.759 -9.777 0.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 11.843 -10.081 2.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 10.346 -9.926 3.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 10.952 -11.467 3.053 1.00 0.00 H new ATOM 1046 N GLN A 186 6.080 -7.844 2.199 1.00 0.00 N ATOM 1047 CA GLN A 186 5.684 -8.025 3.581 1.00 0.00 C ATOM 1048 C GLN A 186 4.169 -7.848 3.729 1.00 0.00 C ATOM 1049 O GLN A 186 3.527 -8.778 4.210 1.00 0.00 O ATOM 1050 CB GLN A 186 6.517 -7.130 4.517 1.00 0.00 C ATOM 1051 CG GLN A 186 7.390 -7.896 5.529 1.00 0.00 C ATOM 1052 CD GLN A 186 8.255 -9.010 4.943 1.00 0.00 C ATOM 1053 OE1 GLN A 186 9.285 -8.780 4.319 1.00 0.00 O ATOM 1054 NE2 GLN A 186 7.864 -10.255 5.158 1.00 0.00 N ATOM 0 H GLN A 186 6.742 -7.084 2.046 1.00 0.00 H new ATOM 0 HA GLN A 186 5.901 -9.047 3.891 1.00 0.00 H new ATOM 0 HB2 GLN A 186 7.161 -6.493 3.911 1.00 0.00 H new ATOM 0 HB3 GLN A 186 5.842 -6.472 5.064 1.00 0.00 H new ATOM 0 HG2 GLN A 186 8.041 -7.182 6.034 1.00 0.00 H new ATOM 0 HG3 GLN A 186 6.739 -8.327 6.290 1.00 0.00 H new ATOM 0 HE21 GLN A 186 7.006 -10.437 5.678 1.00 0.00 H new ATOM 0 HE22 GLN A 186 8.421 -11.033 4.804 1.00 0.00 H new ATOM 1063 N HIS A 187 3.545 -6.769 3.245 1.00 0.00 N ATOM 1064 CA HIS A 187 2.079 -6.678 3.296 1.00 0.00 C ATOM 1065 C HIS A 187 1.359 -7.777 2.476 1.00 0.00 C ATOM 1066 O HIS A 187 0.158 -7.965 2.638 1.00 0.00 O ATOM 1067 CB HIS A 187 1.590 -5.254 2.971 1.00 0.00 C ATOM 1068 CG HIS A 187 1.036 -4.530 4.181 1.00 0.00 C ATOM 1069 ND1 HIS A 187 -0.252 -4.076 4.374 1.00 0.00 N ATOM 1070 CD2 HIS A 187 1.732 -4.271 5.330 1.00 0.00 C ATOM 1071 CE1 HIS A 187 -0.322 -3.561 5.614 1.00 0.00 C ATOM 1072 NE2 HIS A 187 0.869 -3.647 6.244 1.00 0.00 N ATOM 0 H HIS A 187 4.014 -5.967 2.825 1.00 0.00 H new ATOM 0 HA HIS A 187 1.793 -6.882 4.328 1.00 0.00 H new ATOM 0 HB2 HIS A 187 2.417 -4.677 2.556 1.00 0.00 H new ATOM 0 HB3 HIS A 187 0.820 -5.307 2.201 1.00 0.00 H new ATOM 0 HD2 HIS A 187 2.771 -4.507 5.504 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -1.214 -3.135 6.049 1.00 0.00 H new ATOM 0 HE2 HIS A 187 1.094 -3.326 7.186 1.00 0.00 H new ATOM 1080 N THR A 188 2.074 -8.558 1.669 1.00 0.00 N ATOM 1081 CA THR A 188 1.623 -9.634 0.789 1.00 0.00 C ATOM 1082 C THR A 188 2.174 -11.001 1.248 1.00 0.00 C ATOM 1083 O THR A 188 2.010 -12.004 0.552 1.00 0.00 O ATOM 1084 CB THR A 188 2.027 -9.284 -0.649 1.00 0.00 C ATOM 1085 OG1 THR A 188 1.725 -7.929 -0.907 1.00 0.00 O ATOM 1086 CG2 THR A 188 1.297 -10.056 -1.747 1.00 0.00 C ATOM 0 H THR A 188 3.086 -8.441 1.609 1.00 0.00 H new ATOM 0 HA THR A 188 0.538 -9.726 0.833 1.00 0.00 H new ATOM 0 HB THR A 188 3.087 -9.535 -0.689 1.00 0.00 H new ATOM 0 HG1 THR A 188 2.366 -7.356 -0.437 1.00 0.00 H new ATOM 0 HG21 THR A 188 1.659 -9.731 -2.722 1.00 0.00 H new ATOM 0 HG22 THR A 188 1.485 -11.123 -1.628 1.00 0.00 H new ATOM 0 HG23 THR A 188 0.226 -9.866 -1.675 1.00 0.00 H new ATOM 1094 N VAL A 189 2.846 -11.079 2.394 1.00 0.00 N ATOM 1095 CA VAL A 189 3.433 -12.299 2.945 1.00 0.00 C ATOM 1096 C VAL A 189 3.192 -12.302 4.436 1.00 0.00 C ATOM 1097 O VAL A 189 2.455 -13.154 4.901 1.00 0.00 O ATOM 1098 CB VAL A 189 4.931 -12.371 2.638 1.00 0.00 C ATOM 1099 CG1 VAL A 189 5.686 -13.436 3.440 1.00 0.00 C ATOM 1100 CG2 VAL A 189 5.177 -12.635 1.152 1.00 0.00 C ATOM 0 H VAL A 189 3.003 -10.264 2.987 1.00 0.00 H new ATOM 0 HA VAL A 189 2.968 -13.173 2.489 1.00 0.00 H new ATOM 0 HB VAL A 189 5.317 -11.395 2.933 1.00 0.00 H new ATOM 0 HG11 VAL A 189 6.740 -13.421 3.163 1.00 0.00 H new ATOM 0 HG12 VAL A 189 5.588 -13.227 4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 189 5.268 -14.419 3.223 1.00 0.00 H new ATOM 0 HG21 VAL A 189 6.250 -12.681 0.963 1.00 0.00 H new ATOM 0 HG22 VAL A 189 4.718 -13.583 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 189 4.739 -11.830 0.562 1.00 0.00 H new ATOM 1110 N THR A 190 3.748 -11.332 5.163 1.00 0.00 N ATOM 1111 CA THR A 190 3.566 -11.087 6.589 1.00 0.00 C ATOM 1112 C THR A 190 2.065 -11.005 6.943 1.00 0.00 C ATOM 1113 O THR A 190 1.703 -11.211 8.101 1.00 0.00 O ATOM 1114 CB THR A 190 4.407 -9.831 6.956 1.00 0.00 C ATOM 1115 OG1 THR A 190 5.589 -10.169 7.649 1.00 0.00 O ATOM 1116 CG2 THR A 190 3.666 -8.712 7.681 1.00 0.00 C ATOM 0 H THR A 190 4.380 -10.652 4.740 1.00 0.00 H new ATOM 0 HA THR A 190 3.931 -11.912 7.200 1.00 0.00 H new ATOM 0 HB THR A 190 4.659 -9.413 5.981 1.00 0.00 H new ATOM 0 HG1 THR A 190 5.921 -9.383 8.131 1.00 0.00 H new ATOM 0 HG21 THR A 190 4.354 -7.892 7.884 1.00 0.00 H new ATOM 0 HG22 THR A 190 2.848 -8.353 7.057 1.00 0.00 H new ATOM 0 HG23 THR A 190 3.266 -9.090 8.622 1.00 0.00 H new ATOM 1124 N THR A 191 1.181 -10.799 5.966 1.00 0.00 N ATOM 1125 CA THR A 191 -0.266 -10.757 6.126 1.00 0.00 C ATOM 1126 C THR A 191 -0.926 -11.959 5.401 1.00 0.00 C ATOM 1127 O THR A 191 -1.891 -12.546 5.897 1.00 0.00 O ATOM 1128 CB THR A 191 -0.755 -9.388 5.592 1.00 0.00 C ATOM 1129 OG1 THR A 191 0.295 -8.457 5.420 1.00 0.00 O ATOM 1130 CG2 THR A 191 -1.712 -8.665 6.533 1.00 0.00 C ATOM 0 H THR A 191 1.471 -10.651 4.999 1.00 0.00 H new ATOM 0 HA THR A 191 -0.553 -10.848 7.174 1.00 0.00 H new ATOM 0 HB THR A 191 -1.236 -9.666 4.654 1.00 0.00 H new ATOM 0 HG1 THR A 191 -0.081 -7.571 5.235 1.00 0.00 H new ATOM 0 HG21 THR A 191 -2.010 -7.715 6.090 1.00 0.00 H new ATOM 0 HG22 THR A 191 -2.596 -9.282 6.697 1.00 0.00 H new ATOM 0 HG23 THR A 191 -1.216 -8.481 7.486 1.00 0.00 H new ATOM 1138 N THR A 192 -0.381 -12.412 4.269 1.00 0.00 N ATOM 1139 CA THR A 192 -0.903 -13.548 3.503 1.00 0.00 C ATOM 1140 C THR A 192 -0.724 -14.878 4.239 1.00 0.00 C ATOM 1141 O THR A 192 -1.589 -15.754 4.201 1.00 0.00 O ATOM 1142 CB THR A 192 -0.202 -13.565 2.143 1.00 0.00 C ATOM 1143 OG1 THR A 192 -0.342 -12.305 1.543 1.00 0.00 O ATOM 1144 CG2 THR A 192 -0.794 -14.552 1.143 1.00 0.00 C ATOM 0 H THR A 192 0.450 -11.993 3.851 1.00 0.00 H new ATOM 0 HA THR A 192 -1.978 -13.426 3.371 1.00 0.00 H new ATOM 0 HB THR A 192 0.828 -13.850 2.355 1.00 0.00 H new ATOM 0 HG1 THR A 192 -1.120 -11.846 1.923 1.00 0.00 H new ATOM 0 HG21 THR A 192 -0.238 -14.499 0.207 1.00 0.00 H new ATOM 0 HG22 THR A 192 -0.729 -15.562 1.547 1.00 0.00 H new ATOM 0 HG23 THR A 192 -1.839 -14.301 0.959 1.00 0.00 H new ATOM 1152 N THR A 193 0.353 -14.972 5.009 1.00 0.00 N ATOM 1153 CA THR A 193 0.687 -16.032 5.953 1.00 0.00 C ATOM 1154 C THR A 193 -0.468 -16.312 6.914 1.00 0.00 C ATOM 1155 O THR A 193 -0.558 -17.420 7.445 1.00 0.00 O ATOM 1156 CB THR A 193 1.990 -15.632 6.678 1.00 0.00 C ATOM 1157 OG1 THR A 193 2.481 -16.627 7.545 1.00 0.00 O ATOM 1158 CG2 THR A 193 1.866 -14.349 7.508 1.00 0.00 C ATOM 0 H THR A 193 1.074 -14.251 4.988 1.00 0.00 H new ATOM 0 HA THR A 193 0.852 -16.971 5.425 1.00 0.00 H new ATOM 0 HB THR A 193 2.683 -15.477 5.851 1.00 0.00 H new ATOM 0 HG1 THR A 193 3.306 -16.312 7.970 1.00 0.00 H new ATOM 0 HG21 THR A 193 2.821 -14.132 7.987 1.00 0.00 H new ATOM 0 HG22 THR A 193 1.590 -13.520 6.857 1.00 0.00 H new ATOM 0 HG23 THR A 193 1.099 -14.482 8.271 1.00 0.00 H new ATOM 1166 N LYS A 194 -1.402 -15.367 7.077 1.00 0.00 N ATOM 1167 CA LYS A 194 -2.572 -15.532 7.919 1.00 0.00 C ATOM 1168 C LYS A 194 -3.767 -15.752 7.004 1.00 0.00 C ATOM 1169 O LYS A 194 -4.330 -16.843 7.022 1.00 0.00 O ATOM 1170 CB LYS A 194 -2.711 -14.382 8.924 1.00 0.00 C ATOM 1171 CG LYS A 194 -1.361 -13.916 9.528 1.00 0.00 C ATOM 1172 CD LYS A 194 -1.089 -12.460 9.238 1.00 0.00 C ATOM 1173 CE LYS A 194 -2.100 -11.581 9.971 1.00 0.00 C ATOM 1174 NZ LYS A 194 -1.941 -10.150 9.662 1.00 0.00 N ATOM 0 H LYS A 194 -1.357 -14.457 6.617 1.00 0.00 H new ATOM 0 HA LYS A 194 -2.487 -16.409 8.561 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -3.190 -13.536 8.431 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -3.372 -14.695 9.732 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -1.371 -14.076 10.606 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -0.552 -14.524 9.123 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -0.077 -12.202 9.550 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -1.148 -12.278 8.165 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.109 -11.896 9.704 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -1.993 -11.730 11.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -2.302 -9.582 10.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -0.934 -9.937 9.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.474 -9.920 8.799 1.00 0.00 H new ATOM 1188 N GLY A 195 -4.077 -14.790 6.137 1.00 0.00 N ATOM 1189 CA GLY A 195 -5.051 -14.966 5.067 1.00 0.00 C ATOM 1190 C GLY A 195 -5.445 -13.645 4.432 1.00 0.00 C ATOM 1191 O GLY A 195 -6.599 -13.481 4.025 1.00 0.00 O ATOM 0 H GLY A 195 -3.656 -13.861 6.159 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -4.636 -15.625 4.304 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -5.940 -15.457 5.463 1.00 0.00 H new ATOM 1195 N GLU A 196 -4.524 -12.684 4.366 1.00 0.00 N ATOM 1196 CA GLU A 196 -4.769 -11.350 3.871 1.00 0.00 C ATOM 1197 C GLU A 196 -4.061 -11.196 2.537 1.00 0.00 C ATOM 1198 O GLU A 196 -2.843 -11.339 2.453 1.00 0.00 O ATOM 1199 CB GLU A 196 -4.254 -10.314 4.868 1.00 0.00 C ATOM 1200 CG GLU A 196 -4.824 -8.920 4.579 1.00 0.00 C ATOM 1201 CD GLU A 196 -6.149 -8.731 5.301 1.00 0.00 C ATOM 1202 OE1 GLU A 196 -6.131 -8.511 6.533 1.00 0.00 O ATOM 1203 OE2 GLU A 196 -7.208 -8.927 4.656 1.00 0.00 O ATOM 0 H GLU A 196 -3.560 -12.827 4.667 1.00 0.00 H new ATOM 0 HA GLU A 196 -5.840 -11.191 3.742 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -4.525 -10.616 5.880 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -3.165 -10.278 4.827 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -4.115 -8.156 4.900 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -4.966 -8.793 3.506 1.00 0.00 H new ATOM 1210 N ASN A 197 -4.814 -10.875 1.501 1.00 0.00 N ATOM 1211 CA ASN A 197 -4.286 -10.449 0.213 1.00 0.00 C ATOM 1212 C ASN A 197 -5.144 -9.359 -0.414 1.00 0.00 C ATOM 1213 O ASN A 197 -6.005 -8.784 0.263 1.00 0.00 O ATOM 1214 CB ASN A 197 -4.079 -11.640 -0.731 1.00 0.00 C ATOM 1215 CG ASN A 197 -2.822 -11.392 -1.537 1.00 0.00 C ATOM 1216 OD1 ASN A 197 -2.865 -11.063 -2.715 1.00 0.00 O ATOM 1217 ND2 ASN A 197 -1.673 -11.443 -0.890 1.00 0.00 N ATOM 0 H ASN A 197 -5.833 -10.903 1.530 1.00 0.00 H new ATOM 0 HA ASN A 197 -3.304 -10.011 0.390 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -3.989 -12.565 -0.162 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -4.938 -11.755 -1.392 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -0.806 -11.206 -1.372 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -1.652 -11.719 0.092 1.00 0.00 H new ATOM 1224 N PHE A 198 -4.870 -9.043 -1.680 1.00 0.00 N ATOM 1225 CA PHE A 198 -5.447 -7.940 -2.414 1.00 0.00 C ATOM 1226 C PHE A 198 -5.591 -8.334 -3.885 1.00 0.00 C ATOM 1227 O PHE A 198 -4.984 -9.314 -4.329 1.00 0.00 O ATOM 1228 CB PHE A 198 -4.547 -6.699 -2.308 1.00 0.00 C ATOM 1229 CG PHE A 198 -3.695 -6.546 -1.063 1.00 0.00 C ATOM 1230 CD1 PHE A 198 -2.476 -7.244 -0.955 1.00 0.00 C ATOM 1231 CD2 PHE A 198 -4.097 -5.679 -0.032 1.00 0.00 C ATOM 1232 CE1 PHE A 198 -1.657 -7.045 0.168 1.00 0.00 C ATOM 1233 CE2 PHE A 198 -3.271 -5.467 1.080 1.00 0.00 C ATOM 1234 CZ PHE A 198 -2.043 -6.140 1.175 1.00 0.00 C ATOM 0 H PHE A 198 -4.207 -9.581 -2.239 1.00 0.00 H new ATOM 0 HA PHE A 198 -6.424 -7.706 -1.992 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -3.882 -6.693 -3.171 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -5.182 -5.817 -2.389 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -2.173 -7.929 -1.733 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -5.049 -5.173 -0.097 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -0.728 -7.588 0.260 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -3.578 -4.788 1.861 1.00 0.00 H new ATOM 0 HZ PHE A 198 -1.394 -5.964 2.020 1.00 0.00 H new ATOM 1244 N THR A 199 -6.352 -7.556 -4.647 1.00 0.00 N ATOM 1245 CA THR A 199 -6.486 -7.679 -6.098 1.00 0.00 C ATOM 1246 C THR A 199 -5.498 -6.787 -6.831 1.00 0.00 C ATOM 1247 O THR A 199 -5.056 -5.816 -6.233 1.00 0.00 O ATOM 1248 CB THR A 199 -7.924 -7.311 -6.483 1.00 0.00 C ATOM 1249 OG1 THR A 199 -8.541 -6.345 -5.630 1.00 0.00 O ATOM 1250 CG2 THR A 199 -8.726 -8.594 -6.318 1.00 0.00 C ATOM 0 H THR A 199 -6.912 -6.796 -4.261 1.00 0.00 H new ATOM 0 HA THR A 199 -6.265 -8.706 -6.390 1.00 0.00 H new ATOM 0 HB THR A 199 -7.902 -6.884 -7.486 1.00 0.00 H new ATOM 0 HG1 THR A 199 -7.922 -5.601 -5.476 1.00 0.00 H new ATOM 0 HG21 THR A 199 -9.768 -8.407 -6.577 1.00 0.00 H new ATOM 0 HG22 THR A 199 -8.321 -9.363 -6.976 1.00 0.00 H new ATOM 0 HG23 THR A 199 -8.664 -8.932 -5.283 1.00 0.00 H new ATOM 1258 N GLU A 200 -5.230 -7.021 -8.123 1.00 0.00 N ATOM 1259 CA GLU A 200 -4.281 -6.261 -8.940 1.00 0.00 C ATOM 1260 C GLU A 200 -4.433 -4.760 -8.729 1.00 0.00 C ATOM 1261 O GLU A 200 -3.449 -4.067 -8.510 1.00 0.00 O ATOM 1262 CB GLU A 200 -4.476 -6.604 -10.425 1.00 0.00 C ATOM 1263 CG GLU A 200 -3.650 -5.653 -11.315 1.00 0.00 C ATOM 1264 CD GLU A 200 -3.593 -6.044 -12.790 1.00 0.00 C ATOM 1265 OE1 GLU A 200 -3.072 -7.132 -13.130 1.00 0.00 O ATOM 1266 OE2 GLU A 200 -4.008 -5.200 -13.619 1.00 0.00 O ATOM 0 H GLU A 200 -5.685 -7.771 -8.644 1.00 0.00 H new ATOM 0 HA GLU A 200 -3.275 -6.541 -8.629 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -4.175 -7.635 -10.608 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -5.532 -6.529 -10.685 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -4.068 -4.649 -11.236 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -2.633 -5.606 -10.926 1.00 0.00 H new ATOM 1273 N THR A 201 -5.657 -4.245 -8.786 1.00 0.00 N ATOM 1274 CA THR A 201 -5.866 -2.807 -8.667 1.00 0.00 C ATOM 1275 C THR A 201 -5.373 -2.278 -7.314 1.00 0.00 C ATOM 1276 O THR A 201 -4.793 -1.196 -7.266 1.00 0.00 O ATOM 1277 CB THR A 201 -7.349 -2.509 -8.885 1.00 0.00 C ATOM 1278 OG1 THR A 201 -7.714 -2.857 -10.206 1.00 0.00 O ATOM 1279 CG2 THR A 201 -7.688 -1.032 -8.722 1.00 0.00 C ATOM 0 H THR A 201 -6.508 -4.793 -8.912 1.00 0.00 H new ATOM 0 HA THR A 201 -5.281 -2.290 -9.428 1.00 0.00 H new ATOM 0 HB THR A 201 -7.886 -3.088 -8.134 1.00 0.00 H new ATOM 0 HG1 THR A 201 -8.666 -2.667 -10.343 1.00 0.00 H new ATOM 0 HG21 THR A 201 -8.755 -0.883 -8.889 1.00 0.00 H new ATOM 0 HG22 THR A 201 -7.430 -0.709 -7.714 1.00 0.00 H new ATOM 0 HG23 THR A 201 -7.122 -0.447 -9.447 1.00 0.00 H new ATOM 1287 N ASP A 202 -5.570 -3.032 -6.234 1.00 0.00 N ATOM 1288 CA ASP A 202 -5.034 -2.732 -4.916 1.00 0.00 C ATOM 1289 C ASP A 202 -3.533 -2.933 -4.928 1.00 0.00 C ATOM 1290 O ASP A 202 -2.820 -2.032 -4.511 1.00 0.00 O ATOM 1291 CB ASP A 202 -5.677 -3.611 -3.852 1.00 0.00 C ATOM 1292 CG ASP A 202 -7.109 -3.198 -3.573 1.00 0.00 C ATOM 1293 OD1 ASP A 202 -7.324 -2.335 -2.695 1.00 0.00 O ATOM 1294 OD2 ASP A 202 -8.042 -3.791 -4.163 1.00 0.00 O ATOM 0 H ASP A 202 -6.122 -3.890 -6.256 1.00 0.00 H new ATOM 0 HA ASP A 202 -5.261 -1.694 -4.672 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -5.655 -4.651 -4.177 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -5.096 -3.553 -2.932 1.00 0.00 H new ATOM 1299 N VAL A 203 -3.042 -4.051 -5.466 1.00 0.00 N ATOM 1300 CA VAL A 203 -1.600 -4.303 -5.591 1.00 0.00 C ATOM 1301 C VAL A 203 -0.880 -3.118 -6.240 1.00 0.00 C ATOM 1302 O VAL A 203 0.163 -2.655 -5.773 1.00 0.00 O ATOM 1303 CB VAL A 203 -1.348 -5.654 -6.283 1.00 0.00 C ATOM 1304 CG1 VAL A 203 0.139 -5.928 -6.528 1.00 0.00 C ATOM 1305 CG2 VAL A 203 -1.911 -6.780 -5.400 1.00 0.00 C ATOM 0 H VAL A 203 -3.627 -4.805 -5.826 1.00 0.00 H new ATOM 0 HA VAL A 203 -1.162 -4.388 -4.597 1.00 0.00 H new ATOM 0 HB VAL A 203 -1.843 -5.617 -7.253 1.00 0.00 H new ATOM 0 HG11 VAL A 203 0.255 -6.895 -7.018 1.00 0.00 H new ATOM 0 HG12 VAL A 203 0.553 -5.146 -7.165 1.00 0.00 H new ATOM 0 HG13 VAL A 203 0.669 -5.939 -5.575 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -1.737 -7.742 -5.882 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -1.414 -6.765 -4.430 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -2.982 -6.632 -5.261 1.00 0.00 H new ATOM 1315 N LYS A 204 -1.489 -2.562 -7.272 1.00 0.00 N ATOM 1316 CA LYS A 204 -1.034 -1.425 -8.011 1.00 0.00 C ATOM 1317 C LYS A 204 -1.149 -0.134 -7.195 1.00 0.00 C ATOM 1318 O LYS A 204 -0.322 0.763 -7.356 1.00 0.00 O ATOM 1319 CB LYS A 204 -1.927 -1.455 -9.256 1.00 0.00 C ATOM 1320 CG LYS A 204 -1.648 -0.350 -10.247 1.00 0.00 C ATOM 1321 CD LYS A 204 -2.722 -0.295 -11.343 1.00 0.00 C ATOM 1322 CE LYS A 204 -4.082 0.199 -10.824 1.00 0.00 C ATOM 1323 NZ LYS A 204 -4.012 1.554 -10.252 1.00 0.00 N ATOM 0 H LYS A 204 -2.372 -2.926 -7.630 1.00 0.00 H new ATOM 0 HA LYS A 204 0.025 -1.456 -8.268 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -1.802 -2.416 -9.756 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -2.969 -1.392 -8.943 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -1.609 0.607 -9.726 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -0.670 -0.506 -10.702 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -2.384 0.363 -12.143 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -2.843 -1.288 -11.776 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -4.803 0.190 -11.641 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -4.450 -0.493 -10.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -4.534 1.579 -9.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -3.018 1.808 -10.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -4.435 2.234 -10.916 1.00 0.00 H new ATOM 1337 N MET A 205 -2.150 -0.007 -6.320 1.00 0.00 N ATOM 1338 CA MET A 205 -2.208 1.107 -5.379 1.00 0.00 C ATOM 1339 C MET A 205 -1.016 1.029 -4.445 1.00 0.00 C ATOM 1340 O MET A 205 -0.383 2.051 -4.185 1.00 0.00 O ATOM 1341 CB MET A 205 -3.473 1.107 -4.504 1.00 0.00 C ATOM 1342 CG MET A 205 -4.758 1.173 -5.312 1.00 0.00 C ATOM 1343 SD MET A 205 -5.620 2.748 -5.246 1.00 0.00 S ATOM 1344 CE MET A 205 -6.182 2.657 -6.951 1.00 0.00 C ATOM 0 H MET A 205 -2.928 -0.662 -6.246 1.00 0.00 H new ATOM 0 HA MET A 205 -2.212 2.016 -5.981 1.00 0.00 H new ATOM 0 HB2 MET A 205 -3.483 0.206 -3.890 1.00 0.00 H new ATOM 0 HB3 MET A 205 -3.436 1.957 -3.822 1.00 0.00 H new ATOM 0 HG2 MET A 205 -4.526 0.947 -6.353 1.00 0.00 H new ATOM 0 HG3 MET A 205 -5.432 0.393 -4.958 1.00 0.00 H new ATOM 0 HE1 MET A 205 -6.706 3.577 -7.211 1.00 0.00 H new ATOM 0 HE2 MET A 205 -5.324 2.530 -7.611 1.00 0.00 H new ATOM 0 HE3 MET A 205 -6.857 1.809 -7.067 1.00 0.00 H new ATOM 1354 N MET A 206 -0.715 -0.168 -3.938 1.00 0.00 N ATOM 1355 CA MET A 206 0.451 -0.352 -3.086 1.00 0.00 C ATOM 1356 C MET A 206 1.716 0.044 -3.846 1.00 0.00 C ATOM 1357 O MET A 206 2.524 0.778 -3.288 1.00 0.00 O ATOM 1358 CB MET A 206 0.591 -1.751 -2.475 1.00 0.00 C ATOM 1359 CG MET A 206 -0.395 -2.024 -1.326 1.00 0.00 C ATOM 1360 SD MET A 206 -1.896 -2.917 -1.757 1.00 0.00 S ATOM 1361 CE MET A 206 -1.184 -4.519 -2.162 1.00 0.00 C ATOM 0 H MET A 206 -1.260 -1.015 -4.103 1.00 0.00 H new ATOM 0 HA MET A 206 0.303 0.307 -2.231 1.00 0.00 H new ATOM 0 HB2 MET A 206 0.440 -2.496 -3.256 1.00 0.00 H new ATOM 0 HB3 MET A 206 1.609 -1.877 -2.106 1.00 0.00 H new ATOM 0 HG2 MET A 206 0.128 -2.587 -0.553 1.00 0.00 H new ATOM 0 HG3 MET A 206 -0.680 -1.068 -0.886 1.00 0.00 H new ATOM 0 HE1 MET A 206 -1.940 -5.144 -2.638 1.00 0.00 H new ATOM 0 HE2 MET A 206 -0.345 -4.382 -2.844 1.00 0.00 H new ATOM 0 HE3 MET A 206 -0.835 -5.003 -1.250 1.00 0.00 H new ATOM 1371 N GLU A 207 1.903 -0.360 -5.106 1.00 0.00 N ATOM 1372 CA GLU A 207 3.111 0.019 -5.848 1.00 0.00 C ATOM 1373 C GLU A 207 3.240 1.535 -6.045 1.00 0.00 C ATOM 1374 O GLU A 207 4.352 2.034 -6.215 1.00 0.00 O ATOM 1375 CB GLU A 207 3.195 -0.711 -7.203 1.00 0.00 C ATOM 1376 CG GLU A 207 4.452 -1.598 -7.321 1.00 0.00 C ATOM 1377 CD GLU A 207 5.070 -1.598 -8.721 1.00 0.00 C ATOM 1378 OE1 GLU A 207 4.317 -1.627 -9.717 1.00 0.00 O ATOM 1379 OE2 GLU A 207 6.321 -1.558 -8.850 1.00 0.00 O ATOM 0 H GLU A 207 1.246 -0.940 -5.628 1.00 0.00 H new ATOM 0 HA GLU A 207 3.953 -0.296 -5.231 1.00 0.00 H new ATOM 0 HB2 GLU A 207 2.306 -1.327 -7.335 1.00 0.00 H new ATOM 0 HB3 GLU A 207 3.196 0.024 -8.008 1.00 0.00 H new ATOM 0 HG2 GLU A 207 5.197 -1.255 -6.603 1.00 0.00 H new ATOM 0 HG3 GLU A 207 4.192 -2.621 -7.047 1.00 0.00 H new ATOM 1386 N ARG A 208 2.135 2.282 -6.010 1.00 0.00 N ATOM 1387 CA ARG A 208 2.140 3.742 -6.044 1.00 0.00 C ATOM 1388 C ARG A 208 2.479 4.289 -4.663 1.00 0.00 C ATOM 1389 O ARG A 208 3.366 5.131 -4.517 1.00 0.00 O ATOM 1390 CB ARG A 208 0.756 4.224 -6.518 1.00 0.00 C ATOM 1391 CG ARG A 208 0.677 4.305 -8.048 1.00 0.00 C ATOM 1392 CD ARG A 208 0.996 5.718 -8.558 1.00 0.00 C ATOM 1393 NE ARG A 208 2.041 5.707 -9.585 1.00 0.00 N ATOM 1394 CZ ARG A 208 1.892 5.489 -10.894 1.00 0.00 C ATOM 1395 NH1 ARG A 208 0.685 5.282 -11.413 1.00 0.00 N ATOM 1396 NH2 ARG A 208 2.964 5.473 -11.670 1.00 0.00 N ATOM 0 H ARG A 208 1.198 1.882 -5.956 1.00 0.00 H new ATOM 0 HA ARG A 208 2.897 4.107 -6.737 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -0.012 3.544 -6.149 1.00 0.00 H new ATOM 0 HB3 ARG A 208 0.546 5.204 -6.090 1.00 0.00 H new ATOM 0 HG2 ARG A 208 1.376 3.593 -8.487 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -0.321 4.016 -8.377 1.00 0.00 H new ATOM 0 HD2 ARG A 208 0.091 6.169 -8.966 1.00 0.00 H new ATOM 0 HD3 ARG A 208 1.315 6.342 -7.723 1.00 0.00 H new ATOM 0 HE ARG A 208 2.992 5.887 -9.263 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -0.138 5.289 -10.810 1.00 0.00 H new ATOM 0 HH12 ARG A 208 0.582 5.116 -12.414 1.00 0.00 H new ATOM 0 HH21 ARG A 208 3.888 5.626 -11.266 1.00 0.00 H new ATOM 0 HH22 ARG A 208 2.866 5.308 -12.672 1.00 0.00 H new ATOM 1410 N VAL A 209 1.744 3.856 -3.643 1.00 0.00 N ATOM 1411 CA VAL A 209 1.833 4.400 -2.300 1.00 0.00 C ATOM 1412 C VAL A 209 3.170 4.082 -1.662 1.00 0.00 C ATOM 1413 O VAL A 209 3.767 4.959 -1.042 1.00 0.00 O ATOM 1414 CB VAL A 209 0.634 3.931 -1.454 1.00 0.00 C ATOM 1415 CG1 VAL A 209 0.812 2.666 -0.614 1.00 0.00 C ATOM 1416 CG2 VAL A 209 0.181 5.064 -0.543 1.00 0.00 C ATOM 0 H VAL A 209 1.060 3.105 -3.732 1.00 0.00 H new ATOM 0 HA VAL A 209 1.781 5.487 -2.355 1.00 0.00 H new ATOM 0 HB VAL A 209 -0.111 3.655 -2.200 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -0.110 2.456 -0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 209 1.049 1.826 -1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 209 1.625 2.813 0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -0.667 4.732 0.056 1.00 0.00 H new ATOM 0 HG22 VAL A 209 1.000 5.351 0.116 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -0.115 5.921 -1.148 1.00 0.00 H new ATOM 1426 N VAL A 210 3.641 2.844 -1.796 1.00 0.00 N ATOM 1427 CA VAL A 210 4.849 2.403 -1.137 1.00 0.00 C ATOM 1428 C VAL A 210 6.015 3.175 -1.758 1.00 0.00 C ATOM 1429 O VAL A 210 6.895 3.639 -1.036 1.00 0.00 O ATOM 1430 CB VAL A 210 4.996 0.870 -1.268 1.00 0.00 C ATOM 1431 CG1 VAL A 210 6.327 0.308 -0.758 1.00 0.00 C ATOM 1432 CG2 VAL A 210 3.900 0.140 -0.470 1.00 0.00 C ATOM 0 H VAL A 210 3.191 2.127 -2.365 1.00 0.00 H new ATOM 0 HA VAL A 210 4.825 2.609 -0.067 1.00 0.00 H new ATOM 0 HB VAL A 210 4.925 0.697 -2.342 1.00 0.00 H new ATOM 0 HG11 VAL A 210 6.340 -0.774 -0.890 1.00 0.00 H new ATOM 0 HG12 VAL A 210 7.149 0.752 -1.320 1.00 0.00 H new ATOM 0 HG13 VAL A 210 6.441 0.546 0.300 1.00 0.00 H new ATOM 0 HG21 VAL A 210 4.027 -0.937 -0.579 1.00 0.00 H new ATOM 0 HG22 VAL A 210 3.976 0.409 0.583 1.00 0.00 H new ATOM 0 HG23 VAL A 210 2.920 0.430 -0.848 1.00 0.00 H new ATOM 1442 N GLU A 211 5.977 3.360 -3.083 1.00 0.00 N ATOM 1443 CA GLU A 211 6.918 4.178 -3.821 1.00 0.00 C ATOM 1444 C GLU A 211 6.876 5.592 -3.250 1.00 0.00 C ATOM 1445 O GLU A 211 7.864 6.022 -2.669 1.00 0.00 O ATOM 1446 CB GLU A 211 6.620 4.066 -5.323 1.00 0.00 C ATOM 1447 CG GLU A 211 7.664 4.757 -6.203 1.00 0.00 C ATOM 1448 CD GLU A 211 7.389 4.499 -7.687 1.00 0.00 C ATOM 1449 OE1 GLU A 211 7.821 3.462 -8.238 1.00 0.00 O ATOM 1450 OE2 GLU A 211 6.808 5.385 -8.358 1.00 0.00 O ATOM 0 H GLU A 211 5.269 2.929 -3.677 1.00 0.00 H new ATOM 0 HA GLU A 211 7.947 3.836 -3.709 1.00 0.00 H new ATOM 0 HB2 GLU A 211 6.564 3.013 -5.597 1.00 0.00 H new ATOM 0 HB3 GLU A 211 5.641 4.500 -5.525 1.00 0.00 H new ATOM 0 HG2 GLU A 211 7.656 5.830 -6.009 1.00 0.00 H new ATOM 0 HG3 GLU A 211 8.659 4.394 -5.946 1.00 0.00 H new ATOM 1457 N GLN A 212 5.754 6.312 -3.324 1.00 0.00 N ATOM 1458 CA GLN A 212 5.659 7.674 -2.817 1.00 0.00 C ATOM 1459 C GLN A 212 6.063 7.842 -1.352 1.00 0.00 C ATOM 1460 O GLN A 212 6.772 8.806 -1.040 1.00 0.00 O ATOM 1461 CB GLN A 212 4.235 8.166 -3.055 1.00 0.00 C ATOM 1462 CG GLN A 212 4.064 8.465 -4.546 1.00 0.00 C ATOM 1463 CD GLN A 212 4.480 9.894 -4.881 1.00 0.00 C ATOM 1464 OE1 GLN A 212 5.504 10.425 -4.438 1.00 0.00 O ATOM 1465 NE2 GLN A 212 3.670 10.540 -5.684 1.00 0.00 N ATOM 0 H GLN A 212 4.889 5.963 -3.737 1.00 0.00 H new ATOM 0 HA GLN A 212 6.384 8.278 -3.362 1.00 0.00 H new ATOM 0 HB2 GLN A 212 3.516 7.412 -2.736 1.00 0.00 H new ATOM 0 HB3 GLN A 212 4.041 9.062 -2.465 1.00 0.00 H new ATOM 0 HG2 GLN A 212 4.662 7.765 -5.129 1.00 0.00 H new ATOM 0 HG3 GLN A 212 3.023 8.311 -4.832 1.00 0.00 H new ATOM 0 HE21 GLN A 212 2.830 10.082 -6.038 1.00 0.00 H new ATOM 0 HE22 GLN A 212 3.880 11.501 -5.955 1.00 0.00 H new ATOM 1474 N MET A 213 5.630 6.967 -0.441 1.00 0.00 N ATOM 1475 CA MET A 213 6.048 7.026 0.957 1.00 0.00 C ATOM 1476 C MET A 213 7.563 6.886 1.051 1.00 0.00 C ATOM 1477 O MET A 213 8.208 7.758 1.641 1.00 0.00 O ATOM 1478 CB MET A 213 5.370 5.949 1.811 1.00 0.00 C ATOM 1479 CG MET A 213 3.882 6.238 2.046 1.00 0.00 C ATOM 1480 SD MET A 213 3.142 5.418 3.486 1.00 0.00 S ATOM 1481 CE MET A 213 3.364 3.680 3.030 1.00 0.00 C ATOM 0 H MET A 213 4.985 6.205 -0.651 1.00 0.00 H new ATOM 0 HA MET A 213 5.740 7.995 1.350 1.00 0.00 H new ATOM 0 HB2 MET A 213 5.476 4.981 1.321 1.00 0.00 H new ATOM 0 HB3 MET A 213 5.879 5.878 2.772 1.00 0.00 H new ATOM 0 HG2 MET A 213 3.752 7.315 2.157 1.00 0.00 H new ATOM 0 HG3 MET A 213 3.327 5.940 1.156 1.00 0.00 H new ATOM 0 HE1 MET A 213 3.406 3.070 3.932 1.00 0.00 H new ATOM 0 HE2 MET A 213 2.527 3.356 2.411 1.00 0.00 H new ATOM 0 HE3 MET A 213 4.293 3.566 2.472 1.00 0.00 H new ATOM 1491 N CYS A 214 8.133 5.828 0.462 1.00 0.00 N ATOM 1492 CA CYS A 214 9.561 5.604 0.572 1.00 0.00 C ATOM 1493 C CYS A 214 10.343 6.706 -0.126 1.00 0.00 C ATOM 1494 O CYS A 214 11.336 7.146 0.422 1.00 0.00 O ATOM 1495 CB CYS A 214 9.988 4.236 0.051 1.00 0.00 C ATOM 1496 SG CYS A 214 11.712 3.913 0.506 1.00 0.00 S ATOM 0 H CYS A 214 7.629 5.130 -0.085 1.00 0.00 H new ATOM 0 HA CYS A 214 9.793 5.626 1.637 1.00 0.00 H new ATOM 0 HB2 CYS A 214 9.342 3.462 0.465 1.00 0.00 H new ATOM 0 HB3 CYS A 214 9.876 4.199 -1.033 1.00 0.00 H new ATOM 0 HG CYS A 214 12.165 2.915 -0.192 1.00 0.00 H new ATOM 1501 N VAL A 215 9.906 7.216 -1.275 1.00 0.00 N ATOM 1502 CA VAL A 215 10.580 8.301 -1.994 1.00 0.00 C ATOM 1503 C VAL A 215 10.756 9.499 -1.059 1.00 0.00 C ATOM 1504 O VAL A 215 11.847 10.057 -0.979 1.00 0.00 O ATOM 1505 CB VAL A 215 9.788 8.639 -3.274 1.00 0.00 C ATOM 1506 CG1 VAL A 215 10.172 9.978 -3.920 1.00 0.00 C ATOM 1507 CG2 VAL A 215 10.018 7.560 -4.349 1.00 0.00 C ATOM 0 H VAL A 215 9.062 6.884 -1.742 1.00 0.00 H new ATOM 0 HA VAL A 215 11.578 7.996 -2.310 1.00 0.00 H new ATOM 0 HB VAL A 215 8.750 8.693 -2.946 1.00 0.00 H new ATOM 0 HG11 VAL A 215 9.568 10.137 -4.813 1.00 0.00 H new ATOM 0 HG12 VAL A 215 9.994 10.788 -3.212 1.00 0.00 H new ATOM 0 HG13 VAL A 215 11.227 9.961 -4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 215 9.452 7.813 -5.246 1.00 0.00 H new ATOM 0 HG22 VAL A 215 11.079 7.509 -4.592 1.00 0.00 H new ATOM 0 HG23 VAL A 215 9.685 6.593 -3.971 1.00 0.00 H new ATOM 1517 N THR A 216 9.713 9.867 -0.314 1.00 0.00 N ATOM 1518 CA THR A 216 9.821 10.850 0.751 1.00 0.00 C ATOM 1519 C THR A 216 10.809 10.381 1.823 1.00 0.00 C ATOM 1520 O THR A 216 11.778 11.088 2.049 1.00 0.00 O ATOM 1521 CB THR A 216 8.426 11.157 1.303 1.00 0.00 C ATOM 1522 OG1 THR A 216 7.701 11.913 0.345 1.00 0.00 O ATOM 1523 CG2 THR A 216 8.451 11.933 2.632 1.00 0.00 C ATOM 0 H THR A 216 8.773 9.489 -0.436 1.00 0.00 H new ATOM 0 HA THR A 216 10.227 11.783 0.360 1.00 0.00 H new ATOM 0 HB THR A 216 7.948 10.197 1.500 1.00 0.00 H new ATOM 0 HG1 THR A 216 6.806 12.111 0.693 1.00 0.00 H new ATOM 0 HG21 THR A 216 7.430 12.117 2.965 1.00 0.00 H new ATOM 0 HG22 THR A 216 8.979 11.348 3.385 1.00 0.00 H new ATOM 0 HG23 THR A 216 8.962 12.885 2.488 1.00 0.00 H new ATOM 1531 N GLN A 217 10.588 9.258 2.513 1.00 0.00 N ATOM 1532 CA GLN A 217 11.407 8.817 3.652 1.00 0.00 C ATOM 1533 C GLN A 217 12.892 8.707 3.266 1.00 0.00 C ATOM 1534 O GLN A 217 13.768 9.074 4.047 1.00 0.00 O ATOM 1535 CB GLN A 217 10.841 7.465 4.117 1.00 0.00 C ATOM 1536 CG GLN A 217 11.253 7.030 5.533 1.00 0.00 C ATOM 1537 CD GLN A 217 10.067 6.978 6.504 1.00 0.00 C ATOM 1538 OE1 GLN A 217 9.290 6.033 6.540 1.00 0.00 O ATOM 1539 NE2 GLN A 217 9.896 7.977 7.350 1.00 0.00 N ATOM 0 H GLN A 217 9.824 8.618 2.295 1.00 0.00 H new ATOM 0 HA GLN A 217 11.362 9.546 4.461 1.00 0.00 H new ATOM 0 HB2 GLN A 217 9.753 7.511 4.071 1.00 0.00 H new ATOM 0 HB3 GLN A 217 11.158 6.696 3.412 1.00 0.00 H new ATOM 0 HG2 GLN A 217 11.721 6.047 5.485 1.00 0.00 H new ATOM 0 HG3 GLN A 217 12.002 7.722 5.918 1.00 0.00 H new ATOM 0 HE21 GLN A 217 10.534 8.773 7.335 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.126 7.953 8.019 1.00 0.00 H new ATOM 1548 N TYR A 218 13.188 8.253 2.054 1.00 0.00 N ATOM 1549 CA TYR A 218 14.488 8.259 1.411 1.00 0.00 C ATOM 1550 C TYR A 218 14.975 9.695 1.332 1.00 0.00 C ATOM 1551 O TYR A 218 15.997 9.998 1.930 1.00 0.00 O ATOM 1552 CB TYR A 218 14.372 7.649 0.009 1.00 0.00 C ATOM 1553 CG TYR A 218 15.499 7.989 -0.948 1.00 0.00 C ATOM 1554 CD1 TYR A 218 16.809 7.511 -0.745 1.00 0.00 C ATOM 1555 CD2 TYR A 218 15.225 8.845 -2.030 1.00 0.00 C ATOM 1556 CE1 TYR A 218 17.848 7.900 -1.617 1.00 0.00 C ATOM 1557 CE2 TYR A 218 16.253 9.238 -2.895 1.00 0.00 C ATOM 1558 CZ TYR A 218 17.565 8.773 -2.695 1.00 0.00 C ATOM 1559 OH TYR A 218 18.520 9.157 -3.583 1.00 0.00 O ATOM 0 H TYR A 218 12.471 7.842 1.455 1.00 0.00 H new ATOM 0 HA TYR A 218 15.200 7.664 1.983 1.00 0.00 H new ATOM 0 HB2 TYR A 218 14.317 6.565 0.107 1.00 0.00 H new ATOM 0 HB3 TYR A 218 13.432 7.977 -0.434 1.00 0.00 H new ATOM 0 HD1 TYR A 218 17.018 6.846 0.080 1.00 0.00 H new ATOM 0 HD2 TYR A 218 14.218 9.200 -2.194 1.00 0.00 H new ATOM 0 HE1 TYR A 218 18.852 7.534 -1.463 1.00 0.00 H new ATOM 0 HE2 TYR A 218 16.038 9.901 -3.720 1.00 0.00 H new ATOM 0 HH TYR A 218 18.125 9.757 -4.249 1.00 0.00 H new ATOM 1569 N GLN A 219 14.251 10.587 0.646 1.00 0.00 N ATOM 1570 CA GLN A 219 14.598 12.000 0.531 1.00 0.00 C ATOM 1571 C GLN A 219 14.783 12.675 1.893 1.00 0.00 C ATOM 1572 O GLN A 219 15.577 13.609 1.983 1.00 0.00 O ATOM 1573 CB GLN A 219 13.535 12.755 -0.274 1.00 0.00 C ATOM 1574 CG GLN A 219 13.684 12.552 -1.784 1.00 0.00 C ATOM 1575 CD GLN A 219 12.621 13.332 -2.548 1.00 0.00 C ATOM 1576 OE1 GLN A 219 12.307 14.481 -2.223 1.00 0.00 O ATOM 1577 NE2 GLN A 219 12.030 12.737 -3.560 1.00 0.00 N ATOM 0 H GLN A 219 13.395 10.339 0.149 1.00 0.00 H new ATOM 0 HA GLN A 219 15.554 12.041 0.009 1.00 0.00 H new ATOM 0 HB2 GLN A 219 12.545 12.422 0.037 1.00 0.00 H new ATOM 0 HB3 GLN A 219 13.600 13.819 -0.046 1.00 0.00 H new ATOM 0 HG2 GLN A 219 14.675 12.875 -2.102 1.00 0.00 H new ATOM 0 HG3 GLN A 219 13.603 11.491 -2.022 1.00 0.00 H new ATOM 0 HE21 GLN A 219 12.297 11.788 -3.820 1.00 0.00 H new ATOM 0 HE22 GLN A 219 11.304 13.225 -4.085 1.00 0.00 H new ATOM 1586 N LYS A 220 14.100 12.225 2.951 1.00 0.00 N ATOM 1587 CA LYS A 220 14.299 12.716 4.307 1.00 0.00 C ATOM 1588 C LYS A 220 15.778 12.497 4.675 1.00 0.00 C ATOM 1589 O LYS A 220 16.499 13.460 4.941 1.00 0.00 O ATOM 1590 CB LYS A 220 13.321 12.047 5.301 1.00 0.00 C ATOM 1591 CG LYS A 220 11.834 12.378 5.102 1.00 0.00 C ATOM 1592 CD LYS A 220 11.004 11.918 6.309 1.00 0.00 C ATOM 1593 CE LYS A 220 10.920 13.079 7.302 1.00 0.00 C ATOM 1594 NZ LYS A 220 10.535 12.671 8.670 1.00 0.00 N ATOM 0 H LYS A 220 13.386 11.500 2.882 1.00 0.00 H new ATOM 0 HA LYS A 220 14.075 13.781 4.365 1.00 0.00 H new ATOM 0 HB2 LYS A 220 13.445 10.966 5.232 1.00 0.00 H new ATOM 0 HB3 LYS A 220 13.606 12.337 6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 220 11.712 13.452 4.960 1.00 0.00 H new ATOM 0 HG3 LYS A 220 11.467 11.893 4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 220 10.006 11.617 5.991 1.00 0.00 H new ATOM 0 HD3 LYS A 220 11.465 11.049 6.778 1.00 0.00 H new ATOM 0 HE2 LYS A 220 11.887 13.581 7.342 1.00 0.00 H new ATOM 0 HE3 LYS A 220 10.198 13.807 6.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 10.499 13.509 9.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.599 12.218 8.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 11.236 11.999 9.042 1.00 0.00 H new ATOM 1608 N GLU A 221 16.241 11.249 4.646 1.00 0.00 N ATOM 1609 CA GLU A 221 17.600 10.853 5.021 1.00 0.00 C ATOM 1610 C GLU A 221 18.661 11.273 3.997 1.00 0.00 C ATOM 1611 O GLU A 221 19.729 11.748 4.377 1.00 0.00 O ATOM 1612 CB GLU A 221 17.648 9.327 5.139 1.00 0.00 C ATOM 1613 CG GLU A 221 17.506 8.836 6.585 1.00 0.00 C ATOM 1614 CD GLU A 221 17.131 7.354 6.634 1.00 0.00 C ATOM 1615 OE1 GLU A 221 17.958 6.506 6.243 1.00 0.00 O ATOM 1616 OE2 GLU A 221 15.967 7.047 6.998 1.00 0.00 O ATOM 0 H GLU A 221 15.665 10.460 4.352 1.00 0.00 H new ATOM 0 HA GLU A 221 17.827 11.355 5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 221 16.851 8.895 4.534 1.00 0.00 H new ATOM 0 HB3 GLU A 221 18.591 8.965 4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 221 18.443 8.994 7.119 1.00 0.00 H new ATOM 0 HG3 GLU A 221 16.744 9.423 7.098 1.00 0.00 H new ATOM 1623 N SER A 222 18.396 11.028 2.713 1.00 0.00 N ATOM 1624 CA SER A 222 19.204 11.382 1.554 1.00 0.00 C ATOM 1625 C SER A 222 19.543 12.854 1.678 1.00 0.00 C ATOM 1626 O SER A 222 20.725 13.198 1.686 1.00 0.00 O ATOM 1627 CB SER A 222 18.423 11.032 0.283 1.00 0.00 C ATOM 1628 OG SER A 222 19.226 11.116 -0.875 1.00 0.00 O ATOM 0 H SER A 222 17.544 10.539 2.440 1.00 0.00 H new ATOM 0 HA SER A 222 20.140 10.826 1.500 1.00 0.00 H new ATOM 0 HB2 SER A 222 18.021 10.023 0.372 1.00 0.00 H new ATOM 0 HB3 SER A 222 17.573 11.707 0.183 1.00 0.00 H new ATOM 0 HG SER A 222 18.885 10.498 -1.555 1.00 0.00 H new