USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 555 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 223 ASN : amide:sc= -2.37! C(o=-9.7!,f=-11!) USER MOD Set 1.2: A 224 ASN : amide:sc= -7.32! C(o=-9.7!,f=-21!) USER MOD Set 2.1: A 215 THR OG1 : rot 180:sc= 0.167 USER MOD Set 2.2: A 218 SER OG : rot 104:sc= 0.143 USER MOD Set 3.1: A 204 TYR OH : rot -86:sc= 1.06 USER MOD Set 3.2: A 225 CYS SG : rot 159:sc= -0.364 USER MOD Set 4.1: A 196 GLN : amide:sc= 0 K(o=0,f=-1.8) USER MOD Set 4.2: A 199 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 164 ASN : amide:sc= -0.0374 K(o=-0.037,f=-2.2!) USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 173 THR OG1 : rot 180:sc= -0.352 USER MOD Single : A 184 THR OG1 : rot 180:sc= 0 USER MOD Single : A 187 THR OG1 : rot 102:sc= 0.0417 USER MOD Single : A 189 LYS NZ :NH3+ 149:sc= 0.0166 (180deg=0) USER MOD Single : A 190 SER OG : rot 65:sc= 0.12 USER MOD Single : A 191 LYS NZ :NH3+ -150:sc= -0.239 (180deg=-0.859) USER MOD Single : A 192 TYR OH : rot 143:sc= -1.67 USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 200 MET CE :methyl -123:sc= -0.788 (180deg=-2.64!) USER MOD Single : A 201 LYS NZ :NH3+ 156:sc= -7.47! (180deg=-8.72!) USER MOD Single : A 205 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 210 GLN : amide:sc= -4! C(o=-4!,f=-7.1!) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 220 ASN : amide:sc= -0.0284 K(o=-0.028,f=-0.53) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 228 HIS :FLIP no HD1:sc= 0.0194 F(o=-0.62,f=0.019) USER MOD Single : A 229 CYS SG : rot 180:sc= 0 USER MOD Single : A 230 HIS :FLIP no HD1:sc= -1.46 F(o=-2!,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 162 1.072 -16.128 3.512 1.00 0.00 N ATOM 60 CA GLY A 162 1.522 -15.014 2.698 1.00 0.00 C ATOM 61 C GLY A 162 2.606 -14.201 3.377 1.00 0.00 C ATOM 62 O GLY A 162 3.045 -14.536 4.477 1.00 0.00 O ATOM 0 HA2 GLY A 162 1.897 -15.391 1.747 1.00 0.00 H new ATOM 0 HA3 GLY A 162 0.674 -14.367 2.472 1.00 0.00 H new ATOM 66 N ILE A 163 3.040 -13.131 2.719 1.00 0.00 N ATOM 67 CA ILE A 163 4.081 -12.269 3.265 1.00 0.00 C ATOM 68 C ILE A 163 3.494 -10.963 3.790 1.00 0.00 C ATOM 69 O ILE A 163 2.553 -10.419 3.214 1.00 0.00 O ATOM 70 CB ILE A 163 5.157 -11.948 2.212 1.00 0.00 C ATOM 71 CG1 ILE A 163 4.518 -11.318 0.973 1.00 0.00 C ATOM 72 CG2 ILE A 163 5.923 -13.208 1.837 1.00 0.00 C ATOM 73 CD1 ILE A 163 5.500 -11.053 -0.146 1.00 0.00 C ATOM 0 H ILE A 163 2.687 -12.840 1.807 1.00 0.00 H new ATOM 0 HA ILE A 163 4.542 -12.815 4.088 1.00 0.00 H new ATOM 0 HB ILE A 163 5.860 -11.232 2.639 1.00 0.00 H new ATOM 0 HG12 ILE A 163 3.731 -11.976 0.606 1.00 0.00 H new ATOM 0 HG13 ILE A 163 4.042 -10.380 1.257 1.00 0.00 H new ATOM 0 HG21 ILE A 163 6.680 -12.965 1.092 1.00 0.00 H new ATOM 0 HG22 ILE A 163 6.405 -13.618 2.724 1.00 0.00 H new ATOM 0 HG23 ILE A 163 5.233 -13.945 1.426 1.00 0.00 H new ATOM 0 HD11 ILE A 163 4.977 -10.606 -0.991 1.00 0.00 H new ATOM 0 HD12 ILE A 163 6.274 -10.370 0.204 1.00 0.00 H new ATOM 0 HD13 ILE A 163 5.958 -11.992 -0.458 1.00 0.00 H new ATOM 85 N ASN A 164 4.057 -10.465 4.885 1.00 0.00 N ATOM 86 CA ASN A 164 3.590 -9.221 5.487 1.00 0.00 C ATOM 87 C ASN A 164 4.379 -8.029 4.954 1.00 0.00 C ATOM 88 O ASN A 164 5.597 -8.099 4.794 1.00 0.00 O ATOM 89 CB ASN A 164 3.715 -9.289 7.011 1.00 0.00 C ATOM 90 CG ASN A 164 2.692 -10.220 7.634 1.00 0.00 C ATOM 91 OD1 ASN A 164 2.233 -11.170 6.999 1.00 0.00 O ATOM 92 ND2 ASN A 164 2.329 -9.949 8.882 1.00 0.00 N ATOM 0 H ASN A 164 4.837 -10.903 5.374 1.00 0.00 H new ATOM 0 HA ASN A 164 2.541 -9.089 5.220 1.00 0.00 H new ATOM 0 HB2 ASN A 164 4.717 -9.625 7.276 1.00 0.00 H new ATOM 0 HB3 ASN A 164 3.594 -8.289 7.428 1.00 0.00 H new ATOM 0 HD21 ASN A 164 1.643 -10.539 9.353 1.00 0.00 H new ATOM 0 HD22 ASN A 164 2.736 -9.151 9.370 1.00 0.00 H new ATOM 99 N VAL A 165 3.675 -6.935 4.681 1.00 0.00 N ATOM 100 CA VAL A 165 4.309 -5.726 4.168 1.00 0.00 C ATOM 101 C VAL A 165 3.920 -4.507 4.997 1.00 0.00 C ATOM 102 O VAL A 165 2.757 -4.339 5.364 1.00 0.00 O ATOM 103 CB VAL A 165 3.929 -5.475 2.696 1.00 0.00 C ATOM 104 CG1 VAL A 165 4.859 -4.446 2.073 1.00 0.00 C ATOM 105 CG2 VAL A 165 3.957 -6.777 1.910 1.00 0.00 C ATOM 0 H VAL A 165 2.665 -6.861 4.806 1.00 0.00 H new ATOM 0 HA VAL A 165 5.386 -5.879 4.237 1.00 0.00 H new ATOM 0 HB VAL A 165 2.914 -5.079 2.663 1.00 0.00 H new ATOM 0 HG11 VAL A 165 4.576 -4.282 1.033 1.00 0.00 H new ATOM 0 HG12 VAL A 165 4.784 -3.508 2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 165 5.885 -4.810 2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 165 3.686 -6.582 0.872 1.00 0.00 H new ATOM 0 HG22 VAL A 165 4.959 -7.204 1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 165 3.246 -7.480 2.344 1.00 0.00 H new ATOM 115 N ARG A 166 4.901 -3.660 5.288 1.00 0.00 N ATOM 116 CA ARG A 166 4.662 -2.456 6.074 1.00 0.00 C ATOM 117 C ARG A 166 4.543 -1.231 5.172 1.00 0.00 C ATOM 118 O ARG A 166 5.483 -0.877 4.459 1.00 0.00 O ATOM 119 CB ARG A 166 5.791 -2.249 7.086 1.00 0.00 C ATOM 120 CG ARG A 166 6.242 -3.531 7.765 1.00 0.00 C ATOM 121 CD ARG A 166 7.499 -3.310 8.593 1.00 0.00 C ATOM 122 NE ARG A 166 8.708 -3.358 7.776 1.00 0.00 N ATOM 123 CZ ARG A 166 9.860 -2.803 8.135 1.00 0.00 C ATOM 124 NH1 ARG A 166 9.959 -2.163 9.292 1.00 0.00 N ATOM 125 NH2 ARG A 166 10.917 -2.889 7.337 1.00 0.00 N ATOM 0 H ARG A 166 5.869 -3.785 4.991 1.00 0.00 H new ATOM 0 HA ARG A 166 3.721 -2.584 6.610 1.00 0.00 H new ATOM 0 HB2 ARG A 166 6.644 -1.797 6.579 1.00 0.00 H new ATOM 0 HB3 ARG A 166 5.461 -1.542 7.847 1.00 0.00 H new ATOM 0 HG2 ARG A 166 5.444 -3.905 8.406 1.00 0.00 H new ATOM 0 HG3 ARG A 166 6.431 -4.296 7.012 1.00 0.00 H new ATOM 0 HD2 ARG A 166 7.438 -2.344 9.094 1.00 0.00 H new ATOM 0 HD3 ARG A 166 7.558 -4.070 9.372 1.00 0.00 H new ATOM 0 HE ARG A 166 8.666 -3.844 6.880 1.00 0.00 H new ATOM 0 HH11 ARG A 166 9.149 -2.096 9.909 1.00 0.00 H new ATOM 0 HH12 ARG A 166 10.845 -1.738 9.565 1.00 0.00 H new ATOM 0 HH21 ARG A 166 10.845 -3.382 6.447 1.00 0.00 H new ATOM 0 HH22 ARG A 166 11.801 -2.462 7.614 1.00 0.00 H new ATOM 139 N LEU A 167 3.380 -0.588 5.206 1.00 0.00 N ATOM 140 CA LEU A 167 3.137 0.597 4.391 1.00 0.00 C ATOM 141 C LEU A 167 3.601 1.858 5.112 1.00 0.00 C ATOM 142 O LEU A 167 3.021 2.259 6.121 1.00 0.00 O ATOM 143 CB LEU A 167 1.650 0.708 4.049 1.00 0.00 C ATOM 144 CG LEU A 167 1.093 -0.368 3.116 1.00 0.00 C ATOM 145 CD1 LEU A 167 -0.423 -0.431 3.219 1.00 0.00 C ATOM 146 CD2 LEU A 167 1.522 -0.103 1.680 1.00 0.00 C ATOM 0 H LEU A 167 2.591 -0.868 5.789 1.00 0.00 H new ATOM 0 HA LEU A 167 3.709 0.498 3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 167 1.081 0.684 4.979 1.00 0.00 H new ATOM 0 HB3 LEU A 167 1.474 1.682 3.593 1.00 0.00 H new ATOM 0 HG LEU A 167 1.498 -1.333 3.422 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -0.802 -1.202 2.548 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -0.708 -0.669 4.244 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -0.847 0.533 2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 167 1.117 -0.879 1.030 1.00 0.00 H new ATOM 0 HD22 LEU A 167 1.147 0.870 1.362 1.00 0.00 H new ATOM 0 HD23 LEU A 167 2.610 -0.110 1.618 1.00 0.00 H new ATOM 158 N LYS A 168 4.649 2.482 4.586 1.00 0.00 N ATOM 159 CA LYS A 168 5.190 3.701 5.176 1.00 0.00 C ATOM 160 C LYS A 168 4.692 4.934 4.430 1.00 0.00 C ATOM 161 O LYS A 168 4.766 5.002 3.203 1.00 0.00 O ATOM 162 CB LYS A 168 6.720 3.665 5.159 1.00 0.00 C ATOM 163 CG LYS A 168 7.362 4.658 6.113 1.00 0.00 C ATOM 164 CD LYS A 168 7.605 5.999 5.441 1.00 0.00 C ATOM 165 CE LYS A 168 8.782 6.731 6.068 1.00 0.00 C ATOM 166 NZ LYS A 168 8.952 8.096 5.499 1.00 0.00 N ATOM 0 H LYS A 168 5.141 2.164 3.751 1.00 0.00 H new ATOM 0 HA LYS A 168 4.845 3.759 6.208 1.00 0.00 H new ATOM 0 HB2 LYS A 168 7.054 2.660 5.415 1.00 0.00 H new ATOM 0 HB3 LYS A 168 7.069 3.869 4.147 1.00 0.00 H new ATOM 0 HG2 LYS A 168 6.719 4.797 6.982 1.00 0.00 H new ATOM 0 HG3 LYS A 168 8.307 4.256 6.477 1.00 0.00 H new ATOM 0 HD2 LYS A 168 7.794 5.846 4.379 1.00 0.00 H new ATOM 0 HD3 LYS A 168 6.709 6.614 5.519 1.00 0.00 H new ATOM 0 HE2 LYS A 168 8.633 6.803 7.145 1.00 0.00 H new ATOM 0 HE3 LYS A 168 9.694 6.155 5.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 9.764 8.562 5.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 9.119 8.027 4.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 8.092 8.654 5.672 1.00 0.00 H new ATOM 180 N PHE A 169 4.186 5.909 5.178 1.00 0.00 N ATOM 181 CA PHE A 169 3.676 7.141 4.587 1.00 0.00 C ATOM 182 C PHE A 169 4.618 8.308 4.866 1.00 0.00 C ATOM 183 O PHE A 169 5.345 8.311 5.860 1.00 0.00 O ATOM 184 CB PHE A 169 2.281 7.454 5.133 1.00 0.00 C ATOM 185 CG PHE A 169 1.322 6.304 5.021 1.00 0.00 C ATOM 186 CD1 PHE A 169 1.547 5.127 5.715 1.00 0.00 C ATOM 187 CD2 PHE A 169 0.194 6.401 4.222 1.00 0.00 C ATOM 188 CE1 PHE A 169 0.666 4.067 5.613 1.00 0.00 C ATOM 189 CE2 PHE A 169 -0.691 5.345 4.116 1.00 0.00 C ATOM 190 CZ PHE A 169 -0.455 4.177 4.813 1.00 0.00 C ATOM 0 H PHE A 169 4.118 5.870 6.195 1.00 0.00 H new ATOM 0 HA PHE A 169 3.612 6.998 3.508 1.00 0.00 H new ATOM 0 HB2 PHE A 169 2.366 7.745 6.180 1.00 0.00 H new ATOM 0 HB3 PHE A 169 1.873 8.310 4.596 1.00 0.00 H new ATOM 0 HD1 PHE A 169 2.421 5.036 6.343 1.00 0.00 H new ATOM 0 HD2 PHE A 169 0.004 7.313 3.675 1.00 0.00 H new ATOM 0 HE1 PHE A 169 0.854 3.154 6.158 1.00 0.00 H new ATOM 0 HE2 PHE A 169 -1.566 5.433 3.489 1.00 0.00 H new ATOM 0 HZ PHE A 169 -1.146 3.351 4.733 1.00 0.00 H new ATOM 200 N LEU A 170 4.600 9.300 3.982 1.00 0.00 N ATOM 201 CA LEU A 170 5.452 10.474 4.131 1.00 0.00 C ATOM 202 C LEU A 170 5.158 11.197 5.441 1.00 0.00 C ATOM 203 O LEU A 170 5.898 12.092 5.848 1.00 0.00 O ATOM 204 CB LEU A 170 5.250 11.428 2.952 1.00 0.00 C ATOM 205 CG LEU A 170 5.888 11.004 1.629 1.00 0.00 C ATOM 206 CD1 LEU A 170 5.192 11.682 0.459 1.00 0.00 C ATOM 207 CD2 LEU A 170 7.375 11.326 1.626 1.00 0.00 C ATOM 0 H LEU A 170 4.004 9.314 3.154 1.00 0.00 H new ATOM 0 HA LEU A 170 6.489 10.140 4.147 1.00 0.00 H new ATOM 0 HB2 LEU A 170 4.179 11.554 2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 170 5.648 12.404 3.228 1.00 0.00 H new ATOM 0 HG LEU A 170 5.770 9.926 1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 170 5.660 11.368 -0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 170 4.139 11.401 0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 170 5.278 12.764 0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 170 7.812 11.017 0.676 1.00 0.00 H new ATOM 0 HD22 LEU A 170 7.515 12.399 1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 170 7.864 10.793 2.441 1.00 0.00 H new ATOM 219 N ASN A 171 4.072 10.802 6.099 1.00 0.00 N ATOM 220 CA ASN A 171 3.681 11.411 7.365 1.00 0.00 C ATOM 221 C ASN A 171 4.471 10.812 8.524 1.00 0.00 C ATOM 222 O ASN A 171 4.104 10.975 9.688 1.00 0.00 O ATOM 223 CB ASN A 171 2.181 11.223 7.603 1.00 0.00 C ATOM 224 CG ASN A 171 1.349 11.634 6.404 1.00 0.00 C ATOM 225 OD1 ASN A 171 1.641 12.633 5.745 1.00 0.00 O ATOM 226 ND2 ASN A 171 0.307 10.864 6.115 1.00 0.00 N ATOM 0 H ASN A 171 3.448 10.063 5.776 1.00 0.00 H new ATOM 0 HA ASN A 171 3.903 12.477 7.311 1.00 0.00 H new ATOM 0 HB2 ASN A 171 1.982 10.178 7.839 1.00 0.00 H new ATOM 0 HB3 ASN A 171 1.877 11.809 8.470 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -0.289 11.091 5.319 1.00 0.00 H new ATOM 0 HD22 ASN A 171 0.103 10.046 6.689 1.00 0.00 H new ATOM 233 N ASP A 172 5.556 10.119 8.198 1.00 0.00 N ATOM 234 CA ASP A 172 6.400 9.497 9.212 1.00 0.00 C ATOM 235 C ASP A 172 5.625 8.435 9.986 1.00 0.00 C ATOM 236 O ASP A 172 5.875 8.208 11.170 1.00 0.00 O ATOM 237 CB ASP A 172 6.941 10.554 10.175 1.00 0.00 C ATOM 238 CG ASP A 172 7.753 11.621 9.467 1.00 0.00 C ATOM 239 OD1 ASP A 172 8.529 11.267 8.554 1.00 0.00 O ATOM 240 OD2 ASP A 172 7.612 12.809 9.824 1.00 0.00 O ATOM 0 H ASP A 172 5.872 9.974 7.239 1.00 0.00 H new ATOM 0 HA ASP A 172 7.237 9.015 8.707 1.00 0.00 H new ATOM 0 HB2 ASP A 172 6.109 11.023 10.700 1.00 0.00 H new ATOM 0 HB3 ASP A 172 7.561 10.070 10.930 1.00 0.00 H new ATOM 245 N THR A 173 4.681 7.788 9.310 1.00 0.00 N ATOM 246 CA THR A 173 3.867 6.752 9.934 1.00 0.00 C ATOM 247 C THR A 173 3.967 5.438 9.168 1.00 0.00 C ATOM 248 O THR A 173 4.582 5.375 8.104 1.00 0.00 O ATOM 249 CB THR A 173 2.388 7.173 10.018 1.00 0.00 C ATOM 250 OG1 THR A 173 1.630 6.167 10.698 1.00 0.00 O ATOM 251 CG2 THR A 173 1.810 7.399 8.629 1.00 0.00 C ATOM 0 H THR A 173 4.461 7.963 8.330 1.00 0.00 H new ATOM 0 HA THR A 173 4.254 6.612 10.943 1.00 0.00 H new ATOM 0 HB THR A 173 2.330 8.108 10.575 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.691 6.443 10.749 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.765 7.695 8.714 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.371 8.186 8.125 1.00 0.00 H new ATOM 0 HG23 THR A 173 1.880 6.477 8.051 1.00 0.00 H new ATOM 259 N GLU A 174 3.357 4.391 9.715 1.00 0.00 N ATOM 260 CA GLU A 174 3.378 3.078 9.081 1.00 0.00 C ATOM 261 C GLU A 174 2.043 2.363 9.266 1.00 0.00 C ATOM 262 O GLU A 174 1.286 2.669 10.186 1.00 0.00 O ATOM 263 CB GLU A 174 4.510 2.226 9.659 1.00 0.00 C ATOM 264 CG GLU A 174 5.878 2.567 9.093 1.00 0.00 C ATOM 265 CD GLU A 174 7.003 2.257 10.061 1.00 0.00 C ATOM 266 OE1 GLU A 174 7.340 1.065 10.220 1.00 0.00 O ATOM 267 OE2 GLU A 174 7.548 3.208 10.661 1.00 0.00 O ATOM 0 H GLU A 174 2.843 4.427 10.595 1.00 0.00 H new ATOM 0 HA GLU A 174 3.549 3.221 8.014 1.00 0.00 H new ATOM 0 HB2 GLU A 174 4.532 2.352 10.741 1.00 0.00 H new ATOM 0 HB3 GLU A 174 4.298 1.175 9.465 1.00 0.00 H new ATOM 0 HG2 GLU A 174 6.034 2.010 8.169 1.00 0.00 H new ATOM 0 HG3 GLU A 174 5.907 3.626 8.835 1.00 0.00 H new ATOM 274 N GLU A 175 1.762 1.410 8.383 1.00 0.00 N ATOM 275 CA GLU A 175 0.517 0.652 8.449 1.00 0.00 C ATOM 276 C GLU A 175 0.759 -0.821 8.130 1.00 0.00 C ATOM 277 O GLU A 175 1.425 -1.154 7.149 1.00 0.00 O ATOM 278 CB GLU A 175 -0.511 1.233 7.476 1.00 0.00 C ATOM 279 CG GLU A 175 -1.800 0.432 7.403 1.00 0.00 C ATOM 280 CD GLU A 175 -2.798 0.833 8.472 1.00 0.00 C ATOM 281 OE1 GLU A 175 -3.270 1.989 8.439 1.00 0.00 O ATOM 282 OE2 GLU A 175 -3.106 -0.008 9.342 1.00 0.00 O ATOM 0 H GLU A 175 2.378 1.144 7.615 1.00 0.00 H new ATOM 0 HA GLU A 175 0.129 0.727 9.465 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -0.745 2.255 7.775 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -0.068 1.285 6.481 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -2.252 0.567 6.420 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -1.570 -0.629 7.505 1.00 0.00 H new ATOM 289 N LEU A 176 0.214 -1.698 8.966 1.00 0.00 N ATOM 290 CA LEU A 176 0.371 -3.135 8.775 1.00 0.00 C ATOM 291 C LEU A 176 -0.524 -3.635 7.645 1.00 0.00 C ATOM 292 O LEU A 176 -1.748 -3.531 7.718 1.00 0.00 O ATOM 293 CB LEU A 176 0.041 -3.881 10.070 1.00 0.00 C ATOM 294 CG LEU A 176 0.336 -5.381 10.074 1.00 0.00 C ATOM 295 CD1 LEU A 176 1.796 -5.639 9.735 1.00 0.00 C ATOM 296 CD2 LEU A 176 -0.016 -5.990 11.424 1.00 0.00 C ATOM 0 H LEU A 176 -0.340 -1.439 9.782 1.00 0.00 H new ATOM 0 HA LEU A 176 1.409 -3.329 8.505 1.00 0.00 H new ATOM 0 HB2 LEU A 176 0.599 -3.419 10.884 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -1.017 -3.739 10.288 1.00 0.00 H new ATOM 0 HG LEU A 176 -0.282 -5.855 9.312 1.00 0.00 H new ATOM 0 HD11 LEU A 176 1.987 -6.712 9.743 1.00 0.00 H new ATOM 0 HD12 LEU A 176 2.016 -5.238 8.746 1.00 0.00 H new ATOM 0 HD13 LEU A 176 2.433 -5.152 10.474 1.00 0.00 H new ATOM 0 HD21 LEU A 176 0.200 -7.058 11.409 1.00 0.00 H new ATOM 0 HD22 LEU A 176 0.575 -5.511 12.204 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -1.076 -5.837 11.627 1.00 0.00 H new ATOM 308 N ALA A 177 0.095 -4.180 6.604 1.00 0.00 N ATOM 309 CA ALA A 177 -0.645 -4.701 5.461 1.00 0.00 C ATOM 310 C ALA A 177 -0.008 -5.980 4.930 1.00 0.00 C ATOM 311 O ALA A 177 1.182 -6.008 4.616 1.00 0.00 O ATOM 312 CB ALA A 177 -0.724 -3.652 4.362 1.00 0.00 C ATOM 0 H ALA A 177 1.108 -4.273 6.528 1.00 0.00 H new ATOM 0 HA ALA A 177 -1.655 -4.941 5.793 1.00 0.00 H new ATOM 0 HB1 ALA A 177 -1.279 -4.054 3.514 1.00 0.00 H new ATOM 0 HB2 ALA A 177 -1.232 -2.765 4.741 1.00 0.00 H new ATOM 0 HB3 ALA A 177 0.283 -3.384 4.042 1.00 0.00 H new ATOM 318 N VAL A 178 -0.807 -7.038 4.833 1.00 0.00 N ATOM 319 CA VAL A 178 -0.321 -8.320 4.339 1.00 0.00 C ATOM 320 C VAL A 178 -0.524 -8.443 2.833 1.00 0.00 C ATOM 321 O VAL A 178 -1.647 -8.346 2.339 1.00 0.00 O ATOM 322 CB VAL A 178 -1.028 -9.496 5.039 1.00 0.00 C ATOM 323 CG1 VAL A 178 -2.504 -9.524 4.674 1.00 0.00 C ATOM 324 CG2 VAL A 178 -0.356 -10.812 4.679 1.00 0.00 C ATOM 0 H VAL A 178 -1.794 -7.032 5.090 1.00 0.00 H new ATOM 0 HA VAL A 178 0.745 -8.361 4.563 1.00 0.00 H new ATOM 0 HB VAL A 178 -0.947 -9.357 6.117 1.00 0.00 H new ATOM 0 HG11 VAL A 178 -2.987 -10.361 5.177 1.00 0.00 H new ATOM 0 HG12 VAL A 178 -2.974 -8.592 4.987 1.00 0.00 H new ATOM 0 HG13 VAL A 178 -2.610 -9.639 3.595 1.00 0.00 H new ATOM 0 HG21 VAL A 178 -0.868 -11.632 5.182 1.00 0.00 H new ATOM 0 HG22 VAL A 178 -0.404 -10.962 3.600 1.00 0.00 H new ATOM 0 HG23 VAL A 178 0.687 -10.787 4.996 1.00 0.00 H new ATOM 334 N ALA A 179 0.569 -8.657 2.109 1.00 0.00 N ATOM 335 CA ALA A 179 0.511 -8.795 0.659 1.00 0.00 C ATOM 336 C ALA A 179 1.106 -10.125 0.210 1.00 0.00 C ATOM 337 O ALA A 179 1.904 -10.732 0.925 1.00 0.00 O ATOM 338 CB ALA A 179 1.235 -7.637 -0.011 1.00 0.00 C ATOM 0 H ALA A 179 1.506 -8.739 2.503 1.00 0.00 H new ATOM 0 HA ALA A 179 -0.537 -8.776 0.359 1.00 0.00 H new ATOM 0 HB1 ALA A 179 1.184 -7.753 -1.094 1.00 0.00 H new ATOM 0 HB2 ALA A 179 0.762 -6.698 0.276 1.00 0.00 H new ATOM 0 HB3 ALA A 179 2.278 -7.629 0.304 1.00 0.00 H new ATOM 344 N ARG A 180 0.713 -10.573 -0.978 1.00 0.00 N ATOM 345 CA ARG A 180 1.207 -11.833 -1.521 1.00 0.00 C ATOM 346 C ARG A 180 2.096 -11.589 -2.737 1.00 0.00 C ATOM 347 O ARG A 180 1.961 -10.590 -3.445 1.00 0.00 O ATOM 348 CB ARG A 180 0.038 -12.741 -1.904 1.00 0.00 C ATOM 349 CG ARG A 180 -0.836 -13.139 -0.726 1.00 0.00 C ATOM 350 CD ARG A 180 -1.590 -14.430 -1.002 1.00 0.00 C ATOM 351 NE ARG A 180 -2.882 -14.184 -1.637 1.00 0.00 N ATOM 352 CZ ARG A 180 -3.867 -15.076 -1.670 1.00 0.00 C ATOM 353 NH1 ARG A 180 -3.707 -16.265 -1.107 1.00 0.00 N ATOM 354 NH2 ARG A 180 -5.014 -14.778 -2.267 1.00 0.00 N ATOM 0 H ARG A 180 0.054 -10.082 -1.583 1.00 0.00 H new ATOM 0 HA ARG A 180 1.801 -12.324 -0.750 1.00 0.00 H new ATOM 0 HB2 ARG A 180 -0.577 -12.233 -2.647 1.00 0.00 H new ATOM 0 HB3 ARG A 180 0.429 -13.642 -2.376 1.00 0.00 H new ATOM 0 HG2 ARG A 180 -0.217 -13.261 0.163 1.00 0.00 H new ATOM 0 HG3 ARG A 180 -1.546 -12.340 -0.512 1.00 0.00 H new ATOM 0 HD2 ARG A 180 -0.987 -15.072 -1.644 1.00 0.00 H new ATOM 0 HD3 ARG A 180 -1.742 -14.968 -0.066 1.00 0.00 H new ATOM 0 HE ARG A 180 -3.037 -13.278 -2.079 1.00 0.00 H new ATOM 0 HH11 ARG A 180 -2.827 -16.497 -0.647 1.00 0.00 H new ATOM 0 HH12 ARG A 180 -4.464 -16.948 -1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 180 -5.140 -13.864 -2.701 1.00 0.00 H new ATOM 0 HH22 ARG A 180 -5.769 -15.463 -2.292 1.00 0.00 H new ATOM 368 N PRO A 181 3.027 -12.522 -2.987 1.00 0.00 N ATOM 369 CA PRO A 181 3.956 -12.431 -4.117 1.00 0.00 C ATOM 370 C PRO A 181 3.257 -12.628 -5.459 1.00 0.00 C ATOM 371 O PRO A 181 3.890 -12.567 -6.512 1.00 0.00 O ATOM 372 CB PRO A 181 4.944 -13.570 -3.857 1.00 0.00 C ATOM 373 CG PRO A 181 4.184 -14.550 -3.032 1.00 0.00 C ATOM 374 CD PRO A 181 3.244 -13.738 -2.185 1.00 0.00 C ATOM 0 HA PRO A 181 4.424 -11.449 -4.181 1.00 0.00 H new ATOM 0 HB2 PRO A 181 5.285 -14.019 -4.790 1.00 0.00 H new ATOM 0 HB3 PRO A 181 5.830 -13.213 -3.332 1.00 0.00 H new ATOM 0 HG2 PRO A 181 3.635 -15.249 -3.663 1.00 0.00 H new ATOM 0 HG3 PRO A 181 4.857 -15.142 -2.411 1.00 0.00 H new ATOM 0 HD2 PRO A 181 2.310 -14.269 -1.999 1.00 0.00 H new ATOM 0 HD3 PRO A 181 3.678 -13.506 -1.212 1.00 0.00 H new ATOM 382 N GLU A 182 1.950 -12.864 -5.411 1.00 0.00 N ATOM 383 CA GLU A 182 1.167 -13.070 -6.624 1.00 0.00 C ATOM 384 C GLU A 182 0.206 -11.908 -6.855 1.00 0.00 C ATOM 385 O GLU A 182 -0.131 -11.584 -7.994 1.00 0.00 O ATOM 386 CB GLU A 182 0.386 -14.383 -6.536 1.00 0.00 C ATOM 387 CG GLU A 182 -0.568 -14.445 -5.356 1.00 0.00 C ATOM 388 CD GLU A 182 -1.541 -15.605 -5.452 1.00 0.00 C ATOM 389 OE1 GLU A 182 -2.251 -15.699 -6.475 1.00 0.00 O ATOM 390 OE2 GLU A 182 -1.592 -16.417 -4.505 1.00 0.00 O ATOM 0 H GLU A 182 1.411 -12.917 -4.546 1.00 0.00 H new ATOM 0 HA GLU A 182 1.856 -13.121 -7.467 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -0.180 -14.522 -7.457 1.00 0.00 H new ATOM 0 HB3 GLU A 182 1.091 -15.211 -6.466 1.00 0.00 H new ATOM 0 HG2 GLU A 182 0.006 -14.533 -4.434 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -1.127 -13.511 -5.296 1.00 0.00 H new ATOM 397 N ASP A 183 -0.232 -11.285 -5.767 1.00 0.00 N ATOM 398 CA ASP A 183 -1.154 -10.158 -5.850 1.00 0.00 C ATOM 399 C ASP A 183 -0.596 -9.064 -6.755 1.00 0.00 C ATOM 400 O ASP A 183 0.550 -9.136 -7.200 1.00 0.00 O ATOM 401 CB ASP A 183 -1.429 -9.592 -4.456 1.00 0.00 C ATOM 402 CG ASP A 183 -2.539 -10.334 -3.738 1.00 0.00 C ATOM 403 OD1 ASP A 183 -3.649 -10.431 -4.302 1.00 0.00 O ATOM 404 OD2 ASP A 183 -2.298 -10.817 -2.612 1.00 0.00 O ATOM 0 H ASP A 183 0.036 -11.541 -4.817 1.00 0.00 H new ATOM 0 HA ASP A 183 -2.089 -10.518 -6.279 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -0.518 -9.643 -3.860 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -1.696 -8.539 -4.541 1.00 0.00 H new ATOM 409 N THR A 184 -1.415 -8.052 -7.026 1.00 0.00 N ATOM 410 CA THR A 184 -1.004 -6.945 -7.880 1.00 0.00 C ATOM 411 C THR A 184 -0.985 -5.632 -7.106 1.00 0.00 C ATOM 412 O THR A 184 -1.646 -5.496 -6.077 1.00 0.00 O ATOM 413 CB THR A 184 -1.938 -6.797 -9.096 1.00 0.00 C ATOM 414 OG1 THR A 184 -3.305 -6.804 -8.668 1.00 0.00 O ATOM 415 CG2 THR A 184 -1.709 -7.922 -10.094 1.00 0.00 C ATOM 0 H THR A 184 -2.366 -7.977 -6.666 1.00 0.00 H new ATOM 0 HA THR A 184 0.003 -7.172 -8.230 1.00 0.00 H new ATOM 0 HB THR A 184 -1.715 -5.848 -9.584 1.00 0.00 H new ATOM 0 HG1 THR A 184 -3.892 -6.708 -9.447 1.00 0.00 H new ATOM 0 HG21 THR A 184 -2.380 -7.796 -10.944 1.00 0.00 H new ATOM 0 HG22 THR A 184 -0.676 -7.897 -10.440 1.00 0.00 H new ATOM 0 HG23 THR A 184 -1.907 -8.880 -9.614 1.00 0.00 H new ATOM 423 N VAL A 185 -0.223 -4.665 -7.609 1.00 0.00 N ATOM 424 CA VAL A 185 -0.119 -3.361 -6.965 1.00 0.00 C ATOM 425 C VAL A 185 -1.472 -2.661 -6.921 1.00 0.00 C ATOM 426 O VAL A 185 -1.851 -2.083 -5.904 1.00 0.00 O ATOM 427 CB VAL A 185 0.892 -2.455 -7.693 1.00 0.00 C ATOM 428 CG1 VAL A 185 0.938 -1.079 -7.047 1.00 0.00 C ATOM 429 CG2 VAL A 185 2.272 -3.096 -7.700 1.00 0.00 C ATOM 0 H VAL A 185 0.331 -4.760 -8.460 1.00 0.00 H new ATOM 0 HA VAL A 185 0.229 -3.537 -5.947 1.00 0.00 H new ATOM 0 HB VAL A 185 0.567 -2.334 -8.726 1.00 0.00 H new ATOM 0 HG11 VAL A 185 1.658 -0.453 -7.575 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -0.049 -0.620 -7.099 1.00 0.00 H new ATOM 0 HG13 VAL A 185 1.239 -1.177 -6.004 1.00 0.00 H new ATOM 0 HG21 VAL A 185 2.974 -2.443 -8.218 1.00 0.00 H new ATOM 0 HG22 VAL A 185 2.608 -3.248 -6.674 1.00 0.00 H new ATOM 0 HG23 VAL A 185 2.224 -4.057 -8.213 1.00 0.00 H new ATOM 439 N GLY A 186 -2.198 -2.717 -8.034 1.00 0.00 N ATOM 440 CA GLY A 186 -3.502 -2.084 -8.101 1.00 0.00 C ATOM 441 C GLY A 186 -4.456 -2.606 -7.045 1.00 0.00 C ATOM 442 O GLY A 186 -5.196 -1.838 -6.430 1.00 0.00 O ATOM 0 H GLY A 186 -1.906 -3.189 -8.890 1.00 0.00 H new ATOM 0 HA2 GLY A 186 -3.386 -1.007 -7.981 1.00 0.00 H new ATOM 0 HA3 GLY A 186 -3.932 -2.250 -9.089 1.00 0.00 H new ATOM 446 N THR A 187 -4.440 -3.919 -6.833 1.00 0.00 N ATOM 447 CA THR A 187 -5.312 -4.544 -5.846 1.00 0.00 C ATOM 448 C THR A 187 -4.927 -4.127 -4.431 1.00 0.00 C ATOM 449 O THR A 187 -5.788 -3.784 -3.618 1.00 0.00 O ATOM 450 CB THR A 187 -5.264 -6.080 -5.947 1.00 0.00 C ATOM 451 OG1 THR A 187 -6.031 -6.521 -7.073 1.00 0.00 O ATOM 452 CG2 THR A 187 -5.802 -6.723 -4.678 1.00 0.00 C ATOM 0 H THR A 187 -3.833 -4.569 -7.332 1.00 0.00 H new ATOM 0 HA THR A 187 -6.326 -4.205 -6.059 1.00 0.00 H new ATOM 0 HB THR A 187 -4.224 -6.381 -6.075 1.00 0.00 H new ATOM 0 HG1 THR A 187 -5.428 -6.744 -7.813 1.00 0.00 H new ATOM 0 HG21 THR A 187 -5.758 -7.808 -4.773 1.00 0.00 H new ATOM 0 HG22 THR A 187 -5.198 -6.409 -3.827 1.00 0.00 H new ATOM 0 HG23 THR A 187 -6.836 -6.414 -4.524 1.00 0.00 H new ATOM 460 N LEU A 188 -3.631 -4.157 -4.142 1.00 0.00 N ATOM 461 CA LEU A 188 -3.132 -3.781 -2.823 1.00 0.00 C ATOM 462 C LEU A 188 -3.596 -2.378 -2.446 1.00 0.00 C ATOM 463 O LEU A 188 -4.078 -2.149 -1.336 1.00 0.00 O ATOM 464 CB LEU A 188 -1.605 -3.851 -2.795 1.00 0.00 C ATOM 465 CG LEU A 188 -0.963 -3.960 -1.412 1.00 0.00 C ATOM 466 CD1 LEU A 188 -1.081 -5.380 -0.879 1.00 0.00 C ATOM 467 CD2 LEU A 188 0.495 -3.528 -1.465 1.00 0.00 C ATOM 0 H LEU A 188 -2.906 -4.438 -4.803 1.00 0.00 H new ATOM 0 HA LEU A 188 -3.535 -4.485 -2.094 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -1.290 -4.709 -3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -1.211 -2.962 -3.287 1.00 0.00 H new ATOM 0 HG LEU A 188 -1.494 -3.293 -0.733 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -0.618 -5.438 0.106 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -2.133 -5.654 -0.803 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -0.576 -6.067 -1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 188 0.936 -3.612 -0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 188 1.039 -4.169 -2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 188 0.556 -2.493 -1.802 1.00 0.00 H new ATOM 479 N LYS A 189 -3.448 -1.441 -3.376 1.00 0.00 N ATOM 480 CA LYS A 189 -3.854 -0.060 -3.144 1.00 0.00 C ATOM 481 C LYS A 189 -5.335 0.019 -2.790 1.00 0.00 C ATOM 482 O LYS A 189 -5.716 0.667 -1.815 1.00 0.00 O ATOM 483 CB LYS A 189 -3.568 0.792 -4.382 1.00 0.00 C ATOM 484 CG LYS A 189 -2.087 0.963 -4.675 1.00 0.00 C ATOM 485 CD LYS A 189 -1.833 1.186 -6.156 1.00 0.00 C ATOM 486 CE LYS A 189 -1.938 2.659 -6.524 1.00 0.00 C ATOM 487 NZ LYS A 189 -2.100 2.853 -7.991 1.00 0.00 N ATOM 0 H LYS A 189 -3.049 -1.613 -4.299 1.00 0.00 H new ATOM 0 HA LYS A 189 -3.277 0.326 -2.304 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -4.050 0.335 -5.246 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.019 1.775 -4.248 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -1.698 1.808 -4.107 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -1.545 0.078 -4.341 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -0.842 0.815 -6.416 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -2.552 0.612 -6.740 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -2.786 3.104 -6.003 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -1.044 3.183 -6.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -2.665 3.708 -8.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -1.164 2.959 -8.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -2.584 2.028 -8.399 1.00 0.00 H new ATOM 501 N SER A 190 -6.166 -0.645 -3.587 1.00 0.00 N ATOM 502 CA SER A 190 -7.606 -0.647 -3.359 1.00 0.00 C ATOM 503 C SER A 190 -7.958 -1.463 -2.119 1.00 0.00 C ATOM 504 O SER A 190 -8.963 -1.205 -1.456 1.00 0.00 O ATOM 505 CB SER A 190 -8.336 -1.212 -4.579 1.00 0.00 C ATOM 506 OG SER A 190 -9.741 -1.103 -4.428 1.00 0.00 O ATOM 0 H SER A 190 -5.867 -1.189 -4.396 1.00 0.00 H new ATOM 0 HA SER A 190 -7.925 0.383 -3.198 1.00 0.00 H new ATOM 0 HB2 SER A 190 -8.021 -0.678 -5.475 1.00 0.00 H new ATOM 0 HB3 SER A 190 -8.062 -2.258 -4.719 1.00 0.00 H new ATOM 0 HG SER A 190 -9.995 -0.157 -4.403 1.00 0.00 H new ATOM 512 N LYS A 191 -7.123 -2.450 -1.811 1.00 0.00 N ATOM 513 CA LYS A 191 -7.343 -3.304 -0.650 1.00 0.00 C ATOM 514 C LYS A 191 -7.235 -2.503 0.644 1.00 0.00 C ATOM 515 O LYS A 191 -8.093 -2.605 1.521 1.00 0.00 O ATOM 516 CB LYS A 191 -6.331 -4.452 -0.637 1.00 0.00 C ATOM 517 CG LYS A 191 -6.829 -5.694 0.081 1.00 0.00 C ATOM 518 CD LYS A 191 -6.429 -5.689 1.547 1.00 0.00 C ATOM 519 CE LYS A 191 -5.103 -6.403 1.765 1.00 0.00 C ATOM 520 NZ LYS A 191 -5.165 -7.829 1.338 1.00 0.00 N ATOM 0 H LYS A 191 -6.287 -2.678 -2.350 1.00 0.00 H new ATOM 0 HA LYS A 191 -8.350 -3.715 -0.719 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -6.078 -4.714 -1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -5.413 -4.110 -0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -7.914 -5.752 -0.001 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -6.425 -6.582 -0.404 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -6.352 -4.661 1.901 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -7.206 -6.173 2.139 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -4.319 -5.891 1.208 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -4.831 -6.351 2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -4.512 -8.394 1.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -6.134 -8.186 1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -4.893 -7.904 0.337 1.00 0.00 H new ATOM 534 N TYR A 192 -6.178 -1.707 0.755 1.00 0.00 N ATOM 535 CA TYR A 192 -5.958 -0.889 1.942 1.00 0.00 C ATOM 536 C TYR A 192 -6.396 0.552 1.699 1.00 0.00 C ATOM 537 O TYR A 192 -7.052 1.164 2.542 1.00 0.00 O ATOM 538 CB TYR A 192 -4.483 -0.925 2.345 1.00 0.00 C ATOM 539 CG TYR A 192 -3.945 -2.323 2.550 1.00 0.00 C ATOM 540 CD1 TYR A 192 -4.434 -3.135 3.566 1.00 0.00 C ATOM 541 CD2 TYR A 192 -2.947 -2.832 1.728 1.00 0.00 C ATOM 542 CE1 TYR A 192 -3.945 -4.413 3.757 1.00 0.00 C ATOM 543 CE2 TYR A 192 -2.453 -4.109 1.910 1.00 0.00 C ATOM 544 CZ TYR A 192 -2.955 -4.895 2.926 1.00 0.00 C ATOM 545 OH TYR A 192 -2.465 -6.167 3.113 1.00 0.00 O ATOM 0 H TYR A 192 -5.460 -1.610 0.037 1.00 0.00 H new ATOM 0 HA TYR A 192 -6.559 -1.300 2.753 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -3.893 -0.427 1.576 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -4.353 -0.356 3.265 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -5.210 -2.761 4.218 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -2.551 -2.218 0.933 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -4.335 -5.031 4.552 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -1.678 -4.490 1.261 1.00 0.00 H new ATOM 0 HH TYR A 192 -2.276 -6.576 2.243 1.00 0.00 H new ATOM 555 N PHE A 193 -6.028 1.088 0.540 1.00 0.00 N ATOM 556 CA PHE A 193 -6.382 2.458 0.185 1.00 0.00 C ATOM 557 C PHE A 193 -7.422 2.478 -0.932 1.00 0.00 C ATOM 558 O PHE A 193 -7.108 2.691 -2.103 1.00 0.00 O ATOM 559 CB PHE A 193 -5.136 3.232 -0.249 1.00 0.00 C ATOM 560 CG PHE A 193 -3.931 2.958 0.605 1.00 0.00 C ATOM 561 CD1 PHE A 193 -3.972 3.174 1.973 1.00 0.00 C ATOM 562 CD2 PHE A 193 -2.758 2.484 0.041 1.00 0.00 C ATOM 563 CE1 PHE A 193 -2.866 2.922 2.763 1.00 0.00 C ATOM 564 CE2 PHE A 193 -1.649 2.230 0.825 1.00 0.00 C ATOM 565 CZ PHE A 193 -1.702 2.450 2.187 1.00 0.00 C ATOM 0 H PHE A 193 -5.485 0.595 -0.169 1.00 0.00 H new ATOM 0 HA PHE A 193 -6.811 2.937 1.065 1.00 0.00 H new ATOM 0 HB2 PHE A 193 -4.903 2.979 -1.283 1.00 0.00 H new ATOM 0 HB3 PHE A 193 -5.354 4.300 -0.223 1.00 0.00 H new ATOM 0 HD1 PHE A 193 -4.879 3.544 2.428 1.00 0.00 H new ATOM 0 HD2 PHE A 193 -2.710 2.311 -1.024 1.00 0.00 H new ATOM 0 HE1 PHE A 193 -2.912 3.094 3.828 1.00 0.00 H new ATOM 0 HE2 PHE A 193 -0.741 1.860 0.373 1.00 0.00 H new ATOM 0 HZ PHE A 193 -0.835 2.254 2.801 1.00 0.00 H new ATOM 575 N PRO A 194 -8.691 2.252 -0.562 1.00 0.00 N ATOM 576 CA PRO A 194 -9.803 2.240 -1.516 1.00 0.00 C ATOM 577 C PRO A 194 -10.109 3.628 -2.069 1.00 0.00 C ATOM 578 O PRO A 194 -10.174 4.603 -1.322 1.00 0.00 O ATOM 579 CB PRO A 194 -10.980 1.725 -0.683 1.00 0.00 C ATOM 580 CG PRO A 194 -10.635 2.085 0.721 1.00 0.00 C ATOM 581 CD PRO A 194 -9.138 1.992 0.817 1.00 0.00 C ATOM 0 HA PRO A 194 -9.582 1.629 -2.391 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -11.917 2.189 -0.992 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -11.105 0.648 -0.797 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -10.980 3.091 0.962 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -11.114 1.406 1.427 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -8.734 2.725 1.515 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -8.818 1.010 1.165 1.00 0.00 H new ATOM 589 N GLY A 195 -10.296 3.709 -3.383 1.00 0.00 N ATOM 590 CA GLY A 195 -10.593 4.982 -4.013 1.00 0.00 C ATOM 591 C GLY A 195 -9.375 5.878 -4.110 1.00 0.00 C ATOM 592 O GLY A 195 -9.122 6.481 -5.153 1.00 0.00 O ATOM 0 H GLY A 195 -10.247 2.916 -4.022 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -10.991 4.805 -5.012 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.371 5.492 -3.445 1.00 0.00 H new ATOM 596 N GLN A 196 -8.619 5.968 -3.020 1.00 0.00 N ATOM 597 CA GLN A 196 -7.423 6.800 -2.987 1.00 0.00 C ATOM 598 C GLN A 196 -6.233 6.067 -3.598 1.00 0.00 C ATOM 599 O GLN A 196 -5.111 6.166 -3.103 1.00 0.00 O ATOM 600 CB GLN A 196 -7.100 7.210 -1.549 1.00 0.00 C ATOM 601 CG GLN A 196 -8.287 7.799 -0.804 1.00 0.00 C ATOM 602 CD GLN A 196 -8.456 9.285 -1.055 1.00 0.00 C ATOM 603 OE1 GLN A 196 -7.995 9.810 -2.069 1.00 0.00 O ATOM 604 NE2 GLN A 196 -9.118 9.970 -0.131 1.00 0.00 N ATOM 0 H GLN A 196 -8.814 5.475 -2.149 1.00 0.00 H new ATOM 0 HA GLN A 196 -7.618 7.695 -3.578 1.00 0.00 H new ATOM 0 HB2 GLN A 196 -6.736 6.339 -1.005 1.00 0.00 H new ATOM 0 HB3 GLN A 196 -6.290 7.940 -1.561 1.00 0.00 H new ATOM 0 HG2 GLN A 196 -9.195 7.278 -1.106 1.00 0.00 H new ATOM 0 HG3 GLN A 196 -8.162 7.627 0.265 1.00 0.00 H new ATOM 0 HE21 GLN A 196 -9.483 9.493 0.694 1.00 0.00 H new ATOM 0 HE22 GLN A 196 -9.262 10.973 -0.246 1.00 0.00 H new ATOM 613 N GLU A 197 -6.487 5.332 -4.676 1.00 0.00 N ATOM 614 CA GLU A 197 -5.436 4.581 -5.353 1.00 0.00 C ATOM 615 C GLU A 197 -4.702 5.461 -6.360 1.00 0.00 C ATOM 616 O GLU A 197 -3.522 5.251 -6.641 1.00 0.00 O ATOM 617 CB GLU A 197 -6.026 3.360 -6.061 1.00 0.00 C ATOM 618 CG GLU A 197 -6.730 2.394 -5.123 1.00 0.00 C ATOM 619 CD GLU A 197 -8.214 2.681 -4.996 1.00 0.00 C ATOM 620 OE1 GLU A 197 -8.636 3.796 -5.368 1.00 0.00 O ATOM 621 OE2 GLU A 197 -8.952 1.791 -4.524 1.00 0.00 O ATOM 0 H GLU A 197 -7.411 5.241 -5.099 1.00 0.00 H new ATOM 0 HA GLU A 197 -4.722 4.246 -4.601 1.00 0.00 H new ATOM 0 HB2 GLU A 197 -6.733 3.697 -6.820 1.00 0.00 H new ATOM 0 HB3 GLU A 197 -5.227 2.831 -6.581 1.00 0.00 H new ATOM 0 HG2 GLU A 197 -6.590 1.375 -5.485 1.00 0.00 H new ATOM 0 HG3 GLU A 197 -6.268 2.448 -4.137 1.00 0.00 H new ATOM 628 N SER A 198 -5.409 6.448 -6.902 1.00 0.00 N ATOM 629 CA SER A 198 -4.828 7.358 -7.881 1.00 0.00 C ATOM 630 C SER A 198 -3.842 8.314 -7.216 1.00 0.00 C ATOM 631 O SER A 198 -3.066 8.990 -7.891 1.00 0.00 O ATOM 632 CB SER A 198 -5.928 8.151 -8.588 1.00 0.00 C ATOM 633 OG SER A 198 -6.586 7.357 -9.560 1.00 0.00 O ATOM 0 H SER A 198 -6.386 6.637 -6.679 1.00 0.00 H new ATOM 0 HA SER A 198 -4.289 6.763 -8.618 1.00 0.00 H new ATOM 0 HB2 SER A 198 -6.652 8.508 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 198 -5.497 9.031 -9.065 1.00 0.00 H new ATOM 0 HG SER A 198 -7.286 7.887 -9.996 1.00 0.00 H new ATOM 639 N GLN A 199 -3.881 8.365 -5.889 1.00 0.00 N ATOM 640 CA GLN A 199 -2.992 9.239 -5.132 1.00 0.00 C ATOM 641 C GLN A 199 -1.963 8.426 -4.353 1.00 0.00 C ATOM 642 O GLN A 199 -0.769 8.724 -4.386 1.00 0.00 O ATOM 643 CB GLN A 199 -3.799 10.115 -4.173 1.00 0.00 C ATOM 644 CG GLN A 199 -4.752 11.068 -4.875 1.00 0.00 C ATOM 645 CD GLN A 199 -5.970 11.399 -4.036 1.00 0.00 C ATOM 646 OE1 GLN A 199 -5.852 11.760 -2.865 1.00 0.00 O ATOM 647 NE2 GLN A 199 -7.151 11.278 -4.632 1.00 0.00 N ATOM 0 H GLN A 199 -4.518 7.812 -5.316 1.00 0.00 H new ATOM 0 HA GLN A 199 -2.463 9.878 -5.839 1.00 0.00 H new ATOM 0 HB2 GLN A 199 -4.369 9.474 -3.501 1.00 0.00 H new ATOM 0 HB3 GLN A 199 -3.111 10.692 -3.555 1.00 0.00 H new ATOM 0 HG2 GLN A 199 -4.223 11.989 -5.120 1.00 0.00 H new ATOM 0 HG3 GLN A 199 -5.074 10.625 -5.817 1.00 0.00 H new ATOM 0 HE21 GLN A 199 -7.203 10.976 -5.605 1.00 0.00 H new ATOM 0 HE22 GLN A 199 -8.006 11.488 -4.117 1.00 0.00 H new ATOM 656 N MET A 200 -2.433 7.398 -3.654 1.00 0.00 N ATOM 657 CA MET A 200 -1.553 6.542 -2.868 1.00 0.00 C ATOM 658 C MET A 200 -0.571 5.799 -3.768 1.00 0.00 C ATOM 659 O MET A 200 -0.819 4.661 -4.168 1.00 0.00 O ATOM 660 CB MET A 200 -2.374 5.541 -2.053 1.00 0.00 C ATOM 661 CG MET A 200 -2.959 6.129 -0.779 1.00 0.00 C ATOM 662 SD MET A 200 -3.569 7.810 -1.006 1.00 0.00 S ATOM 663 CE MET A 200 -2.149 8.761 -0.471 1.00 0.00 C ATOM 0 H MET A 200 -3.419 7.138 -3.616 1.00 0.00 H new ATOM 0 HA MET A 200 -0.986 7.175 -2.186 1.00 0.00 H new ATOM 0 HB2 MET A 200 -3.185 5.159 -2.673 1.00 0.00 H new ATOM 0 HB3 MET A 200 -1.743 4.691 -1.795 1.00 0.00 H new ATOM 0 HG2 MET A 200 -3.775 5.495 -0.432 1.00 0.00 H new ATOM 0 HG3 MET A 200 -2.198 6.125 0.001 1.00 0.00 H new ATOM 0 HE1 MET A 200 -2.442 9.427 0.340 1.00 0.00 H new ATOM 0 HE2 MET A 200 -1.369 8.085 -0.121 1.00 0.00 H new ATOM 0 HE3 MET A 200 -1.771 9.351 -1.306 1.00 0.00 H new ATOM 673 N LYS A 201 0.544 6.449 -4.083 1.00 0.00 N ATOM 674 CA LYS A 201 1.564 5.850 -4.935 1.00 0.00 C ATOM 675 C LYS A 201 2.584 5.079 -4.104 1.00 0.00 C ATOM 676 O LYS A 201 3.009 5.537 -3.042 1.00 0.00 O ATOM 677 CB LYS A 201 2.272 6.932 -5.755 1.00 0.00 C ATOM 678 CG LYS A 201 1.579 7.251 -7.068 1.00 0.00 C ATOM 679 CD LYS A 201 1.402 6.006 -7.922 1.00 0.00 C ATOM 680 CE LYS A 201 1.225 6.359 -9.391 1.00 0.00 C ATOM 681 NZ LYS A 201 2.532 6.471 -10.096 1.00 0.00 N ATOM 0 H LYS A 201 0.764 7.391 -3.761 1.00 0.00 H new ATOM 0 HA LYS A 201 1.072 5.152 -5.612 1.00 0.00 H new ATOM 0 HB2 LYS A 201 2.339 7.842 -5.159 1.00 0.00 H new ATOM 0 HB3 LYS A 201 3.293 6.610 -5.961 1.00 0.00 H new ATOM 0 HG2 LYS A 201 0.605 7.697 -6.867 1.00 0.00 H new ATOM 0 HG3 LYS A 201 2.161 7.991 -7.618 1.00 0.00 H new ATOM 0 HD2 LYS A 201 2.269 5.357 -7.805 1.00 0.00 H new ATOM 0 HD3 LYS A 201 0.534 5.445 -7.574 1.00 0.00 H new ATOM 0 HE2 LYS A 201 0.615 5.598 -9.876 1.00 0.00 H new ATOM 0 HE3 LYS A 201 0.685 7.302 -9.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.393 6.306 -11.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 2.925 7.423 -9.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 3.192 5.762 -9.718 1.00 0.00 H new ATOM 695 N LEU A 202 2.974 3.907 -4.592 1.00 0.00 N ATOM 696 CA LEU A 202 3.945 3.072 -3.894 1.00 0.00 C ATOM 697 C LEU A 202 5.298 3.107 -4.598 1.00 0.00 C ATOM 698 O LEU A 202 5.370 3.115 -5.827 1.00 0.00 O ATOM 699 CB LEU A 202 3.440 1.631 -3.808 1.00 0.00 C ATOM 700 CG LEU A 202 1.956 1.458 -3.482 1.00 0.00 C ATOM 701 CD1 LEU A 202 1.603 -0.017 -3.367 1.00 0.00 C ATOM 702 CD2 LEU A 202 1.603 2.194 -2.198 1.00 0.00 C ATOM 0 H LEU A 202 2.633 3.513 -5.469 1.00 0.00 H new ATOM 0 HA LEU A 202 4.069 3.468 -2.886 1.00 0.00 H new ATOM 0 HB2 LEU A 202 3.642 1.139 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 202 4.022 1.108 -3.049 1.00 0.00 H new ATOM 0 HG LEU A 202 1.372 1.888 -4.296 1.00 0.00 H new ATOM 0 HD11 LEU A 202 0.543 -0.120 -3.135 1.00 0.00 H new ATOM 0 HD12 LEU A 202 1.818 -0.517 -4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 202 2.195 -0.472 -2.573 1.00 0.00 H new ATOM 0 HD21 LEU A 202 0.543 2.060 -1.981 1.00 0.00 H new ATOM 0 HD22 LEU A 202 2.195 1.794 -1.375 1.00 0.00 H new ATOM 0 HD23 LEU A 202 1.818 3.256 -2.317 1.00 0.00 H new ATOM 714 N ILE A 203 6.368 3.127 -3.810 1.00 0.00 N ATOM 715 CA ILE A 203 7.719 3.158 -4.358 1.00 0.00 C ATOM 716 C ILE A 203 8.589 2.071 -3.736 1.00 0.00 C ATOM 717 O ILE A 203 8.755 2.014 -2.517 1.00 0.00 O ATOM 718 CB ILE A 203 8.387 4.527 -4.131 1.00 0.00 C ATOM 719 CG1 ILE A 203 7.650 5.615 -4.914 1.00 0.00 C ATOM 720 CG2 ILE A 203 9.852 4.475 -4.536 1.00 0.00 C ATOM 721 CD1 ILE A 203 7.870 7.008 -4.368 1.00 0.00 C ATOM 0 H ILE A 203 6.326 3.122 -2.791 1.00 0.00 H new ATOM 0 HA ILE A 203 7.629 2.980 -5.430 1.00 0.00 H new ATOM 0 HB ILE A 203 8.332 4.770 -3.070 1.00 0.00 H new ATOM 0 HG12 ILE A 203 7.975 5.586 -5.954 1.00 0.00 H new ATOM 0 HG13 ILE A 203 6.582 5.396 -4.907 1.00 0.00 H new ATOM 0 HG21 ILE A 203 10.310 5.450 -4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 203 10.368 3.724 -3.938 1.00 0.00 H new ATOM 0 HG23 ILE A 203 9.929 4.213 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 203 7.317 7.727 -4.973 1.00 0.00 H new ATOM 0 HD12 ILE A 203 7.519 7.054 -3.337 1.00 0.00 H new ATOM 0 HD13 ILE A 203 8.933 7.248 -4.400 1.00 0.00 H new ATOM 733 N TYR A 204 9.144 1.210 -4.582 1.00 0.00 N ATOM 734 CA TYR A 204 9.998 0.123 -4.116 1.00 0.00 C ATOM 735 C TYR A 204 11.398 0.236 -4.712 1.00 0.00 C ATOM 736 O TYR A 204 11.585 0.068 -5.917 1.00 0.00 O ATOM 737 CB TYR A 204 9.383 -1.229 -4.481 1.00 0.00 C ATOM 738 CG TYR A 204 10.142 -2.410 -3.921 1.00 0.00 C ATOM 739 CD1 TYR A 204 11.177 -2.999 -4.638 1.00 0.00 C ATOM 740 CD2 TYR A 204 9.825 -2.939 -2.676 1.00 0.00 C ATOM 741 CE1 TYR A 204 11.873 -4.079 -4.131 1.00 0.00 C ATOM 742 CE2 TYR A 204 10.517 -4.017 -2.160 1.00 0.00 C ATOM 743 CZ TYR A 204 11.539 -4.585 -2.892 1.00 0.00 C ATOM 744 OH TYR A 204 12.230 -5.660 -2.382 1.00 0.00 O ATOM 0 H TYR A 204 9.018 1.243 -5.594 1.00 0.00 H new ATOM 0 HA TYR A 204 10.078 0.197 -3.031 1.00 0.00 H new ATOM 0 HB2 TYR A 204 8.356 -1.262 -4.117 1.00 0.00 H new ATOM 0 HB3 TYR A 204 9.339 -1.318 -5.567 1.00 0.00 H new ATOM 0 HD1 TYR A 204 11.442 -2.605 -5.608 1.00 0.00 H new ATOM 0 HD2 TYR A 204 9.023 -2.499 -2.101 1.00 0.00 H new ATOM 0 HE1 TYR A 204 12.674 -4.525 -4.702 1.00 0.00 H new ATOM 0 HE2 TYR A 204 10.259 -4.413 -1.189 1.00 0.00 H new ATOM 0 HH TYR A 204 11.828 -6.492 -2.708 1.00 0.00 H new ATOM 754 N GLN A 205 12.376 0.520 -3.859 1.00 0.00 N ATOM 755 CA GLN A 205 13.759 0.655 -4.301 1.00 0.00 C ATOM 756 C GLN A 205 13.905 1.808 -5.289 1.00 0.00 C ATOM 757 O GLN A 205 14.575 1.681 -6.313 1.00 0.00 O ATOM 758 CB GLN A 205 14.241 -0.646 -4.944 1.00 0.00 C ATOM 759 CG GLN A 205 14.446 -1.777 -3.949 1.00 0.00 C ATOM 760 CD GLN A 205 15.124 -2.984 -4.568 1.00 0.00 C ATOM 761 OE1 GLN A 205 15.414 -3.001 -5.765 1.00 0.00 O ATOM 762 NE2 GLN A 205 15.380 -4.001 -3.755 1.00 0.00 N ATOM 0 H GLN A 205 12.237 0.661 -2.858 1.00 0.00 H new ATOM 0 HA GLN A 205 14.373 0.869 -3.427 1.00 0.00 H new ATOM 0 HB2 GLN A 205 13.516 -0.961 -5.695 1.00 0.00 H new ATOM 0 HB3 GLN A 205 15.179 -0.458 -5.466 1.00 0.00 H new ATOM 0 HG2 GLN A 205 15.046 -1.416 -3.114 1.00 0.00 H new ATOM 0 HG3 GLN A 205 13.480 -2.077 -3.542 1.00 0.00 H new ATOM 0 HE21 GLN A 205 15.122 -3.944 -2.770 1.00 0.00 H new ATOM 0 HE22 GLN A 205 15.835 -4.840 -4.115 1.00 0.00 H new ATOM 771 N GLY A 206 13.272 2.934 -4.974 1.00 0.00 N ATOM 772 CA GLY A 206 13.343 4.094 -5.844 1.00 0.00 C ATOM 773 C GLY A 206 12.521 3.923 -7.106 1.00 0.00 C ATOM 774 O GLY A 206 12.491 4.809 -7.960 1.00 0.00 O ATOM 0 H GLY A 206 12.711 3.064 -4.132 1.00 0.00 H new ATOM 0 HA2 GLY A 206 12.993 4.973 -5.302 1.00 0.00 H new ATOM 0 HA3 GLY A 206 14.383 4.279 -6.114 1.00 0.00 H new ATOM 778 N ARG A 207 11.854 2.779 -7.226 1.00 0.00 N ATOM 779 CA ARG A 207 11.031 2.494 -8.395 1.00 0.00 C ATOM 780 C ARG A 207 9.552 2.700 -8.081 1.00 0.00 C ATOM 781 O ARG A 207 9.082 2.352 -6.997 1.00 0.00 O ATOM 782 CB ARG A 207 11.267 1.061 -8.874 1.00 0.00 C ATOM 783 CG ARG A 207 10.923 0.843 -10.338 1.00 0.00 C ATOM 784 CD ARG A 207 11.379 -0.525 -10.820 1.00 0.00 C ATOM 785 NE ARG A 207 12.793 -0.534 -11.186 1.00 0.00 N ATOM 786 CZ ARG A 207 13.274 0.057 -12.275 1.00 0.00 C ATOM 787 NH1 ARG A 207 12.458 0.700 -13.099 1.00 0.00 N ATOM 788 NH2 ARG A 207 14.573 0.005 -12.540 1.00 0.00 N ATOM 0 H ARG A 207 11.868 2.035 -6.528 1.00 0.00 H new ATOM 0 HA ARG A 207 11.317 3.186 -9.187 1.00 0.00 H new ATOM 0 HB2 ARG A 207 12.313 0.801 -8.713 1.00 0.00 H new ATOM 0 HB3 ARG A 207 10.672 0.381 -8.265 1.00 0.00 H new ATOM 0 HG2 ARG A 207 9.846 0.939 -10.478 1.00 0.00 H new ATOM 0 HG3 ARG A 207 11.393 1.618 -10.943 1.00 0.00 H new ATOM 0 HD2 ARG A 207 11.203 -1.262 -10.037 1.00 0.00 H new ATOM 0 HD3 ARG A 207 10.780 -0.824 -11.680 1.00 0.00 H new ATOM 0 HE ARG A 207 13.447 -1.020 -10.572 1.00 0.00 H new ATOM 0 HH11 ARG A 207 11.459 0.742 -12.898 1.00 0.00 H new ATOM 0 HH12 ARG A 207 12.829 1.153 -13.934 1.00 0.00 H new ATOM 0 HH21 ARG A 207 15.203 -0.489 -11.908 1.00 0.00 H new ATOM 0 HH22 ARG A 207 14.942 0.459 -13.376 1.00 0.00 H new ATOM 802 N LEU A 208 8.824 3.268 -9.036 1.00 0.00 N ATOM 803 CA LEU A 208 7.397 3.521 -8.862 1.00 0.00 C ATOM 804 C LEU A 208 6.576 2.296 -9.250 1.00 0.00 C ATOM 805 O LEU A 208 6.700 1.779 -10.361 1.00 0.00 O ATOM 806 CB LEU A 208 6.967 4.725 -9.701 1.00 0.00 C ATOM 807 CG LEU A 208 5.655 5.395 -9.291 1.00 0.00 C ATOM 808 CD1 LEU A 208 5.739 5.900 -7.859 1.00 0.00 C ATOM 809 CD2 LEU A 208 5.318 6.534 -10.241 1.00 0.00 C ATOM 0 H LEU A 208 9.198 3.562 -9.938 1.00 0.00 H new ATOM 0 HA LEU A 208 7.217 3.737 -7.809 1.00 0.00 H new ATOM 0 HB2 LEU A 208 7.760 5.471 -9.662 1.00 0.00 H new ATOM 0 HB3 LEU A 208 6.880 4.406 -10.740 1.00 0.00 H new ATOM 0 HG LEU A 208 4.858 4.654 -9.347 1.00 0.00 H new ATOM 0 HD11 LEU A 208 4.797 6.374 -7.584 1.00 0.00 H new ATOM 0 HD12 LEU A 208 5.933 5.063 -7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 208 6.548 6.626 -7.776 1.00 0.00 H new ATOM 0 HD21 LEU A 208 4.381 6.999 -9.934 1.00 0.00 H new ATOM 0 HD22 LEU A 208 6.116 7.276 -10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 208 5.215 6.145 -11.254 1.00 0.00 H new ATOM 821 N LEU A 209 5.735 1.838 -8.330 1.00 0.00 N ATOM 822 CA LEU A 209 4.890 0.675 -8.576 1.00 0.00 C ATOM 823 C LEU A 209 3.624 1.071 -9.329 1.00 0.00 C ATOM 824 O LEU A 209 2.626 0.350 -9.307 1.00 0.00 O ATOM 825 CB LEU A 209 4.520 -0.001 -7.255 1.00 0.00 C ATOM 826 CG LEU A 209 5.619 -0.043 -6.192 1.00 0.00 C ATOM 827 CD1 LEU A 209 5.177 -0.878 -5.000 1.00 0.00 C ATOM 828 CD2 LEU A 209 6.910 -0.593 -6.781 1.00 0.00 C ATOM 0 H LEU A 209 5.620 2.255 -7.406 1.00 0.00 H new ATOM 0 HA LEU A 209 5.452 -0.027 -9.191 1.00 0.00 H new ATOM 0 HB2 LEU A 209 3.656 0.514 -6.836 1.00 0.00 H new ATOM 0 HB3 LEU A 209 4.209 -1.024 -7.468 1.00 0.00 H new ATOM 0 HG LEU A 209 5.804 0.975 -5.848 1.00 0.00 H new ATOM 0 HD11 LEU A 209 5.972 -0.897 -4.254 1.00 0.00 H new ATOM 0 HD12 LEU A 209 4.279 -0.441 -4.563 1.00 0.00 H new ATOM 0 HD13 LEU A 209 4.963 -1.895 -5.328 1.00 0.00 H new ATOM 0 HD21 LEU A 209 7.681 -0.616 -6.011 1.00 0.00 H new ATOM 0 HD22 LEU A 209 6.739 -1.603 -7.153 1.00 0.00 H new ATOM 0 HD23 LEU A 209 7.236 0.045 -7.602 1.00 0.00 H new ATOM 840 N GLN A 210 3.673 2.220 -9.996 1.00 0.00 N ATOM 841 CA GLN A 210 2.530 2.711 -10.757 1.00 0.00 C ATOM 842 C GLN A 210 1.756 1.555 -11.382 1.00 0.00 C ATOM 843 O GLN A 210 0.543 1.439 -11.204 1.00 0.00 O ATOM 844 CB GLN A 210 2.994 3.678 -11.847 1.00 0.00 C ATOM 845 CG GLN A 210 4.246 3.219 -12.576 1.00 0.00 C ATOM 846 CD GLN A 210 3.934 2.372 -13.794 1.00 0.00 C ATOM 847 OE1 GLN A 210 2.774 2.212 -14.173 1.00 0.00 O ATOM 848 NE2 GLN A 210 4.972 1.822 -14.414 1.00 0.00 N ATOM 0 H GLN A 210 4.492 2.828 -10.025 1.00 0.00 H new ATOM 0 HA GLN A 210 1.868 3.239 -10.071 1.00 0.00 H new ATOM 0 HB2 GLN A 210 2.190 3.809 -12.571 1.00 0.00 H new ATOM 0 HB3 GLN A 210 3.182 4.654 -11.399 1.00 0.00 H new ATOM 0 HG2 GLN A 210 4.824 4.091 -12.883 1.00 0.00 H new ATOM 0 HG3 GLN A 210 4.872 2.647 -11.891 1.00 0.00 H new ATOM 0 HE21 GLN A 210 5.917 1.981 -14.065 1.00 0.00 H new ATOM 0 HE22 GLN A 210 4.824 1.240 -15.239 1.00 0.00 H new ATOM 857 N ASP A 211 2.464 0.703 -12.114 1.00 0.00 N ATOM 858 CA ASP A 211 1.843 -0.445 -12.766 1.00 0.00 C ATOM 859 C ASP A 211 0.957 -1.211 -11.789 1.00 0.00 C ATOM 860 O ASP A 211 1.436 -1.924 -10.906 1.00 0.00 O ATOM 861 CB ASP A 211 2.915 -1.374 -13.339 1.00 0.00 C ATOM 862 CG ASP A 211 2.339 -2.405 -14.290 1.00 0.00 C ATOM 863 OD1 ASP A 211 1.366 -3.087 -13.906 1.00 0.00 O ATOM 864 OD2 ASP A 211 2.861 -2.529 -15.418 1.00 0.00 O ATOM 0 H ASP A 211 3.468 0.785 -12.271 1.00 0.00 H new ATOM 0 HA ASP A 211 1.220 -0.076 -13.581 1.00 0.00 H new ATOM 0 HB2 ASP A 211 3.665 -0.780 -13.862 1.00 0.00 H new ATOM 0 HB3 ASP A 211 3.425 -1.883 -12.521 1.00 0.00 H new ATOM 869 N PRO A 212 -0.366 -1.061 -11.947 1.00 0.00 N ATOM 870 CA PRO A 212 -1.347 -1.731 -11.088 1.00 0.00 C ATOM 871 C PRO A 212 -1.391 -3.237 -11.322 1.00 0.00 C ATOM 872 O PRO A 212 -2.107 -3.961 -10.631 1.00 0.00 O ATOM 873 CB PRO A 212 -2.674 -1.087 -11.496 1.00 0.00 C ATOM 874 CG PRO A 212 -2.455 -0.622 -12.894 1.00 0.00 C ATOM 875 CD PRO A 212 -1.007 -0.227 -12.977 1.00 0.00 C ATOM 0 HA PRO A 212 -1.109 -1.615 -10.031 1.00 0.00 H new ATOM 0 HB2 PRO A 212 -3.495 -1.802 -11.441 1.00 0.00 H new ATOM 0 HB3 PRO A 212 -2.930 -0.257 -10.838 1.00 0.00 H new ATOM 0 HG2 PRO A 212 -2.686 -1.412 -13.609 1.00 0.00 H new ATOM 0 HG3 PRO A 212 -3.104 0.221 -13.131 1.00 0.00 H new ATOM 0 HD2 PRO A 212 -0.593 -0.422 -13.966 1.00 0.00 H new ATOM 0 HD3 PRO A 212 -0.868 0.836 -12.777 1.00 0.00 H new ATOM 883 N ALA A 213 -0.620 -3.701 -12.300 1.00 0.00 N ATOM 884 CA ALA A 213 -0.569 -5.122 -12.623 1.00 0.00 C ATOM 885 C ALA A 213 0.737 -5.747 -12.145 1.00 0.00 C ATOM 886 O ALA A 213 0.789 -6.937 -11.834 1.00 0.00 O ATOM 887 CB ALA A 213 -0.739 -5.329 -14.121 1.00 0.00 C ATOM 0 H ALA A 213 -0.022 -3.114 -12.882 1.00 0.00 H new ATOM 0 HA ALA A 213 -1.389 -5.617 -12.104 1.00 0.00 H new ATOM 0 HB1 ALA A 213 -0.699 -6.394 -14.348 1.00 0.00 H new ATOM 0 HB2 ALA A 213 -1.701 -4.927 -14.437 1.00 0.00 H new ATOM 0 HB3 ALA A 213 0.061 -4.814 -14.653 1.00 0.00 H new ATOM 893 N ARG A 214 1.790 -4.938 -12.090 1.00 0.00 N ATOM 894 CA ARG A 214 3.097 -5.413 -11.652 1.00 0.00 C ATOM 895 C ARG A 214 2.973 -6.250 -10.383 1.00 0.00 C ATOM 896 O ARG A 214 2.693 -5.726 -9.304 1.00 0.00 O ATOM 897 CB ARG A 214 4.037 -4.231 -11.407 1.00 0.00 C ATOM 898 CG ARG A 214 4.837 -3.825 -12.634 1.00 0.00 C ATOM 899 CD ARG A 214 5.815 -4.913 -13.047 1.00 0.00 C ATOM 900 NE ARG A 214 6.880 -4.396 -13.903 1.00 0.00 N ATOM 901 CZ ARG A 214 7.752 -5.169 -14.540 1.00 0.00 C ATOM 902 NH1 ARG A 214 7.685 -6.488 -14.419 1.00 0.00 N ATOM 903 NH2 ARG A 214 8.692 -4.624 -15.301 1.00 0.00 N ATOM 0 H ARG A 214 1.763 -3.950 -12.343 1.00 0.00 H new ATOM 0 HA ARG A 214 3.512 -6.040 -12.441 1.00 0.00 H new ATOM 0 HB2 ARG A 214 3.452 -3.377 -11.066 1.00 0.00 H new ATOM 0 HB3 ARG A 214 4.726 -4.487 -10.602 1.00 0.00 H new ATOM 0 HG2 ARG A 214 4.157 -3.613 -13.459 1.00 0.00 H new ATOM 0 HG3 ARG A 214 5.382 -2.904 -12.426 1.00 0.00 H new ATOM 0 HD2 ARG A 214 6.253 -5.364 -12.156 1.00 0.00 H new ATOM 0 HD3 ARG A 214 5.278 -5.702 -13.573 1.00 0.00 H new ATOM 0 HE ARG A 214 6.958 -3.385 -14.018 1.00 0.00 H new ATOM 0 HH11 ARG A 214 6.963 -6.911 -13.836 1.00 0.00 H new ATOM 0 HH12 ARG A 214 8.356 -7.080 -14.909 1.00 0.00 H new ATOM 0 HH21 ARG A 214 8.746 -3.610 -15.397 1.00 0.00 H new ATOM 0 HH22 ARG A 214 9.361 -5.219 -15.790 1.00 0.00 H new ATOM 917 N THR A 215 3.184 -7.556 -10.518 1.00 0.00 N ATOM 918 CA THR A 215 3.095 -8.467 -9.384 1.00 0.00 C ATOM 919 C THR A 215 4.142 -8.134 -8.328 1.00 0.00 C ATOM 920 O THR A 215 5.230 -7.652 -8.648 1.00 0.00 O ATOM 921 CB THR A 215 3.273 -9.932 -9.824 1.00 0.00 C ATOM 922 OG1 THR A 215 4.177 -10.004 -10.932 1.00 0.00 O ATOM 923 CG2 THR A 215 1.937 -10.547 -10.212 1.00 0.00 C ATOM 0 H THR A 215 3.418 -8.006 -11.403 1.00 0.00 H new ATOM 0 HA THR A 215 2.100 -8.343 -8.957 1.00 0.00 H new ATOM 0 HB THR A 215 3.683 -10.493 -8.984 1.00 0.00 H new ATOM 0 HG1 THR A 215 4.286 -10.939 -11.205 1.00 0.00 H new ATOM 0 HG21 THR A 215 2.088 -11.582 -10.519 1.00 0.00 H new ATOM 0 HG22 THR A 215 1.261 -10.517 -9.358 1.00 0.00 H new ATOM 0 HG23 THR A 215 1.503 -9.983 -11.038 1.00 0.00 H new ATOM 931 N LEU A 216 3.810 -8.394 -7.069 1.00 0.00 N ATOM 932 CA LEU A 216 4.723 -8.122 -5.964 1.00 0.00 C ATOM 933 C LEU A 216 5.988 -8.966 -6.084 1.00 0.00 C ATOM 934 O LEU A 216 7.069 -8.545 -5.672 1.00 0.00 O ATOM 935 CB LEU A 216 4.035 -8.401 -4.627 1.00 0.00 C ATOM 936 CG LEU A 216 2.552 -8.036 -4.546 1.00 0.00 C ATOM 937 CD1 LEU A 216 2.169 -7.672 -3.120 1.00 0.00 C ATOM 938 CD2 LEU A 216 2.233 -6.890 -5.495 1.00 0.00 C ATOM 0 H LEU A 216 2.915 -8.793 -6.787 1.00 0.00 H new ATOM 0 HA LEU A 216 5.004 -7.070 -6.008 1.00 0.00 H new ATOM 0 HB2 LEU A 216 4.140 -9.462 -4.402 1.00 0.00 H new ATOM 0 HB3 LEU A 216 4.566 -7.855 -3.847 1.00 0.00 H new ATOM 0 HG LEU A 216 1.966 -8.905 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 216 1.110 -7.415 -3.082 1.00 0.00 H new ATOM 0 HD12 LEU A 216 2.360 -8.521 -2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 216 2.761 -6.818 -2.791 1.00 0.00 H new ATOM 0 HD21 LEU A 216 1.174 -6.643 -5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 216 2.828 -6.017 -5.225 1.00 0.00 H new ATOM 0 HD23 LEU A 216 2.469 -7.187 -6.517 1.00 0.00 H new ATOM 950 N SER A 217 5.846 -10.160 -6.651 1.00 0.00 N ATOM 951 CA SER A 217 6.976 -11.064 -6.824 1.00 0.00 C ATOM 952 C SER A 217 8.006 -10.470 -7.781 1.00 0.00 C ATOM 953 O SER A 217 9.209 -10.519 -7.524 1.00 0.00 O ATOM 954 CB SER A 217 6.497 -12.419 -7.349 1.00 0.00 C ATOM 955 OG SER A 217 7.569 -13.155 -7.913 1.00 0.00 O ATOM 0 H SER A 217 4.959 -10.523 -6.998 1.00 0.00 H new ATOM 0 HA SER A 217 7.448 -11.205 -5.852 1.00 0.00 H new ATOM 0 HB2 SER A 217 6.048 -12.990 -6.536 1.00 0.00 H new ATOM 0 HB3 SER A 217 5.721 -12.268 -8.099 1.00 0.00 H new ATOM 0 HG SER A 217 7.237 -14.017 -8.240 1.00 0.00 H new ATOM 961 N SER A 218 7.523 -9.910 -8.886 1.00 0.00 N ATOM 962 CA SER A 218 8.400 -9.310 -9.884 1.00 0.00 C ATOM 963 C SER A 218 9.098 -8.075 -9.322 1.00 0.00 C ATOM 964 O SER A 218 10.258 -7.805 -9.637 1.00 0.00 O ATOM 965 CB SER A 218 7.603 -8.934 -11.134 1.00 0.00 C ATOM 966 OG SER A 218 7.185 -10.090 -11.839 1.00 0.00 O ATOM 0 H SER A 218 6.530 -9.860 -9.112 1.00 0.00 H new ATOM 0 HA SER A 218 9.159 -10.044 -10.153 1.00 0.00 H new ATOM 0 HB2 SER A 218 6.732 -8.343 -10.850 1.00 0.00 H new ATOM 0 HB3 SER A 218 8.214 -8.309 -11.785 1.00 0.00 H new ATOM 0 HG SER A 218 6.231 -10.244 -11.678 1.00 0.00 H new ATOM 972 N LEU A 219 8.383 -7.328 -8.488 1.00 0.00 N ATOM 973 CA LEU A 219 8.932 -6.120 -7.881 1.00 0.00 C ATOM 974 C LEU A 219 9.901 -6.469 -6.756 1.00 0.00 C ATOM 975 O LEU A 219 10.445 -5.585 -6.095 1.00 0.00 O ATOM 976 CB LEU A 219 7.804 -5.238 -7.343 1.00 0.00 C ATOM 977 CG LEU A 219 6.853 -4.654 -8.387 1.00 0.00 C ATOM 978 CD1 LEU A 219 5.730 -3.881 -7.713 1.00 0.00 C ATOM 979 CD2 LEU A 219 7.611 -3.759 -9.358 1.00 0.00 C ATOM 0 H LEU A 219 7.422 -7.537 -8.217 1.00 0.00 H new ATOM 0 HA LEU A 219 9.478 -5.572 -8.649 1.00 0.00 H new ATOM 0 HB2 LEU A 219 7.218 -5.824 -6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 219 8.249 -4.414 -6.785 1.00 0.00 H new ATOM 0 HG LEU A 219 6.413 -5.477 -8.950 1.00 0.00 H new ATOM 0 HD11 LEU A 219 5.063 -3.472 -8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 219 5.170 -4.549 -7.059 1.00 0.00 H new ATOM 0 HD13 LEU A 219 6.151 -3.066 -7.124 1.00 0.00 H new ATOM 0 HD21 LEU A 219 6.918 -3.352 -10.094 1.00 0.00 H new ATOM 0 HD22 LEU A 219 8.079 -2.942 -8.810 1.00 0.00 H new ATOM 0 HD23 LEU A 219 8.379 -4.342 -9.866 1.00 0.00 H new ATOM 991 N ASN A 220 10.114 -7.764 -6.545 1.00 0.00 N ATOM 992 CA ASN A 220 11.019 -8.230 -5.501 1.00 0.00 C ATOM 993 C ASN A 220 10.467 -7.902 -4.116 1.00 0.00 C ATOM 994 O ASN A 220 11.220 -7.780 -3.150 1.00 0.00 O ATOM 995 CB ASN A 220 12.401 -7.595 -5.674 1.00 0.00 C ATOM 996 CG ASN A 220 12.931 -7.742 -7.087 1.00 0.00 C ATOM 997 OD1 ASN A 220 12.728 -6.869 -7.932 1.00 0.00 O ATOM 998 ND2 ASN A 220 13.614 -8.850 -7.351 1.00 0.00 N ATOM 0 H ASN A 220 9.672 -8.509 -7.083 1.00 0.00 H new ATOM 0 HA ASN A 220 11.110 -9.313 -5.590 1.00 0.00 H new ATOM 0 HB2 ASN A 220 12.347 -6.537 -5.417 1.00 0.00 H new ATOM 0 HB3 ASN A 220 13.100 -8.057 -4.977 1.00 0.00 H new ATOM 0 HD21 ASN A 220 13.995 -9.004 -8.285 1.00 0.00 H new ATOM 0 HD22 ASN A 220 13.758 -9.547 -6.620 1.00 0.00 H new ATOM 1005 N ILE A 221 9.149 -7.762 -4.029 1.00 0.00 N ATOM 1006 CA ILE A 221 8.496 -7.451 -2.763 1.00 0.00 C ATOM 1007 C ILE A 221 8.387 -8.691 -1.882 1.00 0.00 C ATOM 1008 O ILE A 221 7.541 -9.556 -2.109 1.00 0.00 O ATOM 1009 CB ILE A 221 7.089 -6.867 -2.985 1.00 0.00 C ATOM 1010 CG1 ILE A 221 7.185 -5.422 -3.479 1.00 0.00 C ATOM 1011 CG2 ILE A 221 6.277 -6.940 -1.700 1.00 0.00 C ATOM 1012 CD1 ILE A 221 5.954 -4.955 -4.225 1.00 0.00 C ATOM 0 H ILE A 221 8.512 -7.859 -4.820 1.00 0.00 H new ATOM 0 HA ILE A 221 9.115 -6.706 -2.263 1.00 0.00 H new ATOM 0 HB ILE A 221 6.582 -7.459 -3.747 1.00 0.00 H new ATOM 0 HG12 ILE A 221 7.354 -4.765 -2.626 1.00 0.00 H new ATOM 0 HG13 ILE A 221 8.053 -5.326 -4.131 1.00 0.00 H new ATOM 0 HG21 ILE A 221 5.285 -6.523 -1.873 1.00 0.00 H new ATOM 0 HG22 ILE A 221 6.185 -7.980 -1.387 1.00 0.00 H new ATOM 0 HG23 ILE A 221 6.779 -6.369 -0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 221 6.093 -3.922 -4.545 1.00 0.00 H new ATOM 0 HD12 ILE A 221 5.796 -5.588 -5.098 1.00 0.00 H new ATOM 0 HD13 ILE A 221 5.086 -5.018 -3.569 1.00 0.00 H new ATOM 1024 N THR A 222 9.249 -8.770 -0.872 1.00 0.00 N ATOM 1025 CA THR A 222 9.250 -9.903 0.044 1.00 0.00 C ATOM 1026 C THR A 222 8.605 -9.533 1.375 1.00 0.00 C ATOM 1027 O THR A 222 8.130 -8.413 1.555 1.00 0.00 O ATOM 1028 CB THR A 222 10.679 -10.415 0.304 1.00 0.00 C ATOM 1029 OG1 THR A 222 11.542 -9.317 0.621 1.00 0.00 O ATOM 1030 CG2 THR A 222 11.217 -11.156 -0.911 1.00 0.00 C ATOM 0 H THR A 222 9.955 -8.062 -0.669 1.00 0.00 H new ATOM 0 HA THR A 222 8.670 -10.694 -0.431 1.00 0.00 H new ATOM 0 HB THR A 222 10.647 -11.106 1.146 1.00 0.00 H new ATOM 0 HG1 THR A 222 12.448 -9.651 0.787 1.00 0.00 H new ATOM 0 HG21 THR A 222 12.228 -11.508 -0.704 1.00 0.00 H new ATOM 0 HG22 THR A 222 10.574 -12.008 -1.132 1.00 0.00 H new ATOM 0 HG23 THR A 222 11.236 -10.483 -1.769 1.00 0.00 H new ATOM 1038 N ASN A 223 8.592 -10.483 2.305 1.00 0.00 N ATOM 1039 CA ASN A 223 8.006 -10.256 3.621 1.00 0.00 C ATOM 1040 C ASN A 223 8.886 -9.332 4.458 1.00 0.00 C ATOM 1041 O ASN A 223 10.011 -9.015 4.074 1.00 0.00 O ATOM 1042 CB ASN A 223 7.806 -11.586 4.350 1.00 0.00 C ATOM 1043 CG ASN A 223 9.020 -11.986 5.166 1.00 0.00 C ATOM 1044 OD1 ASN A 223 10.054 -12.364 4.617 1.00 0.00 O ATOM 1045 ND2 ASN A 223 8.898 -11.904 6.486 1.00 0.00 N ATOM 0 H ASN A 223 8.980 -11.417 2.171 1.00 0.00 H new ATOM 0 HA ASN A 223 7.037 -9.777 3.481 1.00 0.00 H new ATOM 0 HB2 ASN A 223 6.939 -11.511 5.006 1.00 0.00 H new ATOM 0 HB3 ASN A 223 7.588 -12.367 3.622 1.00 0.00 H new ATOM 0 HD21 ASN A 223 9.681 -12.160 7.087 1.00 0.00 H new ATOM 0 HD22 ASN A 223 8.021 -11.585 6.898 1.00 0.00 H new ATOM 1052 N ASN A 224 8.365 -8.905 5.603 1.00 0.00 N ATOM 1053 CA ASN A 224 9.103 -8.018 6.495 1.00 0.00 C ATOM 1054 C ASN A 224 9.713 -6.853 5.721 1.00 0.00 C ATOM 1055 O ASN A 224 10.760 -6.325 6.096 1.00 0.00 O ATOM 1056 CB ASN A 224 10.204 -8.792 7.223 1.00 0.00 C ATOM 1057 CG ASN A 224 11.263 -9.320 6.275 1.00 0.00 C ATOM 1058 OD1 ASN A 224 11.123 -10.406 5.712 1.00 0.00 O ATOM 1059 ND2 ASN A 224 12.331 -8.552 6.094 1.00 0.00 N ATOM 0 H ASN A 224 7.435 -9.159 5.935 1.00 0.00 H new ATOM 0 HA ASN A 224 8.403 -7.618 7.229 1.00 0.00 H new ATOM 0 HB2 ASN A 224 10.673 -8.142 7.962 1.00 0.00 H new ATOM 0 HB3 ASN A 224 9.760 -9.625 7.767 1.00 0.00 H new ATOM 0 HD21 ASN A 224 13.077 -8.855 5.468 1.00 0.00 H new ATOM 0 HD22 ASN A 224 12.405 -7.659 6.581 1.00 0.00 H new ATOM 1066 N CYS A 225 9.050 -6.457 4.640 1.00 0.00 N ATOM 1067 CA CYS A 225 9.526 -5.355 3.812 1.00 0.00 C ATOM 1068 C CYS A 225 8.648 -4.121 3.992 1.00 0.00 C ATOM 1069 O CYS A 225 7.505 -4.219 4.438 1.00 0.00 O ATOM 1070 CB CYS A 225 9.550 -5.768 2.340 1.00 0.00 C ATOM 1071 SG CYS A 225 10.727 -4.838 1.330 1.00 0.00 S ATOM 0 H CYS A 225 8.181 -6.883 4.317 1.00 0.00 H new ATOM 0 HA CYS A 225 10.539 -5.107 4.128 1.00 0.00 H new ATOM 0 HB2 CYS A 225 9.792 -6.829 2.276 1.00 0.00 H new ATOM 0 HB3 CYS A 225 8.551 -5.643 1.922 1.00 0.00 H new ATOM 0 HG CYS A 225 11.008 -5.515 0.257 1.00 0.00 H new ATOM 1077 N VAL A 226 9.191 -2.958 3.643 1.00 0.00 N ATOM 1078 CA VAL A 226 8.457 -1.704 3.767 1.00 0.00 C ATOM 1079 C VAL A 226 8.291 -1.029 2.411 1.00 0.00 C ATOM 1080 O VAL A 226 9.218 -1.004 1.601 1.00 0.00 O ATOM 1081 CB VAL A 226 9.166 -0.732 4.729 1.00 0.00 C ATOM 1082 CG1 VAL A 226 10.270 0.025 4.006 1.00 0.00 C ATOM 1083 CG2 VAL A 226 8.164 0.231 5.346 1.00 0.00 C ATOM 0 H VAL A 226 10.136 -2.859 3.272 1.00 0.00 H new ATOM 0 HA VAL A 226 7.475 -1.950 4.170 1.00 0.00 H new ATOM 0 HB VAL A 226 9.622 -1.311 5.532 1.00 0.00 H new ATOM 0 HG11 VAL A 226 10.759 0.707 4.702 1.00 0.00 H new ATOM 0 HG12 VAL A 226 11.002 -0.683 3.616 1.00 0.00 H new ATOM 0 HG13 VAL A 226 9.841 0.594 3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 226 8.682 0.911 6.023 1.00 0.00 H new ATOM 0 HG22 VAL A 226 7.678 0.805 4.557 1.00 0.00 H new ATOM 0 HG23 VAL A 226 7.413 -0.331 5.901 1.00 0.00 H new ATOM 1093 N ILE A 227 7.104 -0.482 2.170 1.00 0.00 N ATOM 1094 CA ILE A 227 6.817 0.195 0.911 1.00 0.00 C ATOM 1095 C ILE A 227 6.463 1.660 1.144 1.00 0.00 C ATOM 1096 O ILE A 227 5.492 1.974 1.833 1.00 0.00 O ATOM 1097 CB ILE A 227 5.660 -0.487 0.156 1.00 0.00 C ATOM 1098 CG1 ILE A 227 6.041 -1.922 -0.215 1.00 0.00 C ATOM 1099 CG2 ILE A 227 5.298 0.310 -1.088 1.00 0.00 C ATOM 1100 CD1 ILE A 227 5.049 -2.589 -1.142 1.00 0.00 C ATOM 0 H ILE A 227 6.326 -0.494 2.830 1.00 0.00 H new ATOM 0 HA ILE A 227 7.721 0.133 0.306 1.00 0.00 H new ATOM 0 HB ILE A 227 4.788 -0.520 0.809 1.00 0.00 H new ATOM 0 HG12 ILE A 227 7.023 -1.918 -0.688 1.00 0.00 H new ATOM 0 HG13 ILE A 227 6.129 -2.513 0.696 1.00 0.00 H new ATOM 0 HG21 ILE A 227 4.479 -0.184 -1.611 1.00 0.00 H new ATOM 0 HG22 ILE A 227 4.990 1.315 -0.799 1.00 0.00 H new ATOM 0 HG23 ILE A 227 6.165 0.371 -1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 227 5.382 -3.603 -1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 227 4.071 -2.625 -0.663 1.00 0.00 H new ATOM 0 HD13 ILE A 227 4.978 -2.020 -2.069 1.00 0.00 H new ATOM 1112 N HIS A 228 7.257 2.554 0.563 1.00 0.00 N ATOM 1113 CA HIS A 228 7.027 3.987 0.705 1.00 0.00 C ATOM 1114 C HIS A 228 5.780 4.416 -0.064 1.00 0.00 C ATOM 1115 O HIS A 228 5.592 4.037 -1.221 1.00 0.00 O ATOM 1116 CB HIS A 228 8.241 4.772 0.208 1.00 0.00 C ATOM 1117 CG HIS A 228 9.535 4.319 0.812 1.00 0.00 C ATOM 1118 ND1 HIS A 228 10.268 3.201 0.599 1.00 0.00 N flip ATOM 1119 CD2 HIS A 228 10.220 5.049 1.760 1.00 0.00 C flip ATOM 1120 CE1 HIS A 228 11.371 3.276 1.413 1.00 0.00 C flip ATOM 1121 NE2 HIS A 228 11.319 4.401 2.103 1.00 0.00 N flip ATOM 0 H HIS A 228 8.065 2.311 -0.010 1.00 0.00 H new ATOM 0 HA HIS A 228 6.873 4.202 1.762 1.00 0.00 H new ATOM 0 HB2 HIS A 228 8.304 4.680 -0.876 1.00 0.00 H new ATOM 0 HB3 HIS A 228 8.096 5.829 0.431 1.00 0.00 H new ATOM 0 HD2 HIS A 228 9.907 6.002 2.160 1.00 0.00 H new ATOM 0 HE1 HIS A 228 12.154 2.535 1.479 1.00 0.00 H new ATOM 0 HE2 HIS A 228 12.010 4.716 2.784 1.00 0.00 H new ATOM 1130 N CYS A 229 4.933 5.206 0.585 1.00 0.00 N ATOM 1131 CA CYS A 229 3.704 5.685 -0.037 1.00 0.00 C ATOM 1132 C CYS A 229 3.804 7.171 -0.366 1.00 0.00 C ATOM 1133 O CYS A 229 4.476 7.929 0.335 1.00 0.00 O ATOM 1134 CB CYS A 229 2.510 5.433 0.885 1.00 0.00 C ATOM 1135 SG CYS A 229 2.095 3.686 1.095 1.00 0.00 S ATOM 0 H CYS A 229 5.075 5.529 1.542 1.00 0.00 H new ATOM 0 HA CYS A 229 3.558 5.135 -0.967 1.00 0.00 H new ATOM 0 HB2 CYS A 229 2.722 5.865 1.863 1.00 0.00 H new ATOM 0 HB3 CYS A 229 1.641 5.957 0.487 1.00 0.00 H new ATOM 0 HG CYS A 229 1.075 3.575 1.893 1.00 0.00 H new ATOM 1141 N HIS A 230 3.132 7.581 -1.437 1.00 0.00 N ATOM 1142 CA HIS A 230 3.146 8.977 -1.859 1.00 0.00 C ATOM 1143 C HIS A 230 1.727 9.491 -2.085 1.00 0.00 C ATOM 1144 O HIS A 230 0.886 8.791 -2.648 1.00 0.00 O ATOM 1145 CB HIS A 230 3.968 9.136 -3.139 1.00 0.00 C ATOM 1146 CG HIS A 230 5.420 9.406 -2.888 1.00 0.00 C ATOM 1147 ND1 HIS A 230 6.321 8.753 -2.118 1.00 0.00 N flip ATOM 1148 CD2 HIS A 230 6.100 10.459 -3.463 1.00 0.00 C flip ATOM 1149 CE1 HIS A 230 7.518 9.416 -2.241 1.00 0.00 C flip ATOM 1150 NE2 HIS A 230 7.357 10.441 -3.059 1.00 0.00 N flip ATOM 0 H HIS A 230 2.571 6.967 -2.028 1.00 0.00 H new ATOM 0 HA HIS A 230 3.605 9.566 -1.065 1.00 0.00 H new ATOM 0 HB2 HIS A 230 3.873 8.230 -3.737 1.00 0.00 H new ATOM 0 HB3 HIS A 230 3.552 9.952 -3.729 1.00 0.00 H new ATOM 0 HD2 HIS A 230 5.671 11.185 -4.138 1.00 0.00 H new ATOM 0 HE1 HIS A 230 8.440 9.144 -1.749 1.00 0.00 H new ATOM 0 HE2 HIS A 230 8.081 11.106 -3.332 1.00 0.00 H new