USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 590 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 193 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 197 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0121) USER MOD Set 2.1: A 179 THR OG1 : rot -71:sc= 0.744 USER MOD Set 2.2: A 182 GLN : amide:sc= 1.59 K(o=2.3,f=-4.4!) USER MOD Set 3.1: A 167 THR OG1 : rot 80:sc= 1.88 USER MOD Set 3.2: A 219 LYS NZ :NH3+ -145:sc= 0.955 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot -105:sc= 0.0765 USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 SER OG : rot 81:sc= 1.25 USER MOD Single : A 173 SER OG : rot -67:sc= 1.36 USER MOD Single : A 176 LYS NZ :NH3+ 159:sc= 1.42 (180deg=1.17) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 184 TYR OH : rot 180:sc= 0 USER MOD Single : A 187 MET CE :methyl -159:sc= 0 (180deg=-0.626) USER MOD Single : A 189 LYS NZ :NH3+ -160:sc= 0.234 (180deg=0.0893) USER MOD Single : A 190 SER OG : rot 179:sc= 0.437 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 180:sc= 0.0168 USER MOD Single : A 201 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 202 SER OG : rot 180:sc= -0.105 USER MOD Single : A 203 SER OG : rot -100:sc= 1.29 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 209 SER OG : rot 77:sc= 1.09 USER MOD Single : A 212 HIS : no HD1:sc=-0.00609 X(o=-0.0061,f=0) USER MOD Single : A 213 ASN : amide:sc= 0.658 K(o=0.66,f=-0.81) USER MOD Single : A 215 SER OG : rot 67:sc= 1.29 USER MOD Single : A 217 HIS : no HE2:sc= 0.525 K(o=0.52,f=-1.7!) USER MOD Single : A 218 SER OG : rot 180:sc= 0.17 USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 232 SER OG : rot 29:sc= 0.279 USER MOD Single : A 235 MET CE :methyl -113:sc= -0.0786 (180deg=-0.197) USER MOD Single : A 237 ASN : amide:sc= -0.453 K(o=-0.45,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.004 13.882 -2.306 1.00 0.00 N ATOM 117 CA LEU A 160 -13.635 14.912 -3.129 1.00 0.00 C ATOM 118 C LEU A 160 -15.143 14.679 -3.191 1.00 0.00 C ATOM 119 O LEU A 160 -15.604 13.543 -3.305 1.00 0.00 O ATOM 120 CB LEU A 160 -13.047 14.882 -4.543 1.00 0.00 C ATOM 121 CG LEU A 160 -11.567 15.287 -4.665 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.071 15.020 -6.087 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.352 16.761 -4.315 1.00 0.00 C ATOM 0 HA LEU A 160 -13.444 15.888 -2.683 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.162 13.874 -4.942 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.638 15.544 -5.175 1.00 0.00 H new ATOM 0 HG LEU A 160 -10.999 14.686 -3.954 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.023 15.309 -6.167 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.174 13.959 -6.315 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.663 15.602 -6.794 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.295 17.008 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.935 17.385 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.673 16.942 -3.289 1.00 0.00 H new ATOM 135 N SER A 161 -15.901 15.760 -3.124 1.00 0.00 N ATOM 136 CA SER A 161 -17.360 15.687 -3.159 1.00 0.00 C ATOM 137 C SER A 161 -17.839 15.460 -4.586 1.00 0.00 C ATOM 138 O SER A 161 -17.071 15.604 -5.536 1.00 0.00 O ATOM 139 CB SER A 161 -17.958 16.993 -2.634 1.00 0.00 C ATOM 140 OG SER A 161 -17.519 17.247 -1.315 1.00 0.00 O ATOM 0 H SER A 161 -15.531 16.707 -3.044 1.00 0.00 H new ATOM 0 HA SER A 161 -17.682 14.856 -2.531 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.669 17.819 -3.284 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.046 16.936 -2.656 1.00 0.00 H new ATOM 0 HG SER A 161 -17.910 18.087 -0.996 1.00 0.00 H new ATOM 146 N TYR A 162 -19.114 15.129 -4.751 1.00 0.00 N ATOM 147 CA TYR A 162 -19.670 14.918 -6.088 1.00 0.00 C ATOM 148 C TYR A 162 -19.430 16.136 -6.970 1.00 0.00 C ATOM 149 O TYR A 162 -18.978 15.996 -8.092 1.00 0.00 O ATOM 150 CB TYR A 162 -21.174 14.642 -6.024 1.00 0.00 C ATOM 151 CG TYR A 162 -21.519 13.178 -5.875 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.764 12.613 -4.605 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.613 12.346 -7.009 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.104 11.238 -4.474 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.958 10.976 -6.882 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.200 10.436 -5.614 1.00 0.00 C ATOM 157 OH TYR A 162 -22.546 9.114 -5.497 1.00 0.00 O ATOM 0 H TYR A 162 -19.778 15.001 -3.987 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.165 14.052 -6.515 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.600 15.193 -5.186 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.643 15.026 -6.930 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.693 13.232 -3.723 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.420 12.758 -7.989 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.287 10.816 -3.497 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.034 10.352 -7.760 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.751 8.555 -5.624 1.00 0.00 H new ATOM 167 N ALA A 163 -19.718 17.329 -6.464 1.00 0.00 N ATOM 168 CA ALA A 163 -19.530 18.551 -7.243 1.00 0.00 C ATOM 169 C ALA A 163 -18.083 18.691 -7.730 1.00 0.00 C ATOM 170 O ALA A 163 -17.835 19.088 -8.874 1.00 0.00 O ATOM 171 CB ALA A 163 -19.928 19.771 -6.400 1.00 0.00 C ATOM 0 H ALA A 163 -20.081 17.478 -5.523 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.170 18.494 -8.123 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.786 20.680 -6.985 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -20.975 19.686 -6.109 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.306 19.814 -5.506 1.00 0.00 H new ATOM 177 N ASP A 164 -17.133 18.359 -6.870 1.00 0.00 N ATOM 178 CA ASP A 164 -15.718 18.468 -7.213 1.00 0.00 C ATOM 179 C ASP A 164 -15.367 17.487 -8.316 1.00 0.00 C ATOM 180 O ASP A 164 -14.686 17.834 -9.268 1.00 0.00 O ATOM 181 CB ASP A 164 -14.842 18.160 -5.999 1.00 0.00 C ATOM 182 CG ASP A 164 -15.147 19.051 -4.825 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.215 18.523 -3.692 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.335 20.266 -5.024 1.00 0.00 O ATOM 0 H ASP A 164 -17.313 18.011 -5.928 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.536 19.489 -7.548 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.984 17.119 -5.707 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.793 18.273 -6.274 1.00 0.00 H new ATOM 189 N LEU A 165 -15.839 16.257 -8.188 1.00 0.00 N ATOM 190 CA LEU A 165 -15.545 15.212 -9.170 1.00 0.00 C ATOM 191 C LEU A 165 -16.185 15.506 -10.521 1.00 0.00 C ATOM 192 O LEU A 165 -15.571 15.292 -11.563 1.00 0.00 O ATOM 193 CB LEU A 165 -16.034 13.860 -8.650 1.00 0.00 C ATOM 194 CG LEU A 165 -15.291 13.316 -7.421 1.00 0.00 C ATOM 195 CD1 LEU A 165 -16.020 12.095 -6.890 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.845 12.954 -7.763 1.00 0.00 C ATOM 0 H LEU A 165 -16.429 15.952 -7.414 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.465 15.186 -9.313 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.092 13.946 -8.404 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.952 13.130 -9.455 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.270 14.094 -6.658 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.494 11.708 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.036 12.372 -6.608 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.055 11.327 -7.663 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.345 12.572 -6.873 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.835 12.190 -8.541 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.322 13.842 -8.120 1.00 0.00 H new ATOM 208 N ILE A 166 -17.409 16.012 -10.508 1.00 0.00 N ATOM 209 CA ILE A 166 -18.103 16.377 -11.746 1.00 0.00 C ATOM 210 C ILE A 166 -17.292 17.476 -12.423 1.00 0.00 C ATOM 211 O ILE A 166 -17.040 17.438 -13.624 1.00 0.00 O ATOM 212 CB ILE A 166 -19.545 16.898 -11.459 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.416 15.788 -10.859 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.224 17.392 -12.740 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.646 16.316 -10.114 1.00 0.00 C ATOM 0 H ILE A 166 -17.946 16.181 -9.658 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.192 15.498 -12.384 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.447 17.723 -10.753 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.742 15.121 -11.657 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.812 15.193 -10.173 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.227 17.748 -12.506 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.641 18.206 -13.170 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.288 16.573 -13.457 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.217 15.478 -9.715 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.326 16.960 -9.295 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.271 16.886 -10.801 1.00 0.00 H new ATOM 227 N THR A 167 -16.868 18.452 -11.640 1.00 0.00 N ATOM 228 CA THR A 167 -16.056 19.543 -12.159 1.00 0.00 C ATOM 229 C THR A 167 -14.729 19.024 -12.703 1.00 0.00 C ATOM 230 O THR A 167 -14.322 19.409 -13.794 1.00 0.00 O ATOM 231 CB THR A 167 -15.764 20.563 -11.055 1.00 0.00 C ATOM 232 OG1 THR A 167 -16.989 21.125 -10.579 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.859 21.673 -11.525 1.00 0.00 C ATOM 0 H THR A 167 -17.071 18.513 -10.642 1.00 0.00 H new ATOM 0 HA THR A 167 -16.618 20.016 -12.964 1.00 0.00 H new ATOM 0 HB THR A 167 -15.251 20.032 -10.253 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.413 20.502 -9.952 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.682 22.370 -10.706 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.909 21.253 -11.855 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.330 22.200 -12.354 1.00 0.00 H new ATOM 241 N LYS A 168 -14.055 18.153 -11.962 1.00 0.00 N ATOM 242 CA LYS A 168 -12.765 17.619 -12.402 1.00 0.00 C ATOM 243 C LYS A 168 -12.911 16.914 -13.730 1.00 0.00 C ATOM 244 O LYS A 168 -12.039 17.028 -14.577 1.00 0.00 O ATOM 245 CB LYS A 168 -12.186 16.635 -11.385 1.00 0.00 C ATOM 246 CG LYS A 168 -11.540 17.285 -10.166 1.00 0.00 C ATOM 247 CD LYS A 168 -10.233 16.588 -9.771 1.00 0.00 C ATOM 248 CE LYS A 168 -9.086 16.955 -10.730 1.00 0.00 C ATOM 249 NZ LYS A 168 -7.794 16.288 -10.338 1.00 0.00 N ATOM 0 H LYS A 168 -14.374 17.801 -11.059 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.085 18.465 -12.500 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.983 15.972 -11.047 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.443 16.012 -11.884 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -11.341 18.336 -10.377 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.235 17.255 -9.327 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -9.962 16.870 -8.753 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.380 15.508 -9.774 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -9.353 16.662 -11.745 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -8.949 18.036 -10.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -7.046 16.560 -11.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -7.526 16.588 -9.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -7.917 15.255 -10.357 1.00 0.00 H new ATOM 263 N ALA A 169 -14.007 16.199 -13.919 1.00 0.00 N ATOM 264 CA ALA A 169 -14.256 15.514 -15.176 1.00 0.00 C ATOM 265 C ALA A 169 -14.331 16.515 -16.328 1.00 0.00 C ATOM 266 O ALA A 169 -13.738 16.315 -17.384 1.00 0.00 O ATOM 267 CB ALA A 169 -15.561 14.723 -15.078 1.00 0.00 C ATOM 0 H ALA A 169 -14.738 16.078 -13.218 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.432 14.828 -15.373 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.747 14.210 -16.021 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.483 13.990 -14.275 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.385 15.405 -14.868 1.00 0.00 H new ATOM 273 N ILE A 170 -15.062 17.596 -16.112 1.00 0.00 N ATOM 274 CA ILE A 170 -15.257 18.604 -17.148 1.00 0.00 C ATOM 275 C ILE A 170 -13.925 19.286 -17.464 1.00 0.00 C ATOM 276 O ILE A 170 -13.604 19.523 -18.621 1.00 0.00 O ATOM 277 CB ILE A 170 -16.316 19.648 -16.693 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.697 18.972 -16.554 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.409 20.795 -17.695 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.674 19.732 -15.649 1.00 0.00 C ATOM 0 H ILE A 170 -15.531 17.801 -15.230 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.625 18.120 -18.053 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.008 20.050 -15.728 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.141 18.868 -17.544 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.560 17.965 -16.159 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.156 21.514 -17.357 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.440 21.288 -17.774 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.698 20.403 -18.670 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.621 19.194 -15.603 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.253 19.813 -14.647 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.844 20.730 -16.054 1.00 0.00 H new ATOM 292 N GLU A 171 -13.145 19.586 -16.443 1.00 0.00 N ATOM 293 CA GLU A 171 -11.844 20.236 -16.636 1.00 0.00 C ATOM 294 C GLU A 171 -10.862 19.319 -17.335 1.00 0.00 C ATOM 295 O GLU A 171 -9.976 19.766 -18.060 1.00 0.00 O ATOM 296 CB GLU A 171 -11.243 20.616 -15.294 1.00 0.00 C ATOM 297 CG GLU A 171 -12.053 21.613 -14.541 1.00 0.00 C ATOM 298 CD GLU A 171 -11.670 23.057 -14.863 1.00 0.00 C ATOM 299 OE1 GLU A 171 -11.354 23.814 -13.921 1.00 0.00 O ATOM 300 OE2 GLU A 171 -11.695 23.438 -16.059 1.00 0.00 O ATOM 0 H GLU A 171 -13.381 19.394 -15.469 1.00 0.00 H new ATOM 0 HA GLU A 171 -12.018 21.120 -17.249 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.132 19.717 -14.687 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.243 21.019 -15.454 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -13.108 21.463 -14.769 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -11.930 21.440 -13.472 1.00 0.00 H new ATOM 307 N SER A 172 -11.023 18.029 -17.102 1.00 0.00 N ATOM 308 CA SER A 172 -10.148 17.024 -17.716 1.00 0.00 C ATOM 309 C SER A 172 -10.411 16.929 -19.212 1.00 0.00 C ATOM 310 O SER A 172 -9.524 16.582 -19.986 1.00 0.00 O ATOM 311 CB SER A 172 -10.359 15.645 -17.091 1.00 0.00 C ATOM 312 OG SER A 172 -10.054 15.657 -15.706 1.00 0.00 O ATOM 0 H SER A 172 -11.747 17.645 -16.495 1.00 0.00 H new ATOM 0 HA SER A 172 -9.120 17.341 -17.540 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.393 15.332 -17.236 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.730 14.913 -17.598 1.00 0.00 H new ATOM 0 HG SER A 172 -10.814 16.023 -15.207 1.00 0.00 H new ATOM 318 N SER A 173 -11.633 17.233 -19.624 1.00 0.00 N ATOM 319 CA SER A 173 -11.974 17.192 -21.041 1.00 0.00 C ATOM 320 C SER A 173 -11.286 18.343 -21.766 1.00 0.00 C ATOM 321 O SER A 173 -11.146 19.438 -21.221 1.00 0.00 O ATOM 322 CB SER A 173 -13.484 17.281 -21.225 1.00 0.00 C ATOM 323 OG SER A 173 -13.951 18.606 -21.088 1.00 0.00 O ATOM 0 H SER A 173 -12.398 17.508 -19.007 1.00 0.00 H new ATOM 0 HA SER A 173 -11.631 16.247 -21.463 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.753 16.901 -22.210 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.978 16.644 -20.491 1.00 0.00 H new ATOM 0 HG SER A 173 -13.837 18.899 -20.160 1.00 0.00 H new ATOM 329 N ALA A 174 -10.855 18.111 -22.995 1.00 0.00 N ATOM 330 CA ALA A 174 -10.177 19.153 -23.761 1.00 0.00 C ATOM 331 C ALA A 174 -11.120 20.337 -24.011 1.00 0.00 C ATOM 332 O ALA A 174 -10.726 21.493 -23.909 1.00 0.00 O ATOM 333 CB ALA A 174 -9.679 18.576 -25.095 1.00 0.00 C ATOM 0 H ALA A 174 -10.959 17.221 -23.483 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.323 19.512 -23.187 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.174 19.357 -25.663 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.983 17.760 -24.901 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.527 18.201 -25.668 1.00 0.00 H new ATOM 339 N GLU A 175 -12.366 20.023 -24.331 1.00 0.00 N ATOM 340 CA GLU A 175 -13.368 21.032 -24.675 1.00 0.00 C ATOM 341 C GLU A 175 -14.011 21.737 -23.478 1.00 0.00 C ATOM 342 O GLU A 175 -14.831 22.636 -23.659 1.00 0.00 O ATOM 343 CB GLU A 175 -14.499 20.365 -25.451 1.00 0.00 C ATOM 344 CG GLU A 175 -14.091 19.618 -26.700 1.00 0.00 C ATOM 345 CD GLU A 175 -15.315 19.230 -27.511 1.00 0.00 C ATOM 346 OE1 GLU A 175 -16.295 18.738 -26.913 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.321 19.446 -28.735 1.00 0.00 O ATOM 0 H GLU A 175 -12.715 19.065 -24.361 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.829 21.785 -25.250 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.010 19.669 -24.785 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.224 21.130 -25.729 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.430 20.240 -27.303 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.529 18.724 -26.429 1.00 0.00 H new ATOM 354 N LYS A 176 -13.660 21.315 -22.266 1.00 0.00 N ATOM 355 CA LYS A 176 -14.258 21.836 -21.027 1.00 0.00 C ATOM 356 C LYS A 176 -15.772 21.676 -20.989 1.00 0.00 C ATOM 357 O LYS A 176 -16.483 22.536 -20.478 1.00 0.00 O ATOM 358 CB LYS A 176 -13.847 23.294 -20.766 1.00 0.00 C ATOM 359 CG LYS A 176 -12.337 23.525 -20.805 1.00 0.00 C ATOM 360 CD LYS A 176 -11.601 22.572 -19.857 1.00 0.00 C ATOM 361 CE LYS A 176 -10.110 22.817 -19.841 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.401 21.540 -20.190 1.00 0.00 N ATOM 0 H LYS A 176 -12.950 20.599 -22.109 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.858 21.225 -20.218 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.323 23.934 -21.509 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.227 23.600 -19.791 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -11.972 23.383 -21.822 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.118 24.556 -20.529 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -11.997 22.689 -18.848 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.795 21.542 -20.158 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.849 23.599 -20.554 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -9.796 23.165 -18.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.441 21.757 -20.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -9.343 20.934 -19.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.927 21.044 -20.938 1.00 0.00 H new ATOM 376 N ARG A 177 -16.247 20.553 -21.512 1.00 0.00 N ATOM 377 CA ARG A 177 -17.667 20.187 -21.491 1.00 0.00 C ATOM 378 C ARG A 177 -17.705 18.676 -21.603 1.00 0.00 C ATOM 379 O ARG A 177 -16.882 18.102 -22.302 1.00 0.00 O ATOM 380 CB ARG A 177 -18.441 20.836 -22.659 1.00 0.00 C ATOM 381 CG ARG A 177 -17.852 20.558 -24.039 1.00 0.00 C ATOM 382 CD ARG A 177 -18.628 21.234 -25.147 1.00 0.00 C ATOM 383 NE ARG A 177 -17.937 21.051 -26.436 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.695 22.005 -27.330 1.00 0.00 C ATOM 385 NH1 ARG A 177 -18.063 23.251 -27.147 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.060 21.707 -28.427 1.00 0.00 N ATOM 0 H ARG A 177 -15.655 19.860 -21.969 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.145 20.541 -20.578 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.471 20.479 -22.639 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.474 21.914 -22.502 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.817 20.899 -24.064 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.837 19.482 -24.214 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.634 20.818 -25.203 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.734 22.297 -24.931 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.616 20.110 -26.662 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -18.554 23.518 -26.294 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -17.858 23.953 -27.858 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -16.753 20.749 -28.594 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.870 22.432 -29.119 1.00 0.00 H new ATOM 400 N LEU A 178 -18.639 18.037 -20.916 1.00 0.00 N ATOM 401 CA LEU A 178 -18.812 16.586 -21.005 1.00 0.00 C ATOM 402 C LEU A 178 -20.294 16.260 -20.936 1.00 0.00 C ATOM 403 O LEU A 178 -21.051 16.956 -20.273 1.00 0.00 O ATOM 404 CB LEU A 178 -18.107 15.865 -19.852 1.00 0.00 C ATOM 405 CG LEU A 178 -16.581 15.680 -19.897 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.191 14.768 -18.764 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.107 15.055 -21.221 1.00 0.00 C ATOM 0 H LEU A 178 -19.295 18.499 -20.286 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.377 16.251 -21.946 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.344 16.405 -18.935 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.554 14.875 -19.764 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.113 16.661 -19.810 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.111 14.619 -18.772 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.488 15.217 -17.816 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.691 13.807 -18.882 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.023 14.945 -21.204 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.569 14.076 -21.347 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.393 15.701 -22.051 1.00 0.00 H new ATOM 419 N THR A 179 -20.713 15.201 -21.604 1.00 0.00 N ATOM 420 CA THR A 179 -22.099 14.747 -21.514 1.00 0.00 C ATOM 421 C THR A 179 -22.225 13.951 -20.219 1.00 0.00 C ATOM 422 O THR A 179 -21.216 13.572 -19.625 1.00 0.00 O ATOM 423 CB THR A 179 -22.486 13.840 -22.694 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.598 12.720 -22.742 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.398 14.587 -24.015 1.00 0.00 C ATOM 0 H THR A 179 -20.121 14.638 -22.214 1.00 0.00 H new ATOM 0 HA THR A 179 -22.762 15.612 -21.536 1.00 0.00 H new ATOM 0 HB THR A 179 -23.514 13.511 -22.545 1.00 0.00 H new ATOM 0 HG1 THR A 179 -20.710 13.019 -23.030 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.677 13.919 -24.830 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.076 15.440 -23.996 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.377 14.938 -24.167 1.00 0.00 H new ATOM 433 N LEU A 180 -23.445 13.678 -19.774 1.00 0.00 N ATOM 434 CA LEU A 180 -23.635 12.938 -18.520 1.00 0.00 C ATOM 435 C LEU A 180 -22.939 11.577 -18.537 1.00 0.00 C ATOM 436 O LEU A 180 -22.345 11.172 -17.546 1.00 0.00 O ATOM 437 CB LEU A 180 -25.127 12.731 -18.220 1.00 0.00 C ATOM 438 CG LEU A 180 -25.722 13.581 -17.080 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.193 13.209 -16.879 1.00 0.00 C ATOM 440 CD2 LEU A 180 -24.975 13.381 -15.766 1.00 0.00 C ATOM 0 H LEU A 180 -24.307 13.949 -20.248 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.183 13.547 -17.737 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.690 12.938 -19.130 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.284 11.679 -17.980 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.626 14.628 -17.367 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.613 13.810 -16.073 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.745 13.399 -17.799 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.269 12.153 -16.622 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.429 13.999 -14.992 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.030 12.333 -15.472 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -23.931 13.668 -15.894 1.00 0.00 H new ATOM 452 N SER A 181 -23.003 10.884 -19.666 1.00 0.00 N ATOM 453 CA SER A 181 -22.384 9.565 -19.788 1.00 0.00 C ATOM 454 C SER A 181 -20.871 9.643 -19.615 1.00 0.00 C ATOM 455 O SER A 181 -20.262 8.794 -18.983 1.00 0.00 O ATOM 456 CB SER A 181 -22.699 8.976 -21.162 1.00 0.00 C ATOM 457 OG SER A 181 -24.090 9.060 -21.432 1.00 0.00 O ATOM 0 H SER A 181 -23.475 11.209 -20.510 1.00 0.00 H new ATOM 0 HA SER A 181 -22.790 8.929 -19.001 1.00 0.00 H new ATOM 0 HB2 SER A 181 -22.141 9.511 -21.930 1.00 0.00 H new ATOM 0 HB3 SER A 181 -22.377 7.935 -21.200 1.00 0.00 H new ATOM 0 HG SER A 181 -24.275 8.680 -22.316 1.00 0.00 H new ATOM 463 N GLN A 182 -20.273 10.680 -20.173 1.00 0.00 N ATOM 464 CA GLN A 182 -18.831 10.865 -20.100 1.00 0.00 C ATOM 465 C GLN A 182 -18.374 11.165 -18.680 1.00 0.00 C ATOM 466 O GLN A 182 -17.317 10.718 -18.254 1.00 0.00 O ATOM 467 CB GLN A 182 -18.441 12.016 -21.008 1.00 0.00 C ATOM 468 CG GLN A 182 -18.278 11.604 -22.469 1.00 0.00 C ATOM 469 CD GLN A 182 -18.163 12.796 -23.390 1.00 0.00 C ATOM 470 OE1 GLN A 182 -18.959 13.723 -23.312 1.00 0.00 O ATOM 471 NE2 GLN A 182 -17.193 12.782 -24.262 1.00 0.00 N ATOM 0 H GLN A 182 -20.765 11.412 -20.685 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.348 9.941 -20.417 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.199 12.796 -20.940 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.506 12.449 -20.653 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.390 10.981 -22.572 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -19.131 10.996 -22.770 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.549 11.991 -24.296 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -17.078 13.562 -24.909 1.00 0.00 H new ATOM 480 N ILE A 183 -19.178 11.913 -17.940 1.00 0.00 N ATOM 481 CA ILE A 183 -18.858 12.229 -16.549 1.00 0.00 C ATOM 482 C ILE A 183 -18.894 10.935 -15.744 1.00 0.00 C ATOM 483 O ILE A 183 -18.053 10.718 -14.868 1.00 0.00 O ATOM 484 CB ILE A 183 -19.855 13.270 -15.981 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.689 14.587 -16.757 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.621 13.519 -14.468 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.905 15.457 -16.768 1.00 0.00 C ATOM 0 H ILE A 183 -20.055 12.313 -18.274 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.863 12.670 -16.485 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.867 12.883 -16.098 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.861 15.147 -16.324 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.414 14.356 -17.786 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.339 14.255 -14.105 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.751 12.585 -13.921 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.609 13.893 -14.313 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.699 16.364 -17.337 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.733 14.919 -17.230 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.171 15.723 -15.745 1.00 0.00 H new ATOM 499 N TYR A 184 -19.848 10.062 -16.052 1.00 0.00 N ATOM 500 CA TYR A 184 -19.913 8.772 -15.371 1.00 0.00 C ATOM 501 C TYR A 184 -18.630 7.995 -15.649 1.00 0.00 C ATOM 502 O TYR A 184 -17.983 7.501 -14.736 1.00 0.00 O ATOM 503 CB TYR A 184 -21.107 7.920 -15.838 1.00 0.00 C ATOM 504 CG TYR A 184 -22.492 8.534 -15.676 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.766 9.511 -14.694 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.549 8.119 -16.515 1.00 0.00 C ATOM 507 CE1 TYR A 184 -24.072 10.040 -14.538 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.854 8.658 -16.368 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.101 9.604 -15.375 1.00 0.00 C ATOM 510 OH TYR A 184 -26.366 10.111 -15.212 1.00 0.00 O ATOM 0 H TYR A 184 -20.572 10.218 -16.753 1.00 0.00 H new ATOM 0 HA TYR A 184 -20.036 8.973 -14.307 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.962 7.680 -16.891 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -21.087 6.977 -15.291 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.970 9.860 -14.053 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.362 7.380 -17.280 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -24.270 10.778 -13.774 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.651 8.337 -17.022 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.968 9.708 -15.872 1.00 0.00 H new ATOM 520 N GLU A 185 -18.250 7.894 -16.912 1.00 0.00 N ATOM 521 CA GLU A 185 -17.047 7.150 -17.268 1.00 0.00 C ATOM 522 C GLU A 185 -15.815 7.718 -16.587 1.00 0.00 C ATOM 523 O GLU A 185 -14.962 6.968 -16.124 1.00 0.00 O ATOM 524 CB GLU A 185 -16.813 7.174 -18.774 1.00 0.00 C ATOM 525 CG GLU A 185 -17.783 6.331 -19.564 1.00 0.00 C ATOM 526 CD GLU A 185 -17.346 6.206 -21.007 1.00 0.00 C ATOM 527 OE1 GLU A 185 -18.039 6.727 -21.900 1.00 0.00 O ATOM 528 OE2 GLU A 185 -16.283 5.582 -21.239 1.00 0.00 O ATOM 0 H GLU A 185 -18.747 8.310 -17.700 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.207 6.126 -16.932 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.876 8.204 -19.124 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.799 6.829 -18.978 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -17.857 5.340 -19.116 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -18.777 6.776 -19.519 1.00 0.00 H new ATOM 535 N TRP A 186 -15.718 9.036 -16.510 1.00 0.00 N ATOM 536 CA TRP A 186 -14.561 9.662 -15.908 1.00 0.00 C ATOM 537 C TRP A 186 -14.430 9.232 -14.456 1.00 0.00 C ATOM 538 O TRP A 186 -13.340 8.928 -14.013 1.00 0.00 O ATOM 539 CB TRP A 186 -14.658 11.182 -16.015 1.00 0.00 C ATOM 540 CG TRP A 186 -13.466 11.879 -15.434 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.346 12.289 -16.083 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.273 12.263 -14.061 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.470 12.900 -15.232 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.000 12.897 -13.974 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.053 12.147 -12.899 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.491 13.401 -12.762 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.549 12.649 -11.674 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.268 13.274 -11.621 1.00 0.00 C ATOM 0 H TRP A 186 -16.424 9.686 -16.856 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.669 9.341 -16.446 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.763 11.463 -17.063 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.558 11.522 -15.503 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.170 12.149 -17.139 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.567 13.294 -15.494 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.026 11.680 -12.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.521 13.874 -12.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.139 12.558 -10.774 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.899 13.653 -10.680 1.00 0.00 H new ATOM 559 N MET A 187 -15.524 9.184 -13.708 1.00 0.00 N ATOM 560 CA MET A 187 -15.431 8.791 -12.299 1.00 0.00 C ATOM 561 C MET A 187 -15.038 7.327 -12.150 1.00 0.00 C ATOM 562 O MET A 187 -14.298 6.983 -11.240 1.00 0.00 O ATOM 563 CB MET A 187 -16.743 9.044 -11.561 1.00 0.00 C ATOM 564 CG MET A 187 -17.095 10.508 -11.449 1.00 0.00 C ATOM 565 SD MET A 187 -18.487 10.768 -10.352 1.00 0.00 S ATOM 566 CE MET A 187 -18.819 12.476 -10.652 1.00 0.00 C ATOM 0 H MET A 187 -16.464 9.405 -14.036 1.00 0.00 H new ATOM 0 HA MET A 187 -14.652 9.409 -11.854 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.549 8.523 -12.078 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.677 8.616 -10.561 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.232 11.063 -11.081 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.331 10.903 -12.437 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.381 12.890 -9.815 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.878 13.016 -10.760 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.403 12.578 -11.567 1.00 0.00 H new ATOM 576 N VAL A 188 -15.515 6.469 -13.042 1.00 0.00 N ATOM 577 CA VAL A 188 -15.170 5.042 -12.996 1.00 0.00 C ATOM 578 C VAL A 188 -13.674 4.850 -13.279 1.00 0.00 C ATOM 579 O VAL A 188 -13.015 4.017 -12.662 1.00 0.00 O ATOM 580 CB VAL A 188 -16.019 4.231 -14.038 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.603 2.758 -14.082 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.509 4.303 -13.685 1.00 0.00 C ATOM 0 H VAL A 188 -16.140 6.728 -13.806 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.396 4.668 -11.998 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.839 4.681 -15.015 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.213 2.229 -14.815 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.553 2.685 -14.364 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.747 2.310 -13.099 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -18.084 3.736 -14.417 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.669 3.882 -12.693 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.835 5.343 -13.694 1.00 0.00 H new ATOM 592 N LYS A 189 -13.127 5.624 -14.207 1.00 0.00 N ATOM 593 CA LYS A 189 -11.712 5.512 -14.547 1.00 0.00 C ATOM 594 C LYS A 189 -10.796 6.241 -13.555 1.00 0.00 C ATOM 595 O LYS A 189 -9.674 5.812 -13.324 1.00 0.00 O ATOM 596 CB LYS A 189 -11.484 6.087 -15.949 1.00 0.00 C ATOM 597 CG LYS A 189 -11.658 5.079 -17.104 1.00 0.00 C ATOM 598 CD LYS A 189 -13.049 5.134 -17.739 1.00 0.00 C ATOM 599 CE LYS A 189 -13.138 4.207 -18.947 1.00 0.00 C ATOM 600 NZ LYS A 189 -14.496 4.243 -19.593 1.00 0.00 N ATOM 0 H LYS A 189 -13.636 6.332 -14.736 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.456 4.453 -14.506 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.176 6.915 -16.102 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.477 6.500 -15.996 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -10.907 5.278 -17.869 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -11.474 4.071 -16.731 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -13.800 4.849 -17.002 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -13.273 6.156 -18.044 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -12.382 4.493 -19.678 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -12.912 3.187 -18.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -14.629 3.388 -20.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -15.230 4.282 -18.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -14.569 5.084 -20.200 1.00 0.00 H new ATOM 614 N SER A 190 -11.269 7.346 -12.997 1.00 0.00 N ATOM 615 CA SER A 190 -10.458 8.196 -12.112 1.00 0.00 C ATOM 616 C SER A 190 -10.513 7.842 -10.624 1.00 0.00 C ATOM 617 O SER A 190 -9.521 7.998 -9.914 1.00 0.00 O ATOM 618 CB SER A 190 -10.920 9.650 -12.278 1.00 0.00 C ATOM 619 OG SER A 190 -10.110 10.562 -11.561 1.00 0.00 O ATOM 0 H SER A 190 -12.221 7.685 -13.139 1.00 0.00 H new ATOM 0 HA SER A 190 -9.424 8.035 -12.417 1.00 0.00 H new ATOM 0 HB2 SER A 190 -10.908 9.913 -13.336 1.00 0.00 H new ATOM 0 HB3 SER A 190 -11.952 9.741 -11.938 1.00 0.00 H new ATOM 0 HG SER A 190 -10.432 11.475 -11.713 1.00 0.00 H new ATOM 625 N VAL A 191 -11.659 7.382 -10.136 1.00 0.00 N ATOM 626 CA VAL A 191 -11.814 7.103 -8.705 1.00 0.00 C ATOM 627 C VAL A 191 -12.140 5.628 -8.472 1.00 0.00 C ATOM 628 O VAL A 191 -13.175 5.133 -8.924 1.00 0.00 O ATOM 629 CB VAL A 191 -12.931 7.981 -8.074 1.00 0.00 C ATOM 630 CG1 VAL A 191 -12.985 7.779 -6.554 1.00 0.00 C ATOM 631 CG2 VAL A 191 -12.675 9.448 -8.358 1.00 0.00 C ATOM 0 H VAL A 191 -12.489 7.195 -10.699 1.00 0.00 H new ATOM 0 HA VAL A 191 -10.865 7.344 -8.225 1.00 0.00 H new ATOM 0 HB VAL A 191 -13.880 7.679 -8.517 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -13.773 8.402 -6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.193 6.732 -6.333 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.027 8.059 -6.116 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.466 10.049 -7.909 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -11.714 9.738 -7.934 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -12.661 9.613 -9.435 1.00 0.00 H new ATOM 641 N PRO A 192 -11.266 4.901 -7.748 1.00 0.00 N ATOM 642 CA PRO A 192 -11.574 3.477 -7.572 1.00 0.00 C ATOM 643 C PRO A 192 -12.817 3.229 -6.722 1.00 0.00 C ATOM 644 O PRO A 192 -13.463 2.209 -6.863 1.00 0.00 O ATOM 645 CB PRO A 192 -10.306 2.929 -6.910 1.00 0.00 C ATOM 646 CG PRO A 192 -9.739 4.088 -6.178 1.00 0.00 C ATOM 647 CD PRO A 192 -10.002 5.268 -7.080 1.00 0.00 C ATOM 0 HA PRO A 192 -11.816 2.988 -8.516 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.535 2.106 -6.233 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.605 2.546 -7.651 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.217 4.216 -5.207 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.672 3.959 -5.994 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.099 6.195 -6.514 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.195 5.415 -7.797 1.00 0.00 H new ATOM 655 N TYR A 193 -13.167 4.174 -5.859 1.00 0.00 N ATOM 656 CA TYR A 193 -14.381 4.055 -5.051 1.00 0.00 C ATOM 657 C TYR A 193 -15.619 3.984 -5.940 1.00 0.00 C ATOM 658 O TYR A 193 -16.506 3.182 -5.724 1.00 0.00 O ATOM 659 CB TYR A 193 -14.517 5.261 -4.116 1.00 0.00 C ATOM 660 CG TYR A 193 -15.685 5.134 -3.165 1.00 0.00 C ATOM 661 CD1 TYR A 193 -16.939 5.701 -3.483 1.00 0.00 C ATOM 662 CD2 TYR A 193 -15.552 4.440 -1.946 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.045 5.563 -2.601 1.00 0.00 C ATOM 664 CE2 TYR A 193 -16.652 4.312 -1.056 1.00 0.00 C ATOM 665 CZ TYR A 193 -17.887 4.869 -1.397 1.00 0.00 C ATOM 666 OH TYR A 193 -18.951 4.731 -0.542 1.00 0.00 O ATOM 0 H TYR A 193 -12.633 5.028 -5.699 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.302 3.139 -4.466 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -13.597 5.376 -3.542 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.636 6.166 -4.712 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -17.059 6.246 -4.408 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -14.601 3.999 -1.685 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -19.002 5.992 -2.859 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -16.534 3.786 -0.120 1.00 0.00 H new ATOM 0 HH TYR A 193 -18.672 4.222 0.248 1.00 0.00 H new ATOM 676 N PHE A 194 -15.684 4.832 -6.953 1.00 0.00 N ATOM 677 CA PHE A 194 -16.851 4.859 -7.824 1.00 0.00 C ATOM 678 C PHE A 194 -16.812 3.704 -8.811 1.00 0.00 C ATOM 679 O PHE A 194 -17.855 3.247 -9.269 1.00 0.00 O ATOM 680 CB PHE A 194 -16.926 6.197 -8.552 1.00 0.00 C ATOM 681 CG PHE A 194 -17.614 7.265 -7.751 1.00 0.00 C ATOM 682 CD1 PHE A 194 -18.999 7.445 -7.878 1.00 0.00 C ATOM 683 CD2 PHE A 194 -16.900 8.083 -6.860 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.681 8.412 -7.136 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.571 9.068 -6.093 1.00 0.00 C ATOM 686 CZ PHE A 194 -18.967 9.235 -6.234 1.00 0.00 C ATOM 0 H PHE A 194 -14.954 5.503 -7.192 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.747 4.745 -7.215 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.917 6.528 -8.797 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.455 6.061 -9.496 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.551 6.821 -8.566 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -15.832 7.960 -6.759 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.748 8.531 -7.250 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.018 9.688 -5.404 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.486 9.986 -5.657 1.00 0.00 H new ATOM 696 N LYS A 195 -15.615 3.220 -9.113 1.00 0.00 N ATOM 697 CA LYS A 195 -15.450 2.041 -9.965 1.00 0.00 C ATOM 698 C LYS A 195 -16.026 0.824 -9.249 1.00 0.00 C ATOM 699 O LYS A 195 -16.746 0.030 -9.835 1.00 0.00 O ATOM 700 CB LYS A 195 -13.961 1.821 -10.244 1.00 0.00 C ATOM 701 CG LYS A 195 -13.659 0.710 -11.230 1.00 0.00 C ATOM 702 CD LYS A 195 -12.158 0.527 -11.362 1.00 0.00 C ATOM 703 CE LYS A 195 -11.831 -0.575 -12.360 1.00 0.00 C ATOM 704 NZ LYS A 195 -10.350 -0.822 -12.426 1.00 0.00 N ATOM 0 H LYS A 195 -14.739 3.624 -8.782 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.974 2.189 -10.909 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.535 2.750 -10.623 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.458 1.600 -9.303 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -14.119 -0.220 -10.895 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -14.092 0.948 -12.202 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.700 1.462 -11.684 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -11.731 0.281 -10.390 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -12.344 -1.493 -12.074 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -12.201 -0.298 -13.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -10.154 -1.578 -13.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.866 0.049 -12.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -10.004 -1.109 -11.488 1.00 0.00 H new ATOM 718 N ASP A 196 -15.698 0.711 -7.971 1.00 0.00 N ATOM 719 CA ASP A 196 -16.165 -0.382 -7.113 1.00 0.00 C ATOM 720 C ASP A 196 -17.683 -0.349 -6.955 1.00 0.00 C ATOM 721 O ASP A 196 -18.335 -1.370 -6.850 1.00 0.00 O ATOM 722 CB ASP A 196 -15.508 -0.223 -5.737 1.00 0.00 C ATOM 723 CG ASP A 196 -15.861 -1.339 -4.783 1.00 0.00 C ATOM 724 OD1 ASP A 196 -16.539 -1.051 -3.769 1.00 0.00 O ATOM 725 OD2 ASP A 196 -15.451 -2.487 -5.026 1.00 0.00 O ATOM 0 H ASP A 196 -15.095 1.378 -7.490 1.00 0.00 H new ATOM 0 HA ASP A 196 -15.894 -1.335 -7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.426 -0.186 -5.859 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.813 0.729 -5.303 1.00 0.00 H new ATOM 730 N LYS A 197 -18.244 0.849 -6.949 1.00 0.00 N ATOM 731 CA LYS A 197 -19.686 1.031 -6.755 1.00 0.00 C ATOM 732 C LYS A 197 -20.439 1.065 -8.087 1.00 0.00 C ATOM 733 O LYS A 197 -21.546 1.592 -8.173 1.00 0.00 O ATOM 734 CB LYS A 197 -19.933 2.314 -5.931 1.00 0.00 C ATOM 735 CG LYS A 197 -19.957 2.064 -4.417 1.00 0.00 C ATOM 736 CD LYS A 197 -18.573 1.834 -3.793 1.00 0.00 C ATOM 737 CE LYS A 197 -18.637 0.904 -2.593 1.00 0.00 C ATOM 738 NZ LYS A 197 -19.518 1.417 -1.508 1.00 0.00 N ATOM 0 H LYS A 197 -17.726 1.718 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.075 0.175 -6.204 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.154 3.041 -6.160 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.882 2.756 -6.235 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.426 2.917 -3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.583 1.195 -4.214 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -17.903 1.413 -4.543 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -18.149 2.791 -3.488 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -18.998 -0.073 -2.916 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -17.631 0.758 -2.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -19.457 0.786 -0.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -19.212 2.373 -1.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -20.501 1.451 -1.846 1.00 0.00 H new ATOM 752 N GLY A 198 -19.842 0.494 -9.122 1.00 0.00 N ATOM 753 CA GLY A 198 -20.438 0.514 -10.453 1.00 0.00 C ATOM 754 C GLY A 198 -21.533 -0.510 -10.722 1.00 0.00 C ATOM 755 O GLY A 198 -21.958 -0.656 -11.867 1.00 0.00 O ATOM 0 H GLY A 198 -18.945 0.011 -9.068 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.850 1.508 -10.628 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.644 0.365 -11.185 1.00 0.00 H new ATOM 759 N ASP A 199 -21.993 -1.214 -9.695 1.00 0.00 N ATOM 760 CA ASP A 199 -23.050 -2.225 -9.852 1.00 0.00 C ATOM 761 C ASP A 199 -24.317 -1.652 -10.468 1.00 0.00 C ATOM 762 O ASP A 199 -24.654 -0.483 -10.271 1.00 0.00 O ATOM 763 CB ASP A 199 -23.444 -2.809 -8.500 1.00 0.00 C ATOM 764 CG ASP A 199 -22.385 -3.693 -7.925 1.00 0.00 C ATOM 765 OD1 ASP A 199 -21.986 -4.659 -8.599 1.00 0.00 O ATOM 766 OD2 ASP A 199 -21.959 -3.422 -6.787 1.00 0.00 O ATOM 0 H ASP A 199 -21.654 -1.108 -8.739 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.633 -2.987 -10.510 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -23.651 -1.996 -7.804 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -24.367 -3.378 -8.609 1.00 0.00 H new ATOM 771 N SER A 200 -25.040 -2.485 -11.201 1.00 0.00 N ATOM 772 CA SER A 200 -26.262 -2.054 -11.871 1.00 0.00 C ATOM 773 C SER A 200 -27.290 -1.453 -10.912 1.00 0.00 C ATOM 774 O SER A 200 -27.922 -0.449 -11.231 1.00 0.00 O ATOM 775 CB SER A 200 -26.880 -3.241 -12.605 1.00 0.00 C ATOM 776 OG SER A 200 -25.874 -3.950 -13.311 1.00 0.00 O ATOM 0 H SER A 200 -24.803 -3.466 -11.348 1.00 0.00 H new ATOM 0 HA SER A 200 -25.985 -1.267 -12.572 1.00 0.00 H new ATOM 0 HB2 SER A 200 -27.372 -3.904 -11.893 1.00 0.00 H new ATOM 0 HB3 SER A 200 -27.646 -2.892 -13.298 1.00 0.00 H new ATOM 0 HG SER A 200 -26.277 -4.711 -13.778 1.00 0.00 H new ATOM 782 N ASN A 201 -27.455 -2.046 -9.737 1.00 0.00 N ATOM 783 CA ASN A 201 -28.404 -1.509 -8.756 1.00 0.00 C ATOM 784 C ASN A 201 -27.860 -0.243 -8.097 1.00 0.00 C ATOM 785 O ASN A 201 -28.586 0.719 -7.868 1.00 0.00 O ATOM 786 CB ASN A 201 -28.707 -2.546 -7.674 1.00 0.00 C ATOM 787 CG ASN A 201 -29.831 -2.114 -6.767 1.00 0.00 C ATOM 788 OD1 ASN A 201 -30.842 -1.612 -7.219 1.00 0.00 O ATOM 789 ND2 ASN A 201 -29.664 -2.316 -5.489 1.00 0.00 N ATOM 0 H ASN A 201 -26.957 -2.884 -9.438 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.321 -1.264 -9.292 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -28.967 -3.494 -8.145 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -27.810 -2.721 -7.080 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.396 -2.050 -4.831 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -28.801 -2.740 -5.148 1.00 0.00 H new ATOM 796 N SER A 202 -26.567 -0.240 -7.802 1.00 0.00 N ATOM 797 CA SER A 202 -25.929 0.903 -7.148 1.00 0.00 C ATOM 798 C SER A 202 -25.964 2.123 -8.053 1.00 0.00 C ATOM 799 O SER A 202 -25.988 3.265 -7.579 1.00 0.00 O ATOM 800 CB SER A 202 -24.485 0.559 -6.795 1.00 0.00 C ATOM 801 OG SER A 202 -24.458 -0.583 -5.951 1.00 0.00 O ATOM 0 H SER A 202 -25.936 -1.015 -8.004 1.00 0.00 H new ATOM 0 HA SER A 202 -26.478 1.132 -6.235 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.915 0.365 -7.703 1.00 0.00 H new ATOM 0 HB3 SER A 202 -24.011 1.404 -6.295 1.00 0.00 H new ATOM 0 HG SER A 202 -23.529 -0.803 -5.727 1.00 0.00 H new ATOM 807 N SER A 203 -25.993 1.876 -9.359 1.00 0.00 N ATOM 808 CA SER A 203 -26.028 2.934 -10.363 1.00 0.00 C ATOM 809 C SER A 203 -27.190 3.898 -10.137 1.00 0.00 C ATOM 810 O SER A 203 -27.099 5.073 -10.495 1.00 0.00 O ATOM 811 CB SER A 203 -26.093 2.353 -11.778 1.00 0.00 C ATOM 812 OG SER A 203 -27.419 2.014 -12.147 1.00 0.00 O ATOM 0 H SER A 203 -25.993 0.935 -9.752 1.00 0.00 H new ATOM 0 HA SER A 203 -25.101 3.497 -10.258 1.00 0.00 H new ATOM 0 HB2 SER A 203 -25.692 3.077 -12.487 1.00 0.00 H new ATOM 0 HB3 SER A 203 -25.461 1.467 -11.836 1.00 0.00 H new ATOM 0 HG SER A 203 -27.551 1.049 -12.042 1.00 0.00 H new ATOM 818 N ALA A 204 -28.274 3.419 -9.538 1.00 0.00 N ATOM 819 CA ALA A 204 -29.433 4.259 -9.266 1.00 0.00 C ATOM 820 C ALA A 204 -29.043 5.507 -8.450 1.00 0.00 C ATOM 821 O ALA A 204 -29.392 6.628 -8.818 1.00 0.00 O ATOM 822 CB ALA A 204 -30.501 3.433 -8.524 1.00 0.00 C ATOM 0 H ALA A 204 -28.374 2.451 -9.231 1.00 0.00 H new ATOM 0 HA ALA A 204 -29.842 4.608 -10.214 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.369 4.060 -8.320 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.802 2.587 -9.143 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.089 3.066 -7.584 1.00 0.00 H new ATOM 828 N GLY A 205 -28.308 5.320 -7.359 1.00 0.00 N ATOM 829 CA GLY A 205 -27.910 6.454 -6.528 1.00 0.00 C ATOM 830 C GLY A 205 -26.693 7.160 -7.092 1.00 0.00 C ATOM 831 O GLY A 205 -26.543 8.379 -6.978 1.00 0.00 O ATOM 0 H GLY A 205 -27.980 4.411 -7.032 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.738 7.159 -6.453 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.694 6.107 -5.517 1.00 0.00 H new ATOM 835 N TRP A 206 -25.834 6.377 -7.723 1.00 0.00 N ATOM 836 CA TRP A 206 -24.595 6.842 -8.350 1.00 0.00 C ATOM 837 C TRP A 206 -24.902 7.949 -9.374 1.00 0.00 C ATOM 838 O TRP A 206 -24.359 9.054 -9.323 1.00 0.00 O ATOM 839 CB TRP A 206 -24.050 5.597 -9.058 1.00 0.00 C ATOM 840 CG TRP A 206 -22.624 5.448 -9.349 1.00 0.00 C ATOM 841 CD1 TRP A 206 -21.786 4.536 -8.804 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.850 6.130 -10.343 1.00 0.00 C ATOM 843 NE1 TRP A 206 -20.552 4.578 -9.374 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.553 5.538 -10.341 1.00 0.00 C ATOM 845 CE3 TRP A 206 -22.121 7.165 -11.256 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.541 5.950 -11.214 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -21.102 7.589 -12.121 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.821 6.974 -12.092 1.00 0.00 C ATOM 0 H TRP A 206 -25.978 5.372 -7.819 1.00 0.00 H new ATOM 0 HA TRP A 206 -23.889 7.262 -7.634 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.343 4.736 -8.456 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.578 5.516 -10.008 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -22.064 3.857 -8.012 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -19.759 3.989 -9.120 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -23.097 7.625 -11.290 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.569 5.479 -11.200 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -21.293 8.392 -12.817 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -19.053 7.316 -12.770 1.00 0.00 H new ATOM 859 N LYS A 207 -25.797 7.640 -10.305 1.00 0.00 N ATOM 860 CA LYS A 207 -26.185 8.563 -11.375 1.00 0.00 C ATOM 861 C LYS A 207 -27.055 9.702 -10.861 1.00 0.00 C ATOM 862 O LYS A 207 -26.929 10.842 -11.319 1.00 0.00 O ATOM 863 CB LYS A 207 -26.929 7.780 -12.464 1.00 0.00 C ATOM 864 CG LYS A 207 -26.029 6.753 -13.186 1.00 0.00 C ATOM 865 CD LYS A 207 -26.815 5.575 -13.770 1.00 0.00 C ATOM 866 CE LYS A 207 -27.692 5.960 -14.950 1.00 0.00 C ATOM 867 NZ LYS A 207 -28.422 4.736 -15.446 1.00 0.00 N ATOM 0 H LYS A 207 -26.278 6.741 -10.343 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.280 9.012 -11.784 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.777 7.261 -12.017 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -27.333 8.480 -13.196 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -25.486 7.254 -13.988 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -25.285 6.374 -12.485 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -26.115 4.801 -14.084 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -27.440 5.142 -12.989 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -28.406 6.728 -14.653 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -27.083 6.383 -15.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -29.024 4.994 -16.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -27.732 4.017 -15.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -29.014 4.352 -14.682 1.00 0.00 H new ATOM 881 N ASN A 208 -27.944 9.405 -9.922 1.00 0.00 N ATOM 882 CA ASN A 208 -28.856 10.425 -9.402 1.00 0.00 C ATOM 883 C ASN A 208 -28.126 11.529 -8.652 1.00 0.00 C ATOM 884 O ASN A 208 -28.473 12.694 -8.778 1.00 0.00 O ATOM 885 CB ASN A 208 -29.896 9.806 -8.470 1.00 0.00 C ATOM 886 CG ASN A 208 -30.960 10.795 -8.068 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.468 11.534 -8.895 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.296 10.821 -6.808 1.00 0.00 N ATOM 0 H ASN A 208 -28.056 8.480 -9.507 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.347 10.863 -10.271 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.363 8.954 -8.964 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.400 9.425 -7.577 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.007 11.476 -6.483 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -30.847 10.186 -6.147 1.00 0.00 H new ATOM 895 N SER A 209 -27.109 11.176 -7.882 1.00 0.00 N ATOM 896 CA SER A 209 -26.375 12.177 -7.109 1.00 0.00 C ATOM 897 C SER A 209 -25.680 13.187 -8.021 1.00 0.00 C ATOM 898 O SER A 209 -25.641 14.382 -7.725 1.00 0.00 O ATOM 899 CB SER A 209 -25.352 11.495 -6.214 1.00 0.00 C ATOM 900 OG SER A 209 -25.985 10.574 -5.344 1.00 0.00 O ATOM 0 H SER A 209 -26.773 10.219 -7.773 1.00 0.00 H new ATOM 0 HA SER A 209 -27.093 12.719 -6.493 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.614 10.977 -6.826 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.815 12.243 -5.631 1.00 0.00 H new ATOM 0 HG SER A 209 -26.220 9.763 -5.841 1.00 0.00 H new ATOM 906 N ILE A 210 -25.149 12.715 -9.141 1.00 0.00 N ATOM 907 CA ILE A 210 -24.500 13.607 -10.106 1.00 0.00 C ATOM 908 C ILE A 210 -25.552 14.521 -10.710 1.00 0.00 C ATOM 909 O ILE A 210 -25.349 15.726 -10.826 1.00 0.00 O ATOM 910 CB ILE A 210 -23.787 12.805 -11.233 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.614 12.028 -10.617 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.336 13.731 -12.389 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.072 10.929 -11.484 1.00 0.00 C ATOM 0 H ILE A 210 -25.152 11.730 -9.407 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.741 14.192 -9.587 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.485 12.094 -11.676 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.809 12.728 -10.393 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -22.937 11.599 -9.668 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.842 13.138 -13.159 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.206 14.229 -12.817 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.642 14.479 -12.006 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.247 10.434 -10.971 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.860 10.204 -11.688 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.714 11.350 -12.424 1.00 0.00 H new ATOM 925 N ARG A 211 -26.686 13.951 -11.087 1.00 0.00 N ATOM 926 CA ARG A 211 -27.751 14.734 -11.706 1.00 0.00 C ATOM 927 C ARG A 211 -28.280 15.789 -10.745 1.00 0.00 C ATOM 928 O ARG A 211 -28.537 16.912 -11.153 1.00 0.00 O ATOM 929 CB ARG A 211 -28.875 13.813 -12.178 1.00 0.00 C ATOM 930 CG ARG A 211 -29.886 14.515 -13.065 1.00 0.00 C ATOM 931 CD ARG A 211 -30.801 13.509 -13.728 1.00 0.00 C ATOM 932 NE ARG A 211 -31.769 14.174 -14.619 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.706 13.557 -15.332 1.00 0.00 C ATOM 934 NH1 ARG A 211 -32.869 12.256 -15.302 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.499 14.266 -16.088 1.00 0.00 N ATOM 0 H ARG A 211 -26.894 12.958 -10.978 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.340 15.252 -12.573 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -28.444 12.973 -12.723 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.388 13.400 -11.309 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -30.475 15.215 -12.472 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -29.367 15.099 -13.825 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.208 12.795 -14.300 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -31.335 12.942 -12.966 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.715 15.190 -14.695 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -32.265 11.680 -14.716 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -33.600 11.821 -15.864 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.395 15.280 -16.126 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -34.223 13.806 -16.641 1.00 0.00 H new ATOM 949 N HIS A 212 -28.422 15.442 -9.476 1.00 0.00 N ATOM 950 CA HIS A 212 -28.865 16.400 -8.467 1.00 0.00 C ATOM 951 C HIS A 212 -27.873 17.554 -8.360 1.00 0.00 C ATOM 952 O HIS A 212 -28.264 18.710 -8.365 1.00 0.00 O ATOM 953 CB HIS A 212 -28.999 15.715 -7.104 1.00 0.00 C ATOM 954 CG HIS A 212 -29.361 16.655 -5.997 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.640 17.062 -5.707 1.00 0.00 N ATOM 956 CD2 HIS A 212 -28.573 17.299 -5.090 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.584 17.905 -4.679 1.00 0.00 C ATOM 958 NE2 HIS A 212 -29.348 18.080 -4.259 1.00 0.00 N ATOM 0 H HIS A 212 -28.238 14.505 -9.117 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.837 16.789 -8.769 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.758 14.935 -7.171 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -28.058 15.223 -6.859 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -27.498 17.210 -5.031 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -31.446 18.387 -4.242 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -29.032 18.666 -3.486 1.00 0.00 H new ATOM 966 N ASN A 213 -26.586 17.237 -8.279 1.00 0.00 N ATOM 967 CA ASN A 213 -25.551 18.269 -8.150 1.00 0.00 C ATOM 968 C ASN A 213 -25.539 19.193 -9.371 1.00 0.00 C ATOM 969 O ASN A 213 -25.336 20.397 -9.244 1.00 0.00 O ATOM 970 CB ASN A 213 -24.171 17.624 -7.983 1.00 0.00 C ATOM 971 CG ASN A 213 -23.818 17.371 -6.538 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.035 18.095 -5.954 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.378 16.345 -5.962 1.00 0.00 N ATOM 0 H ASN A 213 -26.231 16.281 -8.300 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.782 18.862 -7.265 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.147 16.681 -8.529 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.416 18.271 -8.430 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.164 16.127 -4.989 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -25.030 15.760 -6.484 1.00 0.00 H new ATOM 980 N LEU A 214 -25.766 18.633 -10.551 1.00 0.00 N ATOM 981 CA LEU A 214 -25.830 19.435 -11.775 1.00 0.00 C ATOM 982 C LEU A 214 -27.054 20.345 -11.761 1.00 0.00 C ATOM 983 O LEU A 214 -26.990 21.478 -12.220 1.00 0.00 O ATOM 984 CB LEU A 214 -25.918 18.528 -13.009 1.00 0.00 C ATOM 985 CG LEU A 214 -24.640 17.783 -13.424 1.00 0.00 C ATOM 986 CD1 LEU A 214 -24.989 16.765 -14.497 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.580 18.745 -13.953 1.00 0.00 C ATOM 0 H LEU A 214 -25.909 17.633 -10.692 1.00 0.00 H new ATOM 0 HA LEU A 214 -24.923 20.038 -11.820 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.698 17.788 -12.829 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.244 19.136 -13.853 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.229 17.284 -12.547 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.088 16.231 -14.798 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.717 16.056 -14.103 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.413 17.277 -15.361 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.689 18.185 -14.237 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -23.970 19.273 -14.823 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.323 19.466 -13.177 1.00 0.00 H new ATOM 999 N SER A 215 -28.161 19.835 -11.234 1.00 0.00 N ATOM 1000 CA SER A 215 -29.432 20.567 -11.206 1.00 0.00 C ATOM 1001 C SER A 215 -29.416 21.772 -10.273 1.00 0.00 C ATOM 1002 O SER A 215 -30.271 22.641 -10.380 1.00 0.00 O ATOM 1003 CB SER A 215 -30.568 19.635 -10.783 1.00 0.00 C ATOM 1004 OG SER A 215 -30.650 18.512 -11.651 1.00 0.00 O ATOM 0 H SER A 215 -28.208 18.907 -10.814 1.00 0.00 H new ATOM 0 HA SER A 215 -29.588 20.937 -12.219 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.406 19.298 -9.759 1.00 0.00 H new ATOM 0 HB3 SER A 215 -31.513 20.178 -10.794 1.00 0.00 H new ATOM 0 HG SER A 215 -29.849 17.957 -11.545 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.441 21.834 -9.371 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.303 22.991 -8.481 1.00 0.00 C ATOM 1012 C LEU A 216 -27.994 24.219 -9.334 1.00 0.00 C ATOM 1013 O LEU A 216 -28.339 25.338 -8.973 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.174 22.772 -7.462 1.00 0.00 C ATOM 1015 CG LEU A 216 -27.341 21.589 -6.491 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -26.075 21.439 -5.651 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -28.553 21.767 -5.575 1.00 0.00 C ATOM 0 H LEU A 216 -27.739 21.106 -9.234 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.232 23.131 -7.928 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.242 22.633 -8.011 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.065 23.683 -6.873 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.507 20.690 -7.084 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -26.192 20.602 -4.963 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -25.224 21.254 -6.306 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -25.904 22.354 -5.083 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -28.633 20.910 -4.907 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -28.434 22.676 -4.986 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.457 21.842 -6.179 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.349 23.967 -10.470 1.00 0.00 N ATOM 1030 CA HIS A 217 -27.033 24.963 -11.505 1.00 0.00 C ATOM 1031 C HIS A 217 -26.270 26.236 -11.113 1.00 0.00 C ATOM 1032 O HIS A 217 -26.030 27.094 -11.955 1.00 0.00 O ATOM 1033 CB HIS A 217 -28.313 25.336 -12.265 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.690 24.334 -13.308 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -27.887 23.994 -14.364 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -29.810 23.573 -13.456 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -28.519 23.089 -15.097 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -29.700 22.792 -14.595 1.00 0.00 N ATOM 0 H HIS A 217 -27.018 23.032 -10.709 1.00 0.00 H new ATOM 0 HA HIS A 217 -26.301 24.439 -12.120 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -29.133 25.438 -11.555 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.177 26.309 -12.737 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -26.959 24.373 -14.554 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -30.657 23.578 -12.786 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -28.115 22.649 -15.997 1.00 0.00 H new ATOM 1046 N SER A 218 -25.866 26.359 -9.860 1.00 0.00 N ATOM 1047 CA SER A 218 -25.148 27.544 -9.404 1.00 0.00 C ATOM 1048 C SER A 218 -23.857 27.728 -10.195 1.00 0.00 C ATOM 1049 O SER A 218 -23.545 28.822 -10.652 1.00 0.00 O ATOM 1050 CB SER A 218 -24.849 27.391 -7.917 1.00 0.00 C ATOM 1051 OG SER A 218 -25.503 26.229 -7.423 1.00 0.00 O ATOM 0 H SER A 218 -26.021 25.655 -9.138 1.00 0.00 H new ATOM 0 HA SER A 218 -25.763 28.429 -9.565 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.774 27.313 -7.757 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.189 28.272 -7.373 1.00 0.00 H new ATOM 0 HG SER A 218 -25.311 26.127 -6.467 1.00 0.00 H new ATOM 1057 N LYS A 219 -23.106 26.645 -10.353 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.878 26.674 -11.155 1.00 0.00 C ATOM 1059 C LYS A 219 -21.894 25.792 -12.405 1.00 0.00 C ATOM 1060 O LYS A 219 -21.045 25.946 -13.289 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.686 26.316 -10.281 1.00 0.00 C ATOM 1062 CG LYS A 219 -20.646 24.850 -9.831 1.00 0.00 C ATOM 1063 CD LYS A 219 -19.261 24.454 -9.382 1.00 0.00 C ATOM 1064 CE LYS A 219 -18.320 24.373 -10.578 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.945 23.976 -10.133 1.00 0.00 N ATOM 0 H LYS A 219 -23.320 25.737 -9.941 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.800 27.695 -11.529 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -19.770 26.540 -10.828 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.694 26.954 -9.397 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -21.353 24.698 -9.015 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -20.963 24.206 -10.652 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -18.883 25.180 -8.662 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -19.298 23.490 -8.874 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -18.699 23.649 -11.299 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.281 25.337 -11.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.237 24.459 -10.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -16.811 24.246 -9.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.832 22.947 -10.231 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.830 24.854 -12.467 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.899 23.903 -13.578 1.00 0.00 C ATOM 1081 C PHE A 220 -23.956 24.372 -14.545 1.00 0.00 C ATOM 1082 O PHE A 220 -25.039 24.765 -14.137 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.265 22.507 -13.078 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.261 21.924 -12.125 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.606 21.701 -10.778 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.966 21.580 -12.565 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.673 21.143 -9.877 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -20.027 21.020 -11.672 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.383 20.803 -10.326 1.00 0.00 C ATOM 0 H PHE A 220 -23.555 24.728 -11.761 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.924 23.852 -14.063 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.237 22.550 -12.586 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.370 21.840 -13.934 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.595 21.960 -10.430 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.690 21.747 -13.596 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -21.948 20.977 -8.846 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -19.038 20.759 -12.020 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.667 20.376 -9.640 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.645 24.343 -15.827 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.566 24.836 -16.836 1.00 0.00 C ATOM 1101 C ILE A 221 -24.802 23.749 -17.875 1.00 0.00 C ATOM 1102 O ILE A 221 -23.984 22.834 -18.030 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.039 26.178 -17.449 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.971 25.938 -18.529 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.434 27.066 -16.316 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.658 27.172 -19.382 1.00 0.00 C ATOM 0 H ILE A 221 -22.764 23.984 -16.195 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.531 25.069 -16.387 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.884 26.681 -17.919 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -22.053 25.599 -18.049 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.305 25.132 -19.183 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.067 28.000 -16.742 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.203 27.283 -15.574 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.609 26.536 -15.840 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.896 26.921 -20.120 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.563 27.500 -19.893 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.292 27.974 -18.741 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.924 23.844 -18.572 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.314 22.849 -19.573 1.00 0.00 C ATOM 1120 C ARG A 222 -26.179 23.469 -20.951 1.00 0.00 C ATOM 1121 O ARG A 222 -26.583 24.606 -21.155 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.765 22.420 -19.338 1.00 0.00 C ATOM 1123 CG ARG A 222 -28.226 21.248 -20.213 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.720 20.995 -20.045 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.521 22.102 -20.607 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.844 22.214 -20.529 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.589 21.320 -19.925 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.427 23.250 -21.065 1.00 0.00 N ATOM 0 H ARG A 222 -26.591 24.608 -18.464 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.671 21.972 -19.496 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.885 22.145 -18.290 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.418 23.273 -19.521 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -28.005 21.461 -21.259 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.669 20.350 -19.947 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.990 20.061 -20.539 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.954 20.876 -18.987 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.017 22.842 -21.096 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -32.157 20.503 -19.494 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.601 21.442 -19.886 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.869 23.962 -21.537 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.441 23.349 -21.013 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.626 22.718 -21.886 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.436 23.181 -23.261 1.00 0.00 C ATOM 1144 C VAL A 223 -26.088 22.167 -24.192 1.00 0.00 C ATOM 1145 O VAL A 223 -26.020 20.956 -23.981 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.911 23.451 -23.592 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.004 22.902 -22.537 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.505 23.031 -25.015 1.00 0.00 C ATOM 0 H VAL A 223 -25.294 21.768 -21.720 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.919 24.148 -23.403 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.787 24.534 -23.578 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -21.968 23.109 -22.804 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -23.233 23.371 -21.580 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.149 21.825 -22.457 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -22.448 23.246 -25.170 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.681 21.963 -25.143 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -24.098 23.586 -25.741 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.750 22.681 -25.209 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.440 21.846 -26.190 1.00 0.00 C ATOM 1160 C GLN A 224 -26.465 21.464 -27.302 1.00 0.00 C ATOM 1161 O GLN A 224 -25.407 22.067 -27.440 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.651 22.592 -26.767 1.00 0.00 C ATOM 1163 CG GLN A 224 -28.303 23.828 -27.603 1.00 0.00 C ATOM 1164 CD GLN A 224 -29.539 24.588 -28.033 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -30.419 24.855 -27.233 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -29.608 24.940 -29.290 1.00 0.00 N ATOM 0 H GLN A 224 -26.829 23.683 -25.384 1.00 0.00 H new ATOM 0 HA GLN A 224 -27.801 20.939 -25.704 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -29.225 21.902 -27.385 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -29.298 22.897 -25.945 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -27.656 24.487 -27.024 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -27.740 23.522 -28.485 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -28.851 24.698 -29.930 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -30.419 25.456 -29.631 1.00 0.00 H new ATOM 1265 N SER A 232 -27.359 15.816 -23.302 1.00 0.00 N ATOM 1266 CA SER A 232 -26.901 17.203 -23.385 1.00 0.00 C ATOM 1267 C SER A 232 -25.496 17.350 -22.813 1.00 0.00 C ATOM 1268 O SER A 232 -25.026 16.484 -22.060 1.00 0.00 O ATOM 1269 CB SER A 232 -27.850 18.102 -22.596 1.00 0.00 C ATOM 1270 OG SER A 232 -29.198 17.828 -22.941 1.00 0.00 O ATOM 0 HA SER A 232 -26.887 17.494 -24.435 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.703 17.946 -21.527 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.622 19.148 -22.800 1.00 0.00 H new ATOM 0 HG SER A 232 -29.281 16.891 -23.216 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.839 18.450 -23.150 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.512 18.746 -22.650 1.00 0.00 C ATOM 1278 C TRP A 233 -23.690 19.410 -21.298 1.00 0.00 C ATOM 1279 O TRP A 233 -24.686 20.104 -21.065 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.861 19.765 -23.571 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.283 19.260 -24.829 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.697 19.556 -26.080 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.139 18.401 -24.998 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -21.918 18.968 -27.021 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -20.943 18.242 -26.401 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.252 17.763 -24.113 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -19.894 17.470 -26.933 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.190 16.981 -24.646 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.027 16.847 -26.054 1.00 0.00 C ATOM 0 H TRP A 233 -25.214 19.160 -23.778 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.907 17.842 -22.590 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.606 20.520 -23.820 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -22.071 20.268 -23.014 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.546 20.185 -26.304 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.041 19.054 -28.030 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.375 17.865 -23.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -19.769 17.367 -28.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.502 16.485 -23.977 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.214 16.250 -26.441 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.723 19.227 -20.421 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.710 19.891 -19.131 1.00 0.00 C ATOM 1302 C TRP A 234 -21.320 20.475 -18.982 1.00 0.00 C ATOM 1303 O TRP A 234 -20.327 19.811 -19.286 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.017 18.892 -18.017 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.347 18.231 -18.220 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.602 17.113 -18.942 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.627 18.660 -17.716 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.926 16.799 -18.938 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.597 17.723 -18.187 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.056 19.732 -16.908 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.967 17.831 -17.872 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.434 19.837 -16.579 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.373 18.882 -17.067 1.00 0.00 C ATOM 0 H TRP A 234 -21.924 18.614 -20.582 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.469 20.670 -19.065 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.235 18.134 -17.982 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -23.008 19.405 -17.055 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.846 16.540 -19.458 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.349 16.004 -19.417 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.348 20.462 -16.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.681 17.113 -18.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.774 20.649 -15.953 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.416 18.980 -16.805 1.00 0.00 H new ATOM 1324 N MET A 235 -21.241 21.716 -18.541 1.00 0.00 N ATOM 1325 CA MET A 235 -19.953 22.385 -18.382 1.00 0.00 C ATOM 1326 C MET A 235 -19.983 23.380 -17.236 1.00 0.00 C ATOM 1327 O MET A 235 -21.014 23.578 -16.600 1.00 0.00 O ATOM 1328 CB MET A 235 -19.542 23.082 -19.682 1.00 0.00 C ATOM 1329 CG MET A 235 -20.412 24.234 -20.091 1.00 0.00 C ATOM 1330 SD MET A 235 -19.795 25.052 -21.574 1.00 0.00 S ATOM 1331 CE MET A 235 -18.363 25.954 -20.902 1.00 0.00 C ATOM 0 H MET A 235 -22.048 22.285 -18.286 1.00 0.00 H new ATOM 0 HA MET A 235 -19.212 21.622 -18.145 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.518 23.440 -19.575 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.540 22.346 -20.486 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.426 23.877 -20.269 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.466 24.955 -19.275 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.552 27.026 -20.952 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.204 25.662 -19.864 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.475 25.714 -21.487 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.842 23.995 -16.972 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.716 24.967 -15.893 1.00 0.00 C ATOM 1343 C LEU A 236 -19.039 26.342 -16.457 1.00 0.00 C ATOM 1344 O LEU A 236 -18.658 26.641 -17.588 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.281 24.956 -15.354 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.709 23.570 -15.014 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.263 23.715 -14.603 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.490 22.848 -13.915 1.00 0.00 C ATOM 0 H LEU A 236 -17.980 23.838 -17.495 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.399 24.721 -15.080 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.631 25.426 -16.092 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.244 25.574 -14.457 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.796 22.957 -15.911 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.853 22.734 -14.361 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.694 24.154 -15.423 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.196 24.362 -13.728 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -17.035 21.876 -13.723 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.470 23.444 -13.003 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.523 22.708 -14.235 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.720 27.173 -15.682 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.106 28.514 -16.136 1.00 0.00 C ATOM 1362 C ASN A 237 -18.874 29.298 -16.633 1.00 0.00 C ATOM 1363 O ASN A 237 -17.912 29.478 -15.886 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.802 29.265 -14.988 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.453 30.552 -15.442 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.940 31.246 -16.304 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.572 30.879 -14.862 1.00 0.00 N ATOM 0 H ASN A 237 -20.020 26.948 -14.733 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.800 28.420 -16.971 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.558 28.618 -14.542 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.072 29.487 -14.209 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -23.050 31.741 -15.125 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.971 30.273 -14.145 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.881 29.757 -17.905 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.681 30.454 -18.382 1.00 0.00 C ATOM 1376 C PRO A 238 -17.423 31.826 -17.782 1.00 0.00 C ATOM 1377 O PRO A 238 -16.278 32.170 -17.498 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.935 30.568 -19.882 1.00 0.00 C ATOM 1379 CG PRO A 238 -19.408 30.614 -20.014 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.901 29.659 -18.968 1.00 0.00 C ATOM 0 HA PRO A 238 -16.787 29.902 -18.093 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -17.473 31.465 -20.294 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -17.516 29.717 -20.420 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.792 31.620 -19.847 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -19.728 30.312 -21.011 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.889 29.938 -18.603 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.980 28.644 -19.356 1.00 0.00 H new