USER MOD reduce.3.24.130724 H: found=0, std=0, add=601, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 604 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 318 HIS : no HD1:sc= -1.84! K(o=-1.3!,f=-1.9) USER MOD Set 1.2: B 211 TYR OH : rot -9:sc= 0.502 USER MOD Set 2.1: A 271 HIS :FLIP no HE2:sc= -1.47 F(o=-3.2,f=-1.5) USER MOD Set 2.2: A 274 THR OG1 : rot 180:sc= -0.0198 USER MOD Set 3.1: A 262 THR OG1 : rot 160:sc= -3.58! USER MOD Set 3.2: A 263 GLN : amide:sc= -1.46 X(o=-9.2,f=-9.3) USER MOD Set 3.3: A 266 GLN : amide:sc= -4.17! X(o=-9.2!,f=-9.5) USER MOD Set 3.4: B 206 SER OG : rot 180:sc= 0 USER MOD Single : A 257 TYR OH : rot 180:sc= 0 USER MOD Single : A 259 GLN : amide:sc= -2.44! K(o=-2.4!,f=-3.4) USER MOD Single : A 261 THR OG1 : rot 180:sc= 0 USER MOD Single : A 264 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 268 TYR OH : rot 30:sc= -1.01 USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 273 GLN : amide:sc= -1.29 K(o=-1.3,f=-6.2!) USER MOD Single : A 277 SER OG : rot 33:sc= 0.666 USER MOD Single : A 278 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 HIS : no HD1:sc= -0.362 X(o=-0.36,f=-0.014) USER MOD Single : A 290 ASN :FLIP amide:sc= -0.883 F(o=-1.6,f=-0.88) USER MOD Single : A 292 ASN : amide:sc= -0.193 X(o=-0.19,f=-0.086) USER MOD Single : A 293 CYS SG : rot 150:sc= -1.7! USER MOD Single : A 307 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.028) USER MOD Single : A 308 THR OG1 : rot -108:sc= -2.92! USER MOD Single : A 310 THR OG1 : rot 9:sc= 0.38! USER MOD Single : A 314 TYR OH : rot 180:sc= -0.012 USER MOD Single : A 319 ASN : amide:sc= 1.23 K(o=1.2,f=-0.05) USER MOD Single : A 320 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 322 THR OG1 : rot -170:sc= 0 USER MOD Single : A 323 THR OG1 : rot -169:sc= 0.203 USER MOD Single : A 324 GLN : amide:sc= -0.0313 X(o=-0.031,f=-0.031) USER MOD Single : A 326 THR OG1 : rot -140:sc= 0 USER MOD Single : A 331 SER OG : rot 180:sc= 0 USER MOD Single : B 212 SER OG : rot 71:sc= 0.0113 USER MOD ----------------------------------------------------------------- ATOM 141 N GLU A 255 148.513 14.969 -2.849 1.00 0.00 N ATOM 142 CA GLU A 255 148.271 16.197 -2.102 1.00 0.00 C ATOM 143 C GLU A 255 148.786 16.116 -0.666 1.00 0.00 C ATOM 144 O GLU A 255 148.429 15.211 0.088 1.00 0.00 O ATOM 145 CB GLU A 255 146.774 16.520 -2.091 1.00 0.00 C ATOM 146 CG GLU A 255 146.284 17.192 -3.363 1.00 0.00 C ATOM 147 CD GLU A 255 146.084 18.686 -3.192 1.00 0.00 C ATOM 148 OE1 GLU A 255 145.216 19.080 -2.386 1.00 0.00 O ATOM 149 OE2 GLU A 255 146.796 19.460 -3.865 1.00 0.00 O ATOM 0 HA GLU A 255 148.821 16.991 -2.606 1.00 0.00 H new ATOM 0 HB2 GLU A 255 146.214 15.598 -1.939 1.00 0.00 H new ATOM 0 HB3 GLU A 255 146.558 17.168 -1.242 1.00 0.00 H new ATOM 0 HG2 GLU A 255 147.002 17.014 -4.164 1.00 0.00 H new ATOM 0 HG3 GLU A 255 145.343 16.736 -3.672 1.00 0.00 H new ATOM 156 N GLY A 256 149.590 17.106 -0.287 1.00 0.00 N ATOM 157 CA GLY A 256 150.106 17.180 1.068 1.00 0.00 C ATOM 158 C GLY A 256 151.467 16.536 1.283 1.00 0.00 C ATOM 159 O GLY A 256 152.102 16.798 2.303 1.00 0.00 O ATOM 0 H GLY A 256 149.895 17.863 -0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 256 150.169 18.229 1.358 1.00 0.00 H new ATOM 0 HA3 GLY A 256 149.389 16.707 1.738 1.00 0.00 H new ATOM 163 N TYR A 257 151.932 15.688 0.364 1.00 0.00 N ATOM 164 CA TYR A 257 153.216 15.042 0.551 1.00 0.00 C ATOM 165 C TYR A 257 154.307 15.649 -0.325 1.00 0.00 C ATOM 166 O TYR A 257 154.051 16.190 -1.400 1.00 0.00 O ATOM 167 CB TYR A 257 153.084 13.544 0.302 1.00 0.00 C ATOM 168 CG TYR A 257 152.131 12.887 1.268 1.00 0.00 C ATOM 169 CD1 TYR A 257 150.765 12.860 1.014 1.00 0.00 C ATOM 170 CD2 TYR A 257 152.593 12.311 2.444 1.00 0.00 C ATOM 171 CE1 TYR A 257 149.886 12.273 1.903 1.00 0.00 C ATOM 172 CE2 TYR A 257 151.722 11.723 3.341 1.00 0.00 C ATOM 173 CZ TYR A 257 150.368 11.705 3.066 1.00 0.00 C ATOM 174 OH TYR A 257 149.496 11.121 3.955 1.00 0.00 O ATOM 0 H TYR A 257 151.445 15.441 -0.497 1.00 0.00 H new ATOM 0 HA TYR A 257 153.522 15.208 1.584 1.00 0.00 H new ATOM 0 HB2 TYR A 257 152.738 13.376 -0.718 1.00 0.00 H new ATOM 0 HB3 TYR A 257 154.065 13.076 0.387 1.00 0.00 H new ATOM 0 HD1 TYR A 257 150.385 13.305 0.107 1.00 0.00 H new ATOM 0 HD2 TYR A 257 153.651 12.323 2.661 1.00 0.00 H new ATOM 0 HE1 TYR A 257 148.827 12.258 1.690 1.00 0.00 H new ATOM 0 HE2 TYR A 257 152.097 11.280 4.252 1.00 0.00 H new ATOM 0 HH TYR A 257 149.996 10.768 4.720 1.00 0.00 H new ATOM 184 N GLU A 258 155.528 15.532 0.171 1.00 0.00 N ATOM 185 CA GLU A 258 156.695 16.037 -0.513 1.00 0.00 C ATOM 186 C GLU A 258 157.865 15.155 -0.177 1.00 0.00 C ATOM 187 O GLU A 258 158.003 14.709 0.963 1.00 0.00 O ATOM 188 CB GLU A 258 156.981 17.485 -0.112 1.00 0.00 C ATOM 189 CG GLU A 258 157.106 17.686 1.387 1.00 0.00 C ATOM 190 CD GLU A 258 157.753 19.009 1.745 1.00 0.00 C ATOM 191 OE1 GLU A 258 158.473 19.568 0.892 1.00 0.00 O ATOM 192 OE2 GLU A 258 157.538 19.487 2.880 1.00 0.00 O ATOM 0 H GLU A 258 155.733 15.082 1.063 1.00 0.00 H new ATOM 0 HA GLU A 258 156.519 16.026 -1.589 1.00 0.00 H new ATOM 0 HB2 GLU A 258 157.904 17.811 -0.592 1.00 0.00 H new ATOM 0 HB3 GLU A 258 156.182 18.123 -0.490 1.00 0.00 H new ATOM 0 HG2 GLU A 258 156.116 17.635 1.841 1.00 0.00 H new ATOM 0 HG3 GLU A 258 157.693 16.872 1.811 1.00 0.00 H new ATOM 199 N GLN A 259 158.702 14.883 -1.154 1.00 0.00 N ATOM 200 CA GLN A 259 159.832 14.032 -0.906 1.00 0.00 C ATOM 201 C GLN A 259 160.860 14.773 -0.073 1.00 0.00 C ATOM 202 O GLN A 259 161.087 15.968 -0.262 1.00 0.00 O ATOM 203 CB GLN A 259 160.452 13.548 -2.217 1.00 0.00 C ATOM 204 CG GLN A 259 161.291 12.292 -2.071 1.00 0.00 C ATOM 205 CD GLN A 259 160.448 11.038 -1.964 1.00 0.00 C ATOM 206 OE1 GLN A 259 160.026 10.472 -2.972 1.00 0.00 O ATOM 207 NE2 GLN A 259 160.195 10.598 -0.739 1.00 0.00 N ATOM 0 H GLN A 259 158.620 15.234 -2.108 1.00 0.00 H new ATOM 0 HA GLN A 259 159.492 13.155 -0.355 1.00 0.00 H new ATOM 0 HB2 GLN A 259 159.656 13.360 -2.937 1.00 0.00 H new ATOM 0 HB3 GLN A 259 161.073 14.343 -2.629 1.00 0.00 H new ATOM 0 HG2 GLN A 259 161.959 12.204 -2.928 1.00 0.00 H new ATOM 0 HG3 GLN A 259 161.919 12.380 -1.184 1.00 0.00 H new ATOM 0 HE21 GLN A 259 160.565 11.098 0.069 1.00 0.00 H new ATOM 0 HE22 GLN A 259 159.630 9.759 -0.605 1.00 0.00 H new ATOM 216 N ARG A 260 161.469 14.062 0.855 1.00 0.00 N ATOM 217 CA ARG A 260 162.466 14.654 1.730 1.00 0.00 C ATOM 218 C ARG A 260 163.651 13.718 1.883 1.00 0.00 C ATOM 219 O ARG A 260 163.519 12.511 1.699 1.00 0.00 O ATOM 220 CB ARG A 260 161.852 14.964 3.091 1.00 0.00 C ATOM 221 CG ARG A 260 161.266 16.363 3.181 1.00 0.00 C ATOM 222 CD ARG A 260 161.734 17.080 4.434 1.00 0.00 C ATOM 223 NE ARG A 260 162.805 18.032 4.154 1.00 0.00 N ATOM 224 CZ ARG A 260 163.272 18.904 5.044 1.00 0.00 C ATOM 225 NH1 ARG A 260 162.758 18.955 6.267 1.00 0.00 N ATOM 226 NH2 ARG A 260 164.256 19.728 4.710 1.00 0.00 N ATOM 0 H ARG A 260 161.292 13.072 1.024 1.00 0.00 H new ATOM 0 HA ARG A 260 162.816 15.586 1.286 1.00 0.00 H new ATOM 0 HB2 ARG A 260 161.070 14.235 3.303 1.00 0.00 H new ATOM 0 HB3 ARG A 260 162.614 14.847 3.861 1.00 0.00 H new ATOM 0 HG2 ARG A 260 161.556 16.938 2.301 1.00 0.00 H new ATOM 0 HG3 ARG A 260 160.178 16.304 3.179 1.00 0.00 H new ATOM 0 HD2 ARG A 260 160.893 17.604 4.887 1.00 0.00 H new ATOM 0 HD3 ARG A 260 162.082 16.347 5.162 1.00 0.00 H new ATOM 0 HE ARG A 260 163.219 18.028 3.222 1.00 0.00 H new ATOM 0 HH11 ARG A 260 162.001 18.324 6.529 1.00 0.00 H new ATOM 0 HH12 ARG A 260 163.120 19.626 6.945 1.00 0.00 H new ATOM 0 HH21 ARG A 260 164.654 19.693 3.772 1.00 0.00 H new ATOM 0 HH22 ARG A 260 164.615 20.397 5.392 1.00 0.00 H new ATOM 240 N THR A 261 164.807 14.273 2.213 1.00 0.00 N ATOM 241 CA THR A 261 166.002 13.463 2.375 1.00 0.00 C ATOM 242 C THR A 261 166.722 13.782 3.677 1.00 0.00 C ATOM 243 O THR A 261 166.804 14.939 4.086 1.00 0.00 O ATOM 244 CB THR A 261 166.946 13.665 1.189 1.00 0.00 C ATOM 245 OG1 THR A 261 166.630 14.855 0.487 1.00 0.00 O ATOM 246 CG2 THR A 261 166.896 12.521 0.203 1.00 0.00 C ATOM 0 H THR A 261 164.942 15.271 2.372 1.00 0.00 H new ATOM 0 HA THR A 261 165.691 12.419 2.411 1.00 0.00 H new ATOM 0 HB THR A 261 167.947 13.722 1.616 1.00 0.00 H new ATOM 0 HG1 THR A 261 167.248 14.964 -0.266 1.00 0.00 H new ATOM 0 HG21 THR A 261 167.586 12.718 -0.618 1.00 0.00 H new ATOM 0 HG22 THR A 261 167.182 11.596 0.704 1.00 0.00 H new ATOM 0 HG23 THR A 261 165.884 12.423 -0.189 1.00 0.00 H new ATOM 254 N THR A 262 167.266 12.752 4.315 1.00 0.00 N ATOM 255 CA THR A 262 168.005 12.943 5.552 1.00 0.00 C ATOM 256 C THR A 262 169.432 13.345 5.216 1.00 0.00 C ATOM 257 O THR A 262 169.931 13.008 4.147 1.00 0.00 O ATOM 258 CB THR A 262 167.987 11.674 6.401 1.00 0.00 C ATOM 259 OG1 THR A 262 168.870 10.708 5.865 1.00 0.00 O ATOM 260 CG2 THR A 262 166.611 11.053 6.503 1.00 0.00 C ATOM 0 H THR A 262 167.209 11.784 3.997 1.00 0.00 H new ATOM 0 HA THR A 262 167.532 13.733 6.136 1.00 0.00 H new ATOM 0 HB THR A 262 168.302 11.976 7.400 1.00 0.00 H new ATOM 0 HG1 THR A 262 169.097 10.052 6.557 1.00 0.00 H new ATOM 0 HG21 THR A 262 166.662 10.155 7.118 1.00 0.00 H new ATOM 0 HG22 THR A 262 165.923 11.766 6.957 1.00 0.00 H new ATOM 0 HG23 THR A 262 166.256 10.790 5.507 1.00 0.00 H new ATOM 268 N GLN A 263 170.061 14.087 6.118 1.00 0.00 N ATOM 269 CA GLN A 263 171.428 14.584 5.931 1.00 0.00 C ATOM 270 C GLN A 263 172.303 13.686 5.049 1.00 0.00 C ATOM 271 O GLN A 263 173.097 14.186 4.252 1.00 0.00 O ATOM 272 CB GLN A 263 172.101 14.771 7.288 1.00 0.00 C ATOM 273 CG GLN A 263 172.325 13.471 8.037 1.00 0.00 C ATOM 274 CD GLN A 263 171.029 12.832 8.492 1.00 0.00 C ATOM 275 OE1 GLN A 263 170.190 13.481 9.119 1.00 0.00 O ATOM 276 NE2 GLN A 263 170.856 11.554 8.176 1.00 0.00 N ATOM 0 H GLN A 263 169.641 14.365 7.005 1.00 0.00 H new ATOM 0 HA GLN A 263 171.334 15.535 5.408 1.00 0.00 H new ATOM 0 HB2 GLN A 263 173.060 15.268 7.143 1.00 0.00 H new ATOM 0 HB3 GLN A 263 171.489 15.433 7.900 1.00 0.00 H new ATOM 0 HG2 GLN A 263 172.864 12.774 7.395 1.00 0.00 H new ATOM 0 HG3 GLN A 263 172.957 13.660 8.905 1.00 0.00 H new ATOM 0 HE21 GLN A 263 171.578 11.055 7.655 1.00 0.00 H new ATOM 0 HE22 GLN A 263 170.002 11.071 8.454 1.00 0.00 H new ATOM 285 N GLN A 264 172.194 12.371 5.210 1.00 0.00 N ATOM 286 CA GLN A 264 173.024 11.453 4.433 1.00 0.00 C ATOM 287 C GLN A 264 172.332 10.954 3.156 1.00 0.00 C ATOM 288 O GLN A 264 172.760 9.967 2.563 1.00 0.00 O ATOM 289 CB GLN A 264 173.461 10.274 5.307 1.00 0.00 C ATOM 290 CG GLN A 264 174.506 9.380 4.655 1.00 0.00 C ATOM 291 CD GLN A 264 175.832 9.395 5.394 1.00 0.00 C ATOM 292 OE1 GLN A 264 176.472 10.439 5.520 1.00 0.00 O ATOM 293 NE2 GLN A 264 176.253 8.235 5.888 1.00 0.00 N ATOM 0 H GLN A 264 171.550 11.921 5.861 1.00 0.00 H new ATOM 0 HA GLN A 264 173.902 12.012 4.109 1.00 0.00 H new ATOM 0 HB2 GLN A 264 173.860 10.658 6.246 1.00 0.00 H new ATOM 0 HB3 GLN A 264 172.586 9.673 5.554 1.00 0.00 H new ATOM 0 HG2 GLN A 264 174.129 8.358 4.614 1.00 0.00 H new ATOM 0 HG3 GLN A 264 174.664 9.703 3.626 1.00 0.00 H new ATOM 0 HE21 GLN A 264 175.692 7.393 5.761 1.00 0.00 H new ATOM 0 HE22 GLN A 264 177.137 8.187 6.394 1.00 0.00 H new ATOM 302 N GLY A 265 171.282 11.648 2.716 1.00 0.00 N ATOM 303 CA GLY A 265 170.592 11.258 1.491 1.00 0.00 C ATOM 304 C GLY A 265 169.568 10.158 1.674 1.00 0.00 C ATOM 305 O GLY A 265 169.474 9.254 0.845 1.00 0.00 O ATOM 0 H GLY A 265 170.897 12.470 3.182 1.00 0.00 H new ATOM 0 HA2 GLY A 265 170.096 12.134 1.073 1.00 0.00 H new ATOM 0 HA3 GLY A 265 171.332 10.931 0.760 1.00 0.00 H new ATOM 309 N GLN A 266 168.784 10.234 2.738 1.00 0.00 N ATOM 310 CA GLN A 266 167.753 9.229 2.982 1.00 0.00 C ATOM 311 C GLN A 266 166.382 9.783 2.598 1.00 0.00 C ATOM 312 O GLN A 266 165.859 10.672 3.265 1.00 0.00 O ATOM 313 CB GLN A 266 167.769 8.803 4.448 1.00 0.00 C ATOM 314 CG GLN A 266 167.188 7.425 4.697 1.00 0.00 C ATOM 315 CD GLN A 266 166.929 7.165 6.167 1.00 0.00 C ATOM 316 OE1 GLN A 266 167.422 7.886 7.035 1.00 0.00 O ATOM 317 NE2 GLN A 266 166.156 6.129 6.451 1.00 0.00 N ATOM 0 H GLN A 266 168.838 10.971 3.441 1.00 0.00 H new ATOM 0 HA GLN A 266 167.958 8.353 2.367 1.00 0.00 H new ATOM 0 HB2 GLN A 266 168.797 8.823 4.810 1.00 0.00 H new ATOM 0 HB3 GLN A 266 167.210 9.533 5.034 1.00 0.00 H new ATOM 0 HG2 GLN A 266 166.255 7.321 4.143 1.00 0.00 H new ATOM 0 HG3 GLN A 266 167.873 6.670 4.312 1.00 0.00 H new ATOM 0 HE21 GLN A 266 165.769 5.560 5.698 1.00 0.00 H new ATOM 0 HE22 GLN A 266 165.947 5.900 7.423 1.00 0.00 H new ATOM 326 N VAL A 267 165.815 9.262 1.510 1.00 0.00 N ATOM 327 CA VAL A 267 164.513 9.728 1.025 1.00 0.00 C ATOM 328 C VAL A 267 163.349 9.150 1.820 1.00 0.00 C ATOM 329 O VAL A 267 163.233 7.938 1.982 1.00 0.00 O ATOM 330 CB VAL A 267 164.301 9.400 -0.470 1.00 0.00 C ATOM 331 CG1 VAL A 267 162.833 9.534 -0.862 1.00 0.00 C ATOM 332 CG2 VAL A 267 165.159 10.303 -1.334 1.00 0.00 C ATOM 0 H VAL A 267 166.233 8.520 0.949 1.00 0.00 H new ATOM 0 HA VAL A 267 164.528 10.809 1.161 1.00 0.00 H new ATOM 0 HB VAL A 267 164.601 8.365 -0.632 1.00 0.00 H new ATOM 0 HG11 VAL A 267 162.716 9.297 -1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 267 162.233 8.845 -0.267 1.00 0.00 H new ATOM 0 HG13 VAL A 267 162.500 10.556 -0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 267 164.999 10.060 -2.385 1.00 0.00 H new ATOM 0 HG22 VAL A 267 164.886 11.343 -1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 267 166.209 10.156 -1.083 1.00 0.00 H new ATOM 342 N TYR A 268 162.467 10.039 2.269 1.00 0.00 N ATOM 343 CA TYR A 268 161.272 9.644 3.008 1.00 0.00 C ATOM 344 C TYR A 268 160.082 10.492 2.559 1.00 0.00 C ATOM 345 O TYR A 268 160.226 11.357 1.696 1.00 0.00 O ATOM 346 CB TYR A 268 161.488 9.761 4.521 1.00 0.00 C ATOM 347 CG TYR A 268 161.951 11.123 4.991 1.00 0.00 C ATOM 348 CD1 TYR A 268 163.244 11.565 4.741 1.00 0.00 C ATOM 349 CD2 TYR A 268 161.099 11.959 5.702 1.00 0.00 C ATOM 350 CE1 TYR A 268 163.674 12.801 5.184 1.00 0.00 C ATOM 351 CE2 TYR A 268 161.522 13.196 6.150 1.00 0.00 C ATOM 352 CZ TYR A 268 162.810 13.612 5.889 1.00 0.00 C ATOM 353 OH TYR A 268 163.237 14.842 6.335 1.00 0.00 O ATOM 0 H TYR A 268 162.559 11.046 2.132 1.00 0.00 H new ATOM 0 HA TYR A 268 161.062 8.597 2.791 1.00 0.00 H new ATOM 0 HB2 TYR A 268 160.555 9.515 5.027 1.00 0.00 H new ATOM 0 HB3 TYR A 268 162.223 9.017 4.828 1.00 0.00 H new ATOM 0 HD1 TYR A 268 163.925 10.932 4.191 1.00 0.00 H new ATOM 0 HD2 TYR A 268 160.089 11.637 5.908 1.00 0.00 H new ATOM 0 HE1 TYR A 268 164.682 13.130 4.979 1.00 0.00 H new ATOM 0 HE2 TYR A 268 160.847 13.833 6.702 1.00 0.00 H new ATOM 0 HH TYR A 268 163.917 15.194 5.723 1.00 0.00 H new ATOM 363 N PHE A 269 158.907 10.235 3.125 1.00 0.00 N ATOM 364 CA PHE A 269 157.708 10.980 2.743 1.00 0.00 C ATOM 365 C PHE A 269 157.188 11.850 3.879 1.00 0.00 C ATOM 366 O PHE A 269 156.822 11.354 4.944 1.00 0.00 O ATOM 367 CB PHE A 269 156.629 10.015 2.259 1.00 0.00 C ATOM 368 CG PHE A 269 156.897 9.524 0.869 1.00 0.00 C ATOM 369 CD1 PHE A 269 157.784 8.469 0.645 1.00 0.00 C ATOM 370 CD2 PHE A 269 156.287 10.136 -0.224 1.00 0.00 C ATOM 371 CE1 PHE A 269 158.049 8.038 -0.639 1.00 0.00 C ATOM 372 CE2 PHE A 269 156.556 9.698 -1.508 1.00 0.00 C ATOM 373 CZ PHE A 269 157.436 8.652 -1.715 1.00 0.00 C ATOM 0 H PHE A 269 158.758 9.525 3.842 1.00 0.00 H new ATOM 0 HA PHE A 269 157.978 11.653 1.929 1.00 0.00 H new ATOM 0 HB2 PHE A 269 156.572 9.165 2.939 1.00 0.00 H new ATOM 0 HB3 PHE A 269 155.659 10.512 2.287 1.00 0.00 H new ATOM 0 HD1 PHE A 269 158.266 7.987 1.483 1.00 0.00 H new ATOM 0 HD2 PHE A 269 155.601 10.956 -0.068 1.00 0.00 H new ATOM 0 HE1 PHE A 269 158.736 7.221 -0.803 1.00 0.00 H new ATOM 0 HE2 PHE A 269 156.077 10.174 -2.351 1.00 0.00 H new ATOM 0 HZ PHE A 269 157.645 8.314 -2.719 1.00 0.00 H new ATOM 383 N LEU A 270 157.182 13.160 3.646 1.00 0.00 N ATOM 384 CA LEU A 270 156.736 14.116 4.650 1.00 0.00 C ATOM 385 C LEU A 270 155.471 14.865 4.220 1.00 0.00 C ATOM 386 O LEU A 270 155.272 15.173 3.045 1.00 0.00 O ATOM 387 CB LEU A 270 157.861 15.118 4.946 1.00 0.00 C ATOM 388 CG LEU A 270 157.484 16.299 5.852 1.00 0.00 C ATOM 389 CD1 LEU A 270 157.918 16.041 7.286 1.00 0.00 C ATOM 390 CD2 LEU A 270 158.109 17.588 5.335 1.00 0.00 C ATOM 0 H LEU A 270 157.482 13.582 2.767 1.00 0.00 H new ATOM 0 HA LEU A 270 156.489 13.554 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 270 158.689 14.580 5.408 1.00 0.00 H new ATOM 0 HB3 LEU A 270 158.228 15.514 3.999 1.00 0.00 H new ATOM 0 HG LEU A 270 156.399 16.406 5.836 1.00 0.00 H new ATOM 0 HD11 LEU A 270 157.640 16.891 7.909 1.00 0.00 H new ATOM 0 HD12 LEU A 270 157.427 15.142 7.659 1.00 0.00 H new ATOM 0 HD13 LEU A 270 158.999 15.904 7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 270 157.831 18.415 5.989 1.00 0.00 H new ATOM 0 HD22 LEU A 270 159.194 17.486 5.320 1.00 0.00 H new ATOM 0 HD23 LEU A 270 157.749 17.787 4.326 1.00 0.00 H new ATOM 402 N HIS A 271 154.656 15.190 5.216 1.00 0.00 N ATOM 403 CA HIS A 271 153.434 15.955 4.992 1.00 0.00 C ATOM 404 C HIS A 271 153.703 17.424 5.264 1.00 0.00 C ATOM 405 O HIS A 271 153.578 17.885 6.399 1.00 0.00 O ATOM 406 CB HIS A 271 152.275 15.471 5.864 1.00 0.00 C ATOM 407 CG HIS A 271 150.975 15.394 5.123 1.00 0.00 C ATOM 408 ND1 HIS A 271 150.651 14.773 3.964 1.00 0.00 N flip ATOM 409 CD2 HIS A 271 149.821 16.016 5.556 1.00 0.00 C flip ATOM 410 CE1 HIS A 271 149.324 15.028 3.722 1.00 0.00 C flip ATOM 411 NE2 HIS A 271 148.846 15.779 4.696 1.00 0.00 N flip ATOM 0 H HIS A 271 154.819 14.935 6.190 1.00 0.00 H new ATOM 0 HA HIS A 271 153.139 15.809 3.953 1.00 0.00 H new ATOM 0 HB2 HIS A 271 152.516 14.487 6.266 1.00 0.00 H new ATOM 0 HB3 HIS A 271 152.162 16.143 6.714 1.00 0.00 H new ATOM 0 HD1 HIS A 271 151.277 14.219 3.379 1.00 0.00 H new ATOM 0 HD2 HIS A 271 149.729 16.604 6.457 1.00 0.00 H new ATOM 0 HE1 HIS A 271 148.762 14.671 2.872 1.00 0.00 H new ATOM 420 N THR A 272 154.089 18.151 4.219 1.00 0.00 N ATOM 421 CA THR A 272 154.393 19.571 4.342 1.00 0.00 C ATOM 422 C THR A 272 153.302 20.304 5.121 1.00 0.00 C ATOM 423 O THR A 272 153.553 21.331 5.751 1.00 0.00 O ATOM 424 CB THR A 272 154.552 20.199 2.956 1.00 0.00 C ATOM 425 OG1 THR A 272 154.900 21.568 3.063 1.00 0.00 O ATOM 426 CG2 THR A 272 153.301 20.108 2.110 1.00 0.00 C ATOM 0 H THR A 272 154.198 17.778 3.276 1.00 0.00 H new ATOM 0 HA THR A 272 155.329 19.667 4.892 1.00 0.00 H new ATOM 0 HB THR A 272 155.342 19.627 2.469 1.00 0.00 H new ATOM 0 HG1 THR A 272 154.999 21.951 2.167 1.00 0.00 H new ATOM 0 HG21 THR A 272 153.483 20.572 1.141 1.00 0.00 H new ATOM 0 HG22 THR A 272 153.034 19.061 1.967 1.00 0.00 H new ATOM 0 HG23 THR A 272 152.484 20.625 2.612 1.00 0.00 H new ATOM 434 N GLN A 273 152.087 19.768 5.058 1.00 0.00 N ATOM 435 CA GLN A 273 150.944 20.364 5.739 1.00 0.00 C ATOM 436 C GLN A 273 151.102 20.324 7.256 1.00 0.00 C ATOM 437 O GLN A 273 151.087 21.361 7.918 1.00 0.00 O ATOM 438 CB GLN A 273 149.669 19.620 5.346 1.00 0.00 C ATOM 439 CG GLN A 273 148.411 20.173 6.001 1.00 0.00 C ATOM 440 CD GLN A 273 148.065 21.572 5.522 1.00 0.00 C ATOM 441 OE1 GLN A 273 148.928 22.315 5.058 1.00 0.00 O ATOM 442 NE2 GLN A 273 146.793 21.938 5.635 1.00 0.00 N ATOM 0 H GLN A 273 151.869 18.917 4.539 1.00 0.00 H new ATOM 0 HA GLN A 273 150.884 21.409 5.433 1.00 0.00 H new ATOM 0 HB2 GLN A 273 149.553 19.663 4.263 1.00 0.00 H new ATOM 0 HB3 GLN A 273 149.775 18.569 5.614 1.00 0.00 H new ATOM 0 HG2 GLN A 273 147.575 19.505 5.793 1.00 0.00 H new ATOM 0 HG3 GLN A 273 148.546 20.187 7.083 1.00 0.00 H new ATOM 0 HE21 GLN A 273 146.109 21.290 6.026 1.00 0.00 H new ATOM 0 HE22 GLN A 273 146.501 22.867 5.331 1.00 0.00 H new ATOM 451 N THR A 274 151.227 19.120 7.803 1.00 0.00 N ATOM 452 CA THR A 274 151.357 18.946 9.245 1.00 0.00 C ATOM 453 C THR A 274 152.769 18.524 9.639 1.00 0.00 C ATOM 454 O THR A 274 152.983 18.010 10.736 1.00 0.00 O ATOM 455 CB THR A 274 150.353 17.903 9.734 1.00 0.00 C ATOM 456 OG1 THR A 274 150.514 16.685 9.028 1.00 0.00 O ATOM 457 CG2 THR A 274 148.913 18.339 9.573 1.00 0.00 C ATOM 0 H THR A 274 151.241 18.250 7.270 1.00 0.00 H new ATOM 0 HA THR A 274 151.152 19.908 9.715 1.00 0.00 H new ATOM 0 HB THR A 274 150.561 17.775 10.796 1.00 0.00 H new ATOM 0 HG1 THR A 274 149.864 16.029 9.356 1.00 0.00 H new ATOM 0 HG21 THR A 274 148.252 17.553 9.939 1.00 0.00 H new ATOM 0 HG22 THR A 274 148.743 19.252 10.144 1.00 0.00 H new ATOM 0 HG23 THR A 274 148.705 18.526 8.520 1.00 0.00 H new ATOM 465 N GLY A 275 153.731 18.737 8.747 1.00 0.00 N ATOM 466 CA GLY A 275 155.101 18.362 9.038 1.00 0.00 C ATOM 467 C GLY A 275 155.222 16.911 9.456 1.00 0.00 C ATOM 468 O GLY A 275 156.089 16.557 10.255 1.00 0.00 O ATOM 0 H GLY A 275 153.586 19.161 7.831 1.00 0.00 H new ATOM 0 HA2 GLY A 275 155.718 18.537 8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 275 155.490 19.000 9.831 1.00 0.00 H new ATOM 472 N VAL A 276 154.345 16.069 8.920 1.00 0.00 N ATOM 473 CA VAL A 276 154.346 14.649 9.240 1.00 0.00 C ATOM 474 C VAL A 276 155.396 13.893 8.443 1.00 0.00 C ATOM 475 O VAL A 276 155.810 14.324 7.371 1.00 0.00 O ATOM 476 CB VAL A 276 152.954 14.030 9.001 1.00 0.00 C ATOM 477 CG1 VAL A 276 153.037 12.557 8.613 1.00 0.00 C ATOM 478 CG2 VAL A 276 152.122 14.207 10.245 1.00 0.00 C ATOM 0 H VAL A 276 153.621 16.349 8.258 1.00 0.00 H new ATOM 0 HA VAL A 276 154.596 14.559 10.297 1.00 0.00 H new ATOM 0 HB VAL A 276 152.486 14.546 8.162 1.00 0.00 H new ATOM 0 HG11 VAL A 276 152.032 12.165 8.455 1.00 0.00 H new ATOM 0 HG12 VAL A 276 153.615 12.455 7.694 1.00 0.00 H new ATOM 0 HG13 VAL A 276 153.523 11.997 9.412 1.00 0.00 H new ATOM 0 HG21 VAL A 276 151.135 13.773 10.087 1.00 0.00 H new ATOM 0 HG22 VAL A 276 152.609 13.707 11.082 1.00 0.00 H new ATOM 0 HG23 VAL A 276 152.020 15.269 10.466 1.00 0.00 H new ATOM 488 N SER A 277 155.820 12.760 8.986 1.00 0.00 N ATOM 489 CA SER A 277 156.826 11.931 8.331 1.00 0.00 C ATOM 490 C SER A 277 156.392 10.468 8.282 1.00 0.00 C ATOM 491 O SER A 277 156.210 9.829 9.318 1.00 0.00 O ATOM 492 CB SER A 277 158.166 12.047 9.056 1.00 0.00 C ATOM 493 OG SER A 277 158.099 11.466 10.347 1.00 0.00 O ATOM 0 H SER A 277 155.485 12.393 9.877 1.00 0.00 H new ATOM 0 HA SER A 277 156.937 12.291 7.308 1.00 0.00 H new ATOM 0 HB2 SER A 277 158.943 11.554 8.472 1.00 0.00 H new ATOM 0 HB3 SER A 277 158.448 13.097 9.140 1.00 0.00 H new ATOM 0 HG SER A 277 157.480 10.707 10.332 1.00 0.00 H new ATOM 499 N THR A 278 156.237 9.942 7.069 1.00 0.00 N ATOM 500 CA THR A 278 155.836 8.552 6.881 1.00 0.00 C ATOM 501 C THR A 278 156.769 7.851 5.901 1.00 0.00 C ATOM 502 O THR A 278 157.337 8.479 5.007 1.00 0.00 O ATOM 503 CB THR A 278 154.393 8.466 6.383 1.00 0.00 C ATOM 504 OG1 THR A 278 154.054 7.130 6.055 1.00 0.00 O ATOM 505 CG2 THR A 278 154.131 9.318 5.164 1.00 0.00 C ATOM 0 H THR A 278 156.383 10.459 6.202 1.00 0.00 H new ATOM 0 HA THR A 278 155.901 8.050 7.846 1.00 0.00 H new ATOM 0 HB THR A 278 153.781 8.838 7.205 1.00 0.00 H new ATOM 0 HG1 THR A 278 153.127 7.096 5.740 1.00 0.00 H new ATOM 0 HG21 THR A 278 153.089 9.211 4.863 1.00 0.00 H new ATOM 0 HG22 THR A 278 154.335 10.362 5.399 1.00 0.00 H new ATOM 0 HG23 THR A 278 154.779 8.996 4.349 1.00 0.00 H new ATOM 513 N TRP A 279 156.937 6.549 6.093 1.00 0.00 N ATOM 514 CA TRP A 279 157.817 5.752 5.251 1.00 0.00 C ATOM 515 C TRP A 279 157.134 5.265 3.974 1.00 0.00 C ATOM 516 O TRP A 279 157.790 5.071 2.951 1.00 0.00 O ATOM 517 CB TRP A 279 158.320 4.553 6.041 1.00 0.00 C ATOM 518 CG TRP A 279 159.656 4.781 6.656 1.00 0.00 C ATOM 519 CD1 TRP A 279 160.030 4.487 7.933 1.00 0.00 C ATOM 520 CD2 TRP A 279 160.801 5.354 6.020 1.00 0.00 C ATOM 521 NE1 TRP A 279 161.337 4.838 8.126 1.00 0.00 N ATOM 522 CE2 TRP A 279 161.838 5.365 6.966 1.00 0.00 C ATOM 523 CE3 TRP A 279 161.053 5.853 4.740 1.00 0.00 C ATOM 524 CZ2 TRP A 279 163.109 5.849 6.675 1.00 0.00 C ATOM 525 CZ3 TRP A 279 162.312 6.340 4.453 1.00 0.00 C ATOM 526 CH2 TRP A 279 163.327 6.331 5.416 1.00 0.00 C ATOM 0 H TRP A 279 156.471 6.020 6.830 1.00 0.00 H new ATOM 0 HA TRP A 279 158.645 6.394 4.950 1.00 0.00 H new ATOM 0 HB2 TRP A 279 157.601 4.314 6.825 1.00 0.00 H new ATOM 0 HB3 TRP A 279 158.373 3.687 5.382 1.00 0.00 H new ATOM 0 HD1 TRP A 279 159.390 4.043 8.681 1.00 0.00 H new ATOM 0 HE1 TRP A 279 161.857 4.725 8.996 1.00 0.00 H new ATOM 0 HE3 TRP A 279 160.277 5.858 3.989 1.00 0.00 H new ATOM 0 HZ2 TRP A 279 163.894 5.844 7.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 279 162.517 6.735 3.469 1.00 0.00 H new ATOM 0 HH2 TRP A 279 164.304 6.713 5.158 1.00 0.00 H new ATOM 537 N HIS A 280 155.828 5.049 4.036 1.00 0.00 N ATOM 538 CA HIS A 280 155.088 4.561 2.877 1.00 0.00 C ATOM 539 C HIS A 280 154.614 5.707 1.990 1.00 0.00 C ATOM 540 O HIS A 280 154.291 6.789 2.479 1.00 0.00 O ATOM 541 CB HIS A 280 153.883 3.733 3.330 1.00 0.00 C ATOM 542 CG HIS A 280 154.247 2.534 4.151 1.00 0.00 C ATOM 543 ND1 HIS A 280 153.921 1.244 3.784 1.00 0.00 N ATOM 544 CD2 HIS A 280 154.908 2.432 5.328 1.00 0.00 C ATOM 545 CE1 HIS A 280 154.365 0.402 4.701 1.00 0.00 C ATOM 546 NE2 HIS A 280 154.968 1.097 5.647 1.00 0.00 N ATOM 0 H HIS A 280 155.260 5.202 4.870 1.00 0.00 H new ATOM 0 HA HIS A 280 155.765 3.936 2.294 1.00 0.00 H new ATOM 0 HB2 HIS A 280 153.214 4.369 3.910 1.00 0.00 H new ATOM 0 HB3 HIS A 280 153.328 3.405 2.451 1.00 0.00 H new ATOM 0 HD2 HIS A 280 155.313 3.248 5.908 1.00 0.00 H new ATOM 0 HE1 HIS A 280 154.253 -0.672 4.680 1.00 0.00 H new ATOM 0 HE2 HIS A 280 155.408 0.706 6.480 1.00 0.00 H new ATOM 555 N ASP A 281 154.527 5.445 0.686 1.00 0.00 N ATOM 556 CA ASP A 281 154.038 6.442 -0.254 1.00 0.00 C ATOM 557 C ASP A 281 152.513 6.395 -0.241 1.00 0.00 C ATOM 558 O ASP A 281 151.924 5.332 -0.435 1.00 0.00 O ATOM 559 CB ASP A 281 154.580 6.173 -1.661 1.00 0.00 C ATOM 560 CG ASP A 281 153.962 7.081 -2.707 1.00 0.00 C ATOM 561 OD1 ASP A 281 154.465 8.211 -2.885 1.00 0.00 O ATOM 562 OD2 ASP A 281 152.976 6.662 -3.350 1.00 0.00 O ATOM 0 H ASP A 281 154.788 4.555 0.262 1.00 0.00 H new ATOM 0 HA ASP A 281 154.382 7.434 0.040 1.00 0.00 H new ATOM 0 HB2 ASP A 281 155.662 6.308 -1.662 1.00 0.00 H new ATOM 0 HB3 ASP A 281 154.388 5.134 -1.928 1.00 0.00 H new ATOM 567 N PRO A 282 151.845 7.524 0.034 1.00 0.00 N ATOM 568 CA PRO A 282 150.381 7.564 0.123 1.00 0.00 C ATOM 569 C PRO A 282 149.672 7.295 -1.202 1.00 0.00 C ATOM 570 O PRO A 282 148.510 6.887 -1.209 1.00 0.00 O ATOM 571 CB PRO A 282 150.084 8.983 0.623 1.00 0.00 C ATOM 572 CG PRO A 282 151.380 9.489 1.156 1.00 0.00 C ATOM 573 CD PRO A 282 152.442 8.837 0.327 1.00 0.00 C ATOM 0 HA PRO A 282 150.011 6.777 0.780 1.00 0.00 H new ATOM 0 HB2 PRO A 282 149.716 9.616 -0.185 1.00 0.00 H new ATOM 0 HB3 PRO A 282 149.316 8.975 1.397 1.00 0.00 H new ATOM 0 HG2 PRO A 282 151.437 10.575 1.081 1.00 0.00 H new ATOM 0 HG3 PRO A 282 151.495 9.236 2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 282 152.652 9.401 -0.582 1.00 0.00 H new ATOM 0 HD3 PRO A 282 153.383 8.745 0.870 1.00 0.00 H new ATOM 581 N ARG A 283 150.354 7.517 -2.320 1.00 0.00 N ATOM 582 CA ARG A 283 149.740 7.283 -3.622 1.00 0.00 C ATOM 583 C ARG A 283 149.687 5.791 -3.939 1.00 0.00 C ATOM 584 O ARG A 283 148.688 5.295 -4.459 1.00 0.00 O ATOM 585 CB ARG A 283 150.486 8.033 -4.728 1.00 0.00 C ATOM 586 CG ARG A 283 149.556 8.658 -5.760 1.00 0.00 C ATOM 587 CD ARG A 283 150.258 9.731 -6.577 1.00 0.00 C ATOM 588 NE ARG A 283 149.399 10.891 -6.813 1.00 0.00 N ATOM 589 CZ ARG A 283 148.320 10.872 -7.595 1.00 0.00 C ATOM 590 NH1 ARG A 283 147.967 9.758 -8.225 1.00 0.00 N ATOM 591 NH2 ARG A 283 147.593 11.971 -7.748 1.00 0.00 N ATOM 0 H ARG A 283 151.316 7.853 -2.353 1.00 0.00 H new ATOM 0 HA ARG A 283 148.720 7.665 -3.578 1.00 0.00 H new ATOM 0 HB2 ARG A 283 151.098 8.815 -4.279 1.00 0.00 H new ATOM 0 HB3 ARG A 283 151.166 7.345 -5.230 1.00 0.00 H new ATOM 0 HG2 ARG A 283 149.179 7.882 -6.427 1.00 0.00 H new ATOM 0 HG3 ARG A 283 148.693 9.092 -5.256 1.00 0.00 H new ATOM 0 HD2 ARG A 283 151.162 10.049 -6.057 1.00 0.00 H new ATOM 0 HD3 ARG A 283 150.571 9.312 -7.533 1.00 0.00 H new ATOM 0 HE ARG A 283 149.640 11.768 -6.351 1.00 0.00 H new ATOM 0 HH11 ARG A 283 148.523 8.910 -8.112 1.00 0.00 H new ATOM 0 HH12 ARG A 283 147.140 9.750 -8.822 1.00 0.00 H new ATOM 0 HH21 ARG A 283 147.860 12.830 -7.267 1.00 0.00 H new ATOM 0 HH22 ARG A 283 146.767 11.957 -8.346 1.00 0.00 H new ATOM 605 N VAL A 284 150.761 5.075 -3.616 1.00 0.00 N ATOM 606 CA VAL A 284 150.822 3.647 -3.860 1.00 0.00 C ATOM 607 C VAL A 284 150.237 2.872 -2.682 1.00 0.00 C ATOM 608 O VAL A 284 150.129 3.401 -1.576 1.00 0.00 O ATOM 609 CB VAL A 284 152.267 3.192 -4.111 1.00 0.00 C ATOM 610 CG1 VAL A 284 152.879 3.952 -5.278 1.00 0.00 C ATOM 611 CG2 VAL A 284 153.097 3.366 -2.859 1.00 0.00 C ATOM 0 H VAL A 284 151.599 5.466 -3.185 1.00 0.00 H new ATOM 0 HA VAL A 284 150.230 3.439 -4.751 1.00 0.00 H new ATOM 0 HB VAL A 284 152.255 2.134 -4.372 1.00 0.00 H new ATOM 0 HG11 VAL A 284 153.903 3.612 -5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 284 152.293 3.770 -6.179 1.00 0.00 H new ATOM 0 HG13 VAL A 284 152.881 5.019 -5.056 1.00 0.00 H new ATOM 0 HG21 VAL A 284 154.119 3.039 -3.052 1.00 0.00 H new ATOM 0 HG22 VAL A 284 153.100 4.416 -2.568 1.00 0.00 H new ATOM 0 HG23 VAL A 284 152.671 2.768 -2.054 1.00 0.00 H new ATOM 621 N PRO A 285 149.849 1.605 -2.899 1.00 0.00 N ATOM 622 CA PRO A 285 149.273 0.768 -1.844 1.00 0.00 C ATOM 623 C PRO A 285 150.292 0.421 -0.771 1.00 0.00 C ATOM 624 O PRO A 285 151.447 0.115 -1.065 1.00 0.00 O ATOM 625 CB PRO A 285 148.813 -0.499 -2.580 1.00 0.00 C ATOM 626 CG PRO A 285 148.886 -0.172 -4.037 1.00 0.00 C ATOM 627 CD PRO A 285 149.938 0.889 -4.177 1.00 0.00 C ATOM 0 HA PRO A 285 148.464 1.278 -1.321 1.00 0.00 H new ATOM 0 HB2 PRO A 285 149.453 -1.347 -2.337 1.00 0.00 H new ATOM 0 HB3 PRO A 285 147.798 -0.773 -2.291 1.00 0.00 H new ATOM 0 HG2 PRO A 285 149.144 -1.055 -4.621 1.00 0.00 H new ATOM 0 HG3 PRO A 285 147.923 0.184 -4.405 1.00 0.00 H new ATOM 0 HD2 PRO A 285 150.928 0.459 -4.332 1.00 0.00 H new ATOM 0 HD3 PRO A 285 149.740 1.546 -5.024 1.00 0.00 H new ATOM 701 N ASN A 290 156.952 -2.245 -1.075 1.00 0.00 N ATOM 702 CA ASN A 290 158.269 -2.785 -1.384 1.00 0.00 C ATOM 703 C ASN A 290 158.201 -3.641 -2.644 1.00 0.00 C ATOM 704 O ASN A 290 158.489 -4.838 -2.613 1.00 0.00 O ATOM 705 CB ASN A 290 158.794 -3.616 -0.211 1.00 0.00 C ATOM 706 CG ASN A 290 158.803 -2.838 1.091 1.00 0.00 C ATOM 707 OD1 ASN A 290 159.984 -2.398 1.509 1.00 0.00 O flip ATOM 708 ND2 ASN A 290 157.762 -2.636 1.714 1.00 0.00 N flip ATOM 0 HA ASN A 290 158.954 -1.955 -1.556 1.00 0.00 H new ATOM 0 HB2 ASN A 290 158.176 -4.506 -0.095 1.00 0.00 H new ATOM 0 HB3 ASN A 290 159.805 -3.957 -0.434 1.00 0.00 H new ATOM 0 HD21 ASN A 290 156.876 -2.993 1.356 1.00 0.00 H new ATOM 0 HD22 ASN A 290 157.785 -2.112 2.589 1.00 0.00 H new ATOM 715 N ILE A 291 157.807 -3.018 -3.749 1.00 0.00 N ATOM 716 CA ILE A 291 157.687 -3.718 -5.021 1.00 0.00 C ATOM 717 C ILE A 291 159.036 -3.828 -5.718 1.00 0.00 C ATOM 718 O ILE A 291 159.858 -2.915 -5.649 1.00 0.00 O ATOM 719 CB ILE A 291 156.713 -3.002 -5.980 1.00 0.00 C ATOM 720 CG1 ILE A 291 155.472 -2.486 -5.237 1.00 0.00 C ATOM 721 CG2 ILE A 291 156.323 -3.928 -7.124 1.00 0.00 C ATOM 722 CD1 ILE A 291 154.364 -3.503 -5.126 1.00 0.00 C ATOM 0 H ILE A 291 157.565 -2.028 -3.789 1.00 0.00 H new ATOM 0 HA ILE A 291 157.303 -4.711 -4.786 1.00 0.00 H new ATOM 0 HB ILE A 291 157.224 -2.134 -6.397 1.00 0.00 H new ATOM 0 HG12 ILE A 291 155.764 -2.170 -4.236 1.00 0.00 H new ATOM 0 HG13 ILE A 291 155.092 -1.603 -5.752 1.00 0.00 H new ATOM 0 HG21 ILE A 291 155.636 -3.410 -7.793 1.00 0.00 H new ATOM 0 HG22 ILE A 291 157.216 -4.220 -7.676 1.00 0.00 H new ATOM 0 HG23 ILE A 291 155.838 -4.818 -6.723 1.00 0.00 H new ATOM 0 HD11 ILE A 291 153.522 -3.066 -4.589 1.00 0.00 H new ATOM 0 HD12 ILE A 291 154.043 -3.802 -6.124 1.00 0.00 H new ATOM 0 HD13 ILE A 291 154.725 -4.377 -4.584 1.00 0.00 H new ATOM 734 N ASN A 292 159.250 -4.942 -6.408 1.00 0.00 N ATOM 735 CA ASN A 292 160.491 -5.156 -7.138 1.00 0.00 C ATOM 736 C ASN A 292 160.274 -4.877 -8.622 1.00 0.00 C ATOM 737 O ASN A 292 159.686 -5.687 -9.338 1.00 0.00 O ATOM 738 CB ASN A 292 161.000 -6.585 -6.930 1.00 0.00 C ATOM 739 CG ASN A 292 162.409 -6.620 -6.373 1.00 0.00 C ATOM 740 OD1 ASN A 292 162.634 -7.072 -5.250 1.00 0.00 O ATOM 741 ND2 ASN A 292 163.368 -6.140 -7.157 1.00 0.00 N ATOM 0 H ASN A 292 158.581 -5.709 -6.477 1.00 0.00 H new ATOM 0 HA ASN A 292 161.246 -4.469 -6.756 1.00 0.00 H new ATOM 0 HB2 ASN A 292 160.330 -7.111 -6.250 1.00 0.00 H new ATOM 0 HB3 ASN A 292 160.974 -7.119 -7.880 1.00 0.00 H new ATOM 0 HD21 ASN A 292 164.336 -6.136 -6.835 1.00 0.00 H new ATOM 0 HD22 ASN A 292 163.136 -5.775 -8.081 1.00 0.00 H new ATOM 748 N CYS A 293 160.738 -3.714 -9.071 1.00 0.00 N ATOM 749 CA CYS A 293 160.583 -3.306 -10.465 1.00 0.00 C ATOM 750 C CYS A 293 161.022 -4.401 -11.435 1.00 0.00 C ATOM 751 O CYS A 293 160.611 -4.409 -12.595 1.00 0.00 O ATOM 752 CB CYS A 293 161.369 -2.024 -10.729 1.00 0.00 C ATOM 753 SG CYS A 293 163.158 -2.198 -10.536 1.00 0.00 S ATOM 0 H CYS A 293 161.226 -3.035 -8.487 1.00 0.00 H new ATOM 0 HA CYS A 293 159.522 -3.123 -10.636 1.00 0.00 H new ATOM 0 HB2 CYS A 293 161.156 -1.683 -11.742 1.00 0.00 H new ATOM 0 HB3 CYS A 293 161.015 -1.248 -10.050 1.00 0.00 H new ATOM 0 HG CYS A 293 163.763 -1.370 -11.335 1.00 0.00 H new ATOM 759 N GLU A 294 161.849 -5.328 -10.960 1.00 0.00 N ATOM 760 CA GLU A 294 162.322 -6.425 -11.798 1.00 0.00 C ATOM 761 C GLU A 294 161.152 -7.153 -12.460 1.00 0.00 C ATOM 762 O GLU A 294 161.321 -7.815 -13.484 1.00 0.00 O ATOM 763 CB GLU A 294 163.145 -7.411 -10.965 1.00 0.00 C ATOM 764 CG GLU A 294 164.497 -6.865 -10.535 1.00 0.00 C ATOM 765 CD GLU A 294 165.586 -7.919 -10.559 1.00 0.00 C ATOM 766 OE1 GLU A 294 165.456 -8.924 -9.830 1.00 0.00 O ATOM 767 OE2 GLU A 294 166.571 -7.738 -11.306 1.00 0.00 O ATOM 0 H GLU A 294 162.204 -5.342 -10.004 1.00 0.00 H new ATOM 0 HA GLU A 294 162.953 -6.004 -12.581 1.00 0.00 H new ATOM 0 HB2 GLU A 294 162.576 -7.688 -10.078 1.00 0.00 H new ATOM 0 HB3 GLU A 294 163.298 -8.323 -11.543 1.00 0.00 H new ATOM 0 HG2 GLU A 294 164.778 -6.042 -11.193 1.00 0.00 H new ATOM 0 HG3 GLU A 294 164.416 -6.455 -9.528 1.00 0.00 H new ATOM 774 N GLU A 295 159.965 -7.027 -11.867 1.00 0.00 N ATOM 775 CA GLU A 295 158.769 -7.674 -12.399 1.00 0.00 C ATOM 776 C GLU A 295 158.022 -6.759 -13.366 1.00 0.00 C ATOM 777 O GLU A 295 157.136 -7.205 -14.096 1.00 0.00 O ATOM 778 CB GLU A 295 157.828 -8.086 -11.262 1.00 0.00 C ATOM 779 CG GLU A 295 158.537 -8.556 -10.001 1.00 0.00 C ATOM 780 CD GLU A 295 157.746 -8.249 -8.744 1.00 0.00 C ATOM 781 OE1 GLU A 295 157.417 -7.064 -8.524 1.00 0.00 O ATOM 782 OE2 GLU A 295 157.456 -9.193 -7.979 1.00 0.00 O ATOM 0 H GLU A 295 159.807 -6.483 -11.019 1.00 0.00 H new ATOM 0 HA GLU A 295 159.095 -8.561 -12.941 1.00 0.00 H new ATOM 0 HB2 GLU A 295 157.188 -7.240 -11.011 1.00 0.00 H new ATOM 0 HB3 GLU A 295 157.176 -8.884 -11.617 1.00 0.00 H new ATOM 0 HG2 GLU A 295 158.711 -9.630 -10.064 1.00 0.00 H new ATOM 0 HG3 GLU A 295 159.515 -8.078 -9.938 1.00 0.00 H new ATOM 789 N LEU A 296 158.378 -5.481 -13.364 1.00 0.00 N ATOM 790 CA LEU A 296 157.731 -4.506 -14.240 1.00 0.00 C ATOM 791 C LEU A 296 158.662 -4.065 -15.365 1.00 0.00 C ATOM 792 O LEU A 296 158.207 -3.561 -16.391 1.00 0.00 O ATOM 793 CB LEU A 296 157.276 -3.276 -13.446 1.00 0.00 C ATOM 794 CG LEU A 296 156.987 -3.512 -11.962 1.00 0.00 C ATOM 795 CD1 LEU A 296 157.017 -2.194 -11.203 1.00 0.00 C ATOM 796 CD2 LEU A 296 155.642 -4.203 -11.779 1.00 0.00 C ATOM 0 H LEU A 296 159.109 -5.093 -12.768 1.00 0.00 H new ATOM 0 HA LEU A 296 156.860 -4.995 -14.677 1.00 0.00 H new ATOM 0 HB2 LEU A 296 158.045 -2.508 -13.530 1.00 0.00 H new ATOM 0 HB3 LEU A 296 156.376 -2.878 -13.913 1.00 0.00 H new ATOM 0 HG LEU A 296 157.762 -4.164 -11.559 1.00 0.00 H new ATOM 0 HD11 LEU A 296 156.810 -2.377 -10.149 1.00 0.00 H new ATOM 0 HD12 LEU A 296 158.001 -1.737 -11.306 1.00 0.00 H new ATOM 0 HD13 LEU A 296 156.261 -1.522 -11.610 1.00 0.00 H new ATOM 0 HD21 LEU A 296 155.456 -4.361 -10.717 1.00 0.00 H new ATOM 0 HD22 LEU A 296 154.852 -3.578 -12.197 1.00 0.00 H new ATOM 0 HD23 LEU A 296 155.654 -5.164 -12.293 1.00 0.00 H new ATOM 808 N GLY A 297 159.964 -4.252 -15.173 1.00 0.00 N ATOM 809 CA GLY A 297 160.923 -3.859 -16.187 1.00 0.00 C ATOM 810 C GLY A 297 162.266 -3.475 -15.594 1.00 0.00 C ATOM 811 O GLY A 297 162.483 -3.635 -14.393 1.00 0.00 O ATOM 0 H GLY A 297 160.371 -4.668 -14.335 1.00 0.00 H new ATOM 0 HA2 GLY A 297 161.061 -4.680 -16.891 1.00 0.00 H new ATOM 0 HA3 GLY A 297 160.525 -3.017 -16.753 1.00 0.00 H new ATOM 815 N PRO A 298 163.198 -2.970 -16.419 1.00 0.00 N ATOM 816 CA PRO A 298 164.534 -2.576 -15.957 1.00 0.00 C ATOM 817 C PRO A 298 164.529 -1.301 -15.117 1.00 0.00 C ATOM 818 O PRO A 298 163.654 -0.448 -15.256 1.00 0.00 O ATOM 819 CB PRO A 298 165.303 -2.343 -17.257 1.00 0.00 C ATOM 820 CG PRO A 298 164.259 -1.982 -18.255 1.00 0.00 C ATOM 821 CD PRO A 298 163.030 -2.758 -17.869 1.00 0.00 C ATOM 0 HA PRO A 298 164.968 -3.336 -15.307 1.00 0.00 H new ATOM 0 HB2 PRO A 298 166.037 -1.545 -17.145 1.00 0.00 H new ATOM 0 HB3 PRO A 298 165.848 -3.237 -17.560 1.00 0.00 H new ATOM 0 HG2 PRO A 298 164.063 -0.910 -18.244 1.00 0.00 H new ATOM 0 HG3 PRO A 298 164.580 -2.237 -19.265 1.00 0.00 H new ATOM 0 HD2 PRO A 298 162.119 -2.203 -18.091 1.00 0.00 H new ATOM 0 HD3 PRO A 298 162.966 -3.703 -18.408 1.00 0.00 H new ATOM 829 N LEU A 299 165.533 -1.184 -14.256 1.00 0.00 N ATOM 830 CA LEU A 299 165.702 -0.034 -13.386 1.00 0.00 C ATOM 831 C LEU A 299 166.149 1.180 -14.206 1.00 0.00 C ATOM 832 O LEU A 299 167.006 1.053 -15.080 1.00 0.00 O ATOM 833 CB LEU A 299 166.750 -0.408 -12.333 1.00 0.00 C ATOM 834 CG LEU A 299 166.870 0.519 -11.136 1.00 0.00 C ATOM 835 CD1 LEU A 299 165.719 0.313 -10.158 1.00 0.00 C ATOM 836 CD2 LEU A 299 168.206 0.283 -10.449 1.00 0.00 C ATOM 0 H LEU A 299 166.258 -1.893 -14.144 1.00 0.00 H new ATOM 0 HA LEU A 299 164.764 0.232 -12.898 1.00 0.00 H new ATOM 0 HB2 LEU A 299 166.524 -1.410 -11.967 1.00 0.00 H new ATOM 0 HB3 LEU A 299 167.722 -0.460 -12.823 1.00 0.00 H new ATOM 0 HG LEU A 299 166.819 1.550 -11.485 1.00 0.00 H new ATOM 0 HD11 LEU A 299 165.834 0.991 -9.312 1.00 0.00 H new ATOM 0 HD12 LEU A 299 164.774 0.517 -10.661 1.00 0.00 H new ATOM 0 HD13 LEU A 299 165.725 -0.717 -9.801 1.00 0.00 H new ATOM 0 HD21 LEU A 299 168.295 0.947 -9.589 1.00 0.00 H new ATOM 0 HD22 LEU A 299 168.266 -0.753 -10.115 1.00 0.00 H new ATOM 0 HD23 LEU A 299 169.016 0.486 -11.150 1.00 0.00 H new ATOM 848 N PRO A 300 165.581 2.378 -13.948 1.00 0.00 N ATOM 849 CA PRO A 300 165.954 3.583 -14.692 1.00 0.00 C ATOM 850 C PRO A 300 167.460 3.790 -14.666 1.00 0.00 C ATOM 851 O PRO A 300 168.150 3.177 -13.850 1.00 0.00 O ATOM 852 CB PRO A 300 165.229 4.727 -13.972 1.00 0.00 C ATOM 853 CG PRO A 300 164.606 4.136 -12.747 1.00 0.00 C ATOM 854 CD PRO A 300 164.558 2.645 -12.927 1.00 0.00 C ATOM 0 HA PRO A 300 165.676 3.520 -15.744 1.00 0.00 H new ATOM 0 HB2 PRO A 300 165.927 5.521 -13.707 1.00 0.00 H new ATOM 0 HB3 PRO A 300 164.470 5.171 -14.616 1.00 0.00 H new ATOM 0 HG2 PRO A 300 165.186 4.395 -11.861 1.00 0.00 H new ATOM 0 HG3 PRO A 300 163.603 4.535 -12.599 1.00 0.00 H new ATOM 0 HD2 PRO A 300 164.778 2.123 -11.996 1.00 0.00 H new ATOM 0 HD3 PRO A 300 163.572 2.314 -13.253 1.00 0.00 H new ATOM 862 N PRO A 301 168.017 4.628 -15.557 1.00 0.00 N ATOM 863 CA PRO A 301 169.457 4.832 -15.579 1.00 0.00 C ATOM 864 C PRO A 301 169.921 5.776 -14.479 1.00 0.00 C ATOM 865 O PRO A 301 169.625 6.971 -14.487 1.00 0.00 O ATOM 866 CB PRO A 301 169.714 5.457 -16.964 1.00 0.00 C ATOM 867 CG PRO A 301 168.382 5.529 -17.653 1.00 0.00 C ATOM 868 CD PRO A 301 167.328 5.395 -16.592 1.00 0.00 C ATOM 0 HA PRO A 301 170.001 3.903 -15.410 1.00 0.00 H new ATOM 0 HB2 PRO A 301 170.154 6.449 -16.866 1.00 0.00 H new ATOM 0 HB3 PRO A 301 170.416 4.852 -17.538 1.00 0.00 H new ATOM 0 HG2 PRO A 301 168.274 6.474 -18.186 1.00 0.00 H new ATOM 0 HG3 PRO A 301 168.287 4.734 -18.392 1.00 0.00 H new ATOM 0 HD2 PRO A 301 166.996 6.366 -16.224 1.00 0.00 H new ATOM 0 HD3 PRO A 301 166.444 4.875 -16.961 1.00 0.00 H new ATOM 876 N GLY A 302 170.613 5.198 -13.510 1.00 0.00 N ATOM 877 CA GLY A 302 171.081 5.947 -12.364 1.00 0.00 C ATOM 878 C GLY A 302 170.436 5.434 -11.098 1.00 0.00 C ATOM 879 O GLY A 302 169.927 6.207 -10.289 1.00 0.00 O ATOM 0 H GLY A 302 170.862 4.209 -13.498 1.00 0.00 H new ATOM 0 HA2 GLY A 302 172.165 5.865 -12.286 1.00 0.00 H new ATOM 0 HA3 GLY A 302 170.850 7.004 -12.494 1.00 0.00 H new ATOM 883 N TRP A 303 170.435 4.112 -10.951 1.00 0.00 N ATOM 884 CA TRP A 303 169.826 3.461 -9.804 1.00 0.00 C ATOM 885 C TRP A 303 170.565 2.182 -9.430 1.00 0.00 C ATOM 886 O TRP A 303 171.391 1.680 -10.190 1.00 0.00 O ATOM 887 CB TRP A 303 168.378 3.110 -10.110 1.00 0.00 C ATOM 888 CG TRP A 303 167.479 4.283 -10.234 1.00 0.00 C ATOM 889 CD1 TRP A 303 167.419 5.147 -11.278 1.00 0.00 C ATOM 890 CD2 TRP A 303 166.493 4.706 -9.294 1.00 0.00 C ATOM 891 NE1 TRP A 303 166.456 6.096 -11.045 1.00 0.00 N ATOM 892 CE2 TRP A 303 165.871 5.844 -9.832 1.00 0.00 C ATOM 893 CE3 TRP A 303 166.077 4.231 -8.049 1.00 0.00 C ATOM 894 CZ2 TRP A 303 164.851 6.516 -9.169 1.00 0.00 C ATOM 895 CZ3 TRP A 303 165.064 4.898 -7.390 1.00 0.00 C ATOM 896 CH2 TRP A 303 164.460 6.029 -7.953 1.00 0.00 C ATOM 0 H TRP A 303 170.855 3.468 -11.622 1.00 0.00 H new ATOM 0 HA TRP A 303 169.880 4.159 -8.968 1.00 0.00 H new ATOM 0 HB2 TRP A 303 168.343 2.540 -11.039 1.00 0.00 H new ATOM 0 HB3 TRP A 303 168.000 2.459 -9.322 1.00 0.00 H new ATOM 0 HD1 TRP A 303 168.038 5.095 -12.162 1.00 0.00 H new ATOM 0 HE1 TRP A 303 166.215 6.863 -11.672 1.00 0.00 H new ATOM 0 HE3 TRP A 303 166.539 3.359 -7.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 303 164.385 7.390 -9.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 303 164.732 4.542 -6.426 1.00 0.00 H new ATOM 0 HH2 TRP A 303 163.668 6.528 -7.415 1.00 0.00 H new ATOM 907 N GLU A 304 170.229 1.645 -8.264 1.00 0.00 N ATOM 908 CA GLU A 304 170.816 0.401 -7.782 1.00 0.00 C ATOM 909 C GLU A 304 169.883 -0.238 -6.755 1.00 0.00 C ATOM 910 O GLU A 304 169.498 0.405 -5.779 1.00 0.00 O ATOM 911 CB GLU A 304 172.195 0.648 -7.166 1.00 0.00 C ATOM 912 CG GLU A 304 173.142 -0.534 -7.305 1.00 0.00 C ATOM 913 CD GLU A 304 174.595 -0.147 -7.104 1.00 0.00 C ATOM 914 OE1 GLU A 304 174.992 0.083 -5.943 1.00 0.00 O ATOM 915 OE2 GLU A 304 175.334 -0.077 -8.109 1.00 0.00 O ATOM 0 H GLU A 304 169.546 2.057 -7.629 1.00 0.00 H new ATOM 0 HA GLU A 304 170.944 -0.276 -8.627 1.00 0.00 H new ATOM 0 HB2 GLU A 304 172.644 1.521 -7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 304 172.075 0.885 -6.109 1.00 0.00 H new ATOM 0 HG2 GLU A 304 172.870 -1.299 -6.578 1.00 0.00 H new ATOM 0 HG3 GLU A 304 173.022 -0.976 -8.294 1.00 0.00 H new ATOM 922 N ILE A 305 169.518 -1.501 -6.968 1.00 0.00 N ATOM 923 CA ILE A 305 168.633 -2.192 -6.042 1.00 0.00 C ATOM 924 C ILE A 305 169.424 -2.969 -5.011 1.00 0.00 C ATOM 925 O ILE A 305 170.503 -3.486 -5.302 1.00 0.00 O ATOM 926 CB ILE A 305 167.691 -3.158 -6.775 1.00 0.00 C ATOM 927 CG1 ILE A 305 167.058 -2.438 -7.974 1.00 0.00 C ATOM 928 CG2 ILE A 305 166.642 -3.700 -5.805 1.00 0.00 C ATOM 929 CD1 ILE A 305 165.604 -2.769 -8.215 1.00 0.00 C ATOM 0 H ILE A 305 169.820 -2.059 -7.767 1.00 0.00 H new ATOM 0 HA ILE A 305 168.039 -1.425 -5.545 1.00 0.00 H new ATOM 0 HB ILE A 305 168.249 -4.013 -7.156 1.00 0.00 H new ATOM 0 HG12 ILE A 305 167.151 -1.362 -7.825 1.00 0.00 H new ATOM 0 HG13 ILE A 305 167.626 -2.686 -8.870 1.00 0.00 H new ATOM 0 HG21 ILE A 305 165.978 -4.384 -6.333 1.00 0.00 H new ATOM 0 HG22 ILE A 305 167.138 -4.230 -4.992 1.00 0.00 H new ATOM 0 HG23 ILE A 305 166.061 -2.873 -5.398 1.00 0.00 H new ATOM 0 HD11 ILE A 305 165.243 -2.214 -9.081 1.00 0.00 H new ATOM 0 HD12 ILE A 305 165.500 -3.838 -8.400 1.00 0.00 H new ATOM 0 HD13 ILE A 305 165.018 -2.494 -7.338 1.00 0.00 H new ATOM 941 N ARG A 306 168.882 -3.054 -3.806 1.00 0.00 N ATOM 942 CA ARG A 306 169.552 -3.776 -2.728 1.00 0.00 C ATOM 943 C ARG A 306 168.548 -4.351 -1.743 1.00 0.00 C ATOM 944 O ARG A 306 167.348 -4.130 -1.867 1.00 0.00 O ATOM 945 CB ARG A 306 170.535 -2.874 -1.972 1.00 0.00 C ATOM 946 CG ARG A 306 171.256 -1.856 -2.841 1.00 0.00 C ATOM 947 CD ARG A 306 172.693 -1.664 -2.390 1.00 0.00 C ATOM 948 NE ARG A 306 173.575 -2.692 -2.941 1.00 0.00 N ATOM 949 CZ ARG A 306 174.789 -2.450 -3.437 1.00 0.00 C ATOM 950 NH1 ARG A 306 175.288 -1.220 -3.437 1.00 0.00 N ATOM 951 NH2 ARG A 306 175.510 -3.448 -3.929 1.00 0.00 N ATOM 0 H ARG A 306 167.988 -2.637 -3.548 1.00 0.00 H new ATOM 0 HA ARG A 306 170.106 -4.591 -3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 306 169.993 -2.344 -1.189 1.00 0.00 H new ATOM 0 HB3 ARG A 306 171.277 -3.501 -1.478 1.00 0.00 H new ATOM 0 HG2 ARG A 306 171.240 -2.185 -3.880 1.00 0.00 H new ATOM 0 HG3 ARG A 306 170.730 -0.902 -2.801 1.00 0.00 H new ATOM 0 HD2 ARG A 306 173.043 -0.680 -2.700 1.00 0.00 H new ATOM 0 HD3 ARG A 306 172.739 -1.690 -1.301 1.00 0.00 H new ATOM 0 HE ARG A 306 173.240 -3.656 -2.946 1.00 0.00 H new ATOM 0 HH11 ARG A 306 174.742 -0.448 -3.055 1.00 0.00 H new ATOM 0 HH12 ARG A 306 176.218 -1.047 -3.819 1.00 0.00 H new ATOM 0 HH21 ARG A 306 175.136 -4.397 -3.927 1.00 0.00 H new ATOM 0 HH22 ARG A 306 176.439 -3.267 -4.309 1.00 0.00 H new ATOM 965 N ASN A 307 169.066 -5.059 -0.748 1.00 0.00 N ATOM 966 CA ASN A 307 168.242 -5.645 0.301 1.00 0.00 C ATOM 967 C ASN A 307 168.693 -5.118 1.651 1.00 0.00 C ATOM 968 O ASN A 307 169.890 -5.012 1.911 1.00 0.00 O ATOM 969 CB ASN A 307 168.336 -7.173 0.296 1.00 0.00 C ATOM 970 CG ASN A 307 167.872 -7.781 -1.013 1.00 0.00 C ATOM 971 OD1 ASN A 307 168.647 -8.422 -1.723 1.00 0.00 O ATOM 972 ND2 ASN A 307 166.599 -7.586 -1.337 1.00 0.00 N ATOM 0 H ASN A 307 170.064 -5.243 -0.645 1.00 0.00 H new ATOM 0 HA ASN A 307 167.205 -5.366 0.114 1.00 0.00 H new ATOM 0 HB2 ASN A 307 169.367 -7.471 0.485 1.00 0.00 H new ATOM 0 HB3 ASN A 307 167.734 -7.573 1.112 1.00 0.00 H new ATOM 0 HD21 ASN A 307 166.228 -7.974 -2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 307 165.992 -7.048 -0.719 1.00 0.00 H new ATOM 979 N THR A 308 167.742 -4.821 2.525 1.00 0.00 N ATOM 980 CA THR A 308 168.084 -4.348 3.856 1.00 0.00 C ATOM 981 C THR A 308 168.153 -5.547 4.789 1.00 0.00 C ATOM 982 O THR A 308 167.610 -6.603 4.468 1.00 0.00 O ATOM 983 CB THR A 308 167.078 -3.309 4.347 1.00 0.00 C ATOM 984 OG1 THR A 308 165.759 -3.805 4.254 1.00 0.00 O ATOM 985 CG2 THR A 308 167.151 -2.007 3.572 1.00 0.00 C ATOM 0 H THR A 308 166.742 -4.898 2.340 1.00 0.00 H new ATOM 0 HA THR A 308 169.054 -3.852 3.834 1.00 0.00 H new ATOM 0 HB THR A 308 167.341 -3.109 5.386 1.00 0.00 H new ATOM 0 HG1 THR A 308 165.292 -3.356 3.519 1.00 0.00 H new ATOM 0 HG21 THR A 308 166.413 -1.308 3.965 1.00 0.00 H new ATOM 0 HG22 THR A 308 168.148 -1.578 3.674 1.00 0.00 H new ATOM 0 HG23 THR A 308 166.944 -2.198 2.519 1.00 0.00 H new ATOM 993 N ALA A 309 168.848 -5.395 5.914 1.00 0.00 N ATOM 994 CA ALA A 309 169.041 -6.490 6.869 1.00 0.00 C ATOM 995 C ALA A 309 167.771 -7.295 7.134 1.00 0.00 C ATOM 996 O ALA A 309 167.824 -8.522 7.217 1.00 0.00 O ATOM 997 CB ALA A 309 169.579 -5.932 8.172 1.00 0.00 C ATOM 0 H ALA A 309 169.291 -4.519 6.190 1.00 0.00 H new ATOM 0 HA ALA A 309 169.756 -7.180 6.421 1.00 0.00 H new ATOM 0 HB1 ALA A 309 169.723 -6.745 8.884 1.00 0.00 H new ATOM 0 HB2 ALA A 309 170.532 -5.436 7.989 1.00 0.00 H new ATOM 0 HB3 ALA A 309 168.869 -5.213 8.581 1.00 0.00 H new ATOM 1003 N THR A 310 166.637 -6.626 7.247 1.00 0.00 N ATOM 1004 CA THR A 310 165.378 -7.332 7.479 1.00 0.00 C ATOM 1005 C THR A 310 164.932 -8.039 6.199 1.00 0.00 C ATOM 1006 O THR A 310 164.029 -8.875 6.213 1.00 0.00 O ATOM 1007 CB THR A 310 164.290 -6.368 7.968 1.00 0.00 C ATOM 1008 OG1 THR A 310 163.002 -6.927 7.775 1.00 0.00 O ATOM 1009 CG2 THR A 310 164.313 -5.022 7.276 1.00 0.00 C ATOM 0 H THR A 310 166.556 -5.611 7.184 1.00 0.00 H new ATOM 0 HA THR A 310 165.539 -8.078 8.257 1.00 0.00 H new ATOM 0 HB THR A 310 164.504 -6.213 9.026 1.00 0.00 H new ATOM 0 HG1 THR A 310 163.090 -7.863 7.499 1.00 0.00 H new ATOM 0 HG21 THR A 310 163.515 -4.395 7.674 1.00 0.00 H new ATOM 0 HG22 THR A 310 165.275 -4.540 7.450 1.00 0.00 H new ATOM 0 HG23 THR A 310 164.165 -5.161 6.205 1.00 0.00 H new ATOM 1017 N GLY A 311 165.577 -7.675 5.096 1.00 0.00 N ATOM 1018 CA GLY A 311 165.264 -8.243 3.803 1.00 0.00 C ATOM 1019 C GLY A 311 164.410 -7.304 2.989 1.00 0.00 C ATOM 1020 O GLY A 311 163.713 -7.722 2.064 1.00 0.00 O ATOM 0 H GLY A 311 166.325 -6.982 5.079 1.00 0.00 H new ATOM 0 HA2 GLY A 311 166.187 -8.459 3.265 1.00 0.00 H new ATOM 0 HA3 GLY A 311 164.743 -9.191 3.936 1.00 0.00 H new ATOM 1024 N ARG A 312 164.453 -6.027 3.353 1.00 0.00 N ATOM 1025 CA ARG A 312 163.658 -5.015 2.664 1.00 0.00 C ATOM 1026 C ARG A 312 164.459 -4.337 1.568 1.00 0.00 C ATOM 1027 O ARG A 312 165.325 -3.505 1.830 1.00 0.00 O ATOM 1028 CB ARG A 312 163.123 -3.978 3.656 1.00 0.00 C ATOM 1029 CG ARG A 312 161.635 -4.117 3.938 1.00 0.00 C ATOM 1030 CD ARG A 312 161.266 -3.550 5.300 1.00 0.00 C ATOM 1031 NE ARG A 312 160.317 -4.406 6.009 1.00 0.00 N ATOM 1032 CZ ARG A 312 159.378 -3.952 6.840 1.00 0.00 C ATOM 1033 NH1 ARG A 312 159.263 -2.652 7.083 1.00 0.00 N ATOM 1034 NH2 ARG A 312 158.553 -4.804 7.433 1.00 0.00 N ATOM 0 H ARG A 312 165.026 -5.669 4.117 1.00 0.00 H new ATOM 0 HA ARG A 312 162.811 -5.519 2.199 1.00 0.00 H new ATOM 0 HB2 ARG A 312 163.672 -4.067 4.593 1.00 0.00 H new ATOM 0 HB3 ARG A 312 163.319 -2.979 3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 312 161.068 -3.601 3.163 1.00 0.00 H new ATOM 0 HG3 ARG A 312 161.353 -5.169 3.893 1.00 0.00 H new ATOM 0 HD2 ARG A 312 162.168 -3.433 5.901 1.00 0.00 H new ATOM 0 HD3 ARG A 312 160.835 -2.557 5.175 1.00 0.00 H new ATOM 0 HE ARG A 312 160.377 -5.413 5.859 1.00 0.00 H new ATOM 0 HH11 ARG A 312 159.896 -1.991 6.633 1.00 0.00 H new ATOM 0 HH12 ARG A 312 158.542 -2.314 7.720 1.00 0.00 H new ATOM 0 HH21 ARG A 312 158.637 -5.804 7.253 1.00 0.00 H new ATOM 0 HH22 ARG A 312 157.834 -4.459 8.069 1.00 0.00 H new ATOM 1048 N VAL A 313 164.151 -4.709 0.336 1.00 0.00 N ATOM 1049 CA VAL A 313 164.812 -4.167 -0.826 1.00 0.00 C ATOM 1050 C VAL A 313 164.452 -2.704 -1.043 1.00 0.00 C ATOM 1051 O VAL A 313 163.314 -2.292 -0.820 1.00 0.00 O ATOM 1052 CB VAL A 313 164.409 -4.958 -2.080 1.00 0.00 C ATOM 1053 CG1 VAL A 313 162.901 -4.979 -2.222 1.00 0.00 C ATOM 1054 CG2 VAL A 313 165.034 -4.365 -3.316 1.00 0.00 C ATOM 0 H VAL A 313 163.431 -5.399 0.120 1.00 0.00 H new ATOM 0 HA VAL A 313 165.885 -4.246 -0.654 1.00 0.00 H new ATOM 0 HB VAL A 313 164.773 -5.979 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 313 162.627 -5.542 -3.114 1.00 0.00 H new ATOM 0 HG12 VAL A 313 162.459 -5.452 -1.345 1.00 0.00 H new ATOM 0 HG13 VAL A 313 162.530 -3.958 -2.309 1.00 0.00 H new ATOM 0 HG21 VAL A 313 164.733 -4.943 -4.189 1.00 0.00 H new ATOM 0 HG22 VAL A 313 164.702 -3.333 -3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 313 166.120 -4.389 -3.222 1.00 0.00 H new ATOM 1064 N TYR A 314 165.423 -1.936 -1.512 1.00 0.00 N ATOM 1065 CA TYR A 314 165.226 -0.527 -1.805 1.00 0.00 C ATOM 1066 C TYR A 314 165.887 -0.200 -3.145 1.00 0.00 C ATOM 1067 O TYR A 314 166.159 -1.105 -3.943 1.00 0.00 O ATOM 1068 CB TYR A 314 165.789 0.354 -0.680 1.00 0.00 C ATOM 1069 CG TYR A 314 167.282 0.224 -0.467 1.00 0.00 C ATOM 1070 CD1 TYR A 314 167.806 -0.822 0.282 1.00 0.00 C ATOM 1071 CD2 TYR A 314 168.166 1.153 -1.003 1.00 0.00 C ATOM 1072 CE1 TYR A 314 169.167 -0.939 0.490 1.00 0.00 C ATOM 1073 CE2 TYR A 314 169.529 1.042 -0.799 1.00 0.00 C ATOM 1074 CZ TYR A 314 170.024 -0.005 -0.053 1.00 0.00 C ATOM 1075 OH TYR A 314 171.381 -0.121 0.151 1.00 0.00 O ATOM 0 H TYR A 314 166.368 -2.272 -1.700 1.00 0.00 H new ATOM 0 HA TYR A 314 164.158 -0.318 -1.871 1.00 0.00 H new ATOM 0 HB2 TYR A 314 165.556 1.396 -0.901 1.00 0.00 H new ATOM 0 HB3 TYR A 314 165.279 0.103 0.250 1.00 0.00 H new ATOM 0 HD1 TYR A 314 167.139 -1.556 0.709 1.00 0.00 H new ATOM 0 HD2 TYR A 314 167.782 1.975 -1.589 1.00 0.00 H new ATOM 0 HE1 TYR A 314 169.558 -1.758 1.075 1.00 0.00 H new ATOM 0 HE2 TYR A 314 170.202 1.773 -1.222 1.00 0.00 H new ATOM 0 HH TYR A 314 171.844 0.616 -0.299 1.00 0.00 H new ATOM 1085 N PHE A 315 166.171 1.076 -3.382 1.00 0.00 N ATOM 1086 CA PHE A 315 166.813 1.497 -4.618 1.00 0.00 C ATOM 1087 C PHE A 315 167.658 2.741 -4.384 1.00 0.00 C ATOM 1088 O PHE A 315 167.310 3.600 -3.574 1.00 0.00 O ATOM 1089 CB PHE A 315 165.760 1.769 -5.695 1.00 0.00 C ATOM 1090 CG PHE A 315 164.588 0.835 -5.623 1.00 0.00 C ATOM 1091 CD1 PHE A 315 163.516 1.127 -4.801 1.00 0.00 C ATOM 1092 CD2 PHE A 315 164.563 -0.338 -6.361 1.00 0.00 C ATOM 1093 CE1 PHE A 315 162.441 0.271 -4.711 1.00 0.00 C ATOM 1094 CE2 PHE A 315 163.485 -1.199 -6.278 1.00 0.00 C ATOM 1095 CZ PHE A 315 162.423 -0.894 -5.450 1.00 0.00 C ATOM 0 H PHE A 315 165.966 1.836 -2.733 1.00 0.00 H new ATOM 0 HA PHE A 315 167.466 0.694 -4.959 1.00 0.00 H new ATOM 0 HB2 PHE A 315 165.406 2.795 -5.597 1.00 0.00 H new ATOM 0 HB3 PHE A 315 166.224 1.685 -6.678 1.00 0.00 H new ATOM 0 HD1 PHE A 315 163.521 2.038 -4.222 1.00 0.00 H new ATOM 0 HD2 PHE A 315 165.394 -0.581 -7.007 1.00 0.00 H new ATOM 0 HE1 PHE A 315 161.612 0.512 -4.062 1.00 0.00 H new ATOM 0 HE2 PHE A 315 163.473 -2.109 -6.860 1.00 0.00 H new ATOM 0 HZ PHE A 315 161.580 -1.566 -5.381 1.00 0.00 H new ATOM 1105 N VAL A 316 168.770 2.828 -5.096 1.00 0.00 N ATOM 1106 CA VAL A 316 169.670 3.962 -4.971 1.00 0.00 C ATOM 1107 C VAL A 316 169.703 4.769 -6.261 1.00 0.00 C ATOM 1108 O VAL A 316 170.276 4.330 -7.254 1.00 0.00 O ATOM 1109 CB VAL A 316 171.099 3.499 -4.627 1.00 0.00 C ATOM 1110 CG1 VAL A 316 172.045 4.686 -4.554 1.00 0.00 C ATOM 1111 CG2 VAL A 316 171.104 2.714 -3.322 1.00 0.00 C ATOM 0 H VAL A 316 169.071 2.123 -5.769 1.00 0.00 H new ATOM 0 HA VAL A 316 169.295 4.589 -4.162 1.00 0.00 H new ATOM 0 HB VAL A 316 171.450 2.840 -5.421 1.00 0.00 H new ATOM 0 HG11 VAL A 316 173.048 4.337 -4.310 1.00 0.00 H new ATOM 0 HG12 VAL A 316 172.063 5.197 -5.517 1.00 0.00 H new ATOM 0 HG13 VAL A 316 171.703 5.377 -3.783 1.00 0.00 H new ATOM 0 HG21 VAL A 316 172.121 2.394 -3.094 1.00 0.00 H new ATOM 0 HG22 VAL A 316 170.733 3.346 -2.516 1.00 0.00 H new ATOM 0 HG23 VAL A 316 170.462 1.839 -3.422 1.00 0.00 H new ATOM 1121 N ASP A 317 169.083 5.949 -6.237 1.00 0.00 N ATOM 1122 CA ASP A 317 169.038 6.820 -7.409 1.00 0.00 C ATOM 1123 C ASP A 317 170.178 7.832 -7.379 1.00 0.00 C ATOM 1124 O ASP A 317 170.236 8.691 -6.498 1.00 0.00 O ATOM 1125 CB ASP A 317 167.696 7.551 -7.476 1.00 0.00 C ATOM 1126 CG ASP A 317 167.485 8.265 -8.799 1.00 0.00 C ATOM 1127 OD1 ASP A 317 168.427 8.291 -9.619 1.00 0.00 O ATOM 1128 OD2 ASP A 317 166.376 8.799 -9.014 1.00 0.00 O ATOM 0 H ASP A 317 168.605 6.323 -5.417 1.00 0.00 H new ATOM 0 HA ASP A 317 169.151 6.198 -8.297 1.00 0.00 H new ATOM 0 HB2 ASP A 317 166.889 6.835 -7.321 1.00 0.00 H new ATOM 0 HB3 ASP A 317 167.640 8.275 -6.664 1.00 0.00 H new ATOM 1133 N HIS A 318 171.095 7.715 -8.334 1.00 0.00 N ATOM 1134 CA HIS A 318 172.246 8.608 -8.407 1.00 0.00 C ATOM 1135 C HIS A 318 171.908 9.937 -9.078 1.00 0.00 C ATOM 1136 O HIS A 318 172.756 10.826 -9.162 1.00 0.00 O ATOM 1137 CB HIS A 318 173.386 7.910 -9.143 1.00 0.00 C ATOM 1138 CG HIS A 318 173.720 6.589 -8.531 1.00 0.00 C ATOM 1139 ND1 HIS A 318 173.808 6.411 -7.170 1.00 0.00 N ATOM 1140 CD2 HIS A 318 173.942 5.374 -9.086 1.00 0.00 C ATOM 1141 CE1 HIS A 318 174.064 5.147 -6.907 1.00 0.00 C ATOM 1142 NE2 HIS A 318 174.152 4.493 -8.052 1.00 0.00 N ATOM 0 H HIS A 318 171.063 7.009 -9.070 1.00 0.00 H new ATOM 0 HA HIS A 318 172.554 8.841 -7.388 1.00 0.00 H new ATOM 0 HB2 HIS A 318 173.109 7.766 -10.187 1.00 0.00 H new ATOM 0 HB3 HIS A 318 174.269 8.548 -9.132 1.00 0.00 H new ATOM 0 HD2 HIS A 318 173.952 5.141 -10.141 1.00 0.00 H new ATOM 0 HE1 HIS A 318 174.182 4.717 -5.923 1.00 0.00 H new ATOM 0 HE2 HIS A 318 174.344 3.496 -8.152 1.00 0.00 H new ATOM 1151 N ASN A 319 170.669 10.085 -9.535 1.00 0.00 N ATOM 1152 CA ASN A 319 170.246 11.326 -10.168 1.00 0.00 C ATOM 1153 C ASN A 319 170.179 12.429 -9.123 1.00 0.00 C ATOM 1154 O ASN A 319 170.681 13.534 -9.329 1.00 0.00 O ATOM 1155 CB ASN A 319 168.884 11.150 -10.839 1.00 0.00 C ATOM 1156 CG ASN A 319 168.988 10.449 -12.178 1.00 0.00 C ATOM 1157 OD1 ASN A 319 169.037 11.092 -13.227 1.00 0.00 O ATOM 1158 ND2 ASN A 319 169.022 9.123 -12.148 1.00 0.00 N ATOM 0 H ASN A 319 169.947 9.367 -9.479 1.00 0.00 H new ATOM 0 HA ASN A 319 170.970 11.598 -10.936 1.00 0.00 H new ATOM 0 HB2 ASN A 319 168.229 10.578 -10.182 1.00 0.00 H new ATOM 0 HB3 ASN A 319 168.421 12.127 -10.978 1.00 0.00 H new ATOM 0 HD21 ASN A 319 169.091 8.595 -13.018 1.00 0.00 H new ATOM 0 HD22 ASN A 319 168.979 8.632 -11.255 1.00 0.00 H new ATOM 1165 N ASN A 320 169.571 12.103 -7.989 1.00 0.00 N ATOM 1166 CA ASN A 320 169.448 13.042 -6.881 1.00 0.00 C ATOM 1167 C ASN A 320 170.270 12.559 -5.686 1.00 0.00 C ATOM 1168 O ASN A 320 170.210 13.143 -4.602 1.00 0.00 O ATOM 1169 CB ASN A 320 167.979 13.219 -6.469 1.00 0.00 C ATOM 1170 CG ASN A 320 167.001 12.750 -7.532 1.00 0.00 C ATOM 1171 OD1 ASN A 320 166.634 13.506 -8.432 1.00 0.00 O ATOM 1172 ND2 ASN A 320 166.573 11.497 -7.431 1.00 0.00 N ATOM 0 H ASN A 320 169.153 11.190 -7.812 1.00 0.00 H new ATOM 0 HA ASN A 320 169.830 14.008 -7.212 1.00 0.00 H new ATOM 0 HB2 ASN A 320 167.797 12.666 -5.547 1.00 0.00 H new ATOM 0 HB3 ASN A 320 167.793 14.271 -6.252 1.00 0.00 H new ATOM 0 HD21 ASN A 320 165.914 11.126 -8.116 1.00 0.00 H new ATOM 0 HD22 ASN A 320 166.903 10.905 -6.669 1.00 0.00 H new ATOM 1179 N ARG A 321 171.040 11.485 -5.890 1.00 0.00 N ATOM 1180 CA ARG A 321 171.874 10.921 -4.832 1.00 0.00 C ATOM 1181 C ARG A 321 171.024 10.578 -3.612 1.00 0.00 C ATOM 1182 O ARG A 321 171.055 11.290 -2.608 1.00 0.00 O ATOM 1183 CB ARG A 321 172.998 11.899 -4.438 1.00 0.00 C ATOM 1184 CG ARG A 321 173.178 13.076 -5.391 1.00 0.00 C ATOM 1185 CD ARG A 321 174.639 13.489 -5.503 1.00 0.00 C ATOM 1186 NE ARG A 321 174.884 14.815 -4.938 1.00 0.00 N ATOM 1187 CZ ARG A 321 174.605 15.953 -5.569 1.00 0.00 C ATOM 1188 NH1 ARG A 321 174.060 15.934 -6.779 1.00 0.00 N ATOM 1189 NH2 ARG A 321 174.871 17.115 -4.986 1.00 0.00 N ATOM 0 H ARG A 321 171.101 10.991 -6.780 1.00 0.00 H new ATOM 0 HA ARG A 321 172.332 10.007 -5.212 1.00 0.00 H new ATOM 0 HB2 ARG A 321 172.792 12.285 -3.440 1.00 0.00 H new ATOM 0 HB3 ARG A 321 173.937 11.348 -4.380 1.00 0.00 H new ATOM 0 HG2 ARG A 321 172.799 12.808 -6.377 1.00 0.00 H new ATOM 0 HG3 ARG A 321 172.586 13.922 -5.041 1.00 0.00 H new ATOM 0 HD2 ARG A 321 175.262 12.757 -4.990 1.00 0.00 H new ATOM 0 HD3 ARG A 321 174.937 13.482 -6.551 1.00 0.00 H new ATOM 0 HE ARG A 321 175.293 14.871 -4.005 1.00 0.00 H new ATOM 0 HH11 ARG A 321 173.852 15.043 -7.231 1.00 0.00 H new ATOM 0 HH12 ARG A 321 173.849 16.810 -7.257 1.00 0.00 H new ATOM 0 HH21 ARG A 321 175.289 17.135 -4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 321 174.658 17.988 -5.468 1.00 0.00 H new ATOM 1203 N THR A 322 170.242 9.501 -3.705 1.00 0.00 N ATOM 1204 CA THR A 322 169.372 9.115 -2.598 1.00 0.00 C ATOM 1205 C THR A 322 169.007 7.631 -2.618 1.00 0.00 C ATOM 1206 O THR A 322 169.269 6.919 -3.587 1.00 0.00 O ATOM 1207 CB THR A 322 168.088 9.939 -2.645 1.00 0.00 C ATOM 1208 OG1 THR A 322 167.315 9.594 -3.782 1.00 0.00 O ATOM 1209 CG2 THR A 322 168.330 11.432 -2.692 1.00 0.00 C ATOM 0 H THR A 322 170.194 8.891 -4.521 1.00 0.00 H new ATOM 0 HA THR A 322 169.926 9.306 -1.679 1.00 0.00 H new ATOM 0 HB THR A 322 167.562 9.704 -1.719 1.00 0.00 H new ATOM 0 HG1 THR A 322 166.580 10.234 -3.884 1.00 0.00 H new ATOM 0 HG21 THR A 322 167.374 11.955 -2.724 1.00 0.00 H new ATOM 0 HG22 THR A 322 168.882 11.739 -1.804 1.00 0.00 H new ATOM 0 HG23 THR A 322 168.908 11.679 -3.582 1.00 0.00 H new ATOM 1217 N THR A 323 168.348 7.199 -1.542 1.00 0.00 N ATOM 1218 CA THR A 323 167.869 5.826 -1.405 1.00 0.00 C ATOM 1219 C THR A 323 166.351 5.875 -1.285 1.00 0.00 C ATOM 1220 O THR A 323 165.829 6.666 -0.501 1.00 0.00 O ATOM 1221 CB THR A 323 168.461 5.172 -0.148 1.00 0.00 C ATOM 1222 OG1 THR A 323 168.564 6.115 0.905 1.00 0.00 O ATOM 1223 CG2 THR A 323 169.836 4.575 -0.351 1.00 0.00 C ATOM 0 H THR A 323 168.132 7.793 -0.741 1.00 0.00 H new ATOM 0 HA THR A 323 168.174 5.238 -2.270 1.00 0.00 H new ATOM 0 HB THR A 323 167.770 4.365 0.095 1.00 0.00 H new ATOM 0 HG1 THR A 323 169.093 5.732 1.636 1.00 0.00 H new ATOM 0 HG21 THR A 323 170.183 4.134 0.583 1.00 0.00 H new ATOM 0 HG22 THR A 323 169.788 3.805 -1.121 1.00 0.00 H new ATOM 0 HG23 THR A 323 170.529 5.356 -0.662 1.00 0.00 H new ATOM 1231 N GLN A 324 165.630 5.082 -2.074 1.00 0.00 N ATOM 1232 CA GLN A 324 164.175 5.139 -2.027 1.00 0.00 C ATOM 1233 C GLN A 324 163.522 3.787 -1.788 1.00 0.00 C ATOM 1234 O GLN A 324 163.985 2.750 -2.261 1.00 0.00 O ATOM 1235 CB GLN A 324 163.640 5.750 -3.322 1.00 0.00 C ATOM 1236 CG GLN A 324 163.224 7.204 -3.176 1.00 0.00 C ATOM 1237 CD GLN A 324 161.961 7.528 -3.950 1.00 0.00 C ATOM 1238 OE1 GLN A 324 160.850 7.339 -3.454 1.00 0.00 O ATOM 1239 NE2 GLN A 324 162.124 8.018 -5.174 1.00 0.00 N ATOM 0 H GLN A 324 166.018 4.410 -2.736 1.00 0.00 H new ATOM 0 HA GLN A 324 163.916 5.764 -1.173 1.00 0.00 H new ATOM 0 HB2 GLN A 324 164.406 5.675 -4.094 1.00 0.00 H new ATOM 0 HB3 GLN A 324 162.784 5.167 -3.664 1.00 0.00 H new ATOM 0 HG2 GLN A 324 163.067 7.429 -2.121 1.00 0.00 H new ATOM 0 HG3 GLN A 324 164.033 7.847 -3.523 1.00 0.00 H new ATOM 0 HE21 GLN A 324 163.063 8.159 -5.546 1.00 0.00 H new ATOM 0 HE22 GLN A 324 161.310 8.253 -5.742 1.00 0.00 H new ATOM 1248 N PHE A 325 162.423 3.838 -1.049 1.00 0.00 N ATOM 1249 CA PHE A 325 161.639 2.656 -0.722 1.00 0.00 C ATOM 1250 C PHE A 325 160.741 2.291 -1.894 1.00 0.00 C ATOM 1251 O PHE A 325 160.669 1.134 -2.302 1.00 0.00 O ATOM 1252 CB PHE A 325 160.778 2.928 0.515 1.00 0.00 C ATOM 1253 CG PHE A 325 160.988 1.972 1.656 1.00 0.00 C ATOM 1254 CD1 PHE A 325 161.586 0.733 1.462 1.00 0.00 C ATOM 1255 CD2 PHE A 325 160.578 2.322 2.930 1.00 0.00 C ATOM 1256 CE1 PHE A 325 161.773 -0.136 2.518 1.00 0.00 C ATOM 1257 CE2 PHE A 325 160.761 1.457 3.992 1.00 0.00 C ATOM 1258 CZ PHE A 325 161.360 0.227 3.787 1.00 0.00 C ATOM 0 H PHE A 325 162.049 4.703 -0.658 1.00 0.00 H new ATOM 0 HA PHE A 325 162.317 1.828 -0.515 1.00 0.00 H new ATOM 0 HB2 PHE A 325 160.982 3.940 0.866 1.00 0.00 H new ATOM 0 HB3 PHE A 325 159.728 2.897 0.223 1.00 0.00 H new ATOM 0 HD1 PHE A 325 161.909 0.446 0.472 1.00 0.00 H new ATOM 0 HD2 PHE A 325 160.110 3.281 3.096 1.00 0.00 H new ATOM 0 HE1 PHE A 325 162.240 -1.096 2.354 1.00 0.00 H new ATOM 0 HE2 PHE A 325 160.436 1.741 4.982 1.00 0.00 H new ATOM 0 HZ PHE A 325 161.505 -0.449 4.617 1.00 0.00 H new ATOM 1268 N THR A 326 160.055 3.297 -2.427 1.00 0.00 N ATOM 1269 CA THR A 326 159.158 3.103 -3.555 1.00 0.00 C ATOM 1270 C THR A 326 159.944 3.175 -4.863 1.00 0.00 C ATOM 1271 O THR A 326 160.825 4.019 -5.025 1.00 0.00 O ATOM 1272 CB THR A 326 158.039 4.150 -3.526 1.00 0.00 C ATOM 1273 OG1 THR A 326 157.417 4.181 -2.252 1.00 0.00 O ATOM 1274 CG2 THR A 326 156.956 3.908 -4.555 1.00 0.00 C ATOM 0 H THR A 326 160.106 4.259 -2.092 1.00 0.00 H new ATOM 0 HA THR A 326 158.700 2.117 -3.485 1.00 0.00 H new ATOM 0 HB THR A 326 158.528 5.097 -3.756 1.00 0.00 H new ATOM 0 HG1 THR A 326 156.449 4.290 -2.363 1.00 0.00 H new ATOM 0 HG21 THR A 326 156.198 4.688 -4.476 1.00 0.00 H new ATOM 0 HG22 THR A 326 157.392 3.926 -5.554 1.00 0.00 H new ATOM 0 HG23 THR A 326 156.496 2.936 -4.378 1.00 0.00 H new ATOM 1282 N ASP A 327 159.635 2.267 -5.780 1.00 0.00 N ATOM 1283 CA ASP A 327 160.320 2.197 -7.066 1.00 0.00 C ATOM 1284 C ASP A 327 160.032 3.418 -7.939 1.00 0.00 C ATOM 1285 O ASP A 327 159.076 4.157 -7.706 1.00 0.00 O ATOM 1286 CB ASP A 327 159.910 0.922 -7.805 1.00 0.00 C ATOM 1287 CG ASP A 327 161.034 -0.091 -7.888 1.00 0.00 C ATOM 1288 OD1 ASP A 327 162.184 0.315 -8.155 1.00 0.00 O ATOM 1289 OD2 ASP A 327 160.764 -1.294 -7.684 1.00 0.00 O ATOM 0 H ASP A 327 158.908 1.563 -5.656 1.00 0.00 H new ATOM 0 HA ASP A 327 161.391 2.182 -6.866 1.00 0.00 H new ATOM 0 HB2 ASP A 327 159.057 0.471 -7.298 1.00 0.00 H new ATOM 0 HB3 ASP A 327 159.583 1.180 -8.812 1.00 0.00 H new ATOM 1294 N PRO A 328 160.874 3.636 -8.965 1.00 0.00 N ATOM 1295 CA PRO A 328 160.736 4.762 -9.895 1.00 0.00 C ATOM 1296 C PRO A 328 159.473 4.667 -10.750 1.00 0.00 C ATOM 1297 O PRO A 328 158.928 5.683 -11.181 1.00 0.00 O ATOM 1298 CB PRO A 328 161.978 4.653 -10.792 1.00 0.00 C ATOM 1299 CG PRO A 328 162.906 3.733 -10.076 1.00 0.00 C ATOM 1300 CD PRO A 328 162.036 2.798 -9.297 1.00 0.00 C ATOM 0 HA PRO A 328 160.656 5.708 -9.360 1.00 0.00 H new ATOM 0 HB2 PRO A 328 161.719 4.262 -11.776 1.00 0.00 H new ATOM 0 HB3 PRO A 328 162.436 5.630 -10.948 1.00 0.00 H new ATOM 0 HG2 PRO A 328 163.535 3.187 -10.779 1.00 0.00 H new ATOM 0 HG3 PRO A 328 163.573 4.287 -9.416 1.00 0.00 H new ATOM 0 HD2 PRO A 328 161.751 1.926 -9.885 1.00 0.00 H new ATOM 0 HD3 PRO A 328 162.538 2.429 -8.402 1.00 0.00 H new ATOM 1308 N ARG A 329 159.007 3.442 -10.979 1.00 0.00 N ATOM 1309 CA ARG A 329 157.800 3.209 -11.769 1.00 0.00 C ATOM 1310 C ARG A 329 156.575 2.945 -10.895 1.00 0.00 C ATOM 1311 O ARG A 329 155.441 3.143 -11.331 1.00 0.00 O ATOM 1312 CB ARG A 329 158.008 2.031 -12.711 1.00 0.00 C ATOM 1313 CG ARG A 329 158.518 0.800 -12.000 1.00 0.00 C ATOM 1314 CD ARG A 329 160.031 0.713 -12.066 1.00 0.00 C ATOM 1315 NE ARG A 329 160.486 0.138 -13.331 1.00 0.00 N ATOM 1316 CZ ARG A 329 160.861 0.858 -14.388 1.00 0.00 C ATOM 1317 NH1 ARG A 329 160.886 2.184 -14.330 1.00 0.00 N ATOM 1318 NH2 ARG A 329 161.218 0.248 -15.509 1.00 0.00 N ATOM 0 H ARG A 329 159.448 2.592 -10.627 1.00 0.00 H new ATOM 0 HA ARG A 329 157.614 4.119 -12.340 1.00 0.00 H new ATOM 0 HB2 ARG A 329 157.066 1.796 -13.206 1.00 0.00 H new ATOM 0 HB3 ARG A 329 158.715 2.315 -13.490 1.00 0.00 H new ATOM 0 HG2 ARG A 329 158.198 0.820 -10.958 1.00 0.00 H new ATOM 0 HG3 ARG A 329 158.080 -0.091 -12.451 1.00 0.00 H new ATOM 0 HD2 ARG A 329 160.458 1.708 -11.944 1.00 0.00 H new ATOM 0 HD3 ARG A 329 160.397 0.106 -11.238 1.00 0.00 H new ATOM 0 HE ARG A 329 160.518 -0.878 -13.409 1.00 0.00 H new ATOM 0 HH11 ARG A 329 160.616 2.662 -13.470 1.00 0.00 H new ATOM 0 HH12 ARG A 329 161.175 2.725 -15.145 1.00 0.00 H new ATOM 0 HH21 ARG A 329 161.205 -0.771 -15.562 1.00 0.00 H new ATOM 0 HH22 ARG A 329 161.505 0.797 -16.319 1.00 0.00 H new ATOM 1332 N LEU A 330 156.804 2.461 -9.675 1.00 0.00 N ATOM 1333 CA LEU A 330 155.709 2.129 -8.768 1.00 0.00 C ATOM 1334 C LEU A 330 154.697 3.263 -8.673 1.00 0.00 C ATOM 1335 O LEU A 330 153.558 3.138 -9.123 1.00 0.00 O ATOM 1336 CB LEU A 330 156.267 1.824 -7.383 1.00 0.00 C ATOM 1337 CG LEU A 330 156.321 0.344 -7.018 1.00 0.00 C ATOM 1338 CD1 LEU A 330 156.981 -0.460 -8.134 1.00 0.00 C ATOM 1339 CD2 LEU A 330 157.065 0.168 -5.704 1.00 0.00 C ATOM 0 H LEU A 330 157.735 2.291 -9.294 1.00 0.00 H new ATOM 0 HA LEU A 330 155.196 1.253 -9.165 1.00 0.00 H new ATOM 0 HB2 LEU A 330 157.274 2.236 -7.315 1.00 0.00 H new ATOM 0 HB3 LEU A 330 155.660 2.343 -6.641 1.00 0.00 H new ATOM 0 HG LEU A 330 155.305 -0.031 -6.896 1.00 0.00 H new ATOM 0 HD11 LEU A 330 157.010 -1.513 -7.855 1.00 0.00 H new ATOM 0 HD12 LEU A 330 156.408 -0.344 -9.054 1.00 0.00 H new ATOM 0 HD13 LEU A 330 157.997 -0.098 -8.291 1.00 0.00 H new ATOM 0 HD21 LEU A 330 157.102 -0.890 -5.446 1.00 0.00 H new ATOM 0 HD22 LEU A 330 158.080 0.552 -5.806 1.00 0.00 H new ATOM 0 HD23 LEU A 330 156.547 0.716 -4.917 1.00 0.00 H new ATOM 1351 N SER A 331 155.133 4.368 -8.082 1.00 0.00 N ATOM 1352 CA SER A 331 154.288 5.552 -7.911 1.00 0.00 C ATOM 1353 C SER A 331 153.418 5.806 -9.142 1.00 0.00 C ATOM 1354 O SER A 331 152.296 6.299 -9.028 1.00 0.00 O ATOM 1355 CB SER A 331 155.154 6.780 -7.627 1.00 0.00 C ATOM 1356 OG SER A 331 154.368 7.859 -7.153 1.00 0.00 O ATOM 0 H SER A 331 156.076 4.473 -7.708 1.00 0.00 H new ATOM 0 HA SER A 331 153.628 5.367 -7.064 1.00 0.00 H new ATOM 0 HB2 SER A 331 155.916 6.529 -6.889 1.00 0.00 H new ATOM 0 HB3 SER A 331 155.677 7.078 -8.536 1.00 0.00 H new ATOM 0 HG SER A 331 154.945 8.632 -6.977 1.00 0.00 H new ATOM 1497 N SER B 206 163.235 3.126 10.946 1.00 0.00 N ATOM 1498 CA SER B 206 164.024 3.740 9.880 1.00 0.00 C ATOM 1499 C SER B 206 164.703 2.664 9.026 1.00 0.00 C ATOM 1500 O SER B 206 165.849 2.287 9.269 1.00 0.00 O ATOM 1501 CB SER B 206 165.076 4.677 10.479 1.00 0.00 C ATOM 1502 OG SER B 206 165.213 5.855 9.704 1.00 0.00 O ATOM 0 HA SER B 206 163.355 4.318 9.242 1.00 0.00 H new ATOM 0 HB2 SER B 206 164.794 4.940 11.499 1.00 0.00 H new ATOM 0 HB3 SER B 206 166.035 4.162 10.536 1.00 0.00 H new ATOM 0 HG SER B 206 165.890 6.436 10.109 1.00 0.00 H new ATOM 1508 N PRO B 207 163.965 2.134 8.033 1.00 0.00 N ATOM 1509 CA PRO B 207 164.429 1.062 7.135 1.00 0.00 C ATOM 1510 C PRO B 207 165.473 1.477 6.071 1.00 0.00 C ATOM 1511 O PRO B 207 166.640 1.109 6.198 1.00 0.00 O ATOM 1512 CB PRO B 207 163.131 0.579 6.470 1.00 0.00 C ATOM 1513 CG PRO B 207 162.033 1.168 7.281 1.00 0.00 C ATOM 1514 CD PRO B 207 162.571 2.475 7.759 1.00 0.00 C ATOM 0 HA PRO B 207 164.968 0.304 7.703 1.00 0.00 H new ATOM 0 HB2 PRO B 207 163.074 0.908 5.433 1.00 0.00 H new ATOM 0 HB3 PRO B 207 163.074 -0.509 6.462 1.00 0.00 H new ATOM 0 HG2 PRO B 207 161.131 1.306 6.685 1.00 0.00 H new ATOM 0 HG3 PRO B 207 161.767 0.520 8.116 1.00 0.00 H new ATOM 0 HD2 PRO B 207 162.481 3.256 7.004 1.00 0.00 H new ATOM 0 HD3 PRO B 207 162.053 2.831 8.650 1.00 0.00 H new ATOM 1522 N PRO B 208 165.095 2.210 4.983 1.00 0.00 N ATOM 1523 CA PRO B 208 166.053 2.586 3.930 1.00 0.00 C ATOM 1524 C PRO B 208 167.269 3.337 4.462 1.00 0.00 C ATOM 1525 O PRO B 208 167.162 4.489 4.875 1.00 0.00 O ATOM 1526 CB PRO B 208 165.241 3.488 2.984 1.00 0.00 C ATOM 1527 CG PRO B 208 164.022 3.862 3.749 1.00 0.00 C ATOM 1528 CD PRO B 208 163.744 2.703 4.660 1.00 0.00 C ATOM 0 HA PRO B 208 166.463 1.700 3.446 1.00 0.00 H new ATOM 0 HB2 PRO B 208 165.811 4.371 2.697 1.00 0.00 H new ATOM 0 HB3 PRO B 208 164.983 2.962 2.065 1.00 0.00 H new ATOM 0 HG2 PRO B 208 164.182 4.778 4.318 1.00 0.00 H new ATOM 0 HG3 PRO B 208 163.181 4.045 3.080 1.00 0.00 H new ATOM 0 HD2 PRO B 208 163.202 3.012 5.554 1.00 0.00 H new ATOM 0 HD3 PRO B 208 163.141 1.939 4.170 1.00 0.00 H new ATOM 1536 N PRO B 209 168.454 2.698 4.442 1.00 0.00 N ATOM 1537 CA PRO B 209 169.689 3.329 4.912 1.00 0.00 C ATOM 1538 C PRO B 209 170.110 4.486 4.008 1.00 0.00 C ATOM 1539 O PRO B 209 170.229 4.315 2.795 1.00 0.00 O ATOM 1540 CB PRO B 209 170.720 2.198 4.851 1.00 0.00 C ATOM 1541 CG PRO B 209 170.182 1.245 3.840 1.00 0.00 C ATOM 1542 CD PRO B 209 168.685 1.327 3.948 1.00 0.00 C ATOM 0 HA PRO B 209 169.579 3.759 5.907 1.00 0.00 H new ATOM 0 HB2 PRO B 209 171.701 2.573 4.558 1.00 0.00 H new ATOM 0 HB3 PRO B 209 170.839 1.718 5.823 1.00 0.00 H new ATOM 0 HG2 PRO B 209 170.516 1.511 2.837 1.00 0.00 H new ATOM 0 HG3 PRO B 209 170.532 0.231 4.034 1.00 0.00 H new ATOM 0 HD2 PRO B 209 168.203 1.160 2.985 1.00 0.00 H new ATOM 0 HD3 PRO B 209 168.290 0.580 4.636 1.00 0.00 H new ATOM 1550 N PRO B 210 170.324 5.687 4.585 1.00 0.00 N ATOM 1551 CA PRO B 210 170.718 6.885 3.841 1.00 0.00 C ATOM 1552 C PRO B 210 171.592 6.608 2.616 1.00 0.00 C ATOM 1553 O PRO B 210 172.215 5.554 2.496 1.00 0.00 O ATOM 1554 CB PRO B 210 171.486 7.671 4.887 1.00 0.00 C ATOM 1555 CG PRO B 210 170.799 7.358 6.176 1.00 0.00 C ATOM 1556 CD PRO B 210 170.178 5.986 6.024 1.00 0.00 C ATOM 0 HA PRO B 210 169.855 7.399 3.417 1.00 0.00 H new ATOM 0 HB2 PRO B 210 172.534 7.374 4.915 1.00 0.00 H new ATOM 0 HB3 PRO B 210 171.463 8.740 4.675 1.00 0.00 H new ATOM 0 HG2 PRO B 210 171.508 7.371 7.004 1.00 0.00 H new ATOM 0 HG3 PRO B 210 170.036 8.104 6.398 1.00 0.00 H new ATOM 0 HD2 PRO B 210 170.689 5.246 6.640 1.00 0.00 H new ATOM 0 HD3 PRO B 210 169.131 5.985 6.328 1.00 0.00 H new ATOM 1564 N TYR B 211 171.598 7.571 1.699 1.00 0.00 N ATOM 1565 CA TYR B 211 172.343 7.468 0.451 1.00 0.00 C ATOM 1566 C TYR B 211 173.859 7.515 0.632 1.00 0.00 C ATOM 1567 O TYR B 211 174.384 8.219 1.494 1.00 0.00 O ATOM 1568 CB TYR B 211 171.922 8.581 -0.498 1.00 0.00 C ATOM 1569 CG TYR B 211 172.718 8.613 -1.782 1.00 0.00 C ATOM 1570 CD1 TYR B 211 172.347 7.838 -2.870 1.00 0.00 C ATOM 1571 CD2 TYR B 211 173.845 9.415 -1.899 1.00 0.00 C ATOM 1572 CE1 TYR B 211 173.075 7.861 -4.043 1.00 0.00 C ATOM 1573 CE2 TYR B 211 174.580 9.445 -3.068 1.00 0.00 C ATOM 1574 CZ TYR B 211 174.191 8.667 -4.138 1.00 0.00 C ATOM 1575 OH TYR B 211 174.919 8.694 -5.307 1.00 0.00 O ATOM 0 H TYR B 211 171.085 8.446 1.802 1.00 0.00 H new ATOM 0 HA TYR B 211 172.102 6.489 0.038 1.00 0.00 H new ATOM 0 HB2 TYR B 211 170.865 8.462 -0.738 1.00 0.00 H new ATOM 0 HB3 TYR B 211 172.028 9.540 0.010 1.00 0.00 H new ATOM 0 HD1 TYR B 211 171.474 7.206 -2.799 1.00 0.00 H new ATOM 0 HD2 TYR B 211 174.152 10.025 -1.063 1.00 0.00 H new ATOM 0 HE1 TYR B 211 172.773 7.251 -4.882 1.00 0.00 H new ATOM 0 HE2 TYR B 211 175.454 10.074 -3.144 1.00 0.00 H new ATOM 0 HH TYR B 211 174.596 7.992 -5.910 1.00 0.00 H new ATOM 1585 N SER B 212 174.542 6.760 -0.226 1.00 0.00 N ATOM 1586 CA SER B 212 176.001 6.687 -0.230 1.00 0.00 C ATOM 1587 C SER B 212 176.480 5.580 -1.167 1.00 0.00 C ATOM 1588 O SER B 212 177.513 4.955 -0.925 1.00 0.00 O ATOM 1589 CB SER B 212 176.529 6.442 1.187 1.00 0.00 C ATOM 1590 OG SER B 212 177.297 7.543 1.642 1.00 0.00 O ATOM 0 H SER B 212 174.098 6.181 -0.939 1.00 0.00 H new ATOM 0 HA SER B 212 176.390 7.640 -0.589 1.00 0.00 H new ATOM 0 HB2 SER B 212 175.693 6.272 1.866 1.00 0.00 H new ATOM 0 HB3 SER B 212 177.139 5.539 1.200 1.00 0.00 H new ATOM 0 HG SER B 212 176.706 8.306 1.814 1.00 0.00 H new