USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 745 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 340 TYR OH : rot 22:sc= 1.15 USER MOD Set 1.2: A 379 HIS : no HD1:sc= 0.797 K(o=1.9,f=-2.6) USER MOD Single : A 342 TYR OH : rot 180:sc= 0 USER MOD Single : A 343 GLN : amide:sc= 1.02 K(o=1,f=-0.99) USER MOD Single : A 346 SER OG : rot 70:sc= 1.23 USER MOD Single : A 348 SER OG : rot -28:sc= 1.24 USER MOD Single : A 350 TYR OH : rot 69:sc= 1.12 USER MOD Single : A 352 ASN : amide:sc= 0.89 K(o=0.89,f=-7!) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 78:sc= 1.27 USER MOD Single : A 362 LYS NZ :NH3+ 177:sc= 0.155 (180deg=0.153) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 378 ASN : amide:sc= 1.22 K(o=1.2,f=-0.013) USER MOD Single : A 380 LYS NZ :NH3+ -164:sc= -1.56! (180deg=-2.24!) USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=0.094) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= -1.54! C(o=-1.5!,f=-4.9!) USER MOD Single : A 385 MET CE :methyl -117:sc=-0.00771 (180deg=-3.25!) USER MOD Single : A 386 THR OG1 : rot 180:sc= -0.159 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ 160:sc= 1.28 (180deg=1.03) USER MOD Single : A 390 MET CE :methyl -170:sc= -2.11! (180deg=-2.27) USER MOD Single : A 391 SER OG : rot 66:sc= 1.2 USER MOD Single : A 396 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 397 TYR OH : rot -144:sc= 0.143 USER MOD Single : A 398 TYR OH : rot -23:sc= 0.641 USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 401 ASN : amide:sc= -1.03 K(o=-1,f=-0.0057) USER MOD Single : A 405 LYS NZ :NH3+ -174:sc= 1.25 (180deg=1.17) USER MOD Single : A 409 GLN : amide:sc= -0.0427 X(o=-0.043,f=-0.28) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0.484 (180deg=0.484) USER MOD ----------------------------------------------------------------- ATOM 139 N ARG A 335 0.914 21.476 -4.149 1.00 64.15 N ATOM 140 CA ARG A 335 1.901 22.436 -3.682 1.00 42.21 C ATOM 141 C ARG A 335 1.565 22.859 -2.257 1.00 63.53 C ATOM 142 O ARG A 335 0.395 22.937 -1.892 1.00 64.20 O ATOM 143 CB ARG A 335 1.988 23.659 -4.618 1.00 3.20 C ATOM 144 CG ARG A 335 0.652 24.337 -4.922 1.00 35.02 C ATOM 145 CD ARG A 335 -0.128 23.613 -6.017 1.00 41.23 C ATOM 146 NE ARG A 335 0.500 23.748 -7.331 1.00 12.20 N ATOM 147 CZ ARG A 335 0.549 22.777 -8.246 1.00 61.33 C ATOM 148 NH1 ARG A 335 0.068 21.571 -7.971 1.00 42.31 N ATOM 149 NH2 ARG A 335 1.082 23.021 -9.437 1.00 1.31 N ATOM 0 HA ARG A 335 2.881 21.959 -3.690 1.00 42.21 H new ATOM 0 HB2 ARG A 335 2.657 24.393 -4.170 1.00 3.20 H new ATOM 0 HB3 ARG A 335 2.442 23.346 -5.558 1.00 3.20 H new ATOM 0 HG2 ARG A 335 0.050 24.374 -4.014 1.00 35.02 H new ATOM 0 HG3 ARG A 335 0.831 25.368 -5.227 1.00 35.02 H new ATOM 0 HD2 ARG A 335 -0.209 22.556 -5.763 1.00 41.23 H new ATOM 0 HD3 ARG A 335 -1.142 24.010 -6.060 1.00 41.23 H new ATOM 0 HE ARG A 335 0.929 24.644 -7.564 1.00 12.20 H new ATOM 0 HH11 ARG A 335 -0.342 21.382 -7.056 1.00 42.31 H new ATOM 0 HH12 ARG A 335 0.108 20.833 -8.674 1.00 42.31 H new ATOM 0 HH21 ARG A 335 1.452 23.947 -9.650 1.00 1.31 H new ATOM 0 HH22 ARG A 335 1.122 22.282 -10.139 1.00 1.31 H new ATOM 163 N LEU A 336 2.591 23.160 -1.468 1.00 11.13 N ATOM 164 CA LEU A 336 2.438 23.379 -0.024 1.00 70.11 C ATOM 165 C LEU A 336 1.621 24.640 0.289 1.00 64.42 C ATOM 166 O LEU A 336 1.355 24.951 1.451 1.00 14.11 O ATOM 167 CB LEU A 336 3.823 23.471 0.627 1.00 10.34 C ATOM 168 CG LEU A 336 3.836 23.511 2.158 1.00 60.01 C ATOM 169 CD1 LEU A 336 3.236 22.236 2.733 1.00 75.31 C ATOM 170 CD2 LEU A 336 5.254 23.711 2.670 1.00 54.05 C ATOM 0 H LEU A 336 3.549 23.260 -1.804 1.00 11.13 H new ATOM 0 HA LEU A 336 1.888 22.532 0.386 1.00 70.11 H new ATOM 0 HB2 LEU A 336 4.416 22.617 0.299 1.00 10.34 H new ATOM 0 HB3 LEU A 336 4.321 24.366 0.254 1.00 10.34 H new ATOM 0 HG LEU A 336 3.227 24.353 2.486 1.00 60.01 H new ATOM 0 HD11 LEU A 336 3.254 22.284 3.822 1.00 75.31 H new ATOM 0 HD12 LEU A 336 2.206 22.133 2.392 1.00 75.31 H new ATOM 0 HD13 LEU A 336 3.817 21.377 2.398 1.00 75.31 H new ATOM 0 HD21 LEU A 336 5.247 23.737 3.760 1.00 54.05 H new ATOM 0 HD22 LEU A 336 5.883 22.888 2.331 1.00 54.05 H new ATOM 0 HD23 LEU A 336 5.650 24.652 2.287 1.00 54.05 H new ATOM 182 N LEU A 337 1.209 25.345 -0.752 1.00 45.30 N ATOM 183 CA LEU A 337 0.443 26.572 -0.603 1.00 61.52 C ATOM 184 C LEU A 337 -0.835 26.349 0.206 1.00 52.21 C ATOM 185 O LEU A 337 -1.192 27.179 1.041 1.00 23.15 O ATOM 186 CB LEU A 337 0.090 27.133 -1.979 1.00 64.43 C ATOM 187 CG LEU A 337 -0.698 28.445 -1.965 1.00 32.31 C ATOM 188 CD1 LEU A 337 0.138 29.567 -1.369 1.00 14.33 C ATOM 189 CD2 LEU A 337 -1.159 28.807 -3.368 1.00 4.40 C ATOM 0 H LEU A 337 1.395 25.084 -1.720 1.00 45.30 H new ATOM 0 HA LEU A 337 1.062 27.285 -0.059 1.00 61.52 H new ATOM 0 HB2 LEU A 337 1.013 27.288 -2.538 1.00 64.43 H new ATOM 0 HB3 LEU A 337 -0.489 26.385 -2.521 1.00 64.43 H new ATOM 0 HG LEU A 337 -1.580 28.308 -1.339 1.00 32.31 H new ATOM 0 HD11 LEU A 337 -0.440 30.491 -1.368 1.00 14.33 H new ATOM 0 HD12 LEU A 337 0.414 29.311 -0.346 1.00 14.33 H new ATOM 0 HD13 LEU A 337 1.040 29.704 -1.965 1.00 14.33 H new ATOM 0 HD21 LEU A 337 -1.717 29.743 -3.337 1.00 4.40 H new ATOM 0 HD22 LEU A 337 -0.291 28.923 -4.017 1.00 4.40 H new ATOM 0 HD23 LEU A 337 -1.799 28.015 -3.756 1.00 4.40 H new ATOM 201 N TRP A 338 -1.506 25.219 -0.021 1.00 22.31 N ATOM 202 CA TRP A 338 -2.798 24.966 0.617 1.00 5.24 C ATOM 203 C TRP A 338 -2.653 24.893 2.137 1.00 60.04 C ATOM 204 O TRP A 338 -3.469 25.447 2.874 1.00 41.42 O ATOM 205 CB TRP A 338 -3.458 23.686 0.070 1.00 1.52 C ATOM 206 CG TRP A 338 -2.731 22.412 0.398 1.00 61.11 C ATOM 207 CD1 TRP A 338 -1.712 21.844 -0.306 1.00 71.02 C ATOM 208 CD2 TRP A 338 -2.987 21.537 1.506 1.00 53.42 C ATOM 209 NE1 TRP A 338 -1.305 20.684 0.301 1.00 63.24 N ATOM 210 CE2 TRP A 338 -2.073 20.471 1.414 1.00 14.25 C ATOM 211 CE3 TRP A 338 -3.895 21.555 2.569 1.00 12.04 C ATOM 212 CZ2 TRP A 338 -2.040 19.435 2.341 1.00 64.34 C ATOM 213 CZ3 TRP A 338 -3.862 20.524 3.491 1.00 53.52 C ATOM 214 CH2 TRP A 338 -2.939 19.476 3.371 1.00 64.12 C ATOM 0 H TRP A 338 -1.181 24.472 -0.635 1.00 22.31 H new ATOM 0 HA TRP A 338 -3.451 25.805 0.376 1.00 5.24 H new ATOM 0 HB2 TRP A 338 -4.472 23.621 0.464 1.00 1.52 H new ATOM 0 HB3 TRP A 338 -3.541 23.772 -1.013 1.00 1.52 H new ATOM 0 HD1 TRP A 338 -1.286 22.249 -1.212 1.00 71.02 H new ATOM 0 HE1 TRP A 338 -0.552 20.078 -0.024 1.00 63.24 H new ATOM 0 HE3 TRP A 338 -4.609 22.359 2.669 1.00 12.04 H new ATOM 0 HZ2 TRP A 338 -1.330 18.627 2.251 1.00 64.34 H new ATOM 0 HZ3 TRP A 338 -4.559 20.527 4.316 1.00 53.52 H new ATOM 0 HH2 TRP A 338 -2.938 18.685 4.106 1.00 64.12 H new ATOM 225 N ASP A 339 -1.600 24.227 2.598 1.00 21.31 N ATOM 226 CA ASP A 339 -1.362 24.083 4.027 1.00 42.24 C ATOM 227 C ASP A 339 -0.914 25.408 4.623 1.00 23.33 C ATOM 228 O ASP A 339 -1.330 25.777 5.720 1.00 24.15 O ATOM 229 CB ASP A 339 -0.318 23.002 4.305 1.00 50.21 C ATOM 230 CG ASP A 339 -0.125 22.767 5.791 1.00 30.20 C ATOM 231 OD1 ASP A 339 -0.956 22.059 6.396 1.00 14.01 O ATOM 232 OD2 ASP A 339 0.849 23.299 6.363 1.00 41.22 O ATOM 0 H ASP A 339 -0.901 23.780 2.005 1.00 21.31 H new ATOM 0 HA ASP A 339 -2.298 23.780 4.496 1.00 42.24 H new ATOM 0 HB2 ASP A 339 -0.624 22.071 3.828 1.00 50.21 H new ATOM 0 HB3 ASP A 339 0.633 23.292 3.857 1.00 50.21 H new ATOM 237 N TYR A 340 -0.087 26.134 3.873 1.00 10.32 N ATOM 238 CA TYR A 340 0.426 27.425 4.318 1.00 70.12 C ATOM 239 C TYR A 340 -0.721 28.393 4.585 1.00 4.43 C ATOM 240 O TYR A 340 -0.698 29.140 5.564 1.00 35.21 O ATOM 241 CB TYR A 340 1.378 28.010 3.272 1.00 65.43 C ATOM 242 CG TYR A 340 2.170 29.201 3.766 1.00 64.32 C ATOM 243 CD1 TYR A 340 3.276 29.021 4.585 1.00 11.03 C ATOM 244 CD2 TYR A 340 1.818 30.499 3.412 1.00 73.32 C ATOM 245 CE1 TYR A 340 4.008 30.098 5.041 1.00 50.21 C ATOM 246 CE2 TYR A 340 2.549 31.584 3.863 1.00 34.31 C ATOM 247 CZ TYR A 340 3.644 31.376 4.679 1.00 22.54 C ATOM 248 OH TYR A 340 4.380 32.448 5.135 1.00 51.11 O ATOM 0 H TYR A 340 0.242 25.847 2.951 1.00 10.32 H new ATOM 0 HA TYR A 340 0.976 27.274 5.247 1.00 70.12 H new ATOM 0 HB2 TYR A 340 2.071 27.233 2.950 1.00 65.43 H new ATOM 0 HB3 TYR A 340 0.802 28.307 2.395 1.00 65.43 H new ATOM 0 HD1 TYR A 340 3.569 28.021 4.870 1.00 11.03 H new ATOM 0 HD2 TYR A 340 0.961 30.663 2.775 1.00 73.32 H new ATOM 0 HE1 TYR A 340 4.864 29.939 5.680 1.00 50.21 H new ATOM 0 HE2 TYR A 340 2.265 32.587 3.579 1.00 34.31 H new ATOM 0 HH TYR A 340 5.276 32.144 5.392 1.00 51.11 H new ATOM 258 N VAL A 341 -1.727 28.368 3.718 1.00 1.41 N ATOM 259 CA VAL A 341 -2.912 29.196 3.900 1.00 13.33 C ATOM 260 C VAL A 341 -3.625 28.828 5.197 1.00 42.23 C ATOM 261 O VAL A 341 -4.043 29.700 5.959 1.00 1.01 O ATOM 262 CB VAL A 341 -3.896 29.061 2.713 1.00 63.45 C ATOM 263 CG1 VAL A 341 -5.161 29.872 2.958 1.00 35.42 C ATOM 264 CG2 VAL A 341 -3.230 29.492 1.414 1.00 61.33 C ATOM 0 H VAL A 341 -1.745 27.783 2.882 1.00 1.41 H new ATOM 0 HA VAL A 341 -2.577 30.232 3.948 1.00 13.33 H new ATOM 0 HB VAL A 341 -4.178 28.012 2.627 1.00 63.45 H new ATOM 0 HG11 VAL A 341 -5.835 29.760 2.109 1.00 35.42 H new ATOM 0 HG12 VAL A 341 -5.653 29.514 3.862 1.00 35.42 H new ATOM 0 HG13 VAL A 341 -4.901 30.924 3.078 1.00 35.42 H new ATOM 0 HG21 VAL A 341 -3.937 29.390 0.591 1.00 61.33 H new ATOM 0 HG22 VAL A 341 -2.915 30.532 1.495 1.00 61.33 H new ATOM 0 HG23 VAL A 341 -2.360 28.863 1.225 1.00 61.33 H new ATOM 274 N TYR A 342 -3.739 27.531 5.461 1.00 4.01 N ATOM 275 CA TYR A 342 -4.410 27.066 6.663 1.00 0.12 C ATOM 276 C TYR A 342 -3.587 27.406 7.906 1.00 41.13 C ATOM 277 O TYR A 342 -4.147 27.649 8.978 1.00 62.55 O ATOM 278 CB TYR A 342 -4.681 25.561 6.600 1.00 62.44 C ATOM 279 CG TYR A 342 -5.559 25.077 7.733 1.00 70.25 C ATOM 280 CD1 TYR A 342 -6.932 25.299 7.716 1.00 42.05 C ATOM 281 CD2 TYR A 342 -5.014 24.415 8.827 1.00 53.51 C ATOM 282 CE1 TYR A 342 -7.735 24.878 8.758 1.00 75.43 C ATOM 283 CE2 TYR A 342 -5.812 23.987 9.869 1.00 54.12 C ATOM 284 CZ TYR A 342 -7.170 24.222 9.829 1.00 1.35 C ATOM 285 OH TYR A 342 -7.966 23.809 10.872 1.00 0.12 O ATOM 0 H TYR A 342 -3.377 26.789 4.861 1.00 4.01 H new ATOM 0 HA TYR A 342 -5.369 27.580 6.728 1.00 0.12 H new ATOM 0 HB2 TYR A 342 -5.157 25.321 5.649 1.00 62.44 H new ATOM 0 HB3 TYR A 342 -3.733 25.024 6.626 1.00 62.44 H new ATOM 0 HD1 TYR A 342 -7.377 25.809 6.874 1.00 42.05 H new ATOM 0 HD2 TYR A 342 -3.950 24.233 8.862 1.00 53.51 H new ATOM 0 HE1 TYR A 342 -8.799 25.062 8.733 1.00 75.43 H new ATOM 0 HE2 TYR A 342 -5.375 23.471 10.711 1.00 54.12 H new ATOM 0 HH TYR A 342 -7.414 23.361 11.547 1.00 0.12 H new ATOM 295 N GLN A 343 -2.262 27.419 7.762 1.00 3.22 N ATOM 296 CA GLN A 343 -1.380 27.856 8.842 1.00 43.33 C ATOM 297 C GLN A 343 -1.752 29.272 9.262 1.00 33.13 C ATOM 298 O GLN A 343 -1.970 29.544 10.443 1.00 14.32 O ATOM 299 CB GLN A 343 0.094 27.822 8.409 1.00 33.34 C ATOM 300 CG GLN A 343 0.624 26.435 8.070 1.00 12.41 C ATOM 301 CD GLN A 343 0.499 25.456 9.223 1.00 41.41 C ATOM 302 OE1 GLN A 343 0.504 25.847 10.389 1.00 11.33 O ATOM 303 NE2 GLN A 343 0.416 24.174 8.906 1.00 24.43 N ATOM 0 H GLN A 343 -1.778 27.133 6.911 1.00 3.22 H new ATOM 0 HA GLN A 343 -1.505 27.171 9.681 1.00 43.33 H new ATOM 0 HB2 GLN A 343 0.218 28.467 7.539 1.00 33.34 H new ATOM 0 HB3 GLN A 343 0.703 28.244 9.208 1.00 33.34 H new ATOM 0 HG2 GLN A 343 0.082 26.045 7.209 1.00 12.41 H new ATOM 0 HG3 GLN A 343 1.671 26.513 7.778 1.00 12.41 H new ATOM 0 HE21 GLN A 343 0.415 23.890 7.926 1.00 24.43 H new ATOM 0 HE22 GLN A 343 0.353 23.470 9.641 1.00 24.43 H new ATOM 312 N LEU A 344 -1.857 30.154 8.275 1.00 12.30 N ATOM 313 CA LEU A 344 -2.223 31.546 8.517 1.00 0.21 C ATOM 314 C LEU A 344 -3.616 31.620 9.138 1.00 21.32 C ATOM 315 O LEU A 344 -3.845 32.345 10.103 1.00 54.41 O ATOM 316 CB LEU A 344 -2.201 32.335 7.203 1.00 1.41 C ATOM 317 CG LEU A 344 -0.949 32.147 6.339 1.00 64.53 C ATOM 318 CD1 LEU A 344 -1.028 33.014 5.093 1.00 51.01 C ATOM 319 CD2 LEU A 344 0.313 32.459 7.128 1.00 22.13 C ATOM 0 H LEU A 344 -1.693 29.929 7.294 1.00 12.30 H new ATOM 0 HA LEU A 344 -1.500 31.982 9.206 1.00 0.21 H new ATOM 0 HB2 LEU A 344 -3.073 32.050 6.614 1.00 1.41 H new ATOM 0 HB3 LEU A 344 -2.305 33.395 7.435 1.00 1.41 H new ATOM 0 HG LEU A 344 -0.904 31.102 6.033 1.00 64.53 H new ATOM 0 HD11 LEU A 344 -0.131 32.868 4.491 1.00 51.01 H new ATOM 0 HD12 LEU A 344 -1.906 32.734 4.510 1.00 51.01 H new ATOM 0 HD13 LEU A 344 -1.104 34.062 5.383 1.00 51.01 H new ATOM 0 HD21 LEU A 344 1.185 32.317 6.490 1.00 22.13 H new ATOM 0 HD22 LEU A 344 0.280 33.492 7.473 1.00 22.13 H new ATOM 0 HD23 LEU A 344 0.379 31.791 7.987 1.00 22.13 H new ATOM 331 N LEU A 345 -4.535 30.838 8.582 1.00 42.21 N ATOM 332 CA LEU A 345 -5.914 30.776 9.065 1.00 25.11 C ATOM 333 C LEU A 345 -5.996 30.278 10.509 1.00 30.54 C ATOM 334 O LEU A 345 -6.994 30.505 11.195 1.00 52.14 O ATOM 335 CB LEU A 345 -6.758 29.881 8.156 1.00 51.04 C ATOM 336 CG LEU A 345 -7.035 30.448 6.762 1.00 62.31 C ATOM 337 CD1 LEU A 345 -7.785 29.434 5.916 1.00 22.43 C ATOM 338 CD2 LEU A 345 -7.825 31.745 6.862 1.00 25.20 C ATOM 0 H LEU A 345 -4.348 30.229 7.785 1.00 42.21 H new ATOM 0 HA LEU A 345 -6.309 31.792 9.042 1.00 25.11 H new ATOM 0 HB2 LEU A 345 -6.253 28.921 8.047 1.00 51.04 H new ATOM 0 HB3 LEU A 345 -7.711 29.686 8.648 1.00 51.04 H new ATOM 0 HG LEU A 345 -6.081 30.661 6.281 1.00 62.31 H new ATOM 0 HD11 LEU A 345 -7.974 29.853 4.928 1.00 22.43 H new ATOM 0 HD12 LEU A 345 -7.186 28.528 5.818 1.00 22.43 H new ATOM 0 HD13 LEU A 345 -8.734 29.191 6.395 1.00 22.43 H new ATOM 0 HD21 LEU A 345 -8.013 32.134 5.861 1.00 25.20 H new ATOM 0 HD22 LEU A 345 -8.775 31.555 7.362 1.00 25.20 H new ATOM 0 HD23 LEU A 345 -7.254 32.476 7.434 1.00 25.20 H new ATOM 350 N SER A 346 -4.966 29.569 10.954 1.00 21.23 N ATOM 351 CA SER A 346 -4.937 29.042 12.309 1.00 25.00 C ATOM 352 C SER A 346 -4.700 30.160 13.328 1.00 65.22 C ATOM 353 O SER A 346 -5.140 30.061 14.476 1.00 21.23 O ATOM 354 CB SER A 346 -3.861 27.959 12.435 1.00 22.34 C ATOM 355 OG SER A 346 -4.157 26.855 11.592 1.00 41.12 O ATOM 0 H SER A 346 -4.142 29.347 10.396 1.00 21.23 H new ATOM 0 HA SER A 346 -5.908 28.595 12.522 1.00 25.00 H new ATOM 0 HB2 SER A 346 -2.888 28.374 12.171 1.00 22.34 H new ATOM 0 HB3 SER A 346 -3.794 27.625 13.470 1.00 22.34 H new ATOM 0 HG SER A 346 -4.044 27.119 10.655 1.00 41.12 H new ATOM 361 N ASP A 347 -4.024 31.223 12.904 1.00 62.34 N ATOM 362 CA ASP A 347 -3.785 32.373 13.772 1.00 24.43 C ATOM 363 C ASP A 347 -3.541 33.621 12.932 1.00 60.33 C ATOM 364 O ASP A 347 -2.402 33.980 12.644 1.00 43.50 O ATOM 365 CB ASP A 347 -2.594 32.118 14.703 1.00 24.12 C ATOM 366 CG ASP A 347 -2.546 33.098 15.859 1.00 62.11 C ATOM 367 OD1 ASP A 347 -3.480 33.078 16.689 1.00 25.43 O ATOM 368 OD2 ASP A 347 -1.582 33.886 15.946 1.00 1.15 O ATOM 0 H ASP A 347 -3.632 31.313 11.967 1.00 62.34 H new ATOM 0 HA ASP A 347 -4.671 32.527 14.388 1.00 24.43 H new ATOM 0 HB2 ASP A 347 -2.652 31.102 15.093 1.00 24.12 H new ATOM 0 HB3 ASP A 347 -1.668 32.188 14.132 1.00 24.12 H new ATOM 373 N SER A 348 -4.622 34.269 12.526 1.00 50.10 N ATOM 374 CA SER A 348 -4.540 35.389 11.596 1.00 2.44 C ATOM 375 C SER A 348 -4.541 36.730 12.329 1.00 40.31 C ATOM 376 O SER A 348 -4.474 37.792 11.701 1.00 42.54 O ATOM 377 CB SER A 348 -5.725 35.335 10.632 1.00 51.20 C ATOM 378 OG SER A 348 -5.895 34.030 10.105 1.00 44.54 O ATOM 0 H SER A 348 -5.569 34.039 12.826 1.00 50.10 H new ATOM 0 HA SER A 348 -3.602 35.306 11.047 1.00 2.44 H new ATOM 0 HB2 SER A 348 -6.633 35.643 11.150 1.00 51.20 H new ATOM 0 HB3 SER A 348 -5.568 36.042 9.817 1.00 51.20 H new ATOM 0 HG SER A 348 -5.030 33.569 10.087 1.00 44.54 H new ATOM 384 N ARG A 349 -4.599 36.669 13.657 1.00 41.33 N ATOM 385 CA ARG A 349 -4.749 37.859 14.497 1.00 34.41 C ATOM 386 C ARG A 349 -3.650 38.898 14.256 1.00 3.11 C ATOM 387 O ARG A 349 -3.921 40.096 14.256 1.00 62.22 O ATOM 388 CB ARG A 349 -4.774 37.456 15.976 1.00 34.03 C ATOM 389 CG ARG A 349 -3.544 36.677 16.418 1.00 33.12 C ATOM 390 CD ARG A 349 -3.704 36.112 17.820 1.00 43.44 C ATOM 391 NE ARG A 349 -3.865 37.157 18.829 1.00 50.31 N ATOM 392 CZ ARG A 349 -3.112 37.251 19.923 1.00 74.23 C ATOM 393 NH1 ARG A 349 -2.140 36.376 20.144 1.00 13.20 N ATOM 394 NH2 ARG A 349 -3.328 38.227 20.794 1.00 10.20 N ATOM 0 H ARG A 349 -4.544 35.796 14.182 1.00 41.33 H new ATOM 0 HA ARG A 349 -5.695 38.326 14.222 1.00 34.41 H new ATOM 0 HB2 ARG A 349 -4.863 38.354 16.587 1.00 34.03 H new ATOM 0 HB3 ARG A 349 -5.662 36.853 16.164 1.00 34.03 H new ATOM 0 HG2 ARG A 349 -3.359 35.863 15.717 1.00 33.12 H new ATOM 0 HG3 ARG A 349 -2.671 37.329 16.387 1.00 33.12 H new ATOM 0 HD2 ARG A 349 -4.570 35.451 17.845 1.00 43.44 H new ATOM 0 HD3 ARG A 349 -2.832 35.505 18.066 1.00 43.44 H new ATOM 0 HE ARG A 349 -4.596 37.854 18.687 1.00 50.31 H new ATOM 0 HH11 ARG A 349 -1.966 35.627 19.474 1.00 13.20 H new ATOM 0 HH12 ARG A 349 -1.566 36.453 20.984 1.00 13.20 H new ATOM 0 HH21 ARG A 349 -4.071 38.905 20.626 1.00 10.20 H new ATOM 0 HH22 ARG A 349 -2.751 38.299 21.632 1.00 10.20 H new ATOM 408 N TYR A 350 -2.423 38.447 14.037 1.00 74.04 N ATOM 409 CA TYR A 350 -1.292 39.363 13.918 1.00 2.42 C ATOM 410 C TYR A 350 -1.076 39.805 12.467 1.00 64.44 C ATOM 411 O TYR A 350 -0.548 40.888 12.214 1.00 24.34 O ATOM 412 CB TYR A 350 -0.015 38.716 14.474 1.00 31.13 C ATOM 413 CG TYR A 350 0.525 37.589 13.623 1.00 65.40 C ATOM 414 CD1 TYR A 350 -0.132 36.367 13.548 1.00 10.01 C ATOM 415 CD2 TYR A 350 1.691 37.753 12.887 1.00 71.53 C ATOM 416 CE1 TYR A 350 0.357 35.345 12.764 1.00 32.25 C ATOM 417 CE2 TYR A 350 2.184 36.733 12.098 1.00 73.10 C ATOM 418 CZ TYR A 350 1.514 35.531 12.042 1.00 42.24 C ATOM 419 OH TYR A 350 1.993 34.517 11.248 1.00 65.24 O ATOM 0 H TYR A 350 -2.184 37.460 13.938 1.00 74.04 H new ATOM 0 HA TYR A 350 -1.523 40.251 14.506 1.00 2.42 H new ATOM 0 HB2 TYR A 350 0.754 39.482 14.574 1.00 31.13 H new ATOM 0 HB3 TYR A 350 -0.219 38.336 15.475 1.00 31.13 H new ATOM 0 HD1 TYR A 350 -1.040 36.216 14.113 1.00 10.01 H new ATOM 0 HD2 TYR A 350 2.220 38.693 12.932 1.00 71.53 H new ATOM 0 HE1 TYR A 350 -0.166 34.401 12.716 1.00 32.25 H new ATOM 0 HE2 TYR A 350 3.090 36.877 11.528 1.00 73.10 H new ATOM 0 HH TYR A 350 1.387 34.380 10.490 1.00 65.24 H new ATOM 429 N GLU A 351 -1.500 38.975 11.523 1.00 63.10 N ATOM 430 CA GLU A 351 -1.274 39.246 10.105 1.00 54.25 C ATOM 431 C GLU A 351 -2.292 40.232 9.550 1.00 21.32 C ATOM 432 O GLU A 351 -1.923 41.263 8.983 1.00 73.12 O ATOM 433 CB GLU A 351 -1.330 37.948 9.304 1.00 43.14 C ATOM 434 CG GLU A 351 -0.114 37.065 9.501 1.00 11.45 C ATOM 435 CD GLU A 351 -0.235 35.735 8.792 1.00 54.55 C ATOM 436 OE1 GLU A 351 -0.504 35.735 7.575 1.00 73.53 O ATOM 437 OE2 GLU A 351 -0.068 34.692 9.460 1.00 11.05 O ATOM 0 H GLU A 351 -2.003 38.108 11.711 1.00 63.10 H new ATOM 0 HA GLU A 351 -0.284 39.693 10.012 1.00 54.25 H new ATOM 0 HB2 GLU A 351 -2.223 37.392 9.589 1.00 43.14 H new ATOM 0 HB3 GLU A 351 -1.428 38.187 8.245 1.00 43.14 H new ATOM 0 HG2 GLU A 351 0.771 37.587 9.137 1.00 11.45 H new ATOM 0 HG3 GLU A 351 0.034 36.891 10.567 1.00 11.45 H new ATOM 444 N ASN A 352 -3.572 39.900 9.716 1.00 42.13 N ATOM 445 CA ASN A 352 -4.674 40.699 9.203 1.00 21.34 C ATOM 446 C ASN A 352 -4.630 40.819 7.671 1.00 50.41 C ATOM 447 O ASN A 352 -5.252 41.706 7.086 1.00 12.51 O ATOM 448 CB ASN A 352 -4.666 42.076 9.856 1.00 42.30 C ATOM 449 CG ASN A 352 -6.001 42.766 9.746 1.00 74.14 C ATOM 450 OD1 ASN A 352 -7.050 42.120 9.720 1.00 34.13 O ATOM 451 ND2 ASN A 352 -5.976 44.078 9.678 1.00 23.11 N ATOM 0 H ASN A 352 -3.871 39.062 10.215 1.00 42.13 H new ATOM 0 HA ASN A 352 -5.604 40.191 9.456 1.00 21.34 H new ATOM 0 HB2 ASN A 352 -4.396 41.976 10.907 1.00 42.30 H new ATOM 0 HB3 ASN A 352 -3.900 42.694 9.388 1.00 42.30 H new ATOM 0 HD21 ASN A 352 -6.848 44.601 9.600 1.00 23.11 H new ATOM 0 HD22 ASN A 352 -5.085 44.573 9.703 1.00 23.11 H new ATOM 458 N PHE A 353 -3.911 39.906 7.022 1.00 21.21 N ATOM 459 CA PHE A 353 -3.904 39.840 5.562 1.00 33.54 C ATOM 460 C PHE A 353 -5.084 39.007 5.089 1.00 62.25 C ATOM 461 O PHE A 353 -5.562 39.145 3.961 1.00 22.41 O ATOM 462 CB PHE A 353 -2.604 39.222 5.036 1.00 51.41 C ATOM 463 CG PHE A 353 -1.370 40.010 5.364 1.00 2.01 C ATOM 464 CD1 PHE A 353 -1.154 41.253 4.792 1.00 43.22 C ATOM 465 CD2 PHE A 353 -0.422 39.504 6.237 1.00 35.21 C ATOM 466 CE1 PHE A 353 -0.016 41.977 5.088 1.00 23.20 C ATOM 467 CE2 PHE A 353 0.718 40.222 6.536 1.00 63.25 C ATOM 468 CZ PHE A 353 0.922 41.460 5.960 1.00 64.22 C ATOM 0 H PHE A 353 -3.329 39.205 7.481 1.00 21.21 H new ATOM 0 HA PHE A 353 -3.979 40.856 5.176 1.00 33.54 H new ATOM 0 HB2 PHE A 353 -2.500 38.218 5.447 1.00 51.41 H new ATOM 0 HB3 PHE A 353 -2.677 39.117 3.954 1.00 51.41 H new ATOM 0 HD1 PHE A 353 -1.883 41.660 4.107 1.00 43.22 H new ATOM 0 HD2 PHE A 353 -0.577 38.536 6.690 1.00 35.21 H new ATOM 0 HE1 PHE A 353 0.140 42.946 4.638 1.00 23.20 H new ATOM 0 HE2 PHE A 353 1.449 39.816 7.219 1.00 63.25 H new ATOM 0 HZ PHE A 353 1.814 42.023 6.191 1.00 64.22 H new ATOM 478 N ILE A 354 -5.544 38.146 5.982 1.00 31.32 N ATOM 479 CA ILE A 354 -6.652 37.249 5.721 1.00 61.31 C ATOM 480 C ILE A 354 -7.308 36.876 7.047 1.00 23.44 C ATOM 481 O ILE A 354 -6.630 36.813 8.071 1.00 52.30 O ATOM 482 CB ILE A 354 -6.166 35.972 4.987 1.00 70.41 C ATOM 483 CG1 ILE A 354 -7.321 34.987 4.764 1.00 13.10 C ATOM 484 CG2 ILE A 354 -5.030 35.307 5.758 1.00 54.11 C ATOM 485 CD1 ILE A 354 -6.907 33.712 4.057 1.00 24.45 C ATOM 0 H ILE A 354 -5.152 38.051 6.919 1.00 31.32 H new ATOM 0 HA ILE A 354 -7.375 37.750 5.078 1.00 61.31 H new ATOM 0 HB ILE A 354 -5.789 36.271 4.009 1.00 70.41 H new ATOM 0 HG12 ILE A 354 -7.760 34.731 5.728 1.00 13.10 H new ATOM 0 HG13 ILE A 354 -8.099 35.479 4.180 1.00 13.10 H new ATOM 0 HG21 ILE A 354 -4.704 34.413 5.226 1.00 54.11 H new ATOM 0 HG22 ILE A 354 -4.195 36.002 5.847 1.00 54.11 H new ATOM 0 HG23 ILE A 354 -5.379 35.030 6.753 1.00 54.11 H new ATOM 0 HD11 ILE A 354 -7.776 33.065 3.935 1.00 24.45 H new ATOM 0 HD12 ILE A 354 -6.496 33.956 3.078 1.00 24.45 H new ATOM 0 HD13 ILE A 354 -6.151 33.196 4.650 1.00 24.45 H new ATOM 497 N ARG A 355 -8.621 36.694 7.046 1.00 51.51 N ATOM 498 CA ARG A 355 -9.319 36.244 8.246 1.00 74.42 C ATOM 499 C ARG A 355 -10.541 35.418 7.872 1.00 14.43 C ATOM 500 O ARG A 355 -10.931 35.373 6.706 1.00 41.31 O ATOM 501 CB ARG A 355 -9.745 37.423 9.136 1.00 34.12 C ATOM 502 CG ARG A 355 -10.974 38.177 8.644 1.00 14.02 C ATOM 503 CD ARG A 355 -10.640 39.168 7.543 1.00 20.31 C ATOM 504 NE ARG A 355 -9.831 40.285 8.035 1.00 61.33 N ATOM 505 CZ ARG A 355 -10.210 41.565 7.970 1.00 33.44 C ATOM 506 NH1 ARG A 355 -11.423 41.885 7.535 1.00 54.32 N ATOM 507 NH2 ARG A 355 -9.393 42.524 8.377 1.00 63.45 N ATOM 0 H ARG A 355 -9.222 36.849 6.236 1.00 51.51 H new ATOM 0 HA ARG A 355 -8.622 35.627 8.813 1.00 74.42 H new ATOM 0 HB2 ARG A 355 -9.942 37.050 10.141 1.00 34.12 H new ATOM 0 HB3 ARG A 355 -8.913 38.122 9.213 1.00 34.12 H new ATOM 0 HG2 ARG A 355 -11.712 37.464 8.276 1.00 14.02 H new ATOM 0 HG3 ARG A 355 -11.431 38.706 9.480 1.00 14.02 H new ATOM 0 HD2 ARG A 355 -10.103 38.655 6.745 1.00 20.31 H new ATOM 0 HD3 ARG A 355 -11.563 39.553 7.110 1.00 20.31 H new ATOM 0 HE ARG A 355 -8.924 40.074 8.452 1.00 61.33 H new ATOM 0 HH11 ARG A 355 -12.072 41.152 7.248 1.00 54.32 H new ATOM 0 HH12 ARG A 355 -11.706 42.864 7.488 1.00 54.32 H new ATOM 0 HH21 ARG A 355 -8.470 42.287 8.742 1.00 63.45 H new ATOM 0 HH22 ARG A 355 -9.686 43.500 8.326 1.00 63.45 H new ATOM 521 N TRP A 356 -11.137 34.772 8.862 1.00 40.32 N ATOM 522 CA TRP A 356 -12.375 34.040 8.657 1.00 20.11 C ATOM 523 C TRP A 356 -13.562 34.991 8.712 1.00 71.43 C ATOM 524 O TRP A 356 -13.592 35.913 9.530 1.00 13.42 O ATOM 525 CB TRP A 356 -12.557 32.957 9.726 1.00 31.30 C ATOM 526 CG TRP A 356 -11.513 31.880 9.698 1.00 0.55 C ATOM 527 CD1 TRP A 356 -10.298 31.899 10.318 1.00 15.31 C ATOM 528 CD2 TRP A 356 -11.603 30.616 9.030 1.00 22.33 C ATOM 529 NE1 TRP A 356 -9.622 30.732 10.067 1.00 42.13 N ATOM 530 CE2 TRP A 356 -10.402 29.926 9.283 1.00 23.53 C ATOM 531 CE3 TRP A 356 -12.578 30.002 8.241 1.00 1.14 C ATOM 532 CZ2 TRP A 356 -10.153 28.654 8.775 1.00 42.44 C ATOM 533 CZ3 TRP A 356 -12.329 28.738 7.740 1.00 35.30 C ATOM 534 CH2 TRP A 356 -11.124 28.077 8.010 1.00 54.33 C ATOM 0 H TRP A 356 -10.782 34.740 9.818 1.00 40.32 H new ATOM 0 HA TRP A 356 -12.323 33.567 7.676 1.00 20.11 H new ATOM 0 HB2 TRP A 356 -12.550 33.428 10.709 1.00 31.30 H new ATOM 0 HB3 TRP A 356 -13.538 32.499 9.599 1.00 31.30 H new ATOM 0 HD1 TRP A 356 -9.923 32.714 10.919 1.00 15.31 H new ATOM 0 HE1 TRP A 356 -8.689 30.502 10.409 1.00 42.13 H new ATOM 0 HE3 TRP A 356 -13.509 30.505 8.026 1.00 1.14 H new ATOM 0 HZ2 TRP A 356 -9.224 28.142 8.979 1.00 42.44 H new ATOM 0 HZ3 TRP A 356 -13.076 28.252 7.130 1.00 35.30 H new ATOM 0 HH2 TRP A 356 -10.960 27.090 7.604 1.00 54.33 H new ATOM 545 N GLU A 357 -14.526 34.776 7.834 1.00 11.42 N ATOM 546 CA GLU A 357 -15.787 35.495 7.906 1.00 25.12 C ATOM 547 C GLU A 357 -16.738 34.705 8.788 1.00 33.12 C ATOM 548 O GLU A 357 -17.512 35.268 9.569 1.00 50.25 O ATOM 549 CB GLU A 357 -16.387 35.687 6.514 1.00 4.25 C ATOM 550 CG GLU A 357 -15.490 36.461 5.566 1.00 51.03 C ATOM 551 CD GLU A 357 -15.126 37.834 6.096 1.00 22.42 C ATOM 552 OE1 GLU A 357 -15.897 38.789 5.872 1.00 45.25 O ATOM 553 OE2 GLU A 357 -14.064 37.966 6.736 1.00 1.24 O ATOM 0 H GLU A 357 -14.461 34.111 7.064 1.00 11.42 H new ATOM 0 HA GLU A 357 -15.619 36.485 8.329 1.00 25.12 H new ATOM 0 HB2 GLU A 357 -16.600 34.709 6.082 1.00 4.25 H new ATOM 0 HB3 GLU A 357 -17.339 36.209 6.607 1.00 4.25 H new ATOM 0 HG2 GLU A 357 -14.578 35.891 5.388 1.00 51.03 H new ATOM 0 HG3 GLU A 357 -15.991 36.568 4.604 1.00 51.03 H new ATOM 560 N ASP A 358 -16.653 33.387 8.659 1.00 71.43 N ATOM 561 CA ASP A 358 -17.376 32.474 9.525 1.00 24.24 C ATOM 562 C ASP A 358 -16.590 31.179 9.648 1.00 11.35 C ATOM 563 O ASP A 358 -16.424 30.445 8.671 1.00 64.53 O ATOM 564 CB ASP A 358 -18.785 32.192 9.000 1.00 41.22 C ATOM 565 CG ASP A 358 -19.649 31.519 10.050 1.00 12.42 C ATOM 566 OD1 ASP A 358 -20.300 32.242 10.836 1.00 63.40 O ATOM 567 OD2 ASP A 358 -19.669 30.270 10.108 1.00 51.11 O ATOM 0 H ASP A 358 -16.081 32.925 7.952 1.00 71.43 H new ATOM 0 HA ASP A 358 -17.484 32.939 10.505 1.00 24.24 H new ATOM 0 HB2 ASP A 358 -19.252 33.127 8.689 1.00 41.22 H new ATOM 0 HB3 ASP A 358 -18.724 31.557 8.116 1.00 41.22 H new ATOM 572 N LYS A 359 -16.088 30.925 10.845 1.00 75.40 N ATOM 573 CA LYS A 359 -15.250 29.763 11.111 1.00 64.24 C ATOM 574 C LYS A 359 -16.004 28.465 10.841 1.00 22.41 C ATOM 575 O LYS A 359 -15.524 27.598 10.111 1.00 2.15 O ATOM 576 CB LYS A 359 -14.768 29.814 12.566 1.00 3.45 C ATOM 577 CG LYS A 359 -14.049 28.562 13.050 1.00 4.21 C ATOM 578 CD LYS A 359 -12.721 28.337 12.347 1.00 72.31 C ATOM 579 CE LYS A 359 -11.992 27.158 12.963 1.00 21.11 C ATOM 580 NZ LYS A 359 -10.713 26.852 12.272 1.00 53.02 N ATOM 0 H LYS A 359 -16.248 31.517 11.660 1.00 75.40 H new ATOM 0 HA LYS A 359 -14.391 29.786 10.441 1.00 64.24 H new ATOM 0 HB2 LYS A 359 -14.099 30.667 12.682 1.00 3.45 H new ATOM 0 HB3 LYS A 359 -15.628 29.994 13.212 1.00 3.45 H new ATOM 0 HG2 LYS A 359 -13.878 28.639 14.124 1.00 4.21 H new ATOM 0 HG3 LYS A 359 -14.691 27.695 12.891 1.00 4.21 H new ATOM 0 HD2 LYS A 359 -12.890 28.155 11.286 1.00 72.31 H new ATOM 0 HD3 LYS A 359 -12.106 29.233 12.422 1.00 72.31 H new ATOM 0 HE2 LYS A 359 -11.792 27.368 14.014 1.00 21.11 H new ATOM 0 HE3 LYS A 359 -12.637 26.280 12.931 1.00 21.11 H new ATOM 0 HZ1 LYS A 359 -10.256 26.039 12.732 1.00 53.02 H new ATOM 0 HZ2 LYS A 359 -10.903 26.624 11.275 1.00 53.02 H new ATOM 0 HZ3 LYS A 359 -10.084 27.678 12.324 1.00 53.02 H new ATOM 594 N GLU A 360 -17.200 28.360 11.402 1.00 52.00 N ATOM 595 CA GLU A 360 -17.972 27.122 11.353 1.00 31.32 C ATOM 596 C GLU A 360 -18.427 26.793 9.933 1.00 24.24 C ATOM 597 O GLU A 360 -18.501 25.625 9.551 1.00 24.35 O ATOM 598 CB GLU A 360 -19.183 27.231 12.282 1.00 61.33 C ATOM 599 CG GLU A 360 -18.822 27.667 13.694 1.00 31.41 C ATOM 600 CD GLU A 360 -17.912 26.684 14.405 1.00 63.11 C ATOM 601 OE1 GLU A 360 -16.679 26.757 14.216 1.00 33.42 O ATOM 602 OE2 GLU A 360 -18.428 25.839 15.164 1.00 41.21 O ATOM 0 H GLU A 360 -17.661 29.121 11.900 1.00 52.00 H new ATOM 0 HA GLU A 360 -17.326 26.310 11.687 1.00 31.32 H new ATOM 0 HB2 GLU A 360 -19.893 27.942 11.860 1.00 61.33 H new ATOM 0 HB3 GLU A 360 -19.687 26.265 12.325 1.00 61.33 H new ATOM 0 HG2 GLU A 360 -18.334 28.641 13.654 1.00 31.41 H new ATOM 0 HG3 GLU A 360 -19.736 27.792 14.274 1.00 31.41 H new ATOM 609 N SER A 361 -18.724 27.823 9.151 1.00 21.42 N ATOM 610 CA SER A 361 -19.168 27.633 7.778 1.00 12.22 C ATOM 611 C SER A 361 -17.978 27.600 6.816 1.00 0.05 C ATOM 612 O SER A 361 -18.160 27.583 5.596 1.00 52.31 O ATOM 613 CB SER A 361 -20.135 28.751 7.387 1.00 10.34 C ATOM 614 OG SER A 361 -21.140 28.920 8.379 1.00 52.22 O ATOM 0 H SER A 361 -18.665 28.798 9.445 1.00 21.42 H new ATOM 0 HA SER A 361 -19.682 26.674 7.711 1.00 12.22 H new ATOM 0 HB2 SER A 361 -19.586 29.684 7.257 1.00 10.34 H new ATOM 0 HB3 SER A 361 -20.599 28.518 6.429 1.00 10.34 H new ATOM 0 HG SER A 361 -20.771 29.420 9.137 1.00 52.22 H new ATOM 620 N LYS A 362 -16.765 27.575 7.390 1.00 20.11 N ATOM 621 CA LYS A 362 -15.502 27.539 6.631 1.00 73.34 C ATOM 622 C LYS A 362 -15.468 28.598 5.531 1.00 50.22 C ATOM 623 O LYS A 362 -15.244 28.294 4.356 1.00 73.20 O ATOM 624 CB LYS A 362 -15.153 26.138 6.062 1.00 20.14 C ATOM 625 CG LYS A 362 -16.317 25.170 5.883 1.00 63.41 C ATOM 626 CD LYS A 362 -16.649 24.444 7.179 1.00 53.02 C ATOM 627 CE LYS A 362 -17.860 23.540 7.017 1.00 34.24 C ATOM 628 NZ LYS A 362 -18.193 22.817 8.273 1.00 24.24 N ATOM 0 H LYS A 362 -16.631 27.579 8.401 1.00 20.11 H new ATOM 0 HA LYS A 362 -14.726 27.774 7.359 1.00 73.34 H new ATOM 0 HB2 LYS A 362 -14.669 26.273 5.095 1.00 20.14 H new ATOM 0 HB3 LYS A 362 -14.421 25.674 6.723 1.00 20.14 H new ATOM 0 HG2 LYS A 362 -17.194 25.716 5.537 1.00 63.41 H new ATOM 0 HG3 LYS A 362 -16.069 24.442 5.111 1.00 63.41 H new ATOM 0 HD2 LYS A 362 -15.791 23.851 7.495 1.00 53.02 H new ATOM 0 HD3 LYS A 362 -16.840 25.173 7.967 1.00 53.02 H new ATOM 0 HE2 LYS A 362 -18.717 24.136 6.705 1.00 34.24 H new ATOM 0 HE3 LYS A 362 -17.668 22.817 6.224 1.00 34.24 H new ATOM 0 HZ1 LYS A 362 -19.054 22.252 8.130 1.00 24.24 H new ATOM 0 HZ2 LYS A 362 -17.406 22.189 8.531 1.00 24.24 H new ATOM 0 HZ3 LYS A 362 -18.352 23.504 9.037 1.00 24.24 H new ATOM 642 N ILE A 363 -15.699 29.843 5.926 1.00 45.41 N ATOM 643 CA ILE A 363 -15.665 30.971 5.006 1.00 54.22 C ATOM 644 C ILE A 363 -14.567 31.942 5.423 1.00 54.14 C ATOM 645 O ILE A 363 -14.502 32.340 6.587 1.00 12.24 O ATOM 646 CB ILE A 363 -17.017 31.719 4.988 1.00 34.13 C ATOM 647 CG1 ILE A 363 -18.160 30.753 4.660 1.00 42.13 C ATOM 648 CG2 ILE A 363 -16.981 32.865 3.987 1.00 35.02 C ATOM 649 CD1 ILE A 363 -19.532 31.389 4.731 1.00 40.32 C ATOM 0 H ILE A 363 -15.914 30.098 6.890 1.00 45.41 H new ATOM 0 HA ILE A 363 -15.466 30.584 4.007 1.00 54.22 H new ATOM 0 HB ILE A 363 -17.193 32.136 5.980 1.00 34.13 H new ATOM 0 HG12 ILE A 363 -18.007 30.350 3.659 1.00 42.13 H new ATOM 0 HG13 ILE A 363 -18.123 29.911 5.352 1.00 42.13 H new ATOM 0 HG21 ILE A 363 -17.942 33.380 3.989 1.00 35.02 H new ATOM 0 HG22 ILE A 363 -16.193 33.566 4.264 1.00 35.02 H new ATOM 0 HG23 ILE A 363 -16.782 32.471 2.990 1.00 35.02 H new ATOM 0 HD11 ILE A 363 -20.291 30.646 4.487 1.00 40.32 H new ATOM 0 HD12 ILE A 363 -19.706 31.768 5.738 1.00 40.32 H new ATOM 0 HD13 ILE A 363 -19.589 32.212 4.019 1.00 40.32 H new ATOM 661 N PHE A 364 -13.706 32.319 4.486 1.00 14.51 N ATOM 662 CA PHE A 364 -12.599 33.217 4.792 1.00 15.34 C ATOM 663 C PHE A 364 -12.481 34.319 3.740 1.00 52.42 C ATOM 664 O PHE A 364 -12.996 34.194 2.630 1.00 14.55 O ATOM 665 CB PHE A 364 -11.281 32.439 4.918 1.00 35.23 C ATOM 666 CG PHE A 364 -10.862 31.700 3.674 1.00 3.51 C ATOM 667 CD1 PHE A 364 -11.401 30.462 3.370 1.00 52.24 C ATOM 668 CD2 PHE A 364 -9.911 32.239 2.823 1.00 1.34 C ATOM 669 CE1 PHE A 364 -11.003 29.777 2.238 1.00 32.41 C ATOM 670 CE2 PHE A 364 -9.510 31.559 1.689 1.00 54.01 C ATOM 671 CZ PHE A 364 -10.056 30.325 1.397 1.00 11.11 C ATOM 0 H PHE A 364 -13.752 32.019 3.512 1.00 14.51 H new ATOM 0 HA PHE A 364 -12.806 33.689 5.752 1.00 15.34 H new ATOM 0 HB2 PHE A 364 -10.489 33.136 5.194 1.00 35.23 H new ATOM 0 HB3 PHE A 364 -11.375 31.723 5.735 1.00 35.23 H new ATOM 0 HD1 PHE A 364 -12.141 30.026 4.025 1.00 52.24 H new ATOM 0 HD2 PHE A 364 -9.478 33.202 3.049 1.00 1.34 H new ATOM 0 HE1 PHE A 364 -11.433 28.813 2.011 1.00 32.41 H new ATOM 0 HE2 PHE A 364 -8.770 31.992 1.032 1.00 54.01 H new ATOM 0 HZ PHE A 364 -9.743 29.790 0.513 1.00 11.11 H new ATOM 681 N ARG A 365 -11.798 35.394 4.099 1.00 32.21 N ATOM 682 CA ARG A 365 -11.717 36.572 3.250 1.00 31.32 C ATOM 683 C ARG A 365 -10.284 37.071 3.130 1.00 64.35 C ATOM 684 O ARG A 365 -9.575 37.197 4.132 1.00 41.25 O ATOM 685 CB ARG A 365 -12.593 37.674 3.838 1.00 2.32 C ATOM 686 CG ARG A 365 -12.514 39.004 3.110 1.00 64.34 C ATOM 687 CD ARG A 365 -13.384 40.035 3.801 1.00 63.31 C ATOM 688 NE ARG A 365 -13.302 41.353 3.183 1.00 13.45 N ATOM 689 CZ ARG A 365 -14.306 42.225 3.185 1.00 23.02 C ATOM 690 NH1 ARG A 365 -15.478 41.889 3.711 1.00 4.20 N ATOM 691 NH2 ARG A 365 -14.139 43.431 2.659 1.00 1.42 N ATOM 0 H ARG A 365 -11.288 35.475 4.979 1.00 32.21 H new ATOM 0 HA ARG A 365 -12.066 36.303 2.253 1.00 31.32 H new ATOM 0 HB2 ARG A 365 -13.629 37.335 3.836 1.00 2.32 H new ATOM 0 HB3 ARG A 365 -12.310 37.828 4.879 1.00 2.32 H new ATOM 0 HG2 ARG A 365 -11.481 39.350 3.082 1.00 64.34 H new ATOM 0 HG3 ARG A 365 -12.837 38.880 2.076 1.00 64.34 H new ATOM 0 HD2 ARG A 365 -14.420 39.697 3.787 1.00 63.31 H new ATOM 0 HD3 ARG A 365 -13.087 40.111 4.847 1.00 63.31 H new ATOM 0 HE ARG A 365 -12.430 41.620 2.726 1.00 13.45 H new ATOM 0 HH11 ARG A 365 -15.609 40.961 4.114 1.00 4.20 H new ATOM 0 HH12 ARG A 365 -16.247 42.559 3.712 1.00 4.20 H new ATOM 0 HH21 ARG A 365 -13.240 43.690 2.253 1.00 1.42 H new ATOM 0 HH22 ARG A 365 -14.910 44.099 2.661 1.00 1.42 H new ATOM 705 N ILE A 366 -9.872 37.359 1.904 1.00 63.30 N ATOM 706 CA ILE A 366 -8.572 37.954 1.656 1.00 14.21 C ATOM 707 C ILE A 366 -8.676 39.468 1.802 1.00 74.13 C ATOM 708 O ILE A 366 -9.620 40.081 1.305 1.00 4.20 O ATOM 709 CB ILE A 366 -8.052 37.613 0.240 1.00 1.21 C ATOM 710 CG1 ILE A 366 -8.045 36.098 0.015 1.00 72.24 C ATOM 711 CG2 ILE A 366 -6.659 38.188 0.020 1.00 24.54 C ATOM 712 CD1 ILE A 366 -7.137 35.343 0.960 1.00 72.45 C ATOM 0 H ILE A 366 -10.424 37.188 1.063 1.00 63.30 H new ATOM 0 HA ILE A 366 -7.869 37.548 2.383 1.00 14.21 H new ATOM 0 HB ILE A 366 -8.728 38.067 -0.484 1.00 1.21 H new ATOM 0 HG12 ILE A 366 -9.061 35.720 0.123 1.00 72.24 H new ATOM 0 HG13 ILE A 366 -7.737 35.894 -1.010 1.00 72.24 H new ATOM 0 HG21 ILE A 366 -6.315 37.935 -0.983 1.00 24.54 H new ATOM 0 HG22 ILE A 366 -6.691 39.272 0.130 1.00 24.54 H new ATOM 0 HG23 ILE A 366 -5.972 37.769 0.756 1.00 24.54 H new ATOM 0 HD11 ILE A 366 -7.186 34.277 0.738 1.00 72.45 H new ATOM 0 HD12 ILE A 366 -6.112 35.692 0.836 1.00 72.45 H new ATOM 0 HD13 ILE A 366 -7.457 35.515 1.988 1.00 72.45 H new ATOM 724 N VAL A 367 -7.731 40.061 2.508 1.00 2.14 N ATOM 725 CA VAL A 367 -7.712 41.504 2.689 1.00 54.23 C ATOM 726 C VAL A 367 -6.600 42.124 1.857 1.00 2.15 C ATOM 727 O VAL A 367 -6.812 43.110 1.147 1.00 42.11 O ATOM 728 CB VAL A 367 -7.511 41.883 4.170 1.00 14.11 C ATOM 729 CG1 VAL A 367 -7.584 43.392 4.363 1.00 51.25 C ATOM 730 CG2 VAL A 367 -8.537 41.179 5.039 1.00 34.43 C ATOM 0 H VAL A 367 -6.965 39.567 2.966 1.00 2.14 H new ATOM 0 HA VAL A 367 -8.677 41.889 2.360 1.00 54.23 H new ATOM 0 HB VAL A 367 -6.517 41.556 4.474 1.00 14.11 H new ATOM 0 HG11 VAL A 367 -7.439 43.632 5.416 1.00 51.25 H new ATOM 0 HG12 VAL A 367 -6.805 43.873 3.771 1.00 51.25 H new ATOM 0 HG13 VAL A 367 -8.560 43.753 4.040 1.00 51.25 H new ATOM 0 HG21 VAL A 367 -8.382 41.456 6.082 1.00 34.43 H new ATOM 0 HG22 VAL A 367 -9.540 41.474 4.730 1.00 34.43 H new ATOM 0 HG23 VAL A 367 -8.427 40.100 4.930 1.00 34.43 H new ATOM 740 N ASP A 368 -5.418 41.532 1.939 1.00 32.15 N ATOM 741 CA ASP A 368 -4.265 42.038 1.210 1.00 44.10 C ATOM 742 C ASP A 368 -3.685 40.945 0.320 1.00 23.30 C ATOM 743 O ASP A 368 -3.075 39.991 0.811 1.00 44.44 O ATOM 744 CB ASP A 368 -3.194 42.545 2.180 1.00 42.22 C ATOM 745 CG ASP A 368 -2.165 43.433 1.504 1.00 51.04 C ATOM 746 OD1 ASP A 368 -1.481 42.968 0.569 1.00 34.11 O ATOM 747 OD2 ASP A 368 -2.044 44.611 1.894 1.00 11.21 O ATOM 0 H ASP A 368 -5.232 40.702 2.502 1.00 32.15 H new ATOM 0 HA ASP A 368 -4.591 42.870 0.586 1.00 44.10 H new ATOM 0 HB2 ASP A 368 -3.673 43.100 2.986 1.00 42.22 H new ATOM 0 HB3 ASP A 368 -2.689 41.693 2.636 1.00 42.22 H new ATOM 752 N PRO A 369 -3.886 41.063 -1.001 1.00 33.41 N ATOM 753 CA PRO A 369 -3.398 40.080 -1.976 1.00 23.11 C ATOM 754 C PRO A 369 -1.875 40.049 -2.057 1.00 23.31 C ATOM 755 O PRO A 369 -1.280 39.000 -2.308 1.00 51.54 O ATOM 756 CB PRO A 369 -3.989 40.559 -3.310 1.00 42.21 C ATOM 757 CG PRO A 369 -5.055 41.537 -2.943 1.00 1.34 C ATOM 758 CD PRO A 369 -4.613 42.158 -1.652 1.00 3.32 C ATOM 0 HA PRO A 369 -3.694 39.067 -1.704 1.00 23.11 H new ATOM 0 HB2 PRO A 369 -3.226 41.025 -3.933 1.00 42.21 H new ATOM 0 HB3 PRO A 369 -4.400 39.725 -3.880 1.00 42.21 H new ATOM 0 HG2 PRO A 369 -5.176 42.293 -3.719 1.00 1.34 H new ATOM 0 HG3 PRO A 369 -6.019 41.040 -2.828 1.00 1.34 H new ATOM 0 HD2 PRO A 369 -3.975 43.026 -1.818 1.00 3.32 H new ATOM 0 HD3 PRO A 369 -5.460 42.494 -1.053 1.00 3.32 H new ATOM 766 N ASN A 370 -1.251 41.198 -1.836 1.00 31.10 N ATOM 767 CA ASN A 370 0.199 41.304 -1.924 1.00 64.11 C ATOM 768 C ASN A 370 0.853 40.684 -0.698 1.00 73.45 C ATOM 769 O ASN A 370 1.853 39.984 -0.811 1.00 71.15 O ATOM 770 CB ASN A 370 0.627 42.769 -2.054 1.00 54.22 C ATOM 771 CG ASN A 370 2.133 42.935 -2.199 1.00 52.30 C ATOM 772 OD1 ASN A 370 2.815 42.098 -2.788 1.00 12.11 O ATOM 773 ND2 ASN A 370 2.664 44.018 -1.653 1.00 10.23 N ATOM 0 H ASN A 370 -1.725 42.068 -1.595 1.00 31.10 H new ATOM 0 HA ASN A 370 0.524 40.763 -2.812 1.00 64.11 H new ATOM 0 HB2 ASN A 370 0.133 43.211 -2.919 1.00 54.22 H new ATOM 0 HB3 ASN A 370 0.288 43.320 -1.177 1.00 54.22 H new ATOM 0 HD21 ASN A 370 3.669 44.179 -1.713 1.00 10.23 H new ATOM 0 HD22 ASN A 370 2.068 44.691 -1.172 1.00 10.23 H new ATOM 780 N GLY A 371 0.264 40.936 0.464 1.00 52.33 N ATOM 781 CA GLY A 371 0.807 40.434 1.712 1.00 53.45 C ATOM 782 C GLY A 371 0.932 38.925 1.733 1.00 72.23 C ATOM 783 O GLY A 371 1.949 38.387 2.172 1.00 72.24 O ATOM 0 H GLY A 371 -0.590 41.485 0.564 1.00 52.33 H new ATOM 0 HA2 GLY A 371 1.788 40.878 1.880 1.00 53.45 H new ATOM 0 HA3 GLY A 371 0.168 40.753 2.535 1.00 53.45 H new ATOM 787 N LEU A 372 -0.095 38.244 1.244 1.00 4.21 N ATOM 788 CA LEU A 372 -0.100 36.786 1.201 1.00 53.31 C ATOM 789 C LEU A 372 1.047 36.284 0.318 1.00 22.40 C ATOM 790 O LEU A 372 1.813 35.401 0.711 1.00 74.35 O ATOM 791 CB LEU A 372 -1.449 36.278 0.665 1.00 0.23 C ATOM 792 CG LEU A 372 -1.977 34.975 1.285 1.00 33.54 C ATOM 793 CD1 LEU A 372 -3.336 34.625 0.701 1.00 41.01 C ATOM 794 CD2 LEU A 372 -1.002 33.827 1.077 1.00 20.00 C ATOM 0 H LEU A 372 -0.939 38.678 0.870 1.00 4.21 H new ATOM 0 HA LEU A 372 0.041 36.401 2.211 1.00 53.31 H new ATOM 0 HB2 LEU A 372 -2.195 37.058 0.819 1.00 0.23 H new ATOM 0 HB3 LEU A 372 -1.357 36.133 -0.411 1.00 0.23 H new ATOM 0 HG LEU A 372 -2.082 35.134 2.358 1.00 33.54 H new ATOM 0 HD11 LEU A 372 -3.697 33.700 1.150 1.00 41.01 H new ATOM 0 HD12 LEU A 372 -4.041 35.430 0.911 1.00 41.01 H new ATOM 0 HD13 LEU A 372 -3.246 34.494 -0.377 1.00 41.01 H new ATOM 0 HD21 LEU A 372 -1.406 32.920 1.528 1.00 20.00 H new ATOM 0 HD22 LEU A 372 -0.852 33.666 0.009 1.00 20.00 H new ATOM 0 HD23 LEU A 372 -0.048 34.071 1.545 1.00 20.00 H new ATOM 806 N ALA A 373 1.171 36.870 -0.868 1.00 54.45 N ATOM 807 CA ALA A 373 2.225 36.495 -1.803 1.00 54.31 C ATOM 808 C ALA A 373 3.598 36.894 -1.270 1.00 0.55 C ATOM 809 O ALA A 373 4.586 36.183 -1.466 1.00 72.30 O ATOM 810 CB ALA A 373 1.974 37.138 -3.156 1.00 53.44 C ATOM 0 H ALA A 373 0.553 37.608 -1.205 1.00 54.45 H new ATOM 0 HA ALA A 373 2.212 35.411 -1.918 1.00 54.31 H new ATOM 0 HB1 ALA A 373 2.767 36.852 -3.847 1.00 53.44 H new ATOM 0 HB2 ALA A 373 1.013 36.802 -3.546 1.00 53.44 H new ATOM 0 HB3 ALA A 373 1.962 38.222 -3.047 1.00 53.44 H new ATOM 816 N ARG A 374 3.645 38.034 -0.590 1.00 65.52 N ATOM 817 CA ARG A 374 4.877 38.544 -0.005 1.00 13.45 C ATOM 818 C ARG A 374 5.417 37.557 1.023 1.00 15.34 C ATOM 819 O ARG A 374 6.618 37.281 1.063 1.00 41.34 O ATOM 820 CB ARG A 374 4.615 39.900 0.659 1.00 42.44 C ATOM 821 CG ARG A 374 5.869 40.712 0.938 1.00 42.02 C ATOM 822 CD ARG A 374 6.530 41.178 -0.353 1.00 51.14 C ATOM 823 NE ARG A 374 7.588 42.160 -0.104 1.00 35.33 N ATOM 824 CZ ARG A 374 8.087 42.977 -1.037 1.00 51.43 C ATOM 825 NH1 ARG A 374 7.671 42.890 -2.298 1.00 51.30 N ATOM 826 NH2 ARG A 374 9.003 43.881 -0.707 1.00 52.34 N ATOM 0 H ARG A 374 2.832 38.628 -0.430 1.00 65.52 H new ATOM 0 HA ARG A 374 5.618 38.670 -0.794 1.00 13.45 H new ATOM 0 HB2 ARG A 374 3.953 40.483 0.019 1.00 42.44 H new ATOM 0 HB3 ARG A 374 4.086 39.736 1.598 1.00 42.44 H new ATOM 0 HG2 ARG A 374 5.615 41.577 1.551 1.00 42.02 H new ATOM 0 HG3 ARG A 374 6.573 40.110 1.512 1.00 42.02 H new ATOM 0 HD2 ARG A 374 6.949 40.319 -0.877 1.00 51.14 H new ATOM 0 HD3 ARG A 374 5.777 41.615 -1.009 1.00 51.14 H new ATOM 0 HE ARG A 374 7.968 42.224 0.840 1.00 35.33 H new ATOM 0 HH11 ARG A 374 6.968 42.198 -2.557 1.00 51.30 H new ATOM 0 HH12 ARG A 374 8.055 43.516 -3.006 1.00 51.30 H new ATOM 0 HH21 ARG A 374 9.325 43.952 0.258 1.00 52.34 H new ATOM 0 HH22 ARG A 374 9.384 44.504 -1.419 1.00 52.34 H new ATOM 840 N LEU A 375 4.520 37.027 1.848 1.00 32.44 N ATOM 841 CA LEU A 375 4.891 36.042 2.857 1.00 44.21 C ATOM 842 C LEU A 375 5.417 34.768 2.205 1.00 1.13 C ATOM 843 O LEU A 375 6.494 34.286 2.549 1.00 43.34 O ATOM 844 CB LEU A 375 3.692 35.707 3.755 1.00 54.21 C ATOM 845 CG LEU A 375 3.160 36.866 4.604 1.00 40.41 C ATOM 846 CD1 LEU A 375 1.939 36.424 5.398 1.00 73.32 C ATOM 847 CD2 LEU A 375 4.245 37.398 5.534 1.00 13.24 C ATOM 0 H LEU A 375 3.528 37.264 1.837 1.00 32.44 H new ATOM 0 HA LEU A 375 5.682 36.475 3.469 1.00 44.21 H new ATOM 0 HB2 LEU A 375 2.881 35.338 3.127 1.00 54.21 H new ATOM 0 HB3 LEU A 375 3.975 34.892 4.421 1.00 54.21 H new ATOM 0 HG LEU A 375 2.863 37.674 3.936 1.00 40.41 H new ATOM 0 HD11 LEU A 375 1.572 37.258 5.996 1.00 73.32 H new ATOM 0 HD12 LEU A 375 1.157 36.098 4.712 1.00 73.32 H new ATOM 0 HD13 LEU A 375 2.212 35.598 6.055 1.00 73.32 H new ATOM 0 HD21 LEU A 375 3.845 38.220 6.127 1.00 13.24 H new ATOM 0 HD22 LEU A 375 4.578 36.600 6.198 1.00 13.24 H new ATOM 0 HD23 LEU A 375 5.089 37.754 4.943 1.00 13.24 H new ATOM 859 N TRP A 376 4.661 34.246 1.248 1.00 24.22 N ATOM 860 CA TRP A 376 5.029 33.017 0.549 1.00 45.44 C ATOM 861 C TRP A 376 6.371 33.175 -0.167 1.00 20.22 C ATOM 862 O TRP A 376 7.247 32.310 -0.070 1.00 54.31 O ATOM 863 CB TRP A 376 3.927 32.645 -0.449 1.00 54.52 C ATOM 864 CG TRP A 376 4.197 31.391 -1.228 1.00 33.31 C ATOM 865 CD1 TRP A 376 4.601 31.308 -2.529 1.00 22.15 C ATOM 866 CD2 TRP A 376 4.079 30.041 -0.759 1.00 54.22 C ATOM 867 NE1 TRP A 376 4.731 29.992 -2.902 1.00 1.31 N ATOM 868 CE2 TRP A 376 4.420 29.196 -1.834 1.00 44.31 C ATOM 869 CE3 TRP A 376 3.720 29.462 0.461 1.00 1.50 C ATOM 870 CZ2 TRP A 376 4.411 27.808 -1.723 1.00 0.13 C ATOM 871 CZ3 TRP A 376 3.711 28.083 0.568 1.00 24.22 C ATOM 872 CH2 TRP A 376 4.054 27.270 -0.519 1.00 12.13 C ATOM 0 H TRP A 376 3.782 34.657 0.935 1.00 24.22 H new ATOM 0 HA TRP A 376 5.136 32.216 1.281 1.00 45.44 H new ATOM 0 HB2 TRP A 376 2.988 32.528 0.092 1.00 54.52 H new ATOM 0 HB3 TRP A 376 3.792 33.471 -1.148 1.00 54.52 H new ATOM 0 HD1 TRP A 376 4.791 32.154 -3.172 1.00 22.15 H new ATOM 0 HE1 TRP A 376 5.013 29.662 -3.825 1.00 1.31 H new ATOM 0 HE3 TRP A 376 3.454 30.080 1.306 1.00 1.50 H new ATOM 0 HZ2 TRP A 376 4.677 27.179 -2.559 1.00 0.13 H new ATOM 0 HZ3 TRP A 376 3.435 27.625 1.506 1.00 24.22 H new ATOM 0 HH2 TRP A 376 4.036 26.196 -0.403 1.00 12.13 H new ATOM 883 N GLY A 377 6.530 34.296 -0.863 1.00 64.44 N ATOM 884 CA GLY A 377 7.745 34.550 -1.613 1.00 10.23 C ATOM 885 C GLY A 377 8.979 34.600 -0.735 1.00 41.30 C ATOM 886 O GLY A 377 9.992 33.975 -1.046 1.00 14.34 O ATOM 0 H GLY A 377 5.833 35.038 -0.921 1.00 64.44 H new ATOM 0 HA2 GLY A 377 7.871 33.771 -2.365 1.00 10.23 H new ATOM 0 HA3 GLY A 377 7.646 35.495 -2.146 1.00 10.23 H new ATOM 890 N ASN A 378 8.893 35.332 0.367 1.00 2.45 N ATOM 891 CA ASN A 378 10.026 35.471 1.277 1.00 22.35 C ATOM 892 C ASN A 378 10.266 34.184 2.052 1.00 52.12 C ATOM 893 O ASN A 378 11.405 33.838 2.357 1.00 11.23 O ATOM 894 CB ASN A 378 9.813 36.628 2.258 1.00 42.52 C ATOM 895 CG ASN A 378 10.078 37.983 1.633 1.00 31.43 C ATOM 896 OD1 ASN A 378 11.207 38.472 1.644 1.00 73.13 O ATOM 897 ND2 ASN A 378 9.044 38.607 1.090 1.00 33.21 N ATOM 0 H ASN A 378 8.055 35.838 0.654 1.00 2.45 H new ATOM 0 HA ASN A 378 10.903 35.686 0.667 1.00 22.35 H new ATOM 0 HB2 ASN A 378 8.789 36.599 2.631 1.00 42.52 H new ATOM 0 HB3 ASN A 378 10.469 36.495 3.118 1.00 42.52 H new ATOM 0 HD21 ASN A 378 9.169 39.524 0.662 1.00 33.21 H new ATOM 0 HD22 ASN A 378 8.122 38.170 1.100 1.00 33.21 H new ATOM 904 N HIS A 379 9.191 33.466 2.351 1.00 50.11 N ATOM 905 CA HIS A 379 9.281 32.258 3.163 1.00 42.14 C ATOM 906 C HIS A 379 10.077 31.178 2.439 1.00 50.14 C ATOM 907 O HIS A 379 10.842 30.439 3.056 1.00 52.13 O ATOM 908 CB HIS A 379 7.883 31.735 3.510 1.00 12.11 C ATOM 909 CG HIS A 379 7.834 30.943 4.780 1.00 43.34 C ATOM 910 ND1 HIS A 379 6.980 31.243 5.818 1.00 71.12 N ATOM 911 CD2 HIS A 379 8.539 29.859 5.178 1.00 62.43 C ATOM 912 CE1 HIS A 379 7.164 30.380 6.799 1.00 31.14 C ATOM 913 NE2 HIS A 379 8.105 29.528 6.438 1.00 62.20 N ATOM 0 H HIS A 379 8.247 33.699 2.044 1.00 50.11 H new ATOM 0 HA HIS A 379 9.800 32.512 4.087 1.00 42.14 H new ATOM 0 HB2 HIS A 379 7.199 32.580 3.592 1.00 12.11 H new ATOM 0 HB3 HIS A 379 7.524 31.113 2.690 1.00 12.11 H new ATOM 0 HD2 HIS A 379 9.302 29.348 4.610 1.00 62.43 H new ATOM 0 HE1 HIS A 379 6.633 30.372 7.740 1.00 31.14 H new ATOM 0 HE2 HIS A 379 8.452 28.752 7.002 1.00 62.20 H new ATOM 922 N LYS A 380 9.903 31.088 1.127 1.00 70.35 N ATOM 923 CA LYS A 380 10.625 30.094 0.347 1.00 53.41 C ATOM 924 C LYS A 380 11.819 30.724 -0.360 1.00 3.52 C ATOM 925 O LYS A 380 12.501 30.064 -1.147 1.00 22.23 O ATOM 926 CB LYS A 380 9.697 29.423 -0.668 1.00 65.15 C ATOM 927 CG LYS A 380 8.523 28.700 -0.029 1.00 70.10 C ATOM 928 CD LYS A 380 7.779 27.832 -1.033 1.00 52.21 C ATOM 929 CE LYS A 380 8.409 26.449 -1.187 1.00 31.51 C ATOM 930 NZ LYS A 380 9.801 26.499 -1.713 1.00 55.24 N ATOM 0 H LYS A 380 9.276 31.684 0.587 1.00 70.35 H new ATOM 0 HA LYS A 380 10.995 29.331 1.032 1.00 53.41 H new ATOM 0 HB2 LYS A 380 9.318 30.178 -1.356 1.00 65.15 H new ATOM 0 HB3 LYS A 380 10.273 28.712 -1.261 1.00 65.15 H new ATOM 0 HG2 LYS A 380 8.882 28.080 0.792 1.00 70.10 H new ATOM 0 HG3 LYS A 380 7.836 29.430 0.399 1.00 70.10 H new ATOM 0 HD2 LYS A 380 6.742 27.722 -0.716 1.00 52.21 H new ATOM 0 HD3 LYS A 380 7.765 28.332 -2.002 1.00 52.21 H new ATOM 0 HE2 LYS A 380 8.410 25.946 -0.220 1.00 31.51 H new ATOM 0 HE3 LYS A 380 7.794 25.848 -1.858 1.00 31.51 H new ATOM 0 HZ1 LYS A 380 10.079 25.555 -2.050 1.00 55.24 H new ATOM 0 HZ2 LYS A 380 9.850 27.176 -2.501 1.00 55.24 H new ATOM 0 HZ3 LYS A 380 10.447 26.800 -0.956 1.00 55.24 H new ATOM 944 N ASN A 381 12.069 31.997 -0.053 1.00 11.40 N ATOM 945 CA ASN A 381 13.221 32.733 -0.578 1.00 64.04 C ATOM 946 C ASN A 381 13.261 32.693 -2.108 1.00 24.21 C ATOM 947 O ASN A 381 14.176 32.120 -2.707 1.00 4.02 O ATOM 948 CB ASN A 381 14.527 32.180 0.011 1.00 32.11 C ATOM 949 CG ASN A 381 15.700 33.125 -0.177 1.00 3.13 C ATOM 950 OD1 ASN A 381 16.414 33.070 -1.180 1.00 51.33 O ATOM 951 ND2 ASN A 381 15.924 33.985 0.804 1.00 25.04 N ATOM 0 H ASN A 381 11.477 32.549 0.568 1.00 11.40 H new ATOM 0 HA ASN A 381 13.116 33.775 -0.276 1.00 64.04 H new ATOM 0 HB2 ASN A 381 14.388 31.987 1.075 1.00 32.11 H new ATOM 0 HB3 ASN A 381 14.757 31.224 -0.459 1.00 32.11 H new ATOM 0 HD21 ASN A 381 16.710 34.632 0.745 1.00 25.04 H new ATOM 0 HD22 ASN A 381 15.310 34.000 1.619 1.00 25.04 H new ATOM 958 N ARG A 382 12.239 33.258 -2.739 1.00 35.11 N ATOM 959 CA ARG A 382 12.196 33.334 -4.197 1.00 22.50 C ATOM 960 C ARG A 382 11.992 34.772 -4.660 1.00 74.31 C ATOM 961 O ARG A 382 11.249 35.539 -4.045 1.00 33.12 O ATOM 962 CB ARG A 382 11.097 32.435 -4.779 1.00 13.12 C ATOM 963 CG ARG A 382 9.729 32.633 -4.150 1.00 2.32 C ATOM 964 CD ARG A 382 8.623 32.128 -5.062 1.00 61.34 C ATOM 965 NE ARG A 382 8.900 30.793 -5.590 1.00 12.32 N ATOM 966 CZ ARG A 382 8.191 30.213 -6.559 1.00 40.13 C ATOM 967 NH1 ARG A 382 7.138 30.835 -7.079 1.00 64.23 N ATOM 968 NH2 ARG A 382 8.538 29.012 -7.004 1.00 22.14 N ATOM 0 H ARG A 382 11.432 33.669 -2.269 1.00 35.11 H new ATOM 0 HA ARG A 382 13.157 32.976 -4.566 1.00 22.50 H new ATOM 0 HB2 ARG A 382 11.022 32.621 -5.850 1.00 13.12 H new ATOM 0 HB3 ARG A 382 11.393 31.393 -4.656 1.00 13.12 H new ATOM 0 HG2 ARG A 382 9.685 32.107 -3.196 1.00 2.32 H new ATOM 0 HG3 ARG A 382 9.574 33.691 -3.938 1.00 2.32 H new ATOM 0 HD2 ARG A 382 7.682 32.110 -4.512 1.00 61.34 H new ATOM 0 HD3 ARG A 382 8.494 32.824 -5.891 1.00 61.34 H new ATOM 0 HE ARG A 382 9.683 30.274 -5.193 1.00 12.32 H new ATOM 0 HH11 ARG A 382 6.871 31.758 -6.737 1.00 64.23 H new ATOM 0 HH12 ARG A 382 6.597 30.389 -7.820 1.00 64.23 H new ATOM 0 HH21 ARG A 382 9.346 28.534 -6.605 1.00 22.14 H new ATOM 0 HH22 ARG A 382 7.997 28.567 -7.745 1.00 22.14 H new ATOM 982 N THR A 383 12.659 35.127 -5.748 1.00 71.54 N ATOM 983 CA THR A 383 12.587 36.473 -6.293 1.00 3.51 C ATOM 984 C THR A 383 11.280 36.688 -7.055 1.00 44.21 C ATOM 985 O THR A 383 10.892 35.860 -7.880 1.00 14.43 O ATOM 986 CB THR A 383 13.770 36.738 -7.244 1.00 12.31 C ATOM 987 OG1 THR A 383 14.987 36.249 -6.661 1.00 22.11 O ATOM 988 CG2 THR A 383 13.915 38.223 -7.541 1.00 52.41 C ATOM 0 H THR A 383 13.261 34.494 -6.275 1.00 71.54 H new ATOM 0 HA THR A 383 12.630 37.167 -5.454 1.00 3.51 H new ATOM 0 HB THR A 383 13.572 36.215 -8.179 1.00 12.31 H new ATOM 0 HG1 THR A 383 15.734 36.419 -7.272 1.00 22.11 H new ATOM 0 HG21 THR A 383 14.758 38.379 -8.214 1.00 52.41 H new ATOM 0 HG22 THR A 383 13.003 38.591 -8.010 1.00 52.41 H new ATOM 0 HG23 THR A 383 14.089 38.765 -6.611 1.00 52.41 H new ATOM 996 N ASN A 384 10.606 37.797 -6.749 1.00 34.23 N ATOM 997 CA ASN A 384 9.401 38.217 -7.468 1.00 1.45 C ATOM 998 C ASN A 384 8.279 37.188 -7.382 1.00 2.04 C ATOM 999 O ASN A 384 8.026 36.443 -8.331 1.00 14.31 O ATOM 1000 CB ASN A 384 9.711 38.526 -8.940 1.00 72.31 C ATOM 1001 CG ASN A 384 10.452 39.836 -9.120 1.00 74.35 C ATOM 1002 OD1 ASN A 384 11.682 39.881 -9.102 1.00 44.11 O ATOM 1003 ND2 ASN A 384 9.707 40.913 -9.301 1.00 75.43 N ATOM 0 H ASN A 384 10.879 38.429 -5.997 1.00 34.23 H new ATOM 0 HA ASN A 384 9.056 39.126 -6.976 1.00 1.45 H new ATOM 0 HB2 ASN A 384 10.307 37.716 -9.359 1.00 72.31 H new ATOM 0 HB3 ASN A 384 8.779 38.560 -9.504 1.00 72.31 H new ATOM 0 HD21 ASN A 384 10.149 41.823 -9.432 1.00 75.43 H new ATOM 0 HD22 ASN A 384 8.690 40.834 -9.309 1.00 75.43 H new ATOM 1010 N MET A 385 7.610 37.137 -6.243 1.00 55.42 N ATOM 1011 CA MET A 385 6.454 36.270 -6.093 1.00 22.34 C ATOM 1012 C MET A 385 5.187 37.108 -6.008 1.00 55.34 C ATOM 1013 O MET A 385 4.894 37.708 -4.976 1.00 63.33 O ATOM 1014 CB MET A 385 6.584 35.382 -4.854 1.00 11.34 C ATOM 1015 CG MET A 385 5.432 34.401 -4.697 1.00 42.41 C ATOM 1016 SD MET A 385 5.270 33.301 -6.120 1.00 2.20 S ATOM 1017 CE MET A 385 3.795 32.384 -5.679 1.00 43.04 C ATOM 0 H MET A 385 7.845 37.682 -5.413 1.00 55.42 H new ATOM 0 HA MET A 385 6.399 35.620 -6.966 1.00 22.34 H new ATOM 0 HB2 MET A 385 7.521 34.827 -4.909 1.00 11.34 H new ATOM 0 HB3 MET A 385 6.639 36.013 -3.967 1.00 11.34 H new ATOM 0 HG2 MET A 385 5.584 33.806 -3.796 1.00 42.41 H new ATOM 0 HG3 MET A 385 4.503 34.954 -4.560 1.00 42.41 H new ATOM 0 HE1 MET A 385 4.044 31.329 -5.561 1.00 43.04 H new ATOM 0 HE2 MET A 385 3.394 32.769 -4.741 1.00 43.04 H new ATOM 0 HE3 MET A 385 3.049 32.495 -6.466 1.00 43.04 H new ATOM 1027 N THR A 386 4.457 37.171 -7.110 1.00 33.23 N ATOM 1028 CA THR A 386 3.225 37.936 -7.163 1.00 15.50 C ATOM 1029 C THR A 386 2.020 37.029 -6.930 1.00 72.31 C ATOM 1030 O THR A 386 2.102 35.808 -7.110 1.00 32.25 O ATOM 1031 CB THR A 386 3.074 38.679 -8.515 1.00 50.11 C ATOM 1032 OG1 THR A 386 1.791 39.313 -8.597 1.00 31.10 O ATOM 1033 CG2 THR A 386 3.243 37.726 -9.690 1.00 52.43 C ATOM 0 H THR A 386 4.699 36.699 -7.982 1.00 33.23 H new ATOM 0 HA THR A 386 3.269 38.682 -6.370 1.00 15.50 H new ATOM 0 HB THR A 386 3.857 39.435 -8.564 1.00 50.11 H new ATOM 0 HG1 THR A 386 1.711 39.779 -9.455 1.00 31.10 H new ATOM 0 HG21 THR A 386 3.132 38.277 -10.624 1.00 52.43 H new ATOM 0 HG22 THR A 386 4.234 37.273 -9.652 1.00 52.43 H new ATOM 0 HG23 THR A 386 2.485 36.945 -9.637 1.00 52.43 H new ATOM 1041 N TYR A 387 0.905 37.632 -6.539 1.00 42.15 N ATOM 1042 CA TYR A 387 -0.319 36.896 -6.261 1.00 34.31 C ATOM 1043 C TYR A 387 -0.834 36.214 -7.528 1.00 30.35 C ATOM 1044 O TYR A 387 -1.552 35.218 -7.457 1.00 33.34 O ATOM 1045 CB TYR A 387 -1.382 37.844 -5.694 1.00 62.23 C ATOM 1046 CG TYR A 387 -2.634 37.148 -5.197 1.00 13.34 C ATOM 1047 CD1 TYR A 387 -2.642 36.488 -3.975 1.00 75.01 C ATOM 1048 CD2 TYR A 387 -3.805 37.157 -5.945 1.00 52.22 C ATOM 1049 CE1 TYR A 387 -3.780 35.855 -3.512 1.00 12.13 C ATOM 1050 CE2 TYR A 387 -4.948 36.526 -5.488 1.00 41.20 C ATOM 1051 CZ TYR A 387 -4.929 35.876 -4.272 1.00 20.00 C ATOM 1052 OH TYR A 387 -6.065 35.249 -3.815 1.00 2.22 O ATOM 0 H TYR A 387 0.824 38.640 -6.406 1.00 42.15 H new ATOM 0 HA TYR A 387 -0.104 36.125 -5.521 1.00 34.31 H new ATOM 0 HB2 TYR A 387 -0.945 38.412 -4.873 1.00 62.23 H new ATOM 0 HB3 TYR A 387 -1.661 38.562 -6.465 1.00 62.23 H new ATOM 0 HD1 TYR A 387 -1.743 36.469 -3.376 1.00 75.01 H new ATOM 0 HD2 TYR A 387 -3.823 37.665 -6.898 1.00 52.22 H new ATOM 0 HE1 TYR A 387 -3.769 35.346 -2.559 1.00 12.13 H new ATOM 0 HE2 TYR A 387 -5.851 36.542 -6.081 1.00 41.20 H new ATOM 0 HH TYR A 387 -6.786 35.359 -4.470 1.00 2.22 H new ATOM 1062 N GLU A 388 -0.449 36.741 -8.688 1.00 12.40 N ATOM 1063 CA GLU A 388 -0.859 36.151 -9.955 1.00 52.20 C ATOM 1064 C GLU A 388 -0.221 34.780 -10.146 1.00 65.23 C ATOM 1065 O GLU A 388 -0.846 33.877 -10.692 1.00 34.13 O ATOM 1066 CB GLU A 388 -0.523 37.063 -11.131 1.00 41.14 C ATOM 1067 CG GLU A 388 -1.240 38.401 -11.077 1.00 42.15 C ATOM 1068 CD GLU A 388 -1.257 39.104 -12.416 1.00 12.12 C ATOM 1069 OE1 GLU A 388 -0.230 39.706 -12.791 1.00 74.33 O ATOM 1070 OE2 GLU A 388 -2.297 39.053 -13.106 1.00 31.31 O ATOM 0 H GLU A 388 0.141 37.568 -8.775 1.00 12.40 H new ATOM 0 HA GLU A 388 -1.942 36.029 -9.924 1.00 52.20 H new ATOM 0 HB2 GLU A 388 0.553 37.236 -11.152 1.00 41.14 H new ATOM 0 HB3 GLU A 388 -0.783 36.557 -12.061 1.00 41.14 H new ATOM 0 HG2 GLU A 388 -2.265 38.247 -10.738 1.00 42.15 H new ATOM 0 HG3 GLU A 388 -0.754 39.041 -10.341 1.00 42.15 H new ATOM 1077 N LYS A 389 1.014 34.618 -9.677 1.00 64.03 N ATOM 1078 CA LYS A 389 1.669 33.314 -9.711 1.00 71.52 C ATOM 1079 C LYS A 389 0.932 32.352 -8.788 1.00 51.55 C ATOM 1080 O LYS A 389 0.690 31.194 -9.131 1.00 3.25 O ATOM 1081 CB LYS A 389 3.140 33.420 -9.291 1.00 10.15 C ATOM 1082 CG LYS A 389 4.026 34.129 -10.301 1.00 33.21 C ATOM 1083 CD LYS A 389 5.480 34.129 -9.856 1.00 53.53 C ATOM 1084 CE LYS A 389 6.382 34.782 -10.891 1.00 54.10 C ATOM 1085 NZ LYS A 389 7.804 34.808 -10.460 1.00 5.23 N ATOM 0 H LYS A 389 1.577 35.366 -9.272 1.00 64.03 H new ATOM 0 HA LYS A 389 1.639 32.939 -10.734 1.00 71.52 H new ATOM 0 HB2 LYS A 389 3.197 33.949 -8.340 1.00 10.15 H new ATOM 0 HB3 LYS A 389 3.531 32.417 -9.122 1.00 10.15 H new ATOM 0 HG2 LYS A 389 3.940 33.639 -11.271 1.00 33.21 H new ATOM 0 HG3 LYS A 389 3.683 35.155 -10.431 1.00 33.21 H new ATOM 0 HD2 LYS A 389 5.571 34.658 -8.908 1.00 53.53 H new ATOM 0 HD3 LYS A 389 5.808 33.104 -9.682 1.00 53.53 H new ATOM 0 HE2 LYS A 389 6.300 34.242 -11.834 1.00 54.10 H new ATOM 0 HE3 LYS A 389 6.042 35.801 -11.076 1.00 54.10 H new ATOM 0 HZ1 LYS A 389 8.416 34.937 -11.291 1.00 5.23 H new ATOM 0 HZ2 LYS A 389 7.951 35.595 -9.796 1.00 5.23 H new ATOM 0 HZ3 LYS A 389 8.041 33.911 -9.991 1.00 5.23 H new ATOM 1099 N MET A 390 0.554 32.865 -7.623 1.00 31.24 N ATOM 1100 CA MET A 390 -0.223 32.110 -6.647 1.00 34.23 C ATOM 1101 C MET A 390 -1.567 31.696 -7.244 1.00 74.11 C ATOM 1102 O MET A 390 -2.053 30.592 -7.001 1.00 15.11 O ATOM 1103 CB MET A 390 -0.438 32.952 -5.384 1.00 12.32 C ATOM 1104 CG MET A 390 -1.240 32.249 -4.298 1.00 43.11 C ATOM 1105 SD MET A 390 -1.347 33.218 -2.780 1.00 20.33 S ATOM 1106 CE MET A 390 0.385 33.331 -2.328 1.00 3.33 C ATOM 0 H MET A 390 0.777 33.816 -7.328 1.00 31.24 H new ATOM 0 HA MET A 390 0.329 31.209 -6.379 1.00 34.23 H new ATOM 0 HB2 MET A 390 0.534 33.234 -4.978 1.00 12.32 H new ATOM 0 HB3 MET A 390 -0.949 33.875 -5.658 1.00 12.32 H new ATOM 0 HG2 MET A 390 -2.245 32.046 -4.667 1.00 43.11 H new ATOM 0 HG3 MET A 390 -0.781 31.285 -4.078 1.00 43.11 H new ATOM 0 HE1 MET A 390 0.473 33.745 -1.323 1.00 3.33 H new ATOM 0 HE2 MET A 390 0.833 32.338 -2.352 1.00 3.33 H new ATOM 0 HE3 MET A 390 0.904 33.980 -3.034 1.00 3.33 H new ATOM 1116 N SER A 391 -2.151 32.598 -8.030 1.00 13.43 N ATOM 1117 CA SER A 391 -3.448 32.370 -8.658 1.00 20.54 C ATOM 1118 C SER A 391 -3.468 31.079 -9.478 1.00 74.14 C ATOM 1119 O SER A 391 -4.482 30.380 -9.505 1.00 52.21 O ATOM 1120 CB SER A 391 -3.813 33.559 -9.549 1.00 13.45 C ATOM 1121 OG SER A 391 -3.912 34.749 -8.789 1.00 74.52 O ATOM 0 H SER A 391 -1.739 33.505 -8.248 1.00 13.43 H new ATOM 0 HA SER A 391 -4.185 32.267 -7.862 1.00 20.54 H new ATOM 0 HB2 SER A 391 -3.059 33.681 -10.326 1.00 13.45 H new ATOM 0 HB3 SER A 391 -4.760 33.364 -10.052 1.00 13.45 H new ATOM 0 HG SER A 391 -3.030 34.984 -8.433 1.00 74.52 H new ATOM 1127 N ARG A 392 -2.355 30.753 -10.132 1.00 21.53 N ATOM 1128 CA ARG A 392 -2.286 29.536 -10.942 1.00 60.54 C ATOM 1129 C ARG A 392 -2.347 28.296 -10.058 1.00 52.24 C ATOM 1130 O ARG A 392 -2.944 27.288 -10.431 1.00 45.54 O ATOM 1131 CB ARG A 392 -1.027 29.502 -11.819 1.00 40.35 C ATOM 1132 CG ARG A 392 -1.146 30.321 -13.099 1.00 2.43 C ATOM 1133 CD ARG A 392 -1.118 31.812 -12.819 1.00 32.11 C ATOM 1134 NE ARG A 392 -1.479 32.611 -13.991 1.00 11.30 N ATOM 1135 CZ ARG A 392 -0.823 33.705 -14.373 1.00 52.21 C ATOM 1136 NH1 ARG A 392 0.316 34.041 -13.776 1.00 3.52 N ATOM 1137 NH2 ARG A 392 -1.285 34.443 -15.376 1.00 71.44 N ATOM 0 H ARG A 392 -1.498 31.306 -10.119 1.00 21.53 H new ATOM 0 HA ARG A 392 -3.151 29.541 -11.605 1.00 60.54 H new ATOM 0 HB2 ARG A 392 -0.182 29.872 -11.239 1.00 40.35 H new ATOM 0 HB3 ARG A 392 -0.805 28.467 -12.080 1.00 40.35 H new ATOM 0 HG2 ARG A 392 -0.329 30.062 -13.773 1.00 2.43 H new ATOM 0 HG3 ARG A 392 -2.074 30.064 -13.610 1.00 2.43 H new ATOM 0 HD2 ARG A 392 -1.806 32.038 -12.004 1.00 32.11 H new ATOM 0 HD3 ARG A 392 -0.121 32.096 -12.483 1.00 32.11 H new ATOM 0 HE ARG A 392 -2.280 32.312 -14.548 1.00 11.30 H new ATOM 0 HH11 ARG A 392 0.688 33.461 -13.024 1.00 3.52 H new ATOM 0 HH12 ARG A 392 0.818 34.879 -14.069 1.00 3.52 H new ATOM 0 HH21 ARG A 392 -2.144 34.172 -15.855 1.00 71.44 H new ATOM 0 HH22 ARG A 392 -0.781 35.281 -15.667 1.00 71.44 H new ATOM 1151 N ALA A 393 -1.734 28.373 -8.882 1.00 51.34 N ATOM 1152 CA ALA A 393 -1.785 27.278 -7.924 1.00 62.24 C ATOM 1153 C ALA A 393 -3.191 27.145 -7.351 1.00 5.03 C ATOM 1154 O ALA A 393 -3.671 26.038 -7.104 1.00 22.23 O ATOM 1155 CB ALA A 393 -0.773 27.497 -6.810 1.00 53.12 C ATOM 0 H ALA A 393 -1.197 29.182 -8.571 1.00 51.34 H new ATOM 0 HA ALA A 393 -1.531 26.352 -8.440 1.00 62.24 H new ATOM 0 HB1 ALA A 393 -0.825 26.669 -6.103 1.00 53.12 H new ATOM 0 HB2 ALA A 393 0.230 27.549 -7.234 1.00 53.12 H new ATOM 0 HB3 ALA A 393 -0.997 28.430 -6.293 1.00 53.12 H new ATOM 1161 N LEU A 394 -3.844 28.287 -7.150 1.00 32.22 N ATOM 1162 CA LEU A 394 -5.211 28.323 -6.639 1.00 20.23 C ATOM 1163 C LEU A 394 -6.180 27.681 -7.627 1.00 1.42 C ATOM 1164 O LEU A 394 -7.119 26.998 -7.225 1.00 23.21 O ATOM 1165 CB LEU A 394 -5.638 29.766 -6.356 1.00 2.54 C ATOM 1166 CG LEU A 394 -4.816 30.494 -5.289 1.00 22.21 C ATOM 1167 CD1 LEU A 394 -5.273 31.939 -5.159 1.00 11.34 C ATOM 1168 CD2 LEU A 394 -4.922 29.776 -3.949 1.00 0.43 C ATOM 0 H LEU A 394 -3.444 29.207 -7.335 1.00 32.22 H new ATOM 0 HA LEU A 394 -5.237 27.755 -5.709 1.00 20.23 H new ATOM 0 HB2 LEU A 394 -5.581 30.333 -7.285 1.00 2.54 H new ATOM 0 HB3 LEU A 394 -6.683 29.764 -6.047 1.00 2.54 H new ATOM 0 HG LEU A 394 -3.771 30.490 -5.598 1.00 22.21 H new ATOM 0 HD11 LEU A 394 -4.678 32.442 -4.396 1.00 11.34 H new ATOM 0 HD12 LEU A 394 -5.144 32.449 -6.114 1.00 11.34 H new ATOM 0 HD13 LEU A 394 -6.325 31.964 -4.874 1.00 11.34 H new ATOM 0 HD21 LEU A 394 -4.331 30.308 -3.203 1.00 0.43 H new ATOM 0 HD22 LEU A 394 -5.965 29.748 -3.633 1.00 0.43 H new ATOM 0 HD23 LEU A 394 -4.546 28.758 -4.051 1.00 0.43 H new ATOM 1180 N ARG A 395 -5.940 27.904 -8.921 1.00 21.04 N ATOM 1181 CA ARG A 395 -6.772 27.326 -9.981 1.00 60.14 C ATOM 1182 C ARG A 395 -6.867 25.814 -9.835 1.00 61.43 C ATOM 1183 O ARG A 395 -7.930 25.222 -10.024 1.00 53.23 O ATOM 1184 CB ARG A 395 -6.199 27.666 -11.358 1.00 3.42 C ATOM 1185 CG ARG A 395 -6.930 28.784 -12.086 1.00 14.44 C ATOM 1186 CD ARG A 395 -6.929 30.079 -11.295 1.00 52.12 C ATOM 1187 NE ARG A 395 -7.368 31.207 -12.111 1.00 54.41 N ATOM 1188 CZ ARG A 395 -7.238 32.480 -11.753 1.00 75.31 C ATOM 1189 NH1 ARG A 395 -6.794 32.794 -10.542 1.00 24.02 N ATOM 1190 NH2 ARG A 395 -7.565 33.440 -12.603 1.00 2.34 N ATOM 0 H ARG A 395 -5.173 28.483 -9.262 1.00 21.04 H new ATOM 0 HA ARG A 395 -7.770 27.754 -9.889 1.00 60.14 H new ATOM 0 HB2 ARG A 395 -5.152 27.948 -11.243 1.00 3.42 H new ATOM 0 HB3 ARG A 395 -6.221 26.770 -11.978 1.00 3.42 H new ATOM 0 HG2 ARG A 395 -6.461 28.952 -13.055 1.00 14.44 H new ATOM 0 HG3 ARG A 395 -7.958 28.478 -12.278 1.00 14.44 H new ATOM 0 HD2 ARG A 395 -7.584 29.978 -10.430 1.00 52.12 H new ATOM 0 HD3 ARG A 395 -5.926 30.273 -10.914 1.00 52.12 H new ATOM 0 HE ARG A 395 -7.802 31.005 -13.012 1.00 54.41 H new ATOM 0 HH11 ARG A 395 -6.551 32.056 -9.881 1.00 24.02 H new ATOM 0 HH12 ARG A 395 -6.696 33.773 -10.273 1.00 24.02 H new ATOM 0 HH21 ARG A 395 -7.916 33.202 -13.531 1.00 2.34 H new ATOM 0 HH22 ARG A 395 -7.466 34.418 -12.330 1.00 2.34 H new ATOM 1204 N HIS A 396 -5.751 25.205 -9.466 1.00 20.30 N ATOM 1205 CA HIS A 396 -5.672 23.759 -9.324 1.00 41.54 C ATOM 1206 C HIS A 396 -6.610 23.271 -8.224 1.00 44.40 C ATOM 1207 O HIS A 396 -7.111 22.150 -8.274 1.00 52.23 O ATOM 1208 CB HIS A 396 -4.233 23.346 -9.004 1.00 54.31 C ATOM 1209 CG HIS A 396 -4.002 21.867 -9.053 1.00 52.14 C ATOM 1210 ND1 HIS A 396 -4.165 21.041 -7.963 1.00 11.32 N ATOM 1211 CD2 HIS A 396 -3.601 21.073 -10.067 1.00 12.22 C ATOM 1212 CE1 HIS A 396 -3.872 19.803 -8.309 1.00 61.20 C ATOM 1213 NE2 HIS A 396 -3.523 19.791 -9.582 1.00 70.43 N ATOM 0 H HIS A 396 -4.881 25.694 -9.258 1.00 20.30 H new ATOM 0 HA HIS A 396 -5.978 23.302 -10.265 1.00 41.54 H new ATOM 0 HB2 HIS A 396 -3.560 23.833 -9.710 1.00 54.31 H new ATOM 0 HB3 HIS A 396 -3.972 23.712 -8.011 1.00 54.31 H new ATOM 0 HD2 HIS A 396 -3.381 21.388 -11.076 1.00 12.22 H new ATOM 0 HE1 HIS A 396 -3.911 18.942 -7.659 1.00 61.20 H new ATOM 0 HE2 HIS A 396 -3.243 18.968 -10.115 1.00 70.43 H new ATOM 1222 N TYR A 397 -6.855 24.122 -7.239 1.00 33.40 N ATOM 1223 CA TYR A 397 -7.686 23.745 -6.106 1.00 12.10 C ATOM 1224 C TYR A 397 -9.150 24.075 -6.366 1.00 42.43 C ATOM 1225 O TYR A 397 -10.039 23.569 -5.679 1.00 60.44 O ATOM 1226 CB TYR A 397 -7.179 24.411 -4.825 1.00 64.30 C ATOM 1227 CG TYR A 397 -5.774 23.980 -4.468 1.00 11.34 C ATOM 1228 CD1 TYR A 397 -5.431 22.635 -4.473 1.00 20.22 C ATOM 1229 CD2 TYR A 397 -4.791 24.907 -4.149 1.00 62.12 C ATOM 1230 CE1 TYR A 397 -4.153 22.222 -4.167 1.00 61.24 C ATOM 1231 CE2 TYR A 397 -3.504 24.501 -3.846 1.00 41.44 C ATOM 1232 CZ TYR A 397 -3.192 23.155 -3.855 1.00 25.33 C ATOM 1233 OH TYR A 397 -1.913 22.740 -3.568 1.00 30.43 O ATOM 0 H TYR A 397 -6.492 25.074 -7.201 1.00 33.40 H new ATOM 0 HA TYR A 397 -7.616 22.665 -5.973 1.00 12.10 H new ATOM 0 HB2 TYR A 397 -7.204 25.494 -4.947 1.00 64.30 H new ATOM 0 HB3 TYR A 397 -7.851 24.168 -4.002 1.00 64.30 H new ATOM 0 HD1 TYR A 397 -6.180 21.898 -4.722 1.00 20.22 H new ATOM 0 HD2 TYR A 397 -5.034 25.959 -4.137 1.00 62.12 H new ATOM 0 HE1 TYR A 397 -3.907 21.170 -4.172 1.00 61.24 H new ATOM 0 HE2 TYR A 397 -2.747 25.232 -3.604 1.00 41.44 H new ATOM 0 HH TYR A 397 -1.533 23.311 -2.868 1.00 30.43 H new ATOM 1243 N TYR A 398 -9.402 24.912 -7.364 1.00 51.42 N ATOM 1244 CA TYR A 398 -10.767 25.157 -7.813 1.00 22.10 C ATOM 1245 C TYR A 398 -11.229 23.983 -8.664 1.00 73.15 C ATOM 1246 O TYR A 398 -12.356 23.505 -8.537 1.00 51.31 O ATOM 1247 CB TYR A 398 -10.871 26.443 -8.640 1.00 54.12 C ATOM 1248 CG TYR A 398 -10.375 27.689 -7.943 1.00 60.04 C ATOM 1249 CD1 TYR A 398 -10.720 27.966 -6.627 1.00 14.22 C ATOM 1250 CD2 TYR A 398 -9.566 28.595 -8.613 1.00 62.54 C ATOM 1251 CE1 TYR A 398 -10.271 29.113 -6.000 1.00 51.01 C ATOM 1252 CE2 TYR A 398 -9.112 29.741 -7.994 1.00 43.43 C ATOM 1253 CZ TYR A 398 -9.465 29.995 -6.688 1.00 3.33 C ATOM 1254 OH TYR A 398 -9.012 31.137 -6.071 1.00 64.40 O ATOM 0 H TYR A 398 -8.686 25.429 -7.875 1.00 51.42 H new ATOM 0 HA TYR A 398 -11.397 25.269 -6.931 1.00 22.10 H new ATOM 0 HB2 TYR A 398 -10.306 26.311 -9.563 1.00 54.12 H new ATOM 0 HB3 TYR A 398 -11.913 26.593 -8.923 1.00 54.12 H new ATOM 0 HD1 TYR A 398 -11.349 27.275 -6.085 1.00 14.22 H new ATOM 0 HD2 TYR A 398 -9.287 28.400 -9.638 1.00 62.54 H new ATOM 0 HE1 TYR A 398 -10.550 29.317 -4.977 1.00 51.01 H new ATOM 0 HE2 TYR A 398 -8.483 30.435 -8.531 1.00 43.43 H new ATOM 0 HH TYR A 398 -9.609 31.367 -5.329 1.00 64.40 H new ATOM 1264 N LYS A 399 -10.330 23.520 -9.524 1.00 1.20 N ATOM 1265 CA LYS A 399 -10.614 22.412 -10.427 1.00 30.34 C ATOM 1266 C LYS A 399 -10.677 21.089 -9.671 1.00 31.43 C ATOM 1267 O LYS A 399 -11.380 20.168 -10.077 1.00 74.01 O ATOM 1268 CB LYS A 399 -9.544 22.343 -11.517 1.00 4.43 C ATOM 1269 CG LYS A 399 -9.511 23.574 -12.405 1.00 55.14 C ATOM 1270 CD LYS A 399 -8.353 23.533 -13.389 1.00 64.43 C ATOM 1271 CE LYS A 399 -8.445 22.339 -14.326 1.00 72.12 C ATOM 1272 NZ LYS A 399 -7.417 22.395 -15.398 1.00 63.41 N ATOM 0 H LYS A 399 -9.388 23.900 -9.615 1.00 1.20 H new ATOM 0 HA LYS A 399 -11.587 22.586 -10.886 1.00 30.34 H new ATOM 0 HB2 LYS A 399 -8.568 22.214 -11.050 1.00 4.43 H new ATOM 0 HB3 LYS A 399 -9.721 21.463 -12.135 1.00 4.43 H new ATOM 0 HG2 LYS A 399 -10.450 23.652 -12.953 1.00 55.14 H new ATOM 0 HG3 LYS A 399 -9.429 24.467 -11.785 1.00 55.14 H new ATOM 0 HD2 LYS A 399 -8.341 24.453 -13.974 1.00 64.43 H new ATOM 0 HD3 LYS A 399 -7.412 23.492 -12.840 1.00 64.43 H new ATOM 0 HE2 LYS A 399 -8.324 21.419 -13.754 1.00 72.12 H new ATOM 0 HE3 LYS A 399 -9.437 22.306 -14.776 1.00 72.12 H new ATOM 0 HZ1 LYS A 399 -7.513 21.564 -16.015 1.00 63.41 H new ATOM 0 HZ2 LYS A 399 -7.548 23.260 -15.960 1.00 63.41 H new ATOM 0 HZ3 LYS A 399 -6.469 22.400 -14.970 1.00 63.41 H new ATOM 1286 N LEU A 400 -9.942 20.999 -8.570 1.00 13.41 N ATOM 1287 CA LEU A 400 -9.930 19.781 -7.764 1.00 74.34 C ATOM 1288 C LEU A 400 -11.065 19.806 -6.738 1.00 0.22 C ATOM 1289 O LEU A 400 -11.239 18.864 -5.963 1.00 34.31 O ATOM 1290 CB LEU A 400 -8.572 19.612 -7.068 1.00 73.42 C ATOM 1291 CG LEU A 400 -8.335 18.248 -6.410 1.00 44.03 C ATOM 1292 CD1 LEU A 400 -8.452 17.130 -7.438 1.00 12.14 C ATOM 1293 CD2 LEU A 400 -6.969 18.215 -5.738 1.00 52.42 C ATOM 0 H LEU A 400 -9.349 21.749 -8.215 1.00 13.41 H new ATOM 0 HA LEU A 400 -10.085 18.927 -8.424 1.00 74.34 H new ATOM 0 HB2 LEU A 400 -7.784 19.785 -7.801 1.00 73.42 H new ATOM 0 HB3 LEU A 400 -8.475 20.386 -6.306 1.00 73.42 H new ATOM 0 HG LEU A 400 -9.100 18.094 -5.649 1.00 44.03 H new ATOM 0 HD11 LEU A 400 -8.281 16.169 -6.952 1.00 12.14 H new ATOM 0 HD12 LEU A 400 -9.450 17.142 -7.877 1.00 12.14 H new ATOM 0 HD13 LEU A 400 -7.709 17.278 -8.222 1.00 12.14 H new ATOM 0 HD21 LEU A 400 -6.815 17.240 -5.275 1.00 52.42 H new ATOM 0 HD22 LEU A 400 -6.193 18.390 -6.483 1.00 52.42 H new ATOM 0 HD23 LEU A 400 -6.920 18.991 -4.974 1.00 52.42 H new ATOM 1305 N ASN A 401 -11.840 20.891 -6.759 1.00 34.12 N ATOM 1306 CA ASN A 401 -12.998 21.052 -5.878 1.00 41.14 C ATOM 1307 C ASN A 401 -12.585 21.069 -4.410 1.00 42.44 C ATOM 1308 O ASN A 401 -13.180 20.390 -3.574 1.00 74.03 O ATOM 1309 CB ASN A 401 -14.043 19.952 -6.118 1.00 62.44 C ATOM 1310 CG ASN A 401 -14.610 19.961 -7.527 1.00 33.53 C ATOM 1311 OD1 ASN A 401 -15.005 18.921 -8.050 1.00 32.35 O ATOM 1312 ND2 ASN A 401 -14.671 21.132 -8.148 1.00 63.30 N ATOM 0 H ASN A 401 -11.684 21.681 -7.385 1.00 34.12 H new ATOM 0 HA ASN A 401 -13.449 22.015 -6.120 1.00 41.14 H new ATOM 0 HB2 ASN A 401 -13.589 18.980 -5.922 1.00 62.44 H new ATOM 0 HB3 ASN A 401 -14.858 20.073 -5.405 1.00 62.44 H new ATOM 0 HD21 ASN A 401 -15.055 21.190 -9.091 1.00 63.30 H new ATOM 0 HD22 ASN A 401 -14.334 21.974 -7.682 1.00 63.30 H new ATOM 1319 N ILE A 402 -11.551 21.834 -4.102 1.00 55.23 N ATOM 1320 CA ILE A 402 -11.142 22.028 -2.720 1.00 11.53 C ATOM 1321 C ILE A 402 -11.620 23.387 -2.227 1.00 55.03 C ATOM 1322 O ILE A 402 -12.159 23.511 -1.125 1.00 65.42 O ATOM 1323 CB ILE A 402 -9.609 21.921 -2.551 1.00 54.11 C ATOM 1324 CG1 ILE A 402 -9.127 20.538 -2.995 1.00 72.13 C ATOM 1325 CG2 ILE A 402 -9.206 22.188 -1.106 1.00 55.34 C ATOM 1326 CD1 ILE A 402 -7.634 20.337 -2.848 1.00 31.34 C ATOM 0 H ILE A 402 -10.981 22.330 -4.787 1.00 55.23 H new ATOM 0 HA ILE A 402 -11.597 21.236 -2.126 1.00 11.53 H new ATOM 0 HB ILE A 402 -9.137 22.676 -3.180 1.00 54.11 H new ATOM 0 HG12 ILE A 402 -9.646 19.778 -2.411 1.00 72.13 H new ATOM 0 HG13 ILE A 402 -9.404 20.384 -4.038 1.00 72.13 H new ATOM 0 HG21 ILE A 402 -8.123 22.108 -1.009 1.00 55.34 H new ATOM 0 HG22 ILE A 402 -9.522 23.191 -0.819 1.00 55.34 H new ATOM 0 HG23 ILE A 402 -9.684 21.457 -0.454 1.00 55.34 H new ATOM 0 HD11 ILE A 402 -7.367 19.334 -3.182 1.00 31.34 H new ATOM 0 HD12 ILE A 402 -7.106 21.074 -3.454 1.00 31.34 H new ATOM 0 HD13 ILE A 402 -7.352 20.458 -1.802 1.00 31.34 H new ATOM 1338 N ILE A 403 -11.440 24.399 -3.066 1.00 4.33 N ATOM 1339 CA ILE A 403 -11.856 25.756 -2.742 1.00 42.40 C ATOM 1340 C ILE A 403 -12.903 26.232 -3.742 1.00 0.02 C ATOM 1341 O ILE A 403 -12.774 25.996 -4.945 1.00 23.33 O ATOM 1342 CB ILE A 403 -10.654 26.733 -2.755 1.00 42.05 C ATOM 1343 CG1 ILE A 403 -9.585 26.292 -1.747 1.00 72.50 C ATOM 1344 CG2 ILE A 403 -11.105 28.161 -2.460 1.00 35.41 C ATOM 1345 CD1 ILE A 403 -10.057 26.297 -0.307 1.00 50.05 C ATOM 0 H ILE A 403 -11.005 24.303 -3.983 1.00 4.33 H new ATOM 0 HA ILE A 403 -12.280 25.744 -1.738 1.00 42.40 H new ATOM 0 HB ILE A 403 -10.218 26.713 -3.754 1.00 42.05 H new ATOM 0 HG12 ILE A 403 -9.249 25.288 -2.005 1.00 72.50 H new ATOM 0 HG13 ILE A 403 -8.721 26.950 -1.838 1.00 72.50 H new ATOM 0 HG21 ILE A 403 -10.241 28.826 -2.475 1.00 35.41 H new ATOM 0 HG22 ILE A 403 -11.822 28.480 -3.217 1.00 35.41 H new ATOM 0 HG23 ILE A 403 -11.574 28.199 -1.477 1.00 35.41 H new ATOM 0 HD11 ILE A 403 -9.244 25.973 0.343 1.00 50.05 H new ATOM 0 HD12 ILE A 403 -10.365 27.305 -0.029 1.00 50.05 H new ATOM 0 HD13 ILE A 403 -10.901 25.616 -0.199 1.00 50.05 H new ATOM 1357 N ARG A 404 -13.941 26.884 -3.241 1.00 75.35 N ATOM 1358 CA ARG A 404 -14.992 27.417 -4.090 1.00 1.21 C ATOM 1359 C ARG A 404 -15.188 28.899 -3.804 1.00 72.53 C ATOM 1360 O ARG A 404 -14.896 29.373 -2.705 1.00 42.43 O ATOM 1361 CB ARG A 404 -16.316 26.680 -3.858 1.00 41.15 C ATOM 1362 CG ARG A 404 -16.867 26.854 -2.449 1.00 52.52 C ATOM 1363 CD ARG A 404 -18.387 26.830 -2.424 1.00 40.12 C ATOM 1364 NE ARG A 404 -18.946 25.501 -2.658 1.00 11.34 N ATOM 1365 CZ ARG A 404 -20.223 25.285 -2.980 1.00 4.31 C ATOM 1366 NH1 ARG A 404 -21.015 26.307 -3.283 1.00 12.31 N ATOM 1367 NH2 ARG A 404 -20.696 24.050 -3.041 1.00 15.54 N ATOM 0 H ARG A 404 -14.077 27.057 -2.245 1.00 75.35 H new ATOM 0 HA ARG A 404 -14.690 27.276 -5.128 1.00 1.21 H new ATOM 0 HB2 ARG A 404 -17.054 27.039 -4.575 1.00 41.15 H new ATOM 0 HB3 ARG A 404 -16.171 25.618 -4.055 1.00 41.15 H new ATOM 0 HG2 ARG A 404 -16.481 26.061 -1.809 1.00 52.52 H new ATOM 0 HG3 ARG A 404 -16.513 27.798 -2.035 1.00 52.52 H new ATOM 0 HD2 ARG A 404 -18.734 27.198 -1.458 1.00 40.12 H new ATOM 0 HD3 ARG A 404 -18.767 27.515 -3.181 1.00 40.12 H new ATOM 0 HE ARG A 404 -18.327 24.695 -2.571 1.00 11.34 H new ATOM 0 HH11 ARG A 404 -20.647 27.258 -3.270 1.00 12.31 H new ATOM 0 HH12 ARG A 404 -21.991 26.141 -3.529 1.00 12.31 H new ATOM 0 HH21 ARG A 404 -20.084 23.259 -2.841 1.00 15.54 H new ATOM 0 HH22 ARG A 404 -21.673 23.890 -3.287 1.00 15.54 H new ATOM 1381 N LYS A 405 -15.664 29.629 -4.793 1.00 13.43 N ATOM 1382 CA LYS A 405 -16.053 31.013 -4.595 1.00 22.23 C ATOM 1383 C LYS A 405 -17.566 31.128 -4.656 1.00 43.05 C ATOM 1384 O LYS A 405 -18.213 30.415 -5.424 1.00 20.31 O ATOM 1385 CB LYS A 405 -15.436 31.917 -5.662 1.00 52.04 C ATOM 1386 CG LYS A 405 -13.921 31.858 -5.728 1.00 72.34 C ATOM 1387 CD LYS A 405 -13.372 32.896 -6.692 1.00 31.44 C ATOM 1388 CE LYS A 405 -13.632 34.310 -6.193 1.00 43.53 C ATOM 1389 NZ LYS A 405 -13.125 35.340 -7.138 1.00 63.31 N ATOM 0 H LYS A 405 -15.791 29.286 -5.745 1.00 13.43 H new ATOM 0 HA LYS A 405 -15.690 31.333 -3.618 1.00 22.23 H new ATOM 0 HB2 LYS A 405 -15.842 31.641 -6.635 1.00 52.04 H new ATOM 0 HB3 LYS A 405 -15.740 32.946 -5.470 1.00 52.04 H new ATOM 0 HG2 LYS A 405 -13.504 32.024 -4.735 1.00 72.34 H new ATOM 0 HG3 LYS A 405 -13.607 30.863 -6.043 1.00 72.34 H new ATOM 0 HD2 LYS A 405 -12.300 32.745 -6.820 1.00 31.44 H new ATOM 0 HD3 LYS A 405 -13.832 32.764 -7.672 1.00 31.44 H new ATOM 0 HE2 LYS A 405 -14.703 34.450 -6.045 1.00 43.53 H new ATOM 0 HE3 LYS A 405 -13.156 34.444 -5.222 1.00 43.53 H new ATOM 0 HZ1 LYS A 405 -13.231 36.283 -6.713 1.00 63.31 H new ATOM 0 HZ2 LYS A 405 -12.120 35.162 -7.339 1.00 63.31 H new ATOM 0 HZ3 LYS A 405 -13.668 35.296 -8.024 1.00 63.31 H new ATOM 1403 N GLU A 406 -18.134 31.999 -3.841 1.00 72.11 N ATOM 1404 CA GLU A 406 -19.558 32.263 -3.914 1.00 21.44 C ATOM 1405 C GLU A 406 -19.824 33.425 -4.862 1.00 72.22 C ATOM 1406 O GLU A 406 -19.233 34.498 -4.727 1.00 14.33 O ATOM 1407 CB GLU A 406 -20.156 32.511 -2.525 1.00 60.40 C ATOM 1408 CG GLU A 406 -19.285 33.336 -1.593 1.00 15.22 C ATOM 1409 CD GLU A 406 -19.854 33.388 -0.188 1.00 74.05 C ATOM 1410 OE1 GLU A 406 -19.975 32.318 0.447 1.00 61.33 O ATOM 1411 OE2 GLU A 406 -20.193 34.493 0.288 1.00 43.43 O ATOM 0 H GLU A 406 -17.636 32.531 -3.127 1.00 72.11 H new ATOM 0 HA GLU A 406 -20.055 31.378 -4.312 1.00 21.44 H new ATOM 0 HB2 GLU A 406 -21.116 33.014 -2.643 1.00 60.40 H new ATOM 0 HB3 GLU A 406 -20.357 31.549 -2.054 1.00 60.40 H new ATOM 0 HG2 GLU A 406 -18.281 32.912 -1.563 1.00 15.22 H new ATOM 0 HG3 GLU A 406 -19.191 34.349 -1.985 1.00 15.22 H new ATOM 1418 N PRO A 407 -20.701 33.203 -5.855 1.00 33.43 N ATOM 1419 CA PRO A 407 -20.982 34.177 -6.916 1.00 4.30 C ATOM 1420 C PRO A 407 -21.304 35.570 -6.386 1.00 11.30 C ATOM 1421 O PRO A 407 -22.111 35.729 -5.469 1.00 54.41 O ATOM 1422 CB PRO A 407 -22.200 33.588 -7.626 1.00 44.35 C ATOM 1423 CG PRO A 407 -22.099 32.124 -7.390 1.00 53.12 C ATOM 1424 CD PRO A 407 -21.492 31.968 -6.024 1.00 21.40 C ATOM 0 HA PRO A 407 -20.114 34.321 -7.560 1.00 4.30 H new ATOM 0 HB2 PRO A 407 -23.128 33.992 -7.222 1.00 44.35 H new ATOM 0 HB3 PRO A 407 -22.189 33.820 -8.691 1.00 44.35 H new ATOM 0 HG2 PRO A 407 -23.080 31.652 -7.438 1.00 53.12 H new ATOM 0 HG3 PRO A 407 -21.479 31.648 -8.150 1.00 53.12 H new ATOM 0 HD2 PRO A 407 -22.257 31.873 -5.253 1.00 21.40 H new ATOM 0 HD3 PRO A 407 -20.865 31.078 -5.963 1.00 21.40 H new ATOM 1432 N GLY A 408 -20.650 36.570 -6.962 1.00 42.13 N ATOM 1433 CA GLY A 408 -20.884 37.945 -6.567 1.00 53.23 C ATOM 1434 C GLY A 408 -19.786 38.480 -5.676 1.00 50.41 C ATOM 1435 O GLY A 408 -19.633 39.693 -5.518 1.00 34.42 O ATOM 0 H GLY A 408 -19.957 36.452 -7.701 1.00 42.13 H new ATOM 0 HA2 GLY A 408 -20.962 38.568 -7.458 1.00 53.23 H new ATOM 0 HA3 GLY A 408 -21.838 38.013 -6.045 1.00 53.23 H new ATOM 1439 N GLN A 409 -19.017 37.573 -5.094 1.00 5.24 N ATOM 1440 CA GLN A 409 -17.949 37.953 -4.189 1.00 4.12 C ATOM 1441 C GLN A 409 -16.604 37.916 -4.907 1.00 43.04 C ATOM 1442 O GLN A 409 -16.170 36.870 -5.391 1.00 55.14 O ATOM 1443 CB GLN A 409 -17.937 37.024 -2.974 1.00 21.10 C ATOM 1444 CG GLN A 409 -19.275 36.945 -2.250 1.00 34.24 C ATOM 1445 CD GLN A 409 -19.726 38.281 -1.693 1.00 33.13 C ATOM 1446 OE1 GLN A 409 -20.410 39.054 -2.366 1.00 51.24 O ATOM 1447 NE2 GLN A 409 -19.367 38.555 -0.450 1.00 71.24 N ATOM 0 H GLN A 409 -19.115 36.567 -5.234 1.00 5.24 H new ATOM 0 HA GLN A 409 -18.124 38.973 -3.846 1.00 4.12 H new ATOM 0 HB2 GLN A 409 -17.648 36.023 -3.296 1.00 21.10 H new ATOM 0 HB3 GLN A 409 -17.175 37.366 -2.274 1.00 21.10 H new ATOM 0 HG2 GLN A 409 -20.033 36.570 -2.938 1.00 34.24 H new ATOM 0 HG3 GLN A 409 -19.199 36.225 -1.435 1.00 34.24 H new ATOM 0 HE21 GLN A 409 -18.800 37.890 0.076 1.00 71.24 H new ATOM 0 HE22 GLN A 409 -19.657 39.432 -0.017 1.00 71.24 H new ATOM 1456 N ARG A 410 -15.954 39.067 -4.976 1.00 25.15 N ATOM 1457 CA ARG A 410 -14.688 39.195 -5.687 1.00 63.35 C ATOM 1458 C ARG A 410 -13.560 38.457 -4.973 1.00 44.32 C ATOM 1459 O ARG A 410 -12.944 37.551 -5.535 1.00 64.00 O ATOM 1460 CB ARG A 410 -14.314 40.671 -5.833 1.00 32.51 C ATOM 1461 CG ARG A 410 -12.960 40.892 -6.491 1.00 74.51 C ATOM 1462 CD ARG A 410 -12.520 42.345 -6.401 1.00 24.34 C ATOM 1463 NE ARG A 410 -13.382 43.237 -7.175 1.00 73.54 N ATOM 1464 CZ ARG A 410 -13.555 44.530 -6.894 1.00 63.34 C ATOM 1465 NH1 ARG A 410 -12.979 45.058 -5.818 1.00 42.35 N ATOM 1466 NH2 ARG A 410 -14.318 45.289 -7.673 1.00 70.31 N ATOM 0 H ARG A 410 -16.283 39.932 -4.546 1.00 25.15 H new ATOM 0 HA ARG A 410 -14.820 38.745 -6.671 1.00 63.35 H new ATOM 0 HB2 ARG A 410 -15.081 41.176 -6.420 1.00 32.51 H new ATOM 0 HB3 ARG A 410 -14.310 41.136 -4.847 1.00 32.51 H new ATOM 0 HG2 ARG A 410 -12.215 40.256 -6.013 1.00 74.51 H new ATOM 0 HG3 ARG A 410 -13.011 40.592 -7.538 1.00 74.51 H new ATOM 0 HD2 ARG A 410 -12.521 42.658 -5.357 1.00 24.34 H new ATOM 0 HD3 ARG A 410 -11.494 42.434 -6.759 1.00 24.34 H new ATOM 0 HE ARG A 410 -13.880 42.849 -7.976 1.00 73.54 H new ATOM 0 HH11 ARG A 410 -12.406 44.475 -5.208 1.00 42.35 H new ATOM 0 HH12 ARG A 410 -13.111 46.046 -5.602 1.00 42.35 H new ATOM 0 HH21 ARG A 410 -14.775 44.884 -8.490 1.00 70.31 H new ATOM 0 HH22 ARG A 410 -14.447 46.277 -7.454 1.00 70.31 H new ATOM 1480 N LEU A 411 -13.300 38.842 -3.731 1.00 5.42 N ATOM 1481 CA LEU A 411 -12.125 38.362 -3.011 1.00 43.43 C ATOM 1482 C LEU A 411 -12.530 37.466 -1.841 1.00 33.51 C ATOM 1483 O LEU A 411 -11.769 37.267 -0.890 1.00 73.32 O ATOM 1484 CB LEU A 411 -11.300 39.563 -2.533 1.00 71.44 C ATOM 1485 CG LEU A 411 -9.828 39.276 -2.217 1.00 72.20 C ATOM 1486 CD1 LEU A 411 -9.133 38.646 -3.417 1.00 12.12 C ATOM 1487 CD2 LEU A 411 -9.119 40.558 -1.808 1.00 33.30 C ATOM 0 H LEU A 411 -13.886 39.486 -3.200 1.00 5.42 H new ATOM 0 HA LEU A 411 -11.514 37.758 -3.682 1.00 43.43 H new ATOM 0 HB2 LEU A 411 -11.344 40.338 -3.298 1.00 71.44 H new ATOM 0 HB3 LEU A 411 -11.771 39.971 -1.639 1.00 71.44 H new ATOM 0 HG LEU A 411 -9.785 38.571 -1.387 1.00 72.20 H new ATOM 0 HD11 LEU A 411 -8.089 38.450 -3.172 1.00 12.12 H new ATOM 0 HD12 LEU A 411 -9.627 37.709 -3.673 1.00 12.12 H new ATOM 0 HD13 LEU A 411 -9.184 39.327 -4.266 1.00 12.12 H new ATOM 0 HD21 LEU A 411 -8.074 40.341 -1.586 1.00 33.30 H new ATOM 0 HD22 LEU A 411 -9.175 41.280 -2.622 1.00 33.30 H new ATOM 0 HD23 LEU A 411 -9.600 40.973 -0.922 1.00 33.30 H new ATOM 1499 N LEU A 412 -13.729 36.913 -1.928 1.00 42.13 N ATOM 1500 CA LEU A 412 -14.246 36.037 -0.887 1.00 45.41 C ATOM 1501 C LEU A 412 -14.096 34.583 -1.331 1.00 1.10 C ATOM 1502 O LEU A 412 -14.427 34.236 -2.467 1.00 1.41 O ATOM 1503 CB LEU A 412 -15.720 36.373 -0.612 1.00 61.12 C ATOM 1504 CG LEU A 412 -16.284 35.944 0.752 1.00 44.24 C ATOM 1505 CD1 LEU A 412 -16.434 34.434 0.847 1.00 60.22 C ATOM 1506 CD2 LEU A 412 -15.405 36.464 1.879 1.00 42.24 C ATOM 0 H LEU A 412 -14.366 37.056 -2.712 1.00 42.13 H new ATOM 0 HA LEU A 412 -13.682 36.183 0.034 1.00 45.41 H new ATOM 0 HB2 LEU A 412 -15.847 37.451 -0.708 1.00 61.12 H new ATOM 0 HB3 LEU A 412 -16.325 35.910 -1.391 1.00 61.12 H new ATOM 0 HG LEU A 412 -17.278 36.381 0.851 1.00 44.24 H new ATOM 0 HD11 LEU A 412 -16.835 34.169 1.825 1.00 60.22 H new ATOM 0 HD12 LEU A 412 -17.114 34.086 0.069 1.00 60.22 H new ATOM 0 HD13 LEU A 412 -15.460 33.963 0.715 1.00 60.22 H new ATOM 0 HD21 LEU A 412 -15.819 36.151 2.837 1.00 42.24 H new ATOM 0 HD22 LEU A 412 -14.398 36.062 1.770 1.00 42.24 H new ATOM 0 HD23 LEU A 412 -15.367 37.553 1.838 1.00 42.24 H new ATOM 1518 N PHE A 413 -13.584 33.743 -0.440 1.00 25.22 N ATOM 1519 CA PHE A 413 -13.355 32.339 -0.755 1.00 33.21 C ATOM 1520 C PHE A 413 -13.939 31.444 0.331 1.00 15.23 C ATOM 1521 O PHE A 413 -14.038 31.841 1.492 1.00 35.22 O ATOM 1522 CB PHE A 413 -11.857 32.061 -0.915 1.00 55.14 C ATOM 1523 CG PHE A 413 -11.199 32.869 -2.000 1.00 34.22 C ATOM 1524 CD1 PHE A 413 -11.206 32.424 -3.311 1.00 51.41 C ATOM 1525 CD2 PHE A 413 -10.577 34.072 -1.709 1.00 41.04 C ATOM 1526 CE1 PHE A 413 -10.602 33.164 -4.311 1.00 14.42 C ATOM 1527 CE2 PHE A 413 -9.973 34.815 -2.706 1.00 62.42 C ATOM 1528 CZ PHE A 413 -9.987 34.360 -4.009 1.00 20.11 C ATOM 0 H PHE A 413 -13.319 34.011 0.508 1.00 25.22 H new ATOM 0 HA PHE A 413 -13.855 32.116 -1.698 1.00 33.21 H new ATOM 0 HB2 PHE A 413 -11.356 32.266 0.031 1.00 55.14 H new ATOM 0 HB3 PHE A 413 -11.715 31.001 -1.128 1.00 55.14 H new ATOM 0 HD1 PHE A 413 -11.688 31.489 -3.555 1.00 51.41 H new ATOM 0 HD2 PHE A 413 -10.564 34.434 -0.691 1.00 41.04 H new ATOM 0 HE1 PHE A 413 -10.612 32.805 -5.329 1.00 14.42 H new ATOM 0 HE2 PHE A 413 -9.491 35.751 -2.466 1.00 62.42 H new ATOM 0 HZ PHE A 413 -9.517 34.940 -4.790 1.00 20.11 H new ATOM 1538 N ARG A 414 -14.327 30.239 -0.051 1.00 51.33 N ATOM 1539 CA ARG A 414 -14.955 29.311 0.874 1.00 60.01 C ATOM 1540 C ARG A 414 -14.492 27.884 0.590 1.00 11.31 C ATOM 1541 O ARG A 414 -14.190 27.536 -0.552 1.00 52.30 O ATOM 1542 CB ARG A 414 -16.477 29.431 0.749 1.00 44.31 C ATOM 1543 CG ARG A 414 -17.260 28.544 1.700 1.00 23.51 C ATOM 1544 CD ARG A 414 -18.750 28.804 1.578 1.00 42.43 C ATOM 1545 NE ARG A 414 -19.539 27.861 2.365 1.00 51.23 N ATOM 1546 CZ ARG A 414 -20.861 27.723 2.250 1.00 65.52 C ATOM 1547 NH1 ARG A 414 -21.548 28.529 1.445 1.00 34.33 N ATOM 1548 NH2 ARG A 414 -21.496 26.795 2.957 1.00 54.41 N ATOM 0 H ARG A 414 -14.218 29.879 -0.999 1.00 51.33 H new ATOM 0 HA ARG A 414 -14.663 29.557 1.895 1.00 60.01 H new ATOM 0 HB2 ARG A 414 -16.762 30.469 0.923 1.00 44.31 H new ATOM 0 HB3 ARG A 414 -16.765 29.188 -0.274 1.00 44.31 H new ATOM 0 HG2 ARG A 414 -17.050 27.497 1.483 1.00 23.51 H new ATOM 0 HG3 ARG A 414 -16.937 28.728 2.725 1.00 23.51 H new ATOM 0 HD2 ARG A 414 -18.968 29.820 1.906 1.00 42.43 H new ATOM 0 HD3 ARG A 414 -19.045 28.737 0.531 1.00 42.43 H new ATOM 0 HE ARG A 414 -19.052 27.274 3.042 1.00 51.23 H new ATOM 0 HH11 ARG A 414 -21.064 29.254 0.915 1.00 34.33 H new ATOM 0 HH12 ARG A 414 -22.559 28.422 1.358 1.00 34.33 H new ATOM 0 HH21 ARG A 414 -20.973 26.188 3.588 1.00 54.41 H new ATOM 0 HH22 ARG A 414 -22.507 26.690 2.869 1.00 54.41 H new ATOM 1562 N PHE A 415 -14.419 27.065 1.627 1.00 54.45 N ATOM 1563 CA PHE A 415 -13.995 25.679 1.473 1.00 32.52 C ATOM 1564 C PHE A 415 -15.100 24.821 0.867 1.00 60.05 C ATOM 1565 O PHE A 415 -16.278 24.977 1.198 1.00 21.24 O ATOM 1566 CB PHE A 415 -13.567 25.089 2.818 1.00 13.43 C ATOM 1567 CG PHE A 415 -12.247 25.605 3.326 1.00 44.23 C ATOM 1568 CD1 PHE A 415 -11.066 24.960 2.993 1.00 51.13 C ATOM 1569 CD2 PHE A 415 -12.188 26.723 4.141 1.00 23.14 C ATOM 1570 CE1 PHE A 415 -9.850 25.422 3.461 1.00 75.31 C ATOM 1571 CE2 PHE A 415 -10.975 27.189 4.614 1.00 43.51 C ATOM 1572 CZ PHE A 415 -9.804 26.537 4.274 1.00 42.44 C ATOM 0 H PHE A 415 -14.647 27.334 2.584 1.00 54.45 H new ATOM 0 HA PHE A 415 -13.143 25.676 0.793 1.00 32.52 H new ATOM 0 HB2 PHE A 415 -14.338 25.304 3.558 1.00 13.43 H new ATOM 0 HB3 PHE A 415 -13.509 24.005 2.724 1.00 13.43 H new ATOM 0 HD1 PHE A 415 -11.096 24.086 2.360 1.00 51.13 H new ATOM 0 HD2 PHE A 415 -13.099 27.237 4.410 1.00 23.14 H new ATOM 0 HE1 PHE A 415 -8.937 24.912 3.191 1.00 75.31 H new ATOM 0 HE2 PHE A 415 -10.942 28.062 5.249 1.00 43.51 H new ATOM 0 HZ PHE A 415 -8.856 26.899 4.643 1.00 42.44 H new ATOM 1582 N MET A 416 -14.709 23.933 -0.036 1.00 4.21 N ATOM 1583 CA MET A 416 -15.623 22.946 -0.596 1.00 62.22 C ATOM 1584 C MET A 416 -15.475 21.649 0.192 1.00 33.30 C ATOM 1585 O MET A 416 -16.452 20.963 0.492 1.00 14.30 O ATOM 1586 CB MET A 416 -15.324 22.730 -2.090 1.00 61.10 C ATOM 1587 CG MET A 416 -16.315 21.824 -2.813 1.00 25.21 C ATOM 1588 SD MET A 416 -16.051 20.064 -2.497 1.00 5.15 S ATOM 1589 CE MET A 416 -17.296 19.337 -3.560 1.00 32.15 C ATOM 0 H MET A 416 -13.758 23.876 -0.399 1.00 4.21 H new ATOM 0 HA MET A 416 -16.652 23.297 -0.518 1.00 62.22 H new ATOM 0 HB2 MET A 416 -15.309 23.700 -2.588 1.00 61.10 H new ATOM 0 HB3 MET A 416 -14.325 22.305 -2.189 1.00 61.10 H new ATOM 0 HG2 MET A 416 -17.327 22.091 -2.509 1.00 25.21 H new ATOM 0 HG3 MET A 416 -16.246 22.006 -3.885 1.00 25.21 H new ATOM 0 HE1 MET A 416 -17.258 18.251 -3.475 1.00 32.15 H new ATOM 0 HE2 MET A 416 -18.282 19.690 -3.259 1.00 32.15 H new ATOM 0 HE3 MET A 416 -17.106 19.627 -4.593 1.00 32.15 H new ATOM 1599 N LYS A 417 -14.233 21.329 0.533 1.00 24.45 N ATOM 1600 CA LYS A 417 -13.939 20.218 1.426 1.00 22.14 C ATOM 1601 C LYS A 417 -13.986 20.719 2.862 1.00 74.44 C ATOM 1602 O LYS A 417 -13.533 21.826 3.144 1.00 70.54 O ATOM 1603 CB LYS A 417 -12.553 19.637 1.115 1.00 21.33 C ATOM 1604 CG LYS A 417 -12.453 18.951 -0.244 1.00 73.02 C ATOM 1605 CD LYS A 417 -12.820 17.470 -0.173 1.00 61.12 C ATOM 1606 CE LYS A 417 -14.282 17.250 0.181 1.00 33.24 C ATOM 1607 NZ LYS A 417 -15.198 17.715 -0.891 1.00 43.40 N ATOM 0 H LYS A 417 -13.408 21.828 0.201 1.00 24.45 H new ATOM 0 HA LYS A 417 -14.679 19.430 1.285 1.00 22.14 H new ATOM 0 HB2 LYS A 417 -11.817 20.440 1.159 1.00 21.33 H new ATOM 0 HB3 LYS A 417 -12.290 18.919 1.892 1.00 21.33 H new ATOM 0 HG2 LYS A 417 -13.113 19.453 -0.952 1.00 73.02 H new ATOM 0 HG3 LYS A 417 -11.438 19.054 -0.627 1.00 73.02 H new ATOM 0 HD2 LYS A 417 -12.607 17.000 -1.133 1.00 61.12 H new ATOM 0 HD3 LYS A 417 -12.192 16.978 0.569 1.00 61.12 H new ATOM 0 HE2 LYS A 417 -14.453 16.190 0.367 1.00 33.24 H new ATOM 0 HE3 LYS A 417 -14.513 17.777 1.107 1.00 33.24 H new ATOM 0 HZ1 LYS A 417 -16.183 17.544 -0.604 1.00 43.40 H new ATOM 0 HZ2 LYS A 417 -15.056 18.733 -1.052 1.00 43.40 H new ATOM 0 HZ3 LYS A 417 -14.998 17.194 -1.769 1.00 43.40 H new