USER MOD reduce.3.24.130724 H: found=0, std=0, add=514, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 514 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 364 ASN : amide:sc= 1.26 K(o=1.8,f=-3.8!) USER MOD Set 1.2: A 366 ASN : amide:sc= 0.514 K(o=1.8,f=0.77) USER MOD Single : A 324 SER OG : rot 180:sc= 0 USER MOD Single : A 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 326 LYS NZ :NH3+ 168:sc= -0.0113 (180deg=-0.152) USER MOD Single : A 327 CYS SG : rot -112:sc= 1.19 USER MOD Single : A 331 SER OG : rot 180:sc= 0 USER MOD Single : A 333 THR OG1 : rot -31:sc= 0.145 USER MOD Single : A 334 SER OG : rot 180:sc= 0.00774 USER MOD Single : A 335 ASN : amide:sc= -0.0274 X(o=-0.027,f=0.29) USER MOD Single : A 340 ASN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 341 THR OG1 : rot -135:sc= -1.13! USER MOD Single : A 342 LYS NZ :NH3+ -161:sc= 1.21 (180deg=1.2) USER MOD Single : A 346 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 348 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 350 THR OG1 : rot -18:sc= 0.674 USER MOD Single : A 353 LYS NZ :NH3+ -164:sc= -0.63 (180deg=-1.48) USER MOD Single : A 357 SER OG : rot 180:sc= 0 USER MOD Single : A 358 ASN : amide:sc= -0.0473 K(o=-0.047,f=-4.4!) USER MOD Single : A 359 HIS : no HD1:sc= 0.238 K(o=0.24,f=-1.6!) USER MOD Single : A 360 MET CE :methyl -128:sc= -2.09! (180deg=-6.42!) USER MOD Single : A 365 GLN : amide:sc= -2.81 K(o=-2.8,f=-0.35) USER MOD Single : A 368 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 HIS : no HE2:sc= 0.214 K(o=0.21,f=-4.2!) USER MOD Single : A 384 SER OG : rot 180:sc= 0 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 388 ASN : amide:sc= -0.0191 X(o=-0.019,f=0) USER MOD Single : A 390 ASN : amide:sc= 0.424 X(o=0.42,f=-0.018) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 ASN : amide:sc= -0.257 X(o=-0.26,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 323 -4.518 17.006 -33.157 1.00 0.00 N ATOM 2 CA GLY A 323 -4.302 16.600 -31.751 1.00 0.00 C ATOM 3 C GLY A 323 -5.448 17.014 -30.860 1.00 0.00 C ATOM 4 O GLY A 323 -6.540 17.306 -31.349 1.00 0.00 O ATOM 0 HA2 GLY A 323 -4.177 15.518 -31.701 1.00 0.00 H new ATOM 0 HA3 GLY A 323 -3.378 17.045 -31.383 1.00 0.00 H new ATOM 10 N SER A 324 -5.201 17.028 -29.543 1.00 0.00 N ATOM 11 CA SER A 324 -6.202 17.418 -28.543 1.00 0.00 C ATOM 12 C SER A 324 -7.431 16.498 -28.568 1.00 0.00 C ATOM 13 O SER A 324 -8.512 16.865 -28.093 1.00 0.00 O ATOM 14 CB SER A 324 -6.618 18.878 -28.741 1.00 0.00 C ATOM 15 OG SER A 324 -5.505 19.749 -28.573 1.00 0.00 O ATOM 0 H SER A 324 -4.300 16.769 -29.141 1.00 0.00 H new ATOM 0 HA SER A 324 -5.739 17.313 -27.562 1.00 0.00 H new ATOM 0 HB2 SER A 324 -7.040 19.008 -29.737 1.00 0.00 H new ATOM 0 HB3 SER A 324 -7.400 19.138 -28.027 1.00 0.00 H new ATOM 0 HG SER A 324 -5.793 20.676 -28.705 1.00 0.00 H new ATOM 21 N LYS A 325 -7.253 15.300 -29.100 1.00 0.00 N ATOM 22 CA LYS A 325 -8.331 14.339 -29.170 1.00 0.00 C ATOM 23 C LYS A 325 -8.424 13.562 -27.862 1.00 0.00 C ATOM 24 O LYS A 325 -9.463 13.565 -27.205 1.00 0.00 O ATOM 25 CB LYS A 325 -8.137 13.391 -30.362 1.00 0.00 C ATOM 26 CG LYS A 325 -9.254 12.372 -30.534 1.00 0.00 C ATOM 27 CD LYS A 325 -10.585 13.049 -30.810 1.00 0.00 C ATOM 28 CE LYS A 325 -11.718 12.041 -30.870 1.00 0.00 C ATOM 29 NZ LYS A 325 -13.026 12.692 -31.118 1.00 0.00 N1+ ATOM 0 H LYS A 325 -6.369 14.973 -29.489 1.00 0.00 H new ATOM 0 HA LYS A 325 -9.269 14.874 -29.321 1.00 0.00 H new ATOM 0 HB2 LYS A 325 -8.056 13.983 -31.274 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -7.192 12.861 -30.241 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -9.010 11.698 -31.355 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -9.334 11.762 -29.634 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -10.790 13.783 -30.031 1.00 0.00 H new ATOM 0 HD3 LYS A 325 -10.530 13.593 -31.753 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -11.518 11.317 -31.660 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -11.761 11.487 -29.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 -13.773 11.969 -31.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 -13.230 13.365 -30.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 -12.995 13.200 -32.025 1.00 0.00 H new ATOM 43 N LYS A 326 -7.331 12.915 -27.478 1.00 0.00 N ATOM 44 CA LYS A 326 -7.295 12.172 -26.224 1.00 0.00 C ATOM 45 C LYS A 326 -7.238 13.135 -25.043 1.00 0.00 C ATOM 46 O LYS A 326 -6.719 14.256 -25.166 1.00 0.00 O ATOM 47 CB LYS A 326 -6.103 11.199 -26.183 1.00 0.00 C ATOM 48 CG LYS A 326 -4.745 11.870 -26.324 1.00 0.00 C ATOM 49 CD LYS A 326 -3.599 10.867 -26.210 1.00 0.00 C ATOM 50 CE LYS A 326 -3.572 9.889 -27.381 1.00 0.00 C ATOM 51 NZ LYS A 326 -3.312 10.568 -28.678 1.00 0.00 N1+ ATOM 0 H LYS A 326 -6.463 12.889 -28.013 1.00 0.00 H new ATOM 0 HA LYS A 326 -8.208 11.581 -26.156 1.00 0.00 H new ATOM 0 HB2 LYS A 326 -6.129 10.650 -25.242 1.00 0.00 H new ATOM 0 HB3 LYS A 326 -6.219 10.467 -26.982 1.00 0.00 H new ATOM 0 HG2 LYS A 326 -4.689 12.377 -27.287 1.00 0.00 H new ATOM 0 HG3 LYS A 326 -4.636 12.634 -25.555 1.00 0.00 H new ATOM 0 HD2 LYS A 326 -2.651 11.404 -26.165 1.00 0.00 H new ATOM 0 HD3 LYS A 326 -3.695 10.312 -25.277 1.00 0.00 H new ATOM 0 HE2 LYS A 326 -2.802 9.138 -27.206 1.00 0.00 H new ATOM 0 HE3 LYS A 326 -4.525 9.363 -27.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 -3.101 9.856 -29.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 -4.152 11.113 -28.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 -2.500 11.210 -28.577 1.00 0.00 H new ATOM 65 N CYS A 327 -7.775 12.710 -23.917 1.00 0.00 N ATOM 66 CA CYS A 327 -7.810 13.538 -22.724 1.00 0.00 C ATOM 67 C CYS A 327 -6.411 13.662 -22.126 1.00 0.00 C ATOM 68 O CYS A 327 -5.665 12.680 -22.069 1.00 0.00 O ATOM 69 CB CYS A 327 -8.780 12.940 -21.700 1.00 0.00 C ATOM 70 SG CYS A 327 -9.272 14.071 -20.379 1.00 0.00 S ATOM 0 H CYS A 327 -8.197 11.789 -23.801 1.00 0.00 H new ATOM 0 HA CYS A 327 -8.159 14.535 -22.995 1.00 0.00 H new ATOM 0 HB2 CYS A 327 -9.675 12.601 -22.222 1.00 0.00 H new ATOM 0 HB3 CYS A 327 -8.318 12.059 -21.253 1.00 0.00 H new ATOM 0 HG CYS A 327 -8.771 13.664 -19.251 1.00 0.00 H new ATOM 76 N ASP A 328 -6.054 14.871 -21.697 1.00 0.00 N ATOM 77 CA ASP A 328 -4.738 15.114 -21.109 1.00 0.00 C ATOM 78 C ASP A 328 -4.657 14.451 -19.744 1.00 0.00 C ATOM 79 O ASP A 328 -3.673 13.790 -19.418 1.00 0.00 O ATOM 80 CB ASP A 328 -4.463 16.615 -20.996 1.00 0.00 C ATOM 81 CG ASP A 328 -3.028 16.923 -20.615 1.00 0.00 C ATOM 82 OD1 ASP A 328 -2.135 16.759 -21.470 1.00 0.00 O1- ATOM 83 OD2 ASP A 328 -2.785 17.345 -19.464 1.00 0.00 O ATOM 0 H ASP A 328 -6.654 15.694 -21.745 1.00 0.00 H new ATOM 0 HA ASP A 328 -3.977 14.682 -21.759 1.00 0.00 H new ATOM 0 HB2 ASP A 328 -4.692 17.094 -21.948 1.00 0.00 H new ATOM 0 HB3 ASP A 328 -5.132 17.047 -20.252 1.00 0.00 H new ATOM 88 N ASP A 329 -5.702 14.630 -18.960 1.00 0.00 N ATOM 89 CA ASP A 329 -5.818 13.970 -17.671 1.00 0.00 C ATOM 90 C ASP A 329 -6.877 12.898 -17.768 1.00 0.00 C ATOM 91 O ASP A 329 -8.066 13.182 -17.700 1.00 0.00 O ATOM 92 CB ASP A 329 -6.166 14.954 -16.545 1.00 0.00 C ATOM 93 CG ASP A 329 -4.977 15.762 -16.072 1.00 0.00 C ATOM 94 OD1 ASP A 329 -4.107 15.199 -15.367 1.00 0.00 O ATOM 95 OD2 ASP A 329 -4.907 16.971 -16.387 1.00 0.00 O1- ATOM 0 H ASP A 329 -6.491 15.233 -19.195 1.00 0.00 H new ATOM 0 HA ASP A 329 -4.852 13.531 -17.423 1.00 0.00 H new ATOM 0 HB2 ASP A 329 -6.944 15.634 -16.893 1.00 0.00 H new ATOM 0 HB3 ASP A 329 -6.580 14.400 -15.702 1.00 0.00 H new ATOM 100 N ASP A 330 -6.440 11.670 -17.941 1.00 0.00 N ATOM 101 CA ASP A 330 -7.351 10.544 -18.140 1.00 0.00 C ATOM 102 C ASP A 330 -8.051 10.156 -16.834 1.00 0.00 C ATOM 103 O ASP A 330 -9.043 9.426 -16.846 1.00 0.00 O ATOM 104 CB ASP A 330 -6.586 9.354 -18.722 1.00 0.00 C ATOM 105 CG ASP A 330 -7.487 8.225 -19.182 1.00 0.00 C ATOM 106 OD1 ASP A 330 -8.130 8.364 -20.250 1.00 0.00 O ATOM 107 OD2 ASP A 330 -7.530 7.174 -18.506 1.00 0.00 O1- ATOM 0 H ASP A 330 -5.452 11.416 -17.949 1.00 0.00 H new ATOM 0 HA ASP A 330 -8.124 10.847 -18.846 1.00 0.00 H new ATOM 0 HB2 ASP A 330 -5.985 9.695 -19.565 1.00 0.00 H new ATOM 0 HB3 ASP A 330 -5.894 8.974 -17.970 1.00 0.00 H new ATOM 112 N SER A 331 -7.519 10.657 -15.715 1.00 0.00 N ATOM 113 CA SER A 331 -8.085 10.421 -14.379 1.00 0.00 C ATOM 114 C SER A 331 -7.939 8.953 -13.949 1.00 0.00 C ATOM 115 O SER A 331 -8.649 8.476 -13.066 1.00 0.00 O ATOM 116 CB SER A 331 -9.557 10.856 -14.335 1.00 0.00 C ATOM 117 OG SER A 331 -9.719 12.180 -14.834 1.00 0.00 O ATOM 0 H SER A 331 -6.682 11.239 -15.708 1.00 0.00 H new ATOM 0 HA SER A 331 -7.520 11.025 -13.670 1.00 0.00 H new ATOM 0 HB2 SER A 331 -10.160 10.166 -14.925 1.00 0.00 H new ATOM 0 HB3 SER A 331 -9.924 10.804 -13.310 1.00 0.00 H new ATOM 0 HG SER A 331 -10.666 12.430 -14.796 1.00 0.00 H new ATOM 123 N GLU A 332 -6.988 8.263 -14.552 1.00 0.00 N ATOM 124 CA GLU A 332 -6.745 6.849 -14.258 1.00 0.00 C ATOM 125 C GLU A 332 -6.132 6.644 -12.868 1.00 0.00 C ATOM 126 O GLU A 332 -6.293 5.590 -12.260 1.00 0.00 O ATOM 127 CB GLU A 332 -5.848 6.219 -15.342 1.00 0.00 C ATOM 128 CG GLU A 332 -4.863 7.187 -16.008 1.00 0.00 C ATOM 129 CD GLU A 332 -3.879 7.828 -15.048 1.00 0.00 C ATOM 130 OE1 GLU A 332 -2.827 7.220 -14.774 1.00 0.00 O ATOM 131 OE2 GLU A 332 -4.154 8.958 -14.572 1.00 0.00 O1- ATOM 0 H GLU A 332 -6.363 8.657 -15.255 1.00 0.00 H new ATOM 0 HA GLU A 332 -7.713 6.347 -14.261 1.00 0.00 H new ATOM 0 HB2 GLU A 332 -5.284 5.400 -14.895 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -6.485 5.785 -16.113 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -4.307 6.651 -16.777 1.00 0.00 H new ATOM 0 HG3 GLU A 332 -5.427 7.972 -16.512 1.00 0.00 H new ATOM 138 N THR A 333 -5.446 7.656 -12.378 1.00 0.00 N ATOM 139 CA THR A 333 -4.775 7.586 -11.093 1.00 0.00 C ATOM 140 C THR A 333 -5.764 7.531 -9.910 1.00 0.00 C ATOM 141 O THR A 333 -5.385 7.173 -8.795 1.00 0.00 O ATOM 142 CB THR A 333 -3.799 8.766 -10.916 1.00 0.00 C ATOM 143 OG1 THR A 333 -3.110 8.671 -9.656 1.00 0.00 O ATOM 144 CG2 THR A 333 -4.544 10.069 -10.992 1.00 0.00 C ATOM 0 H THR A 333 -5.337 8.550 -12.857 1.00 0.00 H new ATOM 0 HA THR A 333 -4.211 6.653 -11.088 1.00 0.00 H new ATOM 0 HB THR A 333 -3.063 8.726 -11.719 1.00 0.00 H new ATOM 0 HG1 THR A 333 -3.694 8.244 -8.995 1.00 0.00 H new ATOM 0 HG21 THR A 333 -3.845 10.896 -10.866 1.00 0.00 H new ATOM 0 HG22 THR A 333 -5.033 10.152 -11.963 1.00 0.00 H new ATOM 0 HG23 THR A 333 -5.295 10.105 -10.203 1.00 0.00 H new ATOM 152 N SER A 334 -7.023 7.867 -10.154 1.00 0.00 N ATOM 153 CA SER A 334 -8.023 7.855 -9.096 1.00 0.00 C ATOM 154 C SER A 334 -8.911 6.630 -9.167 1.00 0.00 C ATOM 155 O SER A 334 -10.041 6.640 -8.675 1.00 0.00 O ATOM 156 CB SER A 334 -8.852 9.135 -9.123 1.00 0.00 C ATOM 157 OG SER A 334 -9.194 9.506 -10.452 1.00 0.00 O ATOM 0 H SER A 334 -7.375 8.149 -11.069 1.00 0.00 H new ATOM 0 HA SER A 334 -7.491 7.809 -8.146 1.00 0.00 H new ATOM 0 HB2 SER A 334 -9.761 8.993 -8.538 1.00 0.00 H new ATOM 0 HB3 SER A 334 -8.292 9.942 -8.651 1.00 0.00 H new ATOM 0 HG SER A 334 -9.726 10.329 -10.435 1.00 0.00 H new ATOM 163 N ASN A 335 -8.376 5.562 -9.727 1.00 0.00 N ATOM 164 CA ASN A 335 -9.120 4.317 -9.867 1.00 0.00 C ATOM 165 C ASN A 335 -9.392 3.678 -8.504 1.00 0.00 C ATOM 166 O ASN A 335 -10.260 2.822 -8.370 1.00 0.00 O ATOM 167 CB ASN A 335 -8.352 3.331 -10.761 1.00 0.00 C ATOM 168 CG ASN A 335 -7.062 2.841 -10.118 1.00 0.00 C ATOM 169 OD1 ASN A 335 -6.022 3.489 -10.214 1.00 0.00 O ATOM 170 ND2 ASN A 335 -7.120 1.691 -9.470 1.00 0.00 N ATOM 0 H ASN A 335 -7.425 5.528 -10.095 1.00 0.00 H new ATOM 0 HA ASN A 335 -10.077 4.553 -10.333 1.00 0.00 H new ATOM 0 HB2 ASN A 335 -8.990 2.476 -10.984 1.00 0.00 H new ATOM 0 HB3 ASN A 335 -8.120 3.812 -11.711 1.00 0.00 H new ATOM 0 HD21 ASN A 335 -6.283 1.312 -9.028 1.00 0.00 H new ATOM 0 HD22 ASN A 335 -8.002 1.182 -9.412 1.00 0.00 H new ATOM 177 N TRP A 336 -8.648 4.106 -7.502 1.00 0.00 N ATOM 178 CA TRP A 336 -8.782 3.559 -6.157 1.00 0.00 C ATOM 179 C TRP A 336 -9.230 4.637 -5.170 1.00 0.00 C ATOM 180 O TRP A 336 -9.969 4.361 -4.224 1.00 0.00 O ATOM 181 CB TRP A 336 -7.450 2.936 -5.706 1.00 0.00 C ATOM 182 CG TRP A 336 -6.292 3.892 -5.754 1.00 0.00 C ATOM 183 CD1 TRP A 336 -5.617 4.310 -6.868 1.00 0.00 C ATOM 184 CD2 TRP A 336 -5.670 4.544 -4.642 1.00 0.00 C ATOM 185 NE1 TRP A 336 -4.633 5.194 -6.518 1.00 0.00 N ATOM 186 CE2 TRP A 336 -4.638 5.351 -5.158 1.00 0.00 C ATOM 187 CE3 TRP A 336 -5.888 4.528 -3.263 1.00 0.00 C ATOM 188 CZ2 TRP A 336 -3.830 6.132 -4.343 1.00 0.00 C ATOM 189 CZ3 TRP A 336 -5.079 5.305 -2.456 1.00 0.00 C ATOM 190 CH2 TRP A 336 -4.064 6.098 -2.998 1.00 0.00 C ATOM 0 H TRP A 336 -7.940 4.835 -7.591 1.00 0.00 H new ATOM 0 HA TRP A 336 -9.547 2.782 -6.176 1.00 0.00 H new ATOM 0 HB2 TRP A 336 -7.560 2.562 -4.688 1.00 0.00 H new ATOM 0 HB3 TRP A 336 -7.228 2.077 -6.339 1.00 0.00 H new ATOM 0 HD1 TRP A 336 -5.830 3.989 -7.877 1.00 0.00 H new ATOM 0 HE1 TRP A 336 -3.998 5.661 -7.166 1.00 0.00 H new ATOM 0 HE3 TRP A 336 -6.673 3.921 -2.836 1.00 0.00 H new ATOM 0 HZ2 TRP A 336 -3.044 6.745 -4.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 336 -5.234 5.299 -1.387 1.00 0.00 H new ATOM 0 HH2 TRP A 336 -3.452 6.696 -2.339 1.00 0.00 H new ATOM 201 N ILE A 337 -8.788 5.867 -5.411 1.00 0.00 N ATOM 202 CA ILE A 337 -9.115 7.010 -4.554 1.00 0.00 C ATOM 203 C ILE A 337 -10.623 7.211 -4.454 1.00 0.00 C ATOM 204 O ILE A 337 -11.127 7.718 -3.447 1.00 0.00 O ATOM 205 CB ILE A 337 -8.452 8.302 -5.094 1.00 0.00 C ATOM 206 CG1 ILE A 337 -6.937 8.126 -5.125 1.00 0.00 C ATOM 207 CG2 ILE A 337 -8.832 9.510 -4.240 1.00 0.00 C ATOM 208 CD1 ILE A 337 -6.215 9.172 -5.943 1.00 0.00 C ATOM 0 H ILE A 337 -8.193 6.103 -6.205 1.00 0.00 H new ATOM 0 HA ILE A 337 -8.727 6.797 -3.558 1.00 0.00 H new ATOM 0 HB ILE A 337 -8.813 8.483 -6.106 1.00 0.00 H new ATOM 0 HG12 ILE A 337 -6.557 8.152 -4.104 1.00 0.00 H new ATOM 0 HG13 ILE A 337 -6.704 7.140 -5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 337 -8.353 10.404 -4.641 1.00 0.00 H new ATOM 0 HG22 ILE A 337 -9.914 9.640 -4.255 1.00 0.00 H new ATOM 0 HG23 ILE A 337 -8.500 9.349 -3.214 1.00 0.00 H new ATOM 0 HD11 ILE A 337 -5.143 8.979 -5.916 1.00 0.00 H new ATOM 0 HD12 ILE A 337 -6.565 9.133 -6.975 1.00 0.00 H new ATOM 0 HD13 ILE A 337 -6.416 10.160 -5.529 1.00 0.00 H new ATOM 220 N ALA A 338 -11.333 6.767 -5.488 1.00 0.00 N ATOM 221 CA ALA A 338 -12.786 6.894 -5.569 1.00 0.00 C ATOM 222 C ALA A 338 -13.480 6.476 -4.267 1.00 0.00 C ATOM 223 O ALA A 338 -14.443 7.118 -3.841 1.00 0.00 O ATOM 224 CB ALA A 338 -13.316 6.076 -6.735 1.00 0.00 C ATOM 0 H ALA A 338 -10.915 6.307 -6.297 1.00 0.00 H new ATOM 0 HA ALA A 338 -13.013 7.948 -5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 338 -14.400 6.177 -6.787 1.00 0.00 H new ATOM 0 HB2 ALA A 338 -12.873 6.436 -7.663 1.00 0.00 H new ATOM 0 HB3 ALA A 338 -13.056 5.027 -6.592 1.00 0.00 H new ATOM 230 N ALA A 339 -12.979 5.424 -3.625 1.00 0.00 N ATOM 231 CA ALA A 339 -13.595 4.947 -2.392 1.00 0.00 C ATOM 232 C ALA A 339 -12.567 4.449 -1.380 1.00 0.00 C ATOM 233 O ALA A 339 -12.905 3.699 -0.463 1.00 0.00 O ATOM 234 CB ALA A 339 -14.613 3.857 -2.699 1.00 0.00 C ATOM 0 H ALA A 339 -12.163 4.894 -3.931 1.00 0.00 H new ATOM 0 HA ALA A 339 -14.103 5.797 -1.936 1.00 0.00 H new ATOM 0 HB1 ALA A 339 -15.065 3.510 -1.770 1.00 0.00 H new ATOM 0 HB2 ALA A 339 -15.388 4.257 -3.353 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -14.115 3.023 -3.194 1.00 0.00 H new ATOM 240 N ASN A 340 -11.322 4.864 -1.531 1.00 0.00 N ATOM 241 CA ASN A 340 -10.284 4.447 -0.586 1.00 0.00 C ATOM 242 C ASN A 340 -9.599 5.627 0.041 1.00 0.00 C ATOM 243 O ASN A 340 -8.970 5.503 1.097 1.00 0.00 O ATOM 244 CB ASN A 340 -9.233 3.564 -1.262 1.00 0.00 C ATOM 245 CG ASN A 340 -9.733 2.173 -1.555 1.00 0.00 C ATOM 246 OD1 ASN A 340 -9.586 1.261 -0.735 1.00 0.00 O ATOM 247 ND2 ASN A 340 -10.318 1.997 -2.719 1.00 0.00 N ATOM 0 H ASN A 340 -11.002 5.477 -2.281 1.00 0.00 H new ATOM 0 HA ASN A 340 -10.788 3.874 0.192 1.00 0.00 H new ATOM 0 HB2 ASN A 340 -8.916 4.034 -2.193 1.00 0.00 H new ATOM 0 HB3 ASN A 340 -8.353 3.501 -0.621 1.00 0.00 H new ATOM 0 HD21 ASN A 340 -10.673 1.076 -2.977 1.00 0.00 H new ATOM 0 HD22 ASN A 340 -10.417 2.781 -3.364 1.00 0.00 H new ATOM 254 N THR A 341 -9.733 6.771 -0.572 1.00 0.00 N ATOM 255 CA THR A 341 -9.006 7.929 -0.111 1.00 0.00 C ATOM 256 C THR A 341 -9.798 9.207 -0.248 1.00 0.00 C ATOM 257 O THR A 341 -10.848 9.240 -0.887 1.00 0.00 O ATOM 258 CB THR A 341 -7.696 8.076 -0.884 1.00 0.00 C ATOM 259 OG1 THR A 341 -7.597 7.043 -1.876 1.00 0.00 O ATOM 260 CG2 THR A 341 -6.528 7.986 0.055 1.00 0.00 C ATOM 0 H THR A 341 -10.331 6.929 -1.383 1.00 0.00 H new ATOM 0 HA THR A 341 -8.808 7.767 0.949 1.00 0.00 H new ATOM 0 HB THR A 341 -7.685 9.050 -1.374 1.00 0.00 H new ATOM 0 HG1 THR A 341 -6.698 6.653 -1.854 1.00 0.00 H new ATOM 0 HG21 THR A 341 -5.600 8.092 -0.507 1.00 0.00 H new ATOM 0 HG22 THR A 341 -6.596 8.781 0.797 1.00 0.00 H new ATOM 0 HG23 THR A 341 -6.539 7.019 0.558 1.00 0.00 H new ATOM 268 N LYS A 342 -9.279 10.263 0.363 1.00 0.00 N ATOM 269 CA LYS A 342 -9.887 11.572 0.292 1.00 0.00 C ATOM 270 C LYS A 342 -8.798 12.614 0.124 1.00 0.00 C ATOM 271 O LYS A 342 -7.621 12.269 -0.027 1.00 0.00 O ATOM 272 CB LYS A 342 -10.739 11.878 1.544 1.00 0.00 C ATOM 273 CG LYS A 342 -11.888 10.904 1.763 1.00 0.00 C ATOM 274 CD LYS A 342 -12.890 11.404 2.805 1.00 0.00 C ATOM 275 CE LYS A 342 -12.262 11.582 4.184 1.00 0.00 C ATOM 276 NZ LYS A 342 -13.293 11.736 5.246 1.00 0.00 N1+ ATOM 0 H LYS A 342 -8.425 10.230 0.920 1.00 0.00 H new ATOM 0 HA LYS A 342 -10.560 11.596 -0.565 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -10.093 11.866 2.422 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -11.143 12.887 1.459 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -12.404 10.738 0.818 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -11.488 9.941 2.081 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -13.308 12.355 2.475 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -13.718 10.699 2.875 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -11.633 10.721 4.411 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -11.613 12.458 4.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -12.862 12.166 6.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -14.060 12.347 4.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 -13.679 10.802 5.493 1.00 0.00 H new ATOM 290 N GLU A 343 -9.168 13.876 0.153 1.00 0.00 N ATOM 291 CA GLU A 343 -8.198 14.942 -0.029 1.00 0.00 C ATOM 292 C GLU A 343 -8.254 15.939 1.108 1.00 0.00 C ATOM 293 O GLU A 343 -9.228 15.977 1.871 1.00 0.00 O ATOM 294 CB GLU A 343 -8.416 15.669 -1.357 1.00 0.00 C ATOM 295 CG GLU A 343 -8.343 14.767 -2.572 1.00 0.00 C ATOM 296 CD GLU A 343 -8.150 15.539 -3.849 1.00 0.00 C ATOM 297 OE1 GLU A 343 -9.083 16.248 -4.268 1.00 0.00 O ATOM 298 OE2 GLU A 343 -7.060 15.433 -4.449 1.00 0.00 O1- ATOM 0 H GLU A 343 -10.127 14.191 0.300 1.00 0.00 H new ATOM 0 HA GLU A 343 -7.213 14.476 -0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -9.391 16.156 -1.337 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -7.668 16.456 -1.456 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -7.521 14.062 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -9.259 14.180 -2.641 1.00 0.00 H new ATOM 305 N CYS A 344 -7.204 16.746 1.212 1.00 0.00 N ATOM 306 CA CYS A 344 -7.113 17.780 2.223 1.00 0.00 C ATOM 307 C CYS A 344 -8.253 18.769 2.051 1.00 0.00 C ATOM 308 O CYS A 344 -8.532 19.212 0.946 1.00 0.00 O ATOM 309 CB CYS A 344 -5.761 18.500 2.101 1.00 0.00 C ATOM 310 SG CYS A 344 -5.480 19.849 3.299 1.00 0.00 S ATOM 0 H CYS A 344 -6.394 16.697 0.594 1.00 0.00 H new ATOM 0 HA CYS A 344 -7.187 17.329 3.212 1.00 0.00 H new ATOM 0 HB2 CYS A 344 -4.965 17.764 2.215 1.00 0.00 H new ATOM 0 HB3 CYS A 344 -5.676 18.908 1.094 1.00 0.00 H new ATOM 315 N PRO A 345 -8.940 19.108 3.127 1.00 0.00 N ATOM 316 CA PRO A 345 -10.032 20.063 3.081 1.00 0.00 C ATOM 317 C PRO A 345 -9.517 21.496 3.075 1.00 0.00 C ATOM 318 O PRO A 345 -10.292 22.453 3.011 1.00 0.00 O ATOM 319 CB PRO A 345 -10.799 19.772 4.366 1.00 0.00 C ATOM 320 CG PRO A 345 -9.765 19.266 5.315 1.00 0.00 C ATOM 321 CD PRO A 345 -8.720 18.576 4.481 1.00 0.00 C ATOM 0 HA PRO A 345 -10.639 19.968 2.181 1.00 0.00 H new ATOM 0 HB2 PRO A 345 -11.284 20.669 4.750 1.00 0.00 H new ATOM 0 HB3 PRO A 345 -11.582 19.032 4.201 1.00 0.00 H new ATOM 0 HG2 PRO A 345 -9.327 20.086 5.885 1.00 0.00 H new ATOM 0 HG3 PRO A 345 -10.204 18.576 6.035 1.00 0.00 H new ATOM 0 HD2 PRO A 345 -7.714 18.796 4.838 1.00 0.00 H new ATOM 0 HD3 PRO A 345 -8.838 17.493 4.509 1.00 0.00 H new ATOM 329 N LYS A 346 -8.204 21.633 3.131 1.00 0.00 N ATOM 330 CA LYS A 346 -7.574 22.917 3.158 1.00 0.00 C ATOM 331 C LYS A 346 -6.964 23.267 1.804 1.00 0.00 C ATOM 332 O LYS A 346 -7.283 24.304 1.227 1.00 0.00 O ATOM 333 CB LYS A 346 -6.534 22.961 4.286 1.00 0.00 C ATOM 334 CG LYS A 346 -5.468 24.029 4.122 1.00 0.00 C ATOM 335 CD LYS A 346 -4.819 24.394 5.459 1.00 0.00 C ATOM 336 CE LYS A 346 -5.793 25.091 6.406 1.00 0.00 C ATOM 337 NZ LYS A 346 -5.191 25.331 7.747 1.00 0.00 N1+ ATOM 0 H LYS A 346 -7.554 20.848 3.159 1.00 0.00 H new ATOM 0 HA LYS A 346 -8.330 23.676 3.361 1.00 0.00 H new ATOM 0 HB2 LYS A 346 -7.050 23.124 5.232 1.00 0.00 H new ATOM 0 HB3 LYS A 346 -6.047 21.988 4.352 1.00 0.00 H new ATOM 0 HG2 LYS A 346 -4.703 23.676 3.431 1.00 0.00 H new ATOM 0 HG3 LYS A 346 -5.912 24.920 3.678 1.00 0.00 H new ATOM 0 HD2 LYS A 346 -4.438 23.490 5.934 1.00 0.00 H new ATOM 0 HD3 LYS A 346 -3.963 25.044 5.279 1.00 0.00 H new ATOM 0 HE2 LYS A 346 -6.103 26.042 5.972 1.00 0.00 H new ATOM 0 HE3 LYS A 346 -6.691 24.483 6.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 346 -5.885 25.806 8.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 346 -4.918 24.422 8.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 346 -4.349 25.933 7.647 1.00 0.00 H new ATOM 351 N CYS A 347 -6.103 22.402 1.287 1.00 0.00 N ATOM 352 CA CYS A 347 -5.458 22.672 0.005 1.00 0.00 C ATOM 353 C CYS A 347 -5.943 21.720 -1.084 1.00 0.00 C ATOM 354 O CYS A 347 -5.634 21.908 -2.264 1.00 0.00 O ATOM 355 CB CYS A 347 -3.940 22.598 0.142 1.00 0.00 C ATOM 356 SG CYS A 347 -3.308 20.979 0.649 1.00 0.00 S ATOM 0 H CYS A 347 -5.836 21.520 1.725 1.00 0.00 H new ATOM 0 HA CYS A 347 -5.735 23.683 -0.294 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -3.488 22.867 -0.813 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.617 23.343 0.869 1.00 0.00 H new ATOM 361 N HIS A 348 -6.691 20.707 -0.673 1.00 0.00 N ATOM 362 CA HIS A 348 -7.240 19.698 -1.574 1.00 0.00 C ATOM 363 C HIS A 348 -6.153 18.930 -2.292 1.00 0.00 C ATOM 364 O HIS A 348 -5.972 19.047 -3.507 1.00 0.00 O ATOM 365 CB HIS A 348 -8.257 20.283 -2.558 1.00 0.00 C ATOM 366 CG HIS A 348 -9.537 20.711 -1.911 1.00 0.00 C ATOM 367 ND1 HIS A 348 -10.683 19.962 -2.032 1.00 0.00 N ATOM 368 CD2 HIS A 348 -9.798 21.801 -1.153 1.00 0.00 C ATOM 369 CE1 HIS A 348 -11.609 20.610 -1.346 1.00 0.00 C ATOM 370 NE2 HIS A 348 -11.120 21.727 -0.798 1.00 0.00 N ATOM 0 H HIS A 348 -6.938 20.559 0.305 1.00 0.00 H new ATOM 0 HA HIS A 348 -7.780 18.989 -0.947 1.00 0.00 H new ATOM 0 HB2 HIS A 348 -7.811 21.140 -3.063 1.00 0.00 H new ATOM 0 HB3 HIS A 348 -8.477 19.540 -3.325 1.00 0.00 H new ATOM 0 HD2 HIS A 348 -9.100 22.579 -0.880 1.00 0.00 H new ATOM 0 HE1 HIS A 348 -12.632 20.279 -1.242 1.00 0.00 H new ATOM 0 HE2 HIS A 348 -11.633 22.397 -0.225 1.00 0.00 H new ATOM 378 N VAL A 349 -5.417 18.166 -1.529 1.00 0.00 N ATOM 379 CA VAL A 349 -4.382 17.318 -2.056 1.00 0.00 C ATOM 380 C VAL A 349 -4.707 15.881 -1.701 1.00 0.00 C ATOM 381 O VAL A 349 -5.232 15.616 -0.617 1.00 0.00 O ATOM 382 CB VAL A 349 -2.978 17.701 -1.495 1.00 0.00 C ATOM 383 CG1 VAL A 349 -2.973 17.651 0.013 1.00 0.00 C ATOM 384 CG2 VAL A 349 -1.892 16.800 -2.063 1.00 0.00 C ATOM 0 H VAL A 349 -5.520 18.115 -0.516 1.00 0.00 H new ATOM 0 HA VAL A 349 -4.344 17.445 -3.138 1.00 0.00 H new ATOM 0 HB VAL A 349 -2.763 18.723 -1.808 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -1.984 17.922 0.383 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -3.711 18.353 0.403 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -3.221 16.643 0.344 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -0.925 17.092 -1.653 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -2.102 15.764 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -1.870 16.897 -3.148 1.00 0.00 H new ATOM 394 N THR A 350 -4.440 14.966 -2.607 1.00 0.00 N ATOM 395 CA THR A 350 -4.710 13.573 -2.360 1.00 0.00 C ATOM 396 C THR A 350 -3.852 13.062 -1.214 1.00 0.00 C ATOM 397 O THR A 350 -2.624 13.026 -1.304 1.00 0.00 O ATOM 398 CB THR A 350 -4.449 12.731 -3.606 1.00 0.00 C ATOM 399 OG1 THR A 350 -5.066 13.357 -4.750 1.00 0.00 O ATOM 400 CG2 THR A 350 -5.019 11.336 -3.426 1.00 0.00 C ATOM 0 H THR A 350 -4.035 15.165 -3.522 1.00 0.00 H new ATOM 0 HA THR A 350 -5.763 13.482 -2.093 1.00 0.00 H new ATOM 0 HB THR A 350 -3.373 12.658 -3.763 1.00 0.00 H new ATOM 0 HG1 THR A 350 -5.745 13.995 -4.447 1.00 0.00 H new ATOM 0 HG21 THR A 350 -4.826 10.746 -4.322 1.00 0.00 H new ATOM 0 HG22 THR A 350 -4.547 10.858 -2.568 1.00 0.00 H new ATOM 0 HG23 THR A 350 -6.094 11.401 -3.259 1.00 0.00 H new ATOM 408 N ILE A 351 -4.500 12.692 -0.137 1.00 0.00 N ATOM 409 CA ILE A 351 -3.813 12.202 1.024 1.00 0.00 C ATOM 410 C ILE A 351 -4.101 10.721 1.177 1.00 0.00 C ATOM 411 O ILE A 351 -4.550 10.088 0.239 1.00 0.00 O ATOM 412 CB ILE A 351 -4.265 12.959 2.297 1.00 0.00 C ATOM 413 CG1 ILE A 351 -5.737 12.681 2.585 1.00 0.00 C ATOM 414 CG2 ILE A 351 -4.036 14.463 2.141 1.00 0.00 C ATOM 415 CD1 ILE A 351 -6.309 13.527 3.696 1.00 0.00 C ATOM 0 H ILE A 351 -5.515 12.723 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 351 -2.743 12.365 0.897 1.00 0.00 H new ATOM 0 HB ILE A 351 -3.668 12.603 3.136 1.00 0.00 H new ATOM 0 HG12 ILE A 351 -6.314 12.852 1.676 1.00 0.00 H new ATOM 0 HG13 ILE A 351 -5.855 11.629 2.844 1.00 0.00 H new ATOM 0 HG21 ILE A 351 -4.360 14.976 3.046 1.00 0.00 H new ATOM 0 HG22 ILE A 351 -2.976 14.654 1.975 1.00 0.00 H new ATOM 0 HG23 ILE A 351 -4.609 14.832 1.290 1.00 0.00 H new ATOM 0 HD11 ILE A 351 -7.359 13.273 3.843 1.00 0.00 H new ATOM 0 HD12 ILE A 351 -5.758 13.339 4.617 1.00 0.00 H new ATOM 0 HD13 ILE A 351 -6.224 14.581 3.431 1.00 0.00 H new ATOM 427 N GLU A 352 -3.831 10.185 2.345 1.00 0.00 N ATOM 428 CA GLU A 352 -4.117 8.794 2.642 1.00 0.00 C ATOM 429 C GLU A 352 -4.107 8.599 4.138 1.00 0.00 C ATOM 430 O GLU A 352 -3.182 9.035 4.819 1.00 0.00 O ATOM 431 CB GLU A 352 -3.113 7.853 1.981 1.00 0.00 C ATOM 432 CG GLU A 352 -3.525 6.390 2.078 1.00 0.00 C ATOM 433 CD GLU A 352 -2.474 5.441 1.550 1.00 0.00 C ATOM 434 OE1 GLU A 352 -1.413 5.307 2.193 1.00 0.00 O1- ATOM 435 OE2 GLU A 352 -2.705 4.812 0.499 1.00 0.00 O ATOM 0 H GLU A 352 -3.407 10.698 3.118 1.00 0.00 H new ATOM 0 HA GLU A 352 -5.100 8.551 2.238 1.00 0.00 H new ATOM 0 HB2 GLU A 352 -3.002 8.126 0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 352 -2.137 7.983 2.449 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -3.735 6.146 3.119 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -4.451 6.242 1.523 1.00 0.00 H new ATOM 442 N LYS A 353 -5.137 7.968 4.649 1.00 0.00 N ATOM 443 CA LYS A 353 -5.281 7.787 6.077 1.00 0.00 C ATOM 444 C LYS A 353 -4.710 6.468 6.554 1.00 0.00 C ATOM 445 O LYS A 353 -4.799 5.451 5.868 1.00 0.00 O ATOM 446 CB LYS A 353 -6.754 7.868 6.477 1.00 0.00 C ATOM 447 CG LYS A 353 -6.993 7.749 7.975 1.00 0.00 C ATOM 448 CD LYS A 353 -6.413 8.937 8.706 1.00 0.00 C ATOM 449 CE LYS A 353 -6.375 8.716 10.202 1.00 0.00 C ATOM 450 NZ LYS A 353 -5.416 9.639 10.864 1.00 0.00 N1+ ATOM 0 H LYS A 353 -5.894 7.568 4.094 1.00 0.00 H new ATOM 0 HA LYS A 353 -4.717 8.589 6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 353 -7.164 8.816 6.128 1.00 0.00 H new ATOM 0 HB3 LYS A 353 -7.303 7.076 5.967 1.00 0.00 H new ATOM 0 HG2 LYS A 353 -8.063 7.681 8.173 1.00 0.00 H new ATOM 0 HG3 LYS A 353 -6.541 6.830 8.348 1.00 0.00 H new ATOM 0 HD2 LYS A 353 -5.404 9.130 8.342 1.00 0.00 H new ATOM 0 HD3 LYS A 353 -7.007 9.824 8.485 1.00 0.00 H new ATOM 0 HE2 LYS A 353 -7.371 8.865 10.618 1.00 0.00 H new ATOM 0 HE3 LYS A 353 -6.093 7.684 10.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 353 -5.208 9.295 11.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 353 -4.535 9.679 10.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 353 -5.832 10.590 10.920 1.00 0.00 H new ATOM 464 N ASP A 354 -4.122 6.502 7.738 1.00 0.00 N ATOM 465 CA ASP A 354 -3.647 5.306 8.401 1.00 0.00 C ATOM 466 C ASP A 354 -4.849 4.562 8.969 1.00 0.00 C ATOM 467 O ASP A 354 -5.167 3.456 8.541 1.00 0.00 O ATOM 468 CB ASP A 354 -2.663 5.675 9.518 1.00 0.00 C ATOM 469 CG ASP A 354 -2.298 4.499 10.395 1.00 0.00 C ATOM 470 OD1 ASP A 354 -1.398 3.722 10.017 1.00 0.00 O ATOM 471 OD2 ASP A 354 -2.908 4.354 11.474 1.00 0.00 O1- ATOM 0 H ASP A 354 -3.962 7.361 8.264 1.00 0.00 H new ATOM 0 HA ASP A 354 -3.122 4.667 7.691 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -1.756 6.086 9.075 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -3.100 6.460 10.135 1.00 0.00 H new ATOM 476 N GLY A 355 -5.534 5.197 9.919 1.00 0.00 N ATOM 477 CA GLY A 355 -6.752 4.624 10.461 1.00 0.00 C ATOM 478 C GLY A 355 -6.699 4.396 11.956 1.00 0.00 C ATOM 479 O GLY A 355 -7.712 4.076 12.568 1.00 0.00 O ATOM 0 H GLY A 355 -5.267 6.096 10.321 1.00 0.00 H new ATOM 0 HA2 GLY A 355 -7.588 5.285 10.232 1.00 0.00 H new ATOM 0 HA3 GLY A 355 -6.950 3.675 9.964 1.00 0.00 H new ATOM 483 N GLY A 356 -5.535 4.574 12.541 1.00 0.00 N ATOM 484 CA GLY A 356 -5.380 4.321 13.956 1.00 0.00 C ATOM 485 C GLY A 356 -5.860 5.446 14.871 1.00 0.00 C ATOM 486 O GLY A 356 -7.018 5.468 15.284 1.00 0.00 O ATOM 0 H GLY A 356 -4.690 4.890 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 356 -5.924 3.411 14.208 1.00 0.00 H new ATOM 0 HA3 GLY A 356 -4.327 4.130 14.162 1.00 0.00 H new ATOM 490 N SER A 357 -4.970 6.379 15.174 1.00 0.00 N ATOM 491 CA SER A 357 -5.240 7.425 16.164 1.00 0.00 C ATOM 492 C SER A 357 -6.024 8.630 15.614 1.00 0.00 C ATOM 493 O SER A 357 -6.195 9.624 16.321 1.00 0.00 O ATOM 494 CB SER A 357 -3.929 7.879 16.783 1.00 0.00 C ATOM 495 OG SER A 357 -3.182 6.763 17.235 1.00 0.00 O ATOM 0 H SER A 357 -4.045 6.438 14.747 1.00 0.00 H new ATOM 0 HA SER A 357 -5.889 6.981 16.919 1.00 0.00 H new ATOM 0 HB2 SER A 357 -3.349 8.440 16.050 1.00 0.00 H new ATOM 0 HB3 SER A 357 -4.127 8.553 17.616 1.00 0.00 H new ATOM 0 HG SER A 357 -2.340 7.071 17.630 1.00 0.00 H new ATOM 501 N ASN A 358 -6.453 8.559 14.345 1.00 0.00 N ATOM 502 CA ASN A 358 -7.320 9.598 13.728 1.00 0.00 C ATOM 503 C ASN A 358 -6.568 10.875 13.372 1.00 0.00 C ATOM 504 O ASN A 358 -7.019 11.633 12.514 1.00 0.00 O ATOM 505 CB ASN A 358 -8.532 9.934 14.621 1.00 0.00 C ATOM 506 CG ASN A 358 -9.565 8.826 14.681 1.00 0.00 C ATOM 507 OD1 ASN A 358 -9.254 7.652 14.502 1.00 0.00 O ATOM 508 ND2 ASN A 358 -10.804 9.195 14.938 1.00 0.00 N ATOM 0 H ASN A 358 -6.217 7.792 13.716 1.00 0.00 H new ATOM 0 HA ASN A 358 -7.676 9.160 12.796 1.00 0.00 H new ATOM 0 HB2 ASN A 358 -8.181 10.148 15.631 1.00 0.00 H new ATOM 0 HB3 ASN A 358 -9.006 10.842 14.249 1.00 0.00 H new ATOM 0 HD21 ASN A 358 -11.543 8.495 14.994 1.00 0.00 H new ATOM 0 HD22 ASN A 358 -11.023 10.181 15.081 1.00 0.00 H new ATOM 515 N HIS A 359 -5.416 11.093 13.999 1.00 0.00 N ATOM 516 CA HIS A 359 -4.611 12.295 13.762 1.00 0.00 C ATOM 517 C HIS A 359 -4.075 12.321 12.329 1.00 0.00 C ATOM 518 O HIS A 359 -3.002 11.803 12.040 1.00 0.00 O ATOM 519 CB HIS A 359 -3.449 12.371 14.772 1.00 0.00 C ATOM 520 CG HIS A 359 -2.753 13.714 14.849 1.00 0.00 C ATOM 521 ND1 HIS A 359 -1.959 14.038 15.923 1.00 0.00 N ATOM 522 CD2 HIS A 359 -2.762 14.759 13.979 1.00 0.00 C ATOM 523 CE1 HIS A 359 -1.507 15.257 15.687 1.00 0.00 C ATOM 524 NE2 HIS A 359 -1.964 15.732 14.526 1.00 0.00 N ATOM 0 H HIS A 359 -5.014 10.450 14.681 1.00 0.00 H new ATOM 0 HA HIS A 359 -5.252 13.166 13.900 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -3.831 12.120 15.761 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -2.712 11.611 14.512 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -3.294 14.813 13.040 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -0.850 15.801 16.350 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -1.759 16.646 14.122 1.00 0.00 H new ATOM 532 N MET A 360 -4.866 12.870 11.441 1.00 0.00 N ATOM 533 CA MET A 360 -4.481 13.020 10.047 1.00 0.00 C ATOM 534 C MET A 360 -3.802 14.359 9.810 1.00 0.00 C ATOM 535 O MET A 360 -4.230 15.389 10.323 1.00 0.00 O ATOM 536 CB MET A 360 -5.709 12.864 9.128 1.00 0.00 C ATOM 537 CG MET A 360 -5.541 13.466 7.728 1.00 0.00 C ATOM 538 SD MET A 360 -4.183 12.740 6.790 1.00 0.00 S ATOM 539 CE MET A 360 -4.913 11.198 6.296 1.00 0.00 C ATOM 0 H MET A 360 -5.796 13.228 11.657 1.00 0.00 H new ATOM 0 HA MET A 360 -3.766 12.233 9.807 1.00 0.00 H new ATOM 0 HB2 MET A 360 -5.938 11.803 9.028 1.00 0.00 H new ATOM 0 HB3 MET A 360 -6.568 13.332 9.609 1.00 0.00 H new ATOM 0 HG2 MET A 360 -6.468 13.334 7.171 1.00 0.00 H new ATOM 0 HG3 MET A 360 -5.375 14.539 7.820 1.00 0.00 H new ATOM 0 HE1 MET A 360 -4.249 10.377 6.568 1.00 0.00 H new ATOM 0 HE2 MET A 360 -5.872 11.071 6.799 1.00 0.00 H new ATOM 0 HE3 MET A 360 -5.067 11.197 5.217 1.00 0.00 H new ATOM 549 N VAL A 361 -2.743 14.328 9.044 1.00 0.00 N ATOM 550 CA VAL A 361 -2.024 15.518 8.684 1.00 0.00 C ATOM 551 C VAL A 361 -1.716 15.502 7.191 1.00 0.00 C ATOM 552 O VAL A 361 -1.329 14.464 6.635 1.00 0.00 O ATOM 553 CB VAL A 361 -0.729 15.692 9.525 1.00 0.00 C ATOM 554 CG1 VAL A 361 0.119 14.442 9.496 1.00 0.00 C ATOM 555 CG2 VAL A 361 0.072 16.896 9.058 1.00 0.00 C ATOM 0 H VAL A 361 -2.354 13.471 8.651 1.00 0.00 H new ATOM 0 HA VAL A 361 -2.656 16.378 8.906 1.00 0.00 H new ATOM 0 HB VAL A 361 -1.032 15.867 10.557 1.00 0.00 H new ATOM 0 HG11 VAL A 361 1.017 14.598 10.094 1.00 0.00 H new ATOM 0 HG12 VAL A 361 -0.450 13.607 9.906 1.00 0.00 H new ATOM 0 HG13 VAL A 361 0.402 14.218 8.468 1.00 0.00 H new ATOM 0 HG21 VAL A 361 0.972 16.992 9.665 1.00 0.00 H new ATOM 0 HG22 VAL A 361 0.352 16.764 8.013 1.00 0.00 H new ATOM 0 HG23 VAL A 361 -0.533 17.797 9.161 1.00 0.00 H new ATOM 565 N CYS A 362 -1.929 16.646 6.553 1.00 0.00 N ATOM 566 CA CYS A 362 -1.743 16.809 5.121 1.00 0.00 C ATOM 567 C CYS A 362 -0.369 16.339 4.661 1.00 0.00 C ATOM 568 O CYS A 362 0.622 16.430 5.398 1.00 0.00 O ATOM 569 CB CYS A 362 -1.946 18.268 4.744 1.00 0.00 C ATOM 570 SG CYS A 362 -1.908 18.594 2.965 1.00 0.00 S ATOM 0 H CYS A 362 -2.240 17.496 7.024 1.00 0.00 H new ATOM 0 HA CYS A 362 -2.483 16.187 4.618 1.00 0.00 H new ATOM 0 HB2 CYS A 362 -2.904 18.603 5.142 1.00 0.00 H new ATOM 0 HB3 CYS A 362 -1.173 18.866 5.227 1.00 0.00 H new ATOM 575 N ARG A 363 -0.318 15.856 3.434 1.00 0.00 N ATOM 576 CA ARG A 363 0.913 15.350 2.855 1.00 0.00 C ATOM 577 C ARG A 363 1.620 16.467 2.126 1.00 0.00 C ATOM 578 O ARG A 363 2.848 16.489 2.045 1.00 0.00 O ATOM 579 CB ARG A 363 0.624 14.222 1.864 1.00 0.00 C ATOM 580 CG ARG A 363 -0.572 13.349 2.228 1.00 0.00 C ATOM 581 CD ARG A 363 -0.415 12.682 3.595 1.00 0.00 C ATOM 582 NE ARG A 363 0.673 11.708 3.618 1.00 0.00 N ATOM 583 CZ ARG A 363 1.035 11.004 4.695 1.00 0.00 C ATOM 584 NH1 ARG A 363 0.418 11.198 5.859 1.00 0.00 N1+ ATOM 585 NH2 ARG A 363 2.019 10.120 4.613 1.00 0.00 N ATOM 0 H ARG A 363 -1.125 15.803 2.812 1.00 0.00 H new ATOM 0 HA ARG A 363 1.538 14.964 3.660 1.00 0.00 H new ATOM 0 HB2 ARG A 363 0.454 14.656 0.879 1.00 0.00 H new ATOM 0 HB3 ARG A 363 1.508 13.590 1.785 1.00 0.00 H new ATOM 0 HG2 ARG A 363 -1.476 13.958 2.226 1.00 0.00 H new ATOM 0 HG3 ARG A 363 -0.703 12.581 1.465 1.00 0.00 H new ATOM 0 HD2 ARG A 363 -0.231 13.446 4.350 1.00 0.00 H new ATOM 0 HD3 ARG A 363 -1.348 12.187 3.864 1.00 0.00 H new ATOM 0 HE ARG A 363 1.192 11.555 2.753 1.00 0.00 H new ATOM 0 HH11 ARG A 363 -0.333 11.885 5.930 1.00 0.00 H new ATOM 0 HH12 ARG A 363 0.696 10.660 6.680 1.00 0.00 H new ATOM 0 HH21 ARG A 363 2.502 9.975 3.726 1.00 0.00 H new ATOM 0 HH22 ARG A 363 2.293 9.584 5.436 1.00 0.00 H new ATOM 599 N ASN A 364 0.830 17.399 1.596 1.00 0.00 N ATOM 600 CA ASN A 364 1.356 18.529 0.847 1.00 0.00 C ATOM 601 C ASN A 364 2.371 19.284 1.679 1.00 0.00 C ATOM 602 O ASN A 364 2.048 19.811 2.739 1.00 0.00 O ATOM 603 CB ASN A 364 0.211 19.457 0.401 1.00 0.00 C ATOM 604 CG ASN A 364 0.680 20.714 -0.316 1.00 0.00 C ATOM 605 OD1 ASN A 364 1.784 20.766 -0.862 1.00 0.00 O ATOM 606 ND2 ASN A 364 -0.173 21.724 -0.339 1.00 0.00 N ATOM 0 H ASN A 364 -0.187 17.389 1.675 1.00 0.00 H new ATOM 0 HA ASN A 364 1.857 18.155 -0.046 1.00 0.00 H new ATOM 0 HB2 ASN A 364 -0.457 18.903 -0.258 1.00 0.00 H new ATOM 0 HB3 ASN A 364 -0.371 19.746 1.276 1.00 0.00 H new ATOM 0 HD21 ASN A 364 0.073 22.588 -0.822 1.00 0.00 H new ATOM 0 HD22 ASN A 364 -1.077 21.639 0.126 1.00 0.00 H new ATOM 613 N GLN A 365 3.603 19.317 1.197 1.00 0.00 N ATOM 614 CA GLN A 365 4.693 19.997 1.896 1.00 0.00 C ATOM 615 C GLN A 365 4.477 21.504 1.941 1.00 0.00 C ATOM 616 O GLN A 365 5.187 22.219 2.635 1.00 0.00 O ATOM 617 CB GLN A 365 6.047 19.679 1.257 1.00 0.00 C ATOM 618 CG GLN A 365 6.026 19.630 -0.259 1.00 0.00 C ATOM 619 CD GLN A 365 5.930 18.212 -0.804 1.00 0.00 C ATOM 620 OE1 GLN A 365 6.400 17.928 -1.904 1.00 0.00 O ATOM 621 NE2 GLN A 365 5.344 17.308 -0.031 1.00 0.00 N ATOM 0 H GLN A 365 3.879 18.879 0.318 1.00 0.00 H new ATOM 0 HA GLN A 365 4.696 19.623 2.920 1.00 0.00 H new ATOM 0 HB2 GLN A 365 6.771 20.430 1.575 1.00 0.00 H new ATOM 0 HB3 GLN A 365 6.397 18.719 1.635 1.00 0.00 H new ATOM 0 HG2 GLN A 365 5.180 20.213 -0.625 1.00 0.00 H new ATOM 0 HG3 GLN A 365 6.929 20.102 -0.645 1.00 0.00 H new ATOM 0 HE21 GLN A 365 4.965 17.581 0.876 1.00 0.00 H new ATOM 0 HE22 GLN A 365 5.272 16.340 -0.343 1.00 0.00 H new ATOM 630 N ASN A 366 3.506 21.971 1.197 1.00 0.00 N ATOM 631 CA ASN A 366 3.152 23.381 1.185 1.00 0.00 C ATOM 632 C ASN A 366 1.928 23.615 2.069 1.00 0.00 C ATOM 633 O ASN A 366 1.309 24.677 2.029 1.00 0.00 O ATOM 634 CB ASN A 366 2.843 23.842 -0.240 1.00 0.00 C ATOM 635 CG ASN A 366 3.996 23.634 -1.200 1.00 0.00 C ATOM 636 OD1 ASN A 366 4.861 24.494 -1.349 1.00 0.00 O ATOM 637 ND2 ASN A 366 3.999 22.500 -1.876 1.00 0.00 N ATOM 0 H ASN A 366 2.936 21.391 0.581 1.00 0.00 H new ATOM 0 HA ASN A 366 3.996 23.954 1.568 1.00 0.00 H new ATOM 0 HB2 ASN A 366 1.971 23.302 -0.608 1.00 0.00 H new ATOM 0 HB3 ASN A 366 2.579 24.900 -0.223 1.00 0.00 H new ATOM 0 HD21 ASN A 366 4.739 22.311 -2.552 1.00 0.00 H new ATOM 0 HD22 ASN A 366 3.262 21.812 -1.722 1.00 0.00 H new ATOM 644 N CYS A 367 1.592 22.612 2.876 1.00 0.00 N ATOM 645 CA CYS A 367 0.419 22.674 3.729 1.00 0.00 C ATOM 646 C CYS A 367 0.709 22.021 5.066 1.00 0.00 C ATOM 647 O CYS A 367 0.924 22.709 6.067 1.00 0.00 O ATOM 648 CB CYS A 367 -0.761 21.973 3.050 1.00 0.00 C ATOM 649 SG CYS A 367 -2.346 22.081 3.953 1.00 0.00 S ATOM 0 H CYS A 367 2.122 21.744 2.954 1.00 0.00 H new ATOM 0 HA CYS A 367 0.162 23.720 3.896 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -0.896 22.401 2.057 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -0.509 20.921 2.912 1.00 0.00 H new ATOM 654 N LYS A 368 0.727 20.684 5.065 1.00 0.00 N ATOM 655 CA LYS A 368 0.998 19.893 6.265 1.00 0.00 C ATOM 656 C LYS A 368 0.042 20.249 7.405 1.00 0.00 C ATOM 657 O LYS A 368 0.405 20.179 8.579 1.00 0.00 O ATOM 658 CB LYS A 368 2.444 20.095 6.692 1.00 0.00 C ATOM 659 CG LYS A 368 3.451 19.649 5.644 1.00 0.00 C ATOM 660 CD LYS A 368 4.822 20.227 5.916 1.00 0.00 C ATOM 661 CE LYS A 368 4.857 21.721 5.628 1.00 0.00 C ATOM 662 NZ LYS A 368 6.024 22.388 6.260 1.00 0.00 N1+ ATOM 0 H LYS A 368 0.554 20.122 4.232 1.00 0.00 H new ATOM 0 HA LYS A 368 0.835 18.842 6.027 1.00 0.00 H new ATOM 0 HB2 LYS A 368 2.605 21.150 6.915 1.00 0.00 H new ATOM 0 HB3 LYS A 368 2.623 19.544 7.615 1.00 0.00 H new ATOM 0 HG2 LYS A 368 3.509 18.561 5.633 1.00 0.00 H new ATOM 0 HG3 LYS A 368 3.112 19.961 4.656 1.00 0.00 H new ATOM 0 HD2 LYS A 368 5.095 20.048 6.956 1.00 0.00 H new ATOM 0 HD3 LYS A 368 5.563 19.718 5.300 1.00 0.00 H new ATOM 0 HE2 LYS A 368 4.889 21.881 4.550 1.00 0.00 H new ATOM 0 HE3 LYS A 368 3.938 22.181 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 6.006 23.404 6.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 5.981 22.259 7.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 6.903 21.969 5.895 1.00 0.00 H new ATOM 676 N ALA A 369 -1.178 20.618 7.051 1.00 0.00 N ATOM 677 CA ALA A 369 -2.187 20.964 8.037 1.00 0.00 C ATOM 678 C ALA A 369 -2.739 19.710 8.701 1.00 0.00 C ATOM 679 O ALA A 369 -2.951 18.695 8.045 1.00 0.00 O ATOM 680 CB ALA A 369 -3.305 21.759 7.390 1.00 0.00 C ATOM 0 H ALA A 369 -1.494 20.686 6.084 1.00 0.00 H new ATOM 0 HA ALA A 369 -1.722 21.581 8.805 1.00 0.00 H new ATOM 0 HB1 ALA A 369 -4.054 22.011 8.141 1.00 0.00 H new ATOM 0 HB2 ALA A 369 -2.899 22.675 6.961 1.00 0.00 H new ATOM 0 HB3 ALA A 369 -3.767 21.163 6.603 1.00 0.00 H new ATOM 686 N GLU A 370 -2.953 19.781 9.997 1.00 0.00 N ATOM 687 CA GLU A 370 -3.475 18.654 10.748 1.00 0.00 C ATOM 688 C GLU A 370 -4.977 18.795 10.934 1.00 0.00 C ATOM 689 O GLU A 370 -5.457 19.769 11.522 1.00 0.00 O ATOM 690 CB GLU A 370 -2.769 18.552 12.092 1.00 0.00 C ATOM 691 CG GLU A 370 -1.271 18.347 11.965 1.00 0.00 C ATOM 692 CD GLU A 370 -0.517 18.864 13.155 1.00 0.00 C ATOM 693 OE1 GLU A 370 -0.408 18.135 14.155 1.00 0.00 O ATOM 694 OE2 GLU A 370 -0.026 20.011 13.095 1.00 0.00 O1- ATOM 0 H GLU A 370 -2.773 20.613 10.558 1.00 0.00 H new ATOM 0 HA GLU A 370 -3.287 17.737 10.190 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -2.958 19.460 12.664 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -3.196 17.724 12.658 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -1.062 17.284 11.840 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -0.914 18.850 11.066 1.00 0.00 H new ATOM 701 N PHE A 371 -5.711 17.825 10.440 1.00 0.00 N ATOM 702 CA PHE A 371 -7.159 17.860 10.495 1.00 0.00 C ATOM 703 C PHE A 371 -7.730 16.492 10.811 1.00 0.00 C ATOM 704 O PHE A 371 -7.075 15.463 10.604 1.00 0.00 O ATOM 705 CB PHE A 371 -7.738 18.379 9.166 1.00 0.00 C ATOM 706 CG PHE A 371 -7.209 17.680 7.945 1.00 0.00 C ATOM 707 CD1 PHE A 371 -6.071 18.144 7.307 1.00 0.00 C ATOM 708 CD2 PHE A 371 -7.849 16.564 7.436 1.00 0.00 C ATOM 709 CE1 PHE A 371 -5.579 17.509 6.188 1.00 0.00 C ATOM 710 CE2 PHE A 371 -7.362 15.924 6.313 1.00 0.00 C ATOM 711 CZ PHE A 371 -6.223 16.399 5.691 1.00 0.00 C ATOM 0 H PHE A 371 -5.327 16.993 9.991 1.00 0.00 H new ATOM 0 HA PHE A 371 -7.444 18.542 11.296 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -8.823 18.273 9.190 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -7.524 19.444 9.082 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -5.562 19.015 7.692 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -8.738 16.190 7.921 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -4.690 17.882 5.702 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -7.870 15.055 5.922 1.00 0.00 H new ATOM 0 HZ PHE A 371 -5.838 15.899 4.815 1.00 0.00 H new ATOM 721 N CYS A 372 -8.945 16.479 11.314 1.00 0.00 N ATOM 722 CA CYS A 372 -9.623 15.246 11.607 1.00 0.00 C ATOM 723 C CYS A 372 -10.114 14.651 10.317 1.00 0.00 C ATOM 724 O CYS A 372 -11.039 15.154 9.721 1.00 0.00 O ATOM 725 CB CYS A 372 -10.798 15.487 12.546 1.00 0.00 C ATOM 726 SG CYS A 372 -11.634 13.962 13.115 1.00 0.00 S ATOM 0 H CYS A 372 -9.483 17.319 11.528 1.00 0.00 H new ATOM 0 HA CYS A 372 -8.932 14.562 12.099 1.00 0.00 H new ATOM 0 HB2 CYS A 372 -10.445 16.040 13.416 1.00 0.00 H new ATOM 0 HB3 CYS A 372 -11.527 16.120 12.041 1.00 0.00 H new ATOM 731 N TRP A 373 -9.466 13.605 9.891 1.00 0.00 N ATOM 732 CA TRP A 373 -9.811 12.918 8.655 1.00 0.00 C ATOM 733 C TRP A 373 -11.276 12.468 8.634 1.00 0.00 C ATOM 734 O TRP A 373 -11.921 12.470 7.577 1.00 0.00 O ATOM 735 CB TRP A 373 -8.873 11.724 8.487 1.00 0.00 C ATOM 736 CG TRP A 373 -9.384 10.642 7.604 1.00 0.00 C ATOM 737 CD1 TRP A 373 -10.213 9.635 7.968 1.00 0.00 C ATOM 738 CD2 TRP A 373 -9.091 10.443 6.223 1.00 0.00 C ATOM 739 NE1 TRP A 373 -10.445 8.810 6.909 1.00 0.00 N ATOM 740 CE2 TRP A 373 -9.775 9.284 5.820 1.00 0.00 C ATOM 741 CE3 TRP A 373 -8.318 11.128 5.290 1.00 0.00 C ATOM 742 CZ2 TRP A 373 -9.708 8.791 4.523 1.00 0.00 C ATOM 743 CZ3 TRP A 373 -8.256 10.637 3.999 1.00 0.00 C ATOM 744 CH2 TRP A 373 -8.946 9.480 3.627 1.00 0.00 C ATOM 0 H TRP A 373 -8.676 13.193 10.387 1.00 0.00 H new ATOM 0 HA TRP A 373 -9.691 13.611 7.822 1.00 0.00 H new ATOM 0 HB2 TRP A 373 -7.924 12.080 8.087 1.00 0.00 H new ATOM 0 HB3 TRP A 373 -8.666 11.302 9.471 1.00 0.00 H new ATOM 0 HD1 TRP A 373 -10.630 9.505 8.956 1.00 0.00 H new ATOM 0 HE1 TRP A 373 -11.027 7.972 6.928 1.00 0.00 H new ATOM 0 HE3 TRP A 373 -7.779 12.022 5.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 373 -10.239 7.896 4.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 373 -7.662 11.158 3.263 1.00 0.00 H new ATOM 0 HH2 TRP A 373 -8.874 9.125 2.610 1.00 0.00 H new ATOM 755 N VAL A 374 -11.790 12.107 9.802 1.00 0.00 N ATOM 756 CA VAL A 374 -13.148 11.588 9.935 1.00 0.00 C ATOM 757 C VAL A 374 -14.182 12.569 9.395 1.00 0.00 C ATOM 758 O VAL A 374 -14.989 12.227 8.526 1.00 0.00 O ATOM 759 CB VAL A 374 -13.475 11.273 11.408 1.00 0.00 C ATOM 760 CG1 VAL A 374 -14.883 10.724 11.542 1.00 0.00 C ATOM 761 CG2 VAL A 374 -12.458 10.298 11.984 1.00 0.00 C ATOM 0 H VAL A 374 -11.280 12.165 10.683 1.00 0.00 H new ATOM 0 HA VAL A 374 -13.194 10.672 9.347 1.00 0.00 H new ATOM 0 HB VAL A 374 -13.419 12.201 11.977 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -15.091 10.509 12.590 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -15.597 11.460 11.174 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -14.973 9.808 10.959 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -12.705 10.087 13.025 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -12.478 9.371 11.411 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -11.462 10.737 11.929 1.00 0.00 H new ATOM 771 N CYS A 375 -14.151 13.785 9.903 1.00 0.00 N ATOM 772 CA CYS A 375 -15.098 14.799 9.493 1.00 0.00 C ATOM 773 C CYS A 375 -14.461 15.774 8.517 1.00 0.00 C ATOM 774 O CYS A 375 -15.140 16.654 7.977 1.00 0.00 O ATOM 775 CB CYS A 375 -15.615 15.548 10.724 1.00 0.00 C ATOM 776 SG CYS A 375 -14.302 16.118 11.856 1.00 0.00 S ATOM 0 H CYS A 375 -13.477 14.094 10.603 1.00 0.00 H new ATOM 0 HA CYS A 375 -15.932 14.312 8.988 1.00 0.00 H new ATOM 0 HB2 CYS A 375 -16.195 16.410 10.394 1.00 0.00 H new ATOM 0 HB3 CYS A 375 -16.295 14.897 11.273 1.00 0.00 H new ATOM 781 N LEU A 376 -13.161 15.595 8.280 1.00 0.00 N ATOM 782 CA LEU A 376 -12.381 16.507 7.440 1.00 0.00 C ATOM 783 C LEU A 376 -12.428 17.919 8.009 1.00 0.00 C ATOM 784 O LEU A 376 -12.373 18.912 7.276 1.00 0.00 O ATOM 785 CB LEU A 376 -12.855 16.477 5.975 1.00 0.00 C ATOM 786 CG LEU A 376 -12.438 15.251 5.161 1.00 0.00 C ATOM 787 CD1 LEU A 376 -12.992 15.338 3.749 1.00 0.00 C ATOM 788 CD2 LEU A 376 -10.920 15.117 5.128 1.00 0.00 C ATOM 0 H LEU A 376 -12.621 14.819 8.662 1.00 0.00 H new ATOM 0 HA LEU A 376 -11.345 16.168 7.445 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -13.943 16.543 5.964 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -12.477 17.368 5.473 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.850 14.364 5.643 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.686 14.458 3.183 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -14.080 15.384 3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.608 16.234 3.262 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -10.645 14.239 4.544 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -10.486 16.007 4.672 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -10.542 15.010 6.145 1.00 0.00 H new ATOM 800 N GLY A 377 -12.511 17.998 9.327 1.00 0.00 N ATOM 801 CA GLY A 377 -12.540 19.274 9.992 1.00 0.00 C ATOM 802 C GLY A 377 -11.255 19.528 10.736 1.00 0.00 C ATOM 803 O GLY A 377 -10.320 18.751 10.621 1.00 0.00 O ATOM 0 H GLY A 377 -12.559 17.191 9.949 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -12.702 20.065 9.260 1.00 0.00 H new ATOM 0 HA3 GLY A 377 -13.379 19.306 10.687 1.00 0.00 H new ATOM 807 N PRO A 378 -11.182 20.598 11.517 1.00 0.00 N ATOM 808 CA PRO A 378 -9.972 20.942 12.261 1.00 0.00 C ATOM 809 C PRO A 378 -9.683 19.937 13.379 1.00 0.00 C ATOM 810 O PRO A 378 -10.555 19.626 14.187 1.00 0.00 O ATOM 811 CB PRO A 378 -10.300 22.320 12.848 1.00 0.00 C ATOM 812 CG PRO A 378 -11.789 22.350 12.920 1.00 0.00 C ATOM 813 CD PRO A 378 -12.275 21.553 11.750 1.00 0.00 C ATOM 0 HA PRO A 378 -9.082 20.935 11.631 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -9.852 22.448 13.833 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -9.917 23.122 12.217 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -12.143 21.922 13.858 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -12.161 23.374 12.876 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -13.214 21.045 11.971 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -12.451 22.184 10.879 1.00 0.00 H new ATOM 821 N TRP A 379 -8.458 19.432 13.419 1.00 0.00 N ATOM 822 CA TRP A 379 -8.056 18.471 14.449 1.00 0.00 C ATOM 823 C TRP A 379 -7.871 19.173 15.791 1.00 0.00 C ATOM 824 O TRP A 379 -7.910 18.544 16.845 1.00 0.00 O ATOM 825 CB TRP A 379 -6.755 17.764 14.037 1.00 0.00 C ATOM 826 CG TRP A 379 -6.196 16.856 15.093 1.00 0.00 C ATOM 827 CD1 TRP A 379 -5.139 17.114 15.914 1.00 0.00 C ATOM 828 CD2 TRP A 379 -6.678 15.555 15.452 1.00 0.00 C ATOM 829 NE1 TRP A 379 -4.926 16.053 16.756 1.00 0.00 N ATOM 830 CE2 TRP A 379 -5.855 15.082 16.493 1.00 0.00 C ATOM 831 CE3 TRP A 379 -7.718 14.743 14.992 1.00 0.00 C ATOM 832 CZ2 TRP A 379 -6.045 13.835 17.084 1.00 0.00 C ATOM 833 CZ3 TRP A 379 -7.903 13.507 15.580 1.00 0.00 C ATOM 834 CH2 TRP A 379 -7.071 13.064 16.614 1.00 0.00 C ATOM 0 H TRP A 379 -7.722 19.668 12.753 1.00 0.00 H new ATOM 0 HA TRP A 379 -8.844 17.725 14.553 1.00 0.00 H new ATOM 0 HB2 TRP A 379 -6.939 17.184 13.133 1.00 0.00 H new ATOM 0 HB3 TRP A 379 -6.008 18.517 13.786 1.00 0.00 H new ATOM 0 HD1 TRP A 379 -4.554 18.022 15.903 1.00 0.00 H new ATOM 0 HE1 TRP A 379 -4.194 15.996 17.464 1.00 0.00 H new ATOM 0 HE3 TRP A 379 -8.364 15.075 14.193 1.00 0.00 H new ATOM 0 HZ2 TRP A 379 -5.406 13.490 17.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 379 -8.705 12.871 15.235 1.00 0.00 H new ATOM 0 HH2 TRP A 379 -7.243 12.091 17.050 1.00 0.00 H new ATOM 845 N GLU A 380 -7.702 20.482 15.729 1.00 0.00 N ATOM 846 CA GLU A 380 -7.455 21.317 16.904 1.00 0.00 C ATOM 847 C GLU A 380 -8.464 21.059 18.057 1.00 0.00 C ATOM 848 O GLU A 380 -8.048 20.716 19.164 1.00 0.00 O ATOM 849 CB GLU A 380 -7.436 22.790 16.494 1.00 0.00 C ATOM 850 CG GLU A 380 -6.514 23.060 15.321 1.00 0.00 C ATOM 851 CD GLU A 380 -6.593 24.476 14.818 1.00 0.00 C ATOM 852 OE1 GLU A 380 -7.504 24.779 14.020 1.00 0.00 O ATOM 853 OE2 GLU A 380 -5.725 25.287 15.189 1.00 0.00 O1- ATOM 0 H GLU A 380 -7.732 21.006 14.855 1.00 0.00 H new ATOM 0 HA GLU A 380 -6.479 21.043 17.303 1.00 0.00 H new ATOM 0 HB2 GLU A 380 -8.447 23.104 16.235 1.00 0.00 H new ATOM 0 HB3 GLU A 380 -7.122 23.395 17.344 1.00 0.00 H new ATOM 0 HG2 GLU A 380 -5.488 22.843 15.617 1.00 0.00 H new ATOM 0 HG3 GLU A 380 -6.762 22.378 14.508 1.00 0.00 H new ATOM 860 N PRO A 381 -9.807 21.206 17.822 1.00 0.00 N ATOM 861 CA PRO A 381 -10.814 20.952 18.871 1.00 0.00 C ATOM 862 C PRO A 381 -10.848 19.483 19.303 1.00 0.00 C ATOM 863 O PRO A 381 -11.270 19.165 20.412 1.00 0.00 O ATOM 864 CB PRO A 381 -12.142 21.340 18.205 1.00 0.00 C ATOM 865 CG PRO A 381 -11.877 21.243 16.745 1.00 0.00 C ATOM 866 CD PRO A 381 -10.442 21.638 16.561 1.00 0.00 C ATOM 0 HA PRO A 381 -10.598 21.515 19.779 1.00 0.00 H new ATOM 0 HB2 PRO A 381 -12.947 20.669 18.506 1.00 0.00 H new ATOM 0 HB3 PRO A 381 -12.446 22.348 18.486 1.00 0.00 H new ATOM 0 HG2 PRO A 381 -12.053 20.230 16.382 1.00 0.00 H new ATOM 0 HG3 PRO A 381 -12.539 21.902 16.183 1.00 0.00 H new ATOM 0 HD2 PRO A 381 -9.997 21.145 15.697 1.00 0.00 H new ATOM 0 HD3 PRO A 381 -10.337 22.712 16.405 1.00 0.00 H new ATOM 874 N HIS A 382 -10.391 18.597 18.420 1.00 0.00 N ATOM 875 CA HIS A 382 -10.362 17.166 18.711 1.00 0.00 C ATOM 876 C HIS A 382 -9.218 16.845 19.669 1.00 0.00 C ATOM 877 O HIS A 382 -9.376 16.927 20.895 1.00 0.00 O ATOM 878 CB HIS A 382 -10.204 16.336 17.418 1.00 0.00 C ATOM 879 CG HIS A 382 -11.356 16.420 16.457 1.00 0.00 C ATOM 880 ND1 HIS A 382 -11.584 17.487 15.611 1.00 0.00 N ATOM 881 CD2 HIS A 382 -12.338 15.519 16.193 1.00 0.00 C ATOM 882 CE1 HIS A 382 -12.667 17.210 14.878 1.00 0.00 C ATOM 883 NE2 HIS A 382 -13.167 16.023 15.187 1.00 0.00 N ATOM 0 H HIS A 382 -10.036 18.846 17.497 1.00 0.00 H new ATOM 0 HA HIS A 382 -11.311 16.901 19.177 1.00 0.00 H new ATOM 0 HB2 HIS A 382 -9.299 16.662 16.905 1.00 0.00 H new ATOM 0 HB3 HIS A 382 -10.056 15.291 17.692 1.00 0.00 H new ATOM 0 HD1 HIS A 382 -11.024 18.338 15.555 1.00 0.00 H new ATOM 0 HD2 HIS A 382 -12.459 14.564 16.683 1.00 0.00 H new ATOM 0 HE1 HIS A 382 -13.081 17.870 14.130 1.00 0.00 H new ATOM 891 N GLY A 383 -8.055 16.526 19.101 1.00 0.00 N ATOM 892 CA GLY A 383 -6.889 16.185 19.890 1.00 0.00 C ATOM 893 C GLY A 383 -7.184 15.128 20.931 1.00 0.00 C ATOM 894 O GLY A 383 -7.777 14.089 20.628 1.00 0.00 O ATOM 0 H GLY A 383 -7.903 16.499 18.093 1.00 0.00 H new ATOM 0 HA2 GLY A 383 -6.098 15.829 19.229 1.00 0.00 H new ATOM 0 HA3 GLY A 383 -6.513 17.081 20.383 1.00 0.00 H new ATOM 898 N SER A 384 -6.781 15.400 22.151 1.00 0.00 N ATOM 899 CA SER A 384 -7.012 14.504 23.259 1.00 0.00 C ATOM 900 C SER A 384 -7.749 15.233 24.378 1.00 0.00 C ATOM 901 O SER A 384 -7.768 14.783 25.527 1.00 0.00 O ATOM 902 CB SER A 384 -5.675 13.963 23.763 1.00 0.00 C ATOM 903 OG SER A 384 -4.732 15.015 23.917 1.00 0.00 O ATOM 0 H SER A 384 -6.282 16.253 22.403 1.00 0.00 H new ATOM 0 HA SER A 384 -7.630 13.670 22.927 1.00 0.00 H new ATOM 0 HB2 SER A 384 -5.819 13.455 24.717 1.00 0.00 H new ATOM 0 HB3 SER A 384 -5.290 13.222 23.062 1.00 0.00 H new ATOM 0 HG SER A 384 -3.883 14.648 24.242 1.00 0.00 H new ATOM 909 N ALA A 385 -8.367 16.354 24.034 1.00 0.00 N ATOM 910 CA ALA A 385 -9.079 17.161 25.008 1.00 0.00 C ATOM 911 C ALA A 385 -10.523 16.717 25.136 1.00 0.00 C ATOM 912 O ALA A 385 -10.914 16.110 26.131 1.00 0.00 O ATOM 913 CB ALA A 385 -9.014 18.638 24.629 1.00 0.00 C ATOM 0 H ALA A 385 -8.388 16.724 23.084 1.00 0.00 H new ATOM 0 HA ALA A 385 -8.594 17.023 25.974 1.00 0.00 H new ATOM 0 HB1 ALA A 385 -9.553 19.228 25.370 1.00 0.00 H new ATOM 0 HB2 ALA A 385 -7.973 18.960 24.596 1.00 0.00 H new ATOM 0 HB3 ALA A 385 -9.469 18.783 23.649 1.00 0.00 H new ATOM 919 N TRP A 386 -11.297 16.997 24.115 1.00 0.00 N ATOM 920 CA TRP A 386 -12.711 16.688 24.110 1.00 0.00 C ATOM 921 C TRP A 386 -13.188 16.574 22.664 1.00 0.00 C ATOM 922 O TRP A 386 -12.401 16.225 21.778 1.00 0.00 O ATOM 923 CB TRP A 386 -13.488 17.807 24.849 1.00 0.00 C ATOM 924 CG TRP A 386 -13.554 19.104 24.083 1.00 0.00 C ATOM 925 CD1 TRP A 386 -12.509 19.841 23.618 1.00 0.00 C ATOM 926 CD2 TRP A 386 -14.740 19.803 23.688 1.00 0.00 C ATOM 927 NE1 TRP A 386 -12.969 20.938 22.951 1.00 0.00 N ATOM 928 CE2 TRP A 386 -14.330 20.945 22.985 1.00 0.00 C ATOM 929 CE3 TRP A 386 -16.103 19.569 23.860 1.00 0.00 C ATOM 930 CZ2 TRP A 386 -15.231 21.853 22.453 1.00 0.00 C ATOM 931 CZ3 TRP A 386 -17.003 20.473 23.331 1.00 0.00 C ATOM 932 CH2 TRP A 386 -16.564 21.603 22.634 1.00 0.00 C ATOM 0 H TRP A 386 -10.966 17.446 23.261 1.00 0.00 H new ATOM 0 HA TRP A 386 -12.890 15.743 24.622 1.00 0.00 H new ATOM 0 HB2 TRP A 386 -14.502 17.462 25.050 1.00 0.00 H new ATOM 0 HB3 TRP A 386 -13.016 17.989 25.815 1.00 0.00 H new ATOM 0 HD1 TRP A 386 -11.467 19.593 23.757 1.00 0.00 H new ATOM 0 HE1 TRP A 386 -12.386 21.642 22.498 1.00 0.00 H new ATOM 0 HE3 TRP A 386 -16.449 18.698 24.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 386 -14.893 22.726 21.915 1.00 0.00 H new ATOM 0 HZ3 TRP A 386 -18.062 20.305 23.458 1.00 0.00 H new ATOM 0 HH2 TRP A 386 -17.291 22.292 22.231 1.00 0.00 H new ATOM 943 N TYR A 387 -14.472 16.857 22.448 1.00 0.00 N ATOM 944 CA TYR A 387 -15.077 16.876 21.127 1.00 0.00 C ATOM 945 C TYR A 387 -15.197 15.467 20.565 1.00 0.00 C ATOM 946 O TYR A 387 -14.289 14.969 19.890 1.00 0.00 O ATOM 947 CB TYR A 387 -14.289 17.789 20.170 1.00 0.00 C ATOM 948 CG TYR A 387 -15.037 18.144 18.899 1.00 0.00 C ATOM 949 CD1 TYR A 387 -14.964 17.332 17.778 1.00 0.00 C ATOM 950 CD2 TYR A 387 -15.810 19.294 18.826 1.00 0.00 C ATOM 951 CE1 TYR A 387 -15.641 17.652 16.618 1.00 0.00 C ATOM 952 CE2 TYR A 387 -16.489 19.623 17.667 1.00 0.00 C ATOM 953 CZ TYR A 387 -16.401 18.796 16.567 1.00 0.00 C ATOM 954 OH TYR A 387 -17.068 19.122 15.402 1.00 0.00 O ATOM 0 H TYR A 387 -15.125 17.082 23.198 1.00 0.00 H new ATOM 0 HA TYR A 387 -16.082 17.286 21.224 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -14.028 18.708 20.694 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -13.353 17.297 19.903 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -14.367 16.433 17.813 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -15.882 19.942 19.687 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -15.574 17.006 15.755 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -17.085 20.523 17.624 1.00 0.00 H new ATOM 0 HH TYR A 387 -17.561 19.959 15.531 1.00 0.00 H new ATOM 964 N ASN A 388 -16.308 14.824 20.866 1.00 0.00 N ATOM 965 CA ASN A 388 -16.552 13.467 20.401 1.00 0.00 C ATOM 966 C ASN A 388 -16.928 13.457 18.930 1.00 0.00 C ATOM 967 O ASN A 388 -17.996 13.943 18.546 1.00 0.00 O ATOM 968 CB ASN A 388 -17.650 12.793 21.233 1.00 0.00 C ATOM 969 CG ASN A 388 -17.939 11.362 20.783 1.00 0.00 C ATOM 970 OD1 ASN A 388 -17.285 10.418 21.221 1.00 0.00 O ATOM 971 ND2 ASN A 388 -18.921 11.195 19.916 1.00 0.00 N ATOM 0 H ASN A 388 -17.060 15.218 21.432 1.00 0.00 H new ATOM 0 HA ASN A 388 -15.628 12.902 20.525 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -17.352 12.786 22.282 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -18.565 13.382 21.165 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -19.158 10.259 19.588 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -19.442 12.002 19.574 1.00 0.00 H new ATOM 978 N CYS A 389 -16.040 12.919 18.116 1.00 0.00 N ATOM 979 CA CYS A 389 -16.277 12.814 16.692 1.00 0.00 C ATOM 980 C CYS A 389 -16.784 11.417 16.369 1.00 0.00 C ATOM 981 O CYS A 389 -16.111 10.420 16.662 1.00 0.00 O ATOM 982 CB CYS A 389 -14.982 13.104 15.925 1.00 0.00 C ATOM 983 SG CYS A 389 -15.189 13.305 14.127 1.00 0.00 S ATOM 0 H CYS A 389 -15.141 12.546 18.421 1.00 0.00 H new ATOM 0 HA CYS A 389 -17.028 13.544 16.391 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -14.533 14.011 16.329 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -14.279 12.292 16.107 1.00 0.00 H new ATOM 988 N ASN A 390 -17.963 11.336 15.790 1.00 0.00 N ATOM 989 CA ASN A 390 -18.550 10.048 15.460 1.00 0.00 C ATOM 990 C ASN A 390 -17.936 9.478 14.199 1.00 0.00 C ATOM 991 O ASN A 390 -18.396 9.750 13.089 1.00 0.00 O ATOM 992 CB ASN A 390 -20.072 10.145 15.315 1.00 0.00 C ATOM 993 CG ASN A 390 -20.772 10.376 16.638 1.00 0.00 C ATOM 994 OD1 ASN A 390 -21.002 11.510 17.046 1.00 0.00 O ATOM 995 ND2 ASN A 390 -21.113 9.298 17.320 1.00 0.00 N ATOM 0 H ASN A 390 -18.535 12.142 15.537 1.00 0.00 H new ATOM 0 HA ASN A 390 -18.333 9.372 16.287 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -20.317 10.959 14.632 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -20.449 9.227 14.865 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -21.585 9.392 18.219 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -20.905 8.372 16.947 1.00 0.00 H new ATOM 1002 N ARG A 391 -16.883 8.702 14.373 1.00 0.00 N ATOM 1003 CA ARG A 391 -16.202 8.079 13.266 1.00 0.00 C ATOM 1004 C ARG A 391 -17.003 6.900 12.748 1.00 0.00 C ATOM 1005 O ARG A 391 -17.361 6.847 11.575 1.00 0.00 O ATOM 1006 CB ARG A 391 -14.809 7.624 13.697 1.00 0.00 C ATOM 1007 CG ARG A 391 -14.046 6.897 12.614 1.00 0.00 C ATOM 1008 CD ARG A 391 -12.730 6.362 13.135 1.00 0.00 C ATOM 1009 NE ARG A 391 -12.053 5.526 12.145 1.00 0.00 N ATOM 1010 CZ ARG A 391 -10.875 4.928 12.340 1.00 0.00 C ATOM 1011 NH1 ARG A 391 -10.204 5.120 13.466 1.00 0.00 N1+ ATOM 1012 NH2 ARG A 391 -10.359 4.151 11.396 1.00 0.00 N ATOM 0 H ARG A 391 -16.480 8.489 15.286 1.00 0.00 H new ATOM 0 HA ARG A 391 -16.101 8.808 12.462 1.00 0.00 H new ATOM 0 HB2 ARG A 391 -14.234 8.494 14.013 1.00 0.00 H new ATOM 0 HB3 ARG A 391 -14.902 6.971 14.565 1.00 0.00 H new ATOM 0 HG2 ARG A 391 -14.649 6.074 12.230 1.00 0.00 H new ATOM 0 HG3 ARG A 391 -13.862 7.573 11.779 1.00 0.00 H new ATOM 0 HD2 ARG A 391 -12.083 7.195 13.411 1.00 0.00 H new ATOM 0 HD3 ARG A 391 -12.907 5.782 14.041 1.00 0.00 H new ATOM 0 HE ARG A 391 -12.512 5.390 11.244 1.00 0.00 H new ATOM 0 HH11 ARG A 391 -10.587 5.728 14.190 1.00 0.00 H new ATOM 0 HH12 ARG A 391 -9.305 4.660 13.609 1.00 0.00 H new ATOM 0 HH21 ARG A 391 -10.862 4.010 10.520 1.00 0.00 H new ATOM 0 HH22 ARG A 391 -9.459 3.695 11.546 1.00 0.00 H new ATOM 1026 N TYR A 392 -17.272 5.955 13.625 1.00 0.00 N ATOM 1027 CA TYR A 392 -18.055 4.787 13.264 1.00 0.00 C ATOM 1028 C TYR A 392 -19.030 4.416 14.375 1.00 0.00 C ATOM 1029 O TYR A 392 -20.068 3.818 14.121 1.00 0.00 O ATOM 1030 CB TYR A 392 -17.136 3.594 12.943 1.00 0.00 C ATOM 1031 CG TYR A 392 -16.266 3.149 14.104 1.00 0.00 C ATOM 1032 CD1 TYR A 392 -15.040 3.748 14.347 1.00 0.00 C ATOM 1033 CD2 TYR A 392 -16.680 2.133 14.959 1.00 0.00 C ATOM 1034 CE1 TYR A 392 -14.250 3.353 15.402 1.00 0.00 C ATOM 1035 CE2 TYR A 392 -15.895 1.734 16.019 1.00 0.00 C ATOM 1036 CZ TYR A 392 -14.680 2.346 16.236 1.00 0.00 C ATOM 1037 OH TYR A 392 -13.897 1.955 17.294 1.00 0.00 O ATOM 0 H TYR A 392 -16.960 5.971 14.596 1.00 0.00 H new ATOM 0 HA TYR A 392 -18.631 5.035 12.372 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -17.750 2.753 12.621 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -16.494 3.860 12.103 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -14.698 4.539 13.696 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -17.631 1.650 14.790 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -13.297 3.831 15.575 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -16.231 0.945 16.676 1.00 0.00 H new ATOM 0 HH TYR A 392 -14.345 1.234 17.784 1.00 0.00 H new ATOM 1047 N ASN A 393 -18.695 4.790 15.605 1.00 0.00 N ATOM 1048 CA ASN A 393 -19.521 4.466 16.764 1.00 0.00 C ATOM 1049 C ASN A 393 -20.665 5.467 16.910 1.00 0.00 C ATOM 1050 O ASN A 393 -20.498 6.659 16.637 1.00 0.00 O ATOM 1051 CB ASN A 393 -18.654 4.444 18.035 1.00 0.00 C ATOM 1052 CG ASN A 393 -19.379 3.884 19.247 1.00 0.00 C ATOM 1053 OD1 ASN A 393 -19.390 2.676 19.470 1.00 0.00 O ATOM 1054 ND2 ASN A 393 -19.964 4.750 20.045 1.00 0.00 N ATOM 0 H ASN A 393 -17.853 5.321 15.826 1.00 0.00 H new ATOM 0 HA ASN A 393 -19.956 3.477 16.618 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -17.761 3.848 17.847 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -18.320 5.458 18.256 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -20.448 4.426 20.882 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -19.934 5.746 19.827 1.00 0.00 H new ATOM 1061 N GLU A 394 -21.821 4.978 17.328 1.00 0.00 N ATOM 1062 CA GLU A 394 -23.010 5.808 17.488 1.00 0.00 C ATOM 1063 C GLU A 394 -22.924 6.678 18.740 1.00 0.00 C ATOM 1064 O GLU A 394 -22.234 6.342 19.700 1.00 0.00 O ATOM 1065 CB GLU A 394 -24.275 4.937 17.571 1.00 0.00 C ATOM 1066 CG GLU A 394 -24.641 4.203 16.286 1.00 0.00 C ATOM 1067 CD GLU A 394 -23.611 3.185 15.859 1.00 0.00 C ATOM 1068 OE1 GLU A 394 -23.332 2.243 16.635 1.00 0.00 O1- ATOM 1069 OE2 GLU A 394 -23.064 3.323 14.754 1.00 0.00 O ATOM 0 H GLU A 394 -21.964 3.997 17.566 1.00 0.00 H new ATOM 0 HA GLU A 394 -23.066 6.456 16.613 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -24.140 4.202 18.365 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -25.114 5.569 17.861 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -25.600 3.703 16.423 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -24.773 4.931 15.486 1.00 0.00 H new ATOM 1076 N ASP A 395 -23.614 7.799 18.717 1.00 0.00 N ATOM 1077 CA ASP A 395 -23.685 8.680 19.875 1.00 0.00 C ATOM 1078 C ASP A 395 -24.865 8.274 20.735 1.00 0.00 C ATOM 1079 O ASP A 395 -24.770 8.205 21.962 1.00 0.00 O ATOM 1080 CB ASP A 395 -23.829 10.142 19.444 1.00 0.00 C ATOM 1081 CG ASP A 395 -24.026 11.081 20.622 1.00 0.00 C ATOM 1082 OD1 ASP A 395 -23.024 11.528 21.206 1.00 0.00 O1- ATOM 1083 OD2 ASP A 395 -25.188 11.379 20.966 1.00 0.00 O ATOM 0 H ASP A 395 -24.138 8.127 17.906 1.00 0.00 H new ATOM 0 HA ASP A 395 -22.761 8.588 20.446 1.00 0.00 H new ATOM 0 HB2 ASP A 395 -22.940 10.443 18.889 1.00 0.00 H new ATOM 0 HB3 ASP A 395 -24.676 10.235 18.764 1.00 0.00 H new ATOM 1088 N ASP A 396 -25.974 7.999 20.075 1.00 0.00 N ATOM 1089 CA ASP A 396 -27.185 7.553 20.741 1.00 0.00 C ATOM 1090 C ASP A 396 -27.213 6.041 20.780 1.00 0.00 C ATOM 1091 O ASP A 396 -26.964 5.464 21.856 1.00 0.00 O ATOM 1092 CB ASP A 396 -28.425 8.084 20.015 1.00 0.00 C ATOM 1093 CG ASP A 396 -29.724 7.555 20.597 1.00 0.00 C ATOM 1094 OD1 ASP A 396 -30.070 7.934 21.725 1.00 0.00 O ATOM 1095 OD2 ASP A 396 -30.422 6.771 19.907 1.00 0.00 O1- ATOM 1096 OXT ASP A 396 -27.438 5.427 19.721 1.00 0.00 O ATOM 0 H ASP A 396 -26.062 8.078 19.062 1.00 0.00 H new ATOM 0 HA ASP A 396 -27.192 7.941 21.759 1.00 0.00 H new ATOM 0 HB2 ASP A 396 -28.429 9.173 20.062 1.00 0.00 H new ATOM 0 HB3 ASP A 396 -28.367 7.811 18.961 1.00 0.00 H new TER 1101 ASP A 396 HETATM 1102 ZN ZN A 401 -3.327 20.328 2.769 1.00 0.00 ZN HETATM 1103 ZN ZN A 402 -13.688 14.731 13.469 1.00 0.00 ZN