USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 615 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 347 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 363 LYS NZ :NH3+ -170:sc=-0.00838 (180deg=-0.193) USER MOD Set 2.1: A 345 GLN : amide:sc= 0.338 K(o=0.6,f=-1.2) USER MOD Set 2.2: A 349 LYS NZ :NH3+ 146:sc= 0.261 (180deg=0) USER MOD Set 3.1: A 343 MET CE :methyl -144:sc= -0.18 (180deg=-1.49!) USER MOD Set 3.2: A 367 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0995) USER MOD Set 4.1: A 328 THR OG1 : rot 145:sc= 1.37 USER MOD Set 4.2: A 354 TYR OH : rot 30:sc= 0.724 USER MOD Single : A 314 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 317 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 318 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 321 THR OG1 : rot 180:sc= 0 USER MOD Single : A 326 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.144) USER MOD Single : A 330 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.146) USER MOD Single : A 331 LYS NZ :NH3+ 139:sc= -0.575 (180deg=-2.98!) USER MOD Single : A 335 SER OG : rot 18:sc= 0.455 USER MOD Single : A 337 ASN : amide:sc= -0.489 X(o=-0.49,f=-0.0075) USER MOD Single : A 342 THR OG1 : rot 180:sc= -0.311 USER MOD Single : A 344 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 TYR OH : rot 180:sc= -0.527 USER MOD Single : A 353 ASN : amide:sc=-0.00389 X(o=-0.0039,f=-0.15) USER MOD Single : A 356 THR OG1 : rot 180:sc= 0.00819 USER MOD Single : A 357 TYR OH : rot -88:sc= 0.573 USER MOD Single : A 360 THR OG1 : rot -73:sc= 1.2 USER MOD Single : A 368 THR OG1 : rot 100:sc= 1.1 USER MOD Single : A 369 THR OG1 : rot 180:sc= 0 USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 SER OG : rot 180:sc= 0 USER MOD Single : A 378 HIS :FLIP no HD1:sc= 0.0277 F(o=-1.3,f=0.028) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 309 21.287 23.828 -2.466 1.00 0.00 N ATOM 2 CA ASP A 309 20.875 22.504 -1.914 1.00 0.00 C ATOM 3 C ASP A 309 22.103 21.619 -1.688 1.00 0.00 C ATOM 4 O ASP A 309 22.021 20.407 -1.716 1.00 0.00 O ATOM 5 CB ASP A 309 19.964 21.899 -2.983 1.00 0.00 C ATOM 6 CG ASP A 309 18.581 22.546 -2.898 1.00 0.00 C ATOM 7 OD1 ASP A 309 18.516 23.764 -2.930 1.00 0.00 O ATOM 8 OD2 ASP A 309 17.611 21.813 -2.803 1.00 0.00 O ATOM 0 HA ASP A 309 20.371 22.595 -0.952 1.00 0.00 H new ATOM 0 HB2 ASP A 309 20.392 22.058 -3.973 1.00 0.00 H new ATOM 0 HB3 ASP A 309 19.883 20.821 -2.840 1.00 0.00 H new ATOM 15 N GLU A 310 23.241 22.217 -1.465 1.00 0.00 N ATOM 16 CA GLU A 310 24.475 21.414 -1.238 1.00 0.00 C ATOM 17 C GLU A 310 24.478 20.816 0.174 1.00 0.00 C ATOM 18 O GLU A 310 24.622 19.621 0.339 1.00 0.00 O ATOM 19 CB GLU A 310 25.627 22.406 -1.403 1.00 0.00 C ATOM 20 CG GLU A 310 26.564 21.918 -2.508 1.00 0.00 C ATOM 21 CD GLU A 310 26.443 22.837 -3.725 1.00 0.00 C ATOM 22 OE1 GLU A 310 26.966 23.938 -3.666 1.00 0.00 O ATOM 23 OE2 GLU A 310 25.829 22.425 -4.695 1.00 0.00 O ATOM 0 H GLU A 310 23.369 23.228 -1.430 1.00 0.00 H new ATOM 0 HA GLU A 310 24.552 20.577 -1.931 1.00 0.00 H new ATOM 0 HB2 GLU A 310 25.238 23.394 -1.651 1.00 0.00 H new ATOM 0 HB3 GLU A 310 26.173 22.505 -0.465 1.00 0.00 H new ATOM 0 HG2 GLU A 310 27.593 21.908 -2.148 1.00 0.00 H new ATOM 0 HG3 GLU A 310 26.313 20.894 -2.786 1.00 0.00 H new ATOM 30 N PRO A 311 24.325 21.673 1.150 1.00 0.00 N ATOM 31 CA PRO A 311 24.317 21.221 2.563 1.00 0.00 C ATOM 32 C PRO A 311 23.013 20.485 2.889 1.00 0.00 C ATOM 33 O PRO A 311 22.815 20.014 3.991 1.00 0.00 O ATOM 34 CB PRO A 311 24.424 22.520 3.356 1.00 0.00 C ATOM 35 CG PRO A 311 23.881 23.576 2.448 1.00 0.00 C ATOM 36 CD PRO A 311 24.146 23.124 1.033 1.00 0.00 C ATOM 0 HA PRO A 311 25.121 20.521 2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 311 23.852 22.465 4.282 1.00 0.00 H new ATOM 0 HB3 PRO A 311 25.458 22.730 3.631 1.00 0.00 H new ATOM 0 HG2 PRO A 311 22.813 23.715 2.614 1.00 0.00 H new ATOM 0 HG3 PRO A 311 24.361 24.535 2.642 1.00 0.00 H new ATOM 0 HD2 PRO A 311 23.315 23.371 0.373 1.00 0.00 H new ATOM 0 HD3 PRO A 311 25.034 23.603 0.621 1.00 0.00 H new ATOM 44 N LEU A 312 22.124 20.382 1.939 1.00 0.00 N ATOM 45 CA LEU A 312 20.837 19.674 2.199 1.00 0.00 C ATOM 46 C LEU A 312 20.432 18.845 0.976 1.00 0.00 C ATOM 47 O LEU A 312 19.708 19.303 0.116 1.00 0.00 O ATOM 48 CB LEU A 312 19.817 20.783 2.456 1.00 0.00 C ATOM 49 CG LEU A 312 18.413 20.179 2.516 1.00 0.00 C ATOM 50 CD1 LEU A 312 18.271 19.338 3.785 1.00 0.00 C ATOM 51 CD2 LEU A 312 17.375 21.304 2.534 1.00 0.00 C ATOM 0 H LEU A 312 22.232 20.756 0.996 1.00 0.00 H new ATOM 0 HA LEU A 312 20.909 18.985 3.040 1.00 0.00 H new ATOM 0 HB2 LEU A 312 20.046 21.293 3.392 1.00 0.00 H new ATOM 0 HB3 LEU A 312 19.869 21.531 1.665 1.00 0.00 H new ATOM 0 HG LEU A 312 18.253 19.548 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 312 17.270 18.908 3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 312 19.010 18.537 3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 312 18.432 19.969 4.659 1.00 0.00 H new ATOM 0 HD21 LEU A 312 16.374 20.875 2.577 1.00 0.00 H new ATOM 0 HD22 LEU A 312 17.537 21.935 3.408 1.00 0.00 H new ATOM 0 HD23 LEU A 312 17.474 21.905 1.630 1.00 0.00 H new ATOM 63 N ILE A 313 20.894 17.628 0.897 1.00 0.00 N ATOM 64 CA ILE A 313 20.536 16.770 -0.268 1.00 0.00 C ATOM 65 C ILE A 313 19.358 15.860 0.090 1.00 0.00 C ATOM 66 O ILE A 313 19.316 15.276 1.155 1.00 0.00 O ATOM 67 CB ILE A 313 21.788 15.940 -0.549 1.00 0.00 C ATOM 68 CG1 ILE A 313 21.569 15.100 -1.810 1.00 0.00 C ATOM 69 CG2 ILE A 313 22.064 15.014 0.636 1.00 0.00 C ATOM 70 CD1 ILE A 313 22.923 14.717 -2.412 1.00 0.00 C ATOM 0 H ILE A 313 21.503 17.190 1.588 1.00 0.00 H new ATOM 0 HA ILE A 313 20.233 17.356 -1.136 1.00 0.00 H new ATOM 0 HB ILE A 313 22.639 16.605 -0.696 1.00 0.00 H new ATOM 0 HG12 ILE A 313 21.000 14.202 -1.567 1.00 0.00 H new ATOM 0 HG13 ILE A 313 20.982 15.662 -2.537 1.00 0.00 H new ATOM 0 HG21 ILE A 313 22.957 14.422 0.435 1.00 0.00 H new ATOM 0 HG22 ILE A 313 22.218 15.610 1.535 1.00 0.00 H new ATOM 0 HG23 ILE A 313 21.213 14.349 0.784 1.00 0.00 H new ATOM 0 HD11 ILE A 313 22.766 14.119 -3.310 1.00 0.00 H new ATOM 0 HD12 ILE A 313 23.475 15.621 -2.670 1.00 0.00 H new ATOM 0 HD13 ILE A 313 23.493 14.138 -1.686 1.00 0.00 H new ATOM 82 N LYS A 314 18.402 15.734 -0.789 1.00 0.00 N ATOM 83 CA LYS A 314 17.231 14.859 -0.494 1.00 0.00 C ATOM 84 C LYS A 314 17.671 13.394 -0.432 1.00 0.00 C ATOM 85 O LYS A 314 18.756 13.044 -0.852 1.00 0.00 O ATOM 86 CB LYS A 314 16.265 15.085 -1.657 1.00 0.00 C ATOM 87 CG LYS A 314 14.830 15.128 -1.128 1.00 0.00 C ATOM 88 CD LYS A 314 14.596 16.448 -0.392 1.00 0.00 C ATOM 89 CE LYS A 314 14.701 17.611 -1.381 1.00 0.00 C ATOM 90 NZ LYS A 314 13.663 18.586 -0.940 1.00 0.00 N ATOM 0 H LYS A 314 18.380 16.198 -1.697 1.00 0.00 H new ATOM 0 HA LYS A 314 16.770 15.092 0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 314 16.504 16.019 -2.166 1.00 0.00 H new ATOM 0 HB3 LYS A 314 16.369 14.286 -2.391 1.00 0.00 H new ATOM 0 HG2 LYS A 314 14.124 15.029 -1.953 1.00 0.00 H new ATOM 0 HG3 LYS A 314 14.654 14.288 -0.456 1.00 0.00 H new ATOM 0 HD2 LYS A 314 13.613 16.445 0.078 1.00 0.00 H new ATOM 0 HD3 LYS A 314 15.330 16.567 0.405 1.00 0.00 H new ATOM 0 HE2 LYS A 314 15.695 18.057 -1.362 1.00 0.00 H new ATOM 0 HE3 LYS A 314 14.521 17.278 -2.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 314 13.673 19.413 -1.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 314 12.726 18.135 -0.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 314 13.864 18.891 0.034 1.00 0.00 H new ATOM 104 N LYS A 315 16.838 12.535 0.089 1.00 0.00 N ATOM 105 CA LYS A 315 17.213 11.094 0.177 1.00 0.00 C ATOM 106 C LYS A 315 16.073 10.219 -0.351 1.00 0.00 C ATOM 107 O LYS A 315 15.903 9.089 0.061 1.00 0.00 O ATOM 108 CB LYS A 315 17.442 10.837 1.667 1.00 0.00 C ATOM 109 CG LYS A 315 17.951 9.408 1.867 1.00 0.00 C ATOM 110 CD LYS A 315 19.298 9.443 2.594 1.00 0.00 C ATOM 111 CE LYS A 315 19.086 9.120 4.075 1.00 0.00 C ATOM 112 NZ LYS A 315 20.026 10.015 4.808 1.00 0.00 N ATOM 0 H LYS A 315 15.916 12.767 0.457 1.00 0.00 H new ATOM 0 HA LYS A 315 18.095 10.858 -0.418 1.00 0.00 H new ATOM 0 HB2 LYS A 315 18.165 11.550 2.063 1.00 0.00 H new ATOM 0 HB3 LYS A 315 16.514 10.984 2.219 1.00 0.00 H new ATOM 0 HG2 LYS A 315 17.229 8.831 2.445 1.00 0.00 H new ATOM 0 HG3 LYS A 315 18.059 8.911 0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 315 19.983 8.722 2.148 1.00 0.00 H new ATOM 0 HD3 LYS A 315 19.756 10.426 2.487 1.00 0.00 H new ATOM 0 HE2 LYS A 315 18.054 9.303 4.374 1.00 0.00 H new ATOM 0 HE3 LYS A 315 19.297 8.071 4.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 19.937 9.849 5.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 21.001 9.814 4.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 19.797 11.007 4.597 1.00 0.00 H new ATOM 126 N LEU A 316 15.292 10.734 -1.261 1.00 0.00 N ATOM 127 CA LEU A 316 14.166 9.932 -1.817 1.00 0.00 C ATOM 128 C LEU A 316 14.202 9.964 -3.347 1.00 0.00 C ATOM 129 O LEU A 316 13.191 10.139 -3.997 1.00 0.00 O ATOM 130 CB LEU A 316 12.900 10.611 -1.293 1.00 0.00 C ATOM 131 CG LEU A 316 12.849 10.489 0.232 1.00 0.00 C ATOM 132 CD1 LEU A 316 12.557 11.859 0.848 1.00 0.00 C ATOM 133 CD2 LEU A 316 11.744 9.508 0.631 1.00 0.00 C ATOM 0 H LEU A 316 15.385 11.675 -1.643 1.00 0.00 H new ATOM 0 HA LEU A 316 14.217 8.884 -1.521 1.00 0.00 H new ATOM 0 HB2 LEU A 316 12.890 11.661 -1.585 1.00 0.00 H new ATOM 0 HB3 LEU A 316 12.017 10.149 -1.735 1.00 0.00 H new ATOM 0 HG LEU A 316 13.810 10.124 0.596 1.00 0.00 H new ATOM 0 HD11 LEU A 316 12.521 11.770 1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 316 13.344 12.559 0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 316 11.598 12.225 0.482 1.00 0.00 H new ATOM 0 HD21 LEU A 316 11.709 9.422 1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 316 10.784 9.872 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 316 11.951 8.530 0.196 1.00 0.00 H new ATOM 145 N LYS A 317 15.360 9.796 -3.926 1.00 0.00 N ATOM 146 CA LYS A 317 15.460 9.817 -5.414 1.00 0.00 C ATOM 147 C LYS A 317 15.938 8.458 -5.929 1.00 0.00 C ATOM 148 O LYS A 317 16.760 8.373 -6.819 1.00 0.00 O ATOM 149 CB LYS A 317 16.490 10.903 -5.728 1.00 0.00 C ATOM 150 CG LYS A 317 15.885 11.913 -6.705 1.00 0.00 C ATOM 151 CD LYS A 317 15.042 12.930 -5.932 1.00 0.00 C ATOM 152 CE LYS A 317 14.177 13.726 -6.910 1.00 0.00 C ATOM 153 NZ LYS A 317 13.030 14.218 -6.096 1.00 0.00 N ATOM 0 H LYS A 317 16.241 9.645 -3.434 1.00 0.00 H new ATOM 0 HA LYS A 317 14.500 10.018 -5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 317 16.795 11.406 -4.810 1.00 0.00 H new ATOM 0 HB3 LYS A 317 17.386 10.456 -6.159 1.00 0.00 H new ATOM 0 HG2 LYS A 317 16.677 12.423 -7.254 1.00 0.00 H new ATOM 0 HG3 LYS A 317 15.268 11.398 -7.441 1.00 0.00 H new ATOM 0 HD2 LYS A 317 14.411 12.418 -5.206 1.00 0.00 H new ATOM 0 HD3 LYS A 317 15.690 13.604 -5.372 1.00 0.00 H new ATOM 0 HE2 LYS A 317 14.735 14.554 -7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 317 13.836 13.101 -7.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 317 12.390 14.774 -6.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 317 12.514 13.408 -5.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 317 13.384 14.816 -5.322 1.00 0.00 H new ATOM 167 N LYS A 318 15.429 7.393 -5.373 1.00 0.00 N ATOM 168 CA LYS A 318 15.851 6.038 -5.829 1.00 0.00 C ATOM 169 C LYS A 318 14.653 5.083 -5.816 1.00 0.00 C ATOM 170 O LYS A 318 14.285 4.559 -4.782 1.00 0.00 O ATOM 171 CB LYS A 318 16.909 5.590 -4.818 1.00 0.00 C ATOM 172 CG LYS A 318 17.405 4.190 -5.183 1.00 0.00 C ATOM 173 CD LYS A 318 16.553 3.143 -4.464 1.00 0.00 C ATOM 174 CE LYS A 318 17.428 1.947 -4.083 1.00 0.00 C ATOM 175 NZ LYS A 318 16.508 0.776 -4.104 1.00 0.00 N ATOM 0 H LYS A 318 14.739 7.402 -4.622 1.00 0.00 H new ATOM 0 HA LYS A 318 16.241 6.045 -6.847 1.00 0.00 H new ATOM 0 HB2 LYS A 318 17.742 6.292 -4.813 1.00 0.00 H new ATOM 0 HB3 LYS A 318 16.488 5.587 -3.813 1.00 0.00 H new ATOM 0 HG2 LYS A 318 17.348 4.042 -6.261 1.00 0.00 H new ATOM 0 HG3 LYS A 318 18.452 4.079 -4.901 1.00 0.00 H new ATOM 0 HD2 LYS A 318 16.102 3.576 -3.571 1.00 0.00 H new ATOM 0 HD3 LYS A 318 15.736 2.819 -5.108 1.00 0.00 H new ATOM 0 HE2 LYS A 318 18.249 1.817 -4.789 1.00 0.00 H new ATOM 0 HE3 LYS A 318 17.874 2.082 -3.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 318 17.035 -0.084 -3.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 318 15.741 0.925 -3.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 318 16.104 0.669 -5.056 1.00 0.00 H new ATOM 189 N PRO A 319 14.084 4.894 -6.975 1.00 0.00 N ATOM 190 CA PRO A 319 12.910 3.996 -7.113 1.00 0.00 C ATOM 191 C PRO A 319 13.329 2.531 -6.956 1.00 0.00 C ATOM 192 O PRO A 319 14.440 2.163 -7.284 1.00 0.00 O ATOM 193 CB PRO A 319 12.413 4.275 -8.529 1.00 0.00 C ATOM 194 CG PRO A 319 13.611 4.783 -9.265 1.00 0.00 C ATOM 195 CD PRO A 319 14.477 5.490 -8.255 1.00 0.00 C ATOM 0 HA PRO A 319 12.146 4.170 -6.356 1.00 0.00 H new ATOM 0 HB2 PRO A 319 12.018 3.372 -8.994 1.00 0.00 H new ATOM 0 HB3 PRO A 319 11.609 5.011 -8.528 1.00 0.00 H new ATOM 0 HG2 PRO A 319 14.154 3.962 -9.732 1.00 0.00 H new ATOM 0 HG3 PRO A 319 13.314 5.463 -10.063 1.00 0.00 H new ATOM 0 HD2 PRO A 319 15.536 5.335 -8.459 1.00 0.00 H new ATOM 0 HD3 PRO A 319 14.304 6.566 -8.264 1.00 0.00 H new ATOM 203 N PRO A 320 12.415 1.746 -6.456 1.00 0.00 N ATOM 204 CA PRO A 320 12.678 0.302 -6.243 1.00 0.00 C ATOM 205 C PRO A 320 12.628 -0.452 -7.574 1.00 0.00 C ATOM 206 O PRO A 320 12.195 0.073 -8.581 1.00 0.00 O ATOM 207 CB PRO A 320 11.534 -0.138 -5.336 1.00 0.00 C ATOM 208 CG PRO A 320 10.429 0.835 -5.600 1.00 0.00 C ATOM 209 CD PRO A 320 11.063 2.130 -6.043 1.00 0.00 C ATOM 0 HA PRO A 320 13.661 0.105 -5.815 1.00 0.00 H new ATOM 0 HB2 PRO A 320 11.223 -1.158 -5.561 1.00 0.00 H new ATOM 0 HB3 PRO A 320 11.833 -0.120 -4.288 1.00 0.00 H new ATOM 0 HG2 PRO A 320 9.758 0.454 -6.369 1.00 0.00 H new ATOM 0 HG3 PRO A 320 9.830 0.988 -4.702 1.00 0.00 H new ATOM 0 HD2 PRO A 320 10.509 2.584 -6.865 1.00 0.00 H new ATOM 0 HD3 PRO A 320 11.086 2.859 -5.233 1.00 0.00 H new ATOM 217 N THR A 321 13.060 -1.684 -7.588 1.00 0.00 N ATOM 218 CA THR A 321 13.029 -2.470 -8.855 1.00 0.00 C ATOM 219 C THR A 321 11.806 -3.389 -8.869 1.00 0.00 C ATOM 220 O THR A 321 11.137 -3.561 -7.870 1.00 0.00 O ATOM 221 CB THR A 321 14.319 -3.292 -8.849 1.00 0.00 C ATOM 222 OG1 THR A 321 14.252 -4.269 -7.817 1.00 0.00 O ATOM 223 CG2 THR A 321 15.514 -2.371 -8.605 1.00 0.00 C ATOM 0 H THR A 321 13.433 -2.180 -6.778 1.00 0.00 H new ATOM 0 HA THR A 321 12.961 -1.832 -9.736 1.00 0.00 H new ATOM 0 HB THR A 321 14.438 -3.788 -9.813 1.00 0.00 H new ATOM 0 HG1 THR A 321 15.077 -4.798 -7.813 1.00 0.00 H new ATOM 0 HG21 THR A 321 16.432 -2.959 -8.601 1.00 0.00 H new ATOM 0 HG22 THR A 321 15.565 -1.624 -9.397 1.00 0.00 H new ATOM 0 HG23 THR A 321 15.399 -1.872 -7.643 1.00 0.00 H new ATOM 231 N ASP A 322 11.509 -3.983 -9.993 1.00 0.00 N ATOM 232 CA ASP A 322 10.328 -4.891 -10.063 1.00 0.00 C ATOM 233 C ASP A 322 10.364 -5.891 -8.904 1.00 0.00 C ATOM 234 O ASP A 322 9.346 -6.239 -8.340 1.00 0.00 O ATOM 235 CB ASP A 322 10.466 -5.618 -11.401 1.00 0.00 C ATOM 236 CG ASP A 322 10.664 -4.595 -12.521 1.00 0.00 C ATOM 237 OD1 ASP A 322 9.703 -3.922 -12.858 1.00 0.00 O ATOM 238 OD2 ASP A 322 11.772 -4.502 -13.024 1.00 0.00 O ATOM 0 H ASP A 322 12.031 -3.880 -10.863 1.00 0.00 H new ATOM 0 HA ASP A 322 9.385 -4.350 -9.989 1.00 0.00 H new ATOM 0 HB2 ASP A 322 11.312 -6.305 -11.368 1.00 0.00 H new ATOM 0 HB3 ASP A 322 9.576 -6.217 -11.595 1.00 0.00 H new ATOM 243 N GLU A 323 11.530 -6.357 -8.546 1.00 0.00 N ATOM 244 CA GLU A 323 11.631 -7.335 -7.425 1.00 0.00 C ATOM 245 C GLU A 323 11.181 -6.687 -6.113 1.00 0.00 C ATOM 246 O GLU A 323 10.501 -7.295 -5.311 1.00 0.00 O ATOM 247 CB GLU A 323 13.112 -7.710 -7.360 1.00 0.00 C ATOM 248 CG GLU A 323 13.308 -8.838 -6.345 1.00 0.00 C ATOM 249 CD GLU A 323 14.715 -8.753 -5.753 1.00 0.00 C ATOM 250 OE1 GLU A 323 15.137 -7.654 -5.432 1.00 0.00 O ATOM 251 OE2 GLU A 323 15.349 -9.789 -5.628 1.00 0.00 O ATOM 0 H GLU A 323 12.417 -6.103 -8.981 1.00 0.00 H new ATOM 0 HA GLU A 323 10.996 -8.207 -7.580 1.00 0.00 H new ATOM 0 HB2 GLU A 323 13.462 -8.026 -8.343 1.00 0.00 H new ATOM 0 HB3 GLU A 323 13.706 -6.842 -7.074 1.00 0.00 H new ATOM 0 HG2 GLU A 323 12.563 -8.762 -5.553 1.00 0.00 H new ATOM 0 HG3 GLU A 323 13.163 -9.805 -6.827 1.00 0.00 H new ATOM 258 N GLU A 324 11.554 -5.456 -5.891 1.00 0.00 N ATOM 259 CA GLU A 324 11.143 -4.770 -4.632 1.00 0.00 C ATOM 260 C GLU A 324 9.620 -4.630 -4.584 1.00 0.00 C ATOM 261 O GLU A 324 8.994 -4.886 -3.574 1.00 0.00 O ATOM 262 CB GLU A 324 11.808 -3.394 -4.697 1.00 0.00 C ATOM 263 CG GLU A 324 12.990 -3.351 -3.728 1.00 0.00 C ATOM 264 CD GLU A 324 14.261 -3.792 -4.456 1.00 0.00 C ATOM 265 OE1 GLU A 324 14.290 -4.918 -4.925 1.00 0.00 O ATOM 266 OE2 GLU A 324 15.182 -2.996 -4.534 1.00 0.00 O ATOM 0 H GLU A 324 12.124 -4.896 -6.525 1.00 0.00 H new ATOM 0 HA GLU A 324 11.440 -5.323 -3.741 1.00 0.00 H new ATOM 0 HB2 GLU A 324 12.149 -3.191 -5.712 1.00 0.00 H new ATOM 0 HB3 GLU A 324 11.087 -2.618 -4.442 1.00 0.00 H new ATOM 0 HG2 GLU A 324 13.115 -2.342 -3.334 1.00 0.00 H new ATOM 0 HG3 GLU A 324 12.800 -4.004 -2.877 1.00 0.00 H new ATOM 273 N LEU A 325 9.021 -4.227 -5.669 1.00 0.00 N ATOM 274 CA LEU A 325 7.539 -4.072 -5.692 1.00 0.00 C ATOM 275 C LEU A 325 6.866 -5.375 -5.250 1.00 0.00 C ATOM 276 O LEU A 325 6.050 -5.387 -4.349 1.00 0.00 O ATOM 277 CB LEU A 325 7.202 -3.754 -7.147 1.00 0.00 C ATOM 278 CG LEU A 325 7.575 -2.302 -7.444 1.00 0.00 C ATOM 279 CD1 LEU A 325 7.144 -1.941 -8.866 1.00 0.00 C ATOM 280 CD2 LEU A 325 6.864 -1.383 -6.449 1.00 0.00 C ATOM 0 H LEU A 325 9.494 -3.998 -6.543 1.00 0.00 H new ATOM 0 HA LEU A 325 7.190 -3.293 -5.015 1.00 0.00 H new ATOM 0 HB2 LEU A 325 7.744 -4.425 -7.813 1.00 0.00 H new ATOM 0 HB3 LEU A 325 6.139 -3.914 -7.330 1.00 0.00 H new ATOM 0 HG LEU A 325 8.654 -2.179 -7.351 1.00 0.00 H new ATOM 0 HD11 LEU A 325 7.411 -0.905 -9.075 1.00 0.00 H new ATOM 0 HD12 LEU A 325 7.648 -2.596 -9.576 1.00 0.00 H new ATOM 0 HD13 LEU A 325 6.065 -2.064 -8.961 1.00 0.00 H new ATOM 0 HD21 LEU A 325 7.128 -0.346 -6.658 1.00 0.00 H new ATOM 0 HD22 LEU A 325 5.785 -1.509 -6.544 1.00 0.00 H new ATOM 0 HD23 LEU A 325 7.171 -1.638 -5.435 1.00 0.00 H new ATOM 292 N LYS A 326 7.204 -6.471 -5.872 1.00 0.00 N ATOM 293 CA LYS A 326 6.584 -7.768 -5.482 1.00 0.00 C ATOM 294 C LYS A 326 6.681 -7.959 -3.965 1.00 0.00 C ATOM 295 O LYS A 326 5.715 -8.295 -3.310 1.00 0.00 O ATOM 296 CB LYS A 326 7.402 -8.835 -6.211 1.00 0.00 C ATOM 297 CG LYS A 326 6.458 -9.853 -6.858 1.00 0.00 C ATOM 298 CD LYS A 326 6.709 -11.237 -6.256 1.00 0.00 C ATOM 299 CE LYS A 326 5.843 -12.275 -6.977 1.00 0.00 C ATOM 300 NZ LYS A 326 6.570 -12.584 -8.242 1.00 0.00 N ATOM 0 H LYS A 326 7.882 -6.524 -6.632 1.00 0.00 H new ATOM 0 HA LYS A 326 5.527 -7.818 -5.744 1.00 0.00 H new ATOM 0 HB2 LYS A 326 8.029 -8.370 -6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 326 8.070 -9.337 -5.511 1.00 0.00 H new ATOM 0 HG2 LYS A 326 5.421 -9.557 -6.697 1.00 0.00 H new ATOM 0 HG3 LYS A 326 6.618 -9.879 -7.936 1.00 0.00 H new ATOM 0 HD2 LYS A 326 7.763 -11.500 -6.349 1.00 0.00 H new ATOM 0 HD3 LYS A 326 6.475 -11.230 -5.191 1.00 0.00 H new ATOM 0 HE2 LYS A 326 5.714 -13.170 -6.369 1.00 0.00 H new ATOM 0 HE3 LYS A 326 4.847 -11.882 -7.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 5.904 -12.561 -9.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 7.317 -11.877 -8.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 6.997 -13.530 -8.175 1.00 0.00 H new ATOM 314 N GLU A 327 7.838 -7.741 -3.402 1.00 0.00 N ATOM 315 CA GLU A 327 7.994 -7.906 -1.928 1.00 0.00 C ATOM 316 C GLU A 327 6.910 -7.115 -1.190 1.00 0.00 C ATOM 317 O GLU A 327 6.154 -7.657 -0.410 1.00 0.00 O ATOM 318 CB GLU A 327 9.378 -7.340 -1.610 1.00 0.00 C ATOM 319 CG GLU A 327 9.742 -7.663 -0.159 1.00 0.00 C ATOM 320 CD GLU A 327 10.940 -6.813 0.269 1.00 0.00 C ATOM 321 OE1 GLU A 327 11.982 -6.941 -0.350 1.00 0.00 O ATOM 322 OE2 GLU A 327 10.793 -6.050 1.210 1.00 0.00 O ATOM 0 H GLU A 327 8.682 -7.456 -3.898 1.00 0.00 H new ATOM 0 HA GLU A 327 7.897 -8.946 -1.617 1.00 0.00 H new ATOM 0 HB2 GLU A 327 10.120 -7.765 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 327 9.386 -6.261 -1.766 1.00 0.00 H new ATOM 0 HG2 GLU A 327 8.891 -7.465 0.493 1.00 0.00 H new ATOM 0 HG3 GLU A 327 9.980 -8.722 -0.060 1.00 0.00 H new ATOM 329 N THR A 328 6.828 -5.835 -1.435 1.00 0.00 N ATOM 330 CA THR A 328 5.794 -5.009 -0.752 1.00 0.00 C ATOM 331 C THR A 328 4.411 -5.642 -0.931 1.00 0.00 C ATOM 332 O THR A 328 3.699 -5.887 0.023 1.00 0.00 O ATOM 333 CB THR A 328 5.857 -3.646 -1.445 1.00 0.00 C ATOM 334 OG1 THR A 328 6.998 -2.936 -0.984 1.00 0.00 O ATOM 335 CG2 THR A 328 4.593 -2.847 -1.127 1.00 0.00 C ATOM 0 H THR A 328 7.433 -5.326 -2.079 1.00 0.00 H new ATOM 0 HA THR A 328 5.969 -4.928 0.321 1.00 0.00 H new ATOM 0 HB THR A 328 5.928 -3.790 -2.523 1.00 0.00 H new ATOM 0 HG1 THR A 328 7.373 -2.407 -1.719 1.00 0.00 H new ATOM 0 HG21 THR A 328 4.641 -1.877 -1.622 1.00 0.00 H new ATOM 0 HG22 THR A 328 3.719 -3.393 -1.482 1.00 0.00 H new ATOM 0 HG23 THR A 328 4.516 -2.701 -0.050 1.00 0.00 H new ATOM 343 N ILE A 329 4.028 -5.914 -2.148 1.00 0.00 N ATOM 344 CA ILE A 329 2.694 -6.535 -2.383 1.00 0.00 C ATOM 345 C ILE A 329 2.568 -7.826 -1.573 1.00 0.00 C ATOM 346 O ILE A 329 1.591 -8.046 -0.886 1.00 0.00 O ATOM 347 CB ILE A 329 2.649 -6.829 -3.883 1.00 0.00 C ATOM 348 CG1 ILE A 329 2.601 -5.509 -4.655 1.00 0.00 C ATOM 349 CG2 ILE A 329 1.400 -7.652 -4.207 1.00 0.00 C ATOM 350 CD1 ILE A 329 3.459 -5.619 -5.916 1.00 0.00 C ATOM 0 H ILE A 329 4.579 -5.734 -2.987 1.00 0.00 H new ATOM 0 HA ILE A 329 1.874 -5.886 -2.076 1.00 0.00 H new ATOM 0 HB ILE A 329 3.538 -7.391 -4.170 1.00 0.00 H new ATOM 0 HG12 ILE A 329 1.572 -5.270 -4.923 1.00 0.00 H new ATOM 0 HG13 ILE A 329 2.963 -4.695 -4.027 1.00 0.00 H new ATOM 0 HG21 ILE A 329 1.369 -7.861 -5.276 1.00 0.00 H new ATOM 0 HG22 ILE A 329 1.430 -8.591 -3.655 1.00 0.00 H new ATOM 0 HG23 ILE A 329 0.510 -7.091 -3.921 1.00 0.00 H new ATOM 0 HD11 ILE A 329 3.423 -4.677 -6.464 1.00 0.00 H new ATOM 0 HD12 ILE A 329 4.490 -5.837 -5.637 1.00 0.00 H new ATOM 0 HD13 ILE A 329 3.077 -6.421 -6.547 1.00 0.00 H new ATOM 362 N LYS A 330 3.550 -8.681 -1.645 1.00 0.00 N ATOM 363 CA LYS A 330 3.480 -9.952 -0.872 1.00 0.00 C ATOM 364 C LYS A 330 3.038 -9.663 0.562 1.00 0.00 C ATOM 365 O LYS A 330 2.358 -10.454 1.186 1.00 0.00 O ATOM 366 CB LYS A 330 4.904 -10.513 -0.893 1.00 0.00 C ATOM 367 CG LYS A 330 4.926 -11.879 -0.200 1.00 0.00 C ATOM 368 CD LYS A 330 3.742 -12.721 -0.683 1.00 0.00 C ATOM 369 CE LYS A 330 3.902 -14.160 -0.185 1.00 0.00 C ATOM 370 NZ LYS A 330 3.537 -14.112 1.260 1.00 0.00 N ATOM 0 H LYS A 330 4.394 -8.555 -2.203 1.00 0.00 H new ATOM 0 HA LYS A 330 2.763 -10.656 -1.295 1.00 0.00 H new ATOM 0 HB2 LYS A 330 5.253 -10.609 -1.921 1.00 0.00 H new ATOM 0 HB3 LYS A 330 5.584 -9.827 -0.389 1.00 0.00 H new ATOM 0 HG2 LYS A 330 5.863 -12.393 -0.417 1.00 0.00 H new ATOM 0 HG3 LYS A 330 4.876 -11.750 0.881 1.00 0.00 H new ATOM 0 HD2 LYS A 330 2.807 -12.299 -0.314 1.00 0.00 H new ATOM 0 HD3 LYS A 330 3.691 -12.705 -1.772 1.00 0.00 H new ATOM 0 HE2 LYS A 330 3.252 -14.842 -0.734 1.00 0.00 H new ATOM 0 HE3 LYS A 330 4.924 -14.514 -0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 4.329 -14.471 1.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 3.331 -13.130 1.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 2.696 -14.701 1.425 1.00 0.00 H new ATOM 384 N LYS A 331 3.410 -8.526 1.087 1.00 0.00 N ATOM 385 CA LYS A 331 3.000 -8.181 2.477 1.00 0.00 C ATOM 386 C LYS A 331 1.538 -7.733 2.481 1.00 0.00 C ATOM 387 O LYS A 331 0.858 -7.798 3.486 1.00 0.00 O ATOM 388 CB LYS A 331 3.919 -7.029 2.892 1.00 0.00 C ATOM 389 CG LYS A 331 5.379 -7.438 2.683 1.00 0.00 C ATOM 390 CD LYS A 331 6.070 -7.579 4.041 1.00 0.00 C ATOM 391 CE LYS A 331 7.540 -7.170 3.914 1.00 0.00 C ATOM 392 NZ LYS A 331 7.509 -5.799 3.332 1.00 0.00 N ATOM 0 H LYS A 331 3.979 -7.824 0.614 1.00 0.00 H new ATOM 0 HA LYS A 331 3.084 -9.025 3.161 1.00 0.00 H new ATOM 0 HB2 LYS A 331 3.692 -6.139 2.305 1.00 0.00 H new ATOM 0 HB3 LYS A 331 3.748 -6.773 3.938 1.00 0.00 H new ATOM 0 HG2 LYS A 331 5.429 -8.381 2.138 1.00 0.00 H new ATOM 0 HG3 LYS A 331 5.893 -6.692 2.077 1.00 0.00 H new ATOM 0 HD2 LYS A 331 5.571 -6.954 4.781 1.00 0.00 H new ATOM 0 HD3 LYS A 331 5.997 -8.608 4.392 1.00 0.00 H new ATOM 0 HE2 LYS A 331 8.037 -7.176 4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 331 8.088 -7.859 3.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 8.223 -5.206 3.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 7.717 -5.849 2.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 6.566 -5.383 3.473 1.00 0.00 H new ATOM 406 N LEU A 332 1.052 -7.279 1.358 1.00 0.00 N ATOM 407 CA LEU A 332 -0.367 -6.827 1.286 1.00 0.00 C ATOM 408 C LEU A 332 -1.309 -8.033 1.335 1.00 0.00 C ATOM 409 O LEU A 332 -2.006 -8.248 2.307 1.00 0.00 O ATOM 410 CB LEU A 332 -0.487 -6.112 -0.060 1.00 0.00 C ATOM 411 CG LEU A 332 0.599 -5.041 -0.169 1.00 0.00 C ATOM 412 CD1 LEU A 332 0.381 -4.218 -1.440 1.00 0.00 C ATOM 413 CD2 LEU A 332 0.528 -4.122 1.052 1.00 0.00 C ATOM 0 H LEU A 332 1.576 -7.201 0.487 1.00 0.00 H new ATOM 0 HA LEU A 332 -0.636 -6.178 2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 332 -0.388 -6.829 -0.875 1.00 0.00 H new ATOM 0 HB3 LEU A 332 -1.473 -5.656 -0.155 1.00 0.00 H new ATOM 0 HG LEU A 332 1.578 -5.518 -0.211 1.00 0.00 H new ATOM 0 HD11 LEU A 332 1.156 -3.455 -1.517 1.00 0.00 H new ATOM 0 HD12 LEU A 332 0.429 -4.873 -2.310 1.00 0.00 H new ATOM 0 HD13 LEU A 332 -0.597 -3.739 -1.400 1.00 0.00 H new ATOM 0 HD21 LEU A 332 1.301 -3.357 0.977 1.00 0.00 H new ATOM 0 HD22 LEU A 332 -0.451 -3.645 1.092 1.00 0.00 H new ATOM 0 HD23 LEU A 332 0.684 -4.708 1.958 1.00 0.00 H new ATOM 425 N LEU A 333 -1.337 -8.819 0.293 1.00 0.00 N ATOM 426 CA LEU A 333 -2.234 -10.009 0.282 1.00 0.00 C ATOM 427 C LEU A 333 -1.923 -10.912 1.478 1.00 0.00 C ATOM 428 O LEU A 333 -2.809 -11.491 2.077 1.00 0.00 O ATOM 429 CB LEU A 333 -1.933 -10.726 -1.037 1.00 0.00 C ATOM 430 CG LEU A 333 -0.439 -11.048 -1.122 1.00 0.00 C ATOM 431 CD1 LEU A 333 -0.198 -12.483 -0.649 1.00 0.00 C ATOM 432 CD2 LEU A 333 0.028 -10.906 -2.573 1.00 0.00 C ATOM 0 H LEU A 333 -0.778 -8.688 -0.550 1.00 0.00 H new ATOM 0 HA LEU A 333 -3.287 -9.736 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -2.517 -11.644 -1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -2.228 -10.099 -1.878 1.00 0.00 H new ATOM 0 HG LEU A 333 0.119 -10.358 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 333 0.866 -12.712 -0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 333 -0.533 -12.587 0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 333 -0.755 -13.173 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.092 -11.135 -2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -0.530 -11.597 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -0.145 -9.885 -2.912 1.00 0.00 H new ATOM 444 N ALA A 334 -0.673 -11.032 1.836 1.00 0.00 N ATOM 445 CA ALA A 334 -0.311 -11.894 2.997 1.00 0.00 C ATOM 446 C ALA A 334 -1.174 -11.529 4.207 1.00 0.00 C ATOM 447 O ALA A 334 -1.437 -12.348 5.066 1.00 0.00 O ATOM 448 CB ALA A 334 1.160 -11.585 3.278 1.00 0.00 C ATOM 0 H ALA A 334 0.112 -10.571 1.375 1.00 0.00 H new ATOM 0 HA ALA A 334 -0.472 -12.953 2.794 1.00 0.00 H new ATOM 0 HB1 ALA A 334 1.502 -12.183 4.123 1.00 0.00 H new ATOM 0 HB2 ALA A 334 1.757 -11.825 2.398 1.00 0.00 H new ATOM 0 HB3 ALA A 334 1.271 -10.527 3.514 1.00 0.00 H new ATOM 454 N SER A 335 -1.619 -10.305 4.277 1.00 0.00 N ATOM 455 CA SER A 335 -2.468 -9.882 5.428 1.00 0.00 C ATOM 456 C SER A 335 -3.937 -9.824 4.999 1.00 0.00 C ATOM 457 O SER A 335 -4.703 -9.011 5.478 1.00 0.00 O ATOM 458 CB SER A 335 -1.961 -8.490 5.800 1.00 0.00 C ATOM 459 OG SER A 335 -1.867 -7.694 4.626 1.00 0.00 O ATOM 0 H SER A 335 -1.432 -9.578 3.586 1.00 0.00 H new ATOM 0 HA SER A 335 -2.408 -10.574 6.268 1.00 0.00 H new ATOM 0 HB2 SER A 335 -2.638 -8.024 6.516 1.00 0.00 H new ATOM 0 HB3 SER A 335 -0.986 -8.563 6.283 1.00 0.00 H new ATOM 0 HG SER A 335 -2.398 -8.102 3.911 1.00 0.00 H new ATOM 465 N ALA A 336 -4.333 -10.681 4.098 1.00 0.00 N ATOM 466 CA ALA A 336 -5.750 -10.680 3.633 1.00 0.00 C ATOM 467 C ALA A 336 -5.991 -11.854 2.680 1.00 0.00 C ATOM 468 O ALA A 336 -5.064 -12.485 2.211 1.00 0.00 O ATOM 469 CB ALA A 336 -5.922 -9.352 2.896 1.00 0.00 C ATOM 0 H ALA A 336 -3.735 -11.384 3.663 1.00 0.00 H new ATOM 0 HA ALA A 336 -6.456 -10.785 4.456 1.00 0.00 H new ATOM 0 HB1 ALA A 336 -6.943 -9.273 2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 336 -5.722 -8.528 3.580 1.00 0.00 H new ATOM 0 HB3 ALA A 336 -5.224 -9.307 2.060 1.00 0.00 H new ATOM 475 N ASN A 337 -7.227 -12.150 2.385 1.00 0.00 N ATOM 476 CA ASN A 337 -7.520 -13.279 1.456 1.00 0.00 C ATOM 477 C ASN A 337 -7.299 -12.835 0.007 1.00 0.00 C ATOM 478 O ASN A 337 -7.971 -11.954 -0.492 1.00 0.00 O ATOM 479 CB ASN A 337 -8.990 -13.626 1.699 1.00 0.00 C ATOM 480 CG ASN A 337 -9.083 -14.780 2.698 1.00 0.00 C ATOM 481 OD1 ASN A 337 -9.996 -15.579 2.638 1.00 0.00 O ATOM 482 ND2 ASN A 337 -8.170 -14.900 3.623 1.00 0.00 N ATOM 0 H ASN A 337 -8.046 -11.660 2.746 1.00 0.00 H new ATOM 0 HA ASN A 337 -6.871 -14.138 1.628 1.00 0.00 H new ATOM 0 HB2 ASN A 337 -9.522 -12.755 2.083 1.00 0.00 H new ATOM 0 HB3 ASN A 337 -9.469 -13.904 0.760 1.00 0.00 H new ATOM 0 HD21 ASN A 337 -8.223 -15.665 4.296 1.00 0.00 H new ATOM 0 HD22 ASN A 337 -7.403 -14.229 3.673 1.00 0.00 H new ATOM 489 N LEU A 338 -6.355 -13.433 -0.666 1.00 0.00 N ATOM 490 CA LEU A 338 -6.081 -13.045 -2.080 1.00 0.00 C ATOM 491 C LEU A 338 -7.387 -12.898 -2.866 1.00 0.00 C ATOM 492 O LEU A 338 -7.607 -11.913 -3.542 1.00 0.00 O ATOM 493 CB LEU A 338 -5.247 -14.193 -2.647 1.00 0.00 C ATOM 494 CG LEU A 338 -3.763 -13.928 -2.384 1.00 0.00 C ATOM 495 CD1 LEU A 338 -3.538 -13.730 -0.884 1.00 0.00 C ATOM 496 CD2 LEU A 338 -2.940 -15.123 -2.869 1.00 0.00 C ATOM 0 H LEU A 338 -5.760 -14.175 -0.298 1.00 0.00 H new ATOM 0 HA LEU A 338 -5.567 -12.086 -2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 338 -5.546 -15.135 -2.187 1.00 0.00 H new ATOM 0 HB3 LEU A 338 -5.425 -14.291 -3.718 1.00 0.00 H new ATOM 0 HG LEU A 338 -3.453 -13.030 -2.919 1.00 0.00 H new ATOM 0 HD11 LEU A 338 -2.481 -13.541 -0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 338 -4.126 -12.880 -0.537 1.00 0.00 H new ATOM 0 HD13 LEU A 338 -3.847 -14.628 -0.348 1.00 0.00 H new ATOM 0 HD21 LEU A 338 -1.882 -14.936 -2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 338 -3.250 -16.020 -2.333 1.00 0.00 H new ATOM 0 HD23 LEU A 338 -3.100 -15.265 -3.938 1.00 0.00 H new ATOM 508 N GLU A 339 -8.250 -13.873 -2.793 1.00 0.00 N ATOM 509 CA GLU A 339 -9.535 -13.790 -3.547 1.00 0.00 C ATOM 510 C GLU A 339 -10.468 -12.752 -2.919 1.00 0.00 C ATOM 511 O GLU A 339 -11.530 -12.469 -3.436 1.00 0.00 O ATOM 512 CB GLU A 339 -10.146 -15.187 -3.443 1.00 0.00 C ATOM 513 CG GLU A 339 -11.489 -15.211 -4.175 1.00 0.00 C ATOM 514 CD GLU A 339 -11.681 -16.573 -4.847 1.00 0.00 C ATOM 515 OE1 GLU A 339 -11.115 -16.774 -5.908 1.00 0.00 O ATOM 516 OE2 GLU A 339 -12.395 -17.390 -4.289 1.00 0.00 O ATOM 0 H GLU A 339 -8.122 -14.724 -2.245 1.00 0.00 H new ATOM 0 HA GLU A 339 -9.379 -13.484 -4.581 1.00 0.00 H new ATOM 0 HB2 GLU A 339 -9.470 -15.924 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 339 -10.285 -15.458 -2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 339 -12.301 -15.022 -3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 339 -11.522 -14.417 -4.922 1.00 0.00 H new ATOM 523 N GLU A 340 -10.087 -12.183 -1.808 1.00 0.00 N ATOM 524 CA GLU A 340 -10.967 -11.169 -1.157 1.00 0.00 C ATOM 525 C GLU A 340 -10.376 -9.766 -1.320 1.00 0.00 C ATOM 526 O GLU A 340 -10.779 -8.832 -0.654 1.00 0.00 O ATOM 527 CB GLU A 340 -11.007 -11.564 0.318 1.00 0.00 C ATOM 528 CG GLU A 340 -12.256 -10.968 0.970 1.00 0.00 C ATOM 529 CD GLU A 340 -11.841 -10.000 2.080 1.00 0.00 C ATOM 530 OE1 GLU A 340 -11.052 -10.396 2.921 1.00 0.00 O ATOM 531 OE2 GLU A 340 -12.321 -8.879 2.069 1.00 0.00 O ATOM 0 H GLU A 340 -9.210 -12.374 -1.324 1.00 0.00 H new ATOM 0 HA GLU A 340 -11.963 -11.146 -1.600 1.00 0.00 H new ATOM 0 HB2 GLU A 340 -11.016 -12.650 0.415 1.00 0.00 H new ATOM 0 HB3 GLU A 340 -10.112 -11.206 0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 340 -12.855 -10.446 0.223 1.00 0.00 H new ATOM 0 HG3 GLU A 340 -12.879 -11.763 1.380 1.00 0.00 H new ATOM 538 N VAL A 341 -9.428 -9.607 -2.201 1.00 0.00 N ATOM 539 CA VAL A 341 -8.820 -8.262 -2.404 1.00 0.00 C ATOM 540 C VAL A 341 -8.985 -7.822 -3.861 1.00 0.00 C ATOM 541 O VAL A 341 -9.152 -8.633 -4.749 1.00 0.00 O ATOM 542 CB VAL A 341 -7.342 -8.436 -2.055 1.00 0.00 C ATOM 543 CG1 VAL A 341 -6.677 -9.357 -3.081 1.00 0.00 C ATOM 544 CG2 VAL A 341 -6.652 -7.071 -2.075 1.00 0.00 C ATOM 0 H VAL A 341 -9.048 -10.349 -2.789 1.00 0.00 H new ATOM 0 HA VAL A 341 -9.293 -7.497 -1.788 1.00 0.00 H new ATOM 0 HB VAL A 341 -7.253 -8.877 -1.062 1.00 0.00 H new ATOM 0 HG11 VAL A 341 -5.623 -9.480 -2.831 1.00 0.00 H new ATOM 0 HG12 VAL A 341 -7.169 -10.330 -3.069 1.00 0.00 H new ATOM 0 HG13 VAL A 341 -6.765 -8.918 -4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 341 -5.598 -7.193 -1.826 1.00 0.00 H new ATOM 0 HG22 VAL A 341 -6.742 -6.632 -3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 341 -7.124 -6.414 -1.344 1.00 0.00 H new ATOM 554 N THR A 342 -8.942 -6.543 -4.110 1.00 0.00 N ATOM 555 CA THR A 342 -9.098 -6.052 -5.510 1.00 0.00 C ATOM 556 C THR A 342 -7.999 -5.043 -5.848 1.00 0.00 C ATOM 557 O THR A 342 -7.132 -4.760 -5.044 1.00 0.00 O ATOM 558 CB THR A 342 -10.471 -5.378 -5.541 1.00 0.00 C ATOM 559 OG1 THR A 342 -10.648 -4.725 -6.791 1.00 0.00 O ATOM 560 CG2 THR A 342 -10.565 -4.353 -4.409 1.00 0.00 C ATOM 0 H THR A 342 -8.806 -5.817 -3.407 1.00 0.00 H new ATOM 0 HA THR A 342 -9.020 -6.858 -6.239 1.00 0.00 H new ATOM 0 HB THR A 342 -11.249 -6.131 -5.411 1.00 0.00 H new ATOM 0 HG1 THR A 342 -11.528 -4.294 -6.813 1.00 0.00 H new ATOM 0 HG21 THR A 342 -11.544 -3.874 -4.432 1.00 0.00 H new ATOM 0 HG22 THR A 342 -10.430 -4.855 -3.451 1.00 0.00 H new ATOM 0 HG23 THR A 342 -9.788 -3.599 -4.536 1.00 0.00 H new ATOM 568 N MET A 343 -8.028 -4.498 -7.034 1.00 0.00 N ATOM 569 CA MET A 343 -6.986 -3.507 -7.429 1.00 0.00 C ATOM 570 C MET A 343 -7.009 -2.308 -6.476 1.00 0.00 C ATOM 571 O MET A 343 -5.997 -1.688 -6.217 1.00 0.00 O ATOM 572 CB MET A 343 -7.371 -3.076 -8.845 1.00 0.00 C ATOM 573 CG MET A 343 -6.204 -2.324 -9.488 1.00 0.00 C ATOM 574 SD MET A 343 -6.737 -0.652 -9.933 1.00 0.00 S ATOM 575 CE MET A 343 -8.098 -1.127 -11.030 1.00 0.00 C ATOM 0 H MET A 343 -8.729 -4.697 -7.748 1.00 0.00 H new ATOM 0 HA MET A 343 -5.980 -3.924 -7.389 1.00 0.00 H new ATOM 0 HB2 MET A 343 -7.628 -3.949 -9.444 1.00 0.00 H new ATOM 0 HB3 MET A 343 -8.255 -2.439 -8.814 1.00 0.00 H new ATOM 0 HG2 MET A 343 -5.362 -2.277 -8.797 1.00 0.00 H new ATOM 0 HG3 MET A 343 -5.859 -2.856 -10.375 1.00 0.00 H new ATOM 0 HE1 MET A 343 -8.158 -0.424 -11.861 1.00 0.00 H new ATOM 0 HE2 MET A 343 -7.921 -2.131 -11.416 1.00 0.00 H new ATOM 0 HE3 MET A 343 -9.036 -1.112 -10.474 1.00 0.00 H new ATOM 585 N LYS A 344 -8.158 -1.978 -5.954 1.00 0.00 N ATOM 586 CA LYS A 344 -8.249 -0.821 -5.019 1.00 0.00 C ATOM 587 C LYS A 344 -7.355 -1.056 -3.798 1.00 0.00 C ATOM 588 O LYS A 344 -6.660 -0.168 -3.346 1.00 0.00 O ATOM 589 CB LYS A 344 -9.718 -0.764 -4.606 1.00 0.00 C ATOM 590 CG LYS A 344 -9.981 0.522 -3.819 1.00 0.00 C ATOM 591 CD LYS A 344 -10.831 1.472 -4.664 1.00 0.00 C ATOM 592 CE LYS A 344 -11.703 2.331 -3.746 1.00 0.00 C ATOM 593 NZ LYS A 344 -13.003 1.607 -3.661 1.00 0.00 N ATOM 0 H LYS A 344 -9.039 -2.460 -6.135 1.00 0.00 H new ATOM 0 HA LYS A 344 -7.918 0.110 -5.479 1.00 0.00 H new ATOM 0 HB2 LYS A 344 -10.356 -0.799 -5.489 1.00 0.00 H new ATOM 0 HB3 LYS A 344 -9.969 -1.633 -3.997 1.00 0.00 H new ATOM 0 HG2 LYS A 344 -10.494 0.291 -2.885 1.00 0.00 H new ATOM 0 HG3 LYS A 344 -9.037 0.999 -3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 344 -10.188 2.108 -5.272 1.00 0.00 H new ATOM 0 HD3 LYS A 344 -11.458 0.903 -5.350 1.00 0.00 H new ATOM 0 HE2 LYS A 344 -11.249 2.443 -2.762 1.00 0.00 H new ATOM 0 HE3 LYS A 344 -11.835 3.334 -4.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 -13.655 2.136 -3.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 -13.415 1.521 -4.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 -12.847 0.658 -3.264 1.00 0.00 H new ATOM 607 N GLN A 345 -7.369 -2.244 -3.260 1.00 0.00 N ATOM 608 CA GLN A 345 -6.520 -2.534 -2.069 1.00 0.00 C ATOM 609 C GLN A 345 -5.042 -2.553 -2.468 1.00 0.00 C ATOM 610 O GLN A 345 -4.215 -1.900 -1.861 1.00 0.00 O ATOM 611 CB GLN A 345 -6.964 -3.917 -1.592 1.00 0.00 C ATOM 612 CG GLN A 345 -8.292 -3.798 -0.842 1.00 0.00 C ATOM 613 CD GLN A 345 -8.073 -4.120 0.638 1.00 0.00 C ATOM 614 OE1 GLN A 345 -7.747 -3.249 1.419 1.00 0.00 O ATOM 615 NE2 GLN A 345 -8.241 -5.344 1.058 1.00 0.00 N ATOM 0 H GLN A 345 -7.931 -3.027 -3.593 1.00 0.00 H new ATOM 0 HA GLN A 345 -6.630 -1.780 -1.289 1.00 0.00 H new ATOM 0 HB2 GLN A 345 -7.074 -4.589 -2.443 1.00 0.00 H new ATOM 0 HB3 GLN A 345 -6.204 -4.350 -0.941 1.00 0.00 H new ATOM 0 HG2 GLN A 345 -8.694 -2.791 -0.950 1.00 0.00 H new ATOM 0 HG3 GLN A 345 -9.026 -4.482 -1.269 1.00 0.00 H new ATOM 0 HE21 GLN A 345 -8.515 -6.075 0.402 1.00 0.00 H new ATOM 0 HE22 GLN A 345 -8.099 -5.569 2.043 1.00 0.00 H new ATOM 624 N ILE A 346 -4.703 -3.299 -3.484 1.00 0.00 N ATOM 625 CA ILE A 346 -3.279 -3.365 -3.923 1.00 0.00 C ATOM 626 C ILE A 346 -2.787 -1.980 -4.350 1.00 0.00 C ATOM 627 O ILE A 346 -1.646 -1.621 -4.132 1.00 0.00 O ATOM 628 CB ILE A 346 -3.280 -4.321 -5.114 1.00 0.00 C ATOM 629 CG1 ILE A 346 -3.670 -5.723 -4.640 1.00 0.00 C ATOM 630 CG2 ILE A 346 -1.883 -4.363 -5.736 1.00 0.00 C ATOM 631 CD1 ILE A 346 -2.813 -6.113 -3.434 1.00 0.00 C ATOM 0 H ILE A 346 -5.351 -3.867 -4.030 1.00 0.00 H new ATOM 0 HA ILE A 346 -2.617 -3.702 -3.125 1.00 0.00 H new ATOM 0 HB ILE A 346 -3.998 -3.975 -5.858 1.00 0.00 H new ATOM 0 HG12 ILE A 346 -4.726 -5.747 -4.371 1.00 0.00 H new ATOM 0 HG13 ILE A 346 -3.530 -6.443 -5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 346 -1.884 -5.045 -6.586 1.00 0.00 H new ATOM 0 HG22 ILE A 346 -1.604 -3.364 -6.072 1.00 0.00 H new ATOM 0 HG23 ILE A 346 -1.164 -4.709 -4.993 1.00 0.00 H new ATOM 0 HD11 ILE A 346 -3.092 -7.112 -3.097 1.00 0.00 H new ATOM 0 HD12 ILE A 346 -1.761 -6.106 -3.718 1.00 0.00 H new ATOM 0 HD13 ILE A 346 -2.975 -5.399 -2.626 1.00 0.00 H new ATOM 643 N CYS A 347 -3.635 -1.200 -4.961 1.00 0.00 N ATOM 644 CA CYS A 347 -3.213 0.159 -5.407 1.00 0.00 C ATOM 645 C CYS A 347 -2.999 1.075 -4.198 1.00 0.00 C ATOM 646 O CYS A 347 -2.010 1.776 -4.107 1.00 0.00 O ATOM 647 CB CYS A 347 -4.369 0.669 -6.267 1.00 0.00 C ATOM 648 SG CYS A 347 -3.933 2.279 -6.973 1.00 0.00 S ATOM 0 H CYS A 347 -4.603 -1.444 -5.171 1.00 0.00 H new ATOM 0 HA CYS A 347 -2.272 0.138 -5.957 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -4.585 -0.043 -7.064 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -5.273 0.757 -5.665 1.00 0.00 H new ATOM 0 HG CYS A 347 -4.915 2.712 -7.706 1.00 0.00 H new ATOM 654 N LYS A 348 -3.918 1.079 -3.273 1.00 0.00 N ATOM 655 CA LYS A 348 -3.764 1.955 -2.076 1.00 0.00 C ATOM 656 C LYS A 348 -2.633 1.440 -1.181 1.00 0.00 C ATOM 657 O LYS A 348 -1.885 2.205 -0.607 1.00 0.00 O ATOM 658 CB LYS A 348 -5.106 1.869 -1.347 1.00 0.00 C ATOM 659 CG LYS A 348 -5.523 3.265 -0.882 1.00 0.00 C ATOM 660 CD LYS A 348 -6.284 3.972 -2.006 1.00 0.00 C ATOM 661 CE LYS A 348 -5.488 5.192 -2.474 1.00 0.00 C ATOM 662 NZ LYS A 348 -5.290 4.982 -3.935 1.00 0.00 N ATOM 0 H LYS A 348 -4.768 0.515 -3.293 1.00 0.00 H new ATOM 0 HA LYS A 348 -3.511 2.980 -2.346 1.00 0.00 H new ATOM 0 HB2 LYS A 348 -5.865 1.452 -2.009 1.00 0.00 H new ATOM 0 HB3 LYS A 348 -5.025 1.198 -0.492 1.00 0.00 H new ATOM 0 HG2 LYS A 348 -6.151 3.192 0.006 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -4.643 3.845 -0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 348 -6.443 3.287 -2.839 1.00 0.00 H new ATOM 0 HD3 LYS A 348 -7.269 4.280 -1.655 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -6.030 6.117 -2.278 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -4.534 5.265 -1.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -4.751 5.779 -4.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -4.765 4.098 -4.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 -6.215 4.923 -4.406 1.00 0.00 H new ATOM 676 N LYS A 349 -2.505 0.147 -1.054 1.00 0.00 N ATOM 677 CA LYS A 349 -1.425 -0.416 -0.191 1.00 0.00 C ATOM 678 C LYS A 349 -0.056 -0.219 -0.851 1.00 0.00 C ATOM 679 O LYS A 349 0.804 0.465 -0.329 1.00 0.00 O ATOM 680 CB LYS A 349 -1.756 -1.903 -0.069 1.00 0.00 C ATOM 681 CG LYS A 349 -2.996 -2.079 0.810 1.00 0.00 C ATOM 682 CD LYS A 349 -3.666 -3.415 0.485 1.00 0.00 C ATOM 683 CE LYS A 349 -3.759 -4.262 1.756 1.00 0.00 C ATOM 684 NZ LYS A 349 -5.087 -3.929 2.343 1.00 0.00 N ATOM 0 H LYS A 349 -3.101 -0.544 -1.510 1.00 0.00 H new ATOM 0 HA LYS A 349 -1.376 0.073 0.782 1.00 0.00 H new ATOM 0 HB2 LYS A 349 -1.934 -2.329 -1.056 1.00 0.00 H new ATOM 0 HB3 LYS A 349 -0.912 -2.440 0.363 1.00 0.00 H new ATOM 0 HG2 LYS A 349 -2.716 -2.047 1.863 1.00 0.00 H new ATOM 0 HG3 LYS A 349 -3.694 -1.259 0.641 1.00 0.00 H new ATOM 0 HD2 LYS A 349 -4.662 -3.244 0.075 1.00 0.00 H new ATOM 0 HD3 LYS A 349 -3.094 -3.945 -0.277 1.00 0.00 H new ATOM 0 HE2 LYS A 349 -3.683 -5.325 1.528 1.00 0.00 H new ATOM 0 HE3 LYS A 349 -2.951 -4.026 2.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 -5.483 -4.772 2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 -4.976 -3.169 3.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 -5.730 -3.613 1.589 1.00 0.00 H new ATOM 698 N VAL A 350 0.154 -0.815 -1.996 1.00 0.00 N ATOM 699 CA VAL A 350 1.468 -0.660 -2.686 1.00 0.00 C ATOM 700 C VAL A 350 1.925 0.799 -2.619 1.00 0.00 C ATOM 701 O VAL A 350 3.079 1.089 -2.376 1.00 0.00 O ATOM 702 CB VAL A 350 1.212 -1.081 -4.134 1.00 0.00 C ATOM 703 CG1 VAL A 350 0.425 0.014 -4.857 1.00 0.00 C ATOM 704 CG2 VAL A 350 2.552 -1.296 -4.843 1.00 0.00 C ATOM 0 H VAL A 350 -0.526 -1.401 -2.481 1.00 0.00 H new ATOM 0 HA VAL A 350 2.252 -1.261 -2.225 1.00 0.00 H new ATOM 0 HB VAL A 350 0.637 -2.007 -4.146 1.00 0.00 H new ATOM 0 HG11 VAL A 350 0.244 -0.289 -5.888 1.00 0.00 H new ATOM 0 HG12 VAL A 350 -0.528 0.171 -4.352 1.00 0.00 H new ATOM 0 HG13 VAL A 350 0.998 0.941 -4.846 1.00 0.00 H new ATOM 0 HG21 VAL A 350 2.373 -1.596 -5.875 1.00 0.00 H new ATOM 0 HG22 VAL A 350 3.124 -0.368 -4.829 1.00 0.00 H new ATOM 0 HG23 VAL A 350 3.114 -2.077 -4.330 1.00 0.00 H new ATOM 714 N TYR A 351 1.023 1.720 -2.830 1.00 0.00 N ATOM 715 CA TYR A 351 1.401 3.159 -2.773 1.00 0.00 C ATOM 716 C TYR A 351 1.938 3.499 -1.383 1.00 0.00 C ATOM 717 O TYR A 351 2.962 4.139 -1.242 1.00 0.00 O ATOM 718 CB TYR A 351 0.107 3.919 -3.053 1.00 0.00 C ATOM 719 CG TYR A 351 0.046 4.313 -4.511 1.00 0.00 C ATOM 720 CD1 TYR A 351 0.825 3.636 -5.461 1.00 0.00 C ATOM 721 CD2 TYR A 351 -0.796 5.356 -4.915 1.00 0.00 C ATOM 722 CE1 TYR A 351 0.762 4.006 -6.810 1.00 0.00 C ATOM 723 CE2 TYR A 351 -0.859 5.724 -6.263 1.00 0.00 C ATOM 724 CZ TYR A 351 -0.080 5.050 -7.211 1.00 0.00 C ATOM 725 OH TYR A 351 -0.143 5.412 -8.541 1.00 0.00 O ATOM 0 H TYR A 351 0.042 1.537 -3.039 1.00 0.00 H new ATOM 0 HA TYR A 351 2.182 3.415 -3.489 1.00 0.00 H new ATOM 0 HB2 TYR A 351 -0.752 3.298 -2.799 1.00 0.00 H new ATOM 0 HB3 TYR A 351 0.054 4.808 -2.425 1.00 0.00 H new ATOM 0 HD1 TYR A 351 1.473 2.829 -5.152 1.00 0.00 H new ATOM 0 HD2 TYR A 351 -1.398 5.877 -4.185 1.00 0.00 H new ATOM 0 HE1 TYR A 351 1.363 3.486 -7.541 1.00 0.00 H new ATOM 0 HE2 TYR A 351 -1.509 6.529 -6.573 1.00 0.00 H new ATOM 0 HH TYR A 351 -0.776 6.153 -8.649 1.00 0.00 H new ATOM 735 N GLU A 352 1.264 3.066 -0.353 1.00 0.00 N ATOM 736 CA GLU A 352 1.753 3.358 1.022 1.00 0.00 C ATOM 737 C GLU A 352 3.250 3.061 1.095 1.00 0.00 C ATOM 738 O GLU A 352 4.016 3.809 1.668 1.00 0.00 O ATOM 739 CB GLU A 352 0.966 2.419 1.936 1.00 0.00 C ATOM 740 CG GLU A 352 0.477 3.194 3.162 1.00 0.00 C ATOM 741 CD GLU A 352 0.305 2.235 4.341 1.00 0.00 C ATOM 742 OE1 GLU A 352 1.282 1.610 4.718 1.00 0.00 O ATOM 743 OE2 GLU A 352 -0.802 2.142 4.847 1.00 0.00 O ATOM 0 H GLU A 352 0.400 2.526 -0.404 1.00 0.00 H new ATOM 0 HA GLU A 352 1.612 4.400 1.310 1.00 0.00 H new ATOM 0 HB2 GLU A 352 0.118 1.996 1.398 1.00 0.00 H new ATOM 0 HB3 GLU A 352 1.595 1.585 2.247 1.00 0.00 H new ATOM 0 HG2 GLU A 352 1.191 3.977 3.418 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -0.470 3.686 2.940 1.00 0.00 H new ATOM 750 N ASN A 353 3.672 1.975 0.506 1.00 0.00 N ATOM 751 CA ASN A 353 5.121 1.629 0.526 1.00 0.00 C ATOM 752 C ASN A 353 5.863 2.440 -0.541 1.00 0.00 C ATOM 753 O ASN A 353 7.067 2.591 -0.497 1.00 0.00 O ATOM 754 CB ASN A 353 5.175 0.136 0.200 1.00 0.00 C ATOM 755 CG ASN A 353 5.870 -0.614 1.339 1.00 0.00 C ATOM 756 OD1 ASN A 353 5.244 -1.369 2.055 1.00 0.00 O ATOM 757 ND2 ASN A 353 7.147 -0.436 1.535 1.00 0.00 N ATOM 0 H ASN A 353 3.075 1.312 0.012 1.00 0.00 H new ATOM 0 HA ASN A 353 5.591 1.852 1.484 1.00 0.00 H new ATOM 0 HB2 ASN A 353 4.166 -0.252 0.058 1.00 0.00 H new ATOM 0 HB3 ASN A 353 5.712 -0.023 -0.735 1.00 0.00 H new ATOM 0 HD21 ASN A 353 7.621 -0.931 2.290 1.00 0.00 H new ATOM 0 HD22 ASN A 353 7.672 0.198 0.933 1.00 0.00 H new ATOM 764 N TYR A 354 5.148 2.960 -1.503 1.00 0.00 N ATOM 765 CA TYR A 354 5.803 3.760 -2.579 1.00 0.00 C ATOM 766 C TYR A 354 5.058 5.084 -2.783 1.00 0.00 C ATOM 767 O TYR A 354 4.614 5.386 -3.872 1.00 0.00 O ATOM 768 CB TYR A 354 5.704 2.889 -3.831 1.00 0.00 C ATOM 769 CG TYR A 354 6.388 1.565 -3.577 1.00 0.00 C ATOM 770 CD1 TYR A 354 7.758 1.528 -3.296 1.00 0.00 C ATOM 771 CD2 TYR A 354 5.650 0.376 -3.622 1.00 0.00 C ATOM 772 CE1 TYR A 354 8.393 0.302 -3.060 1.00 0.00 C ATOM 773 CE2 TYR A 354 6.284 -0.850 -3.386 1.00 0.00 C ATOM 774 CZ TYR A 354 7.655 -0.887 -3.105 1.00 0.00 C ATOM 775 OH TYR A 354 8.279 -2.096 -2.872 1.00 0.00 O ATOM 0 H TYR A 354 4.136 2.865 -1.590 1.00 0.00 H new ATOM 0 HA TYR A 354 6.836 4.013 -2.338 1.00 0.00 H new ATOM 0 HB2 TYR A 354 4.658 2.726 -4.093 1.00 0.00 H new ATOM 0 HB3 TYR A 354 6.169 3.395 -4.677 1.00 0.00 H new ATOM 0 HD1 TYR A 354 8.327 2.446 -3.261 1.00 0.00 H new ATOM 0 HD2 TYR A 354 4.592 0.404 -3.839 1.00 0.00 H new ATOM 0 HE1 TYR A 354 9.451 0.274 -2.844 1.00 0.00 H new ATOM 0 HE2 TYR A 354 5.715 -1.767 -3.421 1.00 0.00 H new ATOM 0 HH TYR A 354 9.032 -1.963 -2.259 1.00 0.00 H new ATOM 785 N PRO A 355 4.948 5.829 -1.717 1.00 0.00 N ATOM 786 CA PRO A 355 4.248 7.134 -1.767 1.00 0.00 C ATOM 787 C PRO A 355 5.134 8.203 -2.418 1.00 0.00 C ATOM 788 O PRO A 355 4.785 8.784 -3.427 1.00 0.00 O ATOM 789 CB PRO A 355 4.003 7.462 -0.297 1.00 0.00 C ATOM 790 CG PRO A 355 5.062 6.717 0.456 1.00 0.00 C ATOM 791 CD PRO A 355 5.458 5.523 -0.376 1.00 0.00 C ATOM 0 HA PRO A 355 3.332 7.102 -2.357 1.00 0.00 H new ATOM 0 HB2 PRO A 355 4.073 8.535 -0.116 1.00 0.00 H new ATOM 0 HB3 PRO A 355 3.006 7.151 0.015 1.00 0.00 H new ATOM 0 HG2 PRO A 355 5.924 7.358 0.640 1.00 0.00 H new ATOM 0 HG3 PRO A 355 4.688 6.399 1.429 1.00 0.00 H new ATOM 0 HD2 PRO A 355 6.539 5.385 -0.384 1.00 0.00 H new ATOM 0 HD3 PRO A 355 5.022 4.604 0.015 1.00 0.00 H new ATOM 799 N THR A 356 6.274 8.471 -1.843 1.00 0.00 N ATOM 800 CA THR A 356 7.183 9.507 -2.416 1.00 0.00 C ATOM 801 C THR A 356 7.421 9.257 -3.909 1.00 0.00 C ATOM 802 O THR A 356 7.839 10.137 -4.634 1.00 0.00 O ATOM 803 CB THR A 356 8.490 9.358 -1.634 1.00 0.00 C ATOM 804 OG1 THR A 356 8.815 7.980 -1.517 1.00 0.00 O ATOM 805 CG2 THR A 356 8.327 9.966 -0.240 1.00 0.00 C ATOM 0 H THR A 356 6.618 8.016 -0.997 1.00 0.00 H new ATOM 0 HA THR A 356 6.763 10.509 -2.333 1.00 0.00 H new ATOM 0 HB THR A 356 9.290 9.877 -2.162 1.00 0.00 H new ATOM 0 HG1 THR A 356 9.653 7.883 -1.018 1.00 0.00 H new ATOM 0 HG21 THR A 356 9.259 9.859 0.315 1.00 0.00 H new ATOM 0 HG22 THR A 356 8.079 11.023 -0.331 1.00 0.00 H new ATOM 0 HG23 THR A 356 7.527 9.450 0.291 1.00 0.00 H new ATOM 813 N TYR A 357 7.165 8.065 -4.376 1.00 0.00 N ATOM 814 CA TYR A 357 7.388 7.772 -5.822 1.00 0.00 C ATOM 815 C TYR A 357 6.077 7.887 -6.606 1.00 0.00 C ATOM 816 O TYR A 357 5.018 7.543 -6.120 1.00 0.00 O ATOM 817 CB TYR A 357 7.902 6.334 -5.861 1.00 0.00 C ATOM 818 CG TYR A 357 9.162 6.221 -5.036 1.00 0.00 C ATOM 819 CD1 TYR A 357 10.126 7.235 -5.087 1.00 0.00 C ATOM 820 CD2 TYR A 357 9.365 5.100 -4.224 1.00 0.00 C ATOM 821 CE1 TYR A 357 11.294 7.127 -4.323 1.00 0.00 C ATOM 822 CE2 TYR A 357 10.534 4.992 -3.460 1.00 0.00 C ATOM 823 CZ TYR A 357 11.498 6.005 -3.510 1.00 0.00 C ATOM 824 OH TYR A 357 12.651 5.900 -2.758 1.00 0.00 O ATOM 0 H TYR A 357 6.813 7.284 -3.822 1.00 0.00 H new ATOM 0 HA TYR A 357 8.089 8.474 -6.274 1.00 0.00 H new ATOM 0 HB2 TYR A 357 7.141 5.655 -5.475 1.00 0.00 H new ATOM 0 HB3 TYR A 357 8.102 6.037 -6.890 1.00 0.00 H new ATOM 0 HD1 TYR A 357 9.969 8.099 -5.715 1.00 0.00 H new ATOM 0 HD2 TYR A 357 8.621 4.318 -4.186 1.00 0.00 H new ATOM 0 HE1 TYR A 357 12.038 7.909 -4.361 1.00 0.00 H new ATOM 0 HE2 TYR A 357 10.691 4.127 -2.833 1.00 0.00 H new ATOM 0 HH TYR A 357 13.352 5.471 -3.292 1.00 0.00 H new ATOM 834 N ASP A 358 6.146 8.355 -7.823 1.00 0.00 N ATOM 835 CA ASP A 358 4.912 8.479 -8.649 1.00 0.00 C ATOM 836 C ASP A 358 4.723 7.201 -9.465 1.00 0.00 C ATOM 837 O ASP A 358 4.493 7.237 -10.657 1.00 0.00 O ATOM 838 CB ASP A 358 5.165 9.672 -9.572 1.00 0.00 C ATOM 839 CG ASP A 358 4.023 10.680 -9.431 1.00 0.00 C ATOM 840 OD1 ASP A 358 2.881 10.276 -9.578 1.00 0.00 O ATOM 841 OD2 ASP A 358 4.309 11.839 -9.181 1.00 0.00 O ATOM 0 H ASP A 358 7.006 8.657 -8.281 1.00 0.00 H new ATOM 0 HA ASP A 358 4.015 8.623 -8.047 1.00 0.00 H new ATOM 0 HB2 ASP A 358 6.114 10.145 -9.320 1.00 0.00 H new ATOM 0 HB3 ASP A 358 5.241 9.335 -10.606 1.00 0.00 H new ATOM 846 N LEU A 359 4.834 6.071 -8.824 1.00 0.00 N ATOM 847 CA LEU A 359 4.681 4.774 -9.542 1.00 0.00 C ATOM 848 C LEU A 359 3.565 4.852 -10.587 1.00 0.00 C ATOM 849 O LEU A 359 2.394 4.862 -10.264 1.00 0.00 O ATOM 850 CB LEU A 359 4.323 3.766 -8.451 1.00 0.00 C ATOM 851 CG LEU A 359 5.499 2.812 -8.228 1.00 0.00 C ATOM 852 CD1 LEU A 359 5.941 2.224 -9.569 1.00 0.00 C ATOM 853 CD2 LEU A 359 6.664 3.580 -7.598 1.00 0.00 C ATOM 0 H LEU A 359 5.026 5.990 -7.825 1.00 0.00 H new ATOM 0 HA LEU A 359 5.587 4.499 -10.082 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.084 4.287 -7.524 1.00 0.00 H new ATOM 0 HB3 LEU A 359 3.435 3.204 -8.739 1.00 0.00 H new ATOM 0 HG LEU A 359 5.192 2.005 -7.562 1.00 0.00 H new ATOM 0 HD11 LEU A 359 6.778 1.545 -9.410 1.00 0.00 H new ATOM 0 HD12 LEU A 359 5.111 1.678 -10.018 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.249 3.030 -10.236 1.00 0.00 H new ATOM 0 HD21 LEU A 359 7.503 2.902 -7.438 1.00 0.00 H new ATOM 0 HD22 LEU A 359 6.971 4.386 -8.264 1.00 0.00 H new ATOM 0 HD23 LEU A 359 6.349 3.999 -6.642 1.00 0.00 H new ATOM 865 N THR A 360 3.926 4.891 -11.840 1.00 0.00 N ATOM 866 CA THR A 360 2.897 4.951 -12.919 1.00 0.00 C ATOM 867 C THR A 360 2.975 3.673 -13.756 1.00 0.00 C ATOM 868 O THR A 360 2.047 2.888 -13.802 1.00 0.00 O ATOM 869 CB THR A 360 3.266 6.175 -13.765 1.00 0.00 C ATOM 870 OG1 THR A 360 4.468 6.752 -13.275 1.00 0.00 O ATOM 871 CG2 THR A 360 2.137 7.205 -13.692 1.00 0.00 C ATOM 0 H THR A 360 4.893 4.884 -12.165 1.00 0.00 H new ATOM 0 HA THR A 360 1.882 5.031 -12.530 1.00 0.00 H new ATOM 0 HB THR A 360 3.411 5.867 -14.800 1.00 0.00 H new ATOM 0 HG1 THR A 360 4.289 7.213 -12.429 1.00 0.00 H new ATOM 0 HG21 THR A 360 2.399 8.075 -14.293 1.00 0.00 H new ATOM 0 HG22 THR A 360 1.217 6.764 -14.074 1.00 0.00 H new ATOM 0 HG23 THR A 360 1.990 7.511 -12.656 1.00 0.00 H new ATOM 879 N GLU A 361 4.086 3.449 -14.403 1.00 0.00 N ATOM 880 CA GLU A 361 4.237 2.212 -15.220 1.00 0.00 C ATOM 881 C GLU A 361 4.268 0.997 -14.291 1.00 0.00 C ATOM 882 O GLU A 361 3.391 0.153 -14.318 1.00 0.00 O ATOM 883 CB GLU A 361 5.573 2.377 -15.944 1.00 0.00 C ATOM 884 CG GLU A 361 5.370 3.231 -17.197 1.00 0.00 C ATOM 885 CD GLU A 361 6.444 2.887 -18.231 1.00 0.00 C ATOM 886 OE1 GLU A 361 7.582 2.700 -17.834 1.00 0.00 O ATOM 887 OE2 GLU A 361 6.109 2.816 -19.402 1.00 0.00 O ATOM 0 H GLU A 361 4.896 4.069 -14.401 1.00 0.00 H new ATOM 0 HA GLU A 361 3.418 2.063 -15.924 1.00 0.00 H new ATOM 0 HB2 GLU A 361 6.301 2.848 -15.284 1.00 0.00 H new ATOM 0 HB3 GLU A 361 5.974 1.401 -16.217 1.00 0.00 H new ATOM 0 HG2 GLU A 361 4.379 3.053 -17.614 1.00 0.00 H new ATOM 0 HG3 GLU A 361 5.423 4.289 -16.941 1.00 0.00 H new ATOM 894 N ARG A 362 5.265 0.910 -13.451 1.00 0.00 N ATOM 895 CA ARG A 362 5.336 -0.238 -12.509 1.00 0.00 C ATOM 896 C ARG A 362 4.010 -0.346 -11.755 1.00 0.00 C ATOM 897 O ARG A 362 3.624 -1.404 -11.301 1.00 0.00 O ATOM 898 CB ARG A 362 6.478 0.099 -11.552 1.00 0.00 C ATOM 899 CG ARG A 362 7.759 -0.589 -12.028 1.00 0.00 C ATOM 900 CD ARG A 362 8.836 0.465 -12.293 1.00 0.00 C ATOM 901 NE ARG A 362 9.279 0.213 -13.692 1.00 0.00 N ATOM 902 CZ ARG A 362 10.463 0.603 -14.082 1.00 0.00 C ATOM 903 NH1 ARG A 362 11.137 1.461 -13.367 1.00 0.00 N ATOM 904 NH2 ARG A 362 10.972 0.132 -15.189 1.00 0.00 N ATOM 0 H ARG A 362 6.029 1.582 -13.378 1.00 0.00 H new ATOM 0 HA ARG A 362 5.509 -1.190 -13.011 1.00 0.00 H new ATOM 0 HB2 ARG A 362 6.626 1.178 -11.510 1.00 0.00 H new ATOM 0 HB3 ARG A 362 6.230 -0.228 -10.542 1.00 0.00 H new ATOM 0 HG2 ARG A 362 8.105 -1.297 -11.275 1.00 0.00 H new ATOM 0 HG3 ARG A 362 7.562 -1.160 -12.936 1.00 0.00 H new ATOM 0 HD2 ARG A 362 8.439 1.474 -12.180 1.00 0.00 H new ATOM 0 HD3 ARG A 362 9.665 0.368 -11.592 1.00 0.00 H new ATOM 0 HE ARG A 362 8.658 -0.264 -14.346 1.00 0.00 H new ATOM 0 HH11 ARG A 362 10.740 1.828 -12.502 1.00 0.00 H new ATOM 0 HH12 ARG A 362 12.062 1.765 -13.673 1.00 0.00 H new ATOM 0 HH21 ARG A 362 10.445 -0.539 -15.748 1.00 0.00 H new ATOM 0 HH22 ARG A 362 11.896 0.436 -15.495 1.00 0.00 H new ATOM 918 N LYS A 363 3.303 0.746 -11.635 1.00 0.00 N ATOM 919 CA LYS A 363 1.994 0.709 -10.930 1.00 0.00 C ATOM 920 C LYS A 363 1.075 -0.287 -11.636 1.00 0.00 C ATOM 921 O LYS A 363 0.591 -1.232 -11.042 1.00 0.00 O ATOM 922 CB LYS A 363 1.440 2.129 -11.041 1.00 0.00 C ATOM 923 CG LYS A 363 0.478 2.394 -9.883 1.00 0.00 C ATOM 924 CD LYS A 363 -0.911 1.863 -10.242 1.00 0.00 C ATOM 925 CE LYS A 363 -1.234 0.649 -9.369 1.00 0.00 C ATOM 926 NZ LYS A 363 -2.676 0.372 -9.619 1.00 0.00 N ATOM 0 H LYS A 363 3.577 1.660 -11.995 1.00 0.00 H new ATOM 0 HA LYS A 363 2.080 0.397 -9.889 1.00 0.00 H new ATOM 0 HB2 LYS A 363 2.256 2.851 -11.022 1.00 0.00 H new ATOM 0 HB3 LYS A 363 0.924 2.256 -11.993 1.00 0.00 H new ATOM 0 HG2 LYS A 363 0.841 1.910 -8.977 1.00 0.00 H new ATOM 0 HG3 LYS A 363 0.428 3.463 -9.675 1.00 0.00 H new ATOM 0 HD2 LYS A 363 -1.659 2.641 -10.093 1.00 0.00 H new ATOM 0 HD3 LYS A 363 -0.945 1.586 -11.296 1.00 0.00 H new ATOM 0 HE2 LYS A 363 -0.615 -0.207 -9.637 1.00 0.00 H new ATOM 0 HE3 LYS A 363 -1.049 0.859 -8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 363 -3.017 -0.334 -8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 363 -3.222 1.251 -9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 363 -2.797 0.006 -10.585 1.00 0.00 H new ATOM 940 N ASP A 364 0.849 -0.096 -12.908 1.00 0.00 N ATOM 941 CA ASP A 364 -0.019 -1.048 -13.653 1.00 0.00 C ATOM 942 C ASP A 364 0.506 -2.468 -13.440 1.00 0.00 C ATOM 943 O ASP A 364 -0.238 -3.428 -13.454 1.00 0.00 O ATOM 944 CB ASP A 364 0.101 -0.641 -15.123 1.00 0.00 C ATOM 945 CG ASP A 364 -0.322 0.820 -15.285 1.00 0.00 C ATOM 946 OD1 ASP A 364 -1.209 1.243 -14.563 1.00 0.00 O ATOM 947 OD2 ASP A 364 0.249 1.491 -16.129 1.00 0.00 O ATOM 0 H ASP A 364 1.226 0.674 -13.460 1.00 0.00 H new ATOM 0 HA ASP A 364 -1.057 -1.024 -13.322 1.00 0.00 H new ATOM 0 HB2 ASP A 364 1.127 -0.773 -15.465 1.00 0.00 H new ATOM 0 HB3 ASP A 364 -0.526 -1.283 -15.741 1.00 0.00 H new ATOM 952 N PHE A 365 1.788 -2.601 -13.225 1.00 0.00 N ATOM 953 CA PHE A 365 2.369 -3.954 -12.992 1.00 0.00 C ATOM 954 C PHE A 365 1.961 -4.452 -11.600 1.00 0.00 C ATOM 955 O PHE A 365 1.485 -5.558 -11.441 1.00 0.00 O ATOM 956 CB PHE A 365 3.891 -3.748 -13.101 1.00 0.00 C ATOM 957 CG PHE A 365 4.626 -4.690 -12.169 1.00 0.00 C ATOM 958 CD1 PHE A 365 4.723 -6.052 -12.480 1.00 0.00 C ATOM 959 CD2 PHE A 365 5.207 -4.197 -10.993 1.00 0.00 C ATOM 960 CE1 PHE A 365 5.401 -6.920 -11.616 1.00 0.00 C ATOM 961 CE2 PHE A 365 5.884 -5.066 -10.130 1.00 0.00 C ATOM 962 CZ PHE A 365 5.982 -6.427 -10.441 1.00 0.00 C ATOM 0 H PHE A 365 2.457 -1.831 -13.201 1.00 0.00 H new ATOM 0 HA PHE A 365 2.021 -4.703 -13.703 1.00 0.00 H new ATOM 0 HB2 PHE A 365 4.214 -3.919 -14.128 1.00 0.00 H new ATOM 0 HB3 PHE A 365 4.142 -2.716 -12.856 1.00 0.00 H new ATOM 0 HD1 PHE A 365 4.275 -6.433 -13.386 1.00 0.00 H new ATOM 0 HD2 PHE A 365 5.132 -3.147 -10.753 1.00 0.00 H new ATOM 0 HE1 PHE A 365 5.476 -7.970 -11.856 1.00 0.00 H new ATOM 0 HE2 PHE A 365 6.331 -4.686 -9.223 1.00 0.00 H new ATOM 0 HZ PHE A 365 6.506 -7.097 -9.775 1.00 0.00 H new ATOM 972 N ILE A 366 2.138 -3.640 -10.592 1.00 0.00 N ATOM 973 CA ILE A 366 1.752 -4.067 -9.216 1.00 0.00 C ATOM 974 C ILE A 366 0.349 -4.674 -9.242 1.00 0.00 C ATOM 975 O ILE A 366 0.174 -5.869 -9.100 1.00 0.00 O ATOM 976 CB ILE A 366 1.773 -2.782 -8.383 1.00 0.00 C ATOM 977 CG1 ILE A 366 3.219 -2.437 -8.015 1.00 0.00 C ATOM 978 CG2 ILE A 366 0.959 -2.982 -7.103 1.00 0.00 C ATOM 979 CD1 ILE A 366 3.458 -0.941 -8.227 1.00 0.00 C ATOM 0 H ILE A 366 2.532 -2.702 -10.662 1.00 0.00 H new ATOM 0 HA ILE A 366 2.422 -4.823 -8.805 1.00 0.00 H new ATOM 0 HB ILE A 366 1.338 -1.969 -8.965 1.00 0.00 H new ATOM 0 HG12 ILE A 366 3.414 -2.703 -6.976 1.00 0.00 H new ATOM 0 HG13 ILE A 366 3.909 -3.017 -8.628 1.00 0.00 H new ATOM 0 HG21 ILE A 366 0.977 -2.065 -6.514 1.00 0.00 H new ATOM 0 HG22 ILE A 366 -0.071 -3.227 -7.361 1.00 0.00 H new ATOM 0 HG23 ILE A 366 1.391 -3.796 -6.521 1.00 0.00 H new ATOM 0 HD11 ILE A 366 4.487 -0.696 -7.965 1.00 0.00 H new ATOM 0 HD12 ILE A 366 3.280 -0.689 -9.272 1.00 0.00 H new ATOM 0 HD13 ILE A 366 2.777 -0.371 -7.595 1.00 0.00 H new ATOM 991 N LYS A 367 -0.653 -3.862 -9.431 1.00 0.00 N ATOM 992 CA LYS A 367 -2.044 -4.394 -9.477 1.00 0.00 C ATOM 993 C LYS A 367 -2.083 -5.680 -10.306 1.00 0.00 C ATOM 994 O LYS A 367 -2.714 -6.651 -9.936 1.00 0.00 O ATOM 995 CB LYS A 367 -2.873 -3.287 -10.136 1.00 0.00 C ATOM 996 CG LYS A 367 -2.631 -3.284 -11.647 1.00 0.00 C ATOM 997 CD LYS A 367 -3.402 -2.126 -12.283 1.00 0.00 C ATOM 998 CE LYS A 367 -4.112 -2.617 -13.546 1.00 0.00 C ATOM 999 NZ LYS A 367 -5.564 -2.436 -13.265 1.00 0.00 N ATOM 0 H LYS A 367 -0.569 -2.853 -9.556 1.00 0.00 H new ATOM 0 HA LYS A 367 -2.429 -4.645 -8.489 1.00 0.00 H new ATOM 0 HB2 LYS A 367 -3.932 -3.442 -9.929 1.00 0.00 H new ATOM 0 HB3 LYS A 367 -2.604 -2.319 -9.714 1.00 0.00 H new ATOM 0 HG2 LYS A 367 -1.566 -3.184 -11.856 1.00 0.00 H new ATOM 0 HG3 LYS A 367 -2.953 -4.231 -12.080 1.00 0.00 H new ATOM 0 HD2 LYS A 367 -4.130 -1.728 -11.576 1.00 0.00 H new ATOM 0 HD3 LYS A 367 -2.719 -1.313 -12.530 1.00 0.00 H new ATOM 0 HE2 LYS A 367 -3.804 -2.043 -14.420 1.00 0.00 H new ATOM 0 HE3 LYS A 367 -3.876 -3.661 -13.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 -6.111 -2.622 -14.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 -5.859 -3.099 -12.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 -5.737 -1.461 -12.949 1.00 0.00 H new ATOM 1013 N THR A 368 -1.412 -5.694 -11.426 1.00 0.00 N ATOM 1014 CA THR A 368 -1.404 -6.914 -12.281 1.00 0.00 C ATOM 1015 C THR A 368 -0.735 -8.077 -11.542 1.00 0.00 C ATOM 1016 O THR A 368 -1.002 -9.231 -11.813 1.00 0.00 O ATOM 1017 CB THR A 368 -0.589 -6.521 -13.518 1.00 0.00 C ATOM 1018 OG1 THR A 368 -1.392 -5.722 -14.375 1.00 0.00 O ATOM 1019 CG2 THR A 368 -0.141 -7.779 -14.263 1.00 0.00 C ATOM 0 H THR A 368 -0.868 -4.910 -11.786 1.00 0.00 H new ATOM 0 HA THR A 368 -2.410 -7.244 -12.541 1.00 0.00 H new ATOM 0 HB THR A 368 0.290 -5.956 -13.208 1.00 0.00 H new ATOM 0 HG1 THR A 368 -1.171 -4.776 -14.242 1.00 0.00 H new ATOM 0 HG21 THR A 368 0.438 -7.495 -15.142 1.00 0.00 H new ATOM 0 HG22 THR A 368 0.475 -8.392 -13.605 1.00 0.00 H new ATOM 0 HG23 THR A 368 -1.017 -8.349 -14.574 1.00 0.00 H new ATOM 1027 N THR A 369 0.134 -7.784 -10.612 1.00 0.00 N ATOM 1028 CA THR A 369 0.816 -8.881 -9.865 1.00 0.00 C ATOM 1029 C THR A 369 -0.183 -9.595 -8.948 1.00 0.00 C ATOM 1030 O THR A 369 -0.157 -10.802 -8.806 1.00 0.00 O ATOM 1031 CB THR A 369 1.936 -8.190 -9.064 1.00 0.00 C ATOM 1032 OG1 THR A 369 3.063 -9.052 -9.000 1.00 0.00 O ATOM 1033 CG2 THR A 369 1.470 -7.861 -7.638 1.00 0.00 C ATOM 0 H THR A 369 0.400 -6.838 -10.338 1.00 0.00 H new ATOM 0 HA THR A 369 1.224 -9.647 -10.524 1.00 0.00 H new ATOM 0 HB THR A 369 2.198 -7.259 -9.566 1.00 0.00 H new ATOM 0 HG1 THR A 369 3.780 -8.617 -8.493 1.00 0.00 H new ATOM 0 HG21 THR A 369 2.279 -7.374 -7.094 1.00 0.00 H new ATOM 0 HG22 THR A 369 0.609 -7.194 -7.681 1.00 0.00 H new ATOM 0 HG23 THR A 369 1.191 -8.781 -7.125 1.00 0.00 H new ATOM 1041 N VAL A 370 -1.066 -8.859 -8.330 1.00 0.00 N ATOM 1042 CA VAL A 370 -2.066 -9.502 -7.431 1.00 0.00 C ATOM 1043 C VAL A 370 -3.188 -10.126 -8.262 1.00 0.00 C ATOM 1044 O VAL A 370 -3.580 -11.256 -8.045 1.00 0.00 O ATOM 1045 CB VAL A 370 -2.603 -8.368 -6.557 1.00 0.00 C ATOM 1046 CG1 VAL A 370 -3.690 -8.912 -5.628 1.00 0.00 C ATOM 1047 CG2 VAL A 370 -1.461 -7.792 -5.718 1.00 0.00 C ATOM 0 H VAL A 370 -1.138 -7.845 -8.408 1.00 0.00 H new ATOM 0 HA VAL A 370 -1.633 -10.302 -6.830 1.00 0.00 H new ATOM 0 HB VAL A 370 -3.023 -7.587 -7.190 1.00 0.00 H new ATOM 0 HG11 VAL A 370 -4.073 -8.104 -5.005 1.00 0.00 H new ATOM 0 HG12 VAL A 370 -4.503 -9.328 -6.223 1.00 0.00 H new ATOM 0 HG13 VAL A 370 -3.269 -9.692 -4.993 1.00 0.00 H new ATOM 0 HG21 VAL A 370 -1.840 -6.983 -5.094 1.00 0.00 H new ATOM 0 HG22 VAL A 370 -1.044 -8.575 -5.084 1.00 0.00 H new ATOM 0 HG23 VAL A 370 -0.683 -7.407 -6.378 1.00 0.00 H new ATOM 1057 N LYS A 371 -3.700 -9.404 -9.220 1.00 0.00 N ATOM 1058 CA LYS A 371 -4.789 -9.965 -10.071 1.00 0.00 C ATOM 1059 C LYS A 371 -4.374 -11.341 -10.596 1.00 0.00 C ATOM 1060 O LYS A 371 -5.174 -12.254 -10.683 1.00 0.00 O ATOM 1061 CB LYS A 371 -4.940 -8.973 -11.226 1.00 0.00 C ATOM 1062 CG LYS A 371 -5.780 -7.779 -10.766 1.00 0.00 C ATOM 1063 CD LYS A 371 -6.878 -7.501 -11.794 1.00 0.00 C ATOM 1064 CE LYS A 371 -6.278 -6.775 -13.000 1.00 0.00 C ATOM 1065 NZ LYS A 371 -7.179 -7.112 -14.138 1.00 0.00 N ATOM 0 H LYS A 371 -3.413 -8.453 -9.451 1.00 0.00 H new ATOM 0 HA LYS A 371 -5.723 -10.095 -9.525 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.959 -8.634 -11.559 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.416 -9.459 -12.078 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -6.223 -7.986 -9.792 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -5.147 -6.900 -10.648 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -7.338 -8.437 -12.112 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.665 -6.894 -11.346 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.238 -5.699 -12.833 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.257 -7.106 -13.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -6.833 -6.650 -15.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.192 -8.143 -14.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.142 -6.779 -13.929 1.00 0.00 H new ATOM 1079 N GLU A 372 -3.125 -11.499 -10.937 1.00 0.00 N ATOM 1080 CA GLU A 372 -2.651 -12.816 -11.447 1.00 0.00 C ATOM 1081 C GLU A 372 -2.432 -13.769 -10.273 1.00 0.00 C ATOM 1082 O GLU A 372 -2.548 -14.971 -10.406 1.00 0.00 O ATOM 1083 CB GLU A 372 -1.331 -12.516 -12.161 1.00 0.00 C ATOM 1084 CG GLU A 372 -1.619 -12.095 -13.604 1.00 0.00 C ATOM 1085 CD GLU A 372 -0.441 -12.487 -14.498 1.00 0.00 C ATOM 1086 OE1 GLU A 372 -0.022 -13.630 -14.427 1.00 0.00 O ATOM 1087 OE2 GLU A 372 0.022 -11.636 -15.241 1.00 0.00 O ATOM 0 H GLU A 372 -2.411 -10.772 -10.884 1.00 0.00 H new ATOM 0 HA GLU A 372 -3.367 -13.291 -12.118 1.00 0.00 H new ATOM 0 HB2 GLU A 372 -0.794 -11.724 -11.639 1.00 0.00 H new ATOM 0 HB3 GLU A 372 -0.689 -13.397 -12.149 1.00 0.00 H new ATOM 0 HG2 GLU A 372 -2.532 -12.574 -13.958 1.00 0.00 H new ATOM 0 HG3 GLU A 372 -1.784 -11.019 -13.653 1.00 0.00 H new ATOM 1094 N LEU A 373 -2.131 -13.237 -9.120 1.00 0.00 N ATOM 1095 CA LEU A 373 -1.922 -14.106 -7.930 1.00 0.00 C ATOM 1096 C LEU A 373 -3.289 -14.547 -7.397 1.00 0.00 C ATOM 1097 O LEU A 373 -3.406 -15.523 -6.684 1.00 0.00 O ATOM 1098 CB LEU A 373 -1.171 -13.215 -6.923 1.00 0.00 C ATOM 1099 CG LEU A 373 -1.671 -13.467 -5.496 1.00 0.00 C ATOM 1100 CD1 LEU A 373 -0.548 -13.182 -4.498 1.00 0.00 C ATOM 1101 CD2 LEU A 373 -2.858 -12.544 -5.208 1.00 0.00 C ATOM 0 H LEU A 373 -2.021 -12.237 -8.952 1.00 0.00 H new ATOM 0 HA LEU A 373 -1.356 -15.014 -8.140 1.00 0.00 H new ATOM 0 HB2 LEU A 373 -0.101 -13.416 -6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 373 -1.312 -12.166 -7.183 1.00 0.00 H new ATOM 0 HG LEU A 373 -1.982 -14.507 -5.398 1.00 0.00 H new ATOM 0 HD11 LEU A 373 -0.907 -13.362 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 373 0.298 -13.838 -4.705 1.00 0.00 H new ATOM 0 HD13 LEU A 373 -0.233 -12.143 -4.592 1.00 0.00 H new ATOM 0 HD21 LEU A 373 -3.218 -12.719 -4.194 1.00 0.00 H new ATOM 0 HD22 LEU A 373 -2.543 -11.505 -5.307 1.00 0.00 H new ATOM 0 HD23 LEU A 373 -3.659 -12.750 -5.918 1.00 0.00 H new ATOM 1113 N ILE A 374 -4.323 -13.830 -7.746 1.00 0.00 N ATOM 1114 CA ILE A 374 -5.682 -14.203 -7.268 1.00 0.00 C ATOM 1115 C ILE A 374 -6.295 -15.249 -8.202 1.00 0.00 C ATOM 1116 O ILE A 374 -7.117 -16.049 -7.801 1.00 0.00 O ATOM 1117 CB ILE A 374 -6.494 -12.907 -7.311 1.00 0.00 C ATOM 1118 CG1 ILE A 374 -6.100 -12.017 -6.130 1.00 0.00 C ATOM 1119 CG2 ILE A 374 -7.986 -13.234 -7.224 1.00 0.00 C ATOM 1120 CD1 ILE A 374 -7.100 -10.865 -6.006 1.00 0.00 C ATOM 0 H ILE A 374 -4.284 -13.003 -8.341 1.00 0.00 H new ATOM 0 HA ILE A 374 -5.663 -14.635 -6.267 1.00 0.00 H new ATOM 0 HB ILE A 374 -6.290 -12.384 -8.245 1.00 0.00 H new ATOM 0 HG12 ILE A 374 -6.085 -12.601 -5.210 1.00 0.00 H new ATOM 0 HG13 ILE A 374 -5.093 -11.625 -6.276 1.00 0.00 H new ATOM 0 HG21 ILE A 374 -8.563 -12.310 -7.255 1.00 0.00 H new ATOM 0 HG22 ILE A 374 -8.269 -13.867 -8.065 1.00 0.00 H new ATOM 0 HG23 ILE A 374 -8.190 -13.758 -6.290 1.00 0.00 H new ATOM 0 HD11 ILE A 374 -6.821 -10.230 -5.165 1.00 0.00 H new ATOM 0 HD12 ILE A 374 -7.093 -10.276 -6.923 1.00 0.00 H new ATOM 0 HD13 ILE A 374 -8.100 -11.267 -5.841 1.00 0.00 H new ATOM 1132 N SER A 375 -5.903 -15.246 -9.446 1.00 0.00 N ATOM 1133 CA SER A 375 -6.464 -16.237 -10.407 1.00 0.00 C ATOM 1134 C SER A 375 -5.553 -17.464 -10.494 1.00 0.00 C ATOM 1135 O SER A 375 -6.011 -18.577 -10.666 1.00 0.00 O ATOM 1136 CB SER A 375 -6.505 -15.506 -11.748 1.00 0.00 C ATOM 1137 OG SER A 375 -7.812 -14.989 -11.961 1.00 0.00 O ATOM 0 H SER A 375 -5.218 -14.600 -9.839 1.00 0.00 H new ATOM 0 HA SER A 375 -7.449 -16.593 -10.105 1.00 0.00 H new ATOM 0 HB2 SER A 375 -5.775 -14.696 -11.756 1.00 0.00 H new ATOM 0 HB3 SER A 375 -6.235 -16.187 -12.555 1.00 0.00 H new ATOM 0 HG SER A 375 -7.841 -14.518 -12.820 1.00 0.00 H new ATOM 1143 N LEU A 376 -4.267 -17.272 -10.379 1.00 0.00 N ATOM 1144 CA LEU A 376 -3.332 -18.430 -10.459 1.00 0.00 C ATOM 1145 C LEU A 376 -2.935 -18.891 -9.053 1.00 0.00 C ATOM 1146 O LEU A 376 -2.734 -20.065 -8.809 1.00 0.00 O ATOM 1147 CB LEU A 376 -2.112 -17.909 -11.219 1.00 0.00 C ATOM 1148 CG LEU A 376 -1.484 -19.053 -12.017 1.00 0.00 C ATOM 1149 CD1 LEU A 376 -0.901 -18.507 -13.322 1.00 0.00 C ATOM 1150 CD2 LEU A 376 -0.366 -19.697 -11.192 1.00 0.00 C ATOM 0 H LEU A 376 -3.824 -16.365 -10.233 1.00 0.00 H new ATOM 0 HA LEU A 376 -3.783 -19.288 -10.957 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -2.405 -17.101 -11.890 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -1.384 -17.495 -10.521 1.00 0.00 H new ATOM 0 HG LEU A 376 -2.247 -19.798 -12.243 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -0.454 -19.323 -13.890 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -1.695 -18.047 -13.911 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -0.139 -17.761 -13.096 1.00 0.00 H new ATOM 0 HD21 LEU A 376 0.082 -20.512 -11.760 1.00 0.00 H new ATOM 0 HD22 LEU A 376 0.396 -18.951 -10.966 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -0.779 -20.087 -10.262 1.00 0.00 H new ATOM 1162 N GLU A 377 -2.824 -17.980 -8.125 1.00 0.00 N ATOM 1163 CA GLU A 377 -2.443 -18.374 -6.738 1.00 0.00 C ATOM 1164 C GLU A 377 -3.518 -17.925 -5.745 1.00 0.00 C ATOM 1165 O GLU A 377 -3.221 -17.431 -4.676 1.00 0.00 O ATOM 1166 CB GLU A 377 -1.123 -17.654 -6.462 1.00 0.00 C ATOM 1167 CG GLU A 377 -0.275 -18.500 -5.510 1.00 0.00 C ATOM 1168 CD GLU A 377 0.663 -17.591 -4.712 1.00 0.00 C ATOM 1169 OE1 GLU A 377 0.275 -16.468 -4.437 1.00 0.00 O ATOM 1170 OE2 GLU A 377 1.752 -18.034 -4.388 1.00 0.00 O ATOM 0 H GLU A 377 -2.980 -16.982 -8.266 1.00 0.00 H new ATOM 0 HA GLU A 377 -2.344 -19.454 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 377 -0.585 -17.486 -7.395 1.00 0.00 H new ATOM 0 HB3 GLU A 377 -1.314 -16.674 -6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 377 -0.920 -19.059 -4.832 1.00 0.00 H new ATOM 0 HG3 GLU A 377 0.304 -19.231 -6.075 1.00 0.00 H new ATOM 1177 N HIS A 378 -4.765 -18.096 -6.089 1.00 0.00 N ATOM 1178 CA HIS A 378 -5.857 -17.682 -5.162 1.00 0.00 C ATOM 1179 C HIS A 378 -5.522 -18.108 -3.731 1.00 0.00 C ATOM 1180 O HIS A 378 -6.091 -17.538 -2.815 1.00 0.00 O ATOM 1181 CB HIS A 378 -7.102 -18.416 -5.663 1.00 0.00 C ATOM 1182 CG HIS A 378 -6.757 -19.852 -5.948 1.00 0.00 C ATOM 1183 ND1 HIS A 378 -6.245 -20.467 -7.063 1.00 0.00 N flip ATOM 1184 CD2 HIS A 378 -6.926 -20.855 -5.006 1.00 0.00 C flip ATOM 1185 CE1 HIS A 378 -6.098 -21.830 -6.821 1.00 0.00 C flip ATOM 1186 NE2 HIS A 378 -6.522 -22.010 -5.567 1.00 0.00 N flip ATOM 1187 OXT HIS A 378 -4.702 -18.999 -3.576 1.00 0.00 O ATOM 0 H HIS A 378 -5.075 -18.504 -6.971 1.00 0.00 H new ATOM 0 HA HIS A 378 -6.000 -16.602 -5.147 1.00 0.00 H new ATOM 0 HB2 HIS A 378 -7.894 -18.363 -4.916 1.00 0.00 H new ATOM 0 HB3 HIS A 378 -7.482 -17.936 -6.565 1.00 0.00 H new ATOM 0 HD2 HIS A 378 -7.311 -20.732 -4.005 1.00 0.00 H new ATOM 0 HE1 HIS A 378 -5.722 -22.580 -7.501 1.00 0.00 H new ATOM 0 HE2 HIS A 378 -6.538 -22.913 -5.092 1.00 0.00 H new TER 1195 HIS A 378