USER MOD reduce.3.24.130724 H: found=0, std=0, add=862, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 864 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 767 TYR OH : rot -24:sc= 1.12 USER MOD Set 1.2: A 768 LYS NZ :NH3+ 161:sc=-0.00527 (180deg=-0.124) USER MOD Set 2.1: A 747 TYR OH : rot 180:sc= -1.59! USER MOD Set 2.2: A 755 SER OG : rot 167:sc= 0.0447 USER MOD Set 3.1: A 730 HIS : no HE2:sc= 0.498 K(o=0.5,f=-3.6!) USER MOD Set 3.2: A 736 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 710 SER OG : rot -76:sc= 0.377 USER MOD Set 4.2: A 719 HIS : no HD1:sc= -0.0463 K(o=0.33,f=-1.4) USER MOD Set 5.1: A 678 MET CE :methyl -122:sc= 0 (180deg=0) USER MOD Set 5.2: A 682 GLN : amide:sc= 0 K(o=0,f=-3.2!) USER MOD Single : A 668 TYR OH : rot 130:sc= -1.18 USER MOD Single : A 669 THR OG1 : rot 180:sc= 0 USER MOD Single : A 671 TYR OH : rot 180:sc= 0 USER MOD Single : A 677 ASN : amide:sc= 0.221 K(o=0.22,f=-2.9!) USER MOD Single : A 681 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 683 THR OG1 : rot 90:sc= -0.454 USER MOD Single : A 685 ASN : amide:sc= -0.0286 K(o=-0.029,f=-0.8) USER MOD Single : A 688 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 SER OG : rot 180:sc= 0 USER MOD Single : A 690 HIS : no HD1:sc= -0.547 K(o=-0.55,f=-2.7) USER MOD Single : A 692 SER OG : rot 180:sc= -0.763 USER MOD Single : A 694 THR OG1 : rot 80:sc= -0.657 USER MOD Single : A 695 TYR OH : rot 153:sc= 0.0257 USER MOD Single : A 712 LYS NZ :NH3+ -148:sc= -0.426 (180deg=-1.01) USER MOD Single : A 714 ASN : amide:sc= -0.326 K(o=-0.33,f=-2.1!) USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 721 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 725 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 727 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 735 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 739 SER OG : rot 180:sc= 0 USER MOD Single : A 746 TYR OH : rot 180:sc= 0 USER MOD Single : A 748 GLN : amide:sc= -2.08! X(o=-2.1!,f=-2.1) USER MOD Single : A 749 CYS SG : rot 180:sc= 0 USER MOD Single : A 750 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 751 SER OG : rot 170:sc= -0.314 USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 757 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 758 GLN : amide:sc= -0.0538 X(o=-0.054,f=-0.041) USER MOD Single : A 761 THR OG1 : rot 180:sc= -0.31 USER MOD Single : A 762 THR OG1 : rot 180:sc= 0 USER MOD Single : A 764 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 765 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 145 N TYR A 668 -7.410 0.842 11.320 1.00 0.00 N ATOM 146 CA TYR A 668 -7.479 0.518 9.896 1.00 0.00 C ATOM 147 C TYR A 668 -7.412 -0.995 9.665 1.00 0.00 C ATOM 148 O TYR A 668 -7.705 -1.471 8.569 1.00 0.00 O ATOM 149 CB TYR A 668 -6.347 1.213 9.138 1.00 0.00 C ATOM 150 CG TYR A 668 -6.632 2.663 8.810 1.00 0.00 C ATOM 151 CD1 TYR A 668 -7.177 3.518 9.762 1.00 0.00 C ATOM 152 CD2 TYR A 668 -6.352 3.176 7.551 1.00 0.00 C ATOM 153 CE1 TYR A 668 -7.438 4.840 9.466 1.00 0.00 C ATOM 154 CE2 TYR A 668 -6.611 4.499 7.248 1.00 0.00 C ATOM 155 CZ TYR A 668 -7.153 5.327 8.209 1.00 0.00 C ATOM 156 OH TYR A 668 -7.410 6.643 7.910 1.00 0.00 O ATOM 0 HA TYR A 668 -8.437 0.877 9.519 1.00 0.00 H new ATOM 0 HB2 TYR A 668 -5.436 1.157 9.733 1.00 0.00 H new ATOM 0 HB3 TYR A 668 -6.156 0.671 8.212 1.00 0.00 H new ATOM 0 HD1 TYR A 668 -7.400 3.141 10.749 1.00 0.00 H new ATOM 0 HD2 TYR A 668 -5.925 2.531 6.797 1.00 0.00 H new ATOM 0 HE1 TYR A 668 -7.864 5.490 10.216 1.00 0.00 H new ATOM 0 HE2 TYR A 668 -6.390 4.883 6.263 1.00 0.00 H new ATOM 0 HH TYR A 668 -6.615 7.048 7.505 1.00 0.00 H new ATOM 166 N THR A 669 -7.030 -1.744 10.704 1.00 0.00 N ATOM 167 CA THR A 669 -6.932 -3.200 10.618 1.00 0.00 C ATOM 168 C THR A 669 -8.272 -3.823 10.218 1.00 0.00 C ATOM 169 O THR A 669 -8.307 -4.864 9.563 1.00 0.00 O ATOM 170 CB THR A 669 -6.470 -3.785 11.954 1.00 0.00 C ATOM 171 OG1 THR A 669 -7.335 -3.384 13.003 1.00 0.00 O ATOM 172 CG2 THR A 669 -5.064 -3.374 12.337 1.00 0.00 C ATOM 0 H THR A 669 -6.783 -1.362 11.617 1.00 0.00 H new ATOM 0 HA THR A 669 -6.197 -3.437 9.848 1.00 0.00 H new ATOM 0 HB THR A 669 -6.489 -4.866 11.816 1.00 0.00 H new ATOM 0 HG1 THR A 669 -7.024 -3.769 13.849 1.00 0.00 H new ATOM 0 HG21 THR A 669 -4.801 -3.824 13.294 1.00 0.00 H new ATOM 0 HG22 THR A 669 -4.365 -3.713 11.573 1.00 0.00 H new ATOM 0 HG23 THR A 669 -5.012 -2.288 12.420 1.00 0.00 H new ATOM 180 N ALA A 670 -9.370 -3.178 10.622 1.00 0.00 N ATOM 181 CA ALA A 670 -10.712 -3.666 10.309 1.00 0.00 C ATOM 182 C ALA A 670 -10.946 -3.749 8.798 1.00 0.00 C ATOM 183 O ALA A 670 -11.725 -4.582 8.332 1.00 0.00 O ATOM 184 CB ALA A 670 -11.759 -2.768 10.955 1.00 0.00 C ATOM 0 H ALA A 670 -9.354 -2.316 11.167 1.00 0.00 H new ATOM 0 HA ALA A 670 -10.802 -4.674 10.713 1.00 0.00 H new ATOM 0 HB1 ALA A 670 -12.755 -3.140 10.716 1.00 0.00 H new ATOM 0 HB2 ALA A 670 -11.622 -2.768 12.036 1.00 0.00 H new ATOM 0 HB3 ALA A 670 -11.651 -1.752 10.576 1.00 0.00 H new ATOM 190 N TYR A 671 -10.273 -2.882 8.042 1.00 0.00 N ATOM 191 CA TYR A 671 -10.413 -2.860 6.587 1.00 0.00 C ATOM 192 C TYR A 671 -9.815 -4.117 5.955 1.00 0.00 C ATOM 193 O TYR A 671 -8.729 -4.557 6.338 1.00 0.00 O ATOM 194 CB TYR A 671 -9.729 -1.618 6.005 1.00 0.00 C ATOM 195 CG TYR A 671 -10.417 -0.316 6.356 1.00 0.00 C ATOM 196 CD1 TYR A 671 -10.202 0.300 7.584 1.00 0.00 C ATOM 197 CD2 TYR A 671 -11.277 0.300 5.455 1.00 0.00 C ATOM 198 CE1 TYR A 671 -10.822 1.490 7.903 1.00 0.00 C ATOM 199 CE2 TYR A 671 -11.902 1.491 5.769 1.00 0.00 C ATOM 200 CZ TYR A 671 -11.671 2.081 6.993 1.00 0.00 C ATOM 201 OH TYR A 671 -12.289 3.270 7.305 1.00 0.00 O ATOM 0 H TYR A 671 -9.626 -2.186 8.413 1.00 0.00 H new ATOM 0 HA TYR A 671 -11.478 -2.829 6.356 1.00 0.00 H new ATOM 0 HB2 TYR A 671 -8.700 -1.581 6.362 1.00 0.00 H new ATOM 0 HB3 TYR A 671 -9.686 -1.714 4.920 1.00 0.00 H new ATOM 0 HD1 TYR A 671 -9.538 -0.161 8.300 1.00 0.00 H new ATOM 0 HD2 TYR A 671 -11.459 -0.159 4.495 1.00 0.00 H new ATOM 0 HE1 TYR A 671 -10.643 1.956 8.861 1.00 0.00 H new ATOM 0 HE2 TYR A 671 -12.569 1.958 5.059 1.00 0.00 H new ATOM 0 HH TYR A 671 -12.853 3.552 6.555 1.00 0.00 H new ATOM 211 N PRO A 672 -10.525 -4.717 4.974 1.00 0.00 N ATOM 212 CA PRO A 672 -10.067 -5.936 4.283 1.00 0.00 C ATOM 213 C PRO A 672 -8.730 -5.764 3.551 1.00 0.00 C ATOM 214 O PRO A 672 -8.114 -6.753 3.150 1.00 0.00 O ATOM 215 CB PRO A 672 -11.185 -6.223 3.270 1.00 0.00 C ATOM 216 CG PRO A 672 -12.374 -5.491 3.787 1.00 0.00 C ATOM 217 CD PRO A 672 -11.833 -4.265 4.466 1.00 0.00 C ATOM 0 HA PRO A 672 -9.888 -6.740 4.997 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -10.912 -5.877 2.273 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -11.383 -7.292 3.194 1.00 0.00 H new ATOM 0 HG2 PRO A 672 -13.052 -5.223 2.976 1.00 0.00 H new ATOM 0 HG3 PRO A 672 -12.940 -6.108 4.485 1.00 0.00 H new ATOM 0 HD2 PRO A 672 -11.730 -3.431 3.771 1.00 0.00 H new ATOM 0 HD3 PRO A 672 -12.485 -3.929 5.272 1.00 0.00 H new ATOM 225 N TRP A 673 -8.281 -4.516 3.378 1.00 0.00 N ATOM 226 CA TRP A 673 -7.011 -4.249 2.695 1.00 0.00 C ATOM 227 C TRP A 673 -5.896 -3.905 3.690 1.00 0.00 C ATOM 228 O TRP A 673 -4.913 -3.249 3.331 1.00 0.00 O ATOM 229 CB TRP A 673 -7.168 -3.115 1.665 1.00 0.00 C ATOM 230 CG TRP A 673 -8.023 -1.968 2.125 1.00 0.00 C ATOM 231 CD1 TRP A 673 -9.358 -1.794 1.889 1.00 0.00 C ATOM 232 CD2 TRP A 673 -7.598 -0.830 2.885 1.00 0.00 C ATOM 233 NE1 TRP A 673 -9.790 -0.620 2.461 1.00 0.00 N ATOM 234 CE2 TRP A 673 -8.727 -0.010 3.077 1.00 0.00 C ATOM 235 CE3 TRP A 673 -6.375 -0.425 3.425 1.00 0.00 C ATOM 236 CZ2 TRP A 673 -8.666 1.189 3.785 1.00 0.00 C ATOM 237 CZ3 TRP A 673 -6.314 0.764 4.125 1.00 0.00 C ATOM 238 CH2 TRP A 673 -7.454 1.559 4.300 1.00 0.00 C ATOM 0 H TRP A 673 -8.773 -3.682 3.698 1.00 0.00 H new ATOM 0 HA TRP A 673 -6.728 -5.163 2.172 1.00 0.00 H new ATOM 0 HB2 TRP A 673 -6.179 -2.735 1.409 1.00 0.00 H new ATOM 0 HB3 TRP A 673 -7.597 -3.528 0.752 1.00 0.00 H new ATOM 0 HD1 TRP A 673 -9.983 -2.478 1.334 1.00 0.00 H new ATOM 0 HE1 TRP A 673 -10.745 -0.262 2.432 1.00 0.00 H new ATOM 0 HE3 TRP A 673 -5.491 -1.032 3.297 1.00 0.00 H new ATOM 0 HZ2 TRP A 673 -9.544 1.803 3.922 1.00 0.00 H new ATOM 0 HZ3 TRP A 673 -5.372 1.086 4.544 1.00 0.00 H new ATOM 0 HH2 TRP A 673 -7.374 2.483 4.853 1.00 0.00 H new ATOM 249 N PHE A 674 -6.046 -4.352 4.939 1.00 0.00 N ATOM 250 CA PHE A 674 -5.049 -4.087 5.973 1.00 0.00 C ATOM 251 C PHE A 674 -4.493 -5.388 6.554 1.00 0.00 C ATOM 252 O PHE A 674 -5.252 -6.262 6.983 1.00 0.00 O ATOM 253 CB PHE A 674 -5.665 -3.237 7.086 1.00 0.00 C ATOM 254 CG PHE A 674 -4.651 -2.603 8.002 1.00 0.00 C ATOM 255 CD1 PHE A 674 -3.915 -3.377 8.886 1.00 0.00 C ATOM 256 CD2 PHE A 674 -4.437 -1.234 7.980 1.00 0.00 C ATOM 257 CE1 PHE A 674 -2.986 -2.798 9.729 1.00 0.00 C ATOM 258 CE2 PHE A 674 -3.510 -0.650 8.821 1.00 0.00 C ATOM 259 CZ PHE A 674 -2.783 -1.433 9.697 1.00 0.00 C ATOM 0 H PHE A 674 -6.847 -4.898 5.256 1.00 0.00 H new ATOM 0 HA PHE A 674 -4.223 -3.542 5.516 1.00 0.00 H new ATOM 0 HB2 PHE A 674 -6.274 -2.453 6.636 1.00 0.00 H new ATOM 0 HB3 PHE A 674 -6.335 -3.861 7.678 1.00 0.00 H new ATOM 0 HD1 PHE A 674 -4.070 -4.445 8.916 1.00 0.00 H new ATOM 0 HD2 PHE A 674 -5.002 -0.616 7.297 1.00 0.00 H new ATOM 0 HE1 PHE A 674 -2.419 -3.413 10.412 1.00 0.00 H new ATOM 0 HE2 PHE A 674 -3.353 0.418 8.794 1.00 0.00 H new ATOM 0 HZ PHE A 674 -2.058 -0.978 10.355 1.00 0.00 H new ATOM 269 N ALA A 675 -3.165 -5.498 6.573 1.00 0.00 N ATOM 270 CA ALA A 675 -2.487 -6.677 7.110 1.00 0.00 C ATOM 271 C ALA A 675 -1.592 -6.294 8.287 1.00 0.00 C ATOM 272 O ALA A 675 -1.211 -5.131 8.432 1.00 0.00 O ATOM 273 CB ALA A 675 -1.663 -7.361 6.027 1.00 0.00 C ATOM 0 H ALA A 675 -2.534 -4.779 6.220 1.00 0.00 H new ATOM 0 HA ALA A 675 -3.247 -7.374 7.463 1.00 0.00 H new ATOM 0 HB1 ALA A 675 -1.166 -8.236 6.446 1.00 0.00 H new ATOM 0 HB2 ALA A 675 -2.318 -7.671 5.213 1.00 0.00 H new ATOM 0 HB3 ALA A 675 -0.914 -6.666 5.646 1.00 0.00 H new ATOM 279 N GLY A 676 -1.255 -7.277 9.122 1.00 0.00 N ATOM 280 CA GLY A 676 -0.404 -7.019 10.275 1.00 0.00 C ATOM 281 C GLY A 676 1.053 -6.832 9.898 1.00 0.00 C ATOM 282 O GLY A 676 1.362 -6.244 8.860 1.00 0.00 O ATOM 0 H GLY A 676 -1.556 -8.246 9.021 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -0.759 -6.127 10.791 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -0.490 -7.848 10.977 1.00 0.00 H new ATOM 286 N ASN A 677 1.951 -7.336 10.741 1.00 0.00 N ATOM 287 CA ASN A 677 3.388 -7.226 10.491 1.00 0.00 C ATOM 288 C ASN A 677 3.903 -8.455 9.738 1.00 0.00 C ATOM 289 O ASN A 677 4.888 -9.080 10.140 1.00 0.00 O ATOM 290 CB ASN A 677 4.146 -7.057 11.812 1.00 0.00 C ATOM 291 CG ASN A 677 5.381 -6.189 11.661 1.00 0.00 C ATOM 292 OD1 ASN A 677 5.381 -5.019 12.043 1.00 0.00 O ATOM 293 ND2 ASN A 677 6.444 -6.759 11.104 1.00 0.00 N ATOM 0 H ASN A 677 1.710 -7.825 11.603 1.00 0.00 H new ATOM 0 HA ASN A 677 3.561 -6.346 9.871 1.00 0.00 H new ATOM 0 HB2 ASN A 677 3.482 -6.614 12.555 1.00 0.00 H new ATOM 0 HB3 ASN A 677 4.438 -8.037 12.189 1.00 0.00 H new ATOM 0 HD21 ASN A 677 7.303 -6.224 10.979 1.00 0.00 H new ATOM 0 HD22 ASN A 677 6.401 -7.732 10.801 1.00 0.00 H new ATOM 300 N MET A 678 3.229 -8.797 8.638 1.00 0.00 N ATOM 301 CA MET A 678 3.611 -9.950 7.824 1.00 0.00 C ATOM 302 C MET A 678 4.849 -9.644 6.981 1.00 0.00 C ATOM 303 O MET A 678 5.123 -8.487 6.659 1.00 0.00 O ATOM 304 CB MET A 678 2.449 -10.367 6.918 1.00 0.00 C ATOM 305 CG MET A 678 1.490 -11.351 7.571 1.00 0.00 C ATOM 306 SD MET A 678 -0.241 -10.938 7.279 1.00 0.00 S ATOM 307 CE MET A 678 -0.388 -11.295 5.531 1.00 0.00 C ATOM 0 H MET A 678 2.415 -8.290 8.291 1.00 0.00 H new ATOM 0 HA MET A 678 3.852 -10.773 8.497 1.00 0.00 H new ATOM 0 HB2 MET A 678 1.895 -9.477 6.619 1.00 0.00 H new ATOM 0 HB3 MET A 678 2.851 -10.813 6.008 1.00 0.00 H new ATOM 0 HG2 MET A 678 1.689 -12.353 7.190 1.00 0.00 H new ATOM 0 HG3 MET A 678 1.677 -11.375 8.645 1.00 0.00 H new ATOM 0 HE1 MET A 678 -0.714 -10.399 5.003 1.00 0.00 H new ATOM 0 HE2 MET A 678 0.579 -11.613 5.142 1.00 0.00 H new ATOM 0 HE3 MET A 678 -1.119 -12.090 5.382 1.00 0.00 H new ATOM 317 N GLU A 679 5.593 -10.692 6.630 1.00 0.00 N ATOM 318 CA GLU A 679 6.808 -10.542 5.828 1.00 0.00 C ATOM 319 C GLU A 679 6.504 -10.627 4.333 1.00 0.00 C ATOM 320 O GLU A 679 5.419 -11.052 3.932 1.00 0.00 O ATOM 321 CB GLU A 679 7.828 -11.620 6.207 1.00 0.00 C ATOM 322 CG GLU A 679 8.293 -11.540 7.652 1.00 0.00 C ATOM 323 CD GLU A 679 9.454 -10.584 7.834 1.00 0.00 C ATOM 324 OE1 GLU A 679 9.219 -9.357 7.838 1.00 0.00 O ATOM 325 OE2 GLU A 679 10.601 -11.062 7.967 1.00 0.00 O ATOM 0 H GLU A 679 5.376 -11.655 6.888 1.00 0.00 H new ATOM 0 HA GLU A 679 7.223 -9.556 6.037 1.00 0.00 H new ATOM 0 HB2 GLU A 679 7.389 -12.602 6.030 1.00 0.00 H new ATOM 0 HB3 GLU A 679 8.694 -11.535 5.551 1.00 0.00 H new ATOM 0 HG2 GLU A 679 7.462 -11.221 8.281 1.00 0.00 H new ATOM 0 HG3 GLU A 679 8.587 -12.533 7.991 1.00 0.00 H new ATOM 332 N ARG A 680 7.476 -10.224 3.509 1.00 0.00 N ATOM 333 CA ARG A 680 7.313 -10.265 2.054 1.00 0.00 C ATOM 334 C ARG A 680 7.071 -11.693 1.566 1.00 0.00 C ATOM 335 O ARG A 680 6.317 -11.909 0.619 1.00 0.00 O ATOM 336 CB ARG A 680 8.537 -9.667 1.347 1.00 0.00 C ATOM 337 CG ARG A 680 9.845 -10.394 1.634 1.00 0.00 C ATOM 338 CD ARG A 680 10.984 -9.850 0.783 1.00 0.00 C ATOM 339 NE ARG A 680 10.641 -9.810 -0.641 1.00 0.00 N ATOM 340 CZ ARG A 680 10.639 -10.880 -1.441 1.00 0.00 C ATOM 341 NH1 ARG A 680 10.977 -12.077 -0.971 1.00 0.00 N ATOM 342 NH2 ARG A 680 10.304 -10.752 -2.721 1.00 0.00 N ATOM 0 H ARG A 680 8.379 -9.868 3.823 1.00 0.00 H new ATOM 0 HA ARG A 680 6.439 -9.663 1.805 1.00 0.00 H new ATOM 0 HB2 ARG A 680 8.360 -9.674 0.272 1.00 0.00 H new ATOM 0 HB3 ARG A 680 8.641 -8.624 1.647 1.00 0.00 H new ATOM 0 HG2 ARG A 680 10.096 -10.290 2.690 1.00 0.00 H new ATOM 0 HG3 ARG A 680 9.721 -11.459 1.439 1.00 0.00 H new ATOM 0 HD2 ARG A 680 11.241 -8.846 1.121 1.00 0.00 H new ATOM 0 HD3 ARG A 680 11.869 -10.470 0.924 1.00 0.00 H new ATOM 0 HE ARG A 680 10.388 -8.909 -1.047 1.00 0.00 H new ATOM 0 HH11 ARG A 680 11.241 -12.184 0.008 1.00 0.00 H new ATOM 0 HH12 ARG A 680 10.972 -12.888 -1.590 1.00 0.00 H new ATOM 0 HH21 ARG A 680 10.049 -9.837 -3.092 1.00 0.00 H new ATOM 0 HH22 ARG A 680 10.302 -11.569 -3.332 1.00 0.00 H new ATOM 356 N GLN A 681 7.711 -12.665 2.224 1.00 0.00 N ATOM 357 CA GLN A 681 7.560 -14.076 1.861 1.00 0.00 C ATOM 358 C GLN A 681 6.090 -14.505 1.889 1.00 0.00 C ATOM 359 O GLN A 681 5.655 -15.300 1.054 1.00 0.00 O ATOM 360 CB GLN A 681 8.384 -14.966 2.799 1.00 0.00 C ATOM 361 CG GLN A 681 7.927 -14.926 4.253 1.00 0.00 C ATOM 362 CD GLN A 681 9.074 -15.120 5.226 1.00 0.00 C ATOM 363 OE1 GLN A 681 9.683 -14.154 5.683 1.00 0.00 O ATOM 364 NE2 GLN A 681 9.377 -16.374 5.545 1.00 0.00 N ATOM 0 H GLN A 681 8.339 -12.499 3.011 1.00 0.00 H new ATOM 0 HA GLN A 681 7.930 -14.195 0.843 1.00 0.00 H new ATOM 0 HB2 GLN A 681 8.336 -15.995 2.442 1.00 0.00 H new ATOM 0 HB3 GLN A 681 9.429 -14.660 2.749 1.00 0.00 H new ATOM 0 HG2 GLN A 681 7.443 -13.970 4.452 1.00 0.00 H new ATOM 0 HG3 GLN A 681 7.180 -15.702 4.417 1.00 0.00 H new ATOM 0 HE21 GLN A 681 8.845 -17.145 5.142 1.00 0.00 H new ATOM 0 HE22 GLN A 681 10.141 -16.565 6.193 1.00 0.00 H new ATOM 373 N GLN A 682 5.331 -13.977 2.851 1.00 0.00 N ATOM 374 CA GLN A 682 3.918 -14.307 2.984 1.00 0.00 C ATOM 375 C GLN A 682 3.098 -13.620 1.902 1.00 0.00 C ATOM 376 O GLN A 682 2.414 -14.276 1.119 1.00 0.00 O ATOM 377 CB GLN A 682 3.402 -13.872 4.353 1.00 0.00 C ATOM 378 CG GLN A 682 2.581 -14.938 5.060 1.00 0.00 C ATOM 379 CD GLN A 682 1.248 -15.191 4.382 1.00 0.00 C ATOM 380 OE1 GLN A 682 0.455 -14.269 4.187 1.00 0.00 O ATOM 381 NE2 GLN A 682 0.989 -16.444 4.019 1.00 0.00 N ATOM 0 H GLN A 682 5.676 -13.318 3.549 1.00 0.00 H new ATOM 0 HA GLN A 682 3.814 -15.387 2.878 1.00 0.00 H new ATOM 0 HB2 GLN A 682 4.250 -13.601 4.982 1.00 0.00 H new ATOM 0 HB3 GLN A 682 2.793 -12.975 4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 682 3.150 -15.867 5.093 1.00 0.00 H new ATOM 0 HG3 GLN A 682 2.408 -14.633 6.092 1.00 0.00 H new ATOM 0 HE21 GLN A 682 1.673 -17.179 4.199 1.00 0.00 H new ATOM 0 HE22 GLN A 682 0.106 -16.670 3.561 1.00 0.00 H new ATOM 390 N THR A 683 3.171 -12.291 1.877 1.00 0.00 N ATOM 391 CA THR A 683 2.438 -11.489 0.898 1.00 0.00 C ATOM 392 C THR A 683 2.682 -12.002 -0.522 1.00 0.00 C ATOM 393 O THR A 683 1.753 -12.080 -1.329 1.00 0.00 O ATOM 394 CB THR A 683 2.850 -10.016 1.004 1.00 0.00 C ATOM 395 OG1 THR A 683 2.587 -9.512 2.304 1.00 0.00 O ATOM 396 CG2 THR A 683 2.146 -9.111 0.010 1.00 0.00 C ATOM 0 H THR A 683 3.734 -11.743 2.528 1.00 0.00 H new ATOM 0 HA THR A 683 1.374 -11.577 1.116 1.00 0.00 H new ATOM 0 HB THR A 683 3.917 -10.005 0.781 1.00 0.00 H new ATOM 0 HG1 THR A 683 3.371 -9.653 2.874 1.00 0.00 H new ATOM 0 HG21 THR A 683 2.489 -8.085 0.146 1.00 0.00 H new ATOM 0 HG22 THR A 683 2.373 -9.438 -1.005 1.00 0.00 H new ATOM 0 HG23 THR A 683 1.069 -9.158 0.174 1.00 0.00 H new ATOM 404 N ASP A 684 3.935 -12.359 -0.819 1.00 0.00 N ATOM 405 CA ASP A 684 4.297 -12.872 -2.139 1.00 0.00 C ATOM 406 C ASP A 684 3.515 -14.143 -2.459 1.00 0.00 C ATOM 407 O ASP A 684 2.937 -14.272 -3.540 1.00 0.00 O ATOM 408 CB ASP A 684 5.800 -13.162 -2.217 1.00 0.00 C ATOM 409 CG ASP A 684 6.336 -13.059 -3.633 1.00 0.00 C ATOM 410 OD1 ASP A 684 5.848 -13.803 -4.509 1.00 0.00 O ATOM 411 OD2 ASP A 684 7.243 -12.232 -3.865 1.00 0.00 O ATOM 0 H ASP A 684 4.713 -12.301 -0.162 1.00 0.00 H new ATOM 0 HA ASP A 684 4.045 -12.106 -2.872 1.00 0.00 H new ATOM 0 HB2 ASP A 684 6.336 -12.462 -1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 684 5.995 -14.162 -1.829 1.00 0.00 H new ATOM 416 N ASN A 685 3.506 -15.081 -1.511 1.00 0.00 N ATOM 417 CA ASN A 685 2.802 -16.351 -1.685 1.00 0.00 C ATOM 418 C ASN A 685 1.284 -16.164 -1.617 1.00 0.00 C ATOM 419 O ASN A 685 0.538 -16.828 -2.336 1.00 0.00 O ATOM 420 CB ASN A 685 3.254 -17.362 -0.626 1.00 0.00 C ATOM 421 CG ASN A 685 4.702 -17.785 -0.801 1.00 0.00 C ATOM 422 OD1 ASN A 685 5.216 -17.843 -1.919 1.00 0.00 O ATOM 423 ND2 ASN A 685 5.371 -18.087 0.308 1.00 0.00 N ATOM 0 H ASN A 685 3.980 -14.984 -0.613 1.00 0.00 H new ATOM 0 HA ASN A 685 3.051 -16.734 -2.675 1.00 0.00 H new ATOM 0 HB2 ASN A 685 3.124 -16.927 0.365 1.00 0.00 H new ATOM 0 HB3 ASN A 685 2.614 -18.243 -0.674 1.00 0.00 H new ATOM 0 HD21 ASN A 685 6.347 -18.379 0.251 1.00 0.00 H new ATOM 0 HD22 ASN A 685 4.909 -18.026 1.215 1.00 0.00 H new ATOM 430 N LEU A 686 0.836 -15.257 -0.751 1.00 0.00 N ATOM 431 CA LEU A 686 -0.592 -14.983 -0.595 1.00 0.00 C ATOM 432 C LEU A 686 -1.175 -14.395 -1.880 1.00 0.00 C ATOM 433 O LEU A 686 -2.245 -14.808 -2.330 1.00 0.00 O ATOM 434 CB LEU A 686 -0.829 -14.025 0.578 1.00 0.00 C ATOM 435 CG LEU A 686 -2.294 -13.854 0.996 1.00 0.00 C ATOM 436 CD1 LEU A 686 -2.405 -13.685 2.504 1.00 0.00 C ATOM 437 CD2 LEU A 686 -2.923 -12.670 0.275 1.00 0.00 C ATOM 0 H LEU A 686 1.440 -14.700 -0.147 1.00 0.00 H new ATOM 0 HA LEU A 686 -1.097 -15.926 -0.386 1.00 0.00 H new ATOM 0 HB2 LEU A 686 -0.262 -14.382 1.438 1.00 0.00 H new ATOM 0 HB3 LEU A 686 -0.427 -13.047 0.314 1.00 0.00 H new ATOM 0 HG LEU A 686 -2.838 -14.755 0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 686 -3.452 -13.565 2.781 1.00 0.00 H new ATOM 0 HD12 LEU A 686 -1.997 -14.566 3.000 1.00 0.00 H new ATOM 0 HD13 LEU A 686 -1.845 -12.803 2.813 1.00 0.00 H new ATOM 0 HD21 LEU A 686 -3.963 -12.566 0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 686 -2.377 -11.760 0.524 1.00 0.00 H new ATOM 0 HD23 LEU A 686 -2.881 -12.835 -0.802 1.00 0.00 H new ATOM 449 N LEU A 687 -0.460 -13.436 -2.466 1.00 0.00 N ATOM 450 CA LEU A 687 -0.901 -12.794 -3.704 1.00 0.00 C ATOM 451 C LEU A 687 -0.816 -13.756 -4.894 1.00 0.00 C ATOM 452 O LEU A 687 -1.509 -13.568 -5.896 1.00 0.00 O ATOM 453 CB LEU A 687 -0.063 -11.543 -3.987 1.00 0.00 C ATOM 454 CG LEU A 687 -0.326 -10.353 -3.059 1.00 0.00 C ATOM 455 CD1 LEU A 687 0.725 -9.271 -3.273 1.00 0.00 C ATOM 456 CD2 LEU A 687 -1.726 -9.795 -3.287 1.00 0.00 C ATOM 0 H LEU A 687 0.427 -13.086 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 687 -1.944 -12.505 -3.572 1.00 0.00 H new ATOM 0 HB2 LEU A 687 0.992 -11.810 -3.918 1.00 0.00 H new ATOM 0 HB3 LEU A 687 -0.246 -11.228 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 687 -0.260 -10.698 -2.027 1.00 0.00 H new ATOM 0 HD11 LEU A 687 0.525 -8.432 -2.607 1.00 0.00 H new ATOM 0 HD12 LEU A 687 1.714 -9.677 -3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 687 0.690 -8.929 -4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 687 -1.894 -8.950 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU A 687 -1.822 -9.464 -4.321 1.00 0.00 H new ATOM 0 HD23 LEU A 687 -2.464 -10.571 -3.084 1.00 0.00 H new ATOM 468 N LYS A 688 0.031 -14.785 -4.783 1.00 0.00 N ATOM 469 CA LYS A 688 0.190 -15.767 -5.858 1.00 0.00 C ATOM 470 C LYS A 688 -1.149 -16.412 -6.215 1.00 0.00 C ATOM 471 O LYS A 688 -1.495 -16.522 -7.392 1.00 0.00 O ATOM 472 CB LYS A 688 1.193 -16.853 -5.456 1.00 0.00 C ATOM 473 CG LYS A 688 2.550 -16.716 -6.131 1.00 0.00 C ATOM 474 CD LYS A 688 3.509 -17.809 -5.681 1.00 0.00 C ATOM 475 CE LYS A 688 4.306 -18.368 -6.850 1.00 0.00 C ATOM 476 NZ LYS A 688 3.915 -19.770 -7.175 1.00 0.00 N ATOM 0 H LYS A 688 0.614 -14.958 -3.964 1.00 0.00 H new ATOM 0 HA LYS A 688 0.568 -15.239 -6.733 1.00 0.00 H new ATOM 0 HB2 LYS A 688 1.331 -16.825 -4.375 1.00 0.00 H new ATOM 0 HB3 LYS A 688 0.774 -17.829 -5.699 1.00 0.00 H new ATOM 0 HG2 LYS A 688 2.426 -16.762 -7.213 1.00 0.00 H new ATOM 0 HG3 LYS A 688 2.975 -15.739 -5.900 1.00 0.00 H new ATOM 0 HD2 LYS A 688 4.192 -17.409 -4.932 1.00 0.00 H new ATOM 0 HD3 LYS A 688 2.948 -18.613 -5.204 1.00 0.00 H new ATOM 0 HE2 LYS A 688 4.155 -17.737 -7.726 1.00 0.00 H new ATOM 0 HE3 LYS A 688 5.369 -18.334 -6.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 688 4.482 -20.112 -7.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 688 4.083 -20.378 -6.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 688 2.906 -19.800 -7.427 1.00 0.00 H new ATOM 490 N SER A 689 -1.898 -16.834 -5.194 1.00 0.00 N ATOM 491 CA SER A 689 -3.203 -17.465 -5.404 1.00 0.00 C ATOM 492 C SER A 689 -4.182 -16.490 -6.063 1.00 0.00 C ATOM 493 O SER A 689 -5.013 -16.893 -6.877 1.00 0.00 O ATOM 494 CB SER A 689 -3.778 -17.962 -4.072 1.00 0.00 C ATOM 495 OG SER A 689 -3.367 -19.291 -3.800 1.00 0.00 O ATOM 0 H SER A 689 -1.624 -16.750 -4.215 1.00 0.00 H new ATOM 0 HA SER A 689 -3.062 -18.316 -6.070 1.00 0.00 H new ATOM 0 HB2 SER A 689 -3.453 -17.306 -3.265 1.00 0.00 H new ATOM 0 HB3 SER A 689 -4.867 -17.914 -4.102 1.00 0.00 H new ATOM 0 HG SER A 689 -3.746 -19.582 -2.945 1.00 0.00 H new ATOM 501 N HIS A 690 -4.074 -15.210 -5.706 1.00 0.00 N ATOM 502 CA HIS A 690 -4.944 -14.178 -6.266 1.00 0.00 C ATOM 503 C HIS A 690 -4.562 -13.869 -7.715 1.00 0.00 C ATOM 504 O HIS A 690 -3.563 -14.379 -8.227 1.00 0.00 O ATOM 505 CB HIS A 690 -4.867 -12.903 -5.421 1.00 0.00 C ATOM 506 CG HIS A 690 -5.576 -13.002 -4.104 1.00 0.00 C ATOM 507 ND1 HIS A 690 -6.949 -13.021 -3.986 1.00 0.00 N ATOM 508 CD2 HIS A 690 -5.093 -13.073 -2.840 1.00 0.00 C ATOM 509 CE1 HIS A 690 -7.279 -13.095 -2.710 1.00 0.00 C ATOM 510 NE2 HIS A 690 -6.171 -13.127 -1.992 1.00 0.00 N ATOM 0 H HIS A 690 -3.392 -14.864 -5.031 1.00 0.00 H new ATOM 0 HA HIS A 690 -5.967 -14.553 -6.252 1.00 0.00 H new ATOM 0 HB2 HIS A 690 -3.820 -12.661 -5.241 1.00 0.00 H new ATOM 0 HB3 HIS A 690 -5.292 -12.076 -5.990 1.00 0.00 H new ATOM 0 HD2 HIS A 690 -4.052 -13.085 -2.553 1.00 0.00 H new ATOM 0 HE1 HIS A 690 -8.285 -13.124 -2.319 1.00 0.00 H new ATOM 0 HE2 HIS A 690 -6.124 -13.183 -0.975 1.00 0.00 H new ATOM 519 N ALA A 691 -5.365 -13.032 -8.373 1.00 0.00 N ATOM 520 CA ALA A 691 -5.112 -12.656 -9.763 1.00 0.00 C ATOM 521 C ALA A 691 -4.513 -11.252 -9.856 1.00 0.00 C ATOM 522 O ALA A 691 -4.149 -10.653 -8.844 1.00 0.00 O ATOM 523 CB ALA A 691 -6.400 -12.736 -10.568 1.00 0.00 C ATOM 0 H ALA A 691 -6.195 -12.602 -7.965 1.00 0.00 H new ATOM 0 HA ALA A 691 -4.388 -13.357 -10.179 1.00 0.00 H new ATOM 0 HB1 ALA A 691 -6.201 -12.454 -11.602 1.00 0.00 H new ATOM 0 HB2 ALA A 691 -6.785 -13.755 -10.538 1.00 0.00 H new ATOM 0 HB3 ALA A 691 -7.138 -12.056 -10.142 1.00 0.00 H new ATOM 529 N SER A 692 -4.416 -10.728 -11.080 1.00 0.00 N ATOM 530 CA SER A 692 -3.869 -9.390 -11.299 1.00 0.00 C ATOM 531 C SER A 692 -4.859 -8.324 -10.842 1.00 0.00 C ATOM 532 O SER A 692 -5.999 -8.283 -11.311 1.00 0.00 O ATOM 533 CB SER A 692 -3.532 -9.179 -12.778 1.00 0.00 C ATOM 534 OG SER A 692 -2.264 -8.566 -12.927 1.00 0.00 O ATOM 0 H SER A 692 -4.708 -11.209 -11.931 1.00 0.00 H new ATOM 0 HA SER A 692 -2.955 -9.301 -10.712 1.00 0.00 H new ATOM 0 HB2 SER A 692 -3.540 -10.138 -13.297 1.00 0.00 H new ATOM 0 HB3 SER A 692 -4.297 -8.558 -13.244 1.00 0.00 H new ATOM 0 HG SER A 692 -2.070 -8.443 -13.880 1.00 0.00 H new ATOM 540 N GLY A 693 -4.420 -7.463 -9.925 1.00 0.00 N ATOM 541 CA GLY A 693 -5.283 -6.406 -9.419 1.00 0.00 C ATOM 542 C GLY A 693 -5.476 -6.454 -7.909 1.00 0.00 C ATOM 543 O GLY A 693 -6.161 -5.595 -7.344 1.00 0.00 O ATOM 0 H GLY A 693 -3.483 -7.478 -9.523 1.00 0.00 H new ATOM 0 HA2 GLY A 693 -4.860 -5.439 -9.693 1.00 0.00 H new ATOM 0 HA3 GLY A 693 -6.256 -6.478 -9.905 1.00 0.00 H new ATOM 547 N THR A 694 -4.878 -7.450 -7.248 1.00 0.00 N ATOM 548 CA THR A 694 -5.000 -7.585 -5.800 1.00 0.00 C ATOM 549 C THR A 694 -4.061 -6.612 -5.087 1.00 0.00 C ATOM 550 O THR A 694 -2.868 -6.554 -5.392 1.00 0.00 O ATOM 551 CB THR A 694 -4.692 -9.022 -5.362 1.00 0.00 C ATOM 552 OG1 THR A 694 -5.049 -9.952 -6.371 1.00 0.00 O ATOM 553 CG2 THR A 694 -5.410 -9.425 -4.096 1.00 0.00 C ATOM 0 H THR A 694 -4.308 -8.169 -7.693 1.00 0.00 H new ATOM 0 HA THR A 694 -6.028 -7.347 -5.525 1.00 0.00 H new ATOM 0 HB THR A 694 -3.618 -9.039 -5.178 1.00 0.00 H new ATOM 0 HG1 THR A 694 -4.348 -9.977 -7.055 1.00 0.00 H new ATOM 0 HG21 THR A 694 -5.149 -10.452 -3.841 1.00 0.00 H new ATOM 0 HG22 THR A 694 -5.113 -8.763 -3.283 1.00 0.00 H new ATOM 0 HG23 THR A 694 -6.487 -9.352 -4.249 1.00 0.00 H new ATOM 561 N TYR A 695 -4.611 -5.849 -4.140 1.00 0.00 N ATOM 562 CA TYR A 695 -3.829 -4.872 -3.384 1.00 0.00 C ATOM 563 C TYR A 695 -3.920 -5.130 -1.878 1.00 0.00 C ATOM 564 O TYR A 695 -4.867 -5.757 -1.404 1.00 0.00 O ATOM 565 CB TYR A 695 -4.305 -3.451 -3.706 1.00 0.00 C ATOM 566 CG TYR A 695 -5.691 -3.129 -3.180 1.00 0.00 C ATOM 567 CD1 TYR A 695 -6.829 -3.582 -3.835 1.00 0.00 C ATOM 568 CD2 TYR A 695 -5.855 -2.369 -2.028 1.00 0.00 C ATOM 569 CE1 TYR A 695 -8.092 -3.287 -3.356 1.00 0.00 C ATOM 570 CE2 TYR A 695 -7.115 -2.071 -1.544 1.00 0.00 C ATOM 571 CZ TYR A 695 -8.229 -2.532 -2.211 1.00 0.00 C ATOM 572 OH TYR A 695 -9.485 -2.235 -1.731 1.00 0.00 O ATOM 0 H TYR A 695 -5.596 -5.890 -3.879 1.00 0.00 H new ATOM 0 HA TYR A 695 -2.785 -4.976 -3.680 1.00 0.00 H new ATOM 0 HB2 TYR A 695 -3.595 -2.738 -3.288 1.00 0.00 H new ATOM 0 HB3 TYR A 695 -4.297 -3.313 -4.787 1.00 0.00 H new ATOM 0 HD1 TYR A 695 -6.726 -4.174 -4.732 1.00 0.00 H new ATOM 0 HD2 TYR A 695 -4.984 -2.006 -1.503 1.00 0.00 H new ATOM 0 HE1 TYR A 695 -8.967 -3.647 -3.877 1.00 0.00 H new ATOM 0 HE2 TYR A 695 -7.226 -1.480 -0.647 1.00 0.00 H new ATOM 0 HH TYR A 695 -9.442 -2.103 -0.761 1.00 0.00 H new ATOM 582 N LEU A 696 -2.928 -4.636 -1.132 1.00 0.00 N ATOM 583 CA LEU A 696 -2.893 -4.806 0.321 1.00 0.00 C ATOM 584 C LEU A 696 -1.823 -3.920 0.960 1.00 0.00 C ATOM 585 O LEU A 696 -0.849 -3.537 0.307 1.00 0.00 O ATOM 586 CB LEU A 696 -2.637 -6.276 0.682 1.00 0.00 C ATOM 587 CG LEU A 696 -1.229 -6.793 0.362 1.00 0.00 C ATOM 588 CD1 LEU A 696 -0.332 -6.706 1.589 1.00 0.00 C ATOM 589 CD2 LEU A 696 -1.294 -8.225 -0.153 1.00 0.00 C ATOM 0 H LEU A 696 -2.138 -4.115 -1.512 1.00 0.00 H new ATOM 0 HA LEU A 696 -3.864 -4.504 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 696 -2.822 -6.409 1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 696 -3.362 -6.895 0.153 1.00 0.00 H new ATOM 0 HG LEU A 696 -0.801 -6.164 -0.418 1.00 0.00 H new ATOM 0 HD11 LEU A 696 0.662 -7.078 1.340 1.00 0.00 H new ATOM 0 HD12 LEU A 696 -0.260 -5.668 1.914 1.00 0.00 H new ATOM 0 HD13 LEU A 696 -0.755 -7.310 2.392 1.00 0.00 H new ATOM 0 HD21 LEU A 696 -0.287 -8.578 -0.376 1.00 0.00 H new ATOM 0 HD22 LEU A 696 -1.743 -8.865 0.607 1.00 0.00 H new ATOM 0 HD23 LEU A 696 -1.899 -8.259 -1.059 1.00 0.00 H new ATOM 601 N ILE A 697 -2.010 -3.603 2.243 1.00 0.00 N ATOM 602 CA ILE A 697 -1.063 -2.766 2.981 1.00 0.00 C ATOM 603 C ILE A 697 -0.708 -3.398 4.328 1.00 0.00 C ATOM 604 O ILE A 697 -1.587 -3.871 5.050 1.00 0.00 O ATOM 605 CB ILE A 697 -1.627 -1.347 3.228 1.00 0.00 C ATOM 606 CG1 ILE A 697 -2.216 -0.765 1.937 1.00 0.00 C ATOM 607 CG2 ILE A 697 -0.540 -0.430 3.780 1.00 0.00 C ATOM 608 CD1 ILE A 697 -2.990 0.519 2.146 1.00 0.00 C ATOM 0 H ILE A 697 -2.811 -3.914 2.793 1.00 0.00 H new ATOM 0 HA ILE A 697 -0.167 -2.688 2.365 1.00 0.00 H new ATOM 0 HB ILE A 697 -2.426 -1.420 3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 697 -1.407 -0.580 1.230 1.00 0.00 H new ATOM 0 HG13 ILE A 697 -2.874 -1.506 1.482 1.00 0.00 H new ATOM 0 HG21 ILE A 697 -0.954 0.564 3.948 1.00 0.00 H new ATOM 0 HG22 ILE A 697 -0.168 -0.832 4.722 1.00 0.00 H new ATOM 0 HG23 ILE A 697 0.280 -0.366 3.064 1.00 0.00 H new ATOM 0 HD11 ILE A 697 -3.376 0.871 1.189 1.00 0.00 H new ATOM 0 HD12 ILE A 697 -3.821 0.336 2.828 1.00 0.00 H new ATOM 0 HD13 ILE A 697 -2.331 1.276 2.572 1.00 0.00 H new ATOM 620 N ARG A 698 0.585 -3.401 4.656 1.00 0.00 N ATOM 621 CA ARG A 698 1.064 -3.973 5.916 1.00 0.00 C ATOM 622 C ARG A 698 1.634 -2.890 6.833 1.00 0.00 C ATOM 623 O ARG A 698 1.859 -1.753 6.407 1.00 0.00 O ATOM 624 CB ARG A 698 2.140 -5.030 5.647 1.00 0.00 C ATOM 625 CG ARG A 698 1.671 -6.180 4.770 1.00 0.00 C ATOM 626 CD ARG A 698 2.607 -6.403 3.590 1.00 0.00 C ATOM 627 NE ARG A 698 4.002 -6.562 4.010 1.00 0.00 N ATOM 628 CZ ARG A 698 4.953 -7.100 3.244 1.00 0.00 C ATOM 629 NH1 ARG A 698 4.666 -7.553 2.029 1.00 0.00 N ATOM 630 NH2 ARG A 698 6.199 -7.183 3.695 1.00 0.00 N ATOM 0 H ARG A 698 1.321 -3.013 4.066 1.00 0.00 H new ATOM 0 HA ARG A 698 0.213 -4.438 6.413 1.00 0.00 H new ATOM 0 HB2 ARG A 698 2.996 -4.550 5.172 1.00 0.00 H new ATOM 0 HB3 ARG A 698 2.487 -5.431 6.599 1.00 0.00 H new ATOM 0 HG2 ARG A 698 1.611 -7.091 5.365 1.00 0.00 H new ATOM 0 HG3 ARG A 698 0.666 -5.972 4.404 1.00 0.00 H new ATOM 0 HD2 ARG A 698 2.292 -7.290 3.041 1.00 0.00 H new ATOM 0 HD3 ARG A 698 2.530 -5.560 2.904 1.00 0.00 H new ATOM 0 HE ARG A 698 4.261 -6.242 4.943 1.00 0.00 H new ATOM 0 HH11 ARG A 698 3.712 -7.491 1.674 1.00 0.00 H new ATOM 0 HH12 ARG A 698 5.400 -7.963 1.451 1.00 0.00 H new ATOM 0 HH21 ARG A 698 6.429 -6.836 4.626 1.00 0.00 H new ATOM 0 HH22 ARG A 698 6.927 -7.594 3.110 1.00 0.00 H new ATOM 644 N GLU A 699 1.874 -3.254 8.094 1.00 0.00 N ATOM 645 CA GLU A 699 2.424 -2.325 9.078 1.00 0.00 C ATOM 646 C GLU A 699 3.890 -2.645 9.370 1.00 0.00 C ATOM 647 O GLU A 699 4.259 -3.811 9.530 1.00 0.00 O ATOM 648 CB GLU A 699 1.607 -2.376 10.374 1.00 0.00 C ATOM 649 CG GLU A 699 1.931 -1.253 11.349 1.00 0.00 C ATOM 650 CD GLU A 699 0.798 -0.966 12.317 1.00 0.00 C ATOM 651 OE1 GLU A 699 0.532 -1.817 13.192 1.00 0.00 O ATOM 652 OE2 GLU A 699 0.179 0.114 12.201 1.00 0.00 O ATOM 0 H GLU A 699 1.695 -4.190 8.457 1.00 0.00 H new ATOM 0 HA GLU A 699 2.367 -1.319 8.662 1.00 0.00 H new ATOM 0 HB2 GLU A 699 0.546 -2.334 10.126 1.00 0.00 H new ATOM 0 HB3 GLU A 699 1.782 -3.333 10.865 1.00 0.00 H new ATOM 0 HG2 GLU A 699 2.826 -1.515 11.913 1.00 0.00 H new ATOM 0 HG3 GLU A 699 2.161 -0.347 10.788 1.00 0.00 H new ATOM 659 N ARG A 700 4.719 -1.603 9.440 1.00 0.00 N ATOM 660 CA ARG A 700 6.147 -1.762 9.714 1.00 0.00 C ATOM 661 C ARG A 700 6.652 -0.648 10.638 1.00 0.00 C ATOM 662 O ARG A 700 6.863 0.483 10.196 1.00 0.00 O ATOM 663 CB ARG A 700 6.948 -1.753 8.406 1.00 0.00 C ATOM 664 CG ARG A 700 6.798 -3.022 7.579 1.00 0.00 C ATOM 665 CD ARG A 700 8.029 -3.908 7.681 1.00 0.00 C ATOM 666 NE ARG A 700 9.229 -3.249 7.160 1.00 0.00 N ATOM 667 CZ ARG A 700 10.474 -3.656 7.419 1.00 0.00 C ATOM 668 NH1 ARG A 700 10.689 -4.737 8.164 1.00 0.00 N ATOM 669 NH2 ARG A 700 11.508 -2.988 6.922 1.00 0.00 N ATOM 0 H ARG A 700 4.424 -0.635 9.310 1.00 0.00 H new ATOM 0 HA ARG A 700 6.289 -2.721 10.212 1.00 0.00 H new ATOM 0 HB2 ARG A 700 6.632 -0.900 7.805 1.00 0.00 H new ATOM 0 HB3 ARG A 700 8.003 -1.606 8.639 1.00 0.00 H new ATOM 0 HG2 ARG A 700 5.922 -3.576 7.917 1.00 0.00 H new ATOM 0 HG3 ARG A 700 6.625 -2.758 6.536 1.00 0.00 H new ATOM 0 HD2 ARG A 700 8.191 -4.183 8.723 1.00 0.00 H new ATOM 0 HD3 ARG A 700 7.856 -4.833 7.130 1.00 0.00 H new ATOM 0 HE ARG A 700 9.106 -2.430 6.564 1.00 0.00 H new ATOM 0 HH11 ARG A 700 9.900 -5.261 8.542 1.00 0.00 H new ATOM 0 HH12 ARG A 700 11.643 -5.042 8.357 1.00 0.00 H new ATOM 0 HH21 ARG A 700 11.351 -2.164 6.342 1.00 0.00 H new ATOM 0 HH22 ARG A 700 12.459 -3.299 7.120 1.00 0.00 H new ATOM 683 N PRO A 701 6.848 -0.948 11.937 1.00 0.00 N ATOM 684 CA PRO A 701 7.325 0.040 12.917 1.00 0.00 C ATOM 685 C PRO A 701 8.783 0.440 12.688 1.00 0.00 C ATOM 686 O PRO A 701 9.695 -0.370 12.877 1.00 0.00 O ATOM 687 CB PRO A 701 7.172 -0.681 14.258 1.00 0.00 C ATOM 688 CG PRO A 701 7.224 -2.132 13.919 1.00 0.00 C ATOM 689 CD PRO A 701 6.616 -2.268 12.552 1.00 0.00 C ATOM 0 HA PRO A 701 6.765 0.973 12.853 1.00 0.00 H new ATOM 0 HB2 PRO A 701 7.970 -0.407 14.948 1.00 0.00 H new ATOM 0 HB3 PRO A 701 6.230 -0.421 14.741 1.00 0.00 H new ATOM 0 HG2 PRO A 701 8.251 -2.496 13.926 1.00 0.00 H new ATOM 0 HG3 PRO A 701 6.672 -2.722 14.650 1.00 0.00 H new ATOM 0 HD2 PRO A 701 7.090 -3.066 11.980 1.00 0.00 H new ATOM 0 HD3 PRO A 701 5.553 -2.503 12.607 1.00 0.00 H new ATOM 697 N ALA A 702 9.000 1.694 12.284 1.00 0.00 N ATOM 698 CA ALA A 702 10.347 2.205 12.028 1.00 0.00 C ATOM 699 C ALA A 702 10.348 3.726 11.857 1.00 0.00 C ATOM 700 O ALA A 702 9.290 4.354 11.795 1.00 0.00 O ATOM 701 CB ALA A 702 10.941 1.538 10.795 1.00 0.00 C ATOM 0 H ALA A 702 8.257 2.375 12.127 1.00 0.00 H new ATOM 0 HA ALA A 702 10.962 1.965 12.895 1.00 0.00 H new ATOM 0 HB1 ALA A 702 11.943 1.928 10.617 1.00 0.00 H new ATOM 0 HB2 ALA A 702 10.994 0.461 10.954 1.00 0.00 H new ATOM 0 HB3 ALA A 702 10.312 1.747 9.930 1.00 0.00 H new ATOM 707 N GLU A 703 11.548 4.310 11.768 1.00 0.00 N ATOM 708 CA GLU A 703 11.694 5.757 11.589 1.00 0.00 C ATOM 709 C GLU A 703 11.949 6.109 10.118 1.00 0.00 C ATOM 710 O GLU A 703 12.629 7.094 9.815 1.00 0.00 O ATOM 711 CB GLU A 703 12.838 6.291 12.463 1.00 0.00 C ATOM 712 CG GLU A 703 12.387 7.327 13.486 1.00 0.00 C ATOM 713 CD GLU A 703 13.544 7.967 14.240 1.00 0.00 C ATOM 714 OE1 GLU A 703 14.606 8.199 13.623 1.00 0.00 O ATOM 715 OE2 GLU A 703 13.381 8.241 15.447 1.00 0.00 O ATOM 0 H GLU A 703 12.431 3.802 11.817 1.00 0.00 H new ATOM 0 HA GLU A 703 10.761 6.229 11.897 1.00 0.00 H new ATOM 0 HB2 GLU A 703 13.306 5.456 12.985 1.00 0.00 H new ATOM 0 HB3 GLU A 703 13.600 6.733 11.821 1.00 0.00 H new ATOM 0 HG2 GLU A 703 11.817 8.106 12.978 1.00 0.00 H new ATOM 0 HG3 GLU A 703 11.713 6.854 14.200 1.00 0.00 H new ATOM 722 N ALA A 704 11.392 5.307 9.210 1.00 0.00 N ATOM 723 CA ALA A 704 11.552 5.536 7.776 1.00 0.00 C ATOM 724 C ALA A 704 10.259 5.210 7.031 1.00 0.00 C ATOM 725 O ALA A 704 9.728 6.049 6.300 1.00 0.00 O ATOM 726 CB ALA A 704 12.707 4.708 7.228 1.00 0.00 C ATOM 0 H ALA A 704 10.825 4.492 9.444 1.00 0.00 H new ATOM 0 HA ALA A 704 11.780 6.591 7.621 1.00 0.00 H new ATOM 0 HB1 ALA A 704 12.811 4.892 6.159 1.00 0.00 H new ATOM 0 HB2 ALA A 704 13.629 4.989 7.736 1.00 0.00 H new ATOM 0 HB3 ALA A 704 12.508 3.650 7.397 1.00 0.00 H new ATOM 732 N GLU A 705 9.756 3.989 7.226 1.00 0.00 N ATOM 733 CA GLU A 705 8.524 3.549 6.581 1.00 0.00 C ATOM 734 C GLU A 705 7.578 2.920 7.601 1.00 0.00 C ATOM 735 O GLU A 705 7.791 1.788 8.037 1.00 0.00 O ATOM 736 CB GLU A 705 8.833 2.546 5.468 1.00 0.00 C ATOM 737 CG GLU A 705 9.702 3.114 4.355 1.00 0.00 C ATOM 738 CD GLU A 705 10.567 2.060 3.686 1.00 0.00 C ATOM 739 OE1 GLU A 705 10.061 0.951 3.419 1.00 0.00 O ATOM 740 OE2 GLU A 705 11.754 2.350 3.422 1.00 0.00 O ATOM 0 H GLU A 705 10.187 3.288 7.828 1.00 0.00 H new ATOM 0 HA GLU A 705 8.038 4.422 6.145 1.00 0.00 H new ATOM 0 HB2 GLU A 705 9.333 1.680 5.901 1.00 0.00 H new ATOM 0 HB3 GLU A 705 7.895 2.192 5.040 1.00 0.00 H new ATOM 0 HG2 GLU A 705 9.064 3.583 3.606 1.00 0.00 H new ATOM 0 HG3 GLU A 705 10.342 3.896 4.763 1.00 0.00 H new ATOM 747 N ARG A 706 6.536 3.661 7.981 1.00 0.00 N ATOM 748 CA ARG A 706 5.557 3.172 8.954 1.00 0.00 C ATOM 749 C ARG A 706 4.656 2.098 8.341 1.00 0.00 C ATOM 750 O ARG A 706 4.244 1.162 9.028 1.00 0.00 O ATOM 751 CB ARG A 706 4.703 4.326 9.490 1.00 0.00 C ATOM 752 CG ARG A 706 5.491 5.348 10.294 1.00 0.00 C ATOM 753 CD ARG A 706 4.573 6.312 11.030 1.00 0.00 C ATOM 754 NE ARG A 706 4.211 5.823 12.363 1.00 0.00 N ATOM 755 CZ ARG A 706 3.696 6.592 13.326 1.00 0.00 C ATOM 756 NH1 ARG A 706 3.465 7.886 13.110 1.00 0.00 N ATOM 757 NH2 ARG A 706 3.405 6.064 14.509 1.00 0.00 N ATOM 0 H ARG A 706 6.348 4.600 7.631 1.00 0.00 H new ATOM 0 HA ARG A 706 6.109 2.727 9.781 1.00 0.00 H new ATOM 0 HB2 ARG A 706 4.221 4.830 8.652 1.00 0.00 H new ATOM 0 HB3 ARG A 706 3.909 3.918 10.116 1.00 0.00 H new ATOM 0 HG2 ARG A 706 6.129 4.833 11.012 1.00 0.00 H new ATOM 0 HG3 ARG A 706 6.148 5.907 9.628 1.00 0.00 H new ATOM 0 HD2 ARG A 706 5.064 7.281 11.121 1.00 0.00 H new ATOM 0 HD3 ARG A 706 3.667 6.468 10.444 1.00 0.00 H new ATOM 0 HE ARG A 706 4.361 4.835 12.568 1.00 0.00 H new ATOM 0 HH11 ARG A 706 3.682 8.298 12.203 1.00 0.00 H new ATOM 0 HH12 ARG A 706 3.071 8.465 13.852 1.00 0.00 H new ATOM 0 HH21 ARG A 706 3.575 5.073 14.681 1.00 0.00 H new ATOM 0 HH22 ARG A 706 3.012 6.649 15.246 1.00 0.00 H new ATOM 771 N PHE A 707 4.350 2.237 7.050 1.00 0.00 N ATOM 772 CA PHE A 707 3.498 1.276 6.354 1.00 0.00 C ATOM 773 C PHE A 707 4.165 0.778 5.074 1.00 0.00 C ATOM 774 O PHE A 707 5.138 1.367 4.598 1.00 0.00 O ATOM 775 CB PHE A 707 2.141 1.905 6.024 1.00 0.00 C ATOM 776 CG PHE A 707 1.328 2.270 7.236 1.00 0.00 C ATOM 777 CD1 PHE A 707 0.756 1.286 8.029 1.00 0.00 C ATOM 778 CD2 PHE A 707 1.136 3.598 7.579 1.00 0.00 C ATOM 779 CE1 PHE A 707 0.009 1.622 9.142 1.00 0.00 C ATOM 780 CE2 PHE A 707 0.389 3.939 8.692 1.00 0.00 C ATOM 781 CZ PHE A 707 -0.175 2.951 9.474 1.00 0.00 C ATOM 0 H PHE A 707 4.680 3.006 6.467 1.00 0.00 H new ATOM 0 HA PHE A 707 3.344 0.424 7.016 1.00 0.00 H new ATOM 0 HB2 PHE A 707 2.303 2.800 5.424 1.00 0.00 H new ATOM 0 HB3 PHE A 707 1.569 1.209 5.411 1.00 0.00 H new ATOM 0 HD1 PHE A 707 0.896 0.246 7.774 1.00 0.00 H new ATOM 0 HD2 PHE A 707 1.574 4.376 6.971 1.00 0.00 H new ATOM 0 HE1 PHE A 707 -0.431 0.847 9.752 1.00 0.00 H new ATOM 0 HE2 PHE A 707 0.247 4.978 8.949 1.00 0.00 H new ATOM 0 HZ PHE A 707 -0.759 3.216 10.343 1.00 0.00 H new ATOM 791 N ALA A 708 3.632 -0.312 4.521 1.00 0.00 N ATOM 792 CA ALA A 708 4.169 -0.896 3.294 1.00 0.00 C ATOM 793 C ALA A 708 3.050 -1.451 2.412 1.00 0.00 C ATOM 794 O ALA A 708 2.349 -2.387 2.801 1.00 0.00 O ATOM 795 CB ALA A 708 5.175 -1.988 3.628 1.00 0.00 C ATOM 0 H ALA A 708 2.828 -0.808 4.905 1.00 0.00 H new ATOM 0 HA ALA A 708 4.676 -0.109 2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 708 5.568 -2.415 2.705 1.00 0.00 H new ATOM 0 HB2 ALA A 708 5.994 -1.563 4.209 1.00 0.00 H new ATOM 0 HB3 ALA A 708 4.685 -2.769 4.210 1.00 0.00 H new ATOM 801 N ILE A 709 2.885 -0.861 1.229 1.00 0.00 N ATOM 802 CA ILE A 709 1.845 -1.290 0.291 1.00 0.00 C ATOM 803 C ILE A 709 2.372 -2.339 -0.691 1.00 0.00 C ATOM 804 O ILE A 709 3.551 -2.332 -1.049 1.00 0.00 O ATOM 805 CB ILE A 709 1.268 -0.096 -0.502 1.00 0.00 C ATOM 806 CG1 ILE A 709 0.916 1.059 0.443 1.00 0.00 C ATOM 807 CG2 ILE A 709 0.043 -0.529 -1.299 1.00 0.00 C ATOM 808 CD1 ILE A 709 0.546 2.340 -0.275 1.00 0.00 C ATOM 0 H ILE A 709 3.457 -0.085 0.896 1.00 0.00 H new ATOM 0 HA ILE A 709 1.051 -1.734 0.891 1.00 0.00 H new ATOM 0 HB ILE A 709 2.028 0.254 -1.201 1.00 0.00 H new ATOM 0 HG12 ILE A 709 0.084 0.756 1.079 1.00 0.00 H new ATOM 0 HG13 ILE A 709 1.765 1.252 1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 709 -0.351 0.324 -1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 709 0.324 -1.317 -1.998 1.00 0.00 H new ATOM 0 HG23 ILE A 709 -0.721 -0.904 -0.618 1.00 0.00 H new ATOM 0 HD11 ILE A 709 0.309 3.112 0.457 1.00 0.00 H new ATOM 0 HD12 ILE A 709 1.384 2.668 -0.890 1.00 0.00 H new ATOM 0 HD13 ILE A 709 -0.322 2.164 -0.910 1.00 0.00 H new ATOM 820 N SER A 710 1.487 -3.242 -1.117 1.00 0.00 N ATOM 821 CA SER A 710 1.851 -4.305 -2.056 1.00 0.00 C ATOM 822 C SER A 710 0.724 -4.559 -3.062 1.00 0.00 C ATOM 823 O SER A 710 -0.455 -4.492 -2.712 1.00 0.00 O ATOM 824 CB SER A 710 2.165 -5.593 -1.289 1.00 0.00 C ATOM 825 OG SER A 710 3.452 -5.542 -0.694 1.00 0.00 O ATOM 0 H SER A 710 0.510 -3.258 -0.825 1.00 0.00 H new ATOM 0 HA SER A 710 2.736 -3.986 -2.607 1.00 0.00 H new ATOM 0 HB2 SER A 710 1.412 -5.751 -0.517 1.00 0.00 H new ATOM 0 HB3 SER A 710 2.110 -6.445 -1.967 1.00 0.00 H new ATOM 0 HG SER A 710 4.136 -5.673 -1.383 1.00 0.00 H new ATOM 831 N ILE A 711 1.098 -4.855 -4.312 1.00 0.00 N ATOM 832 CA ILE A 711 0.116 -5.122 -5.366 1.00 0.00 C ATOM 833 C ILE A 711 0.642 -6.145 -6.381 1.00 0.00 C ATOM 834 O ILE A 711 1.840 -6.200 -6.662 1.00 0.00 O ATOM 835 CB ILE A 711 -0.288 -3.825 -6.108 1.00 0.00 C ATOM 836 CG1 ILE A 711 -1.436 -4.102 -7.085 1.00 0.00 C ATOM 837 CG2 ILE A 711 0.907 -3.223 -6.835 1.00 0.00 C ATOM 838 CD1 ILE A 711 -2.346 -2.913 -7.308 1.00 0.00 C ATOM 0 H ILE A 711 2.070 -4.915 -4.616 1.00 0.00 H new ATOM 0 HA ILE A 711 -0.764 -5.535 -4.873 1.00 0.00 H new ATOM 0 HB ILE A 711 -0.633 -3.101 -5.370 1.00 0.00 H new ATOM 0 HG12 ILE A 711 -1.019 -4.414 -8.043 1.00 0.00 H new ATOM 0 HG13 ILE A 711 -2.028 -4.936 -6.709 1.00 0.00 H new ATOM 0 HG21 ILE A 711 0.599 -2.313 -7.349 1.00 0.00 H new ATOM 0 HG22 ILE A 711 1.690 -2.986 -6.114 1.00 0.00 H new ATOM 0 HG23 ILE A 711 1.289 -3.939 -7.563 1.00 0.00 H new ATOM 0 HD11 ILE A 711 -3.134 -3.185 -8.010 1.00 0.00 H new ATOM 0 HD12 ILE A 711 -2.793 -2.614 -6.360 1.00 0.00 H new ATOM 0 HD13 ILE A 711 -1.768 -2.083 -7.715 1.00 0.00 H new ATOM 850 N LYS A 712 -0.274 -6.956 -6.921 1.00 0.00 N ATOM 851 CA LYS A 712 0.076 -7.984 -7.903 1.00 0.00 C ATOM 852 C LYS A 712 -0.337 -7.562 -9.316 1.00 0.00 C ATOM 853 O LYS A 712 -1.525 -7.400 -9.601 1.00 0.00 O ATOM 854 CB LYS A 712 -0.598 -9.313 -7.534 1.00 0.00 C ATOM 855 CG LYS A 712 -0.288 -10.452 -8.494 1.00 0.00 C ATOM 856 CD LYS A 712 1.124 -10.983 -8.296 1.00 0.00 C ATOM 857 CE LYS A 712 1.349 -12.276 -9.065 1.00 0.00 C ATOM 858 NZ LYS A 712 0.610 -13.426 -8.464 1.00 0.00 N ATOM 0 H LYS A 712 -1.267 -6.919 -6.692 1.00 0.00 H new ATOM 0 HA LYS A 712 1.158 -8.112 -7.890 1.00 0.00 H new ATOM 0 HB2 LYS A 712 -0.284 -9.601 -6.531 1.00 0.00 H new ATOM 0 HB3 LYS A 712 -1.677 -9.164 -7.500 1.00 0.00 H new ATOM 0 HG2 LYS A 712 -1.005 -11.259 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 712 -0.406 -10.106 -9.521 1.00 0.00 H new ATOM 0 HD2 LYS A 712 1.844 -10.234 -8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 712 1.303 -11.154 -7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 712 1.030 -12.142 -10.099 1.00 0.00 H new ATOM 0 HE3 LYS A 712 2.415 -12.503 -9.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 712 1.149 -14.302 -8.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 712 0.489 -13.265 -7.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 712 -0.323 -13.512 -8.914 1.00 0.00 H new ATOM 872 N PHE A 713 0.653 -7.391 -10.195 1.00 0.00 N ATOM 873 CA PHE A 713 0.396 -6.995 -11.580 1.00 0.00 C ATOM 874 C PHE A 713 1.591 -7.324 -12.474 1.00 0.00 C ATOM 875 O PHE A 713 2.717 -7.450 -11.993 1.00 0.00 O ATOM 876 CB PHE A 713 0.081 -5.498 -11.657 1.00 0.00 C ATOM 877 CG PHE A 713 -0.531 -5.082 -12.966 1.00 0.00 C ATOM 878 CD1 PHE A 713 -1.784 -5.540 -13.336 1.00 0.00 C ATOM 879 CD2 PHE A 713 0.150 -4.234 -13.825 1.00 0.00 C ATOM 880 CE1 PHE A 713 -2.349 -5.161 -14.538 1.00 0.00 C ATOM 881 CE2 PHE A 713 -0.410 -3.852 -15.028 1.00 0.00 C ATOM 882 CZ PHE A 713 -1.661 -4.315 -15.385 1.00 0.00 C ATOM 0 H PHE A 713 1.640 -7.521 -9.972 1.00 0.00 H new ATOM 0 HA PHE A 713 -0.466 -7.558 -11.937 1.00 0.00 H new ATOM 0 HB2 PHE A 713 -0.599 -5.236 -10.847 1.00 0.00 H new ATOM 0 HB3 PHE A 713 0.999 -4.933 -11.498 1.00 0.00 H new ATOM 0 HD1 PHE A 713 -2.326 -6.202 -12.677 1.00 0.00 H new ATOM 0 HD2 PHE A 713 1.128 -3.868 -13.551 1.00 0.00 H new ATOM 0 HE1 PHE A 713 -3.327 -5.526 -14.815 1.00 0.00 H new ATOM 0 HE2 PHE A 713 0.130 -3.191 -15.690 1.00 0.00 H new ATOM 0 HZ PHE A 713 -2.101 -4.016 -16.325 1.00 0.00 H new ATOM 892 N ASN A 714 1.335 -7.469 -13.777 1.00 0.00 N ATOM 893 CA ASN A 714 2.388 -7.792 -14.742 1.00 0.00 C ATOM 894 C ASN A 714 3.053 -9.126 -14.392 1.00 0.00 C ATOM 895 O ASN A 714 4.250 -9.316 -14.623 1.00 0.00 O ATOM 896 CB ASN A 714 3.434 -6.669 -14.789 1.00 0.00 C ATOM 897 CG ASN A 714 3.145 -5.634 -15.863 1.00 0.00 C ATOM 898 OD1 ASN A 714 2.161 -5.736 -16.598 1.00 0.00 O ATOM 899 ND2 ASN A 714 4.004 -4.626 -15.957 1.00 0.00 N ATOM 0 H ASN A 714 0.407 -7.368 -14.188 1.00 0.00 H new ATOM 0 HA ASN A 714 1.932 -7.885 -15.728 1.00 0.00 H new ATOM 0 HB2 ASN A 714 3.473 -6.176 -13.818 1.00 0.00 H new ATOM 0 HB3 ASN A 714 4.418 -7.103 -14.966 1.00 0.00 H new ATOM 0 HD21 ASN A 714 3.862 -3.898 -16.658 1.00 0.00 H new ATOM 0 HD22 ASN A 714 4.806 -4.579 -15.329 1.00 0.00 H new ATOM 906 N ASP A 715 2.261 -10.048 -13.834 1.00 0.00 N ATOM 907 CA ASP A 715 2.754 -11.371 -13.446 1.00 0.00 C ATOM 908 C ASP A 715 3.940 -11.267 -12.477 1.00 0.00 C ATOM 909 O ASP A 715 4.846 -12.101 -12.497 1.00 0.00 O ATOM 910 CB ASP A 715 3.147 -12.172 -14.694 1.00 0.00 C ATOM 911 CG ASP A 715 1.942 -12.733 -15.430 1.00 0.00 C ATOM 912 OD1 ASP A 715 1.048 -11.941 -15.803 1.00 0.00 O ATOM 913 OD2 ASP A 715 1.892 -13.965 -15.634 1.00 0.00 O ATOM 0 H ASP A 715 1.271 -9.899 -13.641 1.00 0.00 H new ATOM 0 HA ASP A 715 1.950 -11.893 -12.927 1.00 0.00 H new ATOM 0 HB2 ASP A 715 3.715 -11.531 -15.369 1.00 0.00 H new ATOM 0 HB3 ASP A 715 3.805 -12.991 -14.404 1.00 0.00 H new ATOM 918 N GLU A 716 3.924 -10.236 -11.623 1.00 0.00 N ATOM 919 CA GLU A 716 4.993 -10.024 -10.646 1.00 0.00 C ATOM 920 C GLU A 716 4.502 -9.169 -9.476 1.00 0.00 C ATOM 921 O GLU A 716 3.767 -8.199 -9.670 1.00 0.00 O ATOM 922 CB GLU A 716 6.200 -9.355 -11.317 1.00 0.00 C ATOM 923 CG GLU A 716 7.534 -10.003 -10.973 1.00 0.00 C ATOM 924 CD GLU A 716 8.686 -9.447 -11.791 1.00 0.00 C ATOM 925 OE1 GLU A 716 8.601 -9.475 -13.037 1.00 0.00 O ATOM 926 OE2 GLU A 716 9.674 -8.982 -11.184 1.00 0.00 O ATOM 0 H GLU A 716 3.182 -9.537 -11.591 1.00 0.00 H new ATOM 0 HA GLU A 716 5.296 -10.996 -10.257 1.00 0.00 H new ATOM 0 HB2 GLU A 716 6.063 -9.381 -12.398 1.00 0.00 H new ATOM 0 HB3 GLU A 716 6.231 -8.305 -11.024 1.00 0.00 H new ATOM 0 HG2 GLU A 716 7.742 -9.855 -9.913 1.00 0.00 H new ATOM 0 HG3 GLU A 716 7.464 -11.078 -11.137 1.00 0.00 H new ATOM 933 N VAL A 717 4.913 -9.532 -8.260 1.00 0.00 N ATOM 934 CA VAL A 717 4.512 -8.791 -7.064 1.00 0.00 C ATOM 935 C VAL A 717 5.391 -7.551 -6.869 1.00 0.00 C ATOM 936 O VAL A 717 6.611 -7.617 -7.029 1.00 0.00 O ATOM 937 CB VAL A 717 4.590 -9.666 -5.791 1.00 0.00 C ATOM 938 CG1 VAL A 717 3.994 -8.927 -4.601 1.00 0.00 C ATOM 939 CG2 VAL A 717 3.885 -11.003 -6.000 1.00 0.00 C ATOM 0 H VAL A 717 5.521 -10.331 -8.078 1.00 0.00 H new ATOM 0 HA VAL A 717 3.476 -8.488 -7.217 1.00 0.00 H new ATOM 0 HB VAL A 717 5.641 -9.869 -5.584 1.00 0.00 H new ATOM 0 HG11 VAL A 717 4.057 -9.556 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 717 4.548 -8.004 -4.431 1.00 0.00 H new ATOM 0 HG13 VAL A 717 2.950 -8.691 -4.805 1.00 0.00 H new ATOM 0 HG21 VAL A 717 3.955 -11.598 -5.089 1.00 0.00 H new ATOM 0 HG22 VAL A 717 2.836 -10.828 -6.239 1.00 0.00 H new ATOM 0 HG23 VAL A 717 4.359 -11.540 -6.822 1.00 0.00 H new ATOM 949 N LYS A 718 4.763 -6.428 -6.521 1.00 0.00 N ATOM 950 CA LYS A 718 5.488 -5.176 -6.302 1.00 0.00 C ATOM 951 C LYS A 718 5.211 -4.610 -4.910 1.00 0.00 C ATOM 952 O LYS A 718 4.225 -4.974 -4.266 1.00 0.00 O ATOM 953 CB LYS A 718 5.116 -4.146 -7.373 1.00 0.00 C ATOM 954 CG LYS A 718 5.762 -4.411 -8.724 1.00 0.00 C ATOM 955 CD LYS A 718 7.272 -4.234 -8.668 1.00 0.00 C ATOM 956 CE LYS A 718 7.996 -5.349 -9.407 1.00 0.00 C ATOM 957 NZ LYS A 718 8.783 -4.836 -10.567 1.00 0.00 N ATOM 0 H LYS A 718 3.754 -6.359 -6.385 1.00 0.00 H new ATOM 0 HA LYS A 718 6.554 -5.393 -6.374 1.00 0.00 H new ATOM 0 HB2 LYS A 718 4.033 -4.135 -7.494 1.00 0.00 H new ATOM 0 HB3 LYS A 718 5.408 -3.154 -7.028 1.00 0.00 H new ATOM 0 HG2 LYS A 718 5.526 -5.425 -9.048 1.00 0.00 H new ATOM 0 HG3 LYS A 718 5.343 -3.733 -9.467 1.00 0.00 H new ATOM 0 HD2 LYS A 718 7.542 -3.273 -9.105 1.00 0.00 H new ATOM 0 HD3 LYS A 718 7.598 -4.215 -7.628 1.00 0.00 H new ATOM 0 HE2 LYS A 718 8.663 -5.867 -8.718 1.00 0.00 H new ATOM 0 HE3 LYS A 718 7.269 -6.082 -9.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 9.260 -5.629 -11.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 8.144 -4.365 -11.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 9.494 -4.156 -10.230 1.00 0.00 H new ATOM 971 N HIS A 719 6.097 -3.722 -4.450 1.00 0.00 N ATOM 972 CA HIS A 719 5.959 -3.107 -3.130 1.00 0.00 C ATOM 973 C HIS A 719 6.171 -1.594 -3.194 1.00 0.00 C ATOM 974 O HIS A 719 7.009 -1.107 -3.953 1.00 0.00 O ATOM 975 CB HIS A 719 6.960 -3.723 -2.148 1.00 0.00 C ATOM 976 CG HIS A 719 6.830 -5.208 -2.014 1.00 0.00 C ATOM 977 ND1 HIS A 719 6.276 -5.820 -0.911 1.00 0.00 N ATOM 978 CD2 HIS A 719 7.177 -6.204 -2.861 1.00 0.00 C ATOM 979 CE1 HIS A 719 6.286 -7.128 -1.085 1.00 0.00 C ATOM 980 NE2 HIS A 719 6.827 -7.389 -2.260 1.00 0.00 N ATOM 0 H HIS A 719 6.917 -3.414 -4.973 1.00 0.00 H new ATOM 0 HA HIS A 719 4.944 -3.298 -2.783 1.00 0.00 H new ATOM 0 HB2 HIS A 719 7.972 -3.483 -2.475 1.00 0.00 H new ATOM 0 HB3 HIS A 719 6.824 -3.265 -1.168 1.00 0.00 H new ATOM 0 HD2 HIS A 719 7.642 -6.089 -3.829 1.00 0.00 H new ATOM 0 HE1 HIS A 719 5.914 -7.861 -0.384 1.00 0.00 H new ATOM 0 HE2 HIS A 719 6.963 -8.319 -2.657 1.00 0.00 H new ATOM 989 N ILE A 720 5.410 -0.859 -2.379 1.00 0.00 N ATOM 990 CA ILE A 720 5.511 0.599 -2.326 1.00 0.00 C ATOM 991 C ILE A 720 5.685 1.079 -0.885 1.00 0.00 C ATOM 992 O ILE A 720 4.760 0.994 -0.074 1.00 0.00 O ATOM 993 CB ILE A 720 4.267 1.281 -2.938 1.00 0.00 C ATOM 994 CG1 ILE A 720 3.947 0.686 -4.314 1.00 0.00 C ATOM 995 CG2 ILE A 720 4.483 2.784 -3.047 1.00 0.00 C ATOM 996 CD1 ILE A 720 2.521 0.930 -4.765 1.00 0.00 C ATOM 0 H ILE A 720 4.715 -1.253 -1.745 1.00 0.00 H new ATOM 0 HA ILE A 720 6.386 0.877 -2.913 1.00 0.00 H new ATOM 0 HB ILE A 720 3.418 1.100 -2.279 1.00 0.00 H new ATOM 0 HG12 ILE A 720 4.630 1.109 -5.051 1.00 0.00 H new ATOM 0 HG13 ILE A 720 4.132 -0.388 -4.288 1.00 0.00 H new ATOM 0 HG21 ILE A 720 3.597 3.248 -3.480 1.00 0.00 H new ATOM 0 HG22 ILE A 720 4.662 3.199 -2.055 1.00 0.00 H new ATOM 0 HG23 ILE A 720 5.345 2.982 -3.684 1.00 0.00 H new ATOM 0 HD11 ILE A 720 2.368 0.481 -5.746 1.00 0.00 H new ATOM 0 HD12 ILE A 720 1.831 0.482 -4.049 1.00 0.00 H new ATOM 0 HD13 ILE A 720 2.337 2.003 -4.824 1.00 0.00 H new ATOM 1008 N LYS A 721 6.884 1.577 -0.573 1.00 0.00 N ATOM 1009 CA LYS A 721 7.192 2.068 0.772 1.00 0.00 C ATOM 1010 C LYS A 721 6.358 3.300 1.121 1.00 0.00 C ATOM 1011 O LYS A 721 6.060 4.127 0.257 1.00 0.00 O ATOM 1012 CB LYS A 721 8.685 2.390 0.893 1.00 0.00 C ATOM 1013 CG LYS A 721 9.144 3.550 0.017 1.00 0.00 C ATOM 1014 CD LYS A 721 10.135 3.095 -1.043 1.00 0.00 C ATOM 1015 CE LYS A 721 11.534 2.929 -0.468 1.00 0.00 C ATOM 1016 NZ LYS A 721 12.590 3.251 -1.469 1.00 0.00 N ATOM 0 H LYS A 721 7.657 1.651 -1.234 1.00 0.00 H new ATOM 0 HA LYS A 721 6.939 1.279 1.480 1.00 0.00 H new ATOM 0 HB2 LYS A 721 8.913 2.622 1.933 1.00 0.00 H new ATOM 0 HB3 LYS A 721 9.260 1.502 0.632 1.00 0.00 H new ATOM 0 HG2 LYS A 721 8.280 4.007 -0.465 1.00 0.00 H new ATOM 0 HG3 LYS A 721 9.604 4.317 0.640 1.00 0.00 H new ATOM 0 HD2 LYS A 721 9.802 2.149 -1.471 1.00 0.00 H new ATOM 0 HD3 LYS A 721 10.159 3.821 -1.855 1.00 0.00 H new ATOM 0 HE2 LYS A 721 11.648 3.577 0.401 1.00 0.00 H new ATOM 0 HE3 LYS A 721 11.664 1.904 -0.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 721 13.528 3.125 -1.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 721 12.498 2.616 -2.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 721 12.483 4.237 -1.782 1.00 0.00 H new ATOM 1030 N VAL A 722 5.980 3.411 2.397 1.00 0.00 N ATOM 1031 CA VAL A 722 5.175 4.534 2.865 1.00 0.00 C ATOM 1032 C VAL A 722 5.980 5.444 3.793 1.00 0.00 C ATOM 1033 O VAL A 722 6.230 5.103 4.951 1.00 0.00 O ATOM 1034 CB VAL A 722 3.908 4.050 3.601 1.00 0.00 C ATOM 1035 CG1 VAL A 722 2.997 5.223 3.931 1.00 0.00 C ATOM 1036 CG2 VAL A 722 3.166 3.011 2.769 1.00 0.00 C ATOM 0 H VAL A 722 6.220 2.735 3.122 1.00 0.00 H new ATOM 0 HA VAL A 722 4.877 5.099 1.982 1.00 0.00 H new ATOM 0 HB VAL A 722 4.215 3.582 4.537 1.00 0.00 H new ATOM 0 HG11 VAL A 722 2.110 4.860 4.450 1.00 0.00 H new ATOM 0 HG12 VAL A 722 3.528 5.928 4.571 1.00 0.00 H new ATOM 0 HG13 VAL A 722 2.699 5.723 3.009 1.00 0.00 H new ATOM 0 HG21 VAL A 722 2.276 2.683 3.306 1.00 0.00 H new ATOM 0 HG22 VAL A 722 2.873 3.450 1.815 1.00 0.00 H new ATOM 0 HG23 VAL A 722 3.817 2.156 2.590 1.00 0.00 H new ATOM 1046 N VAL A 723 6.384 6.603 3.272 1.00 0.00 N ATOM 1047 CA VAL A 723 7.162 7.570 4.043 1.00 0.00 C ATOM 1048 C VAL A 723 6.251 8.579 4.742 1.00 0.00 C ATOM 1049 O VAL A 723 5.367 9.170 4.116 1.00 0.00 O ATOM 1050 CB VAL A 723 8.162 8.333 3.148 1.00 0.00 C ATOM 1051 CG1 VAL A 723 9.097 9.189 3.993 1.00 0.00 C ATOM 1052 CG2 VAL A 723 8.953 7.362 2.282 1.00 0.00 C ATOM 0 H VAL A 723 6.184 6.895 2.315 1.00 0.00 H new ATOM 0 HA VAL A 723 7.715 7.003 4.792 1.00 0.00 H new ATOM 0 HB VAL A 723 7.598 8.995 2.491 1.00 0.00 H new ATOM 0 HG11 VAL A 723 9.793 9.718 3.342 1.00 0.00 H new ATOM 0 HG12 VAL A 723 8.513 9.911 4.563 1.00 0.00 H new ATOM 0 HG13 VAL A 723 9.654 8.551 4.679 1.00 0.00 H new ATOM 0 HG21 VAL A 723 9.653 7.918 1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 723 9.505 6.672 2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 723 8.268 6.800 1.647 1.00 0.00 H new ATOM 1062 N GLU A 724 6.478 8.770 6.041 1.00 0.00 N ATOM 1063 CA GLU A 724 5.690 9.705 6.841 1.00 0.00 C ATOM 1064 C GLU A 724 6.569 10.844 7.367 1.00 0.00 C ATOM 1065 O GLU A 724 7.383 10.642 8.271 1.00 0.00 O ATOM 1066 CB GLU A 724 5.032 8.964 8.010 1.00 0.00 C ATOM 1067 CG GLU A 724 3.584 9.358 8.247 1.00 0.00 C ATOM 1068 CD GLU A 724 3.419 10.294 9.428 1.00 0.00 C ATOM 1069 OE1 GLU A 724 3.749 9.888 10.561 1.00 0.00 O ATOM 1070 OE2 GLU A 724 2.963 11.435 9.219 1.00 0.00 O ATOM 0 H GLU A 724 7.207 8.285 6.564 1.00 0.00 H new ATOM 0 HA GLU A 724 4.915 10.136 6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 724 5.081 7.891 7.822 1.00 0.00 H new ATOM 0 HB3 GLU A 724 5.604 9.155 8.918 1.00 0.00 H new ATOM 0 HG2 GLU A 724 3.191 9.838 7.351 1.00 0.00 H new ATOM 0 HG3 GLU A 724 2.990 8.460 8.415 1.00 0.00 H new ATOM 1077 N LYS A 725 6.409 12.038 6.790 1.00 0.00 N ATOM 1078 CA LYS A 725 7.196 13.201 7.199 1.00 0.00 C ATOM 1079 C LYS A 725 6.325 14.453 7.306 1.00 0.00 C ATOM 1080 O LYS A 725 5.385 14.630 6.528 1.00 0.00 O ATOM 1081 CB LYS A 725 8.332 13.441 6.200 1.00 0.00 C ATOM 1082 CG LYS A 725 9.612 13.961 6.839 1.00 0.00 C ATOM 1083 CD LYS A 725 10.630 12.848 7.040 1.00 0.00 C ATOM 1084 CE LYS A 725 12.037 13.397 7.215 1.00 0.00 C ATOM 1085 NZ LYS A 725 12.733 13.587 5.911 1.00 0.00 N ATOM 0 H LYS A 725 5.743 12.223 6.040 1.00 0.00 H new ATOM 0 HA LYS A 725 7.614 12.995 8.184 1.00 0.00 H new ATOM 0 HB2 LYS A 725 8.549 12.508 5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 725 7.997 14.155 5.447 1.00 0.00 H new ATOM 0 HG2 LYS A 725 10.043 14.740 6.210 1.00 0.00 H new ATOM 0 HG3 LYS A 725 9.379 14.420 7.800 1.00 0.00 H new ATOM 0 HD2 LYS A 725 10.357 12.260 7.916 1.00 0.00 H new ATOM 0 HD3 LYS A 725 10.606 12.174 6.184 1.00 0.00 H new ATOM 0 HE2 LYS A 725 11.990 14.350 7.742 1.00 0.00 H new ATOM 0 HE3 LYS A 725 12.616 12.716 7.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 725 13.688 13.963 6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 725 12.802 12.674 5.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 725 12.195 14.257 5.325 1.00 0.00 H new ATOM 1099 N ASP A 726 6.650 15.320 8.273 1.00 0.00 N ATOM 1100 CA ASP A 726 5.905 16.565 8.493 1.00 0.00 C ATOM 1101 C ASP A 726 4.435 16.280 8.805 1.00 0.00 C ATOM 1102 O ASP A 726 3.549 17.045 8.421 1.00 0.00 O ATOM 1103 CB ASP A 726 6.013 17.478 7.265 1.00 0.00 C ATOM 1104 CG ASP A 726 7.226 18.386 7.319 1.00 0.00 C ATOM 1105 OD1 ASP A 726 8.358 17.861 7.368 1.00 0.00 O ATOM 1106 OD2 ASP A 726 7.044 19.621 7.314 1.00 0.00 O ATOM 0 H ASP A 726 7.428 15.181 8.918 1.00 0.00 H new ATOM 0 HA ASP A 726 6.346 17.071 9.352 1.00 0.00 H new ATOM 0 HB2 ASP A 726 6.062 16.866 6.365 1.00 0.00 H new ATOM 0 HB3 ASP A 726 5.112 18.086 7.188 1.00 0.00 H new ATOM 1111 N ASN A 727 4.186 15.167 9.497 1.00 0.00 N ATOM 1112 CA ASN A 727 2.826 14.766 9.851 1.00 0.00 C ATOM 1113 C ASN A 727 2.004 14.441 8.599 1.00 0.00 C ATOM 1114 O ASN A 727 0.773 14.483 8.626 1.00 0.00 O ATOM 1115 CB ASN A 727 2.140 15.869 10.665 1.00 0.00 C ATOM 1116 CG ASN A 727 1.254 15.310 11.757 1.00 0.00 C ATOM 1117 OD1 ASN A 727 1.736 14.892 12.810 1.00 0.00 O ATOM 1118 ND2 ASN A 727 -0.050 15.301 11.514 1.00 0.00 N ATOM 0 H ASN A 727 4.910 14.527 9.823 1.00 0.00 H new ATOM 0 HA ASN A 727 2.887 13.864 10.460 1.00 0.00 H new ATOM 0 HB2 ASN A 727 2.898 16.514 11.110 1.00 0.00 H new ATOM 0 HB3 ASN A 727 1.543 16.491 9.999 1.00 0.00 H new ATOM 0 HD21 ASN A 727 -0.697 14.938 12.214 1.00 0.00 H new ATOM 0 HD22 ASN A 727 -0.406 15.658 10.627 1.00 0.00 H new ATOM 1125 N TRP A 728 2.696 14.113 7.506 1.00 0.00 N ATOM 1126 CA TRP A 728 2.042 13.777 6.246 1.00 0.00 C ATOM 1127 C TRP A 728 2.508 12.412 5.741 1.00 0.00 C ATOM 1128 O TRP A 728 3.579 11.933 6.117 1.00 0.00 O ATOM 1129 CB TRP A 728 2.329 14.849 5.186 1.00 0.00 C ATOM 1130 CG TRP A 728 1.982 16.247 5.616 1.00 0.00 C ATOM 1131 CD1 TRP A 728 2.792 17.347 5.563 1.00 0.00 C ATOM 1132 CD2 TRP A 728 0.735 16.695 6.160 1.00 0.00 C ATOM 1133 NE1 TRP A 728 2.125 18.449 6.043 1.00 0.00 N ATOM 1134 CE2 TRP A 728 0.861 18.075 6.414 1.00 0.00 C ATOM 1135 CE3 TRP A 728 -0.476 16.065 6.455 1.00 0.00 C ATOM 1136 CZ2 TRP A 728 -0.178 18.831 6.953 1.00 0.00 C ATOM 1137 CZ3 TRP A 728 -1.507 16.817 6.989 1.00 0.00 C ATOM 1138 CH2 TRP A 728 -1.352 18.187 7.229 1.00 0.00 C ATOM 0 H TRP A 728 3.715 14.074 7.472 1.00 0.00 H new ATOM 0 HA TRP A 728 0.968 13.736 6.426 1.00 0.00 H new ATOM 0 HB2 TRP A 728 3.387 14.813 4.925 1.00 0.00 H new ATOM 0 HB3 TRP A 728 1.770 14.609 4.282 1.00 0.00 H new ATOM 0 HD1 TRP A 728 3.808 17.350 5.197 1.00 0.00 H new ATOM 0 HE1 TRP A 728 2.509 19.391 6.112 1.00 0.00 H new ATOM 0 HE3 TRP A 728 -0.605 15.009 6.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 728 -0.060 19.887 7.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 728 -2.447 16.339 7.224 1.00 0.00 H new ATOM 0 HH2 TRP A 728 -2.178 18.748 7.641 1.00 0.00 H new ATOM 1149 N ILE A 729 1.696 11.793 4.881 1.00 0.00 N ATOM 1150 CA ILE A 729 2.018 10.482 4.317 1.00 0.00 C ATOM 1151 C ILE A 729 2.082 10.537 2.790 1.00 0.00 C ATOM 1152 O ILE A 729 1.316 11.264 2.157 1.00 0.00 O ATOM 1153 CB ILE A 729 0.974 9.423 4.747 1.00 0.00 C ATOM 1154 CG1 ILE A 729 1.401 8.024 4.288 1.00 0.00 C ATOM 1155 CG2 ILE A 729 -0.404 9.776 4.200 1.00 0.00 C ATOM 1156 CD1 ILE A 729 0.428 6.932 4.681 1.00 0.00 C ATOM 0 H ILE A 729 0.809 12.180 4.560 1.00 0.00 H new ATOM 0 HA ILE A 729 2.997 10.197 4.702 1.00 0.00 H new ATOM 0 HB ILE A 729 0.917 9.419 5.836 1.00 0.00 H new ATOM 0 HG12 ILE A 729 1.514 8.025 3.204 1.00 0.00 H new ATOM 0 HG13 ILE A 729 2.380 7.796 4.710 1.00 0.00 H new ATOM 0 HG21 ILE A 729 -1.124 9.020 4.513 1.00 0.00 H new ATOM 0 HG22 ILE A 729 -0.710 10.749 4.584 1.00 0.00 H new ATOM 0 HG23 ILE A 729 -0.365 9.812 3.111 1.00 0.00 H new ATOM 0 HD11 ILE A 729 0.796 5.971 4.323 1.00 0.00 H new ATOM 0 HD12 ILE A 729 0.333 6.903 5.766 1.00 0.00 H new ATOM 0 HD13 ILE A 729 -0.546 7.136 4.237 1.00 0.00 H new ATOM 1168 N HIS A 730 2.996 9.763 2.202 1.00 0.00 N ATOM 1169 CA HIS A 730 3.150 9.723 0.744 1.00 0.00 C ATOM 1170 C HIS A 730 4.197 8.694 0.321 1.00 0.00 C ATOM 1171 O HIS A 730 5.205 8.498 1.002 1.00 0.00 O ATOM 1172 CB HIS A 730 3.527 11.105 0.195 1.00 0.00 C ATOM 1173 CG HIS A 730 4.764 11.689 0.806 1.00 0.00 C ATOM 1174 ND1 HIS A 730 6.021 11.520 0.269 1.00 0.00 N ATOM 1175 CD2 HIS A 730 4.932 12.447 1.917 1.00 0.00 C ATOM 1176 CE1 HIS A 730 6.908 12.144 1.020 1.00 0.00 C ATOM 1177 NE2 HIS A 730 6.275 12.715 2.032 1.00 0.00 N ATOM 0 H HIS A 730 3.640 9.156 2.710 1.00 0.00 H new ATOM 0 HA HIS A 730 2.188 9.427 0.326 1.00 0.00 H new ATOM 0 HB2 HIS A 730 3.668 11.030 -0.883 1.00 0.00 H new ATOM 0 HB3 HIS A 730 2.695 11.789 0.361 1.00 0.00 H new ATOM 0 HD1 HIS A 730 6.233 10.994 -0.579 1.00 0.00 H new ATOM 0 HD2 HIS A 730 4.154 12.779 2.588 1.00 0.00 H new ATOM 0 HE1 HIS A 730 7.972 12.182 0.839 1.00 0.00 H new ATOM 1186 N ILE A 731 3.949 8.044 -0.818 1.00 0.00 N ATOM 1187 CA ILE A 731 4.867 7.036 -1.349 1.00 0.00 C ATOM 1188 C ILE A 731 5.825 7.638 -2.380 1.00 0.00 C ATOM 1189 O ILE A 731 6.940 7.145 -2.562 1.00 0.00 O ATOM 1190 CB ILE A 731 4.113 5.852 -1.995 1.00 0.00 C ATOM 1191 CG1 ILE A 731 3.186 6.333 -3.123 1.00 0.00 C ATOM 1192 CG2 ILE A 731 3.326 5.082 -0.942 1.00 0.00 C ATOM 1193 CD1 ILE A 731 3.267 5.487 -4.376 1.00 0.00 C ATOM 0 H ILE A 731 3.119 8.198 -1.390 1.00 0.00 H new ATOM 0 HA ILE A 731 5.439 6.667 -0.498 1.00 0.00 H new ATOM 0 HB ILE A 731 4.852 5.181 -2.434 1.00 0.00 H new ATOM 0 HG12 ILE A 731 2.158 6.334 -2.761 1.00 0.00 H new ATOM 0 HG13 ILE A 731 3.437 7.364 -3.374 1.00 0.00 H new ATOM 0 HG21 ILE A 731 2.801 4.252 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 731 4.010 4.696 -0.187 1.00 0.00 H new ATOM 0 HG23 ILE A 731 2.603 5.747 -0.470 1.00 0.00 H new ATOM 0 HD11 ILE A 731 2.586 5.885 -5.128 1.00 0.00 H new ATOM 0 HD12 ILE A 731 4.286 5.506 -4.762 1.00 0.00 H new ATOM 0 HD13 ILE A 731 2.987 4.460 -4.141 1.00 0.00 H new ATOM 1205 N THR A 732 5.382 8.701 -3.057 1.00 0.00 N ATOM 1206 CA THR A 732 6.194 9.366 -4.072 1.00 0.00 C ATOM 1207 C THR A 732 6.901 10.593 -3.489 1.00 0.00 C ATOM 1208 O THR A 732 6.754 10.895 -2.303 1.00 0.00 O ATOM 1209 CB THR A 732 5.313 9.781 -5.257 1.00 0.00 C ATOM 1210 OG1 THR A 732 4.276 10.655 -4.833 1.00 0.00 O ATOM 1211 CG2 THR A 732 4.658 8.609 -5.962 1.00 0.00 C ATOM 0 H THR A 732 4.462 9.118 -2.918 1.00 0.00 H new ATOM 0 HA THR A 732 6.954 8.665 -4.417 1.00 0.00 H new ATOM 0 HB THR A 732 5.989 10.274 -5.955 1.00 0.00 H new ATOM 0 HG1 THR A 732 3.727 10.909 -5.604 1.00 0.00 H new ATOM 0 HG21 THR A 732 4.050 8.976 -6.789 1.00 0.00 H new ATOM 0 HG22 THR A 732 5.427 7.939 -6.346 1.00 0.00 H new ATOM 0 HG23 THR A 732 4.025 8.069 -5.258 1.00 0.00 H new ATOM 1219 N GLU A 733 7.654 11.298 -4.330 1.00 0.00 N ATOM 1220 CA GLU A 733 8.368 12.497 -3.899 1.00 0.00 C ATOM 1221 C GLU A 733 7.821 13.741 -4.600 1.00 0.00 C ATOM 1222 O GLU A 733 8.577 14.560 -5.127 1.00 0.00 O ATOM 1223 CB GLU A 733 9.869 12.349 -4.166 1.00 0.00 C ATOM 1224 CG GLU A 733 10.534 11.269 -3.325 1.00 0.00 C ATOM 1225 CD GLU A 733 11.675 11.803 -2.480 1.00 0.00 C ATOM 1226 OE1 GLU A 733 11.439 12.741 -1.688 1.00 0.00 O ATOM 1227 OE2 GLU A 733 12.803 11.284 -2.609 1.00 0.00 O ATOM 0 H GLU A 733 7.785 11.060 -5.313 1.00 0.00 H new ATOM 0 HA GLU A 733 8.214 12.617 -2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 733 10.021 12.121 -5.221 1.00 0.00 H new ATOM 0 HB3 GLU A 733 10.360 13.303 -3.972 1.00 0.00 H new ATOM 0 HG2 GLU A 733 9.789 10.811 -2.674 1.00 0.00 H new ATOM 0 HG3 GLU A 733 10.910 10.484 -3.981 1.00 0.00 H new ATOM 1234 N ALA A 734 6.495 13.879 -4.592 1.00 0.00 N ATOM 1235 CA ALA A 734 5.832 15.024 -5.214 1.00 0.00 C ATOM 1236 C ALA A 734 4.470 15.283 -4.569 1.00 0.00 C ATOM 1237 O ALA A 734 4.188 16.396 -4.123 1.00 0.00 O ATOM 1238 CB ALA A 734 5.680 14.807 -6.716 1.00 0.00 C ATOM 0 H ALA A 734 5.858 13.210 -4.160 1.00 0.00 H new ATOM 0 HA ALA A 734 6.456 15.903 -5.054 1.00 0.00 H new ATOM 0 HB1 ALA A 734 5.184 15.670 -7.160 1.00 0.00 H new ATOM 0 HB2 ALA A 734 6.664 14.682 -7.167 1.00 0.00 H new ATOM 0 HB3 ALA A 734 5.082 13.913 -6.896 1.00 0.00 H new ATOM 1244 N LYS A 735 3.634 14.246 -4.524 1.00 0.00 N ATOM 1245 CA LYS A 735 2.303 14.353 -3.932 1.00 0.00 C ATOM 1246 C LYS A 735 2.338 14.046 -2.435 1.00 0.00 C ATOM 1247 O LYS A 735 3.142 13.230 -1.979 1.00 0.00 O ATOM 1248 CB LYS A 735 1.336 13.395 -4.638 1.00 0.00 C ATOM 1249 CG LYS A 735 0.022 14.040 -5.048 1.00 0.00 C ATOM 1250 CD LYS A 735 0.080 14.564 -6.476 1.00 0.00 C ATOM 1251 CE LYS A 735 -1.222 14.310 -7.222 1.00 0.00 C ATOM 1252 NZ LYS A 735 -0.991 13.900 -8.637 1.00 0.00 N ATOM 0 H LYS A 735 3.857 13.321 -4.892 1.00 0.00 H new ATOM 0 HA LYS A 735 1.957 15.378 -4.062 1.00 0.00 H new ATOM 0 HB2 LYS A 735 1.823 12.990 -5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 735 1.126 12.554 -3.978 1.00 0.00 H new ATOM 0 HG2 LYS A 735 -0.785 13.313 -4.959 1.00 0.00 H new ATOM 0 HG3 LYS A 735 -0.210 14.859 -4.368 1.00 0.00 H new ATOM 0 HD2 LYS A 735 0.289 15.634 -6.463 1.00 0.00 H new ATOM 0 HD3 LYS A 735 0.903 14.085 -7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 735 -1.787 13.532 -6.708 1.00 0.00 H new ATOM 0 HE3 LYS A 735 -1.832 15.213 -7.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 -1.905 13.738 -9.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 -0.475 14.652 -9.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 -0.432 13.024 -8.658 1.00 0.00 H new ATOM 1266 N LYS A 736 1.455 14.700 -1.675 1.00 0.00 N ATOM 1267 CA LYS A 736 1.378 14.492 -0.231 1.00 0.00 C ATOM 1268 C LYS A 736 -0.046 14.132 0.194 1.00 0.00 C ATOM 1269 O LYS A 736 -1.016 14.546 -0.444 1.00 0.00 O ATOM 1270 CB LYS A 736 1.849 15.744 0.516 1.00 0.00 C ATOM 1271 CG LYS A 736 2.368 15.458 1.918 1.00 0.00 C ATOM 1272 CD LYS A 736 3.535 16.364 2.283 1.00 0.00 C ATOM 1273 CE LYS A 736 4.801 15.980 1.532 1.00 0.00 C ATOM 1274 NZ LYS A 736 6.019 16.134 2.375 1.00 0.00 N ATOM 0 H LYS A 736 0.785 15.377 -2.038 1.00 0.00 H new ATOM 0 HA LYS A 736 2.034 13.660 0.025 1.00 0.00 H new ATOM 0 HB2 LYS A 736 2.636 16.227 -0.062 1.00 0.00 H new ATOM 0 HB3 LYS A 736 1.022 16.451 0.581 1.00 0.00 H new ATOM 0 HG2 LYS A 736 1.562 15.595 2.639 1.00 0.00 H new ATOM 0 HG3 LYS A 736 2.682 14.416 1.984 1.00 0.00 H new ATOM 0 HD2 LYS A 736 3.277 17.399 2.057 1.00 0.00 H new ATOM 0 HD3 LYS A 736 3.717 16.308 3.356 1.00 0.00 H new ATOM 0 HE2 LYS A 736 4.723 14.947 1.194 1.00 0.00 H new ATOM 0 HE3 LYS A 736 4.896 16.601 0.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 736 6.859 15.862 1.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 736 6.109 17.125 2.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 736 5.941 15.523 3.213 1.00 0.00 H new ATOM 1288 N PHE A 737 -0.163 13.355 1.271 1.00 0.00 N ATOM 1289 CA PHE A 737 -1.467 12.932 1.783 1.00 0.00 C ATOM 1290 C PHE A 737 -1.579 13.192 3.283 1.00 0.00 C ATOM 1291 O PHE A 737 -0.575 13.216 3.997 1.00 0.00 O ATOM 1292 CB PHE A 737 -1.695 11.445 1.494 1.00 0.00 C ATOM 1293 CG PHE A 737 -1.686 11.105 0.030 1.00 0.00 C ATOM 1294 CD1 PHE A 737 -0.503 10.761 -0.610 1.00 0.00 C ATOM 1295 CD2 PHE A 737 -2.858 11.126 -0.708 1.00 0.00 C ATOM 1296 CE1 PHE A 737 -0.493 10.447 -1.956 1.00 0.00 C ATOM 1297 CE2 PHE A 737 -2.854 10.814 -2.052 1.00 0.00 C ATOM 1298 CZ PHE A 737 -1.669 10.473 -2.677 1.00 0.00 C ATOM 0 H PHE A 737 0.631 13.005 1.807 1.00 0.00 H new ATOM 0 HA PHE A 737 -2.233 13.518 1.274 1.00 0.00 H new ATOM 0 HB2 PHE A 737 -0.923 10.864 1.998 1.00 0.00 H new ATOM 0 HB3 PHE A 737 -2.651 11.143 1.922 1.00 0.00 H new ATOM 0 HD1 PHE A 737 0.420 10.738 -0.050 1.00 0.00 H new ATOM 0 HD2 PHE A 737 -3.787 11.390 -0.225 1.00 0.00 H new ATOM 0 HE1 PHE A 737 0.434 10.182 -2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 737 -3.775 10.836 -2.615 1.00 0.00 H new ATOM 0 HZ PHE A 737 -1.664 10.227 -3.729 1.00 0.00 H new ATOM 1308 N ASP A 738 -2.811 13.383 3.755 1.00 0.00 N ATOM 1309 CA ASP A 738 -3.064 13.639 5.172 1.00 0.00 C ATOM 1310 C ASP A 738 -3.076 12.342 5.985 1.00 0.00 C ATOM 1311 O ASP A 738 -2.844 12.362 7.196 1.00 0.00 O ATOM 1312 CB ASP A 738 -4.397 14.373 5.352 1.00 0.00 C ATOM 1313 CG ASP A 738 -4.496 15.624 4.497 1.00 0.00 C ATOM 1314 OD1 ASP A 738 -3.625 16.510 4.635 1.00 0.00 O ATOM 1315 OD2 ASP A 738 -5.444 15.717 3.691 1.00 0.00 O ATOM 0 H ASP A 738 -3.650 13.365 3.175 1.00 0.00 H new ATOM 0 HA ASP A 738 -2.252 14.265 5.542 1.00 0.00 H new ATOM 0 HB2 ASP A 738 -5.215 13.699 5.099 1.00 0.00 H new ATOM 0 HB3 ASP A 738 -4.520 14.644 6.401 1.00 0.00 H new ATOM 1320 N SER A 739 -3.351 11.215 5.321 1.00 0.00 N ATOM 1321 CA SER A 739 -3.394 9.917 5.993 1.00 0.00 C ATOM 1322 C SER A 739 -3.423 8.773 4.980 1.00 0.00 C ATOM 1323 O SER A 739 -3.560 9.002 3.777 1.00 0.00 O ATOM 1324 CB SER A 739 -4.620 9.835 6.912 1.00 0.00 C ATOM 1325 OG SER A 739 -5.824 9.909 6.168 1.00 0.00 O ATOM 0 H SER A 739 -3.547 11.178 4.321 1.00 0.00 H new ATOM 0 HA SER A 739 -2.490 9.819 6.593 1.00 0.00 H new ATOM 0 HB2 SER A 739 -4.594 8.902 7.475 1.00 0.00 H new ATOM 0 HB3 SER A 739 -4.588 10.647 7.639 1.00 0.00 H new ATOM 0 HG SER A 739 -6.589 9.853 6.778 1.00 0.00 H new ATOM 1331 N LEU A 740 -3.293 7.539 5.475 1.00 0.00 N ATOM 1332 CA LEU A 740 -3.310 6.361 4.607 1.00 0.00 C ATOM 1333 C LEU A 740 -4.607 6.301 3.801 1.00 0.00 C ATOM 1334 O LEU A 740 -4.592 5.966 2.618 1.00 0.00 O ATOM 1335 CB LEU A 740 -3.144 5.078 5.433 1.00 0.00 C ATOM 1336 CG LEU A 740 -2.582 3.875 4.665 1.00 0.00 C ATOM 1337 CD1 LEU A 740 -1.077 4.011 4.475 1.00 0.00 C ATOM 1338 CD2 LEU A 740 -2.912 2.576 5.389 1.00 0.00 C ATOM 0 H LEU A 740 -3.176 7.331 6.467 1.00 0.00 H new ATOM 0 HA LEU A 740 -2.473 6.442 3.914 1.00 0.00 H new ATOM 0 HB2 LEU A 740 -2.486 5.290 6.276 1.00 0.00 H new ATOM 0 HB3 LEU A 740 -4.114 4.803 5.847 1.00 0.00 H new ATOM 0 HG LEU A 740 -3.050 3.851 3.681 1.00 0.00 H new ATOM 0 HD11 LEU A 740 -0.700 3.147 3.928 1.00 0.00 H new ATOM 0 HD12 LEU A 740 -0.862 4.919 3.912 1.00 0.00 H new ATOM 0 HD13 LEU A 740 -0.591 4.064 5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 740 -2.505 1.734 4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 740 -2.474 2.594 6.387 1.00 0.00 H new ATOM 0 HD23 LEU A 740 -3.994 2.469 5.470 1.00 0.00 H new ATOM 1350 N LEU A 741 -5.726 6.637 4.453 1.00 0.00 N ATOM 1351 CA LEU A 741 -7.036 6.632 3.796 1.00 0.00 C ATOM 1352 C LEU A 741 -7.015 7.502 2.539 1.00 0.00 C ATOM 1353 O LEU A 741 -7.375 7.042 1.456 1.00 0.00 O ATOM 1354 CB LEU A 741 -8.116 7.135 4.761 1.00 0.00 C ATOM 1355 CG LEU A 741 -9.550 6.723 4.412 1.00 0.00 C ATOM 1356 CD1 LEU A 741 -9.847 5.323 4.932 1.00 0.00 C ATOM 1357 CD2 LEU A 741 -10.547 7.728 4.976 1.00 0.00 C ATOM 0 H LEU A 741 -5.750 6.915 5.434 1.00 0.00 H new ATOM 0 HA LEU A 741 -7.267 5.607 3.505 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -7.884 6.770 5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -8.067 8.223 4.799 1.00 0.00 H new ATOM 0 HG LEU A 741 -9.650 6.713 3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -10.870 5.049 4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -9.156 4.612 4.479 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -9.728 5.304 6.015 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -11.560 7.419 4.718 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -10.446 7.772 6.060 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -10.349 8.713 4.553 1.00 0.00 H new ATOM 1369 N GLU A 742 -6.581 8.755 2.692 1.00 0.00 N ATOM 1370 CA GLU A 742 -6.504 9.686 1.570 1.00 0.00 C ATOM 1371 C GLU A 742 -5.639 9.109 0.445 1.00 0.00 C ATOM 1372 O GLU A 742 -5.982 9.227 -0.734 1.00 0.00 O ATOM 1373 CB GLU A 742 -5.935 11.033 2.033 1.00 0.00 C ATOM 1374 CG GLU A 742 -5.922 12.100 0.948 1.00 0.00 C ATOM 1375 CD GLU A 742 -7.204 12.914 0.893 1.00 0.00 C ATOM 1376 OE1 GLU A 742 -8.294 12.328 1.069 1.00 0.00 O ATOM 1377 OE2 GLU A 742 -7.116 14.140 0.669 1.00 0.00 O ATOM 0 H GLU A 742 -6.278 9.146 3.584 1.00 0.00 H new ATOM 0 HA GLU A 742 -7.512 9.841 1.186 1.00 0.00 H new ATOM 0 HB2 GLU A 742 -6.522 11.394 2.877 1.00 0.00 H new ATOM 0 HB3 GLU A 742 -4.917 10.882 2.394 1.00 0.00 H new ATOM 0 HG2 GLU A 742 -5.080 12.771 1.118 1.00 0.00 H new ATOM 0 HG3 GLU A 742 -5.760 11.624 -0.019 1.00 0.00 H new ATOM 1384 N LEU A 743 -4.525 8.478 0.819 1.00 0.00 N ATOM 1385 CA LEU A 743 -3.616 7.875 -0.156 1.00 0.00 C ATOM 1386 C LEU A 743 -4.287 6.705 -0.873 1.00 0.00 C ATOM 1387 O LEU A 743 -4.278 6.635 -2.103 1.00 0.00 O ATOM 1388 CB LEU A 743 -2.328 7.402 0.531 1.00 0.00 C ATOM 1389 CG LEU A 743 -1.104 7.292 -0.386 1.00 0.00 C ATOM 1390 CD1 LEU A 743 0.173 7.588 0.389 1.00 0.00 C ATOM 1391 CD2 LEU A 743 -1.033 5.911 -1.026 1.00 0.00 C ATOM 0 H LEU A 743 -4.231 8.371 1.790 1.00 0.00 H new ATOM 0 HA LEU A 743 -3.362 8.634 -0.896 1.00 0.00 H new ATOM 0 HB2 LEU A 743 -2.094 8.091 1.343 1.00 0.00 H new ATOM 0 HB3 LEU A 743 -2.513 6.428 0.983 1.00 0.00 H new ATOM 0 HG LEU A 743 -1.204 8.032 -1.180 1.00 0.00 H new ATOM 0 HD11 LEU A 743 1.031 7.505 -0.278 1.00 0.00 H new ATOM 0 HD12 LEU A 743 0.126 8.598 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 743 0.277 6.873 1.205 1.00 0.00 H new ATOM 0 HD21 LEU A 743 -0.157 5.854 -1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 743 -0.959 5.152 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 743 -1.932 5.737 -1.617 1.00 0.00 H new ATOM 1403 N VAL A 744 -4.871 5.791 -0.098 1.00 0.00 N ATOM 1404 CA VAL A 744 -5.549 4.621 -0.660 1.00 0.00 C ATOM 1405 C VAL A 744 -6.718 5.042 -1.553 1.00 0.00 C ATOM 1406 O VAL A 744 -6.930 4.463 -2.618 1.00 0.00 O ATOM 1407 CB VAL A 744 -6.062 3.669 0.447 1.00 0.00 C ATOM 1408 CG1 VAL A 744 -6.651 2.402 -0.161 1.00 0.00 C ATOM 1409 CG2 VAL A 744 -4.947 3.320 1.426 1.00 0.00 C ATOM 0 H VAL A 744 -4.889 5.838 0.921 1.00 0.00 H new ATOM 0 HA VAL A 744 -4.813 4.087 -1.260 1.00 0.00 H new ATOM 0 HB VAL A 744 -6.849 4.187 0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 744 -7.005 1.747 0.635 1.00 0.00 H new ATOM 0 HG12 VAL A 744 -7.484 2.665 -0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 744 -5.885 1.887 -0.741 1.00 0.00 H new ATOM 0 HG21 VAL A 744 -5.334 2.650 2.194 1.00 0.00 H new ATOM 0 HG22 VAL A 744 -4.134 2.829 0.891 1.00 0.00 H new ATOM 0 HG23 VAL A 744 -4.575 4.232 1.894 1.00 0.00 H new ATOM 1419 N GLU A 745 -7.467 6.056 -1.118 1.00 0.00 N ATOM 1420 CA GLU A 745 -8.607 6.553 -1.886 1.00 0.00 C ATOM 1421 C GLU A 745 -8.154 7.149 -3.220 1.00 0.00 C ATOM 1422 O GLU A 745 -8.764 6.895 -4.259 1.00 0.00 O ATOM 1423 CB GLU A 745 -9.380 7.601 -1.080 1.00 0.00 C ATOM 1424 CG GLU A 745 -10.189 7.019 0.068 1.00 0.00 C ATOM 1425 CD GLU A 745 -10.797 8.092 0.948 1.00 0.00 C ATOM 1426 OE1 GLU A 745 -10.046 8.719 1.726 1.00 0.00 O ATOM 1427 OE2 GLU A 745 -12.023 8.310 0.859 1.00 0.00 O ATOM 0 H GLU A 745 -7.304 6.548 -0.239 1.00 0.00 H new ATOM 0 HA GLU A 745 -9.264 5.709 -2.093 1.00 0.00 H new ATOM 0 HB2 GLU A 745 -8.676 8.332 -0.682 1.00 0.00 H new ATOM 0 HB3 GLU A 745 -10.052 8.138 -1.750 1.00 0.00 H new ATOM 0 HG2 GLU A 745 -10.983 6.389 -0.333 1.00 0.00 H new ATOM 0 HG3 GLU A 745 -9.548 6.377 0.672 1.00 0.00 H new ATOM 1434 N TYR A 746 -7.080 7.940 -3.187 1.00 0.00 N ATOM 1435 CA TYR A 746 -6.548 8.569 -4.398 1.00 0.00 C ATOM 1436 C TYR A 746 -6.147 7.515 -5.432 1.00 0.00 C ATOM 1437 O TYR A 746 -6.569 7.579 -6.587 1.00 0.00 O ATOM 1438 CB TYR A 746 -5.338 9.444 -4.058 1.00 0.00 C ATOM 1439 CG TYR A 746 -5.509 10.906 -4.414 1.00 0.00 C ATOM 1440 CD1 TYR A 746 -6.584 11.641 -3.929 1.00 0.00 C ATOM 1441 CD2 TYR A 746 -4.584 11.555 -5.226 1.00 0.00 C ATOM 1442 CE1 TYR A 746 -6.737 12.979 -4.247 1.00 0.00 C ATOM 1443 CE2 TYR A 746 -4.729 12.891 -5.545 1.00 0.00 C ATOM 1444 CZ TYR A 746 -5.804 13.599 -5.054 1.00 0.00 C ATOM 1445 OH TYR A 746 -5.949 14.931 -5.371 1.00 0.00 O ATOM 0 H TYR A 746 -6.562 8.160 -2.336 1.00 0.00 H new ATOM 0 HA TYR A 746 -7.334 9.193 -4.824 1.00 0.00 H new ATOM 0 HB2 TYR A 746 -5.134 9.363 -2.990 1.00 0.00 H new ATOM 0 HB3 TYR A 746 -4.464 9.054 -4.580 1.00 0.00 H new ATOM 0 HD1 TYR A 746 -7.312 11.160 -3.293 1.00 0.00 H new ATOM 0 HD2 TYR A 746 -3.739 11.005 -5.613 1.00 0.00 H new ATOM 0 HE1 TYR A 746 -7.581 13.535 -3.866 1.00 0.00 H new ATOM 0 HE2 TYR A 746 -4.002 13.379 -6.177 1.00 0.00 H new ATOM 0 HH TYR A 746 -5.207 15.213 -5.946 1.00 0.00 H new ATOM 1455 N TYR A 747 -5.328 6.548 -5.009 1.00 0.00 N ATOM 1456 CA TYR A 747 -4.873 5.484 -5.905 1.00 0.00 C ATOM 1457 C TYR A 747 -6.011 4.523 -6.255 1.00 0.00 C ATOM 1458 O TYR A 747 -5.929 3.798 -7.248 1.00 0.00 O ATOM 1459 CB TYR A 747 -3.704 4.718 -5.282 1.00 0.00 C ATOM 1460 CG TYR A 747 -2.375 5.426 -5.435 1.00 0.00 C ATOM 1461 CD1 TYR A 747 -1.575 5.214 -6.553 1.00 0.00 C ATOM 1462 CD2 TYR A 747 -1.920 6.312 -4.464 1.00 0.00 C ATOM 1463 CE1 TYR A 747 -0.363 5.864 -6.697 1.00 0.00 C ATOM 1464 CE2 TYR A 747 -0.709 6.964 -4.602 1.00 0.00 C ATOM 1465 CZ TYR A 747 0.065 6.736 -5.722 1.00 0.00 C ATOM 1466 OH TYR A 747 1.273 7.387 -5.865 1.00 0.00 O ATOM 0 H TYR A 747 -4.969 6.481 -4.057 1.00 0.00 H new ATOM 0 HA TYR A 747 -4.533 5.953 -6.828 1.00 0.00 H new ATOM 0 HB2 TYR A 747 -3.905 4.562 -4.222 1.00 0.00 H new ATOM 0 HB3 TYR A 747 -3.638 3.732 -5.743 1.00 0.00 H new ATOM 0 HD1 TYR A 747 -1.906 4.531 -7.321 1.00 0.00 H new ATOM 0 HD2 TYR A 747 -2.523 6.494 -3.587 1.00 0.00 H new ATOM 0 HE1 TYR A 747 0.246 5.688 -7.572 1.00 0.00 H new ATOM 0 HE2 TYR A 747 -0.370 7.648 -3.838 1.00 0.00 H new ATOM 0 HH TYR A 747 1.426 7.967 -5.090 1.00 0.00 H new ATOM 1476 N GLN A 748 -7.078 4.528 -5.452 1.00 0.00 N ATOM 1477 CA GLN A 748 -8.230 3.666 -5.710 1.00 0.00 C ATOM 1478 C GLN A 748 -8.834 3.985 -7.078 1.00 0.00 C ATOM 1479 O GLN A 748 -9.346 3.098 -7.763 1.00 0.00 O ATOM 1480 CB GLN A 748 -9.292 3.837 -4.617 1.00 0.00 C ATOM 1481 CG GLN A 748 -9.617 2.553 -3.870 1.00 0.00 C ATOM 1482 CD GLN A 748 -9.944 2.791 -2.405 1.00 0.00 C ATOM 1483 OE1 GLN A 748 -10.574 3.787 -2.052 1.00 0.00 O ATOM 1484 NE2 GLN A 748 -9.515 1.872 -1.547 1.00 0.00 N ATOM 0 H GLN A 748 -7.167 5.116 -4.623 1.00 0.00 H new ATOM 0 HA GLN A 748 -7.889 2.631 -5.704 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -8.947 4.585 -3.903 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -10.205 4.225 -5.068 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -10.463 2.062 -4.351 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -8.769 1.871 -3.942 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -8.996 1.062 -1.885 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -9.705 1.977 -0.550 1.00 0.00 H new ATOM 1493 N CYS A 749 -8.768 5.262 -7.471 1.00 0.00 N ATOM 1494 CA CYS A 749 -9.303 5.703 -8.758 1.00 0.00 C ATOM 1495 C CYS A 749 -8.185 5.934 -9.781 1.00 0.00 C ATOM 1496 O CYS A 749 -8.355 5.639 -10.965 1.00 0.00 O ATOM 1497 CB CYS A 749 -10.117 6.989 -8.582 1.00 0.00 C ATOM 1498 SG CYS A 749 -11.850 6.717 -8.142 1.00 0.00 S ATOM 0 H CYS A 749 -8.349 6.006 -6.914 1.00 0.00 H new ATOM 0 HA CYS A 749 -9.951 4.912 -9.135 1.00 0.00 H new ATOM 0 HB2 CYS A 749 -9.649 7.599 -7.809 1.00 0.00 H new ATOM 0 HB3 CYS A 749 -10.075 7.562 -9.508 1.00 0.00 H new ATOM 0 HG CYS A 749 -12.450 7.863 -8.014 1.00 0.00 H new ATOM 1504 N HIS A 750 -7.050 6.471 -9.327 1.00 0.00 N ATOM 1505 CA HIS A 750 -5.921 6.745 -10.221 1.00 0.00 C ATOM 1506 C HIS A 750 -5.032 5.510 -10.390 1.00 0.00 C ATOM 1507 O HIS A 750 -4.708 4.830 -9.416 1.00 0.00 O ATOM 1508 CB HIS A 750 -5.083 7.914 -9.693 1.00 0.00 C ATOM 1509 CG HIS A 750 -5.871 9.165 -9.432 1.00 0.00 C ATOM 1510 ND1 HIS A 750 -5.580 10.034 -8.401 1.00 0.00 N ATOM 1511 CD2 HIS A 750 -6.933 9.700 -10.081 1.00 0.00 C ATOM 1512 CE1 HIS A 750 -6.429 11.045 -8.425 1.00 0.00 C ATOM 1513 NE2 HIS A 750 -7.259 10.867 -9.435 1.00 0.00 N ATOM 0 H HIS A 750 -6.888 6.724 -8.352 1.00 0.00 H new ATOM 0 HA HIS A 750 -6.333 7.011 -11.194 1.00 0.00 H new ATOM 0 HB2 HIS A 750 -4.592 7.607 -8.769 1.00 0.00 H new ATOM 0 HB3 HIS A 750 -4.296 8.137 -10.413 1.00 0.00 H new ATOM 0 HD2 HIS A 750 -7.431 9.286 -10.945 1.00 0.00 H new ATOM 0 HE1 HIS A 750 -6.442 11.876 -7.735 1.00 0.00 H new ATOM 0 HE2 HIS A 750 -8.020 11.495 -9.694 1.00 0.00 H new ATOM 1522 N SER A 751 -4.637 5.235 -11.637 1.00 0.00 N ATOM 1523 CA SER A 751 -3.781 4.087 -11.943 1.00 0.00 C ATOM 1524 C SER A 751 -2.346 4.327 -11.479 1.00 0.00 C ATOM 1525 O SER A 751 -1.862 5.460 -11.485 1.00 0.00 O ATOM 1526 CB SER A 751 -3.793 3.793 -13.448 1.00 0.00 C ATOM 1527 OG SER A 751 -2.964 2.684 -13.760 1.00 0.00 O ATOM 0 H SER A 751 -4.897 5.793 -12.450 1.00 0.00 H new ATOM 0 HA SER A 751 -4.180 3.227 -11.405 1.00 0.00 H new ATOM 0 HB2 SER A 751 -4.813 3.591 -13.774 1.00 0.00 H new ATOM 0 HB3 SER A 751 -3.452 4.671 -13.996 1.00 0.00 H new ATOM 0 HG SER A 751 -3.112 2.417 -14.691 1.00 0.00 H new ATOM 1533 N LEU A 752 -1.667 3.251 -11.084 1.00 0.00 N ATOM 1534 CA LEU A 752 -0.282 3.341 -10.624 1.00 0.00 C ATOM 1535 C LEU A 752 0.651 3.818 -11.741 1.00 0.00 C ATOM 1536 O LEU A 752 1.743 4.319 -11.467 1.00 0.00 O ATOM 1537 CB LEU A 752 0.197 1.988 -10.098 1.00 0.00 C ATOM 1538 CG LEU A 752 -0.258 1.644 -8.679 1.00 0.00 C ATOM 1539 CD1 LEU A 752 0.073 0.195 -8.354 1.00 0.00 C ATOM 1540 CD2 LEU A 752 0.389 2.585 -7.671 1.00 0.00 C ATOM 0 H LEU A 752 -2.053 2.307 -11.073 1.00 0.00 H new ATOM 0 HA LEU A 752 -0.254 4.073 -9.817 1.00 0.00 H new ATOM 0 HB2 LEU A 752 -0.154 1.208 -10.774 1.00 0.00 H new ATOM 0 HB3 LEU A 752 1.286 1.969 -10.128 1.00 0.00 H new ATOM 0 HG LEU A 752 -1.339 1.770 -8.619 1.00 0.00 H new ATOM 0 HD11 LEU A 752 -0.257 -0.035 -7.341 1.00 0.00 H new ATOM 0 HD12 LEU A 752 -0.436 -0.462 -9.059 1.00 0.00 H new ATOM 0 HD13 LEU A 752 1.150 0.042 -8.429 1.00 0.00 H new ATOM 0 HD21 LEU A 752 0.055 2.327 -6.666 1.00 0.00 H new ATOM 0 HD22 LEU A 752 1.473 2.490 -7.729 1.00 0.00 H new ATOM 0 HD23 LEU A 752 0.102 3.612 -7.896 1.00 0.00 H new ATOM 1552 N LYS A 753 0.220 3.656 -12.998 1.00 0.00 N ATOM 1553 CA LYS A 753 1.024 4.071 -14.153 1.00 0.00 C ATOM 1554 C LYS A 753 1.470 5.531 -14.047 1.00 0.00 C ATOM 1555 O LYS A 753 2.517 5.903 -14.572 1.00 0.00 O ATOM 1556 CB LYS A 753 0.243 3.861 -15.453 1.00 0.00 C ATOM 1557 CG LYS A 753 -1.030 4.692 -15.563 1.00 0.00 C ATOM 1558 CD LYS A 753 -1.164 5.339 -16.934 1.00 0.00 C ATOM 1559 CE LYS A 753 -1.616 6.788 -16.829 1.00 0.00 C ATOM 1560 NZ LYS A 753 -1.632 7.466 -18.157 1.00 0.00 N ATOM 0 H LYS A 753 -0.680 3.241 -13.241 1.00 0.00 H new ATOM 0 HA LYS A 753 1.918 3.448 -14.162 1.00 0.00 H new ATOM 0 HB2 LYS A 753 0.892 4.100 -16.295 1.00 0.00 H new ATOM 0 HB3 LYS A 753 -0.017 2.806 -15.540 1.00 0.00 H new ATOM 0 HG2 LYS A 753 -1.896 4.058 -15.374 1.00 0.00 H new ATOM 0 HG3 LYS A 753 -1.027 5.465 -14.795 1.00 0.00 H new ATOM 0 HD2 LYS A 753 -0.207 5.293 -17.454 1.00 0.00 H new ATOM 0 HD3 LYS A 753 -1.880 4.777 -17.534 1.00 0.00 H new ATOM 0 HE2 LYS A 753 -2.613 6.826 -16.391 1.00 0.00 H new ATOM 0 HE3 LYS A 753 -0.951 7.327 -16.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 -1.946 8.451 -18.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 -0.675 7.453 -18.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 -2.286 6.967 -18.793 1.00 0.00 H new ATOM 1574 N GLU A 754 0.665 6.353 -13.369 1.00 0.00 N ATOM 1575 CA GLU A 754 0.976 7.771 -13.199 1.00 0.00 C ATOM 1576 C GLU A 754 2.330 7.958 -12.515 1.00 0.00 C ATOM 1577 O GLU A 754 3.117 8.819 -12.908 1.00 0.00 O ATOM 1578 CB GLU A 754 -0.120 8.464 -12.386 1.00 0.00 C ATOM 1579 CG GLU A 754 -1.496 8.396 -13.037 1.00 0.00 C ATOM 1580 CD GLU A 754 -2.420 9.516 -12.594 1.00 0.00 C ATOM 1581 OE1 GLU A 754 -1.969 10.679 -12.543 1.00 0.00 O ATOM 1582 OE2 GLU A 754 -3.601 9.228 -12.308 1.00 0.00 O ATOM 0 H GLU A 754 -0.207 6.059 -12.929 1.00 0.00 H new ATOM 0 HA GLU A 754 1.025 8.224 -14.189 1.00 0.00 H new ATOM 0 HB2 GLU A 754 -0.172 8.007 -11.398 1.00 0.00 H new ATOM 0 HB3 GLU A 754 0.153 9.509 -12.240 1.00 0.00 H new ATOM 0 HG2 GLU A 754 -1.381 8.435 -14.120 1.00 0.00 H new ATOM 0 HG3 GLU A 754 -1.957 7.437 -12.799 1.00 0.00 H new ATOM 1589 N SER A 755 2.595 7.144 -11.495 1.00 0.00 N ATOM 1590 CA SER A 755 3.857 7.218 -10.764 1.00 0.00 C ATOM 1591 C SER A 755 4.843 6.164 -11.270 1.00 0.00 C ATOM 1592 O SER A 755 6.001 6.473 -11.558 1.00 0.00 O ATOM 1593 CB SER A 755 3.625 7.031 -9.263 1.00 0.00 C ATOM 1594 OG SER A 755 2.555 7.838 -8.799 1.00 0.00 O ATOM 0 H SER A 755 1.953 6.427 -11.157 1.00 0.00 H new ATOM 0 HA SER A 755 4.283 8.207 -10.935 1.00 0.00 H new ATOM 0 HB2 SER A 755 3.409 5.983 -9.055 1.00 0.00 H new ATOM 0 HB3 SER A 755 4.535 7.283 -8.719 1.00 0.00 H new ATOM 0 HG SER A 755 2.289 7.545 -7.902 1.00 0.00 H new ATOM 1600 N PHE A 756 4.374 4.922 -11.374 1.00 0.00 N ATOM 1601 CA PHE A 756 5.209 3.821 -11.843 1.00 0.00 C ATOM 1602 C PHE A 756 4.777 3.378 -13.240 1.00 0.00 C ATOM 1603 O PHE A 756 3.816 2.625 -13.387 1.00 0.00 O ATOM 1604 CB PHE A 756 5.126 2.633 -10.876 1.00 0.00 C ATOM 1605 CG PHE A 756 5.388 2.983 -9.434 1.00 0.00 C ATOM 1606 CD1 PHE A 756 6.590 3.560 -9.050 1.00 0.00 C ATOM 1607 CD2 PHE A 756 4.432 2.727 -8.463 1.00 0.00 C ATOM 1608 CE1 PHE A 756 6.831 3.873 -7.726 1.00 0.00 C ATOM 1609 CE2 PHE A 756 4.669 3.040 -7.138 1.00 0.00 C ATOM 1610 CZ PHE A 756 5.869 3.613 -6.768 1.00 0.00 C ATOM 0 H PHE A 756 3.418 4.654 -11.139 1.00 0.00 H new ATOM 0 HA PHE A 756 6.240 4.172 -11.885 1.00 0.00 H new ATOM 0 HB2 PHE A 756 4.135 2.186 -10.954 1.00 0.00 H new ATOM 0 HB3 PHE A 756 5.844 1.875 -11.189 1.00 0.00 H new ATOM 0 HD1 PHE A 756 7.345 3.767 -9.794 1.00 0.00 H new ATOM 0 HD2 PHE A 756 3.491 2.278 -8.745 1.00 0.00 H new ATOM 0 HE1 PHE A 756 7.771 4.321 -7.440 1.00 0.00 H new ATOM 0 HE2 PHE A 756 3.915 2.836 -6.392 1.00 0.00 H new ATOM 0 HZ PHE A 756 6.056 3.858 -5.733 1.00 0.00 H new ATOM 1620 N LYS A 757 5.491 3.848 -14.264 1.00 0.00 N ATOM 1621 CA LYS A 757 5.171 3.490 -15.648 1.00 0.00 C ATOM 1622 C LYS A 757 5.190 1.970 -15.849 1.00 0.00 C ATOM 1623 O LYS A 757 4.466 1.444 -16.693 1.00 0.00 O ATOM 1624 CB LYS A 757 6.147 4.162 -16.620 1.00 0.00 C ATOM 1625 CG LYS A 757 5.849 5.633 -16.862 1.00 0.00 C ATOM 1626 CD LYS A 757 6.653 6.186 -18.029 1.00 0.00 C ATOM 1627 CE LYS A 757 7.517 7.361 -17.599 1.00 0.00 C ATOM 1628 NZ LYS A 757 8.544 7.709 -18.619 1.00 0.00 N ATOM 0 H LYS A 757 6.290 4.474 -14.163 1.00 0.00 H new ATOM 0 HA LYS A 757 4.163 3.848 -15.857 1.00 0.00 H new ATOM 0 HB2 LYS A 757 7.160 4.065 -16.230 1.00 0.00 H new ATOM 0 HB3 LYS A 757 6.120 3.633 -17.573 1.00 0.00 H new ATOM 0 HG2 LYS A 757 4.785 5.761 -17.060 1.00 0.00 H new ATOM 0 HG3 LYS A 757 6.076 6.203 -15.961 1.00 0.00 H new ATOM 0 HD2 LYS A 757 7.285 5.400 -18.443 1.00 0.00 H new ATOM 0 HD3 LYS A 757 5.976 6.501 -18.823 1.00 0.00 H new ATOM 0 HE2 LYS A 757 6.882 8.228 -17.415 1.00 0.00 H new ATOM 0 HE3 LYS A 757 8.010 7.121 -16.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 757 9.109 8.515 -18.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 757 9.167 6.892 -18.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 757 8.075 7.964 -19.511 1.00 0.00 H new ATOM 1642 N GLN A 758 6.017 1.270 -15.064 1.00 0.00 N ATOM 1643 CA GLN A 758 6.118 -0.189 -15.160 1.00 0.00 C ATOM 1644 C GLN A 758 4.848 -0.883 -14.648 1.00 0.00 C ATOM 1645 O GLN A 758 4.545 -2.004 -15.057 1.00 0.00 O ATOM 1646 CB GLN A 758 7.329 -0.698 -14.369 1.00 0.00 C ATOM 1647 CG GLN A 758 8.671 -0.225 -14.913 1.00 0.00 C ATOM 1648 CD GLN A 758 8.987 -0.797 -16.285 1.00 0.00 C ATOM 1649 OE1 GLN A 758 9.179 -0.055 -17.247 1.00 0.00 O ATOM 1650 NE2 GLN A 758 9.046 -2.120 -16.378 1.00 0.00 N ATOM 0 H GLN A 758 6.623 1.689 -14.359 1.00 0.00 H new ATOM 0 HA GLN A 758 6.241 -0.433 -16.215 1.00 0.00 H new ATOM 0 HB2 GLN A 758 7.235 -0.374 -13.333 1.00 0.00 H new ATOM 0 HB3 GLN A 758 7.315 -1.788 -14.365 1.00 0.00 H new ATOM 0 HG2 GLN A 758 8.671 0.864 -14.970 1.00 0.00 H new ATOM 0 HG3 GLN A 758 9.460 -0.508 -14.216 1.00 0.00 H new ATOM 0 HE21 GLN A 758 8.880 -2.697 -15.554 1.00 0.00 H new ATOM 0 HE22 GLN A 758 9.258 -2.559 -17.274 1.00 0.00 H new ATOM 1659 N LEU A 759 4.115 -0.223 -13.746 1.00 0.00 N ATOM 1660 CA LEU A 759 2.892 -0.796 -13.184 1.00 0.00 C ATOM 1661 C LEU A 759 1.650 -0.027 -13.637 1.00 0.00 C ATOM 1662 O LEU A 759 1.574 1.190 -13.480 1.00 0.00 O ATOM 1663 CB LEU A 759 2.974 -0.802 -11.655 1.00 0.00 C ATOM 1664 CG LEU A 759 2.973 -2.187 -11.004 1.00 0.00 C ATOM 1665 CD1 LEU A 759 4.103 -3.042 -11.561 1.00 0.00 C ATOM 1666 CD2 LEU A 759 3.088 -2.059 -9.492 1.00 0.00 C ATOM 0 H LEU A 759 4.348 0.705 -13.392 1.00 0.00 H new ATOM 0 HA LEU A 759 2.803 -1.819 -13.549 1.00 0.00 H new ATOM 0 HB2 LEU A 759 3.882 -0.278 -11.354 1.00 0.00 H new ATOM 0 HB3 LEU A 759 2.132 -0.233 -11.260 1.00 0.00 H new ATOM 0 HG LEU A 759 2.029 -2.680 -11.237 1.00 0.00 H new ATOM 0 HD11 LEU A 759 4.085 -4.023 -11.086 1.00 0.00 H new ATOM 0 HD12 LEU A 759 3.975 -3.158 -12.637 1.00 0.00 H new ATOM 0 HD13 LEU A 759 5.059 -2.558 -11.359 1.00 0.00 H new ATOM 0 HD21 LEU A 759 3.086 -3.052 -9.042 1.00 0.00 H new ATOM 0 HD22 LEU A 759 4.017 -1.548 -9.240 1.00 0.00 H new ATOM 0 HD23 LEU A 759 2.243 -1.486 -9.110 1.00 0.00 H new ATOM 1678 N ASP A 760 0.676 -0.754 -14.189 1.00 0.00 N ATOM 1679 CA ASP A 760 -0.573 -0.149 -14.661 1.00 0.00 C ATOM 1680 C ASP A 760 -1.786 -0.825 -14.011 1.00 0.00 C ATOM 1681 O ASP A 760 -2.672 -1.332 -14.703 1.00 0.00 O ATOM 1682 CB ASP A 760 -0.671 -0.253 -16.190 1.00 0.00 C ATOM 1683 CG ASP A 760 0.259 0.710 -16.901 1.00 0.00 C ATOM 1684 OD1 ASP A 760 1.487 0.494 -16.852 1.00 0.00 O ATOM 1685 OD2 ASP A 760 -0.241 1.673 -17.514 1.00 0.00 O ATOM 0 H ASP A 760 0.728 -1.764 -14.321 1.00 0.00 H new ATOM 0 HA ASP A 760 -0.570 0.903 -14.376 1.00 0.00 H new ATOM 0 HB2 ASP A 760 -0.436 -1.272 -16.497 1.00 0.00 H new ATOM 0 HB3 ASP A 760 -1.698 -0.056 -16.499 1.00 0.00 H new ATOM 1690 N THR A 761 -1.815 -0.838 -12.677 1.00 0.00 N ATOM 1691 CA THR A 761 -2.913 -1.465 -11.936 1.00 0.00 C ATOM 1692 C THR A 761 -3.455 -0.534 -10.845 1.00 0.00 C ATOM 1693 O THR A 761 -2.836 0.482 -10.515 1.00 0.00 O ATOM 1694 CB THR A 761 -2.437 -2.791 -11.327 1.00 0.00 C ATOM 1695 OG1 THR A 761 -3.439 -3.367 -10.504 1.00 0.00 O ATOM 1696 CG2 THR A 761 -1.179 -2.650 -10.494 1.00 0.00 C ATOM 0 H THR A 761 -1.093 -0.423 -12.088 1.00 0.00 H new ATOM 0 HA THR A 761 -3.728 -1.663 -12.632 1.00 0.00 H new ATOM 0 HB THR A 761 -2.220 -3.433 -12.181 1.00 0.00 H new ATOM 0 HG1 THR A 761 -3.110 -4.211 -10.130 1.00 0.00 H new ATOM 0 HG21 THR A 761 -0.897 -3.624 -10.093 1.00 0.00 H new ATOM 0 HG22 THR A 761 -0.371 -2.266 -11.117 1.00 0.00 H new ATOM 0 HG23 THR A 761 -1.363 -1.958 -9.672 1.00 0.00 H new ATOM 1704 N THR A 762 -4.618 -0.890 -10.293 1.00 0.00 N ATOM 1705 CA THR A 762 -5.257 -0.096 -9.243 1.00 0.00 C ATOM 1706 C THR A 762 -5.824 -0.991 -8.139 1.00 0.00 C ATOM 1707 O THR A 762 -5.824 -2.219 -8.258 1.00 0.00 O ATOM 1708 CB THR A 762 -6.382 0.763 -9.833 1.00 0.00 C ATOM 1709 OG1 THR A 762 -6.882 0.190 -11.027 1.00 0.00 O ATOM 1710 CG2 THR A 762 -5.950 2.181 -10.149 1.00 0.00 C ATOM 0 H THR A 762 -5.137 -1.727 -10.558 1.00 0.00 H new ATOM 0 HA THR A 762 -4.495 0.551 -8.808 1.00 0.00 H new ATOM 0 HB THR A 762 -7.151 0.797 -9.062 1.00 0.00 H new ATOM 0 HG1 THR A 762 -7.600 0.753 -11.385 1.00 0.00 H new ATOM 0 HG21 THR A 762 -6.793 2.734 -10.563 1.00 0.00 H new ATOM 0 HG22 THR A 762 -5.609 2.669 -9.236 1.00 0.00 H new ATOM 0 HG23 THR A 762 -5.137 2.161 -10.875 1.00 0.00 H new ATOM 1718 N LEU A 763 -6.312 -0.364 -7.066 1.00 0.00 N ATOM 1719 CA LEU A 763 -6.893 -1.096 -5.939 1.00 0.00 C ATOM 1720 C LEU A 763 -8.272 -1.645 -6.301 1.00 0.00 C ATOM 1721 O LEU A 763 -9.287 -0.972 -6.112 1.00 0.00 O ATOM 1722 CB LEU A 763 -7.004 -0.189 -4.705 1.00 0.00 C ATOM 1723 CG LEU A 763 -5.775 0.677 -4.403 1.00 0.00 C ATOM 1724 CD1 LEU A 763 -5.988 1.478 -3.126 1.00 0.00 C ATOM 1725 CD2 LEU A 763 -4.526 -0.184 -4.291 1.00 0.00 C ATOM 0 H LEU A 763 -6.316 0.650 -6.954 1.00 0.00 H new ATOM 0 HA LEU A 763 -6.233 -1.932 -5.707 1.00 0.00 H new ATOM 0 HB2 LEU A 763 -7.865 0.467 -4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 763 -7.208 -0.813 -3.835 1.00 0.00 H new ATOM 0 HG LEU A 763 -5.636 1.375 -5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 763 -5.106 2.087 -2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 763 -6.857 2.126 -3.243 1.00 0.00 H new ATOM 0 HD13 LEU A 763 -6.154 0.796 -2.292 1.00 0.00 H new ATOM 0 HD21 LEU A 763 -3.665 0.450 -4.077 1.00 0.00 H new ATOM 0 HD22 LEU A 763 -4.654 -0.907 -3.486 1.00 0.00 H new ATOM 0 HD23 LEU A 763 -4.363 -0.712 -5.230 1.00 0.00 H new ATOM 1737 N LYS A 764 -8.304 -2.870 -6.824 1.00 0.00 N ATOM 1738 CA LYS A 764 -9.559 -3.506 -7.215 1.00 0.00 C ATOM 1739 C LYS A 764 -10.063 -4.455 -6.126 1.00 0.00 C ATOM 1740 O LYS A 764 -11.225 -4.379 -5.722 1.00 0.00 O ATOM 1741 CB LYS A 764 -9.385 -4.263 -8.533 1.00 0.00 C ATOM 1742 CG LYS A 764 -10.173 -3.663 -9.688 1.00 0.00 C ATOM 1743 CD LYS A 764 -9.759 -4.274 -11.021 1.00 0.00 C ATOM 1744 CE LYS A 764 -10.708 -3.877 -12.145 1.00 0.00 C ATOM 1745 NZ LYS A 764 -10.490 -2.474 -12.606 1.00 0.00 N ATOM 0 H LYS A 764 -7.475 -3.441 -6.986 1.00 0.00 H new ATOM 0 HA LYS A 764 -10.303 -2.721 -7.351 1.00 0.00 H new ATOM 0 HB2 LYS A 764 -8.327 -4.280 -8.796 1.00 0.00 H new ATOM 0 HB3 LYS A 764 -9.695 -5.298 -8.391 1.00 0.00 H new ATOM 0 HG2 LYS A 764 -11.239 -3.826 -9.527 1.00 0.00 H new ATOM 0 HG3 LYS A 764 -10.016 -2.585 -9.716 1.00 0.00 H new ATOM 0 HD2 LYS A 764 -8.747 -3.953 -11.269 1.00 0.00 H new ATOM 0 HD3 LYS A 764 -9.736 -5.360 -10.931 1.00 0.00 H new ATOM 0 HE2 LYS A 764 -10.575 -4.558 -12.986 1.00 0.00 H new ATOM 0 HE3 LYS A 764 -11.737 -3.989 -11.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 -11.159 -2.252 -13.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 -10.642 -1.820 -11.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 -9.516 -2.371 -12.957 1.00 0.00 H new ATOM 1759 N TYR A 765 -9.194 -5.355 -5.659 1.00 0.00 N ATOM 1760 CA TYR A 765 -9.578 -6.320 -4.627 1.00 0.00 C ATOM 1761 C TYR A 765 -8.480 -6.494 -3.576 1.00 0.00 C ATOM 1762 O TYR A 765 -7.324 -6.747 -3.919 1.00 0.00 O ATOM 1763 CB TYR A 765 -9.898 -7.677 -5.260 1.00 0.00 C ATOM 1764 CG TYR A 765 -10.756 -7.586 -6.506 1.00 0.00 C ATOM 1765 CD1 TYR A 765 -12.117 -7.313 -6.417 1.00 0.00 C ATOM 1766 CD2 TYR A 765 -10.207 -7.773 -7.768 1.00 0.00 C ATOM 1767 CE1 TYR A 765 -12.903 -7.227 -7.549 1.00 0.00 C ATOM 1768 CE2 TYR A 765 -10.987 -7.690 -8.906 1.00 0.00 C ATOM 1769 CZ TYR A 765 -12.334 -7.418 -8.792 1.00 0.00 C ATOM 1770 OH TYR A 765 -13.112 -7.331 -9.924 1.00 0.00 O ATOM 0 H TYR A 765 -8.228 -5.435 -5.976 1.00 0.00 H new ATOM 0 HA TYR A 765 -10.466 -5.928 -4.131 1.00 0.00 H new ATOM 0 HB2 TYR A 765 -8.964 -8.180 -5.510 1.00 0.00 H new ATOM 0 HB3 TYR A 765 -10.408 -8.299 -4.524 1.00 0.00 H new ATOM 0 HD1 TYR A 765 -12.567 -7.166 -5.446 1.00 0.00 H new ATOM 0 HD2 TYR A 765 -9.153 -7.987 -7.862 1.00 0.00 H new ATOM 0 HE1 TYR A 765 -13.958 -7.011 -7.462 1.00 0.00 H new ATOM 0 HE2 TYR A 765 -10.544 -7.837 -9.880 1.00 0.00 H new ATOM 0 HH TYR A 765 -12.557 -7.490 -10.716 1.00 0.00 H new ATOM 1780 N PRO A 766 -8.830 -6.370 -2.278 1.00 0.00 N ATOM 1781 CA PRO A 766 -7.870 -6.523 -1.174 1.00 0.00 C ATOM 1782 C PRO A 766 -7.307 -7.943 -1.084 1.00 0.00 C ATOM 1783 O PRO A 766 -7.676 -8.818 -1.869 1.00 0.00 O ATOM 1784 CB PRO A 766 -8.696 -6.200 0.084 1.00 0.00 C ATOM 1785 CG PRO A 766 -9.921 -5.510 -0.414 1.00 0.00 C ATOM 1786 CD PRO A 766 -10.185 -6.073 -1.780 1.00 0.00 C ATOM 0 HA PRO A 766 -7.004 -5.875 -1.307 1.00 0.00 H new ATOM 0 HB2 PRO A 766 -8.951 -7.108 0.631 1.00 0.00 H new ATOM 0 HB3 PRO A 766 -8.137 -5.562 0.769 1.00 0.00 H new ATOM 0 HG2 PRO A 766 -10.766 -5.687 0.251 1.00 0.00 H new ATOM 0 HG3 PRO A 766 -9.771 -4.431 -0.459 1.00 0.00 H new ATOM 0 HD2 PRO A 766 -10.805 -6.968 -1.736 1.00 0.00 H new ATOM 0 HD3 PRO A 766 -10.703 -5.358 -2.419 1.00 0.00 H new ATOM 1794 N TYR A 767 -6.412 -8.165 -0.118 1.00 0.00 N ATOM 1795 CA TYR A 767 -5.798 -9.482 0.074 1.00 0.00 C ATOM 1796 C TYR A 767 -6.816 -10.509 0.580 1.00 0.00 C ATOM 1797 O TYR A 767 -6.702 -11.699 0.279 1.00 0.00 O ATOM 1798 CB TYR A 767 -4.607 -9.387 1.039 1.00 0.00 C ATOM 1799 CG TYR A 767 -4.987 -9.257 2.499 1.00 0.00 C ATOM 1800 CD1 TYR A 767 -5.268 -8.016 3.056 1.00 0.00 C ATOM 1801 CD2 TYR A 767 -5.052 -10.376 3.320 1.00 0.00 C ATOM 1802 CE1 TYR A 767 -5.604 -7.893 4.389 1.00 0.00 C ATOM 1803 CE2 TYR A 767 -5.387 -10.260 4.656 1.00 0.00 C ATOM 1804 CZ TYR A 767 -5.664 -9.015 5.184 1.00 0.00 C ATOM 1805 OH TYR A 767 -5.995 -8.897 6.513 1.00 0.00 O ATOM 0 H TYR A 767 -6.097 -7.453 0.541 1.00 0.00 H new ATOM 0 HA TYR A 767 -5.437 -9.822 -0.897 1.00 0.00 H new ATOM 0 HB2 TYR A 767 -3.986 -10.274 0.917 1.00 0.00 H new ATOM 0 HB3 TYR A 767 -3.996 -8.529 0.758 1.00 0.00 H new ATOM 0 HD1 TYR A 767 -5.223 -7.133 2.436 1.00 0.00 H new ATOM 0 HD2 TYR A 767 -4.838 -11.351 2.908 1.00 0.00 H new ATOM 0 HE1 TYR A 767 -5.819 -6.920 4.807 1.00 0.00 H new ATOM 0 HE2 TYR A 767 -5.432 -11.138 5.283 1.00 0.00 H new ATOM 0 HH TYR A 767 -5.781 -7.993 6.824 1.00 0.00 H new ATOM 1815 N LYS A 768 -7.808 -10.051 1.347 1.00 0.00 N ATOM 1816 CA LYS A 768 -8.836 -10.944 1.881 1.00 0.00 C ATOM 1817 C LYS A 768 -9.968 -11.145 0.873 1.00 0.00 C ATOM 1818 O LYS A 768 -10.485 -12.252 0.724 1.00 0.00 O ATOM 1819 CB LYS A 768 -9.403 -10.391 3.193 1.00 0.00 C ATOM 1820 CG LYS A 768 -8.521 -10.650 4.405 1.00 0.00 C ATOM 1821 CD LYS A 768 -9.328 -11.181 5.581 1.00 0.00 C ATOM 1822 CE LYS A 768 -8.965 -10.478 6.884 1.00 0.00 C ATOM 1823 NZ LYS A 768 -9.373 -9.042 6.887 1.00 0.00 N ATOM 0 H LYS A 768 -7.920 -9.072 1.611 1.00 0.00 H new ATOM 0 HA LYS A 768 -8.368 -11.909 2.074 1.00 0.00 H new ATOM 0 HB2 LYS A 768 -9.553 -9.316 3.088 1.00 0.00 H new ATOM 0 HB3 LYS A 768 -10.383 -10.834 3.369 1.00 0.00 H new ATOM 0 HG2 LYS A 768 -7.743 -11.367 4.143 1.00 0.00 H new ATOM 0 HG3 LYS A 768 -8.019 -9.727 4.695 1.00 0.00 H new ATOM 0 HD2 LYS A 768 -10.391 -11.048 5.381 1.00 0.00 H new ATOM 0 HD3 LYS A 768 -9.155 -12.252 5.686 1.00 0.00 H new ATOM 0 HE2 LYS A 768 -9.445 -10.991 7.717 1.00 0.00 H new ATOM 0 HE3 LYS A 768 -7.889 -10.548 7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 768 -9.408 -8.693 7.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 768 -8.683 -8.484 6.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 768 -10.313 -8.947 6.451 1.00 0.00 H new ATOM 1975 N GLU B1409 9.358 -0.299 -5.109 1.00 0.00 N ATOM 1976 CA GLU B1409 9.271 0.268 -6.458 1.00 0.00 C ATOM 1977 C GLU B1409 9.689 1.739 -6.470 1.00 0.00 C ATOM 1978 O GLU B1409 9.546 2.445 -5.469 1.00 0.00 O ATOM 1979 CB GLU B1409 7.844 0.128 -7.004 1.00 0.00 C ATOM 1980 CG GLU B1409 7.637 -1.098 -7.881 1.00 0.00 C ATOM 1981 CD GLU B1409 8.322 -0.982 -9.230 1.00 0.00 C ATOM 1982 OE1 GLU B1409 7.688 -0.468 -10.176 1.00 0.00 O ATOM 1983 OE2 GLU B1409 9.488 -1.415 -9.346 1.00 0.00 O ATOM 0 HA GLU B1409 9.957 -0.288 -7.097 1.00 0.00 H new ATOM 0 HB2 GLU B1409 7.148 0.085 -6.167 1.00 0.00 H new ATOM 0 HB3 GLU B1409 7.596 1.020 -7.579 1.00 0.00 H new ATOM 0 HG2 GLU B1409 8.016 -1.978 -7.361 1.00 0.00 H new ATOM 0 HG3 GLU B1409 6.569 -1.253 -8.034 1.00 0.00 H new ATOM 1990 N GLU B1410 10.203 2.196 -7.616 1.00 0.00 N ATOM 1991 CA GLU B1410 10.641 3.584 -7.768 1.00 0.00 C ATOM 1992 C GLU B1410 9.925 4.256 -8.939 1.00 0.00 C ATOM 1993 O GLU B1410 9.737 3.650 -9.995 1.00 0.00 O ATOM 1994 CB GLU B1410 12.159 3.645 -7.976 1.00 0.00 C ATOM 1995 CG GLU B1410 12.895 4.412 -6.886 1.00 0.00 C ATOM 1996 CD GLU B1410 14.274 3.848 -6.595 1.00 0.00 C ATOM 1997 OE1 GLU B1410 14.358 2.684 -6.148 1.00 0.00 O ATOM 1998 OE2 GLU B1410 15.270 4.570 -6.813 1.00 0.00 O ATOM 0 H GLU B1410 10.325 1.624 -8.451 1.00 0.00 H new ATOM 0 HA GLU B1410 10.387 4.121 -6.854 1.00 0.00 H new ATOM 0 HB2 GLU B1410 12.552 2.629 -8.022 1.00 0.00 H new ATOM 0 HB3 GLU B1410 12.367 4.111 -8.939 1.00 0.00 H new ATOM 0 HG2 GLU B1410 12.991 5.456 -7.185 1.00 0.00 H new ATOM 0 HG3 GLU B1410 12.301 4.395 -5.972 1.00 0.00 H new ATOM 2005 N VAL B1411 9.521 5.512 -8.736 1.00 0.00 N ATOM 2006 CA VAL B1411 8.815 6.273 -9.769 1.00 0.00 C ATOM 2007 C VAL B1411 9.734 6.631 -10.935 1.00 0.00 C ATOM 2008 O VAL B1411 10.937 6.833 -10.752 1.00 0.00 O ATOM 2009 CB VAL B1411 8.189 7.568 -9.199 1.00 0.00 C ATOM 2010 CG1 VAL B1411 7.109 7.236 -8.180 1.00 0.00 C ATOM 2011 CG2 VAL B1411 9.257 8.470 -8.586 1.00 0.00 C ATOM 0 H VAL B1411 9.671 6.023 -7.866 1.00 0.00 H new ATOM 0 HA VAL B1411 8.018 5.625 -10.133 1.00 0.00 H new ATOM 0 HB VAL B1411 7.727 8.112 -10.023 1.00 0.00 H new ATOM 0 HG11 VAL B1411 6.680 8.159 -7.790 1.00 0.00 H new ATOM 0 HG12 VAL B1411 6.327 6.646 -8.658 1.00 0.00 H new ATOM 0 HG13 VAL B1411 7.545 6.664 -7.361 1.00 0.00 H new ATOM 0 HG21 VAL B1411 8.789 9.373 -8.193 1.00 0.00 H new ATOM 0 HG22 VAL B1411 9.760 7.940 -7.777 1.00 0.00 H new ATOM 0 HG23 VAL B1411 9.986 8.742 -9.350 1.00 0.00 H new ATOM 2021 N GLY B1412 9.155 6.710 -12.134 1.00 0.00 N ATOM 2022 CA GLY B1412 9.929 7.045 -13.321 1.00 0.00 C ATOM 2023 C GLY B1412 9.387 8.258 -14.056 1.00 0.00 C ATOM 2024 O GLY B1412 8.857 9.173 -13.391 1.00 0.00 O ATOM 2025 OXT GLY B1412 9.500 8.297 -15.300 1.00 0.00 O ATOM 0 H GLY B1412 8.162 6.548 -12.304 1.00 0.00 H new ATOM 0 HA2 GLY B1412 10.963 7.233 -13.033 1.00 0.00 H new ATOM 0 HA3 GLY B1412 9.937 6.190 -13.997 1.00 0.00 H new