USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 789 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 710 SER OG : rot 24:sc= -0.607 USER MOD Set 1.2: A 719 HIS :FLIP no HE2:sc= -0.175 F(o=-2!,f=-0.78) USER MOD Set 2.1: A 695 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 748 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Set 3.1: A 692 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 712 LYS NZ :NH3+ 169:sc= -0.276 (180deg=-0.605) USER MOD Set 4.1: A 681 GLN :FLIP amide:sc= -0.155 F(o=-0.81,f=-0.15) USER MOD Set 4.2: A 685 ASN : amide:sc= 0 K(o=-0.15,f=-1.2) USER MOD Set 5.1: A 678 MET CE :methyl 161:sc= -0.0761 (180deg=-1.13) USER MOD Set 5.2: A 767 TYR OH : rot 180:sc= -0.278 USER MOD Single : A 668 TYR OH : rot 180:sc= -0.479 USER MOD Single : A 669 THR OG1 : rot 180:sc= -0.0284 USER MOD Single : A 671 TYR OH : rot 180:sc= 0 USER MOD Single : A 677 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 682 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 683 THR OG1 : rot 73:sc= 0.696 USER MOD Single : A 688 LYS NZ :NH3+ -173:sc=-0.00145 (180deg=-0.0849) USER MOD Single : A 689 SER OG : rot 180:sc= 0 USER MOD Single : A 690 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-1.1) USER MOD Single : A 694 THR OG1 : rot 76:sc= 0.155 USER MOD Single : A 714 ASN :FLIP amide:sc= 0.585 F(o=0,f=0.59) USER MOD Single : A 718 LYS NZ :NH3+ -175:sc= -6.06! (180deg=-6.22!) USER MOD Single : A 721 LYS NZ :NH3+ -139:sc= 0.7 (180deg=-0.12) USER MOD Single : A 725 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 727 ASN : amide:sc= -0.0147 K(o=-0.015,f=-0.79) USER MOD Single : A 730 HIS :FLIP no HE2:sc= -0.0154 F(o=-0.53,f=-0.015) USER MOD Single : A 732 THR OG1 : rot 180:sc= 0.0681 USER MOD Single : A 735 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 736 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 747 TYR OH : rot 180:sc= 0 USER MOD Single : A 749 CYS SG : rot 180:sc= 0 USER MOD Single : A 750 HIS : no HD1:sc= -0.377 X(o=-0.38,f=-0.12) USER MOD Single : A 751 SER OG : rot 180:sc= 0 USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 SER OG : rot 180:sc= 0 USER MOD Single : A 757 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 758 GLN : amide:sc= -0.215 K(o=-0.22,f=-6.3!) USER MOD Single : A 761 THR OG1 : rot 180:sc= -0.868 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 133 N ASP A 667 -0.450 13.841 0.460 1.00 0.00 N ATOM 134 CA ASP A 667 -1.644 13.740 -0.363 1.00 0.00 C ATOM 135 C ASP A 667 -1.624 12.447 -1.177 1.00 0.00 C ATOM 136 O ASP A 667 -1.489 12.475 -2.402 1.00 0.00 O ATOM 137 CB ASP A 667 -1.761 14.946 -1.299 1.00 0.00 C ATOM 138 CG ASP A 667 -2.526 16.097 -0.675 1.00 0.00 C ATOM 139 OD1 ASP A 667 -3.606 15.849 -0.095 1.00 0.00 O ATOM 140 OD2 ASP A 667 -2.050 17.247 -0.771 1.00 0.00 O ATOM 0 HA ASP A 667 -2.511 13.727 0.298 1.00 0.00 H new ATOM 0 HB2 ASP A 667 -0.763 15.285 -1.575 1.00 0.00 H new ATOM 0 HB3 ASP A 667 -2.259 14.640 -2.219 1.00 0.00 H new ATOM 145 N TYR A 668 -1.768 11.312 -0.490 1.00 0.00 N ATOM 146 CA TYR A 668 -1.774 10.015 -1.166 1.00 0.00 C ATOM 147 C TYR A 668 -2.919 9.940 -2.182 1.00 0.00 C ATOM 148 O TYR A 668 -2.876 9.137 -3.116 1.00 0.00 O ATOM 149 CB TYR A 668 -1.899 8.871 -0.153 1.00 0.00 C ATOM 150 CG TYR A 668 -0.861 8.900 0.952 1.00 0.00 C ATOM 151 CD1 TYR A 668 0.470 9.216 0.690 1.00 0.00 C ATOM 152 CD2 TYR A 668 -1.216 8.605 2.261 1.00 0.00 C ATOM 153 CE1 TYR A 668 1.413 9.236 1.702 1.00 0.00 C ATOM 154 CE2 TYR A 668 -0.281 8.623 3.277 1.00 0.00 C ATOM 155 CZ TYR A 668 1.031 8.938 2.995 1.00 0.00 C ATOM 156 OH TYR A 668 1.964 8.954 4.009 1.00 0.00 O ATOM 0 H TYR A 668 -1.881 11.265 0.523 1.00 0.00 H new ATOM 0 HA TYR A 668 -0.827 9.910 -1.695 1.00 0.00 H new ATOM 0 HB2 TYR A 668 -2.892 8.906 0.296 1.00 0.00 H new ATOM 0 HB3 TYR A 668 -1.822 7.922 -0.683 1.00 0.00 H new ATOM 0 HD1 TYR A 668 0.771 9.449 -0.321 1.00 0.00 H new ATOM 0 HD2 TYR A 668 -2.242 8.357 2.489 1.00 0.00 H new ATOM 0 HE1 TYR A 668 2.441 9.483 1.482 1.00 0.00 H new ATOM 0 HE2 TYR A 668 -0.577 8.391 4.289 1.00 0.00 H new ATOM 0 HH TYR A 668 1.530 8.722 4.857 1.00 0.00 H new ATOM 166 N THR A 669 -3.937 10.788 -1.995 1.00 0.00 N ATOM 167 CA THR A 669 -5.090 10.835 -2.888 1.00 0.00 C ATOM 168 C THR A 669 -4.682 11.273 -4.295 1.00 0.00 C ATOM 169 O THR A 669 -5.184 10.744 -5.289 1.00 0.00 O ATOM 170 CB THR A 669 -6.153 11.791 -2.331 1.00 0.00 C ATOM 171 OG1 THR A 669 -5.746 13.142 -2.471 1.00 0.00 O ATOM 172 CG2 THR A 669 -6.472 11.559 -0.867 1.00 0.00 C ATOM 0 H THR A 669 -3.981 11.455 -1.224 1.00 0.00 H new ATOM 0 HA THR A 669 -5.507 9.830 -2.951 1.00 0.00 H new ATOM 0 HB THR A 669 -7.049 11.585 -2.917 1.00 0.00 H new ATOM 0 HG1 THR A 669 -6.441 13.732 -2.110 1.00 0.00 H new ATOM 0 HG21 THR A 669 -7.231 12.271 -0.543 1.00 0.00 H new ATOM 0 HG22 THR A 669 -6.846 10.544 -0.732 1.00 0.00 H new ATOM 0 HG23 THR A 669 -5.569 11.695 -0.272 1.00 0.00 H new ATOM 180 N ALA A 670 -3.768 12.241 -4.370 1.00 0.00 N ATOM 181 CA ALA A 670 -3.288 12.752 -5.653 1.00 0.00 C ATOM 182 C ALA A 670 -2.614 11.649 -6.470 1.00 0.00 C ATOM 183 O ALA A 670 -2.691 11.641 -7.697 1.00 0.00 O ATOM 184 CB ALA A 670 -2.330 13.915 -5.435 1.00 0.00 C ATOM 0 H ALA A 670 -3.345 12.687 -3.556 1.00 0.00 H new ATOM 0 HA ALA A 670 -4.149 13.108 -6.218 1.00 0.00 H new ATOM 0 HB1 ALA A 670 -1.981 14.285 -6.399 1.00 0.00 H new ATOM 0 HB2 ALA A 670 -2.845 14.716 -4.904 1.00 0.00 H new ATOM 0 HB3 ALA A 670 -1.477 13.578 -4.845 1.00 0.00 H new ATOM 190 N TYR A 671 -1.953 10.721 -5.776 1.00 0.00 N ATOM 191 CA TYR A 671 -1.266 9.611 -6.433 1.00 0.00 C ATOM 192 C TYR A 671 -2.262 8.675 -7.124 1.00 0.00 C ATOM 193 O TYR A 671 -3.415 8.564 -6.706 1.00 0.00 O ATOM 194 CB TYR A 671 -0.435 8.825 -5.412 1.00 0.00 C ATOM 195 CG TYR A 671 0.563 9.673 -4.648 1.00 0.00 C ATOM 196 CD1 TYR A 671 1.153 10.788 -5.231 1.00 0.00 C ATOM 197 CD2 TYR A 671 0.914 9.355 -3.343 1.00 0.00 C ATOM 198 CE1 TYR A 671 2.063 11.559 -4.536 1.00 0.00 C ATOM 199 CE2 TYR A 671 1.825 10.122 -2.641 1.00 0.00 C ATOM 200 CZ TYR A 671 2.396 11.223 -3.241 1.00 0.00 C ATOM 201 OH TYR A 671 3.305 11.987 -2.547 1.00 0.00 O ATOM 0 H TYR A 671 -1.880 10.717 -4.759 1.00 0.00 H new ATOM 0 HA TYR A 671 -0.605 10.028 -7.193 1.00 0.00 H new ATOM 0 HB2 TYR A 671 -1.109 8.346 -4.702 1.00 0.00 H new ATOM 0 HB3 TYR A 671 0.101 8.029 -5.930 1.00 0.00 H new ATOM 0 HD1 TYR A 671 0.895 11.056 -6.245 1.00 0.00 H new ATOM 0 HD2 TYR A 671 0.468 8.494 -2.868 1.00 0.00 H new ATOM 0 HE1 TYR A 671 2.512 12.422 -5.005 1.00 0.00 H new ATOM 0 HE2 TYR A 671 2.088 9.859 -1.627 1.00 0.00 H new ATOM 0 HH TYR A 671 3.427 11.615 -1.649 1.00 0.00 H new ATOM 211 N PRO A 672 -1.827 7.989 -8.201 1.00 0.00 N ATOM 212 CA PRO A 672 -2.680 7.066 -8.957 1.00 0.00 C ATOM 213 C PRO A 672 -2.767 5.666 -8.335 1.00 0.00 C ATOM 214 O PRO A 672 -2.735 4.666 -9.051 1.00 0.00 O ATOM 215 CB PRO A 672 -1.978 7.009 -10.314 1.00 0.00 C ATOM 216 CG PRO A 672 -0.531 7.182 -9.994 1.00 0.00 C ATOM 217 CD PRO A 672 -0.466 8.071 -8.777 1.00 0.00 C ATOM 0 HA PRO A 672 -3.716 7.403 -8.992 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -2.163 6.060 -10.817 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -2.334 7.796 -10.979 1.00 0.00 H new ATOM 0 HG2 PRO A 672 -0.059 6.219 -9.797 1.00 0.00 H new ATOM 0 HG3 PRO A 672 0.001 7.632 -10.832 1.00 0.00 H new ATOM 0 HD2 PRO A 672 0.288 7.725 -8.070 1.00 0.00 H new ATOM 0 HD3 PRO A 672 -0.207 9.095 -9.044 1.00 0.00 H new ATOM 225 N TRP A 673 -2.883 5.596 -7.007 1.00 0.00 N ATOM 226 CA TRP A 673 -2.983 4.306 -6.317 1.00 0.00 C ATOM 227 C TRP A 673 -3.595 4.454 -4.922 1.00 0.00 C ATOM 228 O TRP A 673 -3.149 3.815 -3.967 1.00 0.00 O ATOM 229 CB TRP A 673 -1.607 3.623 -6.217 1.00 0.00 C ATOM 230 CG TRP A 673 -0.456 4.567 -6.003 1.00 0.00 C ATOM 231 CD1 TRP A 673 0.289 5.184 -6.969 1.00 0.00 C ATOM 232 CD2 TRP A 673 0.092 4.988 -4.746 1.00 0.00 C ATOM 233 NE1 TRP A 673 1.263 5.961 -6.390 1.00 0.00 N ATOM 234 CE2 TRP A 673 1.162 5.857 -5.027 1.00 0.00 C ATOM 235 CE3 TRP A 673 -0.220 4.716 -3.411 1.00 0.00 C ATOM 236 CZ2 TRP A 673 1.923 6.453 -4.024 1.00 0.00 C ATOM 237 CZ3 TRP A 673 0.536 5.308 -2.417 1.00 0.00 C ATOM 238 CH2 TRP A 673 1.595 6.167 -2.727 1.00 0.00 C ATOM 0 H TRP A 673 -2.910 6.409 -6.392 1.00 0.00 H new ATOM 0 HA TRP A 673 -3.645 3.678 -6.913 1.00 0.00 H new ATOM 0 HB2 TRP A 673 -1.630 2.906 -5.396 1.00 0.00 H new ATOM 0 HB3 TRP A 673 -1.430 3.056 -7.131 1.00 0.00 H new ATOM 0 HD1 TRP A 673 0.134 5.076 -8.032 1.00 0.00 H new ATOM 0 HE1 TRP A 673 1.949 6.524 -6.893 1.00 0.00 H new ATOM 0 HE3 TRP A 673 -1.037 4.055 -3.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 673 2.742 7.116 -4.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 673 0.305 5.103 -1.382 1.00 0.00 H new ATOM 0 HH2 TRP A 673 2.166 6.614 -1.926 1.00 0.00 H new ATOM 249 N PHE A 674 -4.627 5.292 -4.811 1.00 0.00 N ATOM 250 CA PHE A 674 -5.294 5.508 -3.533 1.00 0.00 C ATOM 251 C PHE A 674 -6.756 5.074 -3.587 1.00 0.00 C ATOM 252 O PHE A 674 -7.537 5.587 -4.391 1.00 0.00 O ATOM 253 CB PHE A 674 -5.203 6.979 -3.121 1.00 0.00 C ATOM 254 CG PHE A 674 -5.390 7.201 -1.645 1.00 0.00 C ATOM 255 CD1 PHE A 674 -4.694 6.435 -0.722 1.00 0.00 C ATOM 256 CD2 PHE A 674 -6.268 8.167 -1.182 1.00 0.00 C ATOM 257 CE1 PHE A 674 -4.867 6.631 0.634 1.00 0.00 C ATOM 258 CE2 PHE A 674 -6.447 8.367 0.174 1.00 0.00 C ATOM 259 CZ PHE A 674 -5.746 7.598 1.082 1.00 0.00 C ATOM 0 H PHE A 674 -5.015 5.828 -5.587 1.00 0.00 H new ATOM 0 HA PHE A 674 -4.784 4.896 -2.789 1.00 0.00 H new ATOM 0 HB2 PHE A 674 -4.231 7.372 -3.419 1.00 0.00 H new ATOM 0 HB3 PHE A 674 -5.958 7.548 -3.664 1.00 0.00 H new ATOM 0 HD1 PHE A 674 -4.008 5.676 -1.068 1.00 0.00 H new ATOM 0 HD2 PHE A 674 -6.819 8.771 -1.888 1.00 0.00 H new ATOM 0 HE1 PHE A 674 -4.316 6.030 1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 674 -7.134 9.124 0.523 1.00 0.00 H new ATOM 0 HZ PHE A 674 -5.885 7.753 2.142 1.00 0.00 H new ATOM 269 N ALA A 675 -7.118 4.129 -2.720 1.00 0.00 N ATOM 270 CA ALA A 675 -8.488 3.626 -2.654 1.00 0.00 C ATOM 271 C ALA A 675 -9.256 4.256 -1.492 1.00 0.00 C ATOM 272 O ALA A 675 -10.472 4.438 -1.577 1.00 0.00 O ATOM 273 CB ALA A 675 -8.494 2.110 -2.532 1.00 0.00 C ATOM 0 H ALA A 675 -6.479 3.696 -2.053 1.00 0.00 H new ATOM 0 HA ALA A 675 -8.990 3.906 -3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 675 -9.523 1.753 -2.484 1.00 0.00 H new ATOM 0 HB2 ALA A 675 -7.998 1.673 -3.399 1.00 0.00 H new ATOM 0 HB3 ALA A 675 -7.965 1.816 -1.625 1.00 0.00 H new ATOM 279 N GLY A 676 -8.547 4.580 -0.408 1.00 0.00 N ATOM 280 CA GLY A 676 -9.192 5.178 0.751 1.00 0.00 C ATOM 281 C GLY A 676 -10.018 4.168 1.529 1.00 0.00 C ATOM 282 O GLY A 676 -9.644 3.000 1.620 1.00 0.00 O ATOM 0 H GLY A 676 -7.541 4.439 -0.314 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -8.434 5.607 1.406 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -9.834 5.997 0.426 1.00 0.00 H new ATOM 286 N ASN A 677 -11.142 4.617 2.087 1.00 0.00 N ATOM 287 CA ASN A 677 -12.022 3.738 2.856 1.00 0.00 C ATOM 288 C ASN A 677 -12.824 2.825 1.927 1.00 0.00 C ATOM 289 O ASN A 677 -14.041 2.973 1.787 1.00 0.00 O ATOM 290 CB ASN A 677 -12.964 4.570 3.732 1.00 0.00 C ATOM 291 CG ASN A 677 -12.309 5.024 5.023 1.00 0.00 C ATOM 292 OD1 ASN A 677 -11.093 4.933 5.185 1.00 0.00 O ATOM 293 ND2 ASN A 677 -13.118 5.519 5.952 1.00 0.00 N ATOM 0 H ASN A 677 -11.464 5.583 2.021 1.00 0.00 H new ATOM 0 HA ASN A 677 -11.406 3.110 3.500 1.00 0.00 H new ATOM 0 HB2 ASN A 677 -13.299 5.443 3.172 1.00 0.00 H new ATOM 0 HB3 ASN A 677 -13.851 3.982 3.966 1.00 0.00 H new ATOM 0 HD21 ASN A 677 -12.736 5.842 6.841 1.00 0.00 H new ATOM 0 HD22 ASN A 677 -14.121 5.577 5.777 1.00 0.00 H new ATOM 300 N MET A 678 -12.129 1.887 1.286 1.00 0.00 N ATOM 301 CA MET A 678 -12.760 0.952 0.359 1.00 0.00 C ATOM 302 C MET A 678 -12.977 -0.410 1.015 1.00 0.00 C ATOM 303 O MET A 678 -12.089 -0.934 1.690 1.00 0.00 O ATOM 304 CB MET A 678 -11.900 0.801 -0.897 1.00 0.00 C ATOM 305 CG MET A 678 -12.664 0.282 -2.103 1.00 0.00 C ATOM 306 SD MET A 678 -11.576 -0.290 -3.421 1.00 0.00 S ATOM 307 CE MET A 678 -12.013 0.841 -4.738 1.00 0.00 C ATOM 0 H MET A 678 -11.123 1.755 1.393 1.00 0.00 H new ATOM 0 HA MET A 678 -13.735 1.352 0.081 1.00 0.00 H new ATOM 0 HB2 MET A 678 -11.462 1.768 -1.145 1.00 0.00 H new ATOM 0 HB3 MET A 678 -11.075 0.122 -0.682 1.00 0.00 H new ATOM 0 HG2 MET A 678 -13.313 -0.537 -1.792 1.00 0.00 H new ATOM 0 HG3 MET A 678 -13.309 1.072 -2.487 1.00 0.00 H new ATOM 0 HE1 MET A 678 -11.222 0.850 -5.487 1.00 0.00 H new ATOM 0 HE2 MET A 678 -12.946 0.519 -5.200 1.00 0.00 H new ATOM 0 HE3 MET A 678 -12.138 1.844 -4.330 1.00 0.00 H new ATOM 317 N GLU A 679 -14.166 -0.976 0.808 1.00 0.00 N ATOM 318 CA GLU A 679 -14.509 -2.278 1.377 1.00 0.00 C ATOM 319 C GLU A 679 -13.689 -3.392 0.730 1.00 0.00 C ATOM 320 O GLU A 679 -13.243 -3.264 -0.411 1.00 0.00 O ATOM 321 CB GLU A 679 -16.005 -2.564 1.197 1.00 0.00 C ATOM 322 CG GLU A 679 -16.911 -1.405 1.597 1.00 0.00 C ATOM 323 CD GLU A 679 -17.738 -1.706 2.832 1.00 0.00 C ATOM 324 OE1 GLU A 679 -18.733 -2.452 2.713 1.00 0.00 O ATOM 325 OE2 GLU A 679 -17.387 -1.201 3.918 1.00 0.00 O ATOM 0 H GLU A 679 -14.908 -0.553 0.250 1.00 0.00 H new ATOM 0 HA GLU A 679 -14.276 -2.249 2.441 1.00 0.00 H new ATOM 0 HB2 GLU A 679 -16.193 -2.815 0.153 1.00 0.00 H new ATOM 0 HB3 GLU A 679 -16.271 -3.440 1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 679 -16.302 -0.520 1.780 1.00 0.00 H new ATOM 0 HG3 GLU A 679 -17.577 -1.168 0.768 1.00 0.00 H new ATOM 332 N ARG A 680 -13.498 -4.489 1.465 1.00 0.00 N ATOM 333 CA ARG A 680 -12.735 -5.631 0.962 1.00 0.00 C ATOM 334 C ARG A 680 -13.301 -6.119 -0.373 1.00 0.00 C ATOM 335 O ARG A 680 -12.550 -6.403 -1.306 1.00 0.00 O ATOM 336 CB ARG A 680 -12.742 -6.773 1.984 1.00 0.00 C ATOM 337 CG ARG A 680 -11.350 -7.208 2.420 1.00 0.00 C ATOM 338 CD ARG A 680 -11.378 -7.916 3.769 1.00 0.00 C ATOM 339 NE ARG A 680 -11.028 -9.333 3.657 1.00 0.00 N ATOM 340 CZ ARG A 680 -11.307 -10.249 4.590 1.00 0.00 C ATOM 341 NH1 ARG A 680 -11.932 -9.905 5.713 1.00 0.00 N ATOM 342 NH2 ARG A 680 -10.956 -11.517 4.403 1.00 0.00 N ATOM 0 H ARG A 680 -13.861 -4.610 2.410 1.00 0.00 H new ATOM 0 HA ARG A 680 -11.707 -5.306 0.803 1.00 0.00 H new ATOM 0 HB2 ARG A 680 -13.308 -6.461 2.862 1.00 0.00 H new ATOM 0 HB3 ARG A 680 -13.264 -7.629 1.556 1.00 0.00 H new ATOM 0 HG2 ARG A 680 -10.924 -7.873 1.669 1.00 0.00 H new ATOM 0 HG3 ARG A 680 -10.698 -6.336 2.480 1.00 0.00 H new ATOM 0 HD2 ARG A 680 -10.683 -7.425 4.450 1.00 0.00 H new ATOM 0 HD3 ARG A 680 -12.372 -7.822 4.206 1.00 0.00 H new ATOM 0 HE ARG A 680 -10.541 -9.640 2.815 1.00 0.00 H new ATOM 0 HH11 ARG A 680 -12.203 -8.934 5.869 1.00 0.00 H new ATOM 0 HH12 ARG A 680 -12.140 -10.612 6.418 1.00 0.00 H new ATOM 0 HH21 ARG A 680 -10.473 -11.792 3.547 1.00 0.00 H new ATOM 0 HH22 ARG A 680 -11.169 -12.215 5.115 1.00 0.00 H new ATOM 356 N GLN A 681 -14.630 -6.203 -0.457 1.00 0.00 N ATOM 357 CA GLN A 681 -15.300 -6.647 -1.679 1.00 0.00 C ATOM 358 C GLN A 681 -14.961 -5.729 -2.851 1.00 0.00 C ATOM 359 O GLN A 681 -14.596 -6.199 -3.929 1.00 0.00 O ATOM 360 CB GLN A 681 -16.818 -6.693 -1.465 1.00 0.00 C ATOM 361 CG GLN A 681 -17.591 -7.218 -2.665 1.00 0.00 C ATOM 362 CD GLN A 681 -18.171 -6.105 -3.513 1.00 0.00 C ATOM 363 OE1 GLN A 681 -17.452 -5.723 -4.562 1.00 0.00 O flip ATOM 364 NE2 GLN A 681 -19.255 -5.595 -3.230 1.00 0.00 N flip ATOM 0 H GLN A 681 -15.263 -5.969 0.308 1.00 0.00 H new ATOM 0 HA GLN A 681 -14.945 -7.650 -1.917 1.00 0.00 H new ATOM 0 HB2 GLN A 681 -17.035 -7.322 -0.601 1.00 0.00 H new ATOM 0 HB3 GLN A 681 -17.173 -5.690 -1.226 1.00 0.00 H new ATOM 0 HG2 GLN A 681 -16.931 -7.831 -3.278 1.00 0.00 H new ATOM 0 HG3 GLN A 681 -18.397 -7.865 -2.319 1.00 0.00 H new ATOM 0 HE21 GLN A 681 -19.774 -5.920 -2.414 1.00 0.00 H new ATOM 0 HE22 GLN A 681 -19.634 -4.848 -3.811 1.00 0.00 H new ATOM 373 N GLN A 682 -15.086 -4.421 -2.633 1.00 0.00 N ATOM 374 CA GLN A 682 -14.792 -3.441 -3.677 1.00 0.00 C ATOM 375 C GLN A 682 -13.337 -3.539 -4.124 1.00 0.00 C ATOM 376 O GLN A 682 -13.042 -3.487 -5.319 1.00 0.00 O ATOM 377 CB GLN A 682 -15.092 -2.022 -3.188 1.00 0.00 C ATOM 378 CG GLN A 682 -16.246 -1.357 -3.921 1.00 0.00 C ATOM 379 CD GLN A 682 -16.337 0.130 -3.644 1.00 0.00 C ATOM 380 OE1 GLN A 682 -16.726 0.547 -2.554 1.00 0.00 O ATOM 381 NE2 GLN A 682 -15.978 0.940 -4.634 1.00 0.00 N ATOM 0 H GLN A 682 -15.388 -4.016 -1.747 1.00 0.00 H new ATOM 0 HA GLN A 682 -15.433 -3.663 -4.530 1.00 0.00 H new ATOM 0 HB2 GLN A 682 -15.320 -2.054 -2.123 1.00 0.00 H new ATOM 0 HB3 GLN A 682 -14.198 -1.410 -3.304 1.00 0.00 H new ATOM 0 HG2 GLN A 682 -16.130 -1.516 -4.993 1.00 0.00 H new ATOM 0 HG3 GLN A 682 -17.181 -1.835 -3.627 1.00 0.00 H new ATOM 0 HE21 GLN A 682 -15.661 0.551 -5.522 1.00 0.00 H new ATOM 0 HE22 GLN A 682 -16.019 1.951 -4.506 1.00 0.00 H new ATOM 390 N THR A 683 -12.429 -3.684 -3.156 1.00 0.00 N ATOM 391 CA THR A 683 -11.004 -3.797 -3.449 1.00 0.00 C ATOM 392 C THR A 683 -10.730 -4.993 -4.362 1.00 0.00 C ATOM 393 O THR A 683 -9.876 -4.921 -5.249 1.00 0.00 O ATOM 394 CB THR A 683 -10.199 -3.931 -2.153 1.00 0.00 C ATOM 395 OG1 THR A 683 -10.491 -2.867 -1.265 1.00 0.00 O ATOM 396 CG2 THR A 683 -8.701 -3.942 -2.375 1.00 0.00 C ATOM 0 H THR A 683 -12.658 -3.726 -2.163 1.00 0.00 H new ATOM 0 HA THR A 683 -10.692 -2.889 -3.965 1.00 0.00 H new ATOM 0 HB THR A 683 -10.496 -4.891 -1.731 1.00 0.00 H new ATOM 0 HG1 THR A 683 -11.385 -2.995 -0.884 1.00 0.00 H new ATOM 0 HG21 THR A 683 -8.192 -4.039 -1.416 1.00 0.00 H new ATOM 0 HG22 THR A 683 -8.434 -4.783 -3.015 1.00 0.00 H new ATOM 0 HG23 THR A 683 -8.397 -3.011 -2.854 1.00 0.00 H new ATOM 404 N ASP A 684 -11.463 -6.086 -4.146 1.00 0.00 N ATOM 405 CA ASP A 684 -11.299 -7.291 -4.957 1.00 0.00 C ATOM 406 C ASP A 684 -11.689 -7.024 -6.409 1.00 0.00 C ATOM 407 O ASP A 684 -10.923 -7.318 -7.326 1.00 0.00 O ATOM 408 CB ASP A 684 -12.136 -8.442 -4.394 1.00 0.00 C ATOM 409 CG ASP A 684 -11.798 -9.773 -5.045 1.00 0.00 C ATOM 410 OD1 ASP A 684 -10.899 -10.472 -4.533 1.00 0.00 O ATOM 411 OD2 ASP A 684 -12.431 -10.111 -6.068 1.00 0.00 O ATOM 0 H ASP A 684 -12.174 -6.161 -3.418 1.00 0.00 H new ATOM 0 HA ASP A 684 -10.247 -7.575 -4.925 1.00 0.00 H new ATOM 0 HB2 ASP A 684 -11.973 -8.514 -3.319 1.00 0.00 H new ATOM 0 HB3 ASP A 684 -13.194 -8.226 -4.543 1.00 0.00 H new ATOM 416 N ASN A 685 -12.885 -6.460 -6.610 1.00 0.00 N ATOM 417 CA ASN A 685 -13.380 -6.145 -7.953 1.00 0.00 C ATOM 418 C ASN A 685 -12.445 -5.174 -8.682 1.00 0.00 C ATOM 419 O ASN A 685 -12.442 -5.111 -9.913 1.00 0.00 O ATOM 420 CB ASN A 685 -14.788 -5.546 -7.884 1.00 0.00 C ATOM 421 CG ASN A 685 -15.851 -6.562 -7.506 1.00 0.00 C ATOM 422 OD1 ASN A 685 -15.548 -7.723 -7.228 1.00 0.00 O ATOM 423 ND2 ASN A 685 -17.109 -6.129 -7.491 1.00 0.00 N ATOM 0 H ASN A 685 -13.528 -6.212 -5.858 1.00 0.00 H new ATOM 0 HA ASN A 685 -13.413 -7.079 -8.513 1.00 0.00 H new ATOM 0 HB2 ASN A 685 -14.795 -4.734 -7.157 1.00 0.00 H new ATOM 0 HB3 ASN A 685 -15.038 -5.110 -8.851 1.00 0.00 H new ATOM 0 HD21 ASN A 685 -17.865 -6.767 -7.243 1.00 0.00 H new ATOM 0 HD22 ASN A 685 -17.317 -5.159 -7.728 1.00 0.00 H new ATOM 430 N LEU A 686 -11.651 -4.422 -7.919 1.00 0.00 N ATOM 431 CA LEU A 686 -10.710 -3.461 -8.495 1.00 0.00 C ATOM 432 C LEU A 686 -9.593 -4.192 -9.232 1.00 0.00 C ATOM 433 O LEU A 686 -9.319 -3.909 -10.397 1.00 0.00 O ATOM 434 CB LEU A 686 -10.116 -2.563 -7.399 1.00 0.00 C ATOM 435 CG LEU A 686 -10.025 -1.069 -7.741 1.00 0.00 C ATOM 436 CD1 LEU A 686 -9.112 -0.838 -8.937 1.00 0.00 C ATOM 437 CD2 LEU A 686 -11.410 -0.492 -8.002 1.00 0.00 C ATOM 0 H LEU A 686 -11.641 -4.460 -6.900 1.00 0.00 H new ATOM 0 HA LEU A 686 -11.251 -2.834 -9.204 1.00 0.00 H new ATOM 0 HB2 LEU A 686 -10.718 -2.675 -6.497 1.00 0.00 H new ATOM 0 HB3 LEU A 686 -9.116 -2.924 -7.161 1.00 0.00 H new ATOM 0 HG LEU A 686 -9.594 -0.552 -6.883 1.00 0.00 H new ATOM 0 HD11 LEU A 686 -9.065 0.228 -9.158 1.00 0.00 H new ATOM 0 HD12 LEU A 686 -8.112 -1.205 -8.708 1.00 0.00 H new ATOM 0 HD13 LEU A 686 -9.505 -1.371 -9.803 1.00 0.00 H new ATOM 0 HD21 LEU A 686 -11.323 0.568 -8.243 1.00 0.00 H new ATOM 0 HD22 LEU A 686 -11.871 -1.017 -8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 686 -12.028 -0.613 -7.112 1.00 0.00 H new ATOM 449 N LEU A 687 -8.956 -5.140 -8.543 1.00 0.00 N ATOM 450 CA LEU A 687 -7.870 -5.922 -9.133 1.00 0.00 C ATOM 451 C LEU A 687 -8.374 -7.268 -9.662 1.00 0.00 C ATOM 452 O LEU A 687 -7.581 -8.180 -9.908 1.00 0.00 O ATOM 453 CB LEU A 687 -6.762 -6.149 -8.099 1.00 0.00 C ATOM 454 CG LEU A 687 -6.233 -4.882 -7.421 1.00 0.00 C ATOM 455 CD1 LEU A 687 -5.855 -5.167 -5.974 1.00 0.00 C ATOM 456 CD2 LEU A 687 -5.044 -4.325 -8.189 1.00 0.00 C ATOM 0 H LEU A 687 -9.174 -5.384 -7.577 1.00 0.00 H new ATOM 0 HA LEU A 687 -7.470 -5.357 -9.975 1.00 0.00 H new ATOM 0 HB2 LEU A 687 -7.138 -6.824 -7.330 1.00 0.00 H new ATOM 0 HB3 LEU A 687 -5.929 -6.655 -8.588 1.00 0.00 H new ATOM 0 HG LEU A 687 -7.024 -4.132 -7.424 1.00 0.00 H new ATOM 0 HD11 LEU A 687 -5.481 -4.255 -5.509 1.00 0.00 H new ATOM 0 HD12 LEU A 687 -6.733 -5.518 -5.431 1.00 0.00 H new ATOM 0 HD13 LEU A 687 -5.080 -5.933 -5.944 1.00 0.00 H new ATOM 0 HD21 LEU A 687 -4.680 -3.425 -7.694 1.00 0.00 H new ATOM 0 HD22 LEU A 687 -4.249 -5.070 -8.218 1.00 0.00 H new ATOM 0 HD23 LEU A 687 -5.350 -4.081 -9.206 1.00 0.00 H new ATOM 468 N LYS A 688 -9.693 -7.391 -9.841 1.00 0.00 N ATOM 469 CA LYS A 688 -10.289 -8.621 -10.341 1.00 0.00 C ATOM 470 C LYS A 688 -9.985 -8.823 -11.829 1.00 0.00 C ATOM 471 O LYS A 688 -9.840 -9.956 -12.290 1.00 0.00 O ATOM 472 CB LYS A 688 -11.803 -8.609 -10.094 1.00 0.00 C ATOM 473 CG LYS A 688 -12.593 -7.710 -11.037 1.00 0.00 C ATOM 474 CD LYS A 688 -13.361 -8.515 -12.076 1.00 0.00 C ATOM 475 CE LYS A 688 -14.066 -7.610 -13.078 1.00 0.00 C ATOM 476 NZ LYS A 688 -15.094 -6.747 -12.428 1.00 0.00 N ATOM 0 H LYS A 688 -10.364 -6.649 -9.645 1.00 0.00 H new ATOM 0 HA LYS A 688 -9.849 -9.458 -9.799 1.00 0.00 H new ATOM 0 HB2 LYS A 688 -12.180 -9.628 -10.183 1.00 0.00 H new ATOM 0 HB3 LYS A 688 -11.988 -8.289 -9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 688 -13.290 -7.102 -10.460 1.00 0.00 H new ATOM 0 HG3 LYS A 688 -11.912 -7.023 -11.540 1.00 0.00 H new ATOM 0 HD2 LYS A 688 -12.675 -9.178 -12.603 1.00 0.00 H new ATOM 0 HD3 LYS A 688 -14.095 -9.148 -11.577 1.00 0.00 H new ATOM 0 HE2 LYS A 688 -13.330 -6.981 -13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 688 -14.539 -8.221 -13.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 688 -15.630 -6.235 -13.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 688 -15.744 -7.339 -11.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 688 -14.626 -6.064 -11.799 1.00 0.00 H new ATOM 490 N SER A 689 -9.887 -7.719 -12.573 1.00 0.00 N ATOM 491 CA SER A 689 -9.599 -7.776 -14.006 1.00 0.00 C ATOM 492 C SER A 689 -8.173 -7.310 -14.317 1.00 0.00 C ATOM 493 O SER A 689 -7.636 -7.610 -15.386 1.00 0.00 O ATOM 494 CB SER A 689 -10.602 -6.919 -14.780 1.00 0.00 C ATOM 495 OG SER A 689 -10.450 -5.541 -14.468 1.00 0.00 O ATOM 0 H SER A 689 -10.003 -6.775 -12.206 1.00 0.00 H new ATOM 0 HA SER A 689 -9.689 -8.817 -14.318 1.00 0.00 H new ATOM 0 HB2 SER A 689 -10.463 -7.070 -15.851 1.00 0.00 H new ATOM 0 HB3 SER A 689 -11.617 -7.238 -14.542 1.00 0.00 H new ATOM 0 HG SER A 689 -11.102 -5.016 -14.978 1.00 0.00 H new ATOM 501 N HIS A 690 -7.567 -6.567 -13.387 1.00 0.00 N ATOM 502 CA HIS A 690 -6.214 -6.052 -13.572 1.00 0.00 C ATOM 503 C HIS A 690 -5.198 -7.184 -13.745 1.00 0.00 C ATOM 504 O HIS A 690 -5.453 -8.329 -13.369 1.00 0.00 O ATOM 505 CB HIS A 690 -5.820 -5.171 -12.385 1.00 0.00 C ATOM 506 CG HIS A 690 -6.342 -3.768 -12.483 1.00 0.00 C ATOM 507 ND1 HIS A 690 -6.396 -3.062 -13.665 1.00 0.00 N ATOM 508 CD2 HIS A 690 -6.831 -2.938 -11.531 1.00 0.00 C ATOM 509 CE1 HIS A 690 -6.889 -1.859 -13.437 1.00 0.00 C ATOM 510 NE2 HIS A 690 -7.163 -1.756 -12.149 1.00 0.00 N ATOM 0 H HIS A 690 -7.996 -6.310 -12.498 1.00 0.00 H new ATOM 0 HA HIS A 690 -6.207 -5.455 -14.484 1.00 0.00 H new ATOM 0 HB2 HIS A 690 -6.191 -5.625 -11.466 1.00 0.00 H new ATOM 0 HB3 HIS A 690 -4.733 -5.142 -12.309 1.00 0.00 H new ATOM 0 HD2 HIS A 690 -6.940 -3.163 -10.480 1.00 0.00 H new ATOM 0 HE1 HIS A 690 -7.042 -1.089 -14.178 1.00 0.00 H new ATOM 0 HE2 HIS A 690 -7.556 -0.935 -11.689 1.00 0.00 H new ATOM 519 N ALA A 691 -4.044 -6.845 -14.320 1.00 0.00 N ATOM 520 CA ALA A 691 -2.981 -7.818 -14.553 1.00 0.00 C ATOM 521 C ALA A 691 -2.046 -7.921 -13.351 1.00 0.00 C ATOM 522 O ALA A 691 -2.014 -7.031 -12.499 1.00 0.00 O ATOM 523 CB ALA A 691 -2.192 -7.444 -15.800 1.00 0.00 C ATOM 0 H ALA A 691 -3.823 -5.900 -14.633 1.00 0.00 H new ATOM 0 HA ALA A 691 -3.446 -8.793 -14.701 1.00 0.00 H new ATOM 0 HB1 ALA A 691 -1.402 -8.177 -15.964 1.00 0.00 H new ATOM 0 HB2 ALA A 691 -2.859 -7.430 -16.662 1.00 0.00 H new ATOM 0 HB3 ALA A 691 -1.750 -6.457 -15.668 1.00 0.00 H new ATOM 529 N SER A 692 -1.279 -9.009 -13.294 1.00 0.00 N ATOM 530 CA SER A 692 -0.337 -9.225 -12.199 1.00 0.00 C ATOM 531 C SER A 692 0.703 -8.107 -12.157 1.00 0.00 C ATOM 532 O SER A 692 1.484 -7.939 -13.093 1.00 0.00 O ATOM 533 CB SER A 692 0.362 -10.577 -12.355 1.00 0.00 C ATOM 534 OG SER A 692 -0.481 -11.641 -11.946 1.00 0.00 O ATOM 0 H SER A 692 -1.292 -9.753 -13.992 1.00 0.00 H new ATOM 0 HA SER A 692 -0.896 -9.221 -11.263 1.00 0.00 H new ATOM 0 HB2 SER A 692 0.654 -10.720 -13.395 1.00 0.00 H new ATOM 0 HB3 SER A 692 1.277 -10.587 -11.763 1.00 0.00 H new ATOM 0 HG SER A 692 -0.010 -12.493 -12.058 1.00 0.00 H new ATOM 540 N GLY A 693 0.699 -7.343 -11.067 1.00 0.00 N ATOM 541 CA GLY A 693 1.641 -6.243 -10.920 1.00 0.00 C ATOM 542 C GLY A 693 0.984 -4.958 -10.430 1.00 0.00 C ATOM 543 O GLY A 693 1.678 -4.007 -10.062 1.00 0.00 O ATOM 0 H GLY A 693 0.060 -7.465 -10.282 1.00 0.00 H new ATOM 0 HA2 GLY A 693 2.424 -6.534 -10.220 1.00 0.00 H new ATOM 0 HA3 GLY A 693 2.124 -6.055 -11.879 1.00 0.00 H new ATOM 547 N THR A 694 -0.353 -4.927 -10.422 1.00 0.00 N ATOM 548 CA THR A 694 -1.086 -3.747 -9.969 1.00 0.00 C ATOM 549 C THR A 694 -1.049 -3.644 -8.445 1.00 0.00 C ATOM 550 O THR A 694 -1.304 -4.624 -7.744 1.00 0.00 O ATOM 551 CB THR A 694 -2.539 -3.786 -10.459 1.00 0.00 C ATOM 552 OG1 THR A 694 -2.603 -4.202 -11.813 1.00 0.00 O ATOM 553 CG2 THR A 694 -3.247 -2.451 -10.355 1.00 0.00 C ATOM 0 H THR A 694 -0.944 -5.702 -10.723 1.00 0.00 H new ATOM 0 HA THR A 694 -0.602 -2.867 -10.392 1.00 0.00 H new ATOM 0 HB THR A 694 -3.042 -4.496 -9.803 1.00 0.00 H new ATOM 0 HG1 THR A 694 -2.461 -5.170 -11.865 1.00 0.00 H new ATOM 0 HG21 THR A 694 -4.270 -2.552 -10.719 1.00 0.00 H new ATOM 0 HG22 THR A 694 -3.262 -2.127 -9.314 1.00 0.00 H new ATOM 0 HG23 THR A 694 -2.719 -1.711 -10.957 1.00 0.00 H new ATOM 561 N TYR A 695 -0.719 -2.453 -7.941 1.00 0.00 N ATOM 562 CA TYR A 695 -0.634 -2.225 -6.499 1.00 0.00 C ATOM 563 C TYR A 695 -1.456 -1.007 -6.070 1.00 0.00 C ATOM 564 O TYR A 695 -1.554 -0.022 -6.804 1.00 0.00 O ATOM 565 CB TYR A 695 0.832 -2.046 -6.083 1.00 0.00 C ATOM 566 CG TYR A 695 1.496 -0.815 -6.669 1.00 0.00 C ATOM 567 CD1 TYR A 695 1.837 -0.756 -8.018 1.00 0.00 C ATOM 568 CD2 TYR A 695 1.788 0.285 -5.872 1.00 0.00 C ATOM 569 CE1 TYR A 695 2.449 0.365 -8.550 1.00 0.00 C ATOM 570 CE2 TYR A 695 2.397 1.408 -6.399 1.00 0.00 C ATOM 571 CZ TYR A 695 2.727 1.442 -7.737 1.00 0.00 C ATOM 572 OH TYR A 695 3.334 2.561 -8.265 1.00 0.00 O ATOM 0 H TYR A 695 -0.507 -1.633 -8.510 1.00 0.00 H new ATOM 0 HA TYR A 695 -1.050 -3.098 -5.997 1.00 0.00 H new ATOM 0 HB2 TYR A 695 0.886 -1.992 -4.996 1.00 0.00 H new ATOM 0 HB3 TYR A 695 1.395 -2.929 -6.387 1.00 0.00 H new ATOM 0 HD1 TYR A 695 1.620 -1.598 -8.659 1.00 0.00 H new ATOM 0 HD2 TYR A 695 1.535 0.262 -4.822 1.00 0.00 H new ATOM 0 HE1 TYR A 695 2.708 0.396 -9.598 1.00 0.00 H new ATOM 0 HE2 TYR A 695 2.613 2.255 -5.765 1.00 0.00 H new ATOM 0 HH TYR A 695 3.459 3.229 -7.559 1.00 0.00 H new ATOM 582 N LEU A 696 -2.043 -1.087 -4.873 1.00 0.00 N ATOM 583 CA LEU A 696 -2.859 0.004 -4.334 1.00 0.00 C ATOM 584 C LEU A 696 -2.984 -0.091 -2.811 1.00 0.00 C ATOM 585 O LEU A 696 -2.849 -1.170 -2.235 1.00 0.00 O ATOM 586 CB LEU A 696 -4.250 -0.004 -4.976 1.00 0.00 C ATOM 587 CG LEU A 696 -5.071 -1.277 -4.750 1.00 0.00 C ATOM 588 CD1 LEU A 696 -5.925 -1.150 -3.497 1.00 0.00 C ATOM 589 CD2 LEU A 696 -5.941 -1.575 -5.964 1.00 0.00 C ATOM 0 H LEU A 696 -1.968 -1.897 -4.258 1.00 0.00 H new ATOM 0 HA LEU A 696 -2.359 0.942 -4.574 1.00 0.00 H new ATOM 0 HB2 LEU A 696 -4.814 0.845 -4.590 1.00 0.00 H new ATOM 0 HB3 LEU A 696 -4.137 0.149 -6.049 1.00 0.00 H new ATOM 0 HG LEU A 696 -4.381 -2.109 -4.610 1.00 0.00 H new ATOM 0 HD11 LEU A 696 -6.500 -2.065 -3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 696 -5.281 -0.988 -2.633 1.00 0.00 H new ATOM 0 HD13 LEU A 696 -6.606 -0.306 -3.605 1.00 0.00 H new ATOM 0 HD21 LEU A 696 -6.517 -2.483 -5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 696 -6.622 -0.742 -6.137 1.00 0.00 H new ATOM 0 HD23 LEU A 696 -5.308 -1.714 -6.840 1.00 0.00 H new ATOM 601 N ILE A 697 -3.250 1.047 -2.167 1.00 0.00 N ATOM 602 CA ILE A 697 -3.401 1.096 -0.711 1.00 0.00 C ATOM 603 C ILE A 697 -4.780 1.633 -0.324 1.00 0.00 C ATOM 604 O ILE A 697 -5.324 2.513 -0.996 1.00 0.00 O ATOM 605 CB ILE A 697 -2.305 1.973 -0.058 1.00 0.00 C ATOM 606 CG1 ILE A 697 -0.912 1.449 -0.426 1.00 0.00 C ATOM 607 CG2 ILE A 697 -2.475 2.008 1.456 1.00 0.00 C ATOM 608 CD1 ILE A 697 -0.349 2.049 -1.696 1.00 0.00 C ATOM 0 H ILE A 697 -3.365 1.948 -2.631 1.00 0.00 H new ATOM 0 HA ILE A 697 -3.297 0.076 -0.342 1.00 0.00 H new ATOM 0 HB ILE A 697 -2.407 2.989 -0.439 1.00 0.00 H new ATOM 0 HG12 ILE A 697 -0.227 1.656 0.397 1.00 0.00 H new ATOM 0 HG13 ILE A 697 -0.959 0.366 -0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 697 -1.695 2.630 1.895 1.00 0.00 H new ATOM 0 HG22 ILE A 697 -3.452 2.423 1.703 1.00 0.00 H new ATOM 0 HG23 ILE A 697 -2.400 0.996 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 697 0.638 1.629 -1.890 1.00 0.00 H new ATOM 0 HD12 ILE A 697 -1.011 1.820 -2.531 1.00 0.00 H new ATOM 0 HD13 ILE A 697 -0.268 3.130 -1.583 1.00 0.00 H new ATOM 620 N ARG A 698 -5.344 1.094 0.759 1.00 0.00 N ATOM 621 CA ARG A 698 -6.663 1.512 1.234 1.00 0.00 C ATOM 622 C ARG A 698 -6.671 1.758 2.745 1.00 0.00 C ATOM 623 O ARG A 698 -6.063 1.008 3.513 1.00 0.00 O ATOM 624 CB ARG A 698 -7.716 0.460 0.871 1.00 0.00 C ATOM 625 CG ARG A 698 -7.376 -0.943 1.353 1.00 0.00 C ATOM 626 CD ARG A 698 -8.610 -1.678 1.851 1.00 0.00 C ATOM 627 NE ARG A 698 -8.271 -2.944 2.499 1.00 0.00 N ATOM 628 CZ ARG A 698 -9.170 -3.763 3.053 1.00 0.00 C ATOM 629 NH1 ARG A 698 -10.467 -3.467 3.017 1.00 0.00 N ATOM 630 NH2 ARG A 698 -8.769 -4.886 3.639 1.00 0.00 N ATOM 0 H ARG A 698 -4.906 0.366 1.324 1.00 0.00 H new ATOM 0 HA ARG A 698 -6.905 2.453 0.741 1.00 0.00 H new ATOM 0 HB2 ARG A 698 -8.675 0.758 1.296 1.00 0.00 H new ATOM 0 HB3 ARG A 698 -7.839 0.442 -0.212 1.00 0.00 H new ATOM 0 HG2 ARG A 698 -6.919 -1.507 0.540 1.00 0.00 H new ATOM 0 HG3 ARG A 698 -6.639 -0.885 2.154 1.00 0.00 H new ATOM 0 HD2 ARG A 698 -9.150 -1.044 2.554 1.00 0.00 H new ATOM 0 HD3 ARG A 698 -9.281 -1.868 1.013 1.00 0.00 H new ATOM 0 HE ARG A 698 -7.289 -3.219 2.530 1.00 0.00 H new ATOM 0 HH11 ARG A 698 -10.782 -2.609 2.564 1.00 0.00 H new ATOM 0 HH12 ARG A 698 -11.146 -4.098 3.442 1.00 0.00 H new ATOM 0 HH21 ARG A 698 -7.777 -5.121 3.665 1.00 0.00 H new ATOM 0 HH22 ARG A 698 -9.453 -5.513 4.063 1.00 0.00 H new ATOM 644 N GLU A 699 -7.377 2.810 3.158 1.00 0.00 N ATOM 645 CA GLU A 699 -7.490 3.175 4.569 1.00 0.00 C ATOM 646 C GLU A 699 -8.696 2.490 5.220 1.00 0.00 C ATOM 647 O GLU A 699 -9.625 2.061 4.533 1.00 0.00 O ATOM 648 CB GLU A 699 -7.620 4.696 4.709 1.00 0.00 C ATOM 649 CG GLU A 699 -7.344 5.214 6.113 1.00 0.00 C ATOM 650 CD GLU A 699 -7.305 6.729 6.182 1.00 0.00 C ATOM 651 OE1 GLU A 699 -8.388 7.352 6.200 1.00 0.00 O ATOM 652 OE2 GLU A 699 -6.193 7.292 6.215 1.00 0.00 O ATOM 0 H GLU A 699 -7.884 3.430 2.527 1.00 0.00 H new ATOM 0 HA GLU A 699 -6.587 2.839 5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 699 -6.930 5.175 4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 699 -8.627 4.993 4.415 1.00 0.00 H new ATOM 0 HG2 GLU A 699 -8.114 4.843 6.790 1.00 0.00 H new ATOM 0 HG3 GLU A 699 -6.392 4.814 6.463 1.00 0.00 H new ATOM 747 N ARG A 706 -4.197 0.837 11.499 1.00 0.00 N ATOM 748 CA ARG A 706 -5.029 -0.211 10.901 1.00 0.00 C ATOM 749 C ARG A 706 -5.142 -0.024 9.381 1.00 0.00 C ATOM 750 O ARG A 706 -6.234 -0.098 8.814 1.00 0.00 O ATOM 751 CB ARG A 706 -6.424 -0.222 11.546 1.00 0.00 C ATOM 752 CG ARG A 706 -6.698 -1.447 12.412 1.00 0.00 C ATOM 753 CD ARG A 706 -6.525 -2.745 11.634 1.00 0.00 C ATOM 754 NE ARG A 706 -7.781 -3.483 11.498 1.00 0.00 N ATOM 755 CZ ARG A 706 -7.858 -4.778 11.172 1.00 0.00 C ATOM 756 NH1 ARG A 706 -6.754 -5.486 10.946 1.00 0.00 N ATOM 757 NH2 ARG A 706 -9.045 -5.368 11.071 1.00 0.00 N ATOM 0 HA ARG A 706 -4.550 -1.172 11.089 1.00 0.00 H new ATOM 0 HB2 ARG A 706 -6.538 0.674 12.156 1.00 0.00 H new ATOM 0 HB3 ARG A 706 -7.177 -0.170 10.760 1.00 0.00 H new ATOM 0 HG2 ARG A 706 -6.023 -1.444 13.268 1.00 0.00 H new ATOM 0 HG3 ARG A 706 -7.713 -1.393 12.806 1.00 0.00 H new ATOM 0 HD2 ARG A 706 -6.128 -2.522 10.644 1.00 0.00 H new ATOM 0 HD3 ARG A 706 -5.790 -3.373 12.138 1.00 0.00 H new ATOM 0 HE ARG A 706 -8.652 -2.979 11.662 1.00 0.00 H new ATOM 0 HH11 ARG A 706 -5.839 -5.042 11.021 1.00 0.00 H new ATOM 0 HH12 ARG A 706 -6.823 -6.473 10.698 1.00 0.00 H new ATOM 0 HH21 ARG A 706 -9.897 -4.833 11.242 1.00 0.00 H new ATOM 0 HH22 ARG A 706 -9.104 -6.355 10.822 1.00 0.00 H new ATOM 771 N PHE A 707 -4.004 0.219 8.726 1.00 0.00 N ATOM 772 CA PHE A 707 -3.970 0.416 7.273 1.00 0.00 C ATOM 773 C PHE A 707 -3.913 -0.923 6.530 1.00 0.00 C ATOM 774 O PHE A 707 -3.743 -1.979 7.146 1.00 0.00 O ATOM 775 CB PHE A 707 -2.761 1.273 6.882 1.00 0.00 C ATOM 776 CG PHE A 707 -3.114 2.663 6.429 1.00 0.00 C ATOM 777 CD1 PHE A 707 -3.941 2.864 5.334 1.00 0.00 C ATOM 778 CD2 PHE A 707 -2.611 3.770 7.095 1.00 0.00 C ATOM 779 CE1 PHE A 707 -4.259 4.142 4.915 1.00 0.00 C ATOM 780 CE2 PHE A 707 -2.927 5.049 6.681 1.00 0.00 C ATOM 781 CZ PHE A 707 -3.751 5.236 5.588 1.00 0.00 C ATOM 0 H PHE A 707 -3.092 0.284 9.179 1.00 0.00 H new ATOM 0 HA PHE A 707 -4.888 0.929 6.986 1.00 0.00 H new ATOM 0 HB2 PHE A 707 -2.086 1.341 7.735 1.00 0.00 H new ATOM 0 HB3 PHE A 707 -2.216 0.770 6.084 1.00 0.00 H new ATOM 0 HD1 PHE A 707 -4.341 2.013 4.803 1.00 0.00 H new ATOM 0 HD2 PHE A 707 -1.964 3.630 7.948 1.00 0.00 H new ATOM 0 HE1 PHE A 707 -4.905 4.285 4.061 1.00 0.00 H new ATOM 0 HE2 PHE A 707 -2.530 5.902 7.211 1.00 0.00 H new ATOM 0 HZ PHE A 707 -3.997 6.235 5.261 1.00 0.00 H new ATOM 791 N ALA A 708 -4.051 -0.874 5.202 1.00 0.00 N ATOM 792 CA ALA A 708 -4.013 -2.084 4.378 1.00 0.00 C ATOM 793 C ALA A 708 -3.575 -1.780 2.943 1.00 0.00 C ATOM 794 O ALA A 708 -3.954 -0.757 2.372 1.00 0.00 O ATOM 795 CB ALA A 708 -5.372 -2.766 4.378 1.00 0.00 C ATOM 0 H ALA A 708 -4.190 -0.011 4.676 1.00 0.00 H new ATOM 0 HA ALA A 708 -3.274 -2.756 4.815 1.00 0.00 H new ATOM 0 HB1 ALA A 708 -5.329 -3.664 3.761 1.00 0.00 H new ATOM 0 HB2 ALA A 708 -5.642 -3.039 5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 708 -6.121 -2.085 3.974 1.00 0.00 H new ATOM 801 N ILE A 709 -2.779 -2.684 2.367 1.00 0.00 N ATOM 802 CA ILE A 709 -2.288 -2.528 0.997 1.00 0.00 C ATOM 803 C ILE A 709 -2.689 -3.729 0.140 1.00 0.00 C ATOM 804 O ILE A 709 -2.263 -4.855 0.398 1.00 0.00 O ATOM 805 CB ILE A 709 -0.750 -2.374 0.960 1.00 0.00 C ATOM 806 CG1 ILE A 709 -0.302 -1.257 1.909 1.00 0.00 C ATOM 807 CG2 ILE A 709 -0.273 -2.095 -0.458 1.00 0.00 C ATOM 808 CD1 ILE A 709 1.202 -1.084 1.973 1.00 0.00 C ATOM 0 H ILE A 709 -2.460 -3.535 2.831 1.00 0.00 H new ATOM 0 HA ILE A 709 -2.742 -1.622 0.595 1.00 0.00 H new ATOM 0 HB ILE A 709 -0.302 -3.310 1.293 1.00 0.00 H new ATOM 0 HG12 ILE A 709 -0.754 -0.318 1.591 1.00 0.00 H new ATOM 0 HG13 ILE A 709 -0.678 -1.469 2.910 1.00 0.00 H new ATOM 0 HG21 ILE A 709 0.812 -1.990 -0.463 1.00 0.00 H new ATOM 0 HG22 ILE A 709 -0.560 -2.922 -1.108 1.00 0.00 H new ATOM 0 HG23 ILE A 709 -0.728 -1.173 -0.820 1.00 0.00 H new ATOM 0 HD11 ILE A 709 1.446 -0.277 2.663 1.00 0.00 H new ATOM 0 HD12 ILE A 709 1.660 -2.010 2.321 1.00 0.00 H new ATOM 0 HD13 ILE A 709 1.583 -0.841 0.981 1.00 0.00 H new ATOM 820 N SER A 710 -3.512 -3.482 -0.878 1.00 0.00 N ATOM 821 CA SER A 710 -3.971 -4.544 -1.771 1.00 0.00 C ATOM 822 C SER A 710 -3.158 -4.570 -3.064 1.00 0.00 C ATOM 823 O SER A 710 -2.943 -3.536 -3.695 1.00 0.00 O ATOM 824 CB SER A 710 -5.456 -4.361 -2.089 1.00 0.00 C ATOM 825 OG SER A 710 -6.030 -5.568 -2.565 1.00 0.00 O ATOM 0 H SER A 710 -3.874 -2.556 -1.105 1.00 0.00 H new ATOM 0 HA SER A 710 -3.828 -5.497 -1.262 1.00 0.00 H new ATOM 0 HB2 SER A 710 -5.985 -4.032 -1.194 1.00 0.00 H new ATOM 0 HB3 SER A 710 -5.577 -3.578 -2.837 1.00 0.00 H new ATOM 0 HG SER A 710 -5.500 -6.329 -2.249 1.00 0.00 H new ATOM 831 N ILE A 711 -2.712 -5.765 -3.455 1.00 0.00 N ATOM 832 CA ILE A 711 -1.924 -5.931 -4.674 1.00 0.00 C ATOM 833 C ILE A 711 -2.493 -7.046 -5.559 1.00 0.00 C ATOM 834 O ILE A 711 -3.272 -7.883 -5.097 1.00 0.00 O ATOM 835 CB ILE A 711 -0.440 -6.220 -4.347 1.00 0.00 C ATOM 836 CG1 ILE A 711 0.457 -5.843 -5.529 1.00 0.00 C ATOM 837 CG2 ILE A 711 -0.244 -7.682 -3.977 1.00 0.00 C ATOM 838 CD1 ILE A 711 1.922 -5.723 -5.169 1.00 0.00 C ATOM 0 H ILE A 711 -2.884 -6.631 -2.944 1.00 0.00 H new ATOM 0 HA ILE A 711 -1.981 -4.992 -5.224 1.00 0.00 H new ATOM 0 HB ILE A 711 -0.157 -5.609 -3.490 1.00 0.00 H new ATOM 0 HG12 ILE A 711 0.345 -6.593 -6.312 1.00 0.00 H new ATOM 0 HG13 ILE A 711 0.116 -4.895 -5.945 1.00 0.00 H new ATOM 0 HG21 ILE A 711 0.807 -7.862 -3.751 1.00 0.00 H new ATOM 0 HG22 ILE A 711 -0.849 -7.920 -3.102 1.00 0.00 H new ATOM 0 HG23 ILE A 711 -0.549 -8.313 -4.812 1.00 0.00 H new ATOM 0 HD11 ILE A 711 2.494 -5.454 -6.057 1.00 0.00 H new ATOM 0 HD12 ILE A 711 2.048 -4.952 -4.409 1.00 0.00 H new ATOM 0 HD13 ILE A 711 2.281 -6.677 -4.782 1.00 0.00 H new ATOM 850 N LYS A 712 -2.102 -7.040 -6.834 1.00 0.00 N ATOM 851 CA LYS A 712 -2.575 -8.037 -7.796 1.00 0.00 C ATOM 852 C LYS A 712 -1.451 -8.983 -8.217 1.00 0.00 C ATOM 853 O LYS A 712 -0.456 -8.559 -8.809 1.00 0.00 O ATOM 854 CB LYS A 712 -3.162 -7.334 -9.029 1.00 0.00 C ATOM 855 CG LYS A 712 -3.653 -8.283 -10.115 1.00 0.00 C ATOM 856 CD LYS A 712 -4.628 -9.316 -9.569 1.00 0.00 C ATOM 857 CE LYS A 712 -4.974 -10.365 -10.616 1.00 0.00 C ATOM 858 NZ LYS A 712 -3.762 -11.062 -11.133 1.00 0.00 N ATOM 0 H LYS A 712 -1.457 -6.354 -7.226 1.00 0.00 H new ATOM 0 HA LYS A 712 -3.350 -8.632 -7.313 1.00 0.00 H new ATOM 0 HB2 LYS A 712 -3.992 -6.702 -8.712 1.00 0.00 H new ATOM 0 HB3 LYS A 712 -2.404 -6.676 -9.453 1.00 0.00 H new ATOM 0 HG2 LYS A 712 -4.137 -7.710 -10.906 1.00 0.00 H new ATOM 0 HG3 LYS A 712 -2.800 -8.791 -10.565 1.00 0.00 H new ATOM 0 HD2 LYS A 712 -4.193 -9.802 -8.695 1.00 0.00 H new ATOM 0 HD3 LYS A 712 -5.539 -8.818 -9.237 1.00 0.00 H new ATOM 0 HE2 LYS A 712 -5.656 -11.097 -10.183 1.00 0.00 H new ATOM 0 HE3 LYS A 712 -5.500 -9.890 -11.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 712 -4.050 -11.886 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 712 -3.213 -10.409 -11.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 712 -3.176 -11.378 -10.334 1.00 0.00 H new ATOM 872 N PHE A 713 -1.626 -10.270 -7.918 1.00 0.00 N ATOM 873 CA PHE A 713 -0.638 -11.290 -8.268 1.00 0.00 C ATOM 874 C PHE A 713 -1.193 -12.689 -8.000 1.00 0.00 C ATOM 875 O PHE A 713 -2.055 -12.863 -7.139 1.00 0.00 O ATOM 876 CB PHE A 713 0.651 -11.084 -7.469 1.00 0.00 C ATOM 877 CG PHE A 713 1.894 -11.463 -8.221 1.00 0.00 C ATOM 878 CD1 PHE A 713 2.226 -10.826 -9.407 1.00 0.00 C ATOM 879 CD2 PHE A 713 2.736 -12.451 -7.737 1.00 0.00 C ATOM 880 CE1 PHE A 713 3.372 -11.172 -10.096 1.00 0.00 C ATOM 881 CE2 PHE A 713 3.883 -12.801 -8.420 1.00 0.00 C ATOM 882 CZ PHE A 713 4.203 -12.161 -9.603 1.00 0.00 C ATOM 0 H PHE A 713 -2.447 -10.632 -7.432 1.00 0.00 H new ATOM 0 HA PHE A 713 -0.415 -11.196 -9.331 1.00 0.00 H new ATOM 0 HB2 PHE A 713 0.721 -10.037 -7.173 1.00 0.00 H new ATOM 0 HB3 PHE A 713 0.598 -11.672 -6.553 1.00 0.00 H new ATOM 0 HD1 PHE A 713 1.582 -10.051 -9.796 1.00 0.00 H new ATOM 0 HD2 PHE A 713 2.492 -12.954 -6.813 1.00 0.00 H new ATOM 0 HE1 PHE A 713 3.619 -10.670 -11.020 1.00 0.00 H new ATOM 0 HE2 PHE A 713 4.530 -13.574 -8.031 1.00 0.00 H new ATOM 0 HZ PHE A 713 5.099 -12.433 -10.140 1.00 0.00 H new ATOM 892 N ASN A 714 -0.695 -13.679 -8.744 1.00 0.00 N ATOM 893 CA ASN A 714 -1.144 -15.063 -8.587 1.00 0.00 C ATOM 894 C ASN A 714 -2.658 -15.176 -8.787 1.00 0.00 C ATOM 895 O ASN A 714 -3.320 -15.994 -8.146 1.00 0.00 O ATOM 896 CB ASN A 714 -0.754 -15.594 -7.202 1.00 0.00 C ATOM 897 CG ASN A 714 -0.441 -17.079 -7.213 1.00 0.00 C ATOM 898 OD1 ASN A 714 0.815 -17.424 -6.951 1.00 0.00 O flip ATOM 899 ND2 ASN A 714 -1.317 -17.908 -7.456 1.00 0.00 N flip ATOM 0 H ASN A 714 0.019 -13.548 -9.461 1.00 0.00 H new ATOM 0 HA ASN A 714 -0.653 -15.666 -9.351 1.00 0.00 H new ATOM 0 HB2 ASN A 714 0.115 -15.046 -6.838 1.00 0.00 H new ATOM 0 HB3 ASN A 714 -1.567 -15.403 -6.502 1.00 0.00 H new ATOM 0 HD21 ASN A 714 -2.270 -17.601 -7.652 1.00 0.00 H new ATOM 0 HD22 ASN A 714 -1.091 -18.903 -7.461 1.00 0.00 H new ATOM 906 N ASP A 715 -3.198 -14.343 -9.681 1.00 0.00 N ATOM 907 CA ASP A 715 -4.633 -14.332 -9.973 1.00 0.00 C ATOM 908 C ASP A 715 -5.470 -14.176 -8.697 1.00 0.00 C ATOM 909 O ASP A 715 -6.594 -14.672 -8.617 1.00 0.00 O ATOM 910 CB ASP A 715 -5.036 -15.609 -10.715 1.00 0.00 C ATOM 911 CG ASP A 715 -5.890 -15.314 -11.933 1.00 0.00 C ATOM 912 OD1 ASP A 715 -7.110 -15.105 -11.769 1.00 0.00 O ATOM 913 OD2 ASP A 715 -5.335 -15.284 -13.052 1.00 0.00 O ATOM 0 H ASP A 715 -2.659 -13.664 -10.218 1.00 0.00 H new ATOM 0 HA ASP A 715 -4.832 -13.470 -10.610 1.00 0.00 H new ATOM 0 HB2 ASP A 715 -4.140 -16.147 -11.023 1.00 0.00 H new ATOM 0 HB3 ASP A 715 -5.584 -16.264 -10.038 1.00 0.00 H new ATOM 918 N GLU A 716 -4.914 -13.479 -7.706 1.00 0.00 N ATOM 919 CA GLU A 716 -5.607 -13.256 -6.439 1.00 0.00 C ATOM 920 C GLU A 716 -5.266 -11.880 -5.868 1.00 0.00 C ATOM 921 O GLU A 716 -4.141 -11.396 -6.018 1.00 0.00 O ATOM 922 CB GLU A 716 -5.234 -14.347 -5.431 1.00 0.00 C ATOM 923 CG GLU A 716 -6.198 -15.527 -5.417 1.00 0.00 C ATOM 924 CD GLU A 716 -6.360 -16.140 -4.038 1.00 0.00 C ATOM 925 OE1 GLU A 716 -6.648 -15.386 -3.083 1.00 0.00 O ATOM 926 OE2 GLU A 716 -6.205 -17.374 -3.913 1.00 0.00 O ATOM 0 H GLU A 716 -3.986 -13.059 -7.757 1.00 0.00 H new ATOM 0 HA GLU A 716 -6.680 -13.296 -6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -4.232 -14.711 -5.658 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -5.196 -13.909 -4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -7.172 -15.199 -5.780 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -5.841 -16.290 -6.109 1.00 0.00 H new ATOM 933 N VAL A 717 -6.243 -11.256 -5.211 1.00 0.00 N ATOM 934 CA VAL A 717 -6.052 -9.935 -4.614 1.00 0.00 C ATOM 935 C VAL A 717 -5.565 -10.052 -3.166 1.00 0.00 C ATOM 936 O VAL A 717 -6.360 -10.257 -2.247 1.00 0.00 O ATOM 937 CB VAL A 717 -7.359 -9.111 -4.651 1.00 0.00 C ATOM 938 CG1 VAL A 717 -7.110 -7.686 -4.187 1.00 0.00 C ATOM 939 CG2 VAL A 717 -7.964 -9.124 -6.048 1.00 0.00 C ATOM 0 H VAL A 717 -7.177 -11.645 -5.079 1.00 0.00 H new ATOM 0 HA VAL A 717 -5.294 -9.421 -5.205 1.00 0.00 H new ATOM 0 HB VAL A 717 -8.071 -9.572 -3.967 1.00 0.00 H new ATOM 0 HG11 VAL A 717 -8.043 -7.124 -4.221 1.00 0.00 H new ATOM 0 HG12 VAL A 717 -6.730 -7.697 -3.165 1.00 0.00 H new ATOM 0 HG13 VAL A 717 -6.378 -7.213 -4.841 1.00 0.00 H new ATOM 0 HG21 VAL A 717 -8.883 -8.538 -6.052 1.00 0.00 H new ATOM 0 HG22 VAL A 717 -7.256 -8.693 -6.755 1.00 0.00 H new ATOM 0 HG23 VAL A 717 -8.187 -10.151 -6.338 1.00 0.00 H new ATOM 949 N LYS A 718 -4.249 -9.933 -2.975 1.00 0.00 N ATOM 950 CA LYS A 718 -3.643 -10.035 -1.645 1.00 0.00 C ATOM 951 C LYS A 718 -3.869 -8.762 -0.825 1.00 0.00 C ATOM 952 O LYS A 718 -4.273 -7.728 -1.361 1.00 0.00 O ATOM 953 CB LYS A 718 -2.143 -10.315 -1.766 1.00 0.00 C ATOM 954 CG LYS A 718 -1.800 -11.792 -1.894 1.00 0.00 C ATOM 955 CD LYS A 718 -2.049 -12.313 -3.304 1.00 0.00 C ATOM 956 CE LYS A 718 -0.836 -12.109 -4.201 1.00 0.00 C ATOM 957 NZ LYS A 718 -0.478 -10.669 -4.342 1.00 0.00 N ATOM 0 H LYS A 718 -3.581 -9.765 -3.727 1.00 0.00 H new ATOM 0 HA LYS A 718 -4.126 -10.863 -1.125 1.00 0.00 H new ATOM 0 HB2 LYS A 718 -1.753 -9.785 -2.635 1.00 0.00 H new ATOM 0 HB3 LYS A 718 -1.636 -9.909 -0.891 1.00 0.00 H new ATOM 0 HG2 LYS A 718 -0.754 -11.946 -1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 718 -2.396 -12.366 -1.184 1.00 0.00 H new ATOM 0 HD2 LYS A 718 -2.296 -13.374 -3.262 1.00 0.00 H new ATOM 0 HD3 LYS A 718 -2.910 -11.802 -3.734 1.00 0.00 H new ATOM 0 HE2 LYS A 718 0.014 -12.655 -3.790 1.00 0.00 H new ATOM 0 HE3 LYS A 718 -1.039 -12.530 -5.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 0.299 -10.570 -5.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 -1.306 -10.137 -4.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 -0.177 -10.294 -3.420 1.00 0.00 H new ATOM 971 N HIS A 719 -3.601 -8.849 0.482 1.00 0.00 N ATOM 972 CA HIS A 719 -3.770 -7.708 1.382 1.00 0.00 C ATOM 973 C HIS A 719 -2.671 -7.668 2.447 1.00 0.00 C ATOM 974 O HIS A 719 -2.528 -8.600 3.239 1.00 0.00 O ATOM 975 CB HIS A 719 -5.141 -7.766 2.066 1.00 0.00 C ATOM 976 CG HIS A 719 -6.271 -7.325 1.188 1.00 0.00 C ATOM 977 ND1 HIS A 719 -7.053 -8.025 0.334 1.00 0.00 N flip ATOM 978 CD2 HIS A 719 -6.712 -6.020 1.127 1.00 0.00 C flip ATOM 979 CE1 HIS A 719 -7.944 -7.141 -0.222 1.00 0.00 C flip ATOM 980 NE2 HIS A 719 -7.718 -5.938 0.276 1.00 0.00 N flip ATOM 0 H HIS A 719 -3.267 -9.698 0.938 1.00 0.00 H new ATOM 0 HA HIS A 719 -3.700 -6.802 0.779 1.00 0.00 H new ATOM 0 HB2 HIS A 719 -5.328 -8.787 2.399 1.00 0.00 H new ATOM 0 HB3 HIS A 719 -5.119 -7.139 2.957 1.00 0.00 H new ATOM 0 HD1 HIS A 719 -6.992 -9.024 0.139 1.00 0.00 H new ATOM 0 HD2 HIS A 719 -6.299 -5.194 1.688 1.00 0.00 H new ATOM 0 HE1 HIS A 719 -8.705 -7.388 -0.947 1.00 0.00 H new ATOM 989 N ILE A 720 -1.903 -6.574 2.463 1.00 0.00 N ATOM 990 CA ILE A 720 -0.820 -6.394 3.433 1.00 0.00 C ATOM 991 C ILE A 720 -1.227 -5.385 4.513 1.00 0.00 C ATOM 992 O ILE A 720 -1.761 -4.321 4.204 1.00 0.00 O ATOM 993 CB ILE A 720 0.479 -5.898 2.751 1.00 0.00 C ATOM 994 CG1 ILE A 720 0.810 -6.754 1.524 1.00 0.00 C ATOM 995 CG2 ILE A 720 1.644 -5.909 3.733 1.00 0.00 C ATOM 996 CD1 ILE A 720 1.790 -6.099 0.575 1.00 0.00 C ATOM 0 H ILE A 720 -2.013 -5.797 1.812 1.00 0.00 H new ATOM 0 HA ILE A 720 -0.631 -7.367 3.886 1.00 0.00 H new ATOM 0 HB ILE A 720 0.315 -4.872 2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 720 1.221 -7.707 1.857 1.00 0.00 H new ATOM 0 HG13 ILE A 720 -0.112 -6.975 0.986 1.00 0.00 H new ATOM 0 HG21 ILE A 720 2.546 -5.557 3.232 1.00 0.00 H new ATOM 0 HG22 ILE A 720 1.417 -5.254 4.574 1.00 0.00 H new ATOM 0 HG23 ILE A 720 1.804 -6.924 4.096 1.00 0.00 H new ATOM 0 HD11 ILE A 720 1.977 -6.762 -0.270 1.00 0.00 H new ATOM 0 HD12 ILE A 720 1.373 -5.159 0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 720 2.727 -5.903 1.097 1.00 0.00 H new ATOM 1008 N LYS A 721 -0.975 -5.727 5.779 1.00 0.00 N ATOM 1009 CA LYS A 721 -1.322 -4.844 6.898 1.00 0.00 C ATOM 1010 C LYS A 721 -0.206 -3.841 7.185 1.00 0.00 C ATOM 1011 O LYS A 721 0.966 -4.210 7.277 1.00 0.00 O ATOM 1012 CB LYS A 721 -1.621 -5.663 8.159 1.00 0.00 C ATOM 1013 CG LYS A 721 -2.973 -5.350 8.786 1.00 0.00 C ATOM 1014 CD LYS A 721 -3.001 -3.957 9.403 1.00 0.00 C ATOM 1015 CE LYS A 721 -2.735 -3.999 10.903 1.00 0.00 C ATOM 1016 NZ LYS A 721 -1.973 -2.804 11.374 1.00 0.00 N ATOM 0 H LYS A 721 -0.534 -6.604 6.055 1.00 0.00 H new ATOM 0 HA LYS A 721 -2.215 -4.289 6.611 1.00 0.00 H new ATOM 0 HB2 LYS A 721 -1.583 -6.724 7.910 1.00 0.00 H new ATOM 0 HB3 LYS A 721 -0.838 -5.480 8.895 1.00 0.00 H new ATOM 0 HG2 LYS A 721 -3.752 -5.428 8.028 1.00 0.00 H new ATOM 0 HG3 LYS A 721 -3.199 -6.092 9.552 1.00 0.00 H new ATOM 0 HD2 LYS A 721 -2.253 -3.329 8.918 1.00 0.00 H new ATOM 0 HD3 LYS A 721 -3.972 -3.497 9.218 1.00 0.00 H new ATOM 0 HE2 LYS A 721 -3.683 -4.057 11.437 1.00 0.00 H new ATOM 0 HE3 LYS A 721 -2.177 -4.903 11.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 721 -1.257 -3.100 12.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 721 -1.504 -2.350 10.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 721 -2.627 -2.128 11.818 1.00 0.00 H new ATOM 1030 N VAL A 722 -0.582 -2.569 7.329 1.00 0.00 N ATOM 1031 CA VAL A 722 0.380 -1.503 7.608 1.00 0.00 C ATOM 1032 C VAL A 722 0.126 -0.870 8.978 1.00 0.00 C ATOM 1033 O VAL A 722 -0.999 -0.890 9.483 1.00 0.00 O ATOM 1034 CB VAL A 722 0.330 -0.400 6.528 1.00 0.00 C ATOM 1035 CG1 VAL A 722 1.536 0.519 6.638 1.00 0.00 C ATOM 1036 CG2 VAL A 722 0.248 -1.009 5.136 1.00 0.00 C ATOM 0 H VAL A 722 -1.549 -2.252 7.257 1.00 0.00 H new ATOM 0 HA VAL A 722 1.368 -1.963 7.602 1.00 0.00 H new ATOM 0 HB VAL A 722 -0.569 0.194 6.695 1.00 0.00 H new ATOM 0 HG11 VAL A 722 1.479 1.288 5.867 1.00 0.00 H new ATOM 0 HG12 VAL A 722 1.546 0.990 7.621 1.00 0.00 H new ATOM 0 HG13 VAL A 722 2.449 -0.061 6.505 1.00 0.00 H new ATOM 0 HG21 VAL A 722 0.214 -0.213 4.392 1.00 0.00 H new ATOM 0 HG22 VAL A 722 1.124 -1.633 4.960 1.00 0.00 H new ATOM 0 HG23 VAL A 722 -0.653 -1.618 5.058 1.00 0.00 H new ATOM 1046 N VAL A 723 1.183 -0.312 9.572 1.00 0.00 N ATOM 1047 CA VAL A 723 1.089 0.327 10.885 1.00 0.00 C ATOM 1048 C VAL A 723 1.593 1.770 10.833 1.00 0.00 C ATOM 1049 O VAL A 723 2.785 2.013 10.635 1.00 0.00 O ATOM 1050 CB VAL A 723 1.901 -0.447 11.947 1.00 0.00 C ATOM 1051 CG1 VAL A 723 1.641 0.113 13.339 1.00 0.00 C ATOM 1052 CG2 VAL A 723 1.580 -1.933 11.898 1.00 0.00 C ATOM 0 H VAL A 723 2.117 -0.290 9.162 1.00 0.00 H new ATOM 0 HA VAL A 723 0.035 0.320 11.164 1.00 0.00 H new ATOM 0 HB VAL A 723 2.960 -0.321 11.720 1.00 0.00 H new ATOM 0 HG11 VAL A 723 2.223 -0.447 14.071 1.00 0.00 H new ATOM 0 HG12 VAL A 723 1.933 1.163 13.369 1.00 0.00 H new ATOM 0 HG13 VAL A 723 0.580 0.025 13.574 1.00 0.00 H new ATOM 0 HG21 VAL A 723 2.164 -2.457 12.655 1.00 0.00 H new ATOM 0 HG22 VAL A 723 0.518 -2.082 12.092 1.00 0.00 H new ATOM 0 HG23 VAL A 723 1.828 -2.326 10.912 1.00 0.00 H new ATOM 1062 N GLU A 724 0.678 2.725 11.016 1.00 0.00 N ATOM 1063 CA GLU A 724 1.033 4.144 10.993 1.00 0.00 C ATOM 1064 C GLU A 724 1.454 4.622 12.383 1.00 0.00 C ATOM 1065 O GLU A 724 0.611 4.918 13.231 1.00 0.00 O ATOM 1066 CB GLU A 724 -0.145 4.980 10.481 1.00 0.00 C ATOM 1067 CG GLU A 724 0.243 6.396 10.081 1.00 0.00 C ATOM 1068 CD GLU A 724 -0.907 7.378 10.211 1.00 0.00 C ATOM 1069 OE1 GLU A 724 -1.331 7.651 11.354 1.00 0.00 O ATOM 1070 OE2 GLU A 724 -1.381 7.876 9.169 1.00 0.00 O ATOM 0 H GLU A 724 -0.312 2.541 11.181 1.00 0.00 H new ATOM 0 HA GLU A 724 1.877 4.272 10.315 1.00 0.00 H new ATOM 0 HB2 GLU A 724 -0.590 4.478 9.622 1.00 0.00 H new ATOM 0 HB3 GLU A 724 -0.911 5.027 11.255 1.00 0.00 H new ATOM 0 HG2 GLU A 724 1.073 6.730 10.704 1.00 0.00 H new ATOM 0 HG3 GLU A 724 0.598 6.393 9.051 1.00 0.00 H new ATOM 1077 N LYS A 725 2.765 4.696 12.605 1.00 0.00 N ATOM 1078 CA LYS A 725 3.307 5.140 13.887 1.00 0.00 C ATOM 1079 C LYS A 725 3.144 6.649 14.059 1.00 0.00 C ATOM 1080 O LYS A 725 2.629 7.331 13.172 1.00 0.00 O ATOM 1081 CB LYS A 725 4.788 4.768 13.997 1.00 0.00 C ATOM 1082 CG LYS A 725 5.034 3.275 14.125 1.00 0.00 C ATOM 1083 CD LYS A 725 4.659 2.762 15.506 1.00 0.00 C ATOM 1084 CE LYS A 725 5.591 1.649 15.960 1.00 0.00 C ATOM 1085 NZ LYS A 725 6.055 1.838 17.363 1.00 0.00 N ATOM 0 H LYS A 725 3.473 4.453 11.912 1.00 0.00 H new ATOM 0 HA LYS A 725 2.749 4.637 14.677 1.00 0.00 H new ATOM 0 HB2 LYS A 725 5.313 5.140 13.117 1.00 0.00 H new ATOM 0 HB3 LYS A 725 5.217 5.274 14.862 1.00 0.00 H new ATOM 0 HG2 LYS A 725 4.455 2.744 13.369 1.00 0.00 H new ATOM 0 HG3 LYS A 725 6.085 3.061 13.930 1.00 0.00 H new ATOM 0 HD2 LYS A 725 4.695 3.583 16.222 1.00 0.00 H new ATOM 0 HD3 LYS A 725 3.633 2.396 15.493 1.00 0.00 H new ATOM 0 HE2 LYS A 725 5.078 0.691 15.875 1.00 0.00 H new ATOM 0 HE3 LYS A 725 6.455 1.608 15.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 725 6.687 1.056 17.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 725 6.568 2.739 17.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 725 5.234 1.851 18.001 1.00 0.00 H new ATOM 1099 N ASP A 726 3.593 7.163 15.205 1.00 0.00 N ATOM 1100 CA ASP A 726 3.506 8.594 15.496 1.00 0.00 C ATOM 1101 C ASP A 726 4.102 9.418 14.356 1.00 0.00 C ATOM 1102 O ASP A 726 3.541 10.437 13.955 1.00 0.00 O ATOM 1103 CB ASP A 726 4.226 8.924 16.808 1.00 0.00 C ATOM 1104 CG ASP A 726 3.298 9.503 17.861 1.00 0.00 C ATOM 1105 OD1 ASP A 726 2.383 10.273 17.495 1.00 0.00 O ATOM 1106 OD2 ASP A 726 3.489 9.190 19.054 1.00 0.00 O ATOM 0 H ASP A 726 4.021 6.609 15.947 1.00 0.00 H new ATOM 0 HA ASP A 726 2.452 8.850 15.598 1.00 0.00 H new ATOM 0 HB2 ASP A 726 4.691 8.019 17.199 1.00 0.00 H new ATOM 0 HB3 ASP A 726 5.028 9.634 16.608 1.00 0.00 H new ATOM 1111 N ASN A 727 5.240 8.961 13.837 1.00 0.00 N ATOM 1112 CA ASN A 727 5.916 9.642 12.740 1.00 0.00 C ATOM 1113 C ASN A 727 6.644 8.642 11.833 1.00 0.00 C ATOM 1114 O ASN A 727 7.644 8.980 11.197 1.00 0.00 O ATOM 1115 CB ASN A 727 6.904 10.673 13.298 1.00 0.00 C ATOM 1116 CG ASN A 727 6.996 11.923 12.440 1.00 0.00 C ATOM 1117 OD1 ASN A 727 6.607 11.921 11.272 1.00 0.00 O ATOM 1118 ND2 ASN A 727 7.514 13.002 13.019 1.00 0.00 N ATOM 0 H ASN A 727 5.713 8.118 14.162 1.00 0.00 H new ATOM 0 HA ASN A 727 5.165 10.154 12.138 1.00 0.00 H new ATOM 0 HB2 ASN A 727 6.600 10.952 14.307 1.00 0.00 H new ATOM 0 HB3 ASN A 727 7.891 10.218 13.377 1.00 0.00 H new ATOM 0 HD21 ASN A 727 7.601 13.871 12.492 1.00 0.00 H new ATOM 0 HD22 ASN A 727 7.824 12.961 13.990 1.00 0.00 H new ATOM 1125 N TRP A 728 6.137 7.405 11.783 1.00 0.00 N ATOM 1126 CA TRP A 728 6.744 6.359 10.960 1.00 0.00 C ATOM 1127 C TRP A 728 5.677 5.454 10.339 1.00 0.00 C ATOM 1128 O TRP A 728 4.486 5.601 10.616 1.00 0.00 O ATOM 1129 CB TRP A 728 7.710 5.510 11.796 1.00 0.00 C ATOM 1130 CG TRP A 728 8.671 6.315 12.622 1.00 0.00 C ATOM 1131 CD1 TRP A 728 8.385 7.018 13.756 1.00 0.00 C ATOM 1132 CD2 TRP A 728 10.072 6.490 12.380 1.00 0.00 C ATOM 1133 NE1 TRP A 728 9.522 7.622 14.234 1.00 0.00 N ATOM 1134 CE2 TRP A 728 10.571 7.313 13.408 1.00 0.00 C ATOM 1135 CE3 TRP A 728 10.951 6.032 11.394 1.00 0.00 C ATOM 1136 CZ2 TRP A 728 11.913 7.685 13.476 1.00 0.00 C ATOM 1137 CZ3 TRP A 728 12.280 6.402 11.464 1.00 0.00 C ATOM 1138 CH2 TRP A 728 12.751 7.220 12.499 1.00 0.00 C ATOM 0 H TRP A 728 5.311 7.107 12.302 1.00 0.00 H new ATOM 0 HA TRP A 728 7.295 6.850 10.158 1.00 0.00 H new ATOM 0 HB2 TRP A 728 7.132 4.864 12.456 1.00 0.00 H new ATOM 0 HB3 TRP A 728 8.276 4.859 11.129 1.00 0.00 H new ATOM 0 HD1 TRP A 728 7.408 7.089 14.211 1.00 0.00 H new ATOM 0 HE1 TRP A 728 9.577 8.206 15.069 1.00 0.00 H new ATOM 0 HE3 TRP A 728 10.597 5.401 10.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 728 12.278 8.318 14.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 728 12.968 6.055 10.707 1.00 0.00 H new ATOM 0 HH2 TRP A 728 13.797 7.489 12.527 1.00 0.00 H new ATOM 1149 N ILE A 729 6.118 4.510 9.502 1.00 0.00 N ATOM 1150 CA ILE A 729 5.207 3.572 8.845 1.00 0.00 C ATOM 1151 C ILE A 729 5.931 2.285 8.433 1.00 0.00 C ATOM 1152 O ILE A 729 7.017 2.332 7.851 1.00 0.00 O ATOM 1153 CB ILE A 729 4.540 4.212 7.605 1.00 0.00 C ATOM 1154 CG1 ILE A 729 3.469 3.279 7.029 1.00 0.00 C ATOM 1155 CG2 ILE A 729 5.579 4.557 6.546 1.00 0.00 C ATOM 1156 CD1 ILE A 729 2.056 3.744 7.301 1.00 0.00 C ATOM 0 H ILE A 729 7.101 4.376 9.264 1.00 0.00 H new ATOM 0 HA ILE A 729 4.433 3.321 9.570 1.00 0.00 H new ATOM 0 HB ILE A 729 4.058 5.138 7.918 1.00 0.00 H new ATOM 0 HG12 ILE A 729 3.614 3.193 5.952 1.00 0.00 H new ATOM 0 HG13 ILE A 729 3.602 2.282 7.449 1.00 0.00 H new ATOM 0 HG21 ILE A 729 5.085 5.006 5.684 1.00 0.00 H new ATOM 0 HG22 ILE A 729 6.299 5.263 6.959 1.00 0.00 H new ATOM 0 HG23 ILE A 729 6.097 3.650 6.236 1.00 0.00 H new ATOM 0 HD11 ILE A 729 1.350 3.037 6.865 1.00 0.00 H new ATOM 0 HD12 ILE A 729 1.893 3.803 8.377 1.00 0.00 H new ATOM 0 HD13 ILE A 729 1.905 4.728 6.857 1.00 0.00 H new ATOM 1168 N HIS A 730 5.321 1.138 8.737 1.00 0.00 N ATOM 1169 CA HIS A 730 5.906 -0.161 8.399 1.00 0.00 C ATOM 1170 C HIS A 730 4.849 -1.264 8.376 1.00 0.00 C ATOM 1171 O HIS A 730 3.843 -1.189 9.084 1.00 0.00 O ATOM 1172 CB HIS A 730 7.020 -0.525 9.388 1.00 0.00 C ATOM 1173 CG HIS A 730 6.541 -0.745 10.793 1.00 0.00 C ATOM 1174 ND1 HIS A 730 5.903 -1.798 11.358 1.00 0.00 N flip ATOM 1175 CD2 HIS A 730 6.715 0.181 11.800 1.00 0.00 C flip ATOM 1176 CE1 HIS A 730 5.709 -1.493 12.682 1.00 0.00 C flip ATOM 1177 NE2 HIS A 730 6.208 -0.295 12.925 1.00 0.00 N flip ATOM 0 H HIS A 730 4.422 1.082 9.216 1.00 0.00 H new ATOM 0 HA HIS A 730 6.330 -0.077 7.398 1.00 0.00 H new ATOM 0 HB2 HIS A 730 7.520 -1.429 9.040 1.00 0.00 H new ATOM 0 HB3 HIS A 730 7.765 0.271 9.389 1.00 0.00 H new ATOM 0 HD1 HIS A 730 5.620 -2.657 10.887 1.00 0.00 H new ATOM 0 HD2 HIS A 730 7.191 1.144 11.688 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.226 -2.130 13.408 1.00 0.00 H new ATOM 1186 N ILE A 731 5.093 -2.289 7.561 1.00 0.00 N ATOM 1187 CA ILE A 731 4.175 -3.422 7.441 1.00 0.00 C ATOM 1188 C ILE A 731 4.603 -4.587 8.337 1.00 0.00 C ATOM 1189 O ILE A 731 3.769 -5.385 8.768 1.00 0.00 O ATOM 1190 CB ILE A 731 4.068 -3.926 5.982 1.00 0.00 C ATOM 1191 CG1 ILE A 731 5.461 -4.158 5.378 1.00 0.00 C ATOM 1192 CG2 ILE A 731 3.272 -2.940 5.140 1.00 0.00 C ATOM 1193 CD1 ILE A 731 5.437 -4.936 4.080 1.00 0.00 C ATOM 0 H ILE A 731 5.922 -2.359 6.971 1.00 0.00 H new ATOM 0 HA ILE A 731 3.199 -3.058 7.762 1.00 0.00 H new ATOM 0 HB ILE A 731 3.542 -4.881 5.986 1.00 0.00 H new ATOM 0 HG12 ILE A 731 5.938 -3.193 5.205 1.00 0.00 H new ATOM 0 HG13 ILE A 731 6.077 -4.693 6.101 1.00 0.00 H new ATOM 0 HG21 ILE A 731 3.205 -3.307 4.116 1.00 0.00 H new ATOM 0 HG22 ILE A 731 2.269 -2.834 5.554 1.00 0.00 H new ATOM 0 HG23 ILE A 731 3.771 -1.971 5.146 1.00 0.00 H new ATOM 0 HD11 ILE A 731 6.455 -5.062 3.712 1.00 0.00 H new ATOM 0 HD12 ILE A 731 4.990 -5.915 4.251 1.00 0.00 H new ATOM 0 HD13 ILE A 731 4.849 -4.392 3.341 1.00 0.00 H new ATOM 1205 N THR A 732 5.907 -4.678 8.610 1.00 0.00 N ATOM 1206 CA THR A 732 6.452 -5.742 9.452 1.00 0.00 C ATOM 1207 C THR A 732 7.729 -5.271 10.150 1.00 0.00 C ATOM 1208 O THR A 732 8.071 -4.087 10.097 1.00 0.00 O ATOM 1209 CB THR A 732 6.731 -6.997 8.607 1.00 0.00 C ATOM 1210 OG1 THR A 732 7.192 -8.064 9.418 1.00 0.00 O ATOM 1211 CG2 THR A 732 7.755 -6.779 7.510 1.00 0.00 C ATOM 0 H THR A 732 6.606 -4.024 8.258 1.00 0.00 H new ATOM 0 HA THR A 732 5.717 -5.993 10.216 1.00 0.00 H new ATOM 0 HB THR A 732 5.775 -7.238 8.142 1.00 0.00 H new ATOM 0 HG1 THR A 732 7.361 -8.851 8.859 1.00 0.00 H new ATOM 0 HG21 THR A 732 7.899 -7.707 6.957 1.00 0.00 H new ATOM 0 HG22 THR A 732 7.401 -6.003 6.831 1.00 0.00 H new ATOM 0 HG23 THR A 732 8.702 -6.469 7.952 1.00 0.00 H new ATOM 1219 N GLU A 733 8.436 -6.198 10.794 1.00 0.00 N ATOM 1220 CA GLU A 733 9.678 -5.870 11.489 1.00 0.00 C ATOM 1221 C GLU A 733 10.895 -6.151 10.604 1.00 0.00 C ATOM 1222 O GLU A 733 11.943 -6.582 11.089 1.00 0.00 O ATOM 1223 CB GLU A 733 9.782 -6.662 12.796 1.00 0.00 C ATOM 1224 CG GLU A 733 8.827 -6.177 13.876 1.00 0.00 C ATOM 1225 CD GLU A 733 7.792 -7.218 14.247 1.00 0.00 C ATOM 1226 OE1 GLU A 733 6.819 -7.386 13.482 1.00 0.00 O ATOM 1227 OE2 GLU A 733 7.955 -7.868 15.301 1.00 0.00 O ATOM 0 H GLU A 733 8.170 -7.181 10.849 1.00 0.00 H new ATOM 0 HA GLU A 733 9.664 -4.805 11.720 1.00 0.00 H new ATOM 0 HB2 GLU A 733 9.583 -7.714 12.591 1.00 0.00 H new ATOM 0 HB3 GLU A 733 10.804 -6.598 13.170 1.00 0.00 H new ATOM 0 HG2 GLU A 733 9.397 -5.904 14.764 1.00 0.00 H new ATOM 0 HG3 GLU A 733 8.322 -5.275 13.531 1.00 0.00 H new ATOM 1234 N ALA A 734 10.749 -5.897 9.302 1.00 0.00 N ATOM 1235 CA ALA A 734 11.836 -6.113 8.351 1.00 0.00 C ATOM 1236 C ALA A 734 12.423 -4.788 7.868 1.00 0.00 C ATOM 1237 O ALA A 734 13.635 -4.675 7.673 1.00 0.00 O ATOM 1238 CB ALA A 734 11.350 -6.943 7.171 1.00 0.00 C ATOM 0 H ALA A 734 9.889 -5.542 8.884 1.00 0.00 H new ATOM 0 HA ALA A 734 12.627 -6.660 8.863 1.00 0.00 H new ATOM 0 HB1 ALA A 734 12.171 -7.096 6.471 1.00 0.00 H new ATOM 0 HB2 ALA A 734 10.993 -7.909 7.528 1.00 0.00 H new ATOM 0 HB3 ALA A 734 10.537 -6.419 6.668 1.00 0.00 H new ATOM 1244 N LYS A 735 11.561 -3.784 7.680 1.00 0.00 N ATOM 1245 CA LYS A 735 11.998 -2.468 7.222 1.00 0.00 C ATOM 1246 C LYS A 735 10.963 -1.395 7.568 1.00 0.00 C ATOM 1247 O LYS A 735 9.800 -1.494 7.171 1.00 0.00 O ATOM 1248 CB LYS A 735 12.244 -2.484 5.710 1.00 0.00 C ATOM 1249 CG LYS A 735 13.715 -2.454 5.326 1.00 0.00 C ATOM 1250 CD LYS A 735 14.222 -1.029 5.157 1.00 0.00 C ATOM 1251 CE LYS A 735 15.702 -1.003 4.807 1.00 0.00 C ATOM 1252 NZ LYS A 735 16.134 0.331 4.303 1.00 0.00 N ATOM 0 H LYS A 735 10.556 -3.861 7.839 1.00 0.00 H new ATOM 0 HA LYS A 735 12.930 -2.227 7.733 1.00 0.00 H new ATOM 0 HB2 LYS A 735 11.786 -3.378 5.286 1.00 0.00 H new ATOM 0 HB3 LYS A 735 11.744 -1.626 5.261 1.00 0.00 H new ATOM 0 HG2 LYS A 735 14.302 -2.961 6.092 1.00 0.00 H new ATOM 0 HG3 LYS A 735 13.860 -3.005 4.397 1.00 0.00 H new ATOM 0 HD2 LYS A 735 13.653 -0.529 4.373 1.00 0.00 H new ATOM 0 HD3 LYS A 735 14.055 -0.470 6.078 1.00 0.00 H new ATOM 0 HE2 LYS A 735 16.287 -1.264 5.689 1.00 0.00 H new ATOM 0 HE3 LYS A 735 15.909 -1.760 4.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 17.149 0.305 4.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 15.594 0.570 3.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 15.961 1.051 5.034 1.00 0.00 H new ATOM 1266 N LYS A 736 11.397 -0.373 8.306 1.00 0.00 N ATOM 1267 CA LYS A 736 10.512 0.720 8.707 1.00 0.00 C ATOM 1268 C LYS A 736 10.846 2.009 7.950 1.00 0.00 C ATOM 1269 O LYS A 736 11.991 2.224 7.550 1.00 0.00 O ATOM 1270 CB LYS A 736 10.603 0.956 10.220 1.00 0.00 C ATOM 1271 CG LYS A 736 11.962 1.454 10.689 1.00 0.00 C ATOM 1272 CD LYS A 736 12.125 1.294 12.195 1.00 0.00 C ATOM 1273 CE LYS A 736 12.414 2.625 12.872 1.00 0.00 C ATOM 1274 NZ LYS A 736 12.916 2.446 14.266 1.00 0.00 N ATOM 0 H LYS A 736 12.357 -0.280 8.638 1.00 0.00 H new ATOM 0 HA LYS A 736 9.491 0.433 8.455 1.00 0.00 H new ATOM 0 HB2 LYS A 736 9.842 1.680 10.511 1.00 0.00 H new ATOM 0 HB3 LYS A 736 10.371 0.025 10.737 1.00 0.00 H new ATOM 0 HG2 LYS A 736 12.750 0.902 10.176 1.00 0.00 H new ATOM 0 HG3 LYS A 736 12.079 2.503 10.419 1.00 0.00 H new ATOM 0 HD2 LYS A 736 11.218 0.861 12.616 1.00 0.00 H new ATOM 0 HD3 LYS A 736 12.937 0.596 12.402 1.00 0.00 H new ATOM 0 HE2 LYS A 736 13.152 3.176 12.289 1.00 0.00 H new ATOM 0 HE3 LYS A 736 11.506 3.228 12.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 736 13.100 3.377 14.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 736 12.202 1.943 14.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 736 13.796 1.893 14.250 1.00 0.00 H new ATOM 1288 N PHE A 737 9.836 2.859 7.755 1.00 0.00 N ATOM 1289 CA PHE A 737 10.015 4.127 7.043 1.00 0.00 C ATOM 1290 C PHE A 737 9.346 5.275 7.799 1.00 0.00 C ATOM 1291 O PHE A 737 8.703 5.059 8.826 1.00 0.00 O ATOM 1292 CB PHE A 737 9.429 4.027 5.628 1.00 0.00 C ATOM 1293 CG PHE A 737 10.136 3.035 4.746 1.00 0.00 C ATOM 1294 CD1 PHE A 737 9.954 1.671 4.929 1.00 0.00 C ATOM 1295 CD2 PHE A 737 10.977 3.464 3.733 1.00 0.00 C ATOM 1296 CE1 PHE A 737 10.598 0.757 4.118 1.00 0.00 C ATOM 1297 CE2 PHE A 737 11.624 2.553 2.919 1.00 0.00 C ATOM 1298 CZ PHE A 737 11.436 1.199 3.111 1.00 0.00 C ATOM 0 H PHE A 737 8.884 2.692 8.081 1.00 0.00 H new ATOM 0 HA PHE A 737 11.084 4.331 6.977 1.00 0.00 H new ATOM 0 HB2 PHE A 737 8.377 3.750 5.699 1.00 0.00 H new ATOM 0 HB3 PHE A 737 9.469 5.010 5.158 1.00 0.00 H new ATOM 0 HD1 PHE A 737 9.301 1.320 5.715 1.00 0.00 H new ATOM 0 HD2 PHE A 737 11.129 4.522 3.577 1.00 0.00 H new ATOM 0 HE1 PHE A 737 10.447 -0.302 4.270 1.00 0.00 H new ATOM 0 HE2 PHE A 737 12.277 2.901 2.132 1.00 0.00 H new ATOM 0 HZ PHE A 737 11.942 0.487 2.476 1.00 0.00 H new ATOM 1308 N ASP A 738 9.496 6.494 7.282 1.00 0.00 N ATOM 1309 CA ASP A 738 8.896 7.669 7.912 1.00 0.00 C ATOM 1310 C ASP A 738 7.512 7.956 7.331 1.00 0.00 C ATOM 1311 O ASP A 738 6.550 8.147 8.076 1.00 0.00 O ATOM 1312 CB ASP A 738 9.800 8.894 7.747 1.00 0.00 C ATOM 1313 CG ASP A 738 9.828 9.754 8.995 1.00 0.00 C ATOM 1314 OD1 ASP A 738 10.565 9.406 9.940 1.00 0.00 O ATOM 1315 OD2 ASP A 738 9.108 10.775 9.028 1.00 0.00 O ATOM 0 H ASP A 738 10.025 6.693 6.433 1.00 0.00 H new ATOM 0 HA ASP A 738 8.786 7.456 8.975 1.00 0.00 H new ATOM 0 HB2 ASP A 738 10.812 8.568 7.509 1.00 0.00 H new ATOM 0 HB3 ASP A 738 9.451 9.490 6.904 1.00 0.00 H new ATOM 1320 N SER A 739 7.413 7.982 6.000 1.00 0.00 N ATOM 1321 CA SER A 739 6.139 8.241 5.330 1.00 0.00 C ATOM 1322 C SER A 739 5.759 7.077 4.415 1.00 0.00 C ATOM 1323 O SER A 739 6.629 6.396 3.871 1.00 0.00 O ATOM 1324 CB SER A 739 6.205 9.544 4.522 1.00 0.00 C ATOM 1325 OG SER A 739 7.440 9.662 3.832 1.00 0.00 O ATOM 0 H SER A 739 8.198 7.827 5.367 1.00 0.00 H new ATOM 0 HA SER A 739 5.373 8.344 6.098 1.00 0.00 H new ATOM 0 HB2 SER A 739 5.383 9.573 3.807 1.00 0.00 H new ATOM 0 HB3 SER A 739 6.077 10.396 5.190 1.00 0.00 H new ATOM 0 HG SER A 739 7.453 10.501 3.325 1.00 0.00 H new ATOM 1331 N LEU A 740 4.451 6.856 4.250 1.00 0.00 N ATOM 1332 CA LEU A 740 3.954 5.772 3.399 1.00 0.00 C ATOM 1333 C LEU A 740 4.493 5.898 1.974 1.00 0.00 C ATOM 1334 O LEU A 740 4.730 4.894 1.304 1.00 0.00 O ATOM 1335 CB LEU A 740 2.420 5.764 3.372 1.00 0.00 C ATOM 1336 CG LEU A 740 1.764 4.509 3.957 1.00 0.00 C ATOM 1337 CD1 LEU A 740 0.344 4.812 4.414 1.00 0.00 C ATOM 1338 CD2 LEU A 740 1.767 3.376 2.937 1.00 0.00 C ATOM 0 H LEU A 740 3.720 7.412 4.693 1.00 0.00 H new ATOM 0 HA LEU A 740 4.308 4.832 3.823 1.00 0.00 H new ATOM 0 HB2 LEU A 740 2.058 6.633 3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 740 2.090 5.879 2.340 1.00 0.00 H new ATOM 0 HG LEU A 740 2.344 4.192 4.823 1.00 0.00 H new ATOM 0 HD11 LEU A 740 -0.106 3.909 4.827 1.00 0.00 H new ATOM 0 HD12 LEU A 740 0.366 5.588 5.179 1.00 0.00 H new ATOM 0 HD13 LEU A 740 -0.246 5.156 3.564 1.00 0.00 H new ATOM 0 HD21 LEU A 740 1.297 2.494 3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 740 1.212 3.683 2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 740 2.794 3.140 2.659 1.00 0.00 H new ATOM 1350 N LEU A 741 4.691 7.137 1.518 1.00 0.00 N ATOM 1351 CA LEU A 741 5.207 7.385 0.175 1.00 0.00 C ATOM 1352 C LEU A 741 6.644 6.875 0.040 1.00 0.00 C ATOM 1353 O LEU A 741 7.017 6.325 -0.997 1.00 0.00 O ATOM 1354 CB LEU A 741 5.115 8.882 -0.165 1.00 0.00 C ATOM 1355 CG LEU A 741 6.392 9.695 0.058 1.00 0.00 C ATOM 1356 CD1 LEU A 741 7.323 9.558 -1.137 1.00 0.00 C ATOM 1357 CD2 LEU A 741 6.054 11.159 0.310 1.00 0.00 C ATOM 0 H LEU A 741 4.502 7.980 2.059 1.00 0.00 H new ATOM 0 HA LEU A 741 4.593 6.835 -0.538 1.00 0.00 H new ATOM 0 HB2 LEU A 741 4.822 8.981 -1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 741 4.317 9.323 0.433 1.00 0.00 H new ATOM 0 HG LEU A 741 6.903 9.305 0.938 1.00 0.00 H new ATOM 0 HD11 LEU A 741 8.227 10.142 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 741 7.589 8.510 -1.273 1.00 0.00 H new ATOM 0 HD13 LEU A 741 6.821 9.924 -2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 741 6.974 11.723 0.467 1.00 0.00 H new ATOM 0 HD22 LEU A 741 5.523 11.563 -0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 741 5.424 11.240 1.196 1.00 0.00 H new ATOM 1369 N GLU A 742 7.444 7.052 1.094 1.00 0.00 N ATOM 1370 CA GLU A 742 8.833 6.602 1.085 1.00 0.00 C ATOM 1371 C GLU A 742 8.909 5.078 1.108 1.00 0.00 C ATOM 1372 O GLU A 742 9.699 4.478 0.374 1.00 0.00 O ATOM 1373 CB GLU A 742 9.595 7.186 2.275 1.00 0.00 C ATOM 1374 CG GLU A 742 10.153 8.577 2.010 1.00 0.00 C ATOM 1375 CD GLU A 742 10.984 9.105 3.162 1.00 0.00 C ATOM 1376 OE1 GLU A 742 12.153 8.685 3.292 1.00 0.00 O ATOM 1377 OE2 GLU A 742 10.468 9.941 3.931 1.00 0.00 O ATOM 0 H GLU A 742 7.152 7.503 1.961 1.00 0.00 H new ATOM 0 HA GLU A 742 9.297 6.957 0.165 1.00 0.00 H new ATOM 0 HB2 GLU A 742 8.930 7.227 3.138 1.00 0.00 H new ATOM 0 HB3 GLU A 742 10.415 6.517 2.536 1.00 0.00 H new ATOM 0 HG2 GLU A 742 10.764 8.553 1.108 1.00 0.00 H new ATOM 0 HG3 GLU A 742 9.329 9.264 1.818 1.00 0.00 H new ATOM 1384 N LEU A 743 8.081 4.451 1.945 1.00 0.00 N ATOM 1385 CA LEU A 743 8.054 2.995 2.047 1.00 0.00 C ATOM 1386 C LEU A 743 7.733 2.371 0.692 1.00 0.00 C ATOM 1387 O LEU A 743 8.410 1.442 0.250 1.00 0.00 O ATOM 1388 CB LEU A 743 7.026 2.547 3.095 1.00 0.00 C ATOM 1389 CG LEU A 743 6.884 1.029 3.271 1.00 0.00 C ATOM 1390 CD1 LEU A 743 6.628 0.681 4.732 1.00 0.00 C ATOM 1391 CD2 LEU A 743 5.767 0.486 2.389 1.00 0.00 C ATOM 0 H LEU A 743 7.422 4.929 2.560 1.00 0.00 H new ATOM 0 HA LEU A 743 9.041 2.655 2.362 1.00 0.00 H new ATOM 0 HB2 LEU A 743 7.298 2.983 4.056 1.00 0.00 H new ATOM 0 HB3 LEU A 743 6.053 2.957 2.823 1.00 0.00 H new ATOM 0 HG LEU A 743 7.820 0.561 2.964 1.00 0.00 H new ATOM 0 HD11 LEU A 743 6.530 -0.400 4.837 1.00 0.00 H new ATOM 0 HD12 LEU A 743 7.462 1.031 5.341 1.00 0.00 H new ATOM 0 HD13 LEU A 743 5.709 1.163 5.065 1.00 0.00 H new ATOM 0 HD21 LEU A 743 5.684 -0.592 2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 743 4.825 0.961 2.661 1.00 0.00 H new ATOM 0 HD23 LEU A 743 5.992 0.699 1.344 1.00 0.00 H new ATOM 1403 N VAL A 744 6.696 2.893 0.034 1.00 0.00 N ATOM 1404 CA VAL A 744 6.284 2.390 -1.274 1.00 0.00 C ATOM 1405 C VAL A 744 7.397 2.570 -2.307 1.00 0.00 C ATOM 1406 O VAL A 744 7.599 1.707 -3.161 1.00 0.00 O ATOM 1407 CB VAL A 744 5.001 3.090 -1.778 1.00 0.00 C ATOM 1408 CG1 VAL A 744 4.532 2.482 -3.094 1.00 0.00 C ATOM 1409 CG2 VAL A 744 3.900 3.009 -0.729 1.00 0.00 C ATOM 0 H VAL A 744 6.128 3.663 0.387 1.00 0.00 H new ATOM 0 HA VAL A 744 6.075 1.327 -1.151 1.00 0.00 H new ATOM 0 HB VAL A 744 5.234 4.140 -1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 744 3.628 2.991 -3.428 1.00 0.00 H new ATOM 0 HG12 VAL A 744 5.312 2.597 -3.846 1.00 0.00 H new ATOM 0 HG13 VAL A 744 4.320 1.423 -2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 744 3.005 3.507 -1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 744 3.673 1.964 -0.520 1.00 0.00 H new ATOM 0 HG23 VAL A 744 4.233 3.498 0.186 1.00 0.00 H new ATOM 1419 N GLU A 745 8.119 3.690 -2.223 1.00 0.00 N ATOM 1420 CA GLU A 745 9.211 3.971 -3.154 1.00 0.00 C ATOM 1421 C GLU A 745 10.264 2.862 -3.122 1.00 0.00 C ATOM 1422 O GLU A 745 10.696 2.378 -4.169 1.00 0.00 O ATOM 1423 CB GLU A 745 9.861 5.318 -2.828 1.00 0.00 C ATOM 1424 CG GLU A 745 9.255 6.490 -3.587 1.00 0.00 C ATOM 1425 CD GLU A 745 10.159 7.015 -4.690 1.00 0.00 C ATOM 1426 OE1 GLU A 745 11.382 7.121 -4.461 1.00 0.00 O ATOM 1427 OE2 GLU A 745 9.639 7.328 -5.782 1.00 0.00 O ATOM 0 H GLU A 745 7.967 4.414 -1.521 1.00 0.00 H new ATOM 0 HA GLU A 745 8.789 4.014 -4.158 1.00 0.00 H new ATOM 0 HB2 GLU A 745 9.772 5.505 -1.758 1.00 0.00 H new ATOM 0 HB3 GLU A 745 10.926 5.262 -3.054 1.00 0.00 H new ATOM 0 HG2 GLU A 745 8.304 6.182 -4.021 1.00 0.00 H new ATOM 0 HG3 GLU A 745 9.040 7.297 -2.887 1.00 0.00 H new ATOM 1434 N TYR A 746 10.671 2.461 -1.917 1.00 0.00 N ATOM 1435 CA TYR A 746 11.671 1.404 -1.759 1.00 0.00 C ATOM 1436 C TYR A 746 11.142 0.069 -2.279 1.00 0.00 C ATOM 1437 O TYR A 746 11.858 -0.666 -2.963 1.00 0.00 O ATOM 1438 CB TYR A 746 12.079 1.262 -0.288 1.00 0.00 C ATOM 1439 CG TYR A 746 13.460 0.667 -0.082 1.00 0.00 C ATOM 1440 CD1 TYR A 746 14.605 1.428 -0.283 1.00 0.00 C ATOM 1441 CD2 TYR A 746 13.616 -0.657 0.319 1.00 0.00 C ATOM 1442 CE1 TYR A 746 15.864 0.892 -0.089 1.00 0.00 C ATOM 1443 CE2 TYR A 746 14.872 -1.200 0.514 1.00 0.00 C ATOM 1444 CZ TYR A 746 15.991 -0.422 0.308 1.00 0.00 C ATOM 1445 OH TYR A 746 17.245 -0.961 0.504 1.00 0.00 O ATOM 0 H TYR A 746 10.326 2.850 -1.040 1.00 0.00 H new ATOM 0 HA TYR A 746 12.546 1.684 -2.345 1.00 0.00 H new ATOM 0 HB2 TYR A 746 12.044 2.244 0.184 1.00 0.00 H new ATOM 0 HB3 TYR A 746 11.346 0.637 0.222 1.00 0.00 H new ATOM 0 HD1 TYR A 746 14.509 2.457 -0.597 1.00 0.00 H new ATOM 0 HD2 TYR A 746 12.741 -1.270 0.480 1.00 0.00 H new ATOM 0 HE1 TYR A 746 16.743 1.499 -0.247 1.00 0.00 H new ATOM 0 HE2 TYR A 746 14.976 -2.229 0.826 1.00 0.00 H new ATOM 0 HH TYR A 746 17.159 -1.896 0.783 1.00 0.00 H new ATOM 1455 N TYR A 747 9.888 -0.242 -1.949 1.00 0.00 N ATOM 1456 CA TYR A 747 9.271 -1.495 -2.383 1.00 0.00 C ATOM 1457 C TYR A 747 8.918 -1.467 -3.873 1.00 0.00 C ATOM 1458 O TYR A 747 8.757 -2.520 -4.490 1.00 0.00 O ATOM 1459 CB TYR A 747 8.020 -1.795 -1.554 1.00 0.00 C ATOM 1460 CG TYR A 747 8.320 -2.374 -0.187 1.00 0.00 C ATOM 1461 CD1 TYR A 747 8.849 -3.655 -0.052 1.00 0.00 C ATOM 1462 CD2 TYR A 747 8.071 -1.644 0.968 1.00 0.00 C ATOM 1463 CE1 TYR A 747 9.119 -4.188 1.195 1.00 0.00 C ATOM 1464 CE2 TYR A 747 8.340 -2.170 2.217 1.00 0.00 C ATOM 1465 CZ TYR A 747 8.863 -3.440 2.325 1.00 0.00 C ATOM 1466 OH TYR A 747 9.129 -3.968 3.568 1.00 0.00 O ATOM 0 H TYR A 747 9.282 0.354 -1.385 1.00 0.00 H new ATOM 0 HA TYR A 747 10.002 -2.288 -2.226 1.00 0.00 H new ATOM 0 HB2 TYR A 747 7.447 -0.876 -1.432 1.00 0.00 H new ATOM 0 HB3 TYR A 747 7.389 -2.493 -2.104 1.00 0.00 H new ATOM 0 HD1 TYR A 747 9.052 -4.242 -0.936 1.00 0.00 H new ATOM 0 HD2 TYR A 747 7.660 -0.648 0.889 1.00 0.00 H new ATOM 0 HE1 TYR A 747 9.528 -5.184 1.283 1.00 0.00 H new ATOM 0 HE2 TYR A 747 8.141 -1.588 3.105 1.00 0.00 H new ATOM 0 HH TYR A 747 8.894 -3.314 4.259 1.00 0.00 H new ATOM 1476 N GLN A 748 8.799 -0.270 -4.452 1.00 0.00 N ATOM 1477 CA GLN A 748 8.474 -0.140 -5.870 1.00 0.00 C ATOM 1478 C GLN A 748 9.508 -0.868 -6.727 1.00 0.00 C ATOM 1479 O GLN A 748 9.164 -1.504 -7.723 1.00 0.00 O ATOM 1480 CB GLN A 748 8.405 1.337 -6.275 1.00 0.00 C ATOM 1481 CG GLN A 748 7.001 1.917 -6.231 1.00 0.00 C ATOM 1482 CD GLN A 748 6.954 3.390 -6.596 1.00 0.00 C ATOM 1483 OE1 GLN A 748 7.952 3.971 -7.024 1.00 0.00 O ATOM 1484 NE2 GLN A 748 5.789 4.005 -6.424 1.00 0.00 N ATOM 0 H GLN A 748 8.922 0.616 -3.963 1.00 0.00 H new ATOM 0 HA GLN A 748 7.497 -0.595 -6.036 1.00 0.00 H new ATOM 0 HB2 GLN A 748 9.049 1.917 -5.614 1.00 0.00 H new ATOM 0 HB3 GLN A 748 8.803 1.447 -7.284 1.00 0.00 H new ATOM 0 HG2 GLN A 748 6.362 1.359 -6.915 1.00 0.00 H new ATOM 0 HG3 GLN A 748 6.590 1.783 -5.230 1.00 0.00 H new ATOM 0 HE21 GLN A 748 4.986 3.487 -6.067 1.00 0.00 H new ATOM 0 HE22 GLN A 748 5.697 4.996 -6.649 1.00 0.00 H new ATOM 1493 N CYS A 749 10.777 -0.770 -6.327 1.00 0.00 N ATOM 1494 CA CYS A 749 11.864 -1.422 -7.054 1.00 0.00 C ATOM 1495 C CYS A 749 12.226 -2.771 -6.427 1.00 0.00 C ATOM 1496 O CYS A 749 12.597 -3.709 -7.133 1.00 0.00 O ATOM 1497 CB CYS A 749 13.097 -0.517 -7.091 1.00 0.00 C ATOM 1498 SG CYS A 749 13.026 0.774 -8.355 1.00 0.00 S ATOM 0 H CYS A 749 11.076 -0.246 -5.505 1.00 0.00 H new ATOM 0 HA CYS A 749 11.520 -1.603 -8.072 1.00 0.00 H new ATOM 0 HB2 CYS A 749 13.220 -0.048 -6.115 1.00 0.00 H new ATOM 0 HB3 CYS A 749 13.981 -1.131 -7.263 1.00 0.00 H new ATOM 0 HG CYS A 749 14.111 1.489 -8.307 1.00 0.00 H new ATOM 1504 N HIS A 750 12.120 -2.863 -5.099 1.00 0.00 N ATOM 1505 CA HIS A 750 12.439 -4.101 -4.387 1.00 0.00 C ATOM 1506 C HIS A 750 11.276 -5.093 -4.447 1.00 0.00 C ATOM 1507 O HIS A 750 10.152 -4.726 -4.786 1.00 0.00 O ATOM 1508 CB HIS A 750 12.791 -3.793 -2.926 1.00 0.00 C ATOM 1509 CG HIS A 750 14.069 -4.426 -2.459 1.00 0.00 C ATOM 1510 ND1 HIS A 750 14.366 -4.623 -1.127 1.00 0.00 N ATOM 1511 CD2 HIS A 750 15.131 -4.903 -3.153 1.00 0.00 C ATOM 1512 CE1 HIS A 750 15.554 -5.192 -1.021 1.00 0.00 C ATOM 1513 NE2 HIS A 750 16.039 -5.373 -2.235 1.00 0.00 N ATOM 0 H HIS A 750 11.817 -2.097 -4.497 1.00 0.00 H new ATOM 0 HA HIS A 750 13.299 -4.558 -4.877 1.00 0.00 H new ATOM 0 HB2 HIS A 750 12.866 -2.713 -2.801 1.00 0.00 H new ATOM 0 HB3 HIS A 750 11.975 -4.132 -2.287 1.00 0.00 H new ATOM 0 HD2 HIS A 750 15.243 -4.912 -4.227 1.00 0.00 H new ATOM 0 HE1 HIS A 750 16.045 -5.463 -0.098 1.00 0.00 H new ATOM 0 HE2 HIS A 750 16.942 -5.794 -2.456 1.00 0.00 H new ATOM 1522 N SER A 751 11.558 -6.355 -4.111 1.00 0.00 N ATOM 1523 CA SER A 751 10.537 -7.402 -4.124 1.00 0.00 C ATOM 1524 C SER A 751 9.989 -7.649 -2.720 1.00 0.00 C ATOM 1525 O SER A 751 10.653 -7.359 -1.724 1.00 0.00 O ATOM 1526 CB SER A 751 11.117 -8.702 -4.690 1.00 0.00 C ATOM 1527 OG SER A 751 10.087 -9.567 -5.138 1.00 0.00 O ATOM 0 H SER A 751 12.484 -6.674 -3.827 1.00 0.00 H new ATOM 0 HA SER A 751 9.719 -7.066 -4.761 1.00 0.00 H new ATOM 0 HB2 SER A 751 11.790 -8.474 -5.516 1.00 0.00 H new ATOM 0 HB3 SER A 751 11.710 -9.203 -3.925 1.00 0.00 H new ATOM 0 HG SER A 751 10.483 -10.389 -5.496 1.00 0.00 H new ATOM 1533 N LEU A 752 8.777 -8.197 -2.649 1.00 0.00 N ATOM 1534 CA LEU A 752 8.143 -8.491 -1.367 1.00 0.00 C ATOM 1535 C LEU A 752 8.349 -9.958 -0.968 1.00 0.00 C ATOM 1536 O LEU A 752 7.603 -10.490 -0.145 1.00 0.00 O ATOM 1537 CB LEU A 752 6.642 -8.171 -1.423 1.00 0.00 C ATOM 1538 CG LEU A 752 6.267 -6.888 -2.174 1.00 0.00 C ATOM 1539 CD1 LEU A 752 4.772 -6.618 -2.057 1.00 0.00 C ATOM 1540 CD2 LEU A 752 7.068 -5.705 -1.649 1.00 0.00 C ATOM 0 H LEU A 752 8.216 -8.446 -3.464 1.00 0.00 H new ATOM 0 HA LEU A 752 8.614 -7.861 -0.613 1.00 0.00 H new ATOM 0 HB2 LEU A 752 6.127 -9.009 -1.892 1.00 0.00 H new ATOM 0 HB3 LEU A 752 6.266 -8.097 -0.403 1.00 0.00 H new ATOM 0 HG LEU A 752 6.510 -7.024 -3.228 1.00 0.00 H new ATOM 0 HD11 LEU A 752 4.524 -5.704 -2.596 1.00 0.00 H new ATOM 0 HD12 LEU A 752 4.217 -7.453 -2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 752 4.504 -6.504 -1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 752 6.787 -4.804 -2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 752 6.859 -5.566 -0.588 1.00 0.00 H new ATOM 0 HD23 LEU A 752 8.132 -5.896 -1.787 1.00 0.00 H new ATOM 1552 N LYS A 753 9.366 -10.608 -1.548 1.00 0.00 N ATOM 1553 CA LYS A 753 9.658 -12.010 -1.242 1.00 0.00 C ATOM 1554 C LYS A 753 10.297 -12.155 0.138 1.00 0.00 C ATOM 1555 O LYS A 753 10.077 -13.153 0.826 1.00 0.00 O ATOM 1556 CB LYS A 753 10.579 -12.623 -2.306 1.00 0.00 C ATOM 1557 CG LYS A 753 11.911 -11.902 -2.470 1.00 0.00 C ATOM 1558 CD LYS A 753 13.037 -12.624 -1.740 1.00 0.00 C ATOM 1559 CE LYS A 753 14.350 -12.542 -2.510 1.00 0.00 C ATOM 1560 NZ LYS A 753 15.111 -13.823 -2.458 1.00 0.00 N ATOM 0 H LYS A 753 9.997 -10.185 -2.229 1.00 0.00 H new ATOM 0 HA LYS A 753 8.709 -12.547 -1.243 1.00 0.00 H new ATOM 0 HB2 LYS A 753 10.772 -13.664 -2.047 1.00 0.00 H new ATOM 0 HB3 LYS A 753 10.059 -12.624 -3.264 1.00 0.00 H new ATOM 0 HG2 LYS A 753 12.155 -11.825 -3.530 1.00 0.00 H new ATOM 0 HG3 LYS A 753 11.823 -10.885 -2.088 1.00 0.00 H new ATOM 0 HD2 LYS A 753 13.168 -12.188 -0.750 1.00 0.00 H new ATOM 0 HD3 LYS A 753 12.765 -13.669 -1.594 1.00 0.00 H new ATOM 0 HE2 LYS A 753 14.145 -12.284 -3.549 1.00 0.00 H new ATOM 0 HE3 LYS A 753 14.962 -11.740 -2.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 15.996 -13.723 -2.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 15.330 -14.057 -1.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 14.538 -14.584 -2.875 1.00 0.00 H new ATOM 1574 N GLU A 754 11.089 -11.160 0.538 1.00 0.00 N ATOM 1575 CA GLU A 754 11.756 -11.187 1.840 1.00 0.00 C ATOM 1576 C GLU A 754 10.735 -11.294 2.970 1.00 0.00 C ATOM 1577 O GLU A 754 10.933 -12.045 3.924 1.00 0.00 O ATOM 1578 CB GLU A 754 12.619 -9.938 2.028 1.00 0.00 C ATOM 1579 CG GLU A 754 14.037 -10.101 1.505 1.00 0.00 C ATOM 1580 CD GLU A 754 15.095 -9.795 2.550 1.00 0.00 C ATOM 1581 OE1 GLU A 754 14.951 -10.260 3.700 1.00 0.00 O ATOM 1582 OE2 GLU A 754 16.073 -9.094 2.214 1.00 0.00 O ATOM 0 H GLU A 754 11.284 -10.328 -0.019 1.00 0.00 H new ATOM 0 HA GLU A 754 12.400 -12.066 1.871 1.00 0.00 H new ATOM 0 HB2 GLU A 754 12.146 -9.098 1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 754 12.657 -9.688 3.088 1.00 0.00 H new ATOM 0 HG2 GLU A 754 14.171 -11.122 1.148 1.00 0.00 H new ATOM 0 HG3 GLU A 754 14.180 -9.443 0.648 1.00 0.00 H new ATOM 1589 N SER A 755 9.643 -10.546 2.847 1.00 0.00 N ATOM 1590 CA SER A 755 8.582 -10.565 3.849 1.00 0.00 C ATOM 1591 C SER A 755 7.534 -11.623 3.507 1.00 0.00 C ATOM 1592 O SER A 755 7.025 -12.315 4.390 1.00 0.00 O ATOM 1593 CB SER A 755 7.921 -9.189 3.954 1.00 0.00 C ATOM 1594 OG SER A 755 8.889 -8.156 4.017 1.00 0.00 O ATOM 0 H SER A 755 9.469 -9.918 2.062 1.00 0.00 H new ATOM 0 HA SER A 755 9.029 -10.816 4.811 1.00 0.00 H new ATOM 0 HB2 SER A 755 7.271 -9.029 3.094 1.00 0.00 H new ATOM 0 HB3 SER A 755 7.290 -9.153 4.842 1.00 0.00 H new ATOM 0 HG SER A 755 8.438 -7.288 4.082 1.00 0.00 H new ATOM 1600 N PHE A 756 7.217 -11.744 2.217 1.00 0.00 N ATOM 1601 CA PHE A 756 6.234 -12.717 1.748 1.00 0.00 C ATOM 1602 C PHE A 756 6.897 -13.744 0.831 1.00 0.00 C ATOM 1603 O PHE A 756 7.031 -13.512 -0.369 1.00 0.00 O ATOM 1604 CB PHE A 756 5.101 -12.008 0.995 1.00 0.00 C ATOM 1605 CG PHE A 756 4.111 -11.320 1.892 1.00 0.00 C ATOM 1606 CD1 PHE A 756 4.522 -10.334 2.774 1.00 0.00 C ATOM 1607 CD2 PHE A 756 2.770 -11.660 1.853 1.00 0.00 C ATOM 1608 CE1 PHE A 756 3.614 -9.699 3.599 1.00 0.00 C ATOM 1609 CE2 PHE A 756 1.857 -11.030 2.675 1.00 0.00 C ATOM 1610 CZ PHE A 756 2.278 -10.049 3.549 1.00 0.00 C ATOM 0 H PHE A 756 7.630 -11.177 1.477 1.00 0.00 H new ATOM 0 HA PHE A 756 5.819 -13.231 2.615 1.00 0.00 H new ATOM 0 HB2 PHE A 756 5.533 -11.273 0.316 1.00 0.00 H new ATOM 0 HB3 PHE A 756 4.574 -12.738 0.381 1.00 0.00 H new ATOM 0 HD1 PHE A 756 5.565 -10.058 2.817 1.00 0.00 H new ATOM 0 HD2 PHE A 756 2.434 -12.427 1.171 1.00 0.00 H new ATOM 0 HE1 PHE A 756 3.947 -8.931 4.281 1.00 0.00 H new ATOM 0 HE2 PHE A 756 0.813 -11.305 2.634 1.00 0.00 H new ATOM 0 HZ PHE A 756 1.565 -9.556 4.193 1.00 0.00 H new ATOM 1620 N LYS A 757 7.315 -14.879 1.399 1.00 0.00 N ATOM 1621 CA LYS A 757 7.968 -15.931 0.611 1.00 0.00 C ATOM 1622 C LYS A 757 7.101 -16.358 -0.574 1.00 0.00 C ATOM 1623 O LYS A 757 7.619 -16.734 -1.626 1.00 0.00 O ATOM 1624 CB LYS A 757 8.292 -17.150 1.480 1.00 0.00 C ATOM 1625 CG LYS A 757 7.067 -17.836 2.074 1.00 0.00 C ATOM 1626 CD LYS A 757 6.548 -18.948 1.169 1.00 0.00 C ATOM 1627 CE LYS A 757 6.100 -20.162 1.973 1.00 0.00 C ATOM 1628 NZ LYS A 757 4.648 -20.106 2.308 1.00 0.00 N ATOM 0 H LYS A 757 7.215 -15.093 2.391 1.00 0.00 H new ATOM 0 HA LYS A 757 8.899 -15.514 0.228 1.00 0.00 H new ATOM 0 HB2 LYS A 757 8.845 -17.873 0.880 1.00 0.00 H new ATOM 0 HB3 LYS A 757 8.950 -16.839 2.292 1.00 0.00 H new ATOM 0 HG2 LYS A 757 7.319 -18.250 3.050 1.00 0.00 H new ATOM 0 HG3 LYS A 757 6.279 -17.100 2.234 1.00 0.00 H new ATOM 0 HD2 LYS A 757 5.713 -18.575 0.576 1.00 0.00 H new ATOM 0 HD3 LYS A 757 7.330 -19.243 0.469 1.00 0.00 H new ATOM 0 HE2 LYS A 757 6.306 -21.069 1.405 1.00 0.00 H new ATOM 0 HE3 LYS A 757 6.682 -20.223 2.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 757 4.385 -20.951 2.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 757 4.454 -19.254 2.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 757 4.090 -20.074 1.431 1.00 0.00 H new ATOM 1642 N GLN A 758 5.784 -16.295 -0.392 1.00 0.00 N ATOM 1643 CA GLN A 758 4.836 -16.667 -1.438 1.00 0.00 C ATOM 1644 C GLN A 758 4.817 -15.623 -2.556 1.00 0.00 C ATOM 1645 O GLN A 758 4.490 -15.935 -3.702 1.00 0.00 O ATOM 1646 CB GLN A 758 3.431 -16.823 -0.848 1.00 0.00 C ATOM 1647 CG GLN A 758 2.997 -15.666 0.044 1.00 0.00 C ATOM 1648 CD GLN A 758 3.034 -16.023 1.518 1.00 0.00 C ATOM 1649 OE1 GLN A 758 4.093 -16.336 2.066 1.00 0.00 O ATOM 1650 NE2 GLN A 758 1.877 -15.983 2.170 1.00 0.00 N ATOM 0 H GLN A 758 5.347 -15.987 0.477 1.00 0.00 H new ATOM 0 HA GLN A 758 5.156 -17.619 -1.861 1.00 0.00 H new ATOM 0 HB2 GLN A 758 2.716 -16.926 -1.664 1.00 0.00 H new ATOM 0 HB3 GLN A 758 3.392 -17.747 -0.271 1.00 0.00 H new ATOM 0 HG2 GLN A 758 3.647 -14.810 -0.135 1.00 0.00 H new ATOM 0 HG3 GLN A 758 1.986 -15.362 -0.227 1.00 0.00 H new ATOM 0 HE21 GLN A 758 1.023 -15.719 1.678 1.00 0.00 H new ATOM 0 HE22 GLN A 758 1.842 -16.217 3.162 1.00 0.00 H new ATOM 1659 N LEU A 759 5.170 -14.386 -2.212 1.00 0.00 N ATOM 1660 CA LEU A 759 5.195 -13.294 -3.173 1.00 0.00 C ATOM 1661 C LEU A 759 6.603 -13.077 -3.723 1.00 0.00 C ATOM 1662 O LEU A 759 7.593 -13.470 -3.105 1.00 0.00 O ATOM 1663 CB LEU A 759 4.690 -12.005 -2.517 1.00 0.00 C ATOM 1664 CG LEU A 759 3.729 -11.184 -3.375 1.00 0.00 C ATOM 1665 CD1 LEU A 759 2.289 -11.587 -3.103 1.00 0.00 C ATOM 1666 CD2 LEU A 759 3.931 -9.697 -3.130 1.00 0.00 C ATOM 0 H LEU A 759 5.444 -14.118 -1.267 1.00 0.00 H new ATOM 0 HA LEU A 759 4.540 -13.559 -4.003 1.00 0.00 H new ATOM 0 HB2 LEU A 759 4.192 -12.261 -1.582 1.00 0.00 H new ATOM 0 HB3 LEU A 759 5.548 -11.384 -2.261 1.00 0.00 H new ATOM 0 HG LEU A 759 3.945 -11.388 -4.424 1.00 0.00 H new ATOM 0 HD11 LEU A 759 1.621 -10.990 -3.724 1.00 0.00 H new ATOM 0 HD12 LEU A 759 2.156 -12.643 -3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 759 2.056 -11.417 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 759 3.238 -9.129 -3.750 1.00 0.00 H new ATOM 0 HD22 LEU A 759 3.746 -9.473 -2.079 1.00 0.00 H new ATOM 0 HD23 LEU A 759 4.955 -9.422 -3.385 1.00 0.00 H new ATOM 1678 N ASP A 760 6.672 -12.444 -4.889 1.00 0.00 N ATOM 1679 CA ASP A 760 7.949 -12.153 -5.544 1.00 0.00 C ATOM 1680 C ASP A 760 7.765 -11.115 -6.657 1.00 0.00 C ATOM 1681 O ASP A 760 8.423 -11.185 -7.697 1.00 0.00 O ATOM 1682 CB ASP A 760 8.567 -13.437 -6.116 1.00 0.00 C ATOM 1683 CG ASP A 760 7.576 -14.252 -6.927 1.00 0.00 C ATOM 1684 OD1 ASP A 760 7.433 -13.980 -8.136 1.00 0.00 O ATOM 1685 OD2 ASP A 760 6.940 -15.156 -6.347 1.00 0.00 O ATOM 0 H ASP A 760 5.855 -12.119 -5.405 1.00 0.00 H new ATOM 0 HA ASP A 760 8.626 -11.742 -4.796 1.00 0.00 H new ATOM 0 HB2 ASP A 760 9.418 -13.177 -6.745 1.00 0.00 H new ATOM 0 HB3 ASP A 760 8.950 -14.047 -5.298 1.00 0.00 H new ATOM 1690 N THR A 761 6.863 -10.154 -6.434 1.00 0.00 N ATOM 1691 CA THR A 761 6.592 -9.111 -7.421 1.00 0.00 C ATOM 1692 C THR A 761 6.834 -7.720 -6.840 1.00 0.00 C ATOM 1693 O THR A 761 6.809 -7.527 -5.623 1.00 0.00 O ATOM 1694 CB THR A 761 5.151 -9.225 -7.934 1.00 0.00 C ATOM 1695 OG1 THR A 761 4.852 -8.180 -8.849 1.00 0.00 O ATOM 1696 CG2 THR A 761 4.112 -9.192 -6.831 1.00 0.00 C ATOM 0 H THR A 761 6.311 -10.079 -5.580 1.00 0.00 H new ATOM 0 HA THR A 761 7.280 -9.253 -8.254 1.00 0.00 H new ATOM 0 HB THR A 761 5.100 -10.198 -8.423 1.00 0.00 H new ATOM 0 HG1 THR A 761 3.929 -8.275 -9.164 1.00 0.00 H new ATOM 0 HG21 THR A 761 3.116 -9.277 -7.266 1.00 0.00 H new ATOM 0 HG22 THR A 761 4.281 -10.024 -6.147 1.00 0.00 H new ATOM 0 HG23 THR A 761 4.190 -8.252 -6.285 1.00 0.00 H new ATOM 1704 N THR A 762 7.060 -6.754 -7.727 1.00 0.00 N ATOM 1705 CA THR A 762 7.298 -5.373 -7.324 1.00 0.00 C ATOM 1706 C THR A 762 6.194 -4.459 -7.860 1.00 0.00 C ATOM 1707 O THR A 762 5.467 -4.825 -8.787 1.00 0.00 O ATOM 1708 CB THR A 762 8.666 -4.902 -7.833 1.00 0.00 C ATOM 1709 OG1 THR A 762 8.648 -4.739 -9.241 1.00 0.00 O ATOM 1710 CG2 THR A 762 9.800 -5.853 -7.496 1.00 0.00 C ATOM 0 H THR A 762 7.083 -6.905 -8.735 1.00 0.00 H new ATOM 0 HA THR A 762 7.290 -5.325 -6.235 1.00 0.00 H new ATOM 0 HB THR A 762 8.848 -3.955 -7.325 1.00 0.00 H new ATOM 0 HG1 THR A 762 9.529 -4.437 -9.547 1.00 0.00 H new ATOM 0 HG21 THR A 762 10.737 -5.455 -7.887 1.00 0.00 H new ATOM 0 HG22 THR A 762 9.875 -5.961 -6.414 1.00 0.00 H new ATOM 0 HG23 THR A 762 9.604 -6.827 -7.945 1.00 0.00 H new ATOM 1718 N LEU A 763 6.075 -3.269 -7.275 1.00 0.00 N ATOM 1719 CA LEU A 763 5.060 -2.304 -7.701 1.00 0.00 C ATOM 1720 C LEU A 763 5.377 -1.785 -9.105 1.00 0.00 C ATOM 1721 O LEU A 763 6.414 -1.158 -9.320 1.00 0.00 O ATOM 1722 CB LEU A 763 4.977 -1.136 -6.709 1.00 0.00 C ATOM 1723 CG LEU A 763 4.995 -1.527 -5.223 1.00 0.00 C ATOM 1724 CD1 LEU A 763 4.875 -0.292 -4.341 1.00 0.00 C ATOM 1725 CD2 LEU A 763 3.876 -2.512 -4.916 1.00 0.00 C ATOM 0 H LEU A 763 6.666 -2.949 -6.507 1.00 0.00 H new ATOM 0 HA LEU A 763 4.094 -2.808 -7.724 1.00 0.00 H new ATOM 0 HB2 LEU A 763 5.811 -0.461 -6.899 1.00 0.00 H new ATOM 0 HB3 LEU A 763 4.063 -0.577 -6.909 1.00 0.00 H new ATOM 0 HG LEU A 763 5.948 -2.010 -5.008 1.00 0.00 H new ATOM 0 HD11 LEU A 763 4.890 -0.591 -3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 763 5.711 0.379 -4.539 1.00 0.00 H new ATOM 0 HD13 LEU A 763 3.938 0.221 -4.559 1.00 0.00 H new ATOM 0 HD21 LEU A 763 3.905 -2.777 -3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 763 2.915 -2.055 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 763 4.006 -3.410 -5.519 1.00 0.00 H new ATOM 1737 N LYS A 764 4.487 -2.064 -10.059 1.00 0.00 N ATOM 1738 CA LYS A 764 4.690 -1.637 -11.444 1.00 0.00 C ATOM 1739 C LYS A 764 3.620 -0.644 -11.902 1.00 0.00 C ATOM 1740 O LYS A 764 3.915 0.530 -12.128 1.00 0.00 O ATOM 1741 CB LYS A 764 4.694 -2.851 -12.378 1.00 0.00 C ATOM 1742 CG LYS A 764 5.717 -3.911 -12.004 1.00 0.00 C ATOM 1743 CD LYS A 764 5.066 -5.276 -11.844 1.00 0.00 C ATOM 1744 CE LYS A 764 6.063 -6.317 -11.355 1.00 0.00 C ATOM 1745 NZ LYS A 764 6.423 -7.289 -12.425 1.00 0.00 N ATOM 0 H LYS A 764 3.623 -2.581 -9.899 1.00 0.00 H new ATOM 0 HA LYS A 764 5.656 -1.134 -11.487 1.00 0.00 H new ATOM 0 HB2 LYS A 764 3.701 -3.301 -12.377 1.00 0.00 H new ATOM 0 HB3 LYS A 764 4.890 -2.514 -13.396 1.00 0.00 H new ATOM 0 HG2 LYS A 764 6.489 -3.962 -12.772 1.00 0.00 H new ATOM 0 HG3 LYS A 764 6.211 -3.630 -11.074 1.00 0.00 H new ATOM 0 HD2 LYS A 764 4.238 -5.205 -11.139 1.00 0.00 H new ATOM 0 HD3 LYS A 764 4.646 -5.594 -12.798 1.00 0.00 H new ATOM 0 HE2 LYS A 764 6.965 -5.817 -11.000 1.00 0.00 H new ATOM 0 HE3 LYS A 764 5.640 -6.853 -10.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 7.104 -7.981 -12.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 5.567 -7.785 -12.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 6.850 -6.781 -13.226 1.00 0.00 H new ATOM 1759 N TYR A 765 2.385 -1.122 -12.060 1.00 0.00 N ATOM 1760 CA TYR A 765 1.287 -0.269 -12.516 1.00 0.00 C ATOM 1761 C TYR A 765 0.296 0.013 -11.390 1.00 0.00 C ATOM 1762 O TYR A 765 -0.509 -0.849 -11.034 1.00 0.00 O ATOM 1763 CB TYR A 765 0.556 -0.914 -13.700 1.00 0.00 C ATOM 1764 CG TYR A 765 1.467 -1.653 -14.655 1.00 0.00 C ATOM 1765 CD1 TYR A 765 2.283 -0.962 -15.543 1.00 0.00 C ATOM 1766 CD2 TYR A 765 1.513 -3.041 -14.667 1.00 0.00 C ATOM 1767 CE1 TYR A 765 3.119 -1.635 -16.414 1.00 0.00 C ATOM 1768 CE2 TYR A 765 2.346 -3.721 -15.533 1.00 0.00 C ATOM 1769 CZ TYR A 765 3.146 -3.013 -16.405 1.00 0.00 C ATOM 1770 OH TYR A 765 3.979 -3.686 -17.271 1.00 0.00 O ATOM 0 H TYR A 765 2.121 -2.091 -11.880 1.00 0.00 H new ATOM 0 HA TYR A 765 1.721 0.678 -12.837 1.00 0.00 H new ATOM 0 HB2 TYR A 765 -0.193 -1.608 -13.318 1.00 0.00 H new ATOM 0 HB3 TYR A 765 0.021 -0.139 -14.250 1.00 0.00 H new ATOM 0 HD1 TYR A 765 2.264 0.118 -15.553 1.00 0.00 H new ATOM 0 HD2 TYR A 765 0.886 -3.598 -13.987 1.00 0.00 H new ATOM 0 HE1 TYR A 765 3.748 -1.084 -17.098 1.00 0.00 H new ATOM 0 HE2 TYR A 765 2.371 -4.801 -15.528 1.00 0.00 H new ATOM 0 HH TYR A 765 3.879 -4.652 -17.137 1.00 0.00 H new ATOM 1780 N PRO A 766 0.329 1.233 -10.823 1.00 0.00 N ATOM 1781 CA PRO A 766 -0.582 1.624 -9.745 1.00 0.00 C ATOM 1782 C PRO A 766 -1.999 1.865 -10.263 1.00 0.00 C ATOM 1783 O PRO A 766 -2.228 2.784 -11.053 1.00 0.00 O ATOM 1784 CB PRO A 766 0.034 2.921 -9.220 1.00 0.00 C ATOM 1785 CG PRO A 766 0.758 3.498 -10.387 1.00 0.00 C ATOM 1786 CD PRO A 766 1.246 2.329 -11.198 1.00 0.00 C ATOM 0 HA PRO A 766 -0.684 0.853 -8.982 1.00 0.00 H new ATOM 0 HB2 PRO A 766 -0.733 3.603 -8.854 1.00 0.00 H new ATOM 0 HB3 PRO A 766 0.713 2.729 -8.389 1.00 0.00 H new ATOM 0 HG2 PRO A 766 0.099 4.134 -10.978 1.00 0.00 H new ATOM 0 HG3 PRO A 766 1.591 4.120 -10.060 1.00 0.00 H new ATOM 0 HD2 PRO A 766 1.204 2.538 -12.267 1.00 0.00 H new ATOM 0 HD3 PRO A 766 2.281 2.083 -10.962 1.00 0.00 H new ATOM 1794 N TYR A 767 -2.943 1.027 -9.821 1.00 0.00 N ATOM 1795 CA TYR A 767 -4.339 1.131 -10.238 1.00 0.00 C ATOM 1796 C TYR A 767 -4.480 0.959 -11.753 1.00 0.00 C ATOM 1797 O TYR A 767 -4.852 -0.113 -12.228 1.00 0.00 O ATOM 1798 CB TYR A 767 -4.933 2.472 -9.797 1.00 0.00 C ATOM 1799 CG TYR A 767 -5.957 2.354 -8.690 1.00 0.00 C ATOM 1800 CD1 TYR A 767 -5.692 1.608 -7.551 1.00 0.00 C ATOM 1801 CD2 TYR A 767 -7.188 2.994 -8.782 1.00 0.00 C ATOM 1802 CE1 TYR A 767 -6.622 1.497 -6.537 1.00 0.00 C ATOM 1803 CE2 TYR A 767 -8.125 2.889 -7.770 1.00 0.00 C ATOM 1804 CZ TYR A 767 -7.836 2.138 -6.649 1.00 0.00 C ATOM 1805 OH TYR A 767 -8.767 2.034 -5.638 1.00 0.00 O ATOM 0 H TYR A 767 -2.760 0.264 -9.169 1.00 0.00 H new ATOM 0 HA TYR A 767 -4.892 0.326 -9.754 1.00 0.00 H new ATOM 0 HB2 TYR A 767 -4.126 3.124 -9.464 1.00 0.00 H new ATOM 0 HB3 TYR A 767 -5.397 2.954 -10.658 1.00 0.00 H new ATOM 0 HD1 TYR A 767 -4.741 1.105 -7.456 1.00 0.00 H new ATOM 0 HD2 TYR A 767 -7.416 3.583 -9.658 1.00 0.00 H new ATOM 0 HE1 TYR A 767 -6.398 0.910 -5.659 1.00 0.00 H new ATOM 0 HE2 TYR A 767 -9.077 3.392 -7.857 1.00 0.00 H new ATOM 0 HH TYR A 767 -9.567 2.547 -5.876 1.00 0.00 H new