USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 872 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 724 THR OG1 : rot -88:sc= -2.04 USER MOD Set 1.2: A 773 HIS : no HE2:sc= -0.868 K(o=-2.9,f=-7.3!) USER MOD Set 2.1: A 755 SER OG : rot 171:sc= 0.0172 USER MOD Set 2.2: A 769 LYS NZ :NH3+ -145:sc= 0.649 (180deg=-0.0123) USER MOD Set 3.1: A 714 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 690 THR OG1 : rot -36:sc= 0.268 USER MOD Single : A 699 HIS : no HD1:sc= -0.0125 X(o=-0.012,f=0) USER MOD Single : A 703 GLN : amide:sc= -0.399 K(o=-0.4,f=-0.95) USER MOD Single : A 705 SER OG : rot -105:sc= 0.524 USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 709 TYR OH : rot 180:sc= -0.229 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 165:sc= 0 USER MOD Single : A 718 ASN : amide:sc= -0.388 X(o=-0.39,f=-0.51) USER MOD Single : A 720 SER OG : rot -55:sc= 0.0988 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl 161:sc= -0.028 (180deg=-0.242) USER MOD Single : A 728 HIS :FLIP no HD1:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 730 SER OG : rot 14:sc= -0.683! USER MOD Single : A 735 HIS :FLIP no HD1:sc=-0.000271 F(o=-1.9!,f=-0.00027) USER MOD Single : A 739 THR OG1 : rot 59:sc= -1.75! USER MOD Single : A 740 GLN :FLIP amide:sc= -1.75! C(o=-5!,f=-1.7!) USER MOD Single : A 743 GLN : amide:sc= -0.6 X(o=-0.6,f=-0.52) USER MOD Single : A 749 LYS NZ :NH3+ 172:sc= 0.973 (180deg=0.867) USER MOD Single : A 751 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 752 LYS NZ :NH3+ -126:sc= 1.13 (180deg=-0.609) USER MOD Single : A 754 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 756 SER OG : rot -160:sc=-0.00202 USER MOD Single : A 757 ASN : amide:sc= -0.0129 K(o=-0.013,f=-0.53) USER MOD Single : A 764 HIS : +bothHN:sc= 0.502 K(o=0.5,f=-6.4!) USER MOD Single : A 766 LYS NZ :NH3+ -121:sc= -0.016 (180deg=-0.628) USER MOD Single : A 767 ASN : amide:sc= 0.377 X(o=0.38,f=0) USER MOD Single : A 768 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0374) USER MOD Single : A 774 ASN : amide:sc= 0.0129 X(o=0.013,f=0) USER MOD Single : A 775 SER OG : rot -115:sc= 1.2 USER MOD Single : A 776 ASN :FLIP amide:sc= -0.672 F(o=-2.3!,f=-0.67) USER MOD Single : A 779 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 CYS SG : rot 180:sc= 0 USER MOD Single : A 784 LYS NZ :NH3+ 173:sc=-0.00862 (180deg=-0.068) USER MOD Single : A 789 HIS :FLIP no HD1:sc= -0.538 F(o=-1.2,f=-0.54) USER MOD Single : A 790 THR OG1 : rot 114:sc= -0.766! USER MOD Single : A 794 ASN :FLIP amide:sc= -5.99! C(o=-6.8!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 690 27.531 -9.403 -1.284 1.00 0.00 N ATOM 2 CA THR A 690 26.860 -8.321 -0.656 1.00 0.00 C ATOM 3 C THR A 690 26.336 -7.381 -1.715 1.00 0.00 C ATOM 4 O THR A 690 26.965 -7.204 -2.760 1.00 0.00 O ATOM 5 CB THR A 690 27.814 -7.559 0.300 1.00 0.00 C ATOM 6 OG1 THR A 690 29.084 -7.336 -0.345 1.00 0.00 O ATOM 7 CG2 THR A 690 28.033 -8.326 1.596 1.00 0.00 C ATOM 0 HA THR A 690 26.032 -8.714 -0.067 1.00 0.00 H new ATOM 0 HB THR A 690 27.348 -6.603 0.541 1.00 0.00 H new ATOM 0 HG1 THR A 690 29.303 -8.105 -0.911 1.00 0.00 H new ATOM 0 HG21 THR A 690 28.706 -7.763 2.242 1.00 0.00 H new ATOM 0 HG22 THR A 690 27.078 -8.466 2.102 1.00 0.00 H new ATOM 0 HG23 THR A 690 28.472 -9.299 1.373 1.00 0.00 H new ATOM 15 N CYS A 691 25.189 -6.841 -1.482 1.00 0.00 N ATOM 16 CA CYS A 691 24.630 -5.851 -2.373 1.00 0.00 C ATOM 17 C CYS A 691 25.370 -4.565 -2.241 1.00 0.00 C ATOM 18 O CYS A 691 26.000 -4.097 -3.185 1.00 0.00 O ATOM 19 CB CYS A 691 23.137 -5.653 -2.131 1.00 0.00 C ATOM 20 SG CYS A 691 22.127 -6.945 -2.895 1.00 0.00 S ATOM 0 H CYS A 691 24.605 -7.064 -0.676 1.00 0.00 H new ATOM 0 HA CYS A 691 24.742 -6.215 -3.394 1.00 0.00 H new ATOM 0 HB2 CYS A 691 22.946 -5.636 -1.058 1.00 0.00 H new ATOM 0 HB3 CYS A 691 22.835 -4.682 -2.524 1.00 0.00 H new ATOM 25 N GLY A 692 25.303 -4.005 -1.086 1.00 0.00 N ATOM 26 CA GLY A 692 25.940 -2.838 -0.820 1.00 0.00 C ATOM 27 C GLY A 692 24.981 -1.950 -0.184 1.00 0.00 C ATOM 28 O GLY A 692 23.909 -2.396 0.241 1.00 0.00 O ATOM 0 H GLY A 692 24.778 -4.386 -0.299 1.00 0.00 H new ATOM 0 HA2 GLY A 692 26.796 -3.009 -0.167 1.00 0.00 H new ATOM 0 HA3 GLY A 692 26.324 -2.393 -1.738 1.00 0.00 H new ATOM 32 N ASP A 693 25.338 -0.742 -0.167 1.00 0.00 N ATOM 33 CA ASP A 693 24.587 0.369 0.403 1.00 0.00 C ATOM 34 C ASP A 693 23.126 0.325 0.004 1.00 0.00 C ATOM 35 O ASP A 693 22.769 0.011 -1.157 1.00 0.00 O ATOM 36 CB ASP A 693 25.217 1.699 -0.041 1.00 0.00 C ATOM 37 CG ASP A 693 25.071 1.991 -1.527 1.00 0.00 C ATOM 38 OD1 ASP A 693 25.621 1.236 -2.371 1.00 0.00 O ATOM 39 OD2 ASP A 693 24.418 2.979 -1.887 1.00 0.00 O ATOM 0 H ASP A 693 26.224 -0.441 -0.572 1.00 0.00 H new ATOM 0 HA ASP A 693 24.632 0.284 1.489 1.00 0.00 H new ATOM 0 HB2 ASP A 693 24.760 2.511 0.524 1.00 0.00 H new ATOM 0 HB3 ASP A 693 26.277 1.690 0.214 1.00 0.00 H new ATOM 44 N ILE A 694 22.283 0.579 0.964 1.00 0.00 N ATOM 45 CA ILE A 694 20.877 0.598 0.722 1.00 0.00 C ATOM 46 C ILE A 694 20.486 1.789 -0.155 1.00 0.00 C ATOM 47 O ILE A 694 21.164 2.831 -0.160 1.00 0.00 O ATOM 48 CB ILE A 694 19.990 0.515 2.028 1.00 0.00 C ATOM 49 CG1 ILE A 694 20.516 1.341 3.225 1.00 0.00 C ATOM 50 CG2 ILE A 694 19.766 -0.908 2.429 1.00 0.00 C ATOM 51 CD1 ILE A 694 20.688 2.813 2.988 1.00 0.00 C ATOM 0 H ILE A 694 22.552 0.777 1.928 1.00 0.00 H new ATOM 0 HA ILE A 694 20.659 -0.321 0.177 1.00 0.00 H new ATOM 0 HB ILE A 694 19.041 0.976 1.755 1.00 0.00 H new ATOM 0 HG12 ILE A 694 19.831 1.206 4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 694 21.477 0.928 3.530 1.00 0.00 H new ATOM 0 HG21 ILE A 694 19.153 -0.940 3.330 1.00 0.00 H new ATOM 0 HG22 ILE A 694 19.256 -1.437 1.624 1.00 0.00 H new ATOM 0 HG23 ILE A 694 20.726 -1.386 2.626 1.00 0.00 H new ATOM 0 HD11 ILE A 694 21.061 3.287 3.896 1.00 0.00 H new ATOM 0 HD12 ILE A 694 21.400 2.970 2.178 1.00 0.00 H new ATOM 0 HD13 ILE A 694 19.728 3.253 2.718 1.00 0.00 H new ATOM 63 N PRO A 695 19.461 1.624 -0.964 1.00 0.00 N ATOM 64 CA PRO A 695 18.932 2.686 -1.816 1.00 0.00 C ATOM 65 C PRO A 695 18.171 3.744 -1.004 1.00 0.00 C ATOM 66 O PRO A 695 18.198 3.747 0.233 1.00 0.00 O ATOM 67 CB PRO A 695 17.969 1.929 -2.722 1.00 0.00 C ATOM 68 CG PRO A 695 17.536 0.783 -1.904 1.00 0.00 C ATOM 69 CD PRO A 695 18.745 0.367 -1.158 1.00 0.00 C ATOM 0 HA PRO A 695 19.714 3.232 -2.344 1.00 0.00 H new ATOM 0 HB2 PRO A 695 17.124 2.552 -3.015 1.00 0.00 H new ATOM 0 HB3 PRO A 695 18.458 1.602 -3.640 1.00 0.00 H new ATOM 0 HG2 PRO A 695 16.731 1.064 -1.225 1.00 0.00 H new ATOM 0 HG3 PRO A 695 17.159 -0.027 -2.528 1.00 0.00 H new ATOM 0 HD2 PRO A 695 18.491 -0.103 -0.208 1.00 0.00 H new ATOM 0 HD3 PRO A 695 19.339 -0.353 -1.721 1.00 0.00 H new ATOM 77 N GLU A 696 17.479 4.604 -1.688 1.00 0.00 N ATOM 78 CA GLU A 696 16.749 5.638 -1.081 1.00 0.00 C ATOM 79 C GLU A 696 15.414 5.681 -1.755 1.00 0.00 C ATOM 80 O GLU A 696 15.291 5.412 -2.963 1.00 0.00 O ATOM 81 CB GLU A 696 17.486 6.989 -1.198 1.00 0.00 C ATOM 82 CG GLU A 696 17.573 7.540 -2.608 1.00 0.00 C ATOM 83 CD GLU A 696 18.497 8.707 -2.730 1.00 0.00 C ATOM 84 OE1 GLU A 696 18.209 9.777 -2.182 1.00 0.00 O ATOM 85 OE2 GLU A 696 19.529 8.572 -3.409 1.00 0.00 O ATOM 0 H GLU A 696 17.415 4.593 -2.706 1.00 0.00 H new ATOM 0 HA GLU A 696 16.632 5.452 -0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 696 16.980 7.720 -0.567 1.00 0.00 H new ATOM 0 HB3 GLU A 696 18.496 6.872 -0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 696 17.907 6.749 -3.280 1.00 0.00 H new ATOM 0 HG3 GLU A 696 16.577 7.838 -2.936 1.00 0.00 H new ATOM 92 N LEU A 697 14.445 5.949 -1.005 1.00 0.00 N ATOM 93 CA LEU A 697 13.111 6.008 -1.488 1.00 0.00 C ATOM 94 C LEU A 697 12.764 7.422 -1.889 1.00 0.00 C ATOM 95 O LEU A 697 12.859 8.338 -1.082 1.00 0.00 O ATOM 96 CB LEU A 697 12.148 5.431 -0.447 1.00 0.00 C ATOM 97 CG LEU A 697 10.655 5.499 -0.741 1.00 0.00 C ATOM 98 CD1 LEU A 697 10.344 4.933 -2.110 1.00 0.00 C ATOM 99 CD2 LEU A 697 9.916 4.699 0.291 1.00 0.00 C ATOM 0 H LEU A 697 14.537 6.142 -0.008 1.00 0.00 H new ATOM 0 HA LEU A 697 13.015 5.394 -2.383 1.00 0.00 H new ATOM 0 HB2 LEU A 697 12.411 4.385 -0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 697 12.327 5.947 0.496 1.00 0.00 H new ATOM 0 HG LEU A 697 10.345 6.544 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 697 9.271 4.994 -2.294 1.00 0.00 H new ATOM 0 HD12 LEU A 697 10.876 5.506 -2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 697 10.661 3.891 -2.153 1.00 0.00 H new ATOM 0 HD21 LEU A 697 8.846 4.743 0.088 1.00 0.00 H new ATOM 0 HD22 LEU A 697 10.250 3.662 0.255 1.00 0.00 H new ATOM 0 HD23 LEU A 697 10.114 5.110 1.281 1.00 0.00 H new ATOM 111 N GLU A 698 12.351 7.546 -3.146 1.00 0.00 N ATOM 112 CA GLU A 698 11.979 8.792 -3.848 1.00 0.00 C ATOM 113 C GLU A 698 11.384 9.901 -2.962 1.00 0.00 C ATOM 114 O GLU A 698 11.829 11.036 -3.009 1.00 0.00 O ATOM 115 CB GLU A 698 11.012 8.447 -4.974 1.00 0.00 C ATOM 116 CG GLU A 698 9.882 7.527 -4.532 1.00 0.00 C ATOM 117 CD GLU A 698 8.885 7.264 -5.602 1.00 0.00 C ATOM 118 OE1 GLU A 698 9.249 6.679 -6.637 1.00 0.00 O ATOM 119 OE2 GLU A 698 7.713 7.616 -5.415 1.00 0.00 O ATOM 0 H GLU A 698 12.257 6.730 -3.751 1.00 0.00 H new ATOM 0 HA GLU A 698 12.910 9.214 -4.225 1.00 0.00 H new ATOM 0 HB2 GLU A 698 10.587 9.367 -5.374 1.00 0.00 H new ATOM 0 HB3 GLU A 698 11.563 7.971 -5.785 1.00 0.00 H new ATOM 0 HG2 GLU A 698 10.304 6.579 -4.198 1.00 0.00 H new ATOM 0 HG3 GLU A 698 9.376 7.971 -3.675 1.00 0.00 H new ATOM 126 N HIS A 699 10.380 9.584 -2.181 1.00 0.00 N ATOM 127 CA HIS A 699 9.750 10.577 -1.318 1.00 0.00 C ATOM 128 C HIS A 699 9.522 9.961 0.046 1.00 0.00 C ATOM 129 O HIS A 699 8.688 10.425 0.821 1.00 0.00 O ATOM 130 CB HIS A 699 8.391 11.054 -1.894 1.00 0.00 C ATOM 131 CG HIS A 699 8.430 11.719 -3.249 1.00 0.00 C ATOM 132 ND1 HIS A 699 8.483 13.081 -3.426 1.00 0.00 N ATOM 133 CD2 HIS A 699 8.368 11.190 -4.499 1.00 0.00 C ATOM 134 CE1 HIS A 699 8.443 13.356 -4.715 1.00 0.00 C ATOM 135 NE2 HIS A 699 8.376 12.227 -5.379 1.00 0.00 N ATOM 0 H HIS A 699 9.976 8.650 -2.119 1.00 0.00 H new ATOM 0 HA HIS A 699 10.410 11.442 -1.249 1.00 0.00 H new ATOM 0 HB2 HIS A 699 7.725 10.193 -1.956 1.00 0.00 H new ATOM 0 HB3 HIS A 699 7.945 11.751 -1.184 1.00 0.00 H new ATOM 0 HD2 HIS A 699 8.321 10.140 -4.748 1.00 0.00 H new ATOM 0 HE1 HIS A 699 8.462 14.344 -5.150 1.00 0.00 H new ATOM 0 HE2 HIS A 699 8.336 12.140 -6.395 1.00 0.00 H new ATOM 144 N GLY A 700 10.295 8.951 0.353 1.00 0.00 N ATOM 145 CA GLY A 700 10.103 8.228 1.577 1.00 0.00 C ATOM 146 C GLY A 700 11.395 7.989 2.296 1.00 0.00 C ATOM 147 O GLY A 700 12.391 8.654 2.016 1.00 0.00 O ATOM 0 H GLY A 700 11.062 8.613 -0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 700 9.425 8.785 2.224 1.00 0.00 H new ATOM 0 HA3 GLY A 700 9.625 7.272 1.362 1.00 0.00 H new ATOM 151 N TRP A 701 11.399 7.014 3.160 1.00 0.00 N ATOM 152 CA TRP A 701 12.533 6.751 4.026 1.00 0.00 C ATOM 153 C TRP A 701 12.772 5.247 4.192 1.00 0.00 C ATOM 154 O TRP A 701 11.970 4.425 3.730 1.00 0.00 O ATOM 155 CB TRP A 701 12.300 7.411 5.413 1.00 0.00 C ATOM 156 CG TRP A 701 11.046 6.944 6.143 1.00 0.00 C ATOM 157 CD1 TRP A 701 10.165 5.979 5.746 1.00 0.00 C ATOM 158 CD2 TRP A 701 10.543 7.429 7.392 1.00 0.00 C ATOM 159 NE1 TRP A 701 9.173 5.837 6.655 1.00 0.00 N ATOM 160 CE2 TRP A 701 9.373 6.706 7.666 1.00 0.00 C ATOM 161 CE3 TRP A 701 10.962 8.399 8.305 1.00 0.00 C ATOM 162 CZ2 TRP A 701 8.616 6.905 8.787 1.00 0.00 C ATOM 163 CZ3 TRP A 701 10.198 8.604 9.442 1.00 0.00 C ATOM 164 CH2 TRP A 701 9.033 7.857 9.673 1.00 0.00 C ATOM 0 H TRP A 701 10.617 6.372 3.291 1.00 0.00 H new ATOM 0 HA TRP A 701 13.421 7.181 3.563 1.00 0.00 H new ATOM 0 HB2 TRP A 701 13.166 7.211 6.044 1.00 0.00 H new ATOM 0 HB3 TRP A 701 12.245 8.491 5.280 1.00 0.00 H new ATOM 0 HD1 TRP A 701 10.249 5.408 4.833 1.00 0.00 H new ATOM 0 HE1 TRP A 701 8.398 5.178 6.586 1.00 0.00 H new ATOM 0 HE3 TRP A 701 11.859 8.975 8.129 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 7.720 6.330 8.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 10.503 9.350 10.161 1.00 0.00 H new ATOM 0 HH2 TRP A 701 8.456 8.038 10.568 1.00 0.00 H new ATOM 175 N ALA A 702 13.822 4.914 4.898 1.00 0.00 N ATOM 176 CA ALA A 702 14.193 3.545 5.179 1.00 0.00 C ATOM 177 C ALA A 702 13.999 3.276 6.654 1.00 0.00 C ATOM 178 O ALA A 702 14.414 4.089 7.494 1.00 0.00 O ATOM 179 CB ALA A 702 15.652 3.316 4.819 1.00 0.00 C ATOM 0 H ALA A 702 14.459 5.600 5.304 1.00 0.00 H new ATOM 0 HA ALA A 702 13.569 2.874 4.588 1.00 0.00 H new ATOM 0 HB1 ALA A 702 15.922 2.282 5.034 1.00 0.00 H new ATOM 0 HB2 ALA A 702 15.801 3.517 3.758 1.00 0.00 H new ATOM 0 HB3 ALA A 702 16.281 3.985 5.406 1.00 0.00 H new ATOM 185 N GLN A 703 13.382 2.165 6.980 1.00 0.00 N ATOM 186 CA GLN A 703 13.161 1.817 8.363 1.00 0.00 C ATOM 187 C GLN A 703 14.419 1.340 9.075 1.00 0.00 C ATOM 188 O GLN A 703 14.992 2.080 9.874 1.00 0.00 O ATOM 189 CB GLN A 703 12.008 0.838 8.540 1.00 0.00 C ATOM 190 CG GLN A 703 10.655 1.522 8.557 1.00 0.00 C ATOM 191 CD GLN A 703 10.536 2.531 9.702 1.00 0.00 C ATOM 192 OE1 GLN A 703 11.147 2.373 10.761 1.00 0.00 O ATOM 193 NE2 GLN A 703 9.748 3.560 9.520 1.00 0.00 N ATOM 0 H GLN A 703 13.024 1.487 6.307 1.00 0.00 H new ATOM 0 HA GLN A 703 12.871 2.748 8.850 1.00 0.00 H new ATOM 0 HB2 GLN A 703 12.031 0.107 7.732 1.00 0.00 H new ATOM 0 HB3 GLN A 703 12.144 0.288 9.471 1.00 0.00 H new ATOM 0 HG2 GLN A 703 10.495 2.032 7.607 1.00 0.00 H new ATOM 0 HG3 GLN A 703 9.871 0.771 8.653 1.00 0.00 H new ATOM 0 HE21 GLN A 703 9.252 3.672 8.636 1.00 0.00 H new ATOM 0 HE22 GLN A 703 9.630 4.250 10.262 1.00 0.00 H new ATOM 202 N LEU A 704 14.871 0.134 8.773 1.00 0.00 N ATOM 203 CA LEU A 704 16.036 -0.416 9.447 1.00 0.00 C ATOM 204 C LEU A 704 16.628 -1.571 8.636 1.00 0.00 C ATOM 205 O LEU A 704 15.892 -2.354 8.019 1.00 0.00 O ATOM 206 CB LEU A 704 15.629 -0.872 10.896 1.00 0.00 C ATOM 207 CG LEU A 704 16.741 -1.292 11.906 1.00 0.00 C ATOM 208 CD1 LEU A 704 16.168 -1.307 13.312 1.00 0.00 C ATOM 209 CD2 LEU A 704 17.301 -2.679 11.605 1.00 0.00 C ATOM 0 H LEU A 704 14.454 -0.478 8.072 1.00 0.00 H new ATOM 0 HA LEU A 704 16.808 0.349 9.530 1.00 0.00 H new ATOM 0 HB2 LEU A 704 15.066 -0.056 11.350 1.00 0.00 H new ATOM 0 HB3 LEU A 704 14.944 -1.714 10.794 1.00 0.00 H new ATOM 0 HG LEU A 704 17.549 -0.566 11.815 1.00 0.00 H new ATOM 0 HD11 LEU A 704 16.945 -1.600 14.018 1.00 0.00 H new ATOM 0 HD12 LEU A 704 15.803 -0.312 13.567 1.00 0.00 H new ATOM 0 HD13 LEU A 704 15.344 -2.019 13.362 1.00 0.00 H new ATOM 0 HD21 LEU A 704 18.072 -2.926 12.335 1.00 0.00 H new ATOM 0 HD22 LEU A 704 16.499 -3.415 11.660 1.00 0.00 H new ATOM 0 HD23 LEU A 704 17.733 -2.688 10.604 1.00 0.00 H new ATOM 221 N SER A 705 17.944 -1.603 8.593 1.00 0.00 N ATOM 222 CA SER A 705 18.731 -2.676 8.059 1.00 0.00 C ATOM 223 C SER A 705 20.145 -2.453 8.575 1.00 0.00 C ATOM 224 O SER A 705 20.365 -1.520 9.368 1.00 0.00 O ATOM 225 CB SER A 705 18.691 -2.705 6.522 1.00 0.00 C ATOM 226 OG SER A 705 19.430 -3.813 5.994 1.00 0.00 O ATOM 0 H SER A 705 18.515 -0.837 8.950 1.00 0.00 H new ATOM 0 HA SER A 705 18.340 -3.643 8.377 1.00 0.00 H new ATOM 0 HB2 SER A 705 17.656 -2.765 6.186 1.00 0.00 H new ATOM 0 HB3 SER A 705 19.100 -1.774 6.130 1.00 0.00 H new ATOM 0 HG SER A 705 20.276 -3.492 5.617 1.00 0.00 H new ATOM 232 N SER A 706 21.078 -3.256 8.157 1.00 0.00 N ATOM 233 CA SER A 706 22.430 -3.137 8.601 1.00 0.00 C ATOM 234 C SER A 706 23.370 -3.664 7.529 1.00 0.00 C ATOM 235 O SER A 706 23.049 -4.653 6.863 1.00 0.00 O ATOM 236 CB SER A 706 22.593 -3.914 9.913 1.00 0.00 C ATOM 237 OG SER A 706 22.102 -5.251 9.784 1.00 0.00 O ATOM 0 H SER A 706 20.919 -4.015 7.495 1.00 0.00 H new ATOM 0 HA SER A 706 22.678 -2.091 8.780 1.00 0.00 H new ATOM 0 HB2 SER A 706 23.645 -3.936 10.198 1.00 0.00 H new ATOM 0 HB3 SER A 706 22.057 -3.402 10.712 1.00 0.00 H new ATOM 0 HG SER A 706 22.219 -5.726 10.633 1.00 0.00 H new ATOM 243 N PRO A 707 24.518 -3.013 7.308 1.00 0.00 N ATOM 244 CA PRO A 707 25.507 -3.503 6.360 1.00 0.00 C ATOM 245 C PRO A 707 26.142 -4.798 6.906 1.00 0.00 C ATOM 246 O PRO A 707 25.964 -5.122 8.087 1.00 0.00 O ATOM 247 CB PRO A 707 26.499 -2.355 6.247 1.00 0.00 C ATOM 248 CG PRO A 707 26.400 -1.654 7.556 1.00 0.00 C ATOM 249 CD PRO A 707 24.956 -1.763 7.966 1.00 0.00 C ATOM 0 HA PRO A 707 25.104 -3.767 5.382 1.00 0.00 H new ATOM 0 HB2 PRO A 707 27.510 -2.719 6.066 1.00 0.00 H new ATOM 0 HB3 PRO A 707 26.247 -1.691 5.420 1.00 0.00 H new ATOM 0 HG2 PRO A 707 27.054 -2.114 8.297 1.00 0.00 H new ATOM 0 HG3 PRO A 707 26.704 -0.611 7.466 1.00 0.00 H new ATOM 0 HD2 PRO A 707 24.847 -1.817 9.049 1.00 0.00 H new ATOM 0 HD3 PRO A 707 24.375 -0.904 7.630 1.00 0.00 H new ATOM 257 N PRO A 708 26.889 -5.569 6.106 1.00 0.00 N ATOM 258 CA PRO A 708 27.294 -5.234 4.723 1.00 0.00 C ATOM 259 C PRO A 708 26.196 -5.333 3.689 1.00 0.00 C ATOM 260 O PRO A 708 26.446 -5.068 2.501 1.00 0.00 O ATOM 261 CB PRO A 708 28.347 -6.262 4.386 1.00 0.00 C ATOM 262 CG PRO A 708 28.433 -7.205 5.527 1.00 0.00 C ATOM 263 CD PRO A 708 27.379 -6.871 6.515 1.00 0.00 C ATOM 0 HA PRO A 708 27.618 -4.194 4.694 1.00 0.00 H new ATOM 0 HB2 PRO A 708 28.086 -6.792 3.470 1.00 0.00 H new ATOM 0 HB3 PRO A 708 29.310 -5.781 4.213 1.00 0.00 H new ATOM 0 HG2 PRO A 708 28.309 -8.230 5.177 1.00 0.00 H new ATOM 0 HG3 PRO A 708 29.417 -7.143 5.992 1.00 0.00 H new ATOM 0 HD2 PRO A 708 26.581 -7.614 6.509 1.00 0.00 H new ATOM 0 HD3 PRO A 708 27.781 -6.842 7.528 1.00 0.00 H new ATOM 271 N TYR A 709 25.025 -5.739 4.129 1.00 0.00 N ATOM 272 CA TYR A 709 23.847 -5.875 3.284 1.00 0.00 C ATOM 273 C TYR A 709 24.015 -7.088 2.376 1.00 0.00 C ATOM 274 O TYR A 709 24.382 -6.978 1.195 1.00 0.00 O ATOM 275 CB TYR A 709 23.550 -4.598 2.468 1.00 0.00 C ATOM 276 CG TYR A 709 23.265 -3.343 3.282 1.00 0.00 C ATOM 277 CD1 TYR A 709 22.113 -3.210 4.035 1.00 0.00 C ATOM 278 CD2 TYR A 709 24.168 -2.299 3.293 1.00 0.00 C ATOM 279 CE1 TYR A 709 21.871 -2.066 4.775 1.00 0.00 C ATOM 280 CE2 TYR A 709 23.941 -1.158 4.026 1.00 0.00 C ATOM 281 CZ TYR A 709 22.795 -1.042 4.765 1.00 0.00 C ATOM 282 OH TYR A 709 22.574 0.108 5.499 1.00 0.00 O ATOM 0 H TYR A 709 24.856 -5.990 5.103 1.00 0.00 H new ATOM 0 HA TYR A 709 22.982 -6.023 3.931 1.00 0.00 H new ATOM 0 HB2 TYR A 709 24.401 -4.400 1.816 1.00 0.00 H new ATOM 0 HB3 TYR A 709 22.693 -4.793 1.823 1.00 0.00 H new ATOM 0 HD1 TYR A 709 21.390 -4.012 4.046 1.00 0.00 H new ATOM 0 HD2 TYR A 709 25.075 -2.380 2.712 1.00 0.00 H new ATOM 0 HE1 TYR A 709 20.965 -1.976 5.356 1.00 0.00 H new ATOM 0 HE2 TYR A 709 24.665 -0.356 4.019 1.00 0.00 H new ATOM 0 HH TYR A 709 23.327 0.723 5.377 1.00 0.00 H new ATOM 292 N TYR A 710 23.845 -8.241 2.969 1.00 0.00 N ATOM 293 CA TYR A 710 23.993 -9.512 2.286 1.00 0.00 C ATOM 294 C TYR A 710 22.773 -9.864 1.466 1.00 0.00 C ATOM 295 O TYR A 710 21.725 -9.229 1.585 1.00 0.00 O ATOM 296 CB TYR A 710 24.235 -10.609 3.293 1.00 0.00 C ATOM 297 CG TYR A 710 25.659 -10.822 3.678 1.00 0.00 C ATOM 298 CD1 TYR A 710 26.238 -10.163 4.746 1.00 0.00 C ATOM 299 CD2 TYR A 710 26.420 -11.727 2.982 1.00 0.00 C ATOM 300 CE1 TYR A 710 27.543 -10.415 5.097 1.00 0.00 C ATOM 301 CE2 TYR A 710 27.715 -11.974 3.314 1.00 0.00 C ATOM 302 CZ TYR A 710 28.278 -11.322 4.376 1.00 0.00 C ATOM 303 OH TYR A 710 29.581 -11.583 4.727 1.00 0.00 O ATOM 0 H TYR A 710 23.596 -8.331 3.954 1.00 0.00 H new ATOM 0 HA TYR A 710 24.843 -9.417 1.610 1.00 0.00 H new ATOM 0 HB2 TYR A 710 23.663 -10.385 4.193 1.00 0.00 H new ATOM 0 HB3 TYR A 710 23.842 -11.542 2.890 1.00 0.00 H new ATOM 0 HD1 TYR A 710 25.661 -9.445 5.309 1.00 0.00 H new ATOM 0 HD2 TYR A 710 25.979 -12.256 2.150 1.00 0.00 H new ATOM 0 HE1 TYR A 710 27.988 -9.901 5.937 1.00 0.00 H new ATOM 0 HE2 TYR A 710 28.296 -12.682 2.742 1.00 0.00 H new ATOM 0 HH TYR A 710 29.957 -12.250 4.115 1.00 0.00 H new ATOM 313 N TYR A 711 22.902 -10.894 0.655 1.00 0.00 N ATOM 314 CA TYR A 711 21.799 -11.346 -0.172 1.00 0.00 C ATOM 315 C TYR A 711 20.714 -11.945 0.666 1.00 0.00 C ATOM 316 O TYR A 711 20.977 -12.753 1.571 1.00 0.00 O ATOM 317 CB TYR A 711 22.246 -12.340 -1.221 1.00 0.00 C ATOM 318 CG TYR A 711 23.050 -11.742 -2.336 1.00 0.00 C ATOM 319 CD1 TYR A 711 24.373 -11.413 -2.165 1.00 0.00 C ATOM 320 CD2 TYR A 711 22.477 -11.523 -3.574 1.00 0.00 C ATOM 321 CE1 TYR A 711 25.110 -10.881 -3.198 1.00 0.00 C ATOM 322 CE2 TYR A 711 23.208 -11.001 -4.615 1.00 0.00 C ATOM 323 CZ TYR A 711 24.527 -10.684 -4.421 1.00 0.00 C ATOM 324 OH TYR A 711 25.268 -10.171 -5.465 1.00 0.00 O ATOM 0 H TYR A 711 23.760 -11.435 0.550 1.00 0.00 H new ATOM 0 HA TYR A 711 21.410 -10.467 -0.686 1.00 0.00 H new ATOM 0 HB2 TYR A 711 22.838 -13.118 -0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 711 21.366 -12.825 -1.643 1.00 0.00 H new ATOM 0 HD1 TYR A 711 24.841 -11.574 -1.205 1.00 0.00 H new ATOM 0 HD2 TYR A 711 21.436 -11.766 -3.727 1.00 0.00 H new ATOM 0 HE1 TYR A 711 26.146 -10.619 -3.044 1.00 0.00 H new ATOM 0 HE2 TYR A 711 22.746 -10.842 -5.578 1.00 0.00 H new ATOM 0 HH TYR A 711 24.789 -10.316 -6.308 1.00 0.00 H new ATOM 334 N GLY A 712 19.513 -11.555 0.376 1.00 0.00 N ATOM 335 CA GLY A 712 18.393 -12.020 1.127 1.00 0.00 C ATOM 336 C GLY A 712 17.952 -11.001 2.149 1.00 0.00 C ATOM 337 O GLY A 712 16.878 -11.133 2.739 1.00 0.00 O ATOM 0 H GLY A 712 19.283 -10.911 -0.381 1.00 0.00 H new ATOM 0 HA2 GLY A 712 17.567 -12.241 0.451 1.00 0.00 H new ATOM 0 HA3 GLY A 712 18.652 -12.952 1.629 1.00 0.00 H new ATOM 341 N ASP A 713 18.776 -9.973 2.357 1.00 0.00 N ATOM 342 CA ASP A 713 18.452 -8.915 3.321 1.00 0.00 C ATOM 343 C ASP A 713 17.286 -8.138 2.791 1.00 0.00 C ATOM 344 O ASP A 713 17.105 -8.023 1.556 1.00 0.00 O ATOM 345 CB ASP A 713 19.590 -7.930 3.479 1.00 0.00 C ATOM 346 CG ASP A 713 19.689 -7.321 4.876 1.00 0.00 C ATOM 347 OD1 ASP A 713 18.820 -6.503 5.252 1.00 0.00 O ATOM 348 OD2 ASP A 713 20.648 -7.665 5.631 1.00 0.00 O ATOM 0 H ASP A 713 19.667 -9.849 1.876 1.00 0.00 H new ATOM 0 HA ASP A 713 18.246 -9.390 4.280 1.00 0.00 H new ATOM 0 HB2 ASP A 713 20.528 -8.433 3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 713 19.468 -7.128 2.751 1.00 0.00 H new ATOM 353 N SER A 714 16.521 -7.604 3.662 1.00 0.00 N ATOM 354 CA SER A 714 15.374 -6.846 3.285 1.00 0.00 C ATOM 355 C SER A 714 15.241 -5.637 4.178 1.00 0.00 C ATOM 356 O SER A 714 15.518 -5.697 5.389 1.00 0.00 O ATOM 357 CB SER A 714 14.139 -7.679 3.400 1.00 0.00 C ATOM 358 OG SER A 714 14.279 -8.925 2.705 1.00 0.00 O ATOM 0 H SER A 714 16.667 -7.676 4.669 1.00 0.00 H new ATOM 0 HA SER A 714 15.496 -6.527 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 714 13.924 -7.870 4.451 1.00 0.00 H new ATOM 0 HB3 SER A 714 13.289 -7.129 2.996 1.00 0.00 H new ATOM 0 HG SER A 714 13.455 -9.447 2.801 1.00 0.00 H new ATOM 364 N VAL A 715 14.820 -4.551 3.601 1.00 0.00 N ATOM 365 CA VAL A 715 14.719 -3.307 4.320 1.00 0.00 C ATOM 366 C VAL A 715 13.367 -2.690 4.056 1.00 0.00 C ATOM 367 O VAL A 715 12.968 -2.573 2.905 1.00 0.00 O ATOM 368 CB VAL A 715 15.788 -2.314 3.829 1.00 0.00 C ATOM 369 CG1 VAL A 715 15.852 -1.071 4.705 1.00 0.00 C ATOM 370 CG2 VAL A 715 17.134 -2.967 3.719 1.00 0.00 C ATOM 0 H VAL A 715 14.537 -4.498 2.623 1.00 0.00 H new ATOM 0 HA VAL A 715 14.859 -3.510 5.382 1.00 0.00 H new ATOM 0 HB VAL A 715 15.490 -1.993 2.831 1.00 0.00 H new ATOM 0 HG11 VAL A 715 16.619 -0.396 4.324 1.00 0.00 H new ATOM 0 HG12 VAL A 715 14.886 -0.567 4.692 1.00 0.00 H new ATOM 0 HG13 VAL A 715 16.097 -1.359 5.727 1.00 0.00 H new ATOM 0 HG21 VAL A 715 17.865 -2.238 3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 715 17.436 -3.344 4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 715 17.080 -3.794 3.011 1.00 0.00 H new ATOM 380 N GLU A 716 12.653 -2.357 5.100 1.00 0.00 N ATOM 381 CA GLU A 716 11.399 -1.657 4.959 1.00 0.00 C ATOM 382 C GLU A 716 11.616 -0.226 4.534 1.00 0.00 C ATOM 383 O GLU A 716 12.514 0.456 5.037 1.00 0.00 O ATOM 384 CB GLU A 716 10.571 -1.685 6.231 1.00 0.00 C ATOM 385 CG GLU A 716 10.016 -3.034 6.582 1.00 0.00 C ATOM 386 CD GLU A 716 9.030 -2.952 7.700 1.00 0.00 C ATOM 387 OE1 GLU A 716 7.832 -2.693 7.435 1.00 0.00 O ATOM 388 OE2 GLU A 716 9.410 -3.145 8.857 1.00 0.00 O ATOM 0 H GLU A 716 12.919 -2.560 6.063 1.00 0.00 H new ATOM 0 HA GLU A 716 10.845 -2.185 4.183 1.00 0.00 H new ATOM 0 HB2 GLU A 716 11.187 -1.333 7.058 1.00 0.00 H new ATOM 0 HB3 GLU A 716 9.745 -0.982 6.127 1.00 0.00 H new ATOM 0 HG2 GLU A 716 9.537 -3.470 5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 716 10.831 -3.701 6.864 1.00 0.00 H new ATOM 395 N PHE A 717 10.796 0.212 3.635 1.00 0.00 N ATOM 396 CA PHE A 717 10.817 1.542 3.112 1.00 0.00 C ATOM 397 C PHE A 717 9.399 1.992 3.006 1.00 0.00 C ATOM 398 O PHE A 717 8.590 1.319 2.385 1.00 0.00 O ATOM 399 CB PHE A 717 11.482 1.594 1.733 1.00 0.00 C ATOM 400 CG PHE A 717 12.979 1.734 1.716 1.00 0.00 C ATOM 401 CD1 PHE A 717 13.802 0.671 1.968 1.00 0.00 C ATOM 402 CD2 PHE A 717 13.550 2.952 1.414 1.00 0.00 C ATOM 403 CE1 PHE A 717 15.172 0.823 1.925 1.00 0.00 C ATOM 404 CE2 PHE A 717 14.913 3.109 1.360 1.00 0.00 C ATOM 405 CZ PHE A 717 15.727 2.040 1.617 1.00 0.00 C ATOM 0 H PHE A 717 10.063 -0.369 3.228 1.00 0.00 H new ATOM 0 HA PHE A 717 11.395 2.190 3.771 1.00 0.00 H new ATOM 0 HB2 PHE A 717 11.218 0.685 1.192 1.00 0.00 H new ATOM 0 HB3 PHE A 717 11.055 2.430 1.179 1.00 0.00 H new ATOM 0 HD1 PHE A 717 13.376 -0.294 2.202 1.00 0.00 H new ATOM 0 HD2 PHE A 717 12.912 3.800 1.216 1.00 0.00 H new ATOM 0 HE1 PHE A 717 15.812 -0.021 2.135 1.00 0.00 H new ATOM 0 HE2 PHE A 717 15.340 4.071 1.116 1.00 0.00 H new ATOM 0 HZ PHE A 717 16.800 2.153 1.578 1.00 0.00 H new ATOM 415 N ASN A 718 9.084 3.080 3.623 1.00 0.00 N ATOM 416 CA ASN A 718 7.734 3.567 3.628 1.00 0.00 C ATOM 417 C ASN A 718 7.812 5.042 3.382 1.00 0.00 C ATOM 418 O ASN A 718 8.870 5.563 3.039 1.00 0.00 O ATOM 419 CB ASN A 718 7.041 3.340 4.993 1.00 0.00 C ATOM 420 CG ASN A 718 7.285 1.983 5.631 1.00 0.00 C ATOM 421 OD1 ASN A 718 6.625 0.994 5.339 1.00 0.00 O ATOM 422 ND2 ASN A 718 8.170 1.979 6.586 1.00 0.00 N ATOM 0 H ASN A 718 9.747 3.659 4.138 1.00 0.00 H new ATOM 0 HA ASN A 718 7.156 3.038 2.870 1.00 0.00 H new ATOM 0 HB2 ASN A 718 7.376 4.113 5.684 1.00 0.00 H new ATOM 0 HB3 ASN A 718 5.967 3.473 4.863 1.00 0.00 H new ATOM 0 HD21 ASN A 718 8.335 1.129 7.124 1.00 0.00 H new ATOM 0 HD22 ASN A 718 8.698 2.826 6.796 1.00 0.00 H new ATOM 429 N CYS A 719 6.763 5.725 3.631 1.00 0.00 N ATOM 430 CA CYS A 719 6.740 7.138 3.409 1.00 0.00 C ATOM 431 C CYS A 719 6.563 7.760 4.756 1.00 0.00 C ATOM 432 O CYS A 719 5.692 7.328 5.517 1.00 0.00 O ATOM 433 CB CYS A 719 5.610 7.507 2.456 1.00 0.00 C ATOM 434 SG CYS A 719 5.513 6.390 1.018 1.00 0.00 S ATOM 0 H CYS A 719 5.893 5.334 3.993 1.00 0.00 H new ATOM 0 HA CYS A 719 7.657 7.496 2.941 1.00 0.00 H new ATOM 0 HB2 CYS A 719 4.663 7.483 2.995 1.00 0.00 H new ATOM 0 HB3 CYS A 719 5.753 8.530 2.108 1.00 0.00 H new ATOM 439 N SER A 720 7.400 8.712 5.045 1.00 0.00 N ATOM 440 CA SER A 720 7.515 9.358 6.361 1.00 0.00 C ATOM 441 C SER A 720 6.148 9.750 6.932 1.00 0.00 C ATOM 442 O SER A 720 5.632 9.117 7.866 1.00 0.00 O ATOM 443 CB SER A 720 8.403 10.578 6.189 1.00 0.00 C ATOM 444 OG SER A 720 9.523 10.244 5.383 1.00 0.00 O ATOM 0 H SER A 720 8.055 9.089 4.360 1.00 0.00 H new ATOM 0 HA SER A 720 7.949 8.660 7.077 1.00 0.00 H new ATOM 0 HB2 SER A 720 7.839 11.388 5.727 1.00 0.00 H new ATOM 0 HB3 SER A 720 8.737 10.937 7.162 1.00 0.00 H new ATOM 0 HG SER A 720 9.987 9.473 5.771 1.00 0.00 H new ATOM 450 N GLU A 721 5.585 10.748 6.342 1.00 0.00 N ATOM 451 CA GLU A 721 4.283 11.239 6.614 1.00 0.00 C ATOM 452 C GLU A 721 4.050 12.191 5.500 1.00 0.00 C ATOM 453 O GLU A 721 5.023 12.503 4.810 1.00 0.00 O ATOM 454 CB GLU A 721 4.186 11.941 7.982 1.00 0.00 C ATOM 455 CG GLU A 721 5.052 13.174 8.151 1.00 0.00 C ATOM 456 CD GLU A 721 4.831 13.818 9.488 1.00 0.00 C ATOM 457 OE1 GLU A 721 3.870 14.605 9.631 1.00 0.00 O ATOM 458 OE2 GLU A 721 5.593 13.530 10.431 1.00 0.00 O ATOM 0 H GLU A 721 6.056 11.276 5.608 1.00 0.00 H new ATOM 0 HA GLU A 721 3.542 10.442 6.672 1.00 0.00 H new ATOM 0 HB2 GLU A 721 3.147 12.223 8.152 1.00 0.00 H new ATOM 0 HB3 GLU A 721 4.452 11.223 8.758 1.00 0.00 H new ATOM 0 HG2 GLU A 721 6.102 12.900 8.046 1.00 0.00 H new ATOM 0 HG3 GLU A 721 4.828 13.889 7.359 1.00 0.00 H new ATOM 465 N SER A 722 2.811 12.604 5.268 1.00 0.00 N ATOM 466 CA SER A 722 2.473 13.519 4.158 1.00 0.00 C ATOM 467 C SER A 722 2.696 12.871 2.778 1.00 0.00 C ATOM 468 O SER A 722 2.607 13.524 1.738 1.00 0.00 O ATOM 469 CB SER A 722 3.305 14.774 4.252 1.00 0.00 C ATOM 470 OG SER A 722 3.034 15.513 5.438 1.00 0.00 O ATOM 0 H SER A 722 2.009 12.323 5.833 1.00 0.00 H new ATOM 0 HA SER A 722 1.414 13.757 4.252 1.00 0.00 H new ATOM 0 HB2 SER A 722 4.362 14.510 4.225 1.00 0.00 H new ATOM 0 HB3 SER A 722 3.111 15.402 3.383 1.00 0.00 H new ATOM 0 HG SER A 722 3.595 16.316 5.459 1.00 0.00 H new ATOM 476 N PHE A 723 2.974 11.607 2.791 1.00 0.00 N ATOM 477 CA PHE A 723 3.234 10.841 1.634 1.00 0.00 C ATOM 478 C PHE A 723 2.610 9.491 1.800 1.00 0.00 C ATOM 479 O PHE A 723 2.591 8.919 2.893 1.00 0.00 O ATOM 480 CB PHE A 723 4.732 10.697 1.353 1.00 0.00 C ATOM 481 CG PHE A 723 5.435 11.986 1.032 1.00 0.00 C ATOM 482 CD1 PHE A 723 5.391 12.497 -0.244 1.00 0.00 C ATOM 483 CD2 PHE A 723 6.135 12.680 2.002 1.00 0.00 C ATOM 484 CE1 PHE A 723 6.033 13.682 -0.551 1.00 0.00 C ATOM 485 CE2 PHE A 723 6.780 13.858 1.702 1.00 0.00 C ATOM 486 CZ PHE A 723 6.729 14.360 0.423 1.00 0.00 C ATOM 0 H PHE A 723 3.026 11.064 3.653 1.00 0.00 H new ATOM 0 HA PHE A 723 2.802 11.360 0.779 1.00 0.00 H new ATOM 0 HB2 PHE A 723 5.210 10.245 2.222 1.00 0.00 H new ATOM 0 HB3 PHE A 723 4.867 10.007 0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 723 4.850 11.967 -1.014 1.00 0.00 H new ATOM 0 HD2 PHE A 723 6.176 12.292 3.009 1.00 0.00 H new ATOM 0 HE1 PHE A 723 5.988 14.076 -1.556 1.00 0.00 H new ATOM 0 HE2 PHE A 723 7.325 14.387 2.470 1.00 0.00 H new ATOM 0 HZ PHE A 723 7.234 15.284 0.184 1.00 0.00 H new ATOM 496 N THR A 724 2.119 9.026 0.748 1.00 0.00 N ATOM 497 CA THR A 724 1.433 7.796 0.642 1.00 0.00 C ATOM 498 C THR A 724 2.294 6.752 -0.090 1.00 0.00 C ATOM 499 O THR A 724 2.897 7.047 -1.135 1.00 0.00 O ATOM 500 CB THR A 724 0.043 8.020 -0.043 1.00 0.00 C ATOM 501 OG1 THR A 724 -0.973 8.177 0.932 1.00 0.00 O ATOM 502 CG2 THR A 724 -0.308 6.914 -0.972 1.00 0.00 C ATOM 0 H THR A 724 2.181 9.520 -0.142 1.00 0.00 H new ATOM 0 HA THR A 724 1.246 7.397 1.639 1.00 0.00 H new ATOM 0 HB THR A 724 0.120 8.934 -0.632 1.00 0.00 H new ATOM 0 HG1 THR A 724 -1.332 7.298 1.175 1.00 0.00 H new ATOM 0 HG21 THR A 724 -1.280 7.113 -1.424 1.00 0.00 H new ATOM 0 HG22 THR A 724 0.448 6.842 -1.754 1.00 0.00 H new ATOM 0 HG23 THR A 724 -0.349 5.975 -0.420 1.00 0.00 H new ATOM 510 N MET A 725 2.335 5.561 0.478 1.00 0.00 N ATOM 511 CA MET A 725 3.111 4.458 -0.013 1.00 0.00 C ATOM 512 C MET A 725 2.315 3.680 -1.015 1.00 0.00 C ATOM 513 O MET A 725 1.228 3.185 -0.716 1.00 0.00 O ATOM 514 CB MET A 725 3.464 3.515 1.129 1.00 0.00 C ATOM 515 CG MET A 725 4.302 2.315 0.713 1.00 0.00 C ATOM 516 SD MET A 725 3.796 0.806 1.557 1.00 0.00 S ATOM 517 CE MET A 725 2.216 0.481 0.771 1.00 0.00 C ATOM 0 H MET A 725 1.808 5.336 1.322 1.00 0.00 H new ATOM 0 HA MET A 725 4.017 4.857 -0.469 1.00 0.00 H new ATOM 0 HB2 MET A 725 4.005 4.074 1.893 1.00 0.00 H new ATOM 0 HB3 MET A 725 2.542 3.158 1.588 1.00 0.00 H new ATOM 0 HG2 MET A 725 4.219 2.172 -0.364 1.00 0.00 H new ATOM 0 HG3 MET A 725 5.352 2.515 0.928 1.00 0.00 H new ATOM 0 HE1 MET A 725 1.941 -0.562 0.925 1.00 0.00 H new ATOM 0 HE2 MET A 725 1.453 1.126 1.207 1.00 0.00 H new ATOM 0 HE3 MET A 725 2.293 0.681 -0.298 1.00 0.00 H new ATOM 527 N ILE A 726 2.833 3.590 -2.175 1.00 0.00 N ATOM 528 CA ILE A 726 2.225 2.814 -3.225 1.00 0.00 C ATOM 529 C ILE A 726 3.183 1.717 -3.689 1.00 0.00 C ATOM 530 O ILE A 726 4.376 1.963 -3.904 1.00 0.00 O ATOM 531 CB ILE A 726 1.819 3.712 -4.436 1.00 0.00 C ATOM 532 CG1 ILE A 726 0.887 4.838 -3.971 1.00 0.00 C ATOM 533 CG2 ILE A 726 1.148 2.891 -5.540 1.00 0.00 C ATOM 534 CD1 ILE A 726 -0.377 4.347 -3.288 1.00 0.00 C ATOM 0 H ILE A 726 3.702 4.052 -2.445 1.00 0.00 H new ATOM 0 HA ILE A 726 1.320 2.359 -2.823 1.00 0.00 H new ATOM 0 HB ILE A 726 2.728 4.149 -4.850 1.00 0.00 H new ATOM 0 HG12 ILE A 726 1.431 5.486 -3.284 1.00 0.00 H new ATOM 0 HG13 ILE A 726 0.610 5.446 -4.832 1.00 0.00 H new ATOM 0 HG21 ILE A 726 0.878 3.547 -6.368 1.00 0.00 H new ATOM 0 HG22 ILE A 726 1.838 2.125 -5.894 1.00 0.00 H new ATOM 0 HG23 ILE A 726 0.250 2.416 -5.145 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -0.984 5.201 -2.988 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -0.945 3.723 -3.978 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -0.111 3.764 -2.406 1.00 0.00 H new ATOM 546 N GLY A 727 2.693 0.510 -3.779 1.00 0.00 N ATOM 547 CA GLY A 727 3.486 -0.559 -4.334 1.00 0.00 C ATOM 548 C GLY A 727 3.889 -1.600 -3.324 1.00 0.00 C ATOM 549 O GLY A 727 3.234 -2.632 -3.204 1.00 0.00 O ATOM 0 H GLY A 727 1.756 0.241 -3.478 1.00 0.00 H new ATOM 0 HA2 GLY A 727 2.923 -1.040 -5.134 1.00 0.00 H new ATOM 0 HA3 GLY A 727 4.384 -0.137 -4.786 1.00 0.00 H new ATOM 553 N HIS A 728 4.923 -1.321 -2.580 1.00 0.00 N ATOM 554 CA HIS A 728 5.484 -2.280 -1.629 1.00 0.00 C ATOM 555 C HIS A 728 6.090 -1.466 -0.535 1.00 0.00 C ATOM 556 O HIS A 728 6.164 -0.274 -0.672 1.00 0.00 O ATOM 557 CB HIS A 728 6.577 -3.128 -2.327 1.00 0.00 C ATOM 558 CG HIS A 728 6.803 -4.511 -1.777 1.00 0.00 C ATOM 559 ND1 HIS A 728 7.654 -4.980 -0.830 1.00 0.00 N flip ATOM 560 CD2 HIS A 728 6.100 -5.603 -2.220 1.00 0.00 C flip ATOM 561 CE1 HIS A 728 7.439 -6.325 -0.722 1.00 0.00 C flip ATOM 562 NE2 HIS A 728 6.496 -6.675 -1.571 1.00 0.00 N flip ATOM 0 H HIS A 728 5.411 -0.426 -2.605 1.00 0.00 H new ATOM 0 HA HIS A 728 4.725 -2.962 -1.246 1.00 0.00 H new ATOM 0 HB2 HIS A 728 6.318 -3.218 -3.382 1.00 0.00 H new ATOM 0 HB3 HIS A 728 7.519 -2.581 -2.275 1.00 0.00 H new ATOM 0 HD2 HIS A 728 5.338 -5.584 -2.985 1.00 0.00 H new ATOM 0 HE1 HIS A 728 7.958 -6.992 -0.050 1.00 0.00 H new ATOM 0 HE2 HIS A 728 6.134 -7.619 -1.703 1.00 0.00 H new ATOM 571 N ARG A 729 6.510 -2.083 0.524 1.00 0.00 N ATOM 572 CA ARG A 729 7.122 -1.339 1.635 1.00 0.00 C ATOM 573 C ARG A 729 8.425 -1.936 2.104 1.00 0.00 C ATOM 574 O ARG A 729 8.844 -1.732 3.233 1.00 0.00 O ATOM 575 CB ARG A 729 6.117 -1.154 2.780 1.00 0.00 C ATOM 576 CG ARG A 729 5.287 -2.373 3.100 1.00 0.00 C ATOM 577 CD ARG A 729 5.997 -3.440 3.913 1.00 0.00 C ATOM 578 NE ARG A 729 5.301 -4.734 3.773 1.00 0.00 N ATOM 579 CZ ARG A 729 4.093 -5.065 4.291 1.00 0.00 C ATOM 580 NH1 ARG A 729 3.460 -4.258 5.146 1.00 0.00 N ATOM 581 NH2 ARG A 729 3.527 -6.214 3.935 1.00 0.00 N ATOM 0 H ARG A 729 6.452 -3.092 0.665 1.00 0.00 H new ATOM 0 HA ARG A 729 7.384 -0.352 1.254 1.00 0.00 H new ATOM 0 HB2 ARG A 729 6.661 -0.857 3.677 1.00 0.00 H new ATOM 0 HB3 ARG A 729 5.447 -0.332 2.527 1.00 0.00 H new ATOM 0 HG2 ARG A 729 4.398 -2.055 3.644 1.00 0.00 H new ATOM 0 HG3 ARG A 729 4.947 -2.817 2.165 1.00 0.00 H new ATOM 0 HD2 ARG A 729 7.030 -3.536 3.578 1.00 0.00 H new ATOM 0 HD3 ARG A 729 6.028 -3.147 4.962 1.00 0.00 H new ATOM 0 HE ARG A 729 5.778 -5.454 3.230 1.00 0.00 H new ATOM 0 HH11 ARG A 729 3.885 -3.373 5.421 1.00 0.00 H new ATOM 0 HH12 ARG A 729 2.551 -4.527 5.524 1.00 0.00 H new ATOM 0 HH21 ARG A 729 4.002 -6.835 3.279 1.00 0.00 H new ATOM 0 HH22 ARG A 729 2.618 -6.475 4.318 1.00 0.00 H new ATOM 595 N SER A 730 9.092 -2.633 1.232 1.00 0.00 N ATOM 596 CA SER A 730 10.372 -3.228 1.542 1.00 0.00 C ATOM 597 C SER A 730 11.130 -3.475 0.288 1.00 0.00 C ATOM 598 O SER A 730 10.569 -3.378 -0.814 1.00 0.00 O ATOM 599 CB SER A 730 10.231 -4.533 2.346 1.00 0.00 C ATOM 600 OG SER A 730 9.663 -4.293 3.623 1.00 0.00 O ATOM 0 H SER A 730 8.768 -2.809 0.281 1.00 0.00 H new ATOM 0 HA SER A 730 10.918 -2.523 2.169 1.00 0.00 H new ATOM 0 HB2 SER A 730 9.607 -5.237 1.795 1.00 0.00 H new ATOM 0 HB3 SER A 730 11.210 -4.998 2.463 1.00 0.00 H new ATOM 0 HG SER A 730 9.280 -3.391 3.646 1.00 0.00 H new ATOM 606 N ILE A 731 12.383 -3.754 0.454 1.00 0.00 N ATOM 607 CA ILE A 731 13.262 -4.045 -0.623 1.00 0.00 C ATOM 608 C ILE A 731 13.988 -5.308 -0.304 1.00 0.00 C ATOM 609 O ILE A 731 14.034 -5.713 0.858 1.00 0.00 O ATOM 610 CB ILE A 731 14.303 -2.933 -0.864 1.00 0.00 C ATOM 611 CG1 ILE A 731 15.143 -2.710 0.394 1.00 0.00 C ATOM 612 CG2 ILE A 731 13.624 -1.652 -1.302 1.00 0.00 C ATOM 613 CD1 ILE A 731 16.256 -1.720 0.231 1.00 0.00 C ATOM 0 H ILE A 731 12.832 -3.786 1.370 1.00 0.00 H new ATOM 0 HA ILE A 731 12.660 -4.133 -1.528 1.00 0.00 H new ATOM 0 HB ILE A 731 14.970 -3.248 -1.666 1.00 0.00 H new ATOM 0 HG12 ILE A 731 14.488 -2.372 1.197 1.00 0.00 H new ATOM 0 HG13 ILE A 731 15.566 -3.665 0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 731 14.375 -0.880 -1.467 1.00 0.00 H new ATOM 0 HG22 ILE A 731 13.076 -1.829 -2.228 1.00 0.00 H new ATOM 0 HG23 ILE A 731 12.931 -1.324 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE A 731 16.799 -1.624 1.172 1.00 0.00 H new ATOM 0 HD12 ILE A 731 16.937 -2.063 -0.548 1.00 0.00 H new ATOM 0 HD13 ILE A 731 15.843 -0.751 -0.050 1.00 0.00 H new ATOM 625 N THR A 732 14.542 -5.927 -1.294 1.00 0.00 N ATOM 626 CA THR A 732 15.276 -7.154 -1.071 1.00 0.00 C ATOM 627 C THR A 732 16.567 -7.156 -1.856 1.00 0.00 C ATOM 628 O THR A 732 16.595 -6.759 -3.004 1.00 0.00 O ATOM 629 CB THR A 732 14.442 -8.382 -1.469 1.00 0.00 C ATOM 630 OG1 THR A 732 13.127 -8.275 -0.867 1.00 0.00 O ATOM 631 CG2 THR A 732 15.103 -9.666 -0.962 1.00 0.00 C ATOM 0 H THR A 732 14.508 -5.615 -2.265 1.00 0.00 H new ATOM 0 HA THR A 732 15.499 -7.208 -0.006 1.00 0.00 H new ATOM 0 HB THR A 732 14.369 -8.419 -2.556 1.00 0.00 H new ATOM 0 HG1 THR A 732 12.588 -9.054 -1.118 1.00 0.00 H new ATOM 0 HG21 THR A 732 14.499 -10.525 -1.253 1.00 0.00 H new ATOM 0 HG22 THR A 732 16.099 -9.759 -1.396 1.00 0.00 H new ATOM 0 HG23 THR A 732 15.183 -9.630 0.124 1.00 0.00 H new ATOM 639 N CYS A 733 17.619 -7.560 -1.218 1.00 0.00 N ATOM 640 CA CYS A 733 18.903 -7.669 -1.850 1.00 0.00 C ATOM 641 C CYS A 733 18.998 -8.965 -2.645 1.00 0.00 C ATOM 642 O CYS A 733 19.052 -10.067 -2.076 1.00 0.00 O ATOM 643 CB CYS A 733 20.014 -7.540 -0.810 1.00 0.00 C ATOM 644 SG CYS A 733 21.643 -8.152 -1.348 1.00 0.00 S ATOM 0 H CYS A 733 17.615 -7.827 -0.234 1.00 0.00 H new ATOM 0 HA CYS A 733 19.027 -6.851 -2.560 1.00 0.00 H new ATOM 0 HB2 CYS A 733 20.110 -6.491 -0.531 1.00 0.00 H new ATOM 0 HB3 CYS A 733 19.717 -8.083 0.087 1.00 0.00 H new ATOM 649 N ILE A 734 18.965 -8.810 -3.949 1.00 0.00 N ATOM 650 CA ILE A 734 19.018 -9.887 -4.919 1.00 0.00 C ATOM 651 C ILE A 734 19.769 -9.434 -6.160 1.00 0.00 C ATOM 652 O ILE A 734 19.749 -8.274 -6.488 1.00 0.00 O ATOM 653 CB ILE A 734 17.584 -10.427 -5.293 1.00 0.00 C ATOM 654 CG1 ILE A 734 16.495 -9.307 -5.326 1.00 0.00 C ATOM 655 CG2 ILE A 734 17.163 -11.559 -4.368 1.00 0.00 C ATOM 656 CD1 ILE A 734 16.702 -8.199 -6.347 1.00 0.00 C ATOM 0 H ILE A 734 18.898 -7.890 -4.385 1.00 0.00 H new ATOM 0 HA ILE A 734 19.555 -10.718 -4.461 1.00 0.00 H new ATOM 0 HB ILE A 734 17.664 -10.815 -6.308 1.00 0.00 H new ATOM 0 HG12 ILE A 734 15.529 -9.774 -5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 734 16.439 -8.854 -4.336 1.00 0.00 H new ATOM 0 HG21 ILE A 734 16.171 -11.910 -4.651 1.00 0.00 H new ATOM 0 HG22 ILE A 734 17.875 -12.380 -4.450 1.00 0.00 H new ATOM 0 HG23 ILE A 734 17.141 -11.199 -3.339 1.00 0.00 H new ATOM 0 HD11 ILE A 734 15.885 -7.481 -6.276 1.00 0.00 H new ATOM 0 HD12 ILE A 734 17.647 -7.693 -6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 734 16.723 -8.627 -7.349 1.00 0.00 H new ATOM 668 N HIS A 735 20.487 -10.339 -6.810 1.00 0.00 N ATOM 669 CA HIS A 735 21.260 -10.043 -8.065 1.00 0.00 C ATOM 670 C HIS A 735 22.499 -9.150 -7.779 1.00 0.00 C ATOM 671 O HIS A 735 23.380 -9.001 -8.618 1.00 0.00 O ATOM 672 CB HIS A 735 20.377 -9.329 -9.133 1.00 0.00 C ATOM 673 CG HIS A 735 19.150 -10.065 -9.614 1.00 0.00 C ATOM 674 ND1 HIS A 735 18.013 -10.392 -8.966 1.00 0.00 N flip ATOM 675 CD2 HIS A 735 18.948 -10.444 -10.919 1.00 0.00 C flip ATOM 676 CE1 HIS A 735 17.154 -10.941 -9.873 1.00 0.00 C flip ATOM 677 NE2 HIS A 735 17.746 -10.962 -11.047 1.00 0.00 N flip ATOM 0 H HIS A 735 20.567 -11.308 -6.503 1.00 0.00 H new ATOM 0 HA HIS A 735 21.587 -11.009 -8.451 1.00 0.00 H new ATOM 0 HB2 HIS A 735 20.058 -8.371 -8.722 1.00 0.00 H new ATOM 0 HB3 HIS A 735 21.002 -9.112 -9.999 1.00 0.00 H new ATOM 0 HD2 HIS A 735 19.667 -10.333 -11.718 1.00 0.00 H new ATOM 0 HE1 HIS A 735 16.157 -11.298 -9.662 1.00 0.00 H new ATOM 0 HE2 HIS A 735 17.341 -11.320 -11.912 1.00 0.00 H new ATOM 686 N GLY A 736 22.546 -8.577 -6.588 1.00 0.00 N ATOM 687 CA GLY A 736 23.586 -7.649 -6.214 1.00 0.00 C ATOM 688 C GLY A 736 23.049 -6.248 -6.219 1.00 0.00 C ATOM 689 O GLY A 736 23.793 -5.263 -6.286 1.00 0.00 O ATOM 0 H GLY A 736 21.858 -8.747 -5.854 1.00 0.00 H new ATOM 0 HA2 GLY A 736 23.968 -7.897 -5.224 1.00 0.00 H new ATOM 0 HA3 GLY A 736 24.423 -7.729 -6.908 1.00 0.00 H new ATOM 693 N VAL A 737 21.748 -6.163 -6.155 1.00 0.00 N ATOM 694 CA VAL A 737 21.018 -4.949 -6.204 1.00 0.00 C ATOM 695 C VAL A 737 19.862 -5.147 -5.245 1.00 0.00 C ATOM 696 O VAL A 737 19.559 -6.266 -4.867 1.00 0.00 O ATOM 697 CB VAL A 737 20.428 -4.718 -7.651 1.00 0.00 C ATOM 698 CG1 VAL A 737 19.758 -3.364 -7.800 1.00 0.00 C ATOM 699 CG2 VAL A 737 21.469 -4.907 -8.740 1.00 0.00 C ATOM 0 H VAL A 737 21.150 -6.984 -6.063 1.00 0.00 H new ATOM 0 HA VAL A 737 21.648 -4.096 -5.952 1.00 0.00 H new ATOM 0 HB VAL A 737 19.664 -5.486 -7.775 1.00 0.00 H new ATOM 0 HG11 VAL A 737 19.371 -3.259 -8.814 1.00 0.00 H new ATOM 0 HG12 VAL A 737 18.937 -3.284 -7.088 1.00 0.00 H new ATOM 0 HG13 VAL A 737 20.485 -2.575 -7.606 1.00 0.00 H new ATOM 0 HG21 VAL A 737 21.011 -4.737 -9.714 1.00 0.00 H new ATOM 0 HG22 VAL A 737 22.283 -4.197 -8.592 1.00 0.00 H new ATOM 0 HG23 VAL A 737 21.861 -5.923 -8.696 1.00 0.00 H new ATOM 709 N TRP A 738 19.293 -4.123 -4.791 1.00 0.00 N ATOM 710 CA TRP A 738 18.075 -4.256 -4.056 1.00 0.00 C ATOM 711 C TRP A 738 16.912 -4.272 -5.038 1.00 0.00 C ATOM 712 O TRP A 738 17.118 -4.170 -6.248 1.00 0.00 O ATOM 713 CB TRP A 738 17.936 -3.138 -3.070 1.00 0.00 C ATOM 714 CG TRP A 738 18.995 -3.137 -2.034 1.00 0.00 C ATOM 715 CD1 TRP A 738 20.206 -2.530 -2.103 1.00 0.00 C ATOM 716 CD2 TRP A 738 18.933 -3.763 -0.776 1.00 0.00 C ATOM 717 NE1 TRP A 738 20.897 -2.731 -0.949 1.00 0.00 N ATOM 718 CE2 TRP A 738 20.130 -3.489 -0.116 1.00 0.00 C ATOM 719 CE3 TRP A 738 17.970 -4.526 -0.138 1.00 0.00 C ATOM 720 CZ2 TRP A 738 20.382 -3.946 1.147 1.00 0.00 C ATOM 721 CZ3 TRP A 738 18.216 -4.978 1.119 1.00 0.00 C ATOM 722 CH2 TRP A 738 19.414 -4.687 1.755 1.00 0.00 C ATOM 0 H TRP A 738 19.633 -3.168 -4.903 1.00 0.00 H new ATOM 0 HA TRP A 738 18.080 -5.189 -3.492 1.00 0.00 H new ATOM 0 HB2 TRP A 738 17.958 -2.188 -3.603 1.00 0.00 H new ATOM 0 HB3 TRP A 738 16.963 -3.209 -2.585 1.00 0.00 H new ATOM 0 HD1 TRP A 738 20.569 -1.969 -2.951 1.00 0.00 H new ATOM 0 HE1 TRP A 738 21.830 -2.375 -0.742 1.00 0.00 H new ATOM 0 HE3 TRP A 738 17.038 -4.758 -0.632 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 21.315 -3.728 1.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 17.471 -5.570 1.629 1.00 0.00 H new ATOM 0 HH2 TRP A 738 19.583 -5.057 2.756 1.00 0.00 H new ATOM 733 N THR A 739 15.721 -4.407 -4.549 1.00 0.00 N ATOM 734 CA THR A 739 14.572 -4.448 -5.394 1.00 0.00 C ATOM 735 C THR A 739 14.183 -3.054 -5.906 1.00 0.00 C ATOM 736 O THR A 739 14.990 -2.116 -5.907 1.00 0.00 O ATOM 737 CB THR A 739 13.417 -5.207 -4.709 1.00 0.00 C ATOM 738 OG1 THR A 739 13.211 -4.710 -3.416 1.00 0.00 O ATOM 739 CG2 THR A 739 13.719 -6.695 -4.647 1.00 0.00 C ATOM 0 H THR A 739 15.518 -4.492 -3.553 1.00 0.00 H new ATOM 0 HA THR A 739 14.823 -5.015 -6.290 1.00 0.00 H new ATOM 0 HB THR A 739 12.512 -5.057 -5.297 1.00 0.00 H new ATOM 0 HG1 THR A 739 13.002 -3.754 -3.463 1.00 0.00 H new ATOM 0 HG21 THR A 739 12.893 -7.214 -4.161 1.00 0.00 H new ATOM 0 HG22 THR A 739 13.846 -7.083 -5.658 1.00 0.00 H new ATOM 0 HG23 THR A 739 14.635 -6.857 -4.078 1.00 0.00 H new ATOM 747 N GLN A 740 12.980 -2.920 -6.299 1.00 0.00 N ATOM 748 CA GLN A 740 12.541 -1.790 -7.079 1.00 0.00 C ATOM 749 C GLN A 740 12.196 -0.550 -6.259 1.00 0.00 C ATOM 750 O GLN A 740 12.000 0.532 -6.841 1.00 0.00 O ATOM 751 CB GLN A 740 11.357 -2.194 -7.973 1.00 0.00 C ATOM 752 CG GLN A 740 10.038 -2.470 -7.242 1.00 0.00 C ATOM 753 CD GLN A 740 10.003 -3.678 -6.300 1.00 0.00 C ATOM 754 OE1 GLN A 740 10.729 -4.720 -6.605 1.00 0.00 O flip ATOM 755 NE2 GLN A 740 9.287 -3.662 -5.302 1.00 0.00 N flip ATOM 0 H GLN A 740 12.243 -3.594 -6.094 1.00 0.00 H new ATOM 0 HA GLN A 740 13.394 -1.501 -7.692 1.00 0.00 H new ATOM 0 HB2 GLN A 740 11.188 -1.401 -8.702 1.00 0.00 H new ATOM 0 HB3 GLN A 740 11.635 -3.087 -8.532 1.00 0.00 H new ATOM 0 HG2 GLN A 740 9.779 -1.583 -6.664 1.00 0.00 H new ATOM 0 HG3 GLN A 740 9.257 -2.602 -7.991 1.00 0.00 H new ATOM 0 HE21 GLN A 740 8.730 -2.835 -5.087 1.00 0.00 H new ATOM 0 HE22 GLN A 740 9.249 -4.476 -4.688 1.00 0.00 H new ATOM 764 N LEU A 741 12.146 -0.690 -4.930 1.00 0.00 N ATOM 765 CA LEU A 741 11.743 0.402 -4.017 1.00 0.00 C ATOM 766 C LEU A 741 10.241 0.678 -4.117 1.00 0.00 C ATOM 767 O LEU A 741 9.615 0.417 -5.146 1.00 0.00 O ATOM 768 CB LEU A 741 12.536 1.738 -4.246 1.00 0.00 C ATOM 769 CG LEU A 741 13.963 1.858 -3.691 1.00 0.00 C ATOM 770 CD1 LEU A 741 13.962 1.759 -2.175 1.00 0.00 C ATOM 771 CD2 LEU A 741 14.899 0.834 -4.313 1.00 0.00 C ATOM 0 H LEU A 741 12.382 -1.559 -4.451 1.00 0.00 H new ATOM 0 HA LEU A 741 11.990 0.048 -3.016 1.00 0.00 H new ATOM 0 HB2 LEU A 741 12.585 1.912 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 741 11.947 2.549 -3.818 1.00 0.00 H new ATOM 0 HG LEU A 741 14.342 2.843 -3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 741 14.983 1.847 -1.804 1.00 0.00 H new ATOM 0 HD12 LEU A 741 13.354 2.562 -1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 741 13.548 0.797 -1.873 1.00 0.00 H new ATOM 0 HD21 LEU A 741 15.898 0.952 -3.894 1.00 0.00 H new ATOM 0 HD22 LEU A 741 14.533 -0.170 -4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 741 14.938 0.985 -5.392 1.00 0.00 H new ATOM 783 N PRO A 742 9.633 1.142 -3.033 1.00 0.00 N ATOM 784 CA PRO A 742 8.238 1.580 -3.040 1.00 0.00 C ATOM 785 C PRO A 742 8.036 2.869 -3.851 1.00 0.00 C ATOM 786 O PRO A 742 8.877 3.267 -4.666 1.00 0.00 O ATOM 787 CB PRO A 742 7.928 1.880 -1.577 1.00 0.00 C ATOM 788 CG PRO A 742 9.060 1.363 -0.785 1.00 0.00 C ATOM 789 CD PRO A 742 10.227 1.210 -1.697 1.00 0.00 C ATOM 0 HA PRO A 742 7.599 0.820 -3.490 1.00 0.00 H new ATOM 0 HB2 PRO A 742 7.804 2.952 -1.420 1.00 0.00 H new ATOM 0 HB3 PRO A 742 6.995 1.404 -1.274 1.00 0.00 H new ATOM 0 HG2 PRO A 742 9.300 2.047 0.029 1.00 0.00 H new ATOM 0 HG3 PRO A 742 8.802 0.406 -0.332 1.00 0.00 H new ATOM 0 HD2 PRO A 742 10.914 2.052 -1.609 1.00 0.00 H new ATOM 0 HD3 PRO A 742 10.796 0.309 -1.468 1.00 0.00 H new ATOM 797 N GLN A 743 6.948 3.507 -3.600 1.00 0.00 N ATOM 798 CA GLN A 743 6.587 4.730 -4.252 1.00 0.00 C ATOM 799 C GLN A 743 5.933 5.593 -3.212 1.00 0.00 C ATOM 800 O GLN A 743 5.147 5.090 -2.414 1.00 0.00 O ATOM 801 CB GLN A 743 5.609 4.446 -5.398 1.00 0.00 C ATOM 802 CG GLN A 743 5.149 5.674 -6.152 1.00 0.00 C ATOM 803 CD GLN A 743 4.134 5.360 -7.225 1.00 0.00 C ATOM 804 OE1 GLN A 743 4.128 4.272 -7.805 1.00 0.00 O ATOM 805 NE2 GLN A 743 3.290 6.303 -7.508 1.00 0.00 N ATOM 0 H GLN A 743 6.260 3.189 -2.917 1.00 0.00 H new ATOM 0 HA GLN A 743 7.460 5.224 -4.678 1.00 0.00 H new ATOM 0 HB2 GLN A 743 6.082 3.760 -6.101 1.00 0.00 H new ATOM 0 HB3 GLN A 743 4.735 3.935 -4.994 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.717 6.386 -5.448 1.00 0.00 H new ATOM 0 HG3 GLN A 743 6.013 6.159 -6.607 1.00 0.00 H new ATOM 0 HE21 GLN A 743 3.328 7.189 -7.005 1.00 0.00 H new ATOM 0 HE22 GLN A 743 2.588 6.158 -8.234 1.00 0.00 H new ATOM 814 N CYS A 744 6.251 6.846 -3.197 1.00 0.00 N ATOM 815 CA CYS A 744 5.692 7.738 -2.222 1.00 0.00 C ATOM 816 C CYS A 744 5.146 8.954 -2.873 1.00 0.00 C ATOM 817 O CYS A 744 5.885 9.804 -3.344 1.00 0.00 O ATOM 818 CB CYS A 744 6.698 8.131 -1.146 1.00 0.00 C ATOM 819 SG CYS A 744 7.198 6.790 -0.040 1.00 0.00 S ATOM 0 H CYS A 744 6.900 7.282 -3.852 1.00 0.00 H new ATOM 0 HA CYS A 744 4.883 7.197 -1.732 1.00 0.00 H new ATOM 0 HB2 CYS A 744 7.588 8.532 -1.631 1.00 0.00 H new ATOM 0 HB3 CYS A 744 6.271 8.935 -0.547 1.00 0.00 H new ATOM 824 N VAL A 745 3.865 9.039 -2.912 1.00 0.00 N ATOM 825 CA VAL A 745 3.234 10.177 -3.476 1.00 0.00 C ATOM 826 C VAL A 745 2.824 11.073 -2.355 1.00 0.00 C ATOM 827 O VAL A 745 2.395 10.614 -1.326 1.00 0.00 O ATOM 828 CB VAL A 745 2.022 9.826 -4.365 1.00 0.00 C ATOM 829 CG1 VAL A 745 1.442 11.068 -5.042 1.00 0.00 C ATOM 830 CG2 VAL A 745 2.384 8.771 -5.395 1.00 0.00 C ATOM 0 H VAL A 745 3.228 8.326 -2.556 1.00 0.00 H new ATOM 0 HA VAL A 745 3.944 10.673 -4.138 1.00 0.00 H new ATOM 0 HB VAL A 745 1.252 9.414 -3.713 1.00 0.00 H new ATOM 0 HG11 VAL A 745 0.591 10.782 -5.659 1.00 0.00 H new ATOM 0 HG12 VAL A 745 1.117 11.778 -4.282 1.00 0.00 H new ATOM 0 HG13 VAL A 745 2.205 11.531 -5.668 1.00 0.00 H new ATOM 0 HG21 VAL A 745 1.510 8.544 -6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 745 3.186 9.144 -6.032 1.00 0.00 H new ATOM 0 HG23 VAL A 745 2.716 7.866 -4.887 1.00 0.00 H new ATOM 840 N ALA A 746 2.935 12.334 -2.585 1.00 0.00 N ATOM 841 CA ALA A 746 2.692 13.426 -1.613 1.00 0.00 C ATOM 842 C ALA A 746 1.273 13.518 -1.106 1.00 0.00 C ATOM 843 O ALA A 746 0.919 14.459 -0.396 1.00 0.00 O ATOM 844 CB ALA A 746 3.033 14.714 -2.256 1.00 0.00 C ATOM 0 H ALA A 746 3.213 12.687 -3.501 1.00 0.00 H new ATOM 0 HA ALA A 746 3.317 13.203 -0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 746 2.859 15.529 -1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 746 4.082 14.707 -2.551 1.00 0.00 H new ATOM 0 HB3 ALA A 746 2.409 14.857 -3.138 1.00 0.00 H new ATOM 850 N ILE A 747 0.468 12.603 -1.546 1.00 0.00 N ATOM 851 CA ILE A 747 -0.943 12.475 -1.186 1.00 0.00 C ATOM 852 C ILE A 747 -1.804 13.536 -1.905 1.00 0.00 C ATOM 853 O ILE A 747 -3.007 13.381 -2.106 1.00 0.00 O ATOM 854 CB ILE A 747 -1.084 12.523 0.344 1.00 0.00 C ATOM 855 CG1 ILE A 747 -0.585 11.242 0.999 1.00 0.00 C ATOM 856 CG2 ILE A 747 -2.464 12.941 0.847 1.00 0.00 C ATOM 857 CD1 ILE A 747 -0.572 11.278 2.513 1.00 0.00 C ATOM 0 H ILE A 747 0.774 11.881 -2.199 1.00 0.00 H new ATOM 0 HA ILE A 747 -1.321 11.511 -1.525 1.00 0.00 H new ATOM 0 HB ILE A 747 -0.429 13.333 0.663 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -1.213 10.413 0.673 1.00 0.00 H new ATOM 0 HG13 ILE A 747 0.425 11.036 0.644 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -2.468 12.946 1.937 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -2.698 13.940 0.479 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -3.212 12.236 0.485 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -0.203 10.327 2.896 1.00 0.00 H new ATOM 0 HD12 ILE A 747 0.080 12.083 2.852 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -1.583 11.450 2.882 1.00 0.00 H new ATOM 869 N ASP A 748 -1.128 14.510 -2.385 1.00 0.00 N ATOM 870 CA ASP A 748 -1.685 15.664 -3.055 1.00 0.00 C ATOM 871 C ASP A 748 -2.176 15.257 -4.407 1.00 0.00 C ATOM 872 O ASP A 748 -3.211 15.701 -4.886 1.00 0.00 O ATOM 873 CB ASP A 748 -0.560 16.687 -3.214 1.00 0.00 C ATOM 874 CG ASP A 748 -0.910 17.854 -4.112 1.00 0.00 C ATOM 875 OD1 ASP A 748 -0.665 17.768 -5.335 1.00 0.00 O ATOM 876 OD2 ASP A 748 -1.420 18.873 -3.612 1.00 0.00 O ATOM 0 H ASP A 748 -0.110 14.543 -2.327 1.00 0.00 H new ATOM 0 HA ASP A 748 -2.514 16.084 -2.485 1.00 0.00 H new ATOM 0 HB2 ASP A 748 -0.288 17.068 -2.230 1.00 0.00 H new ATOM 0 HB3 ASP A 748 0.320 16.184 -3.615 1.00 0.00 H new ATOM 881 N LYS A 749 -1.445 14.361 -4.975 1.00 0.00 N ATOM 882 CA LYS A 749 -1.665 13.898 -6.320 1.00 0.00 C ATOM 883 C LYS A 749 -2.133 12.471 -6.337 1.00 0.00 C ATOM 884 O LYS A 749 -1.893 11.730 -7.286 1.00 0.00 O ATOM 885 CB LYS A 749 -0.391 14.074 -7.126 1.00 0.00 C ATOM 886 CG LYS A 749 0.830 14.313 -6.275 1.00 0.00 C ATOM 887 CD LYS A 749 2.037 14.737 -7.105 1.00 0.00 C ATOM 888 CE LYS A 749 1.786 16.044 -7.867 1.00 0.00 C ATOM 889 NZ LYS A 749 1.483 17.185 -6.968 1.00 0.00 N ATOM 0 H LYS A 749 -0.654 13.912 -4.513 1.00 0.00 H new ATOM 0 HA LYS A 749 -2.456 14.494 -6.776 1.00 0.00 H new ATOM 0 HB2 LYS A 749 -0.231 13.185 -7.736 1.00 0.00 H new ATOM 0 HB3 LYS A 749 -0.517 14.912 -7.811 1.00 0.00 H new ATOM 0 HG2 LYS A 749 0.611 15.084 -5.536 1.00 0.00 H new ATOM 0 HG3 LYS A 749 1.071 13.403 -5.725 1.00 0.00 H new ATOM 0 HD2 LYS A 749 2.900 14.860 -6.451 1.00 0.00 H new ATOM 0 HD3 LYS A 749 2.284 13.947 -7.814 1.00 0.00 H new ATOM 0 HE2 LYS A 749 2.664 16.284 -8.467 1.00 0.00 H new ATOM 0 HE3 LYS A 749 0.956 15.902 -8.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 749 1.456 18.065 -7.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 749 0.560 17.033 -6.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 749 2.220 17.257 -6.238 1.00 0.00 H new ATOM 903 N LEU A 750 -2.821 12.096 -5.294 1.00 0.00 N ATOM 904 CA LEU A 750 -3.403 10.799 -5.212 1.00 0.00 C ATOM 905 C LEU A 750 -4.774 10.818 -5.866 1.00 0.00 C ATOM 906 O LEU A 750 -5.081 11.701 -6.674 1.00 0.00 O ATOM 907 CB LEU A 750 -3.492 10.306 -3.760 1.00 0.00 C ATOM 908 CG LEU A 750 -2.221 10.176 -3.024 1.00 0.00 C ATOM 909 CD1 LEU A 750 -2.518 9.620 -1.706 1.00 0.00 C ATOM 910 CD2 LEU A 750 -1.257 9.308 -3.732 1.00 0.00 C ATOM 0 H LEU A 750 -2.990 12.687 -4.480 1.00 0.00 H new ATOM 0 HA LEU A 750 -2.761 10.098 -5.744 1.00 0.00 H new ATOM 0 HB2 LEU A 750 -4.136 10.990 -3.208 1.00 0.00 H new ATOM 0 HB3 LEU A 750 -3.985 9.334 -3.761 1.00 0.00 H new ATOM 0 HG LEU A 750 -1.759 11.160 -2.939 1.00 0.00 H new ATOM 0 HD11 LEU A 750 -1.593 9.513 -1.139 1.00 0.00 H new ATOM 0 HD12 LEU A 750 -3.195 10.288 -1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 750 -2.988 8.643 -1.821 1.00 0.00 H new ATOM 0 HD21 LEU A 750 -0.335 9.241 -3.154 1.00 0.00 H new ATOM 0 HD22 LEU A 750 -1.684 8.312 -3.852 1.00 0.00 H new ATOM 0 HD23 LEU A 750 -1.040 9.730 -4.713 1.00 0.00 H new ATOM 922 N LYS A 751 -5.568 9.856 -5.538 1.00 0.00 N ATOM 923 CA LYS A 751 -6.860 9.674 -6.067 1.00 0.00 C ATOM 924 C LYS A 751 -7.713 9.101 -4.970 1.00 0.00 C ATOM 925 O LYS A 751 -7.197 8.631 -3.939 1.00 0.00 O ATOM 926 CB LYS A 751 -6.832 8.704 -7.259 1.00 0.00 C ATOM 927 CG LYS A 751 -5.998 9.180 -8.438 1.00 0.00 C ATOM 928 CD LYS A 751 -6.050 8.248 -9.626 1.00 0.00 C ATOM 929 CE LYS A 751 -7.381 8.327 -10.350 1.00 0.00 C ATOM 930 NZ LYS A 751 -7.373 7.496 -11.567 1.00 0.00 N ATOM 0 H LYS A 751 -5.311 9.142 -4.856 1.00 0.00 H new ATOM 0 HA LYS A 751 -7.257 10.625 -6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 751 -6.445 7.743 -6.920 1.00 0.00 H new ATOM 0 HB3 LYS A 751 -7.854 8.534 -7.598 1.00 0.00 H new ATOM 0 HG2 LYS A 751 -6.346 10.167 -8.744 1.00 0.00 H new ATOM 0 HG3 LYS A 751 -4.962 9.292 -8.119 1.00 0.00 H new ATOM 0 HD2 LYS A 751 -5.245 8.497 -10.318 1.00 0.00 H new ATOM 0 HD3 LYS A 751 -5.879 7.225 -9.292 1.00 0.00 H new ATOM 0 HE2 LYS A 751 -8.180 7.997 -9.686 1.00 0.00 H new ATOM 0 HE3 LYS A 751 -7.594 9.363 -10.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 751 -8.295 7.568 -12.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 751 -6.625 7.828 -12.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 751 -7.193 6.505 -11.309 1.00 0.00 H new ATOM 944 N LYS A 752 -8.960 9.092 -5.216 1.00 0.00 N ATOM 945 CA LYS A 752 -9.966 8.645 -4.333 1.00 0.00 C ATOM 946 C LYS A 752 -10.614 7.456 -5.009 1.00 0.00 C ATOM 947 O LYS A 752 -10.809 7.442 -6.229 1.00 0.00 O ATOM 948 CB LYS A 752 -11.029 9.743 -4.110 1.00 0.00 C ATOM 949 CG LYS A 752 -10.463 11.167 -4.029 1.00 0.00 C ATOM 950 CD LYS A 752 -11.555 12.199 -3.781 1.00 0.00 C ATOM 951 CE LYS A 752 -11.930 12.282 -2.316 1.00 0.00 C ATOM 952 NZ LYS A 752 -10.857 12.923 -1.517 1.00 0.00 N ATOM 0 H LYS A 752 -9.337 9.420 -6.105 1.00 0.00 H new ATOM 0 HA LYS A 752 -9.543 8.391 -3.361 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -11.755 9.699 -4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -11.569 9.527 -3.188 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -9.725 11.219 -3.228 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -9.943 11.404 -4.957 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -11.216 13.176 -4.125 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -12.437 11.943 -4.368 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -12.855 12.849 -2.207 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -12.123 11.281 -1.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -10.592 12.299 -0.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -10.027 13.090 -2.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -11.199 13.830 -1.141 1.00 0.00 H new ATOM 966 N CYS A 753 -10.895 6.505 -4.250 1.00 0.00 N ATOM 967 CA CYS A 753 -11.475 5.246 -4.698 1.00 0.00 C ATOM 968 C CYS A 753 -12.978 5.299 -4.630 1.00 0.00 C ATOM 969 O CYS A 753 -13.547 6.257 -4.122 1.00 0.00 O ATOM 970 CB CYS A 753 -10.996 4.134 -3.793 1.00 0.00 C ATOM 971 SG CYS A 753 -9.196 4.074 -3.628 1.00 0.00 S ATOM 0 H CYS A 753 -10.737 6.539 -3.243 1.00 0.00 H new ATOM 0 HA CYS A 753 -11.168 5.069 -5.729 1.00 0.00 H new ATOM 0 HB2 CYS A 753 -11.441 4.261 -2.806 1.00 0.00 H new ATOM 0 HB3 CYS A 753 -11.351 3.180 -4.182 1.00 0.00 H new ATOM 976 N LYS A 754 -13.617 4.283 -5.141 1.00 0.00 N ATOM 977 CA LYS A 754 -15.043 4.178 -5.049 1.00 0.00 C ATOM 978 C LYS A 754 -15.421 2.750 -4.718 1.00 0.00 C ATOM 979 O LYS A 754 -14.698 1.803 -5.076 1.00 0.00 O ATOM 980 CB LYS A 754 -15.738 4.610 -6.355 1.00 0.00 C ATOM 981 CG LYS A 754 -15.497 3.679 -7.540 1.00 0.00 C ATOM 982 CD LYS A 754 -16.357 4.057 -8.733 1.00 0.00 C ATOM 983 CE LYS A 754 -16.123 3.117 -9.900 1.00 0.00 C ATOM 984 NZ LYS A 754 -16.985 3.440 -11.054 1.00 0.00 N ATOM 0 H LYS A 754 -13.165 3.510 -5.630 1.00 0.00 H new ATOM 0 HA LYS A 754 -15.379 4.850 -4.259 1.00 0.00 H new ATOM 0 HB2 LYS A 754 -16.811 4.678 -6.175 1.00 0.00 H new ATOM 0 HB3 LYS A 754 -15.395 5.610 -6.620 1.00 0.00 H new ATOM 0 HG2 LYS A 754 -14.445 3.715 -7.823 1.00 0.00 H new ATOM 0 HG3 LYS A 754 -15.713 2.652 -7.246 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -17.409 4.032 -8.448 1.00 0.00 H new ATOM 0 HD3 LYS A 754 -16.133 5.080 -9.036 1.00 0.00 H new ATOM 0 HE2 LYS A 754 -15.077 3.169 -10.203 1.00 0.00 H new ATOM 0 HE3 LYS A 754 -16.312 2.091 -9.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 -16.792 2.773 -11.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 -17.984 3.365 -10.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -16.787 4.409 -11.374 1.00 0.00 H new ATOM 998 N SER A 755 -16.487 2.595 -3.994 1.00 0.00 N ATOM 999 CA SER A 755 -17.051 1.293 -3.735 1.00 0.00 C ATOM 1000 C SER A 755 -17.564 0.642 -5.030 1.00 0.00 C ATOM 1001 O SER A 755 -18.103 1.325 -5.912 1.00 0.00 O ATOM 1002 CB SER A 755 -18.192 1.434 -2.731 1.00 0.00 C ATOM 1003 OG SER A 755 -19.043 2.526 -3.088 1.00 0.00 O ATOM 0 H SER A 755 -16.996 3.366 -3.562 1.00 0.00 H new ATOM 0 HA SER A 755 -16.273 0.649 -3.325 1.00 0.00 H new ATOM 0 HB2 SER A 755 -18.770 0.511 -2.697 1.00 0.00 H new ATOM 0 HB3 SER A 755 -17.787 1.593 -1.732 1.00 0.00 H new ATOM 0 HG SER A 755 -19.844 2.514 -2.524 1.00 0.00 H new ATOM 1009 N SER A 756 -17.334 -0.636 -5.160 1.00 0.00 N ATOM 1010 CA SER A 756 -17.884 -1.415 -6.238 1.00 0.00 C ATOM 1011 C SER A 756 -19.372 -1.720 -5.915 1.00 0.00 C ATOM 1012 O SER A 756 -19.841 -1.420 -4.806 1.00 0.00 O ATOM 1013 CB SER A 756 -17.055 -2.687 -6.372 1.00 0.00 C ATOM 1014 OG SER A 756 -15.699 -2.367 -6.617 1.00 0.00 O ATOM 0 H SER A 756 -16.754 -1.172 -4.515 1.00 0.00 H new ATOM 0 HA SER A 756 -17.849 -0.880 -7.187 1.00 0.00 H new ATOM 0 HB2 SER A 756 -17.137 -3.280 -5.461 1.00 0.00 H new ATOM 0 HB3 SER A 756 -17.444 -3.298 -7.186 1.00 0.00 H new ATOM 0 HG SER A 756 -15.246 -3.142 -7.009 1.00 0.00 H new ATOM 1020 N ASN A 757 -20.104 -2.304 -6.835 1.00 0.00 N ATOM 1021 CA ASN A 757 -21.541 -2.533 -6.622 1.00 0.00 C ATOM 1022 C ASN A 757 -21.819 -3.960 -6.126 1.00 0.00 C ATOM 1023 O ASN A 757 -22.887 -4.258 -5.585 1.00 0.00 O ATOM 1024 CB ASN A 757 -22.328 -2.267 -7.919 1.00 0.00 C ATOM 1025 CG ASN A 757 -23.838 -2.328 -7.717 1.00 0.00 C ATOM 1026 OD1 ASN A 757 -24.357 -1.970 -6.650 1.00 0.00 O ATOM 1027 ND2 ASN A 757 -24.553 -2.784 -8.716 1.00 0.00 N ATOM 0 H ASN A 757 -19.747 -2.631 -7.733 1.00 0.00 H new ATOM 0 HA ASN A 757 -21.872 -1.836 -5.852 1.00 0.00 H new ATOM 0 HB2 ASN A 757 -22.057 -1.285 -8.308 1.00 0.00 H new ATOM 0 HB3 ASN A 757 -22.037 -2.999 -8.672 1.00 0.00 H new ATOM 0 HD21 ASN A 757 -25.567 -2.852 -8.628 1.00 0.00 H new ATOM 0 HD22 ASN A 757 -24.096 -3.071 -9.581 1.00 0.00 H new ATOM 1034 N LEU A 758 -20.848 -4.831 -6.264 1.00 0.00 N ATOM 1035 CA LEU A 758 -21.035 -6.226 -5.883 1.00 0.00 C ATOM 1036 C LEU A 758 -20.427 -6.490 -4.540 1.00 0.00 C ATOM 1037 O LEU A 758 -20.224 -7.628 -4.149 1.00 0.00 O ATOM 1038 CB LEU A 758 -20.480 -7.210 -6.940 1.00 0.00 C ATOM 1039 CG LEU A 758 -21.330 -7.439 -8.210 1.00 0.00 C ATOM 1040 CD1 LEU A 758 -22.733 -7.900 -7.851 1.00 0.00 C ATOM 1041 CD2 LEU A 758 -21.379 -6.209 -9.097 1.00 0.00 C ATOM 0 H LEU A 758 -19.924 -4.609 -6.634 1.00 0.00 H new ATOM 0 HA LEU A 758 -22.110 -6.400 -5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 758 -19.498 -6.853 -7.251 1.00 0.00 H new ATOM 0 HB3 LEU A 758 -20.329 -8.175 -6.456 1.00 0.00 H new ATOM 0 HG LEU A 758 -20.842 -8.229 -8.781 1.00 0.00 H new ATOM 0 HD11 LEU A 758 -23.310 -8.054 -8.763 1.00 0.00 H new ATOM 0 HD12 LEU A 758 -22.677 -8.836 -7.295 1.00 0.00 H new ATOM 0 HD13 LEU A 758 -23.219 -7.142 -7.237 1.00 0.00 H new ATOM 0 HD21 LEU A 758 -21.988 -6.419 -9.977 1.00 0.00 H new ATOM 0 HD22 LEU A 758 -21.816 -5.378 -8.543 1.00 0.00 H new ATOM 0 HD23 LEU A 758 -20.369 -5.945 -9.410 1.00 0.00 H new ATOM 1053 N ILE A 759 -20.163 -5.441 -3.829 1.00 0.00 N ATOM 1054 CA ILE A 759 -19.590 -5.540 -2.531 1.00 0.00 C ATOM 1055 C ILE A 759 -20.441 -4.841 -1.524 1.00 0.00 C ATOM 1056 O ILE A 759 -21.222 -3.924 -1.854 1.00 0.00 O ATOM 1057 CB ILE A 759 -18.176 -4.960 -2.459 1.00 0.00 C ATOM 1058 CG1 ILE A 759 -18.167 -3.569 -3.006 1.00 0.00 C ATOM 1059 CG2 ILE A 759 -17.220 -5.818 -3.266 1.00 0.00 C ATOM 1060 CD1 ILE A 759 -17.012 -2.762 -2.523 1.00 0.00 C ATOM 0 H ILE A 759 -20.341 -4.485 -4.138 1.00 0.00 H new ATOM 0 HA ILE A 759 -19.533 -6.606 -2.309 1.00 0.00 H new ATOM 0 HB ILE A 759 -17.858 -4.945 -1.416 1.00 0.00 H new ATOM 0 HG12 ILE A 759 -18.143 -3.613 -4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 759 -19.095 -3.069 -2.728 1.00 0.00 H new ATOM 0 HG21 ILE A 759 -16.216 -5.397 -3.209 1.00 0.00 H new ATOM 0 HG22 ILE A 759 -17.212 -6.831 -2.864 1.00 0.00 H new ATOM 0 HG23 ILE A 759 -17.544 -5.843 -4.306 1.00 0.00 H new ATOM 0 HD11 ILE A 759 -17.061 -1.762 -2.955 1.00 0.00 H new ATOM 0 HD12 ILE A 759 -17.048 -2.690 -1.436 1.00 0.00 H new ATOM 0 HD13 ILE A 759 -16.081 -3.242 -2.824 1.00 0.00 H new ATOM 1072 N ILE A 760 -20.330 -5.286 -0.329 1.00 0.00 N ATOM 1073 CA ILE A 760 -20.994 -4.682 0.778 1.00 0.00 C ATOM 1074 C ILE A 760 -19.926 -4.130 1.670 1.00 0.00 C ATOM 1075 O ILE A 760 -18.938 -4.805 1.931 1.00 0.00 O ATOM 1076 CB ILE A 760 -21.897 -5.686 1.597 1.00 0.00 C ATOM 1077 CG1 ILE A 760 -23.081 -6.245 0.784 1.00 0.00 C ATOM 1078 CG2 ILE A 760 -22.415 -5.065 2.892 1.00 0.00 C ATOM 1079 CD1 ILE A 760 -22.709 -7.219 -0.298 1.00 0.00 C ATOM 0 H ILE A 760 -19.764 -6.098 -0.081 1.00 0.00 H new ATOM 0 HA ILE A 760 -21.670 -3.914 0.402 1.00 0.00 H new ATOM 0 HB ILE A 760 -21.239 -6.521 1.840 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -23.773 -6.734 1.469 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -23.617 -5.411 0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -23.031 -5.791 3.423 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -21.572 -4.777 3.520 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -23.012 -4.183 2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -23.610 -7.554 -0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -22.044 -6.733 -1.012 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -22.203 -8.077 0.144 1.00 0.00 H new ATOM 1091 N LEU A 761 -20.083 -2.911 2.079 1.00 0.00 N ATOM 1092 CA LEU A 761 -19.145 -2.298 2.968 1.00 0.00 C ATOM 1093 C LEU A 761 -19.794 -2.173 4.319 1.00 0.00 C ATOM 1094 O LEU A 761 -20.965 -2.561 4.494 1.00 0.00 O ATOM 1095 CB LEU A 761 -18.742 -0.882 2.494 1.00 0.00 C ATOM 1096 CG LEU A 761 -18.136 -0.720 1.097 1.00 0.00 C ATOM 1097 CD1 LEU A 761 -17.061 -1.716 0.830 1.00 0.00 C ATOM 1098 CD2 LEU A 761 -19.195 -0.669 0.013 1.00 0.00 C ATOM 0 H LEU A 761 -20.863 -2.313 1.807 1.00 0.00 H new ATOM 0 HA LEU A 761 -18.248 -2.916 3.000 1.00 0.00 H new ATOM 0 HB2 LEU A 761 -19.629 -0.251 2.545 1.00 0.00 H new ATOM 0 HB3 LEU A 761 -18.026 -0.484 3.213 1.00 0.00 H new ATOM 0 HG LEU A 761 -17.646 0.254 1.073 1.00 0.00 H new ATOM 0 HD11 LEU A 761 -16.662 -1.561 -0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 761 -16.262 -1.594 1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 761 -17.471 -2.723 0.906 1.00 0.00 H new ATOM 0 HD21 LEU A 761 -18.715 -0.553 -0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 761 -19.773 -1.593 0.025 1.00 0.00 H new ATOM 0 HD23 LEU A 761 -19.859 0.176 0.193 1.00 0.00 H new ATOM 1110 N GLU A 762 -19.051 -1.662 5.277 1.00 0.00 N ATOM 1111 CA GLU A 762 -19.618 -1.325 6.563 1.00 0.00 C ATOM 1112 C GLU A 762 -20.605 -0.194 6.312 1.00 0.00 C ATOM 1113 O GLU A 762 -20.429 0.555 5.350 1.00 0.00 O ATOM 1114 CB GLU A 762 -18.535 -0.841 7.519 1.00 0.00 C ATOM 1115 CG GLU A 762 -17.464 -1.858 7.842 1.00 0.00 C ATOM 1116 CD GLU A 762 -16.478 -1.340 8.866 1.00 0.00 C ATOM 1117 OE1 GLU A 762 -16.861 -1.149 10.043 1.00 0.00 O ATOM 1118 OE2 GLU A 762 -15.309 -1.074 8.515 1.00 0.00 O ATOM 0 H GLU A 762 -18.053 -1.471 5.189 1.00 0.00 H new ATOM 0 HA GLU A 762 -20.096 -2.195 7.012 1.00 0.00 H new ATOM 0 HB2 GLU A 762 -18.059 0.040 7.089 1.00 0.00 H new ATOM 0 HB3 GLU A 762 -19.008 -0.526 8.449 1.00 0.00 H new ATOM 0 HG2 GLU A 762 -17.931 -2.769 8.217 1.00 0.00 H new ATOM 0 HG3 GLU A 762 -16.931 -2.125 6.929 1.00 0.00 H new ATOM 1125 N GLU A 763 -21.579 0.005 7.164 1.00 0.00 N ATOM 1126 CA GLU A 763 -22.601 1.006 6.879 1.00 0.00 C ATOM 1127 C GLU A 763 -22.060 2.437 6.929 1.00 0.00 C ATOM 1128 O GLU A 763 -22.671 3.368 6.416 1.00 0.00 O ATOM 1129 CB GLU A 763 -23.912 0.776 7.668 1.00 0.00 C ATOM 1130 CG GLU A 763 -23.805 0.673 9.184 1.00 0.00 C ATOM 1131 CD GLU A 763 -23.482 1.973 9.869 1.00 0.00 C ATOM 1132 OE1 GLU A 763 -24.402 2.766 10.126 1.00 0.00 O ATOM 1133 OE2 GLU A 763 -22.311 2.211 10.198 1.00 0.00 O ATOM 0 H GLU A 763 -21.694 -0.496 8.045 1.00 0.00 H new ATOM 0 HA GLU A 763 -22.893 0.865 5.838 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -24.595 1.592 7.433 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -24.372 -0.141 7.299 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -24.747 0.292 9.578 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -23.036 -0.057 9.434 1.00 0.00 H new ATOM 1140 N HIS A 764 -20.839 2.561 7.441 1.00 0.00 N ATOM 1141 CA HIS A 764 -20.147 3.847 7.520 1.00 0.00 C ATOM 1142 C HIS A 764 -19.692 4.180 6.118 1.00 0.00 C ATOM 1143 O HIS A 764 -19.630 5.331 5.695 1.00 0.00 O ATOM 1144 CB HIS A 764 -18.841 3.777 8.358 1.00 0.00 C ATOM 1145 CG HIS A 764 -18.725 2.725 9.430 1.00 0.00 C ATOM 1146 ND1 HIS A 764 -19.706 2.396 10.324 1.00 0.00 N ATOM 1147 CD2 HIS A 764 -17.704 1.906 9.699 1.00 0.00 C ATOM 1148 CE1 HIS A 764 -19.278 1.421 11.098 1.00 0.00 C ATOM 1149 NE2 HIS A 764 -18.066 1.103 10.734 1.00 0.00 N ATOM 0 H HIS A 764 -20.302 1.777 7.812 1.00 0.00 H new ATOM 0 HA HIS A 764 -20.830 4.566 7.972 1.00 0.00 H new ATOM 0 HB2 HIS A 764 -18.011 3.636 7.666 1.00 0.00 H new ATOM 0 HB3 HIS A 764 -18.700 4.749 8.832 1.00 0.00 H new ATOM 0 HD1 HIS A 764 -20.624 2.836 10.382 1.00 0.00 H new ATOM 0 HD2 HIS A 764 -16.755 1.886 9.183 1.00 0.00 H new ATOM 0 HE1 HIS A 764 -19.836 0.961 11.900 1.00 0.00 H new ATOM 0 HE2 HIS A 764 -17.488 0.375 11.155 1.00 0.00 H new ATOM 1158 N LEU A 765 -19.403 3.127 5.402 1.00 0.00 N ATOM 1159 CA LEU A 765 -18.805 3.179 4.122 1.00 0.00 C ATOM 1160 C LEU A 765 -19.813 3.054 3.001 1.00 0.00 C ATOM 1161 O LEU A 765 -19.566 3.512 1.891 1.00 0.00 O ATOM 1162 CB LEU A 765 -17.866 2.044 4.020 1.00 0.00 C ATOM 1163 CG LEU A 765 -16.669 2.029 4.901 1.00 0.00 C ATOM 1164 CD1 LEU A 765 -15.888 0.889 4.557 1.00 0.00 C ATOM 1165 CD2 LEU A 765 -15.917 3.372 4.975 1.00 0.00 C ATOM 0 H LEU A 765 -19.591 2.176 5.720 1.00 0.00 H new ATOM 0 HA LEU A 765 -18.312 4.145 4.018 1.00 0.00 H new ATOM 0 HB2 LEU A 765 -18.429 1.130 4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 765 -17.518 1.994 2.988 1.00 0.00 H new ATOM 0 HG LEU A 765 -16.975 1.922 5.942 1.00 0.00 H new ATOM 0 HD11 LEU A 765 -15.001 0.852 5.189 1.00 0.00 H new ATOM 0 HD12 LEU A 765 -16.478 -0.015 4.707 1.00 0.00 H new ATOM 0 HD13 LEU A 765 -15.586 0.956 3.512 1.00 0.00 H new ATOM 0 HD21 LEU A 765 -15.058 3.272 5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 765 -15.575 3.653 3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 765 -16.585 4.142 5.360 1.00 0.00 H new ATOM 1177 N LYS A 766 -20.942 2.422 3.281 1.00 0.00 N ATOM 1178 CA LYS A 766 -21.968 2.222 2.264 1.00 0.00 C ATOM 1179 C LYS A 766 -22.505 3.560 1.775 1.00 0.00 C ATOM 1180 O LYS A 766 -22.843 3.725 0.600 1.00 0.00 O ATOM 1181 CB LYS A 766 -23.114 1.347 2.775 1.00 0.00 C ATOM 1182 CG LYS A 766 -22.689 -0.025 3.260 1.00 0.00 C ATOM 1183 CD LYS A 766 -23.848 -1.032 3.432 1.00 0.00 C ATOM 1184 CE LYS A 766 -25.069 -0.492 4.195 1.00 0.00 C ATOM 1185 NZ LYS A 766 -26.045 0.161 3.293 1.00 0.00 N ATOM 0 H LYS A 766 -21.172 2.040 4.198 1.00 0.00 H new ATOM 0 HA LYS A 766 -21.500 1.700 1.429 1.00 0.00 H new ATOM 0 HB2 LYS A 766 -23.616 1.867 3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 766 -23.846 1.226 1.976 1.00 0.00 H new ATOM 0 HG2 LYS A 766 -21.967 -0.438 2.555 1.00 0.00 H new ATOM 0 HG3 LYS A 766 -22.175 0.084 4.215 1.00 0.00 H new ATOM 0 HD2 LYS A 766 -24.172 -1.362 2.445 1.00 0.00 H new ATOM 0 HD3 LYS A 766 -23.471 -1.911 3.955 1.00 0.00 H new ATOM 0 HE2 LYS A 766 -25.556 -1.311 4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 766 -24.738 0.222 4.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 -26.179 1.150 3.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 -25.688 0.133 2.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 -26.954 -0.341 3.344 1.00 0.00 H new ATOM 1199 N ASN A 767 -22.524 4.522 2.677 1.00 0.00 N ATOM 1200 CA ASN A 767 -22.977 5.865 2.360 1.00 0.00 C ATOM 1201 C ASN A 767 -21.797 6.724 1.929 1.00 0.00 C ATOM 1202 O ASN A 767 -21.946 7.915 1.676 1.00 0.00 O ATOM 1203 CB ASN A 767 -23.682 6.532 3.565 1.00 0.00 C ATOM 1204 CG ASN A 767 -24.904 5.771 4.055 1.00 0.00 C ATOM 1205 OD1 ASN A 767 -26.024 5.960 3.568 1.00 0.00 O ATOM 1206 ND2 ASN A 767 -24.716 4.933 5.040 1.00 0.00 N ATOM 0 H ASN A 767 -22.228 4.397 3.645 1.00 0.00 H new ATOM 0 HA ASN A 767 -23.697 5.784 1.546 1.00 0.00 H new ATOM 0 HB2 ASN A 767 -22.970 6.626 4.385 1.00 0.00 H new ATOM 0 HB3 ASN A 767 -23.982 7.542 3.286 1.00 0.00 H new ATOM 0 HD21 ASN A 767 -25.505 4.415 5.426 1.00 0.00 H new ATOM 0 HD22 ASN A 767 -23.780 4.797 5.422 1.00 0.00 H new ATOM 1213 N LYS A 768 -20.622 6.114 1.806 1.00 0.00 N ATOM 1214 CA LYS A 768 -19.445 6.870 1.454 1.00 0.00 C ATOM 1215 C LYS A 768 -19.344 6.953 -0.030 1.00 0.00 C ATOM 1216 O LYS A 768 -19.189 8.046 -0.571 1.00 0.00 O ATOM 1217 CB LYS A 768 -18.162 6.293 2.086 1.00 0.00 C ATOM 1218 CG LYS A 768 -16.965 7.225 1.964 1.00 0.00 C ATOM 1219 CD LYS A 768 -15.801 6.804 2.846 1.00 0.00 C ATOM 1220 CE LYS A 768 -16.179 6.777 4.323 1.00 0.00 C ATOM 1221 NZ LYS A 768 -16.580 8.104 4.850 1.00 0.00 N ATOM 0 H LYS A 768 -20.469 5.115 1.944 1.00 0.00 H new ATOM 0 HA LYS A 768 -19.545 7.876 1.863 1.00 0.00 H new ATOM 0 HB2 LYS A 768 -18.346 6.083 3.140 1.00 0.00 H new ATOM 0 HB3 LYS A 768 -17.925 5.342 1.609 1.00 0.00 H new ATOM 0 HG2 LYS A 768 -16.636 7.254 0.925 1.00 0.00 H new ATOM 0 HG3 LYS A 768 -17.269 8.237 2.230 1.00 0.00 H new ATOM 0 HD2 LYS A 768 -15.456 5.815 2.543 1.00 0.00 H new ATOM 0 HD3 LYS A 768 -14.968 7.491 2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 768 -16.999 6.073 4.468 1.00 0.00 H new ATOM 0 HE3 LYS A 768 -15.333 6.405 4.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 768 -16.742 8.036 5.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 768 -15.824 8.794 4.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 768 -17.455 8.414 4.381 1.00 0.00 H new ATOM 1235 N LYS A 769 -19.480 5.795 -0.690 1.00 0.00 N ATOM 1236 CA LYS A 769 -19.453 5.651 -2.131 1.00 0.00 C ATOM 1237 C LYS A 769 -18.038 5.923 -2.694 1.00 0.00 C ATOM 1238 O LYS A 769 -17.464 5.081 -3.366 1.00 0.00 O ATOM 1239 CB LYS A 769 -20.512 6.546 -2.781 1.00 0.00 C ATOM 1240 CG LYS A 769 -20.829 6.179 -4.196 1.00 0.00 C ATOM 1241 CD LYS A 769 -22.219 5.536 -4.324 1.00 0.00 C ATOM 1242 CE LYS A 769 -22.295 4.133 -3.716 1.00 0.00 C ATOM 1243 NZ LYS A 769 -21.555 3.136 -4.524 1.00 0.00 N ATOM 0 H LYS A 769 -19.616 4.907 -0.207 1.00 0.00 H new ATOM 0 HA LYS A 769 -19.699 4.618 -2.379 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -21.427 6.498 -2.190 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -20.167 7.580 -2.752 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -20.783 7.071 -4.821 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -20.074 5.488 -4.570 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -22.954 6.176 -3.836 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -22.492 5.483 -5.378 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -21.888 4.154 -2.705 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -23.339 3.830 -3.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -22.052 2.223 -4.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -21.497 3.462 -5.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -20.595 3.022 -4.140 1.00 0.00 H new ATOM 1257 N GLU A 770 -17.494 7.066 -2.371 1.00 0.00 N ATOM 1258 CA GLU A 770 -16.166 7.464 -2.780 1.00 0.00 C ATOM 1259 C GLU A 770 -15.300 7.550 -1.552 1.00 0.00 C ATOM 1260 O GLU A 770 -15.623 8.257 -0.606 1.00 0.00 O ATOM 1261 CB GLU A 770 -16.212 8.794 -3.517 1.00 0.00 C ATOM 1262 CG GLU A 770 -16.937 8.705 -4.845 1.00 0.00 C ATOM 1263 CD GLU A 770 -17.053 10.029 -5.533 1.00 0.00 C ATOM 1264 OE1 GLU A 770 -16.017 10.580 -5.969 1.00 0.00 O ATOM 1265 OE2 GLU A 770 -18.188 10.525 -5.691 1.00 0.00 O ATOM 0 H GLU A 770 -17.971 7.766 -1.802 1.00 0.00 H new ATOM 0 HA GLU A 770 -15.748 6.729 -3.468 1.00 0.00 H new ATOM 0 HB2 GLU A 770 -16.705 9.536 -2.888 1.00 0.00 H new ATOM 0 HB3 GLU A 770 -15.194 9.146 -3.687 1.00 0.00 H new ATOM 0 HG2 GLU A 770 -16.409 8.008 -5.496 1.00 0.00 H new ATOM 0 HG3 GLU A 770 -17.934 8.297 -4.682 1.00 0.00 H new ATOM 1272 N PHE A 771 -14.229 6.833 -1.559 1.00 0.00 N ATOM 1273 CA PHE A 771 -13.379 6.709 -0.404 1.00 0.00 C ATOM 1274 C PHE A 771 -12.085 7.406 -0.669 1.00 0.00 C ATOM 1275 O PHE A 771 -11.624 7.457 -1.802 1.00 0.00 O ATOM 1276 CB PHE A 771 -13.110 5.233 -0.078 1.00 0.00 C ATOM 1277 CG PHE A 771 -14.343 4.404 0.204 1.00 0.00 C ATOM 1278 CD1 PHE A 771 -15.243 4.110 -0.802 1.00 0.00 C ATOM 1279 CD2 PHE A 771 -14.584 3.906 1.464 1.00 0.00 C ATOM 1280 CE1 PHE A 771 -16.351 3.349 -0.560 1.00 0.00 C ATOM 1281 CE2 PHE A 771 -15.711 3.131 1.714 1.00 0.00 C ATOM 1282 CZ PHE A 771 -16.589 2.856 0.695 1.00 0.00 C ATOM 0 H PHE A 771 -13.907 6.307 -2.371 1.00 0.00 H new ATOM 0 HA PHE A 771 -13.881 7.164 0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 771 -12.573 4.784 -0.914 1.00 0.00 H new ATOM 0 HB3 PHE A 771 -12.451 5.183 0.789 1.00 0.00 H new ATOM 0 HD1 PHE A 771 -15.067 4.489 -1.798 1.00 0.00 H new ATOM 0 HD2 PHE A 771 -13.892 4.119 2.265 1.00 0.00 H new ATOM 0 HE1 PHE A 771 -17.042 3.135 -1.362 1.00 0.00 H new ATOM 0 HE2 PHE A 771 -15.895 2.747 2.706 1.00 0.00 H new ATOM 0 HZ PHE A 771 -17.465 2.253 0.883 1.00 0.00 H new ATOM 1292 N ASP A 772 -11.494 7.924 0.348 1.00 0.00 N ATOM 1293 CA ASP A 772 -10.251 8.654 0.192 1.00 0.00 C ATOM 1294 C ASP A 772 -9.106 7.670 0.411 1.00 0.00 C ATOM 1295 O ASP A 772 -9.320 6.630 1.020 1.00 0.00 O ATOM 1296 CB ASP A 772 -10.180 9.786 1.220 1.00 0.00 C ATOM 1297 CG ASP A 772 -9.271 10.919 0.796 1.00 0.00 C ATOM 1298 OD1 ASP A 772 -8.104 10.684 0.464 1.00 0.00 O ATOM 1299 OD2 ASP A 772 -9.731 12.067 0.740 1.00 0.00 O ATOM 0 H ASP A 772 -11.838 7.865 1.306 1.00 0.00 H new ATOM 0 HA ASP A 772 -10.186 9.095 -0.803 1.00 0.00 H new ATOM 0 HB2 ASP A 772 -11.183 10.177 1.390 1.00 0.00 H new ATOM 0 HB3 ASP A 772 -9.830 9.384 2.171 1.00 0.00 H new ATOM 1304 N HIS A 773 -7.934 7.959 -0.134 1.00 0.00 N ATOM 1305 CA HIS A 773 -6.732 7.139 0.001 1.00 0.00 C ATOM 1306 C HIS A 773 -6.468 6.687 1.471 1.00 0.00 C ATOM 1307 O HIS A 773 -6.809 7.387 2.425 1.00 0.00 O ATOM 1308 CB HIS A 773 -5.515 7.954 -0.493 1.00 0.00 C ATOM 1309 CG HIS A 773 -4.978 8.964 0.534 1.00 0.00 C ATOM 1310 ND1 HIS A 773 -5.719 9.982 1.069 1.00 0.00 N ATOM 1311 CD2 HIS A 773 -3.800 9.006 1.173 1.00 0.00 C ATOM 1312 CE1 HIS A 773 -5.031 10.591 1.997 1.00 0.00 C ATOM 1313 NE2 HIS A 773 -3.859 10.018 2.085 1.00 0.00 N ATOM 0 H HIS A 773 -7.785 8.795 -0.700 1.00 0.00 H new ATOM 0 HA HIS A 773 -6.883 6.240 -0.596 1.00 0.00 H new ATOM 0 HB2 HIS A 773 -4.714 7.265 -0.762 1.00 0.00 H new ATOM 0 HB3 HIS A 773 -5.794 8.489 -1.401 1.00 0.00 H new ATOM 0 HD1 HIS A 773 -6.667 10.229 0.785 1.00 0.00 H new ATOM 0 HD2 HIS A 773 -2.956 8.355 0.997 1.00 0.00 H new ATOM 0 HE1 HIS A 773 -5.372 11.426 2.591 1.00 0.00 H new ATOM 1322 N ASN A 774 -5.853 5.525 1.596 1.00 0.00 N ATOM 1323 CA ASN A 774 -5.380 4.939 2.869 1.00 0.00 C ATOM 1324 C ASN A 774 -6.538 4.544 3.775 1.00 0.00 C ATOM 1325 O ASN A 774 -6.345 4.226 4.942 1.00 0.00 O ATOM 1326 CB ASN A 774 -4.420 5.890 3.615 1.00 0.00 C ATOM 1327 CG ASN A 774 -3.315 5.152 4.379 1.00 0.00 C ATOM 1328 OD1 ASN A 774 -2.235 4.910 3.829 1.00 0.00 O ATOM 1329 ND2 ASN A 774 -3.551 4.798 5.613 1.00 0.00 N ATOM 0 H ASN A 774 -5.654 4.929 0.792 1.00 0.00 H new ATOM 0 HA ASN A 774 -4.830 4.035 2.608 1.00 0.00 H new ATOM 0 HB2 ASN A 774 -3.964 6.572 2.898 1.00 0.00 H new ATOM 0 HB3 ASN A 774 -4.993 6.499 4.315 1.00 0.00 H new ATOM 0 HD21 ASN A 774 -2.835 4.308 6.149 1.00 0.00 H new ATOM 0 HD22 ASN A 774 -4.452 5.011 6.041 1.00 0.00 H new ATOM 1336 N SER A 775 -7.734 4.535 3.242 1.00 0.00 N ATOM 1337 CA SER A 775 -8.864 4.155 4.016 1.00 0.00 C ATOM 1338 C SER A 775 -8.901 2.648 4.155 1.00 0.00 C ATOM 1339 O SER A 775 -9.051 1.926 3.170 1.00 0.00 O ATOM 1340 CB SER A 775 -10.154 4.707 3.403 1.00 0.00 C ATOM 1341 OG SER A 775 -10.236 4.408 2.023 1.00 0.00 O ATOM 0 H SER A 775 -7.939 4.788 2.275 1.00 0.00 H new ATOM 0 HA SER A 775 -8.780 4.585 5.014 1.00 0.00 H new ATOM 0 HB2 SER A 775 -11.015 4.284 3.921 1.00 0.00 H new ATOM 0 HB3 SER A 775 -10.194 5.787 3.546 1.00 0.00 H new ATOM 0 HG SER A 775 -10.214 5.240 1.506 1.00 0.00 H new ATOM 1347 N ASN A 776 -8.662 2.179 5.350 1.00 0.00 N ATOM 1348 CA ASN A 776 -8.730 0.771 5.629 1.00 0.00 C ATOM 1349 C ASN A 776 -10.162 0.441 5.923 1.00 0.00 C ATOM 1350 O ASN A 776 -10.659 0.650 7.040 1.00 0.00 O ATOM 1351 CB ASN A 776 -7.815 0.339 6.803 1.00 0.00 C ATOM 1352 CG ASN A 776 -6.304 0.489 6.545 1.00 0.00 C ATOM 1353 OD1 ASN A 776 -5.901 1.516 5.836 1.00 0.00 O flip ATOM 1354 ND2 ASN A 776 -5.498 -0.310 7.033 1.00 0.00 N flip ATOM 0 H ASN A 776 -8.416 2.758 6.153 1.00 0.00 H new ATOM 0 HA ASN A 776 -8.367 0.221 4.761 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -8.077 0.927 7.683 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -8.025 -0.704 7.042 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -5.833 -1.102 7.581 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -4.497 -0.178 6.888 1.00 0.00 H new ATOM 1361 N ILE A 777 -10.840 0.035 4.908 1.00 0.00 N ATOM 1362 CA ILE A 777 -12.227 -0.271 4.969 1.00 0.00 C ATOM 1363 C ILE A 777 -12.422 -1.759 4.928 1.00 0.00 C ATOM 1364 O ILE A 777 -11.463 -2.534 4.856 1.00 0.00 O ATOM 1365 CB ILE A 777 -12.971 0.316 3.770 1.00 0.00 C ATOM 1366 CG1 ILE A 777 -12.502 -0.243 2.442 1.00 0.00 C ATOM 1367 CG2 ILE A 777 -12.939 1.837 3.801 1.00 0.00 C ATOM 1368 CD1 ILE A 777 -13.630 -0.368 1.444 1.00 0.00 C ATOM 0 H ILE A 777 -10.432 -0.098 3.983 1.00 0.00 H new ATOM 0 HA ILE A 777 -12.616 0.153 5.895 1.00 0.00 H new ATOM 0 HB ILE A 777 -14.011 0.002 3.861 1.00 0.00 H new ATOM 0 HG12 ILE A 777 -11.726 0.403 2.032 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -12.050 -1.222 2.601 1.00 0.00 H new ATOM 0 HG21 ILE A 777 -13.475 2.230 2.937 1.00 0.00 H new ATOM 0 HG22 ILE A 777 -13.414 2.192 4.715 1.00 0.00 H new ATOM 0 HG23 ILE A 777 -11.905 2.180 3.773 1.00 0.00 H new ATOM 0 HD11 ILE A 777 -13.245 -0.773 0.508 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -14.395 -1.036 1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 777 -14.066 0.615 1.262 1.00 0.00 H new ATOM 1380 N ARG A 778 -13.640 -2.163 4.933 1.00 0.00 N ATOM 1381 CA ARG A 778 -13.976 -3.535 4.848 1.00 0.00 C ATOM 1382 C ARG A 778 -15.045 -3.708 3.820 1.00 0.00 C ATOM 1383 O ARG A 778 -15.990 -2.925 3.772 1.00 0.00 O ATOM 1384 CB ARG A 778 -14.507 -4.036 6.166 1.00 0.00 C ATOM 1385 CG ARG A 778 -13.536 -4.034 7.313 1.00 0.00 C ATOM 1386 CD ARG A 778 -14.249 -4.460 8.559 1.00 0.00 C ATOM 1387 NE ARG A 778 -13.387 -4.549 9.736 1.00 0.00 N ATOM 1388 CZ ARG A 778 -13.373 -3.665 10.736 1.00 0.00 C ATOM 1389 NH1 ARG A 778 -13.976 -2.490 10.599 1.00 0.00 N ATOM 1390 NH2 ARG A 778 -12.718 -3.940 11.857 1.00 0.00 N ATOM 0 H ARG A 778 -14.444 -1.538 4.997 1.00 0.00 H new ATOM 0 HA ARG A 778 -13.080 -4.097 4.582 1.00 0.00 H new ATOM 0 HB2 ARG A 778 -15.367 -3.427 6.443 1.00 0.00 H new ATOM 0 HB3 ARG A 778 -14.870 -5.054 6.025 1.00 0.00 H new ATOM 0 HG2 ARG A 778 -12.707 -4.710 7.105 1.00 0.00 H new ATOM 0 HG3 ARG A 778 -13.111 -3.039 7.444 1.00 0.00 H new ATOM 0 HD2 ARG A 778 -15.054 -3.755 8.764 1.00 0.00 H new ATOM 0 HD3 ARG A 778 -14.712 -5.431 8.386 1.00 0.00 H new ATOM 0 HE ARG A 778 -12.750 -5.344 9.798 1.00 0.00 H new ATOM 0 HH11 ARG A 778 -14.452 -2.260 9.727 1.00 0.00 H new ATOM 0 HH12 ARG A 778 -13.963 -1.818 11.366 1.00 0.00 H new ATOM 0 HH21 ARG A 778 -12.225 -4.827 11.955 1.00 0.00 H new ATOM 0 HH22 ARG A 778 -12.708 -3.264 12.621 1.00 0.00 H new ATOM 1404 N TYR A 779 -14.886 -4.695 2.994 1.00 0.00 N ATOM 1405 CA TYR A 779 -15.893 -5.051 2.039 1.00 0.00 C ATOM 1406 C TYR A 779 -16.086 -6.530 2.151 1.00 0.00 C ATOM 1407 O TYR A 779 -15.258 -7.219 2.800 1.00 0.00 O ATOM 1408 CB TYR A 779 -15.475 -4.701 0.594 1.00 0.00 C ATOM 1409 CG TYR A 779 -14.483 -5.660 -0.021 1.00 0.00 C ATOM 1410 CD1 TYR A 779 -13.196 -5.806 0.467 1.00 0.00 C ATOM 1411 CD2 TYR A 779 -14.863 -6.432 -1.086 1.00 0.00 C ATOM 1412 CE1 TYR A 779 -12.327 -6.699 -0.099 1.00 0.00 C ATOM 1413 CE2 TYR A 779 -14.016 -7.318 -1.670 1.00 0.00 C ATOM 1414 CZ TYR A 779 -12.732 -7.455 -1.170 1.00 0.00 C ATOM 1415 OH TYR A 779 -11.863 -8.358 -1.715 1.00 0.00 O ATOM 0 H TYR A 779 -14.051 -5.280 2.962 1.00 0.00 H new ATOM 0 HA TYR A 779 -16.807 -4.495 2.249 1.00 0.00 H new ATOM 0 HB2 TYR A 779 -16.367 -4.670 -0.031 1.00 0.00 H new ATOM 0 HB3 TYR A 779 -15.046 -3.699 0.586 1.00 0.00 H new ATOM 0 HD1 TYR A 779 -12.873 -5.207 1.306 1.00 0.00 H new ATOM 0 HD2 TYR A 779 -15.866 -6.333 -1.473 1.00 0.00 H new ATOM 0 HE1 TYR A 779 -11.328 -6.808 0.295 1.00 0.00 H new ATOM 0 HE2 TYR A 779 -14.340 -7.909 -2.514 1.00 0.00 H new ATOM 0 HH TYR A 779 -12.296 -8.817 -2.465 1.00 0.00 H new ATOM 1425 N ARG A 780 -17.111 -7.014 1.535 1.00 0.00 N ATOM 1426 CA ARG A 780 -17.406 -8.411 1.499 1.00 0.00 C ATOM 1427 C ARG A 780 -18.317 -8.673 0.314 1.00 0.00 C ATOM 1428 O ARG A 780 -18.880 -7.720 -0.251 1.00 0.00 O ATOM 1429 CB ARG A 780 -18.080 -8.851 2.801 1.00 0.00 C ATOM 1430 CG ARG A 780 -19.549 -8.534 2.891 1.00 0.00 C ATOM 1431 CD ARG A 780 -20.126 -9.027 4.191 1.00 0.00 C ATOM 1432 NE ARG A 780 -21.587 -9.020 4.190 1.00 0.00 N ATOM 1433 CZ ARG A 780 -22.365 -8.771 5.246 1.00 0.00 C ATOM 1434 NH1 ARG A 780 -21.848 -8.390 6.404 1.00 0.00 N ATOM 1435 NH2 ARG A 780 -23.665 -8.901 5.140 1.00 0.00 N ATOM 0 H ARG A 780 -17.784 -6.438 1.030 1.00 0.00 H new ATOM 0 HA ARG A 780 -16.484 -8.983 1.394 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -17.947 -9.927 2.917 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -17.568 -8.375 3.637 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -19.699 -7.458 2.807 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -20.077 -8.995 2.056 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -19.770 -10.039 4.383 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -19.763 -8.402 5.007 1.00 0.00 H new ATOM 0 HE ARG A 780 -22.053 -9.223 3.306 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -20.838 -8.282 6.501 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -22.459 -8.205 7.199 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -24.078 -9.191 4.254 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -24.264 -8.712 5.944 1.00 0.00 H new ATOM 1449 N CYS A 781 -18.443 -9.917 -0.067 1.00 0.00 N ATOM 1450 CA CYS A 781 -19.331 -10.309 -1.142 1.00 0.00 C ATOM 1451 C CYS A 781 -20.760 -10.474 -0.587 1.00 0.00 C ATOM 1452 O CYS A 781 -20.938 -10.635 0.617 1.00 0.00 O ATOM 1453 CB CYS A 781 -18.826 -11.599 -1.788 1.00 0.00 C ATOM 1454 SG CYS A 781 -17.198 -11.484 -2.656 1.00 0.00 S ATOM 0 H CYS A 781 -17.934 -10.692 0.357 1.00 0.00 H new ATOM 0 HA CYS A 781 -19.350 -9.538 -1.912 1.00 0.00 H new ATOM 0 HB2 CYS A 781 -18.751 -12.364 -1.015 1.00 0.00 H new ATOM 0 HB3 CYS A 781 -19.574 -11.941 -2.503 1.00 0.00 H new ATOM 0 HG CYS A 781 -16.889 -12.644 -3.154 1.00 0.00 H new ATOM 1459 N ARG A 782 -21.756 -10.455 -1.457 1.00 0.00 N ATOM 1460 CA ARG A 782 -23.167 -10.435 -1.047 1.00 0.00 C ATOM 1461 C ARG A 782 -23.672 -11.786 -0.558 1.00 0.00 C ATOM 1462 O ARG A 782 -24.547 -11.852 0.300 1.00 0.00 O ATOM 1463 CB ARG A 782 -24.040 -9.886 -2.180 1.00 0.00 C ATOM 1464 CG ARG A 782 -24.190 -10.796 -3.383 1.00 0.00 C ATOM 1465 CD ARG A 782 -24.308 -9.998 -4.663 1.00 0.00 C ATOM 1466 NE ARG A 782 -25.309 -8.926 -4.599 1.00 0.00 N ATOM 1467 CZ ARG A 782 -26.168 -8.622 -5.574 1.00 0.00 C ATOM 1468 NH1 ARG A 782 -26.355 -9.454 -6.592 1.00 0.00 N ATOM 1469 NH2 ARG A 782 -26.863 -7.495 -5.503 1.00 0.00 N ATOM 0 H ARG A 782 -21.619 -10.453 -2.468 1.00 0.00 H new ATOM 0 HA ARG A 782 -23.239 -9.767 -0.188 1.00 0.00 H new ATOM 0 HB2 ARG A 782 -25.032 -9.672 -1.781 1.00 0.00 H new ATOM 0 HB3 ARG A 782 -23.619 -8.937 -2.513 1.00 0.00 H new ATOM 0 HG2 ARG A 782 -23.331 -11.464 -3.446 1.00 0.00 H new ATOM 0 HG3 ARG A 782 -25.073 -11.423 -3.260 1.00 0.00 H new ATOM 0 HD2 ARG A 782 -23.337 -9.563 -4.901 1.00 0.00 H new ATOM 0 HD3 ARG A 782 -24.563 -10.673 -5.480 1.00 0.00 H new ATOM 0 HE ARG A 782 -25.351 -8.371 -3.744 1.00 0.00 H new ATOM 0 HH11 ARG A 782 -25.840 -10.334 -6.633 1.00 0.00 H new ATOM 0 HH12 ARG A 782 -27.014 -9.214 -7.333 1.00 0.00 H new ATOM 0 HH21 ARG A 782 -26.739 -6.868 -4.708 1.00 0.00 H new ATOM 0 HH22 ARG A 782 -27.522 -7.255 -6.244 1.00 0.00 H new ATOM 1483 N GLY A 783 -23.118 -12.851 -1.084 1.00 0.00 N ATOM 1484 CA GLY A 783 -23.518 -14.170 -0.658 1.00 0.00 C ATOM 1485 C GLY A 783 -22.535 -14.719 0.332 1.00 0.00 C ATOM 1486 O GLY A 783 -22.580 -15.898 0.697 1.00 0.00 O ATOM 0 H GLY A 783 -22.394 -12.832 -1.802 1.00 0.00 H new ATOM 0 HA2 GLY A 783 -24.511 -14.129 -0.210 1.00 0.00 H new ATOM 0 HA3 GLY A 783 -23.584 -14.833 -1.520 1.00 0.00 H new ATOM 1490 N LYS A 784 -21.630 -13.869 0.745 1.00 0.00 N ATOM 1491 CA LYS A 784 -20.600 -14.218 1.681 1.00 0.00 C ATOM 1492 C LYS A 784 -20.728 -13.351 2.911 1.00 0.00 C ATOM 1493 O LYS A 784 -21.420 -12.329 2.890 1.00 0.00 O ATOM 1494 CB LYS A 784 -19.177 -14.027 1.084 1.00 0.00 C ATOM 1495 CG LYS A 784 -18.701 -15.065 0.053 1.00 0.00 C ATOM 1496 CD LYS A 784 -19.517 -15.065 -1.229 1.00 0.00 C ATOM 1497 CE LYS A 784 -18.951 -16.019 -2.272 1.00 0.00 C ATOM 1498 NZ LYS A 784 -18.893 -17.419 -1.798 1.00 0.00 N ATOM 0 H LYS A 784 -21.590 -12.899 0.433 1.00 0.00 H new ATOM 0 HA LYS A 784 -20.726 -15.272 1.930 1.00 0.00 H new ATOM 0 HB2 LYS A 784 -19.136 -13.043 0.616 1.00 0.00 H new ATOM 0 HB3 LYS A 784 -18.464 -14.018 1.908 1.00 0.00 H new ATOM 0 HG2 LYS A 784 -17.656 -14.871 -0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 784 -18.744 -16.057 0.502 1.00 0.00 H new ATOM 0 HD2 LYS A 784 -20.546 -15.346 -1.003 1.00 0.00 H new ATOM 0 HD3 LYS A 784 -19.545 -14.056 -1.640 1.00 0.00 H new ATOM 0 HE2 LYS A 784 -19.563 -15.970 -3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 784 -17.949 -15.693 -2.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 -18.613 -18.040 -2.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 -18.196 -17.497 -1.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 -19.829 -17.706 -1.447 1.00 0.00 H new ATOM 1512 N GLU A 785 -20.115 -13.765 3.968 1.00 0.00 N ATOM 1513 CA GLU A 785 -20.000 -12.969 5.142 1.00 0.00 C ATOM 1514 C GLU A 785 -18.558 -12.974 5.590 1.00 0.00 C ATOM 1515 O GLU A 785 -17.783 -13.841 5.170 1.00 0.00 O ATOM 1516 CB GLU A 785 -20.957 -13.405 6.244 1.00 0.00 C ATOM 1517 CG GLU A 785 -20.848 -14.848 6.686 1.00 0.00 C ATOM 1518 CD GLU A 785 -21.737 -15.125 7.868 1.00 0.00 C ATOM 1519 OE1 GLU A 785 -22.952 -14.858 7.793 1.00 0.00 O ATOM 1520 OE2 GLU A 785 -21.228 -15.572 8.920 1.00 0.00 O ATOM 0 H GLU A 785 -19.673 -14.681 4.041 1.00 0.00 H new ATOM 0 HA GLU A 785 -20.296 -11.947 4.907 1.00 0.00 H new ATOM 0 HB2 GLU A 785 -20.794 -12.767 7.112 1.00 0.00 H new ATOM 0 HB3 GLU A 785 -21.977 -13.226 5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 785 -21.121 -15.505 5.861 1.00 0.00 H new ATOM 0 HG3 GLU A 785 -19.814 -15.074 6.945 1.00 0.00 H new ATOM 1527 N GLY A 786 -18.198 -12.039 6.420 1.00 0.00 N ATOM 1528 CA GLY A 786 -16.816 -11.871 6.776 1.00 0.00 C ATOM 1529 C GLY A 786 -16.215 -10.788 5.919 1.00 0.00 C ATOM 1530 O GLY A 786 -16.587 -10.638 4.762 1.00 0.00 O ATOM 0 H GLY A 786 -18.839 -11.381 6.863 1.00 0.00 H new ATOM 0 HA2 GLY A 786 -16.728 -11.608 7.830 1.00 0.00 H new ATOM 0 HA3 GLY A 786 -16.275 -12.806 6.634 1.00 0.00 H new ATOM 1534 N TRP A 787 -15.321 -10.029 6.462 1.00 0.00 N ATOM 1535 CA TRP A 787 -14.780 -8.903 5.753 1.00 0.00 C ATOM 1536 C TRP A 787 -13.347 -9.159 5.384 1.00 0.00 C ATOM 1537 O TRP A 787 -12.572 -9.688 6.178 1.00 0.00 O ATOM 1538 CB TRP A 787 -14.882 -7.650 6.599 1.00 0.00 C ATOM 1539 CG TRP A 787 -16.268 -7.396 7.127 1.00 0.00 C ATOM 1540 CD1 TRP A 787 -16.798 -7.886 8.281 1.00 0.00 C ATOM 1541 CD2 TRP A 787 -17.297 -6.600 6.529 1.00 0.00 C ATOM 1542 NE1 TRP A 787 -18.084 -7.454 8.429 1.00 0.00 N ATOM 1543 CE2 TRP A 787 -18.415 -6.663 7.377 1.00 0.00 C ATOM 1544 CE3 TRP A 787 -17.386 -5.845 5.367 1.00 0.00 C ATOM 1545 CZ2 TRP A 787 -19.601 -6.000 7.098 1.00 0.00 C ATOM 1546 CZ3 TRP A 787 -18.559 -5.191 5.095 1.00 0.00 C ATOM 1547 CH2 TRP A 787 -19.651 -5.272 5.955 1.00 0.00 C ATOM 0 H TRP A 787 -14.944 -10.165 7.400 1.00 0.00 H new ATOM 0 HA TRP A 787 -15.358 -8.759 4.840 1.00 0.00 H new ATOM 0 HB2 TRP A 787 -14.191 -7.730 7.438 1.00 0.00 H new ATOM 0 HB3 TRP A 787 -14.565 -6.793 6.005 1.00 0.00 H new ATOM 0 HD1 TRP A 787 -16.276 -8.524 8.979 1.00 0.00 H new ATOM 0 HE1 TRP A 787 -18.700 -7.689 9.208 1.00 0.00 H new ATOM 0 HE3 TRP A 787 -16.547 -5.775 4.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 787 -20.449 -6.061 7.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 787 -18.638 -4.600 4.194 1.00 0.00 H new ATOM 0 HH2 TRP A 787 -20.559 -4.743 5.706 1.00 0.00 H new ATOM 1558 N ILE A 788 -12.989 -8.758 4.200 1.00 0.00 N ATOM 1559 CA ILE A 788 -11.655 -9.028 3.686 1.00 0.00 C ATOM 1560 C ILE A 788 -10.662 -7.922 4.098 1.00 0.00 C ATOM 1561 O ILE A 788 -9.485 -8.193 4.288 1.00 0.00 O ATOM 1562 CB ILE A 788 -11.632 -9.245 2.115 1.00 0.00 C ATOM 1563 CG1 ILE A 788 -12.553 -10.412 1.665 1.00 0.00 C ATOM 1564 CG2 ILE A 788 -10.218 -9.501 1.602 1.00 0.00 C ATOM 1565 CD1 ILE A 788 -14.038 -10.094 1.618 1.00 0.00 C ATOM 0 H ILE A 788 -13.594 -8.241 3.562 1.00 0.00 H new ATOM 0 HA ILE A 788 -11.338 -9.967 4.140 1.00 0.00 H new ATOM 0 HB ILE A 788 -12.010 -8.318 1.683 1.00 0.00 H new ATOM 0 HG12 ILE A 788 -12.238 -10.739 0.674 1.00 0.00 H new ATOM 0 HG13 ILE A 788 -12.401 -11.253 2.341 1.00 0.00 H new ATOM 0 HG21 ILE A 788 -10.243 -9.645 0.522 1.00 0.00 H new ATOM 0 HG22 ILE A 788 -9.584 -8.646 1.840 1.00 0.00 H new ATOM 0 HG23 ILE A 788 -9.815 -10.395 2.078 1.00 0.00 H new ATOM 0 HD11 ILE A 788 -14.589 -10.976 1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 788 -14.379 -9.800 2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 788 -14.213 -9.277 0.918 1.00 0.00 H new ATOM 1577 N HIS A 789 -11.187 -6.694 4.313 1.00 0.00 N ATOM 1578 CA HIS A 789 -10.375 -5.465 4.642 1.00 0.00 C ATOM 1579 C HIS A 789 -9.634 -5.007 3.420 1.00 0.00 C ATOM 1580 O HIS A 789 -8.944 -5.792 2.797 1.00 0.00 O ATOM 1581 CB HIS A 789 -9.301 -5.671 5.740 1.00 0.00 C ATOM 1582 CG HIS A 789 -9.782 -6.066 7.072 1.00 0.00 C ATOM 1583 ND1 HIS A 789 -10.975 -6.503 7.476 1.00 0.00 N flip ATOM 1584 CD2 HIS A 789 -8.972 -6.081 8.166 1.00 0.00 C flip ATOM 1585 CE1 HIS A 789 -10.875 -6.788 8.805 1.00 0.00 C flip ATOM 1586 NE2 HIS A 789 -9.643 -6.517 9.194 1.00 0.00 N flip ATOM 0 H HIS A 789 -12.189 -6.510 4.267 1.00 0.00 H new ATOM 0 HA HIS A 789 -11.105 -4.742 5.006 1.00 0.00 H new ATOM 0 HB2 HIS A 789 -8.601 -6.431 5.392 1.00 0.00 H new ATOM 0 HB3 HIS A 789 -8.738 -4.743 5.843 1.00 0.00 H new ATOM 0 HD2 HIS A 789 -7.935 -5.779 8.180 1.00 0.00 H new ATOM 0 HE1 HIS A 789 -11.667 -7.170 9.432 1.00 0.00 H new ATOM 0 HE2 HIS A 789 -9.278 -6.630 10.140 1.00 0.00 H new ATOM 1595 N THR A 790 -9.769 -3.779 3.071 1.00 0.00 N ATOM 1596 CA THR A 790 -9.035 -3.257 1.950 1.00 0.00 C ATOM 1597 C THR A 790 -8.719 -1.775 2.141 1.00 0.00 C ATOM 1598 O THR A 790 -9.425 -1.072 2.854 1.00 0.00 O ATOM 1599 CB THR A 790 -9.781 -3.538 0.630 1.00 0.00 C ATOM 1600 OG1 THR A 790 -9.153 -2.921 -0.475 1.00 0.00 O ATOM 1601 CG2 THR A 790 -11.220 -3.133 0.726 1.00 0.00 C ATOM 0 H THR A 790 -10.378 -3.108 3.538 1.00 0.00 H new ATOM 0 HA THR A 790 -8.077 -3.774 1.891 1.00 0.00 H new ATOM 0 HB THR A 790 -9.742 -4.614 0.463 1.00 0.00 H new ATOM 0 HG1 THR A 790 -8.795 -3.609 -1.074 1.00 0.00 H new ATOM 0 HG21 THR A 790 -11.721 -3.343 -0.219 1.00 0.00 H new ATOM 0 HG22 THR A 790 -11.703 -3.695 1.525 1.00 0.00 H new ATOM 0 HG23 THR A 790 -11.284 -2.066 0.942 1.00 0.00 H new ATOM 1609 N VAL A 791 -7.639 -1.342 1.547 1.00 0.00 N ATOM 1610 CA VAL A 791 -7.143 0.008 1.675 1.00 0.00 C ATOM 1611 C VAL A 791 -7.246 0.730 0.339 1.00 0.00 C ATOM 1612 O VAL A 791 -6.887 0.178 -0.686 1.00 0.00 O ATOM 1613 CB VAL A 791 -5.653 -0.011 2.117 1.00 0.00 C ATOM 1614 CG1 VAL A 791 -5.126 1.389 2.386 1.00 0.00 C ATOM 1615 CG2 VAL A 791 -5.454 -0.914 3.325 1.00 0.00 C ATOM 0 H VAL A 791 -7.063 -1.931 0.945 1.00 0.00 H new ATOM 0 HA VAL A 791 -7.743 0.526 2.423 1.00 0.00 H new ATOM 0 HB VAL A 791 -5.073 -0.420 1.290 1.00 0.00 H new ATOM 0 HG11 VAL A 791 -4.081 1.332 2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 791 -5.206 1.988 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 791 -5.712 1.852 3.180 1.00 0.00 H new ATOM 0 HG21 VAL A 791 -4.403 -0.909 3.614 1.00 0.00 H new ATOM 0 HG22 VAL A 791 -6.060 -0.550 4.155 1.00 0.00 H new ATOM 0 HG23 VAL A 791 -5.756 -1.930 3.073 1.00 0.00 H new ATOM 1625 N CYS A 792 -7.765 1.938 0.356 1.00 0.00 N ATOM 1626 CA CYS A 792 -7.842 2.758 -0.853 1.00 0.00 C ATOM 1627 C CYS A 792 -6.455 3.213 -1.274 1.00 0.00 C ATOM 1628 O CYS A 792 -5.786 4.000 -0.589 1.00 0.00 O ATOM 1629 CB CYS A 792 -8.735 3.956 -0.630 1.00 0.00 C ATOM 1630 SG CYS A 792 -8.813 5.185 -1.984 1.00 0.00 S ATOM 0 H CYS A 792 -8.143 2.383 1.192 1.00 0.00 H new ATOM 0 HA CYS A 792 -8.270 2.150 -1.650 1.00 0.00 H new ATOM 0 HB2 CYS A 792 -9.746 3.596 -0.438 1.00 0.00 H new ATOM 0 HB3 CYS A 792 -8.401 4.466 0.274 1.00 0.00 H new ATOM 1635 N ILE A 793 -6.051 2.736 -2.377 1.00 0.00 N ATOM 1636 CA ILE A 793 -4.776 2.994 -2.938 1.00 0.00 C ATOM 1637 C ILE A 793 -4.963 3.768 -4.217 1.00 0.00 C ATOM 1638 O ILE A 793 -5.059 3.198 -5.288 1.00 0.00 O ATOM 1639 CB ILE A 793 -3.997 1.673 -3.211 1.00 0.00 C ATOM 1640 CG1 ILE A 793 -3.759 0.886 -1.908 1.00 0.00 C ATOM 1641 CG2 ILE A 793 -2.682 1.942 -3.922 1.00 0.00 C ATOM 1642 CD1 ILE A 793 -2.933 1.623 -0.865 1.00 0.00 C ATOM 0 H ILE A 793 -6.625 2.120 -2.952 1.00 0.00 H new ATOM 0 HA ILE A 793 -4.186 3.576 -2.230 1.00 0.00 H new ATOM 0 HB ILE A 793 -4.615 1.062 -3.868 1.00 0.00 H new ATOM 0 HG12 ILE A 793 -4.725 0.629 -1.473 1.00 0.00 H new ATOM 0 HG13 ILE A 793 -3.260 -0.052 -2.151 1.00 0.00 H new ATOM 0 HG21 ILE A 793 -2.164 0.999 -4.097 1.00 0.00 H new ATOM 0 HG22 ILE A 793 -2.878 2.431 -4.876 1.00 0.00 H new ATOM 0 HG23 ILE A 793 -2.060 2.589 -3.304 1.00 0.00 H new ATOM 0 HD11 ILE A 793 -2.816 0.994 0.018 1.00 0.00 H new ATOM 0 HD12 ILE A 793 -1.951 1.856 -1.277 1.00 0.00 H new ATOM 0 HD13 ILE A 793 -3.439 2.548 -0.587 1.00 0.00 H new ATOM 1654 N ASN A 794 -5.169 5.065 -4.051 1.00 0.00 N ATOM 1655 CA ASN A 794 -5.275 6.030 -5.156 1.00 0.00 C ATOM 1656 C ASN A 794 -6.272 5.564 -6.227 1.00 0.00 C ATOM 1657 O ASN A 794 -5.881 5.206 -7.343 1.00 0.00 O ATOM 1658 CB ASN A 794 -3.915 6.329 -5.846 1.00 0.00 C ATOM 1659 CG ASN A 794 -2.715 6.465 -4.937 1.00 0.00 C ATOM 1660 OD1 ASN A 794 -2.913 6.727 -3.662 1.00 0.00 O flip ATOM 1661 ND2 ASN A 794 -1.604 6.300 -5.381 1.00 0.00 N flip ATOM 0 H ASN A 794 -5.270 5.494 -3.131 1.00 0.00 H new ATOM 0 HA ASN A 794 -5.632 6.948 -4.689 1.00 0.00 H new ATOM 0 HB2 ASN A 794 -3.713 5.532 -6.562 1.00 0.00 H new ATOM 0 HB3 ASN A 794 -4.017 7.252 -6.417 1.00 0.00 H new ATOM 0 HD21 ASN A 794 -1.476 6.098 -6.373 1.00 0.00 H new ATOM 0 HD22 ASN A 794 -0.794 6.363 -4.764 1.00 0.00 H new ATOM 1668 N GLY A 795 -7.532 5.543 -5.886 1.00 0.00 N ATOM 1669 CA GLY A 795 -8.544 5.087 -6.817 1.00 0.00 C ATOM 1670 C GLY A 795 -8.604 3.562 -6.975 1.00 0.00 C ATOM 1671 O GLY A 795 -9.307 3.065 -7.854 1.00 0.00 O ATOM 0 H GLY A 795 -7.888 5.834 -4.975 1.00 0.00 H new ATOM 0 HA2 GLY A 795 -9.518 5.446 -6.484 1.00 0.00 H new ATOM 0 HA3 GLY A 795 -8.355 5.536 -7.792 1.00 0.00 H new ATOM 1675 N ARG A 796 -7.937 2.814 -6.109 1.00 0.00 N ATOM 1676 CA ARG A 796 -7.893 1.369 -6.244 1.00 0.00 C ATOM 1677 C ARG A 796 -7.958 0.797 -4.857 1.00 0.00 C ATOM 1678 O ARG A 796 -7.836 1.521 -3.903 1.00 0.00 O ATOM 1679 CB ARG A 796 -6.584 0.952 -6.893 1.00 0.00 C ATOM 1680 CG ARG A 796 -6.572 -0.421 -7.521 1.00 0.00 C ATOM 1681 CD ARG A 796 -5.183 -0.747 -8.022 1.00 0.00 C ATOM 1682 NE ARG A 796 -4.750 0.145 -9.110 1.00 0.00 N ATOM 1683 CZ ARG A 796 -3.475 0.396 -9.441 1.00 0.00 C ATOM 1684 NH1 ARG A 796 -2.464 -0.179 -8.767 1.00 0.00 N ATOM 1685 NH2 ARG A 796 -3.203 1.218 -10.449 1.00 0.00 N ATOM 0 H ARG A 796 -7.422 3.183 -5.310 1.00 0.00 H new ATOM 0 HA ARG A 796 -8.718 1.013 -6.861 1.00 0.00 H new ATOM 0 HB2 ARG A 796 -6.331 1.684 -7.660 1.00 0.00 H new ATOM 0 HB3 ARG A 796 -5.797 0.994 -6.140 1.00 0.00 H new ATOM 0 HG2 ARG A 796 -6.889 -1.167 -6.792 1.00 0.00 H new ATOM 0 HG3 ARG A 796 -7.284 -0.459 -8.346 1.00 0.00 H new ATOM 0 HD2 ARG A 796 -4.476 -0.675 -7.195 1.00 0.00 H new ATOM 0 HD3 ARG A 796 -5.160 -1.779 -8.372 1.00 0.00 H new ATOM 0 HE ARG A 796 -5.477 0.609 -9.655 1.00 0.00 H new ATOM 0 HH11 ARG A 796 -2.662 -0.814 -7.994 1.00 0.00 H new ATOM 0 HH12 ARG A 796 -1.498 0.020 -9.028 1.00 0.00 H new ATOM 0 HH21 ARG A 796 -3.963 1.656 -10.969 1.00 0.00 H new ATOM 0 HH22 ARG A 796 -2.234 1.411 -10.703 1.00 0.00 H new ATOM 1699 N TRP A 797 -8.117 -0.461 -4.738 1.00 0.00 N ATOM 1700 CA TRP A 797 -8.212 -1.067 -3.451 1.00 0.00 C ATOM 1701 C TRP A 797 -7.059 -2.015 -3.241 1.00 0.00 C ATOM 1702 O TRP A 797 -6.407 -2.415 -4.201 1.00 0.00 O ATOM 1703 CB TRP A 797 -9.545 -1.780 -3.343 1.00 0.00 C ATOM 1704 CG TRP A 797 -10.695 -0.833 -3.311 1.00 0.00 C ATOM 1705 CD1 TRP A 797 -11.626 -0.625 -4.280 1.00 0.00 C ATOM 1706 CD2 TRP A 797 -11.004 0.064 -2.258 1.00 0.00 C ATOM 1707 NE1 TRP A 797 -12.506 0.350 -3.883 1.00 0.00 N ATOM 1708 CE2 TRP A 797 -12.140 0.788 -2.642 1.00 0.00 C ATOM 1709 CE3 TRP A 797 -10.424 0.322 -1.018 1.00 0.00 C ATOM 1710 CZ2 TRP A 797 -12.703 1.755 -1.828 1.00 0.00 C ATOM 1711 CZ3 TRP A 797 -10.981 1.277 -0.220 1.00 0.00 C ATOM 1712 CH2 TRP A 797 -12.104 1.983 -0.622 1.00 0.00 C ATOM 0 H TRP A 797 -8.186 -1.109 -5.522 1.00 0.00 H new ATOM 0 HA TRP A 797 -8.158 -0.307 -2.671 1.00 0.00 H new ATOM 0 HB2 TRP A 797 -9.660 -2.459 -4.188 1.00 0.00 H new ATOM 0 HB3 TRP A 797 -9.555 -2.390 -2.440 1.00 0.00 H new ATOM 0 HD1 TRP A 797 -11.667 -1.150 -5.223 1.00 0.00 H new ATOM 0 HE1 TRP A 797 -13.301 0.691 -4.424 1.00 0.00 H new ATOM 0 HE3 TRP A 797 -9.550 -0.224 -0.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 797 -13.580 2.307 -2.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 797 -10.539 1.487 0.743 1.00 0.00 H new ATOM 0 HH2 TRP A 797 -12.516 2.734 0.036 1.00 0.00 H new ATOM 1723 N ASP A 798 -6.807 -2.354 -2.013 1.00 0.00 N ATOM 1724 CA ASP A 798 -5.746 -3.287 -1.654 1.00 0.00 C ATOM 1725 C ASP A 798 -6.153 -4.050 -0.416 1.00 0.00 C ATOM 1726 O ASP A 798 -6.138 -3.501 0.688 1.00 0.00 O ATOM 1727 CB ASP A 798 -4.428 -2.553 -1.415 1.00 0.00 C ATOM 1728 CG ASP A 798 -3.282 -3.452 -0.968 1.00 0.00 C ATOM 1729 OD1 ASP A 798 -2.606 -4.037 -1.836 1.00 0.00 O ATOM 1730 OD2 ASP A 798 -3.001 -3.553 0.259 1.00 0.00 O ATOM 0 H ASP A 798 -7.329 -1.995 -1.214 1.00 0.00 H new ATOM 0 HA ASP A 798 -5.594 -3.983 -2.479 1.00 0.00 H new ATOM 0 HB2 ASP A 798 -4.138 -2.044 -2.334 1.00 0.00 H new ATOM 0 HB3 ASP A 798 -4.586 -1.783 -0.660 1.00 0.00 H new ATOM 1735 N PRO A 799 -6.595 -5.301 -0.565 1.00 0.00 N ATOM 1736 CA PRO A 799 -6.741 -5.971 -1.867 1.00 0.00 C ATOM 1737 C PRO A 799 -7.903 -5.415 -2.696 1.00 0.00 C ATOM 1738 O PRO A 799 -8.941 -5.003 -2.149 1.00 0.00 O ATOM 1739 CB PRO A 799 -7.051 -7.418 -1.490 1.00 0.00 C ATOM 1740 CG PRO A 799 -7.630 -7.340 -0.127 1.00 0.00 C ATOM 1741 CD PRO A 799 -6.965 -6.182 0.540 1.00 0.00 C ATOM 0 HA PRO A 799 -5.848 -5.837 -2.478 1.00 0.00 H new ATOM 0 HB2 PRO A 799 -7.753 -7.868 -2.192 1.00 0.00 H new ATOM 0 HB3 PRO A 799 -6.150 -8.031 -1.502 1.00 0.00 H new ATOM 0 HG2 PRO A 799 -8.710 -7.197 -0.170 1.00 0.00 H new ATOM 0 HG3 PRO A 799 -7.452 -8.263 0.425 1.00 0.00 H new ATOM 0 HD2 PRO A 799 -7.637 -5.684 1.239 1.00 0.00 H new ATOM 0 HD3 PRO A 799 -6.090 -6.498 1.109 1.00 0.00 H new ATOM 1749 N GLU A 800 -7.677 -5.334 -3.982 1.00 0.00 N ATOM 1750 CA GLU A 800 -8.687 -4.944 -4.960 1.00 0.00 C ATOM 1751 C GLU A 800 -9.943 -5.756 -4.791 1.00 0.00 C ATOM 1752 O GLU A 800 -9.922 -6.988 -4.856 1.00 0.00 O ATOM 1753 CB GLU A 800 -8.141 -5.115 -6.350 1.00 0.00 C ATOM 1754 CG GLU A 800 -7.071 -4.122 -6.668 1.00 0.00 C ATOM 1755 CD GLU A 800 -6.240 -4.533 -7.831 1.00 0.00 C ATOM 1756 OE1 GLU A 800 -6.663 -4.336 -8.983 1.00 0.00 O ATOM 1757 OE2 GLU A 800 -5.154 -5.106 -7.612 1.00 0.00 O ATOM 0 H GLU A 800 -6.769 -5.540 -4.398 1.00 0.00 H new ATOM 0 HA GLU A 800 -8.939 -3.896 -4.798 1.00 0.00 H new ATOM 0 HB2 GLU A 800 -7.741 -6.123 -6.459 1.00 0.00 H new ATOM 0 HB3 GLU A 800 -8.952 -5.014 -7.071 1.00 0.00 H new ATOM 0 HG2 GLU A 800 -7.528 -3.154 -6.876 1.00 0.00 H new ATOM 0 HG3 GLU A 800 -6.430 -3.991 -5.796 1.00 0.00 H new ATOM 1764 N VAL A 801 -11.016 -5.068 -4.548 1.00 0.00 N ATOM 1765 CA VAL A 801 -12.231 -5.635 -4.293 1.00 0.00 C ATOM 1766 C VAL A 801 -12.882 -6.154 -5.581 1.00 0.00 C ATOM 1767 O VAL A 801 -12.904 -5.468 -6.617 1.00 0.00 O ATOM 1768 CB VAL A 801 -13.116 -4.589 -3.581 1.00 0.00 C ATOM 1769 CG1 VAL A 801 -12.409 -3.948 -2.407 1.00 0.00 C ATOM 1770 CG2 VAL A 801 -13.709 -3.547 -4.484 1.00 0.00 C ATOM 0 H VAL A 801 -11.030 -4.048 -4.530 1.00 0.00 H new ATOM 0 HA VAL A 801 -12.108 -6.502 -3.643 1.00 0.00 H new ATOM 0 HB VAL A 801 -13.961 -5.166 -3.205 1.00 0.00 H new ATOM 0 HG11 VAL A 801 -13.070 -3.220 -1.938 1.00 0.00 H new ATOM 0 HG12 VAL A 801 -12.141 -4.715 -1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 801 -11.506 -3.447 -2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 801 -14.314 -2.857 -3.896 1.00 0.00 H new ATOM 0 HG22 VAL A 801 -12.909 -2.997 -4.979 1.00 0.00 H new ATOM 0 HG23 VAL A 801 -14.335 -4.030 -5.234 1.00 0.00 H new