USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 837 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 739 SER OG : rot 70:sc= -1.84 USER MOD Set 1.2: A 782 THR OG1 : rot -179:sc= -2.4! USER MOD Set 2.1: A 748 GLN : amide:sc= -0.557 K(o=-0.9,f=-0.1) USER MOD Set 2.2: A 776 ASN : amide:sc= -0.345! K(o=-0.9!,f=-0.1) USER MOD Set 3.1: A 732 LYS NZ :NH3+ 151:sc= 1.26 (180deg=0) USER MOD Set 3.2: A 816 GLN : amide:sc= -1.95! C(o=-0.68!,f=-8.5!) USER MOD Single : A 720 LYS NZ :NH3+ 170:sc= -0.0132 (180deg=-0.136) USER MOD Single : A 722 SER OG : rot -16:sc= 0.237 USER MOD Single : A 724 SER OG : rot 180:sc= 0 USER MOD Single : A 726 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.05) USER MOD Single : A 728 HIS : no HD1:sc= -0.28 X(o=-0.28,f=-0.27) USER MOD Single : A 729 HIS : no HD1:sc= -0.0847 X(o=-0.085,f=-0.4) USER MOD Single : A 734 CYS SG : rot 180:sc= 0 USER MOD Single : A 738 HIS : no HD1:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : A 740 SER OG : rot 47:sc= 0.146 USER MOD Single : A 746 LYS NZ :NH3+ 161:sc= -0.0616 (180deg=-0.468) USER MOD Single : A 752 THR OG1 : rot 180:sc= 0 USER MOD Single : A 754 THR OG1 : rot 180:sc= 0 USER MOD Single : A 755 TYR OH : rot -37:sc= -0.613 USER MOD Single : A 760 THR OG1 : rot 18:sc= 0.865 USER MOD Single : A 762 SER OG : rot -98:sc= 0.478 USER MOD Single : A 763 SER OG : rot 180:sc= 0 USER MOD Single : A 764 LYS NZ :NH3+ -142:sc= -1.92! (180deg=-3.11!) USER MOD Single : A 766 LYS NZ :NH3+ 177:sc= 0.79 (180deg=0.727) USER MOD Single : A 767 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 THR OG1 : rot 180:sc= 0 USER MOD Single : A 778 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 786 THR OG1 : rot 180:sc=0.000376 USER MOD Single : A 787 THR OG1 : rot -15:sc= 0.637 USER MOD Single : A 791 TYR OH : rot 11:sc= 0.23 USER MOD Single : A 794 SER OG : rot 180:sc= 0.00575 USER MOD Single : A 797 SER OG : rot 5:sc= 1.2 USER MOD Single : A 799 LYS NZ :NH3+ 153:sc= -0.899 (180deg=-1.77!) USER MOD Single : A 801 SER OG : rot -40:sc= 0.149 USER MOD Single : A 802 THR OG1 : rot -83:sc= 1.97 USER MOD Single : A 804 CYS SG : rot 180:sc= 0 USER MOD Single : A 809 SER OG : rot 180:sc= 0 USER MOD Single : A 810 GLN : amide:sc= -1.43 X(o=-1.4,f=-1.8) USER MOD Single : A 814 LYS NZ :NH3+ -173:sc= 1.6 (180deg=1.41) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 718 -23.163 -0.132 -2.699 1.00 0.00 N ATOM 2 CA ARG A 718 -22.064 -0.521 -3.566 1.00 0.00 C ATOM 3 C ARG A 718 -21.301 0.698 -4.028 1.00 0.00 C ATOM 4 O ARG A 718 -21.884 1.704 -4.435 1.00 0.00 O ATOM 5 CB ARG A 718 -22.564 -1.314 -4.773 1.00 0.00 C ATOM 6 CG ARG A 718 -21.449 -1.961 -5.580 1.00 0.00 C ATOM 7 CD ARG A 718 -20.799 -3.103 -4.816 1.00 0.00 C ATOM 8 NE ARG A 718 -21.723 -4.223 -4.621 1.00 0.00 N ATOM 9 CZ ARG A 718 -21.771 -4.974 -3.521 1.00 0.00 C ATOM 10 NH1 ARG A 718 -20.981 -4.707 -2.492 1.00 0.00 N ATOM 11 NH2 ARG A 718 -22.623 -5.988 -3.447 1.00 0.00 N ATOM 0 HA ARG A 718 -21.397 -1.162 -2.990 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -23.249 -2.089 -4.430 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -23.134 -0.650 -5.423 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -21.850 -2.334 -6.522 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -20.696 -1.213 -5.828 1.00 0.00 H new ATOM 0 HD2 ARG A 718 -19.919 -3.448 -5.358 1.00 0.00 H new ATOM 0 HD3 ARG A 718 -20.455 -2.742 -3.847 1.00 0.00 H new ATOM 0 HE ARG A 718 -22.372 -4.442 -5.377 1.00 0.00 H new ATOM 0 HH11 ARG A 718 -20.331 -3.923 -2.538 1.00 0.00 H new ATOM 0 HH12 ARG A 718 -21.023 -5.286 -1.653 1.00 0.00 H new ATOM 0 HH21 ARG A 718 -23.241 -6.193 -4.232 1.00 0.00 H new ATOM 0 HH22 ARG A 718 -22.660 -6.563 -2.605 1.00 0.00 H new ATOM 25 N VAL A 719 -19.997 0.588 -3.962 1.00 0.00 N ATOM 26 CA VAL A 719 -19.111 1.659 -4.332 1.00 0.00 C ATOM 27 C VAL A 719 -17.894 1.043 -5.002 1.00 0.00 C ATOM 28 O VAL A 719 -17.843 -0.171 -5.206 1.00 0.00 O ATOM 29 CB VAL A 719 -18.708 2.489 -3.080 1.00 0.00 C ATOM 30 CG1 VAL A 719 -17.667 1.762 -2.238 1.00 0.00 C ATOM 31 CG2 VAL A 719 -18.230 3.890 -3.452 1.00 0.00 C ATOM 0 H VAL A 719 -19.519 -0.256 -3.647 1.00 0.00 H new ATOM 0 HA VAL A 719 -19.604 2.344 -5.022 1.00 0.00 H new ATOM 0 HB VAL A 719 -19.607 2.602 -2.475 1.00 0.00 H new ATOM 0 HG11 VAL A 719 -17.409 2.372 -1.372 1.00 0.00 H new ATOM 0 HG12 VAL A 719 -18.073 0.808 -1.902 1.00 0.00 H new ATOM 0 HG13 VAL A 719 -16.773 1.586 -2.837 1.00 0.00 H new ATOM 0 HG21 VAL A 719 -17.959 4.434 -2.547 1.00 0.00 H new ATOM 0 HG22 VAL A 719 -17.361 3.816 -4.105 1.00 0.00 H new ATOM 0 HG23 VAL A 719 -19.029 4.421 -3.970 1.00 0.00 H new ATOM 41 N LYS A 720 -16.941 1.870 -5.346 1.00 0.00 N ATOM 42 CA LYS A 720 -15.702 1.422 -5.954 1.00 0.00 C ATOM 43 C LYS A 720 -14.561 1.608 -4.968 1.00 0.00 C ATOM 44 O LYS A 720 -13.875 2.631 -4.972 1.00 0.00 O ATOM 45 CB LYS A 720 -15.424 2.189 -7.242 1.00 0.00 C ATOM 46 CG LYS A 720 -16.507 2.024 -8.297 1.00 0.00 C ATOM 47 CD LYS A 720 -16.198 2.822 -9.552 1.00 0.00 C ATOM 48 CE LYS A 720 -14.886 2.390 -10.187 1.00 0.00 C ATOM 49 NZ LYS A 720 -14.900 0.957 -10.585 1.00 0.00 N ATOM 0 H LYS A 720 -16.997 2.880 -5.214 1.00 0.00 H new ATOM 0 HA LYS A 720 -15.792 0.365 -6.206 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -15.316 3.248 -7.008 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -14.472 1.855 -7.655 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -16.608 0.969 -8.553 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -17.465 2.346 -7.888 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -17.008 2.697 -10.271 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -16.151 3.883 -9.306 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -14.688 3.007 -11.064 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -14.070 2.562 -9.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -14.060 0.749 -11.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -14.892 0.360 -9.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -15.758 0.759 -11.139 1.00 0.00 H new ATOM 63 N PRO A 721 -14.360 0.619 -4.096 1.00 0.00 N ATOM 64 CA PRO A 721 -13.399 0.702 -3.012 1.00 0.00 C ATOM 65 C PRO A 721 -12.021 0.238 -3.435 1.00 0.00 C ATOM 66 O PRO A 721 -11.884 -0.754 -4.151 1.00 0.00 O ATOM 67 CB PRO A 721 -13.992 -0.229 -1.965 1.00 0.00 C ATOM 68 CG PRO A 721 -14.855 -1.205 -2.718 1.00 0.00 C ATOM 69 CD PRO A 721 -15.032 -0.687 -4.120 1.00 0.00 C ATOM 0 HA PRO A 721 -13.250 1.722 -2.658 1.00 0.00 H new ATOM 0 HB2 PRO A 721 -13.207 -0.747 -1.414 1.00 0.00 H new ATOM 0 HB3 PRO A 721 -14.579 0.328 -1.235 1.00 0.00 H new ATOM 0 HG2 PRO A 721 -14.391 -2.191 -2.732 1.00 0.00 H new ATOM 0 HG3 PRO A 721 -15.822 -1.315 -2.228 1.00 0.00 H new ATOM 0 HD2 PRO A 721 -14.582 -1.356 -4.854 1.00 0.00 H new ATOM 0 HD3 PRO A 721 -16.086 -0.590 -4.381 1.00 0.00 H new ATOM 77 N SER A 722 -11.002 0.935 -2.956 1.00 0.00 N ATOM 78 CA SER A 722 -9.638 0.744 -3.438 1.00 0.00 C ATOM 79 C SER A 722 -8.683 1.594 -2.607 1.00 0.00 C ATOM 80 O SER A 722 -8.944 1.866 -1.443 1.00 0.00 O ATOM 81 CB SER A 722 -9.512 1.164 -4.922 1.00 0.00 C ATOM 82 OG SER A 722 -10.430 0.498 -5.771 1.00 0.00 O ATOM 0 H SER A 722 -11.093 1.644 -2.228 1.00 0.00 H new ATOM 0 HA SER A 722 -9.388 -0.313 -3.346 1.00 0.00 H new ATOM 0 HB2 SER A 722 -9.667 2.240 -5.003 1.00 0.00 H new ATOM 0 HB3 SER A 722 -8.497 0.962 -5.265 1.00 0.00 H new ATOM 0 HG SER A 722 -10.797 -0.283 -5.307 1.00 0.00 H new ATOM 88 N ALA A 723 -7.574 2.007 -3.213 1.00 0.00 N ATOM 89 CA ALA A 723 -6.649 2.920 -2.582 1.00 0.00 C ATOM 90 C ALA A 723 -6.016 3.819 -3.632 1.00 0.00 C ATOM 91 O ALA A 723 -5.838 3.404 -4.772 1.00 0.00 O ATOM 92 CB ALA A 723 -5.578 2.152 -1.832 1.00 0.00 C ATOM 0 H ALA A 723 -7.299 1.715 -4.151 1.00 0.00 H new ATOM 0 HA ALA A 723 -7.194 3.538 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -4.889 2.854 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -6.044 1.533 -1.066 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -5.030 1.517 -2.528 1.00 0.00 H new ATOM 98 N SER A 724 -5.679 5.039 -3.251 1.00 0.00 N ATOM 99 CA SER A 724 -5.056 5.970 -4.170 1.00 0.00 C ATOM 100 C SER A 724 -3.847 6.574 -3.484 1.00 0.00 C ATOM 101 O SER A 724 -3.971 7.494 -2.674 1.00 0.00 O ATOM 102 CB SER A 724 -6.051 7.062 -4.581 1.00 0.00 C ATOM 103 OG SER A 724 -5.506 7.919 -5.572 1.00 0.00 O ATOM 0 H SER A 724 -5.827 5.406 -2.311 1.00 0.00 H new ATOM 0 HA SER A 724 -4.745 5.452 -5.077 1.00 0.00 H new ATOM 0 HB2 SER A 724 -6.963 6.600 -4.960 1.00 0.00 H new ATOM 0 HB3 SER A 724 -6.331 7.648 -3.706 1.00 0.00 H new ATOM 0 HG SER A 724 -6.166 8.602 -5.812 1.00 0.00 H new ATOM 109 N LEU A 725 -2.680 6.034 -3.784 1.00 0.00 N ATOM 110 CA LEU A 725 -1.488 6.389 -3.060 1.00 0.00 C ATOM 111 C LEU A 725 -1.107 7.837 -3.316 1.00 0.00 C ATOM 112 O LEU A 725 -1.256 8.354 -4.423 1.00 0.00 O ATOM 113 CB LEU A 725 -0.336 5.474 -3.443 1.00 0.00 C ATOM 114 CG LEU A 725 -0.683 4.007 -3.735 1.00 0.00 C ATOM 115 CD1 LEU A 725 0.565 3.184 -3.661 1.00 0.00 C ATOM 116 CD2 LEU A 725 -1.718 3.444 -2.780 1.00 0.00 C ATOM 0 H LEU A 725 -2.539 5.348 -4.526 1.00 0.00 H new ATOM 0 HA LEU A 725 -1.696 6.268 -1.997 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.149 5.890 -4.326 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.397 5.495 -2.637 1.00 0.00 H new ATOM 0 HG LEU A 725 -1.117 3.968 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 725 0.326 2.141 -3.867 1.00 0.00 H new ATOM 0 HD12 LEU A 725 1.283 3.544 -4.398 1.00 0.00 H new ATOM 0 HD13 LEU A 725 0.997 3.267 -2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -1.922 2.404 -3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -1.339 3.498 -1.759 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -2.638 4.024 -2.857 1.00 0.00 H new ATOM 128 N LYS A 726 -0.602 8.468 -2.278 1.00 0.00 N ATOM 129 CA LYS A 726 -0.290 9.887 -2.308 1.00 0.00 C ATOM 130 C LYS A 726 1.164 10.118 -2.669 1.00 0.00 C ATOM 131 O LYS A 726 1.547 11.218 -3.067 1.00 0.00 O ATOM 132 CB LYS A 726 -0.569 10.508 -0.953 1.00 0.00 C ATOM 133 CG LYS A 726 -1.992 10.283 -0.467 1.00 0.00 C ATOM 134 CD LYS A 726 -2.370 11.228 0.662 1.00 0.00 C ATOM 135 CE LYS A 726 -2.666 12.620 0.134 1.00 0.00 C ATOM 136 NZ LYS A 726 -2.937 13.587 1.230 1.00 0.00 N ATOM 0 H LYS A 726 -0.395 8.015 -1.388 1.00 0.00 H new ATOM 0 HA LYS A 726 -0.919 10.352 -3.067 1.00 0.00 H new ATOM 0 HB2 LYS A 726 0.126 10.095 -0.222 1.00 0.00 H new ATOM 0 HB3 LYS A 726 -0.376 11.580 -1.006 1.00 0.00 H new ATOM 0 HG2 LYS A 726 -2.684 10.418 -1.299 1.00 0.00 H new ATOM 0 HG3 LYS A 726 -2.099 9.253 -0.127 1.00 0.00 H new ATOM 0 HD2 LYS A 726 -3.244 10.841 1.187 1.00 0.00 H new ATOM 0 HD3 LYS A 726 -1.558 11.276 1.387 1.00 0.00 H new ATOM 0 HE2 LYS A 726 -1.820 12.971 -0.457 1.00 0.00 H new ATOM 0 HE3 LYS A 726 -3.527 12.579 -0.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 726 -3.017 14.546 0.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 726 -3.827 13.333 1.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 726 -2.157 13.560 1.918 1.00 0.00 H new ATOM 150 N LEU A 727 1.973 9.083 -2.497 1.00 0.00 N ATOM 151 CA LEU A 727 3.385 9.154 -2.824 1.00 0.00 C ATOM 152 C LEU A 727 3.564 9.556 -4.287 1.00 0.00 C ATOM 153 O LEU A 727 2.963 8.950 -5.178 1.00 0.00 O ATOM 154 CB LEU A 727 4.041 7.801 -2.587 1.00 0.00 C ATOM 155 CG LEU A 727 5.538 7.736 -2.908 1.00 0.00 C ATOM 156 CD1 LEU A 727 6.283 8.869 -2.218 1.00 0.00 C ATOM 157 CD2 LEU A 727 6.121 6.396 -2.492 1.00 0.00 C ATOM 0 H LEU A 727 1.671 8.180 -2.131 1.00 0.00 H new ATOM 0 HA LEU A 727 3.856 9.901 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 727 3.897 7.524 -1.543 1.00 0.00 H new ATOM 0 HB3 LEU A 727 3.524 7.054 -3.189 1.00 0.00 H new ATOM 0 HG LEU A 727 5.657 7.845 -3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 727 7.344 8.806 -2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 727 5.890 9.826 -2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 727 6.150 8.788 -1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 727 7.185 6.372 -2.729 1.00 0.00 H new ATOM 0 HD22 LEU A 727 5.985 6.257 -1.419 1.00 0.00 H new ATOM 0 HD23 LEU A 727 5.612 5.595 -3.028 1.00 0.00 H new ATOM 169 N HIS A 728 4.391 10.557 -4.541 1.00 0.00 N ATOM 170 CA HIS A 728 4.519 11.094 -5.886 1.00 0.00 C ATOM 171 C HIS A 728 5.939 10.922 -6.439 1.00 0.00 C ATOM 172 O HIS A 728 6.308 11.558 -7.422 1.00 0.00 O ATOM 173 CB HIS A 728 4.108 12.574 -5.884 1.00 0.00 C ATOM 174 CG HIS A 728 3.898 13.160 -7.247 1.00 0.00 C ATOM 175 ND1 HIS A 728 4.243 14.455 -7.569 1.00 0.00 N ATOM 176 CD2 HIS A 728 3.363 12.627 -8.371 1.00 0.00 C ATOM 177 CE1 HIS A 728 3.932 14.691 -8.826 1.00 0.00 C ATOM 178 NE2 HIS A 728 3.398 13.600 -9.335 1.00 0.00 N ATOM 0 H HIS A 728 4.978 11.011 -3.841 1.00 0.00 H new ATOM 0 HA HIS A 728 3.855 10.533 -6.544 1.00 0.00 H new ATOM 0 HB2 HIS A 728 3.188 12.682 -5.310 1.00 0.00 H new ATOM 0 HB3 HIS A 728 4.876 13.151 -5.368 1.00 0.00 H new ATOM 0 HD2 HIS A 728 2.981 11.624 -8.486 1.00 0.00 H new ATOM 0 HE1 HIS A 728 4.088 15.622 -9.351 1.00 0.00 H new ATOM 0 HE2 HIS A 728 3.064 13.496 -10.293 1.00 0.00 H new ATOM 187 N HIS A 729 6.731 10.055 -5.815 1.00 0.00 N ATOM 188 CA HIS A 729 8.089 9.781 -6.292 1.00 0.00 C ATOM 189 C HIS A 729 8.688 8.586 -5.566 1.00 0.00 C ATOM 190 O HIS A 729 8.030 7.977 -4.727 1.00 0.00 O ATOM 191 CB HIS A 729 9.011 11.002 -6.124 1.00 0.00 C ATOM 192 CG HIS A 729 9.130 11.487 -4.715 1.00 0.00 C ATOM 193 ND1 HIS A 729 10.268 11.347 -3.952 1.00 0.00 N ATOM 194 CD2 HIS A 729 8.232 12.120 -3.937 1.00 0.00 C ATOM 195 CE1 HIS A 729 10.062 11.878 -2.761 1.00 0.00 C ATOM 196 NE2 HIS A 729 8.832 12.354 -2.726 1.00 0.00 N ATOM 0 H HIS A 729 6.461 9.531 -4.982 1.00 0.00 H new ATOM 0 HA HIS A 729 8.012 9.554 -7.355 1.00 0.00 H new ATOM 0 HB2 HIS A 729 10.004 10.748 -6.495 1.00 0.00 H new ATOM 0 HB3 HIS A 729 8.637 11.815 -6.746 1.00 0.00 H new ATOM 0 HD2 HIS A 729 7.225 12.393 -4.215 1.00 0.00 H new ATOM 0 HE1 HIS A 729 10.778 11.916 -1.953 1.00 0.00 H new ATOM 0 HE2 HIS A 729 8.398 12.820 -1.929 1.00 0.00 H new ATOM 205 N ASP A 730 9.928 8.259 -5.899 1.00 0.00 N ATOM 206 CA ASP A 730 10.663 7.204 -5.210 1.00 0.00 C ATOM 207 C ASP A 730 10.856 7.552 -3.747 1.00 0.00 C ATOM 208 O ASP A 730 11.255 8.666 -3.404 1.00 0.00 O ATOM 209 CB ASP A 730 12.030 6.977 -5.850 1.00 0.00 C ATOM 210 CG ASP A 730 11.983 6.116 -7.093 1.00 0.00 C ATOM 211 OD1 ASP A 730 11.260 6.472 -8.047 1.00 0.00 O ATOM 212 OD2 ASP A 730 12.697 5.089 -7.131 1.00 0.00 O ATOM 0 H ASP A 730 10.451 8.712 -6.648 1.00 0.00 H new ATOM 0 HA ASP A 730 10.074 6.291 -5.293 1.00 0.00 H new ATOM 0 HB2 ASP A 730 12.468 7.943 -6.104 1.00 0.00 H new ATOM 0 HB3 ASP A 730 12.690 6.510 -5.120 1.00 0.00 H new ATOM 217 N LEU A 731 10.563 6.597 -2.891 1.00 0.00 N ATOM 218 CA LEU A 731 10.743 6.768 -1.468 1.00 0.00 C ATOM 219 C LEU A 731 12.128 6.288 -1.055 1.00 0.00 C ATOM 220 O LEU A 731 12.371 5.089 -0.940 1.00 0.00 O ATOM 221 CB LEU A 731 9.662 6.002 -0.722 1.00 0.00 C ATOM 222 CG LEU A 731 9.709 6.146 0.782 1.00 0.00 C ATOM 223 CD1 LEU A 731 9.607 7.606 1.193 1.00 0.00 C ATOM 224 CD2 LEU A 731 8.609 5.335 1.425 1.00 0.00 C ATOM 0 H LEU A 731 10.195 5.685 -3.161 1.00 0.00 H new ATOM 0 HA LEU A 731 10.660 7.825 -1.216 1.00 0.00 H new ATOM 0 HB2 LEU A 731 8.687 6.339 -1.075 1.00 0.00 H new ATOM 0 HB3 LEU A 731 9.745 4.945 -0.975 1.00 0.00 H new ATOM 0 HG LEU A 731 10.669 5.765 1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 731 9.643 7.681 2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 731 10.438 8.164 0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 731 8.666 8.021 0.832 1.00 0.00 H new ATOM 0 HD21 LEU A 731 8.658 5.450 2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 731 7.641 5.685 1.066 1.00 0.00 H new ATOM 0 HD23 LEU A 731 8.733 4.284 1.166 1.00 0.00 H new ATOM 236 N LYS A 732 13.033 7.232 -0.842 1.00 0.00 N ATOM 237 CA LYS A 732 14.425 6.907 -0.563 1.00 0.00 C ATOM 238 C LYS A 732 14.617 6.446 0.877 1.00 0.00 C ATOM 239 O LYS A 732 14.279 7.160 1.824 1.00 0.00 O ATOM 240 CB LYS A 732 15.313 8.115 -0.850 1.00 0.00 C ATOM 241 CG LYS A 732 15.192 8.633 -2.275 1.00 0.00 C ATOM 242 CD LYS A 732 15.725 7.640 -3.300 1.00 0.00 C ATOM 243 CE LYS A 732 17.233 7.476 -3.197 1.00 0.00 C ATOM 244 NZ LYS A 732 17.780 6.652 -4.307 1.00 0.00 N ATOM 0 H LYS A 732 12.828 8.231 -0.857 1.00 0.00 H new ATOM 0 HA LYS A 732 14.712 6.083 -1.217 1.00 0.00 H new ATOM 0 HB2 LYS A 732 15.057 8.917 -0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 732 16.352 7.847 -0.657 1.00 0.00 H new ATOM 0 HG2 LYS A 732 14.146 8.850 -2.493 1.00 0.00 H new ATOM 0 HG3 LYS A 732 15.738 9.572 -2.365 1.00 0.00 H new ATOM 0 HD2 LYS A 732 15.244 6.673 -3.154 1.00 0.00 H new ATOM 0 HD3 LYS A 732 15.464 7.978 -4.303 1.00 0.00 H new ATOM 0 HE2 LYS A 732 17.706 8.458 -3.207 1.00 0.00 H new ATOM 0 HE3 LYS A 732 17.483 7.011 -2.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 732 18.758 6.944 -4.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 732 17.767 5.649 -4.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 732 17.198 6.786 -5.158 1.00 0.00 H new ATOM 258 N LEU A 733 15.153 5.243 1.025 1.00 0.00 N ATOM 259 CA LEU A 733 15.442 4.660 2.332 1.00 0.00 C ATOM 260 C LEU A 733 16.926 4.340 2.463 1.00 0.00 C ATOM 261 O LEU A 733 17.662 4.299 1.471 1.00 0.00 O ATOM 262 CB LEU A 733 14.650 3.365 2.536 1.00 0.00 C ATOM 263 CG LEU A 733 13.322 3.474 3.284 1.00 0.00 C ATOM 264 CD1 LEU A 733 12.347 4.336 2.535 1.00 0.00 C ATOM 265 CD2 LEU A 733 12.750 2.091 3.536 1.00 0.00 C ATOM 0 H LEU A 733 15.401 4.640 0.241 1.00 0.00 H new ATOM 0 HA LEU A 733 15.153 5.392 3.086 1.00 0.00 H new ATOM 0 HB2 LEU A 733 14.452 2.931 1.556 1.00 0.00 H new ATOM 0 HB3 LEU A 733 15.285 2.661 3.074 1.00 0.00 H new ATOM 0 HG LEU A 733 13.506 3.952 4.246 1.00 0.00 H new ATOM 0 HD11 LEU A 733 11.412 4.395 3.091 1.00 0.00 H new ATOM 0 HD12 LEU A 733 12.762 5.337 2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 733 12.158 3.903 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 733 11.804 2.180 4.070 1.00 0.00 H new ATOM 0 HD22 LEU A 733 12.584 1.587 2.584 1.00 0.00 H new ATOM 0 HD23 LEU A 733 13.451 1.511 4.136 1.00 0.00 H new ATOM 277 N CYS A 734 17.349 4.119 3.693 1.00 0.00 N ATOM 278 CA CYS A 734 18.696 3.656 3.990 1.00 0.00 C ATOM 279 C CYS A 734 18.618 2.277 4.639 1.00 0.00 C ATOM 280 O CYS A 734 17.531 1.720 4.789 1.00 0.00 O ATOM 281 CB CYS A 734 19.411 4.648 4.908 1.00 0.00 C ATOM 282 SG CYS A 734 19.518 6.322 4.234 1.00 0.00 S ATOM 0 H CYS A 734 16.767 4.255 4.520 1.00 0.00 H new ATOM 0 HA CYS A 734 19.269 3.585 3.066 1.00 0.00 H new ATOM 0 HB2 CYS A 734 18.889 4.684 5.864 1.00 0.00 H new ATOM 0 HB3 CYS A 734 20.418 4.282 5.108 1.00 0.00 H new ATOM 0 HG CYS A 734 20.136 7.092 5.080 1.00 0.00 H new ATOM 288 N LEU A 735 19.758 1.722 5.007 1.00 0.00 N ATOM 289 CA LEU A 735 19.799 0.377 5.557 1.00 0.00 C ATOM 290 C LEU A 735 19.039 0.296 6.870 1.00 0.00 C ATOM 291 O LEU A 735 19.323 1.036 7.811 1.00 0.00 O ATOM 292 CB LEU A 735 21.230 -0.066 5.769 1.00 0.00 C ATOM 293 CG LEU A 735 21.411 -1.516 6.201 1.00 0.00 C ATOM 294 CD1 LEU A 735 20.732 -2.424 5.205 1.00 0.00 C ATOM 295 CD2 LEU A 735 22.884 -1.859 6.310 1.00 0.00 C ATOM 0 H LEU A 735 20.667 2.179 4.936 1.00 0.00 H new ATOM 0 HA LEU A 735 19.320 -0.288 4.838 1.00 0.00 H new ATOM 0 HB2 LEU A 735 21.781 0.090 4.842 1.00 0.00 H new ATOM 0 HB3 LEU A 735 21.684 0.578 6.522 1.00 0.00 H new ATOM 0 HG LEU A 735 20.958 -1.655 7.182 1.00 0.00 H new ATOM 0 HD11 LEU A 735 20.860 -3.462 5.512 1.00 0.00 H new ATOM 0 HD12 LEU A 735 19.669 -2.187 5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 735 21.176 -2.280 4.220 1.00 0.00 H new ATOM 0 HD21 LEU A 735 22.994 -2.898 6.620 1.00 0.00 H new ATOM 0 HD22 LEU A 735 23.363 -1.716 5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 735 23.355 -1.209 7.047 1.00 0.00 H new ATOM 307 N GLY A 736 18.061 -0.591 6.918 1.00 0.00 N ATOM 308 CA GLY A 736 17.297 -0.776 8.135 1.00 0.00 C ATOM 309 C GLY A 736 16.193 0.251 8.285 1.00 0.00 C ATOM 310 O GLY A 736 15.553 0.343 9.336 1.00 0.00 O ATOM 0 H GLY A 736 17.781 -1.187 6.139 1.00 0.00 H new ATOM 0 HA2 GLY A 736 16.863 -1.776 8.140 1.00 0.00 H new ATOM 0 HA3 GLY A 736 17.966 -0.715 8.994 1.00 0.00 H new ATOM 314 N ASP A 737 15.989 1.041 7.242 1.00 0.00 N ATOM 315 CA ASP A 737 14.903 2.016 7.221 1.00 0.00 C ATOM 316 C ASP A 737 13.553 1.325 7.069 1.00 0.00 C ATOM 317 O ASP A 737 13.465 0.219 6.534 1.00 0.00 O ATOM 318 CB ASP A 737 15.087 3.008 6.069 1.00 0.00 C ATOM 319 CG ASP A 737 15.321 4.425 6.541 1.00 0.00 C ATOM 320 OD1 ASP A 737 14.352 5.081 6.975 1.00 0.00 O ATOM 321 OD2 ASP A 737 16.472 4.900 6.468 1.00 0.00 O ATOM 0 H ASP A 737 16.560 1.028 6.397 1.00 0.00 H new ATOM 0 HA ASP A 737 14.927 2.552 8.170 1.00 0.00 H new ATOM 0 HB2 ASP A 737 15.930 2.691 5.455 1.00 0.00 H new ATOM 0 HB3 ASP A 737 14.203 2.984 5.432 1.00 0.00 H new ATOM 326 N HIS A 738 12.508 1.975 7.552 1.00 0.00 N ATOM 327 CA HIS A 738 11.152 1.523 7.313 1.00 0.00 C ATOM 328 C HIS A 738 10.476 2.550 6.431 1.00 0.00 C ATOM 329 O HIS A 738 10.788 3.739 6.511 1.00 0.00 O ATOM 330 CB HIS A 738 10.371 1.326 8.625 1.00 0.00 C ATOM 331 CG HIS A 738 10.035 2.587 9.368 1.00 0.00 C ATOM 332 ND1 HIS A 738 10.839 3.116 10.354 1.00 0.00 N ATOM 333 CD2 HIS A 738 8.961 3.414 9.279 1.00 0.00 C ATOM 334 CE1 HIS A 738 10.279 4.208 10.838 1.00 0.00 C ATOM 335 NE2 HIS A 738 9.141 4.411 10.203 1.00 0.00 N ATOM 0 H HIS A 738 12.576 2.823 8.115 1.00 0.00 H new ATOM 0 HA HIS A 738 11.173 0.550 6.823 1.00 0.00 H new ATOM 0 HB2 HIS A 738 9.444 0.798 8.401 1.00 0.00 H new ATOM 0 HB3 HIS A 738 10.954 0.681 9.282 1.00 0.00 H new ATOM 0 HD2 HIS A 738 8.123 3.306 8.607 1.00 0.00 H new ATOM 0 HE1 HIS A 738 10.684 4.831 11.622 1.00 0.00 H new ATOM 0 HE2 HIS A 738 8.498 5.185 10.372 1.00 0.00 H new ATOM 344 N SER A 739 9.562 2.112 5.600 1.00 0.00 N ATOM 345 CA SER A 739 8.994 3.006 4.613 1.00 0.00 C ATOM 346 C SER A 739 7.701 3.620 5.118 1.00 0.00 C ATOM 347 O SER A 739 7.048 3.090 6.016 1.00 0.00 O ATOM 348 CB SER A 739 8.758 2.282 3.291 1.00 0.00 C ATOM 349 OG SER A 739 9.867 1.483 2.937 1.00 0.00 O ATOM 0 H SER A 739 9.198 1.159 5.584 1.00 0.00 H new ATOM 0 HA SER A 739 9.711 3.809 4.440 1.00 0.00 H new ATOM 0 HB2 SER A 739 7.868 1.658 3.370 1.00 0.00 H new ATOM 0 HB3 SER A 739 8.567 3.011 2.504 1.00 0.00 H new ATOM 0 HG SER A 739 9.928 0.719 3.548 1.00 0.00 H new ATOM 355 N SER A 740 7.354 4.742 4.530 1.00 0.00 N ATOM 356 CA SER A 740 6.175 5.485 4.897 1.00 0.00 C ATOM 357 C SER A 740 5.566 6.106 3.649 1.00 0.00 C ATOM 358 O SER A 740 6.050 7.118 3.138 1.00 0.00 O ATOM 359 CB SER A 740 6.517 6.554 5.942 1.00 0.00 C ATOM 360 OG SER A 740 7.668 7.301 5.567 1.00 0.00 O ATOM 0 H SER A 740 7.891 5.168 3.774 1.00 0.00 H new ATOM 0 HA SER A 740 5.444 4.812 5.346 1.00 0.00 H new ATOM 0 HB2 SER A 740 5.669 7.228 6.065 1.00 0.00 H new ATOM 0 HB3 SER A 740 6.689 6.078 6.907 1.00 0.00 H new ATOM 0 HG SER A 740 7.592 7.570 4.628 1.00 0.00 H new ATOM 366 N VAL A 741 4.527 5.478 3.147 1.00 0.00 N ATOM 367 CA VAL A 741 3.846 5.952 1.965 1.00 0.00 C ATOM 368 C VAL A 741 2.421 6.307 2.314 1.00 0.00 C ATOM 369 O VAL A 741 1.648 5.462 2.760 1.00 0.00 O ATOM 370 CB VAL A 741 3.869 4.918 0.816 1.00 0.00 C ATOM 371 CG1 VAL A 741 3.757 3.502 1.351 1.00 0.00 C ATOM 372 CG2 VAL A 741 2.750 5.194 -0.178 1.00 0.00 C ATOM 0 H VAL A 741 4.132 4.627 3.546 1.00 0.00 H new ATOM 0 HA VAL A 741 4.377 6.835 1.610 1.00 0.00 H new ATOM 0 HB VAL A 741 4.825 5.014 0.302 1.00 0.00 H new ATOM 0 HG11 VAL A 741 3.776 2.797 0.520 1.00 0.00 H new ATOM 0 HG12 VAL A 741 4.594 3.298 2.019 1.00 0.00 H new ATOM 0 HG13 VAL A 741 2.821 3.393 1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 741 2.784 4.455 -0.979 1.00 0.00 H new ATOM 0 HG22 VAL A 741 1.788 5.133 0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 741 2.875 6.191 -0.599 1.00 0.00 H new ATOM 382 N PRO A 742 2.049 7.564 2.126 1.00 0.00 N ATOM 383 CA PRO A 742 0.721 8.012 2.435 1.00 0.00 C ATOM 384 C PRO A 742 -0.235 7.656 1.319 1.00 0.00 C ATOM 385 O PRO A 742 0.089 7.808 0.146 1.00 0.00 O ATOM 386 CB PRO A 742 0.867 9.523 2.609 1.00 0.00 C ATOM 387 CG PRO A 742 2.239 9.882 2.108 1.00 0.00 C ATOM 388 CD PRO A 742 2.870 8.635 1.559 1.00 0.00 C ATOM 0 HA PRO A 742 0.308 7.543 3.328 1.00 0.00 H new ATOM 0 HB2 PRO A 742 0.098 10.054 2.048 1.00 0.00 H new ATOM 0 HB3 PRO A 742 0.750 9.806 3.655 1.00 0.00 H new ATOM 0 HG2 PRO A 742 2.175 10.649 1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 742 2.845 10.293 2.916 1.00 0.00 H new ATOM 0 HD2 PRO A 742 2.852 8.621 0.469 1.00 0.00 H new ATOM 0 HD3 PRO A 742 3.913 8.545 1.862 1.00 0.00 H new ATOM 396 N VAL A 743 -1.386 7.123 1.680 1.00 0.00 N ATOM 397 CA VAL A 743 -2.368 6.712 0.697 1.00 0.00 C ATOM 398 C VAL A 743 -3.762 7.206 1.047 1.00 0.00 C ATOM 399 O VAL A 743 -4.312 6.876 2.093 1.00 0.00 O ATOM 400 CB VAL A 743 -2.420 5.191 0.554 1.00 0.00 C ATOM 401 CG1 VAL A 743 -3.410 4.824 -0.522 1.00 0.00 C ATOM 402 CG2 VAL A 743 -1.041 4.604 0.278 1.00 0.00 C ATOM 0 H VAL A 743 -1.664 6.964 2.649 1.00 0.00 H new ATOM 0 HA VAL A 743 -2.052 7.159 -0.246 1.00 0.00 H new ATOM 0 HB VAL A 743 -2.752 4.759 1.498 1.00 0.00 H new ATOM 0 HG11 VAL A 743 -3.449 3.740 -0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 743 -4.397 5.198 -0.251 1.00 0.00 H new ATOM 0 HG13 VAL A 743 -3.101 5.268 -1.468 1.00 0.00 H new ATOM 0 HG21 VAL A 743 -1.119 3.521 0.183 1.00 0.00 H new ATOM 0 HG22 VAL A 743 -0.646 5.022 -0.648 1.00 0.00 H new ATOM 0 HG23 VAL A 743 -0.370 4.848 1.102 1.00 0.00 H new ATOM 412 N ALA A 744 -4.322 8.000 0.159 1.00 0.00 N ATOM 413 CA ALA A 744 -5.710 8.395 0.256 1.00 0.00 C ATOM 414 C ALA A 744 -6.571 7.285 -0.314 1.00 0.00 C ATOM 415 O ALA A 744 -6.779 7.173 -1.520 1.00 0.00 O ATOM 416 CB ALA A 744 -5.949 9.720 -0.437 1.00 0.00 C ATOM 0 H ALA A 744 -3.830 8.388 -0.646 1.00 0.00 H new ATOM 0 HA ALA A 744 -5.981 8.546 1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 744 -7.001 9.992 -0.348 1.00 0.00 H new ATOM 0 HB2 ALA A 744 -5.334 10.490 0.029 1.00 0.00 H new ATOM 0 HB3 ALA A 744 -5.684 9.632 -1.491 1.00 0.00 H new ATOM 422 N LEU A 745 -7.034 6.450 0.588 1.00 0.00 N ATOM 423 CA LEU A 745 -7.675 5.200 0.244 1.00 0.00 C ATOM 424 C LEU A 745 -9.110 5.420 -0.216 1.00 0.00 C ATOM 425 O LEU A 745 -9.719 6.449 0.078 1.00 0.00 O ATOM 426 CB LEU A 745 -7.629 4.299 1.471 1.00 0.00 C ATOM 427 CG LEU A 745 -6.267 4.273 2.173 1.00 0.00 C ATOM 428 CD1 LEU A 745 -6.443 4.104 3.662 1.00 0.00 C ATOM 429 CD2 LEU A 745 -5.383 3.169 1.626 1.00 0.00 C ATOM 0 H LEU A 745 -6.976 6.621 1.592 1.00 0.00 H new ATOM 0 HA LEU A 745 -7.149 4.732 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 745 -8.386 4.630 2.181 1.00 0.00 H new ATOM 0 HB3 LEU A 745 -7.893 3.284 1.174 1.00 0.00 H new ATOM 0 HG LEU A 745 -5.777 5.227 1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 745 -5.466 4.088 4.144 1.00 0.00 H new ATOM 0 HD12 LEU A 745 -7.028 4.935 4.056 1.00 0.00 H new ATOM 0 HD13 LEU A 745 -6.962 3.167 3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 745 -4.425 3.179 2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 745 -5.869 2.205 1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 745 -5.219 3.328 0.560 1.00 0.00 H new ATOM 441 N LYS A 746 -9.647 4.446 -0.930 1.00 0.00 N ATOM 442 CA LYS A 746 -10.991 4.545 -1.461 1.00 0.00 C ATOM 443 C LYS A 746 -11.912 3.563 -0.768 1.00 0.00 C ATOM 444 O LYS A 746 -11.463 2.617 -0.125 1.00 0.00 O ATOM 445 CB LYS A 746 -11.012 4.281 -2.949 1.00 0.00 C ATOM 446 CG LYS A 746 -11.880 5.258 -3.716 1.00 0.00 C ATOM 447 CD LYS A 746 -11.282 6.652 -3.680 1.00 0.00 C ATOM 448 CE LYS A 746 -12.233 7.694 -4.241 1.00 0.00 C ATOM 449 NZ LYS A 746 -13.509 7.761 -3.482 1.00 0.00 N ATOM 0 H LYS A 746 -9.168 3.574 -1.155 1.00 0.00 H new ATOM 0 HA LYS A 746 -11.340 5.561 -1.278 1.00 0.00 H new ATOM 0 HB2 LYS A 746 -9.994 4.329 -3.335 1.00 0.00 H new ATOM 0 HB3 LYS A 746 -11.372 3.268 -3.127 1.00 0.00 H new ATOM 0 HG2 LYS A 746 -11.982 4.927 -4.750 1.00 0.00 H new ATOM 0 HG3 LYS A 746 -12.882 5.276 -3.287 1.00 0.00 H new ATOM 0 HD2 LYS A 746 -11.027 6.910 -2.652 1.00 0.00 H new ATOM 0 HD3 LYS A 746 -10.354 6.663 -4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 746 -11.750 8.671 -4.222 1.00 0.00 H new ATOM 0 HE3 LYS A 746 -12.446 7.464 -5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 746 -13.981 8.667 -3.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 746 -14.128 6.978 -3.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 746 -13.312 7.684 -2.464 1.00 0.00 H new ATOM 463 N GLY A 747 -13.194 3.757 -0.971 1.00 0.00 N ATOM 464 CA GLY A 747 -14.193 2.978 -0.263 1.00 0.00 C ATOM 465 C GLY A 747 -14.705 3.705 0.963 1.00 0.00 C ATOM 466 O GLY A 747 -13.923 4.111 1.822 1.00 0.00 O ATOM 0 H GLY A 747 -13.574 4.446 -1.620 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -15.026 2.761 -0.932 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -13.765 2.021 0.034 1.00 0.00 H new ATOM 470 N GLN A 748 -16.015 3.881 1.048 1.00 0.00 N ATOM 471 CA GLN A 748 -16.605 4.633 2.152 1.00 0.00 C ATOM 472 C GLN A 748 -17.239 3.697 3.174 1.00 0.00 C ATOM 473 O GLN A 748 -18.390 3.282 3.018 1.00 0.00 O ATOM 474 CB GLN A 748 -17.671 5.605 1.644 1.00 0.00 C ATOM 475 CG GLN A 748 -17.234 6.500 0.492 1.00 0.00 C ATOM 476 CD GLN A 748 -16.033 7.364 0.822 1.00 0.00 C ATOM 477 OE1 GLN A 748 -16.173 8.464 1.357 1.00 0.00 O ATOM 478 NE2 GLN A 748 -14.850 6.890 0.469 1.00 0.00 N ATOM 0 H GLN A 748 -16.688 3.518 0.373 1.00 0.00 H new ATOM 0 HA GLN A 748 -15.800 5.194 2.626 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -18.542 5.031 1.327 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -17.989 6.236 2.473 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -16.999 5.878 -0.372 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -18.066 7.142 0.205 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -14.779 5.973 0.028 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -14.009 7.441 0.638 1.00 0.00 H new ATOM 487 N GLY A 749 -16.494 3.369 4.216 1.00 0.00 N ATOM 488 CA GLY A 749 -16.990 2.457 5.227 1.00 0.00 C ATOM 489 C GLY A 749 -15.954 1.426 5.588 1.00 0.00 C ATOM 490 O GLY A 749 -14.786 1.601 5.272 1.00 0.00 O ATOM 0 H GLY A 749 -15.550 3.719 4.382 1.00 0.00 H new ATOM 0 HA2 GLY A 749 -17.274 3.017 6.118 1.00 0.00 H new ATOM 0 HA3 GLY A 749 -17.889 1.960 4.862 1.00 0.00 H new ATOM 494 N PRO A 750 -16.346 0.344 6.260 1.00 0.00 N ATOM 495 CA PRO A 750 -15.428 -0.719 6.645 1.00 0.00 C ATOM 496 C PRO A 750 -15.025 -1.587 5.457 1.00 0.00 C ATOM 497 O PRO A 750 -15.723 -2.536 5.093 1.00 0.00 O ATOM 498 CB PRO A 750 -16.218 -1.535 7.676 1.00 0.00 C ATOM 499 CG PRO A 750 -17.455 -0.739 7.951 1.00 0.00 C ATOM 500 CD PRO A 750 -17.703 0.075 6.722 1.00 0.00 C ATOM 0 HA PRO A 750 -14.491 -0.325 7.039 1.00 0.00 H new ATOM 0 HB2 PRO A 750 -16.465 -2.523 7.289 1.00 0.00 H new ATOM 0 HB3 PRO A 750 -15.637 -1.685 8.586 1.00 0.00 H new ATOM 0 HG2 PRO A 750 -18.301 -1.393 8.163 1.00 0.00 H new ATOM 0 HG3 PRO A 750 -17.321 -0.099 8.823 1.00 0.00 H new ATOM 0 HD2 PRO A 750 -18.286 -0.472 5.981 1.00 0.00 H new ATOM 0 HD3 PRO A 750 -18.249 0.992 6.943 1.00 0.00 H new ATOM 508 N PHE A 751 -13.899 -1.243 4.853 1.00 0.00 N ATOM 509 CA PHE A 751 -13.389 -1.965 3.697 1.00 0.00 C ATOM 510 C PHE A 751 -12.053 -2.634 4.027 1.00 0.00 C ATOM 511 O PHE A 751 -11.235 -2.066 4.747 1.00 0.00 O ATOM 512 CB PHE A 751 -13.243 -1.001 2.513 1.00 0.00 C ATOM 513 CG PHE A 751 -14.566 -0.578 1.935 1.00 0.00 C ATOM 514 CD1 PHE A 751 -15.234 0.532 2.419 1.00 0.00 C ATOM 515 CD2 PHE A 751 -15.149 -1.305 0.916 1.00 0.00 C ATOM 516 CE1 PHE A 751 -16.454 0.903 1.896 1.00 0.00 C ATOM 517 CE2 PHE A 751 -16.371 -0.931 0.389 1.00 0.00 C ATOM 518 CZ PHE A 751 -17.024 0.172 0.881 1.00 0.00 C ATOM 0 H PHE A 751 -13.315 -0.460 5.147 1.00 0.00 H new ATOM 0 HA PHE A 751 -14.095 -2.750 3.425 1.00 0.00 H new ATOM 0 HB2 PHE A 751 -12.694 -0.117 2.837 1.00 0.00 H new ATOM 0 HB3 PHE A 751 -12.648 -1.478 1.734 1.00 0.00 H new ATOM 0 HD1 PHE A 751 -14.795 1.114 3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 751 -14.644 -2.176 0.526 1.00 0.00 H new ATOM 0 HE1 PHE A 751 -16.964 1.772 2.285 1.00 0.00 H new ATOM 0 HE2 PHE A 751 -16.813 -1.507 -0.411 1.00 0.00 H new ATOM 0 HZ PHE A 751 -17.980 0.464 0.473 1.00 0.00 H new ATOM 528 N THR A 752 -11.835 -3.842 3.515 1.00 0.00 N ATOM 529 CA THR A 752 -10.600 -4.562 3.786 1.00 0.00 C ATOM 530 C THR A 752 -9.641 -4.364 2.633 1.00 0.00 C ATOM 531 O THR A 752 -9.806 -4.924 1.553 1.00 0.00 O ATOM 532 CB THR A 752 -10.837 -6.065 4.056 1.00 0.00 C ATOM 533 OG1 THR A 752 -11.754 -6.217 5.150 1.00 0.00 O ATOM 534 CG2 THR A 752 -9.532 -6.763 4.390 1.00 0.00 C ATOM 0 H THR A 752 -12.494 -4.338 2.915 1.00 0.00 H new ATOM 0 HA THR A 752 -10.166 -4.153 4.698 1.00 0.00 H new ATOM 0 HB THR A 752 -11.254 -6.518 3.157 1.00 0.00 H new ATOM 0 HG1 THR A 752 -11.905 -7.170 5.320 1.00 0.00 H new ATOM 0 HG21 THR A 752 -9.722 -7.820 4.576 1.00 0.00 H new ATOM 0 HG22 THR A 752 -8.840 -6.661 3.554 1.00 0.00 H new ATOM 0 HG23 THR A 752 -9.095 -6.310 5.280 1.00 0.00 H new ATOM 542 N LEU A 753 -8.647 -3.545 2.887 1.00 0.00 N ATOM 543 CA LEU A 753 -7.776 -3.035 1.858 1.00 0.00 C ATOM 544 C LEU A 753 -6.419 -3.742 1.922 1.00 0.00 C ATOM 545 O LEU A 753 -5.681 -3.601 2.894 1.00 0.00 O ATOM 546 CB LEU A 753 -7.636 -1.534 2.079 1.00 0.00 C ATOM 547 CG LEU A 753 -7.293 -0.705 0.849 1.00 0.00 C ATOM 548 CD1 LEU A 753 -7.613 0.740 1.125 1.00 0.00 C ATOM 549 CD2 LEU A 753 -5.833 -0.877 0.462 1.00 0.00 C ATOM 0 H LEU A 753 -8.419 -3.212 3.824 1.00 0.00 H new ATOM 0 HA LEU A 753 -8.188 -3.222 0.866 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -8.571 -1.160 2.495 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -6.864 -1.368 2.831 1.00 0.00 H new ATOM 0 HG LEU A 753 -7.891 -1.051 0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -7.370 1.340 0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -8.675 0.841 1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -7.026 1.086 1.976 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -5.617 -0.273 -0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -5.198 -0.555 1.287 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -5.636 -1.926 0.241 1.00 0.00 H new ATOM 561 N THR A 754 -6.106 -4.506 0.891 1.00 0.00 N ATOM 562 CA THR A 754 -4.886 -5.300 0.855 1.00 0.00 C ATOM 563 C THR A 754 -3.883 -4.705 -0.125 1.00 0.00 C ATOM 564 O THR A 754 -4.253 -4.328 -1.242 1.00 0.00 O ATOM 565 CB THR A 754 -5.192 -6.731 0.411 1.00 0.00 C ATOM 566 OG1 THR A 754 -6.467 -7.138 0.927 1.00 0.00 O ATOM 567 CG2 THR A 754 -4.120 -7.673 0.914 1.00 0.00 C ATOM 0 H THR A 754 -6.686 -4.595 0.057 1.00 0.00 H new ATOM 0 HA THR A 754 -4.466 -5.300 1.861 1.00 0.00 H new ATOM 0 HB THR A 754 -5.214 -6.764 -0.678 1.00 0.00 H new ATOM 0 HG1 THR A 754 -6.659 -8.055 0.638 1.00 0.00 H new ATOM 0 HG21 THR A 754 -4.348 -8.689 0.592 1.00 0.00 H new ATOM 0 HG22 THR A 754 -3.153 -7.373 0.510 1.00 0.00 H new ATOM 0 HG23 THR A 754 -4.085 -7.637 2.003 1.00 0.00 H new ATOM 575 N TYR A 755 -2.619 -4.637 0.270 1.00 0.00 N ATOM 576 CA TYR A 755 -1.596 -4.101 -0.609 1.00 0.00 C ATOM 577 C TYR A 755 -0.336 -4.963 -0.600 1.00 0.00 C ATOM 578 O TYR A 755 -0.107 -5.748 0.328 1.00 0.00 O ATOM 579 CB TYR A 755 -1.260 -2.650 -0.234 1.00 0.00 C ATOM 580 CG TYR A 755 -0.889 -2.429 1.221 1.00 0.00 C ATOM 581 CD1 TYR A 755 0.380 -2.734 1.697 1.00 0.00 C ATOM 582 CD2 TYR A 755 -1.807 -1.889 2.113 1.00 0.00 C ATOM 583 CE1 TYR A 755 0.719 -2.503 3.017 1.00 0.00 C ATOM 584 CE2 TYR A 755 -1.473 -1.661 3.431 1.00 0.00 C ATOM 585 CZ TYR A 755 -0.211 -1.968 3.878 1.00 0.00 C ATOM 586 OH TYR A 755 0.126 -1.729 5.191 1.00 0.00 O ATOM 0 H TYR A 755 -2.283 -4.943 1.183 1.00 0.00 H new ATOM 0 HA TYR A 755 -1.998 -4.114 -1.622 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -0.433 -2.312 -0.859 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -2.118 -2.022 -0.473 1.00 0.00 H new ATOM 0 HD1 TYR A 755 1.112 -3.158 1.026 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -2.800 -1.643 1.768 1.00 0.00 H new ATOM 0 HE1 TYR A 755 1.711 -2.742 3.371 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.201 -1.242 4.110 1.00 0.00 H new ATOM 0 HH TYR A 755 0.717 -2.442 5.512 1.00 0.00 H new ATOM 596 N ASP A 756 0.467 -4.815 -1.646 1.00 0.00 N ATOM 597 CA ASP A 756 1.693 -5.582 -1.800 1.00 0.00 C ATOM 598 C ASP A 756 2.910 -4.680 -1.836 1.00 0.00 C ATOM 599 O ASP A 756 2.962 -3.710 -2.581 1.00 0.00 O ATOM 600 CB ASP A 756 1.669 -6.445 -3.071 1.00 0.00 C ATOM 601 CG ASP A 756 1.313 -5.684 -4.337 1.00 0.00 C ATOM 602 OD1 ASP A 756 0.112 -5.602 -4.669 1.00 0.00 O ATOM 603 OD2 ASP A 756 2.230 -5.209 -5.033 1.00 0.00 O ATOM 0 H ASP A 756 0.286 -4.162 -2.408 1.00 0.00 H new ATOM 0 HA ASP A 756 1.758 -6.236 -0.931 1.00 0.00 H new ATOM 0 HB2 ASP A 756 2.648 -6.906 -3.201 1.00 0.00 H new ATOM 0 HB3 ASP A 756 0.951 -7.254 -2.933 1.00 0.00 H new ATOM 608 N ILE A 757 3.876 -4.997 -1.000 1.00 0.00 N ATOM 609 CA ILE A 757 5.186 -4.399 -1.095 1.00 0.00 C ATOM 610 C ILE A 757 6.075 -5.371 -1.841 1.00 0.00 C ATOM 611 O ILE A 757 6.648 -6.283 -1.255 1.00 0.00 O ATOM 612 CB ILE A 757 5.779 -4.092 0.301 1.00 0.00 C ATOM 613 CG1 ILE A 757 4.975 -2.992 0.980 1.00 0.00 C ATOM 614 CG2 ILE A 757 7.241 -3.705 0.206 1.00 0.00 C ATOM 615 CD1 ILE A 757 3.749 -3.493 1.711 1.00 0.00 C ATOM 0 H ILE A 757 3.775 -5.672 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 757 5.116 -3.447 -1.622 1.00 0.00 H new ATOM 0 HB ILE A 757 5.717 -4.998 0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 757 5.619 -2.468 1.686 1.00 0.00 H new ATOM 0 HG13 ILE A 757 4.667 -2.264 0.229 1.00 0.00 H new ATOM 0 HG21 ILE A 757 7.628 -3.496 1.203 1.00 0.00 H new ATOM 0 HG22 ILE A 757 7.806 -4.525 -0.238 1.00 0.00 H new ATOM 0 HG23 ILE A 757 7.342 -2.816 -0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 757 3.229 -2.651 2.168 1.00 0.00 H new ATOM 0 HD12 ILE A 757 3.083 -3.991 1.006 1.00 0.00 H new ATOM 0 HD13 ILE A 757 4.050 -4.198 2.486 1.00 0.00 H new ATOM 627 N ILE A 758 6.177 -5.189 -3.137 1.00 0.00 N ATOM 628 CA ILE A 758 6.811 -6.185 -3.965 1.00 0.00 C ATOM 629 C ILE A 758 8.249 -5.822 -4.293 1.00 0.00 C ATOM 630 O ILE A 758 8.586 -4.658 -4.511 1.00 0.00 O ATOM 631 CB ILE A 758 5.984 -6.454 -5.238 1.00 0.00 C ATOM 632 CG1 ILE A 758 5.809 -5.191 -6.070 1.00 0.00 C ATOM 633 CG2 ILE A 758 4.626 -7.003 -4.858 1.00 0.00 C ATOM 634 CD1 ILE A 758 6.835 -5.058 -7.173 1.00 0.00 C ATOM 0 H ILE A 758 5.833 -4.369 -3.636 1.00 0.00 H new ATOM 0 HA ILE A 758 6.847 -7.111 -3.392 1.00 0.00 H new ATOM 0 HB ILE A 758 6.525 -7.183 -5.841 1.00 0.00 H new ATOM 0 HG12 ILE A 758 4.811 -5.188 -6.508 1.00 0.00 H new ATOM 0 HG13 ILE A 758 5.873 -4.321 -5.416 1.00 0.00 H new ATOM 0 HG21 ILE A 758 4.044 -7.192 -5.760 1.00 0.00 H new ATOM 0 HG22 ILE A 758 4.752 -7.934 -4.306 1.00 0.00 H new ATOM 0 HG23 ILE A 758 4.102 -6.279 -4.234 1.00 0.00 H new ATOM 0 HD11 ILE A 758 6.655 -4.138 -7.728 1.00 0.00 H new ATOM 0 HD12 ILE A 758 7.834 -5.030 -6.739 1.00 0.00 H new ATOM 0 HD13 ILE A 758 6.756 -5.910 -7.848 1.00 0.00 H new ATOM 646 N GLU A 759 9.088 -6.839 -4.321 1.00 0.00 N ATOM 647 CA GLU A 759 10.518 -6.661 -4.433 1.00 0.00 C ATOM 648 C GLU A 759 10.951 -6.805 -5.881 1.00 0.00 C ATOM 649 O GLU A 759 11.099 -7.912 -6.401 1.00 0.00 O ATOM 650 CB GLU A 759 11.195 -7.681 -3.532 1.00 0.00 C ATOM 651 CG GLU A 759 10.549 -7.713 -2.158 1.00 0.00 C ATOM 652 CD GLU A 759 11.035 -8.837 -1.271 1.00 0.00 C ATOM 653 OE1 GLU A 759 12.264 -9.005 -1.126 1.00 0.00 O ATOM 654 OE2 GLU A 759 10.190 -9.556 -0.699 1.00 0.00 O ATOM 0 H GLU A 759 8.794 -7.814 -4.266 1.00 0.00 H new ATOM 0 HA GLU A 759 10.809 -5.660 -4.114 1.00 0.00 H new ATOM 0 HB2 GLU A 759 11.136 -8.669 -3.988 1.00 0.00 H new ATOM 0 HB3 GLU A 759 12.253 -7.438 -3.434 1.00 0.00 H new ATOM 0 HG2 GLU A 759 10.738 -6.763 -1.658 1.00 0.00 H new ATOM 0 HG3 GLU A 759 9.469 -7.801 -2.278 1.00 0.00 H new ATOM 661 N THR A 760 11.174 -5.668 -6.514 1.00 0.00 N ATOM 662 CA THR A 760 11.381 -5.606 -7.951 1.00 0.00 C ATOM 663 C THR A 760 12.855 -5.800 -8.311 1.00 0.00 C ATOM 664 O THR A 760 13.230 -5.785 -9.483 1.00 0.00 O ATOM 665 CB THR A 760 10.832 -4.273 -8.517 1.00 0.00 C ATOM 666 OG1 THR A 760 11.515 -3.883 -9.719 1.00 0.00 O ATOM 667 CG2 THR A 760 10.927 -3.174 -7.475 1.00 0.00 C ATOM 0 H THR A 760 11.217 -4.762 -6.048 1.00 0.00 H new ATOM 0 HA THR A 760 10.828 -6.425 -8.411 1.00 0.00 H new ATOM 0 HB THR A 760 9.784 -4.432 -8.770 1.00 0.00 H new ATOM 0 HG1 THR A 760 11.983 -4.658 -10.096 1.00 0.00 H new ATOM 0 HG21 THR A 760 10.537 -2.245 -7.890 1.00 0.00 H new ATOM 0 HG22 THR A 760 10.343 -3.453 -6.598 1.00 0.00 H new ATOM 0 HG23 THR A 760 11.969 -3.034 -7.188 1.00 0.00 H new ATOM 675 N PHE A 761 13.688 -6.005 -7.298 1.00 0.00 N ATOM 676 CA PHE A 761 15.106 -6.250 -7.532 1.00 0.00 C ATOM 677 C PHE A 761 15.360 -7.730 -7.805 1.00 0.00 C ATOM 678 O PHE A 761 16.460 -8.119 -8.195 1.00 0.00 O ATOM 679 CB PHE A 761 15.955 -5.761 -6.350 1.00 0.00 C ATOM 680 CG PHE A 761 15.604 -6.380 -5.025 1.00 0.00 C ATOM 681 CD1 PHE A 761 14.729 -5.745 -4.161 1.00 0.00 C ATOM 682 CD2 PHE A 761 16.161 -7.588 -4.637 1.00 0.00 C ATOM 683 CE1 PHE A 761 14.416 -6.302 -2.939 1.00 0.00 C ATOM 684 CE2 PHE A 761 15.849 -8.151 -3.415 1.00 0.00 C ATOM 685 CZ PHE A 761 14.976 -7.506 -2.565 1.00 0.00 C ATOM 0 H PHE A 761 13.410 -6.007 -6.316 1.00 0.00 H new ATOM 0 HA PHE A 761 15.403 -5.683 -8.414 1.00 0.00 H new ATOM 0 HB2 PHE A 761 17.004 -5.966 -6.565 1.00 0.00 H new ATOM 0 HB3 PHE A 761 15.851 -4.679 -6.269 1.00 0.00 H new ATOM 0 HD1 PHE A 761 14.286 -4.802 -4.447 1.00 0.00 H new ATOM 0 HD2 PHE A 761 16.848 -8.096 -5.298 1.00 0.00 H new ATOM 0 HE1 PHE A 761 13.732 -5.795 -2.274 1.00 0.00 H new ATOM 0 HE2 PHE A 761 16.288 -9.094 -3.126 1.00 0.00 H new ATOM 0 HZ PHE A 761 14.731 -7.943 -1.608 1.00 0.00 H new ATOM 695 N SER A 762 14.343 -8.553 -7.586 1.00 0.00 N ATOM 696 CA SER A 762 14.432 -9.964 -7.903 1.00 0.00 C ATOM 697 C SER A 762 13.085 -10.496 -8.397 1.00 0.00 C ATOM 698 O SER A 762 12.721 -10.302 -9.558 1.00 0.00 O ATOM 699 CB SER A 762 14.928 -10.756 -6.689 1.00 0.00 C ATOM 700 OG SER A 762 14.187 -10.432 -5.520 1.00 0.00 O ATOM 0 H SER A 762 13.449 -8.264 -7.190 1.00 0.00 H new ATOM 0 HA SER A 762 15.155 -10.092 -8.709 1.00 0.00 H new ATOM 0 HB2 SER A 762 14.844 -11.824 -6.890 1.00 0.00 H new ATOM 0 HB3 SER A 762 15.984 -10.545 -6.522 1.00 0.00 H new ATOM 0 HG SER A 762 14.683 -9.773 -4.990 1.00 0.00 H new ATOM 706 N SER A 763 12.332 -11.130 -7.509 1.00 0.00 N ATOM 707 CA SER A 763 11.021 -11.665 -7.853 1.00 0.00 C ATOM 708 C SER A 763 10.199 -11.905 -6.591 1.00 0.00 C ATOM 709 O SER A 763 9.191 -12.612 -6.610 1.00 0.00 O ATOM 710 CB SER A 763 11.173 -12.966 -8.648 1.00 0.00 C ATOM 711 OG SER A 763 11.909 -13.937 -7.916 1.00 0.00 O ATOM 0 H SER A 763 12.608 -11.287 -6.540 1.00 0.00 H new ATOM 0 HA SER A 763 10.497 -10.937 -8.473 1.00 0.00 H new ATOM 0 HB2 SER A 763 10.187 -13.362 -8.892 1.00 0.00 H new ATOM 0 HB3 SER A 763 11.677 -12.761 -9.592 1.00 0.00 H new ATOM 0 HG SER A 763 11.988 -14.757 -8.448 1.00 0.00 H new ATOM 717 N LYS A 764 10.631 -11.296 -5.496 1.00 0.00 N ATOM 718 CA LYS A 764 10.004 -11.511 -4.202 1.00 0.00 C ATOM 719 C LYS A 764 8.885 -10.502 -3.978 1.00 0.00 C ATOM 720 O LYS A 764 8.690 -9.591 -4.788 1.00 0.00 O ATOM 721 CB LYS A 764 11.056 -11.415 -3.103 1.00 0.00 C ATOM 722 CG LYS A 764 12.194 -12.410 -3.261 1.00 0.00 C ATOM 723 CD LYS A 764 13.344 -12.141 -2.293 1.00 0.00 C ATOM 724 CE LYS A 764 13.007 -12.508 -0.849 1.00 0.00 C ATOM 725 NZ LYS A 764 12.027 -11.576 -0.227 1.00 0.00 N ATOM 0 H LYS A 764 11.417 -10.646 -5.479 1.00 0.00 H new ATOM 0 HA LYS A 764 9.563 -12.507 -4.177 1.00 0.00 H new ATOM 0 HB2 LYS A 764 11.466 -10.405 -3.092 1.00 0.00 H new ATOM 0 HB3 LYS A 764 10.576 -11.575 -2.137 1.00 0.00 H new ATOM 0 HG2 LYS A 764 11.815 -13.419 -3.099 1.00 0.00 H new ATOM 0 HG3 LYS A 764 12.568 -12.370 -4.284 1.00 0.00 H new ATOM 0 HD2 LYS A 764 14.219 -12.707 -2.611 1.00 0.00 H new ATOM 0 HD3 LYS A 764 13.612 -11.086 -2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 764 12.605 -13.521 -0.821 1.00 0.00 H new ATOM 0 HE3 LYS A 764 13.923 -12.512 -0.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 12.282 -11.417 0.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 12.039 -10.669 -0.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 11.074 -11.989 -0.278 1.00 0.00 H new ATOM 739 N ARG A 765 8.151 -10.659 -2.885 1.00 0.00 N ATOM 740 CA ARG A 765 6.978 -9.857 -2.633 1.00 0.00 C ATOM 741 C ARG A 765 6.515 -9.974 -1.178 1.00 0.00 C ATOM 742 O ARG A 765 6.666 -11.019 -0.548 1.00 0.00 O ATOM 743 CB ARG A 765 5.880 -10.290 -3.602 1.00 0.00 C ATOM 744 CG ARG A 765 4.476 -10.035 -3.109 1.00 0.00 C ATOM 745 CD ARG A 765 3.474 -10.081 -4.251 1.00 0.00 C ATOM 746 NE ARG A 765 3.502 -11.358 -4.960 1.00 0.00 N ATOM 747 CZ ARG A 765 2.872 -11.585 -6.114 1.00 0.00 C ATOM 748 NH1 ARG A 765 2.127 -10.636 -6.668 1.00 0.00 N ATOM 749 NH2 ARG A 765 2.979 -12.767 -6.707 1.00 0.00 N ATOM 0 H ARG A 765 8.356 -11.343 -2.157 1.00 0.00 H new ATOM 0 HA ARG A 765 7.217 -8.806 -2.795 1.00 0.00 H new ATOM 0 HB2 ARG A 765 6.020 -9.767 -4.548 1.00 0.00 H new ATOM 0 HB3 ARG A 765 5.992 -11.355 -3.807 1.00 0.00 H new ATOM 0 HG2 ARG A 765 4.211 -10.780 -2.359 1.00 0.00 H new ATOM 0 HG3 ARG A 765 4.431 -9.061 -2.621 1.00 0.00 H new ATOM 0 HD2 ARG A 765 2.472 -9.907 -3.860 1.00 0.00 H new ATOM 0 HD3 ARG A 765 3.687 -9.274 -4.952 1.00 0.00 H new ATOM 0 HE ARG A 765 4.036 -12.123 -4.548 1.00 0.00 H new ATOM 0 HH11 ARG A 765 2.034 -9.729 -6.211 1.00 0.00 H new ATOM 0 HH12 ARG A 765 1.647 -10.814 -7.550 1.00 0.00 H new ATOM 0 HH21 ARG A 765 3.543 -13.502 -6.281 1.00 0.00 H new ATOM 0 HH22 ARG A 765 2.497 -12.940 -7.589 1.00 0.00 H new ATOM 763 N LYS A 766 5.967 -8.880 -0.659 1.00 0.00 N ATOM 764 CA LYS A 766 5.436 -8.813 0.689 1.00 0.00 C ATOM 765 C LYS A 766 3.979 -8.375 0.605 1.00 0.00 C ATOM 766 O LYS A 766 3.603 -7.646 -0.302 1.00 0.00 O ATOM 767 CB LYS A 766 6.255 -7.821 1.531 1.00 0.00 C ATOM 768 CG LYS A 766 6.192 -8.077 3.033 1.00 0.00 C ATOM 769 CD LYS A 766 4.906 -7.570 3.667 1.00 0.00 C ATOM 770 CE LYS A 766 4.827 -7.970 5.133 1.00 0.00 C ATOM 771 NZ LYS A 766 3.475 -7.733 5.700 1.00 0.00 N ATOM 0 H LYS A 766 5.880 -8.004 -1.175 1.00 0.00 H new ATOM 0 HA LYS A 766 5.499 -9.789 1.170 1.00 0.00 H new ATOM 0 HB2 LYS A 766 7.296 -7.862 1.210 1.00 0.00 H new ATOM 0 HB3 LYS A 766 5.899 -6.811 1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 766 6.285 -9.147 3.218 1.00 0.00 H new ATOM 0 HG3 LYS A 766 7.043 -7.595 3.514 1.00 0.00 H new ATOM 0 HD2 LYS A 766 4.856 -6.485 3.579 1.00 0.00 H new ATOM 0 HD3 LYS A 766 4.048 -7.973 3.129 1.00 0.00 H new ATOM 0 HE2 LYS A 766 5.084 -9.024 5.236 1.00 0.00 H new ATOM 0 HE3 LYS A 766 5.564 -7.405 5.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 3.449 -8.065 6.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 3.260 -6.716 5.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 2.768 -8.252 5.141 1.00 0.00 H new ATOM 785 N THR A 767 3.156 -8.846 1.514 1.00 0.00 N ATOM 786 CA THR A 767 1.733 -8.540 1.477 1.00 0.00 C ATOM 787 C THR A 767 1.216 -8.093 2.848 1.00 0.00 C ATOM 788 O THR A 767 1.651 -8.604 3.877 1.00 0.00 O ATOM 789 CB THR A 767 0.956 -9.780 1.000 1.00 0.00 C ATOM 790 OG1 THR A 767 1.463 -10.198 -0.276 1.00 0.00 O ATOM 791 CG2 THR A 767 -0.536 -9.500 0.888 1.00 0.00 C ATOM 0 H THR A 767 3.442 -9.443 2.290 1.00 0.00 H new ATOM 0 HA THR A 767 1.579 -7.715 0.781 1.00 0.00 H new ATOM 0 HB THR A 767 1.094 -10.570 1.738 1.00 0.00 H new ATOM 0 HG1 THR A 767 0.970 -10.989 -0.581 1.00 0.00 H new ATOM 0 HG21 THR A 767 -1.050 -10.399 0.549 1.00 0.00 H new ATOM 0 HG22 THR A 767 -0.925 -9.205 1.863 1.00 0.00 H new ATOM 0 HG23 THR A 767 -0.702 -8.695 0.172 1.00 0.00 H new ATOM 799 N PHE A 768 0.309 -7.118 2.860 1.00 0.00 N ATOM 800 CA PHE A 768 -0.313 -6.668 4.099 1.00 0.00 C ATOM 801 C PHE A 768 -1.763 -6.261 3.853 1.00 0.00 C ATOM 802 O PHE A 768 -2.093 -5.713 2.800 1.00 0.00 O ATOM 803 CB PHE A 768 0.463 -5.498 4.693 1.00 0.00 C ATOM 804 CG PHE A 768 0.404 -5.443 6.194 1.00 0.00 C ATOM 805 CD1 PHE A 768 0.862 -6.508 6.945 1.00 0.00 C ATOM 806 CD2 PHE A 768 -0.095 -4.333 6.848 1.00 0.00 C ATOM 807 CE1 PHE A 768 0.824 -6.469 8.326 1.00 0.00 C ATOM 808 CE2 PHE A 768 -0.136 -4.285 8.228 1.00 0.00 C ATOM 809 CZ PHE A 768 0.324 -5.355 8.969 1.00 0.00 C ATOM 0 H PHE A 768 -0.010 -6.626 2.025 1.00 0.00 H new ATOM 0 HA PHE A 768 -0.297 -7.496 4.808 1.00 0.00 H new ATOM 0 HB2 PHE A 768 1.505 -5.566 4.380 1.00 0.00 H new ATOM 0 HB3 PHE A 768 0.069 -4.567 4.287 1.00 0.00 H new ATOM 0 HD1 PHE A 768 1.255 -7.382 6.447 1.00 0.00 H new ATOM 0 HD2 PHE A 768 -0.457 -3.493 6.274 1.00 0.00 H new ATOM 0 HE1 PHE A 768 1.185 -7.309 8.901 1.00 0.00 H new ATOM 0 HE2 PHE A 768 -0.528 -3.411 8.727 1.00 0.00 H new ATOM 0 HZ PHE A 768 0.293 -5.320 10.048 1.00 0.00 H new ATOM 819 N GLU A 769 -2.618 -6.532 4.827 1.00 0.00 N ATOM 820 CA GLU A 769 -4.046 -6.294 4.692 1.00 0.00 C ATOM 821 C GLU A 769 -4.585 -5.448 5.847 1.00 0.00 C ATOM 822 O GLU A 769 -4.392 -5.784 7.018 1.00 0.00 O ATOM 823 CB GLU A 769 -4.745 -7.647 4.643 1.00 0.00 C ATOM 824 CG GLU A 769 -6.261 -7.580 4.607 1.00 0.00 C ATOM 825 CD GLU A 769 -6.894 -8.956 4.573 1.00 0.00 C ATOM 826 OE1 GLU A 769 -6.678 -9.733 5.526 1.00 0.00 O ATOM 827 OE2 GLU A 769 -7.614 -9.266 3.598 1.00 0.00 O ATOM 0 H GLU A 769 -2.343 -6.921 5.729 1.00 0.00 H new ATOM 0 HA GLU A 769 -4.238 -5.734 3.777 1.00 0.00 H new ATOM 0 HB2 GLU A 769 -4.398 -8.187 3.762 1.00 0.00 H new ATOM 0 HB3 GLU A 769 -4.442 -8.228 5.514 1.00 0.00 H new ATOM 0 HG2 GLU A 769 -6.620 -7.038 5.482 1.00 0.00 H new ATOM 0 HG3 GLU A 769 -6.577 -7.015 3.730 1.00 0.00 H new ATOM 834 N ILE A 770 -5.255 -4.349 5.513 1.00 0.00 N ATOM 835 CA ILE A 770 -5.850 -3.477 6.498 1.00 0.00 C ATOM 836 C ILE A 770 -7.357 -3.661 6.456 1.00 0.00 C ATOM 837 O ILE A 770 -8.007 -3.191 5.531 1.00 0.00 O ATOM 838 CB ILE A 770 -5.544 -1.992 6.205 1.00 0.00 C ATOM 839 CG1 ILE A 770 -4.134 -1.810 5.646 1.00 0.00 C ATOM 840 CG2 ILE A 770 -5.736 -1.166 7.458 1.00 0.00 C ATOM 841 CD1 ILE A 770 -3.037 -2.360 6.524 1.00 0.00 C ATOM 0 H ILE A 770 -5.396 -4.045 4.550 1.00 0.00 H new ATOM 0 HA ILE A 770 -5.436 -3.733 7.473 1.00 0.00 H new ATOM 0 HB ILE A 770 -6.243 -1.646 5.443 1.00 0.00 H new ATOM 0 HG12 ILE A 770 -4.078 -2.294 4.671 1.00 0.00 H new ATOM 0 HG13 ILE A 770 -3.955 -0.747 5.485 1.00 0.00 H new ATOM 0 HG21 ILE A 770 -5.518 -0.120 7.241 1.00 0.00 H new ATOM 0 HG22 ILE A 770 -6.767 -1.258 7.800 1.00 0.00 H new ATOM 0 HG23 ILE A 770 -5.062 -1.524 8.236 1.00 0.00 H new ATOM 0 HD11 ILE A 770 -2.071 -2.187 6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 770 -3.061 -1.860 7.492 1.00 0.00 H new ATOM 0 HD13 ILE A 770 -3.186 -3.431 6.665 1.00 0.00 H new ATOM 853 N LYS A 771 -7.915 -4.373 7.408 1.00 0.00 N ATOM 854 CA LYS A 771 -9.338 -4.598 7.408 1.00 0.00 C ATOM 855 C LYS A 771 -10.064 -3.425 8.032 1.00 0.00 C ATOM 856 O LYS A 771 -9.535 -2.745 8.915 1.00 0.00 O ATOM 857 CB LYS A 771 -9.668 -5.883 8.145 1.00 0.00 C ATOM 858 CG LYS A 771 -8.537 -6.893 8.086 1.00 0.00 C ATOM 859 CD LYS A 771 -8.990 -8.290 8.454 1.00 0.00 C ATOM 860 CE LYS A 771 -9.885 -8.887 7.375 1.00 0.00 C ATOM 861 NZ LYS A 771 -10.184 -10.322 7.623 1.00 0.00 N ATOM 0 H LYS A 771 -7.410 -4.801 8.184 1.00 0.00 H new ATOM 0 HA LYS A 771 -9.673 -4.695 6.375 1.00 0.00 H new ATOM 0 HB2 LYS A 771 -9.892 -5.653 9.187 1.00 0.00 H new ATOM 0 HB3 LYS A 771 -10.567 -6.324 7.715 1.00 0.00 H new ATOM 0 HG2 LYS A 771 -8.115 -6.904 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -7.741 -6.582 8.762 1.00 0.00 H new ATOM 0 HD2 LYS A 771 -8.120 -8.929 8.601 1.00 0.00 H new ATOM 0 HD3 LYS A 771 -9.529 -8.262 9.401 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -10.818 -8.326 7.328 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -9.401 -8.781 6.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -10.795 -10.685 6.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -9.296 -10.863 7.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 -10.670 -10.422 8.537 1.00 0.00 H new ATOM 875 N GLU A 772 -11.279 -3.216 7.555 1.00 0.00 N ATOM 876 CA GLU A 772 -12.153 -2.129 8.001 1.00 0.00 C ATOM 877 C GLU A 772 -11.449 -0.770 7.968 1.00 0.00 C ATOM 878 O GLU A 772 -11.468 -0.045 8.964 1.00 0.00 O ATOM 879 CB GLU A 772 -12.675 -2.375 9.425 1.00 0.00 C ATOM 880 CG GLU A 772 -12.663 -3.830 9.859 1.00 0.00 C ATOM 881 CD GLU A 772 -13.257 -4.041 11.237 1.00 0.00 C ATOM 882 OE1 GLU A 772 -12.525 -3.875 12.238 1.00 0.00 O ATOM 883 OE2 GLU A 772 -14.456 -4.376 11.328 1.00 0.00 O ATOM 0 H GLU A 772 -11.699 -3.803 6.834 1.00 0.00 H new ATOM 0 HA GLU A 772 -12.988 -2.112 7.301 1.00 0.00 H new ATOM 0 HB2 GLU A 772 -12.072 -1.796 10.124 1.00 0.00 H new ATOM 0 HB3 GLU A 772 -13.695 -1.997 9.495 1.00 0.00 H new ATOM 0 HG2 GLU A 772 -13.220 -4.424 9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 772 -11.637 -4.197 9.851 1.00 0.00 H new ATOM 890 N ILE A 773 -10.817 -0.411 6.854 1.00 0.00 N ATOM 891 CA ILE A 773 -10.267 0.927 6.748 1.00 0.00 C ATOM 892 C ILE A 773 -11.419 1.884 6.492 1.00 0.00 C ATOM 893 O ILE A 773 -12.160 1.751 5.522 1.00 0.00 O ATOM 894 CB ILE A 773 -9.132 1.069 5.674 1.00 0.00 C ATOM 895 CG1 ILE A 773 -9.612 1.697 4.363 1.00 0.00 C ATOM 896 CG2 ILE A 773 -8.473 -0.272 5.379 1.00 0.00 C ATOM 897 CD1 ILE A 773 -9.618 3.223 4.366 1.00 0.00 C ATOM 0 H ILE A 773 -10.678 -1.009 6.039 1.00 0.00 H new ATOM 0 HA ILE A 773 -9.769 1.170 7.686 1.00 0.00 H new ATOM 0 HB ILE A 773 -8.402 1.747 6.116 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -8.973 1.349 3.551 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -10.620 1.341 4.150 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -7.692 -0.137 4.631 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -8.035 -0.671 6.294 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -9.220 -0.969 5.001 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -9.971 3.587 3.401 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -10.280 3.583 5.154 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -8.608 3.590 4.545 1.00 0.00 H new ATOM 909 N LYS A 774 -11.609 2.796 7.419 1.00 0.00 N ATOM 910 CA LYS A 774 -12.687 3.759 7.336 1.00 0.00 C ATOM 911 C LYS A 774 -12.090 5.152 7.268 1.00 0.00 C ATOM 912 O LYS A 774 -12.701 6.140 7.671 1.00 0.00 O ATOM 913 CB LYS A 774 -13.593 3.600 8.557 1.00 0.00 C ATOM 914 CG LYS A 774 -13.982 2.151 8.819 1.00 0.00 C ATOM 915 CD LYS A 774 -14.719 1.986 10.134 1.00 0.00 C ATOM 916 CE LYS A 774 -14.911 0.518 10.477 1.00 0.00 C ATOM 917 NZ LYS A 774 -15.689 0.348 11.728 1.00 0.00 N ATOM 0 H LYS A 774 -11.024 2.892 8.249 1.00 0.00 H new ATOM 0 HA LYS A 774 -13.288 3.595 6.442 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -13.085 3.999 9.435 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -14.496 4.193 8.413 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -14.611 1.792 8.004 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -13.085 1.531 8.826 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -14.161 2.478 10.931 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -15.690 2.478 10.074 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -15.425 0.016 9.657 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -13.938 0.038 10.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -15.801 -0.666 11.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -15.186 0.806 12.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -16.626 0.784 11.616 1.00 0.00 H new ATOM 931 N THR A 775 -10.884 5.208 6.726 1.00 0.00 N ATOM 932 CA THR A 775 -10.084 6.416 6.738 1.00 0.00 C ATOM 933 C THR A 775 -10.238 7.229 5.456 1.00 0.00 C ATOM 934 O THR A 775 -10.834 8.305 5.463 1.00 0.00 O ATOM 935 CB THR A 775 -8.606 6.055 6.895 1.00 0.00 C ATOM 936 OG1 THR A 775 -8.481 4.869 7.687 1.00 0.00 O ATOM 937 CG2 THR A 775 -7.840 7.190 7.555 1.00 0.00 C ATOM 0 H THR A 775 -10.435 4.416 6.266 1.00 0.00 H new ATOM 0 HA THR A 775 -10.436 7.019 7.575 1.00 0.00 H new ATOM 0 HB THR A 775 -8.186 5.882 5.904 1.00 0.00 H new ATOM 0 HG1 THR A 775 -7.533 4.639 7.784 1.00 0.00 H new ATOM 0 HG21 THR A 775 -6.791 6.911 7.656 1.00 0.00 H new ATOM 0 HG22 THR A 775 -7.919 8.087 6.941 1.00 0.00 H new ATOM 0 HG23 THR A 775 -8.260 7.387 8.541 1.00 0.00 H new ATOM 945 N ASN A 776 -9.651 6.698 4.376 1.00 0.00 N ATOM 946 CA ASN A 776 -9.647 7.310 3.040 1.00 0.00 C ATOM 947 C ASN A 776 -8.471 8.256 2.906 1.00 0.00 C ATOM 948 O ASN A 776 -8.314 8.942 1.900 1.00 0.00 O ATOM 949 CB ASN A 776 -10.956 8.025 2.701 1.00 0.00 C ATOM 950 CG ASN A 776 -12.154 7.093 2.683 1.00 0.00 C ATOM 951 OD1 ASN A 776 -13.292 7.530 2.851 1.00 0.00 O ATOM 952 ND2 ASN A 776 -11.909 5.801 2.521 1.00 0.00 N ATOM 0 H ASN A 776 -9.153 5.808 4.407 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.548 6.498 2.320 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -11.130 8.817 3.429 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -10.860 8.503 1.726 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -12.678 5.131 2.533 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -10.952 5.477 2.384 1.00 0.00 H new ATOM 959 N GLU A 777 -7.652 8.279 3.940 1.00 0.00 N ATOM 960 CA GLU A 777 -6.406 9.002 3.936 1.00 0.00 C ATOM 961 C GLU A 777 -5.535 8.493 5.058 1.00 0.00 C ATOM 962 O GLU A 777 -5.666 8.910 6.207 1.00 0.00 O ATOM 963 CB GLU A 777 -6.660 10.478 4.083 1.00 0.00 C ATOM 964 CG GLU A 777 -5.394 11.301 4.141 1.00 0.00 C ATOM 965 CD GLU A 777 -5.607 12.747 3.752 1.00 0.00 C ATOM 966 OE1 GLU A 777 -5.179 13.137 2.641 1.00 0.00 O ATOM 967 OE2 GLU A 777 -6.204 13.502 4.545 1.00 0.00 O ATOM 0 H GLU A 777 -7.840 7.789 4.814 1.00 0.00 H new ATOM 0 HA GLU A 777 -5.893 8.843 2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -7.269 10.820 3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -7.239 10.651 4.990 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -4.987 11.259 5.151 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -4.650 10.859 3.479 1.00 0.00 H new ATOM 974 N TYR A 778 -4.656 7.587 4.722 1.00 0.00 N ATOM 975 CA TYR A 778 -3.909 6.875 5.734 1.00 0.00 C ATOM 976 C TYR A 778 -2.461 6.695 5.318 1.00 0.00 C ATOM 977 O TYR A 778 -2.173 6.253 4.206 1.00 0.00 O ATOM 978 CB TYR A 778 -4.592 5.541 6.020 1.00 0.00 C ATOM 979 CG TYR A 778 -3.818 4.640 6.960 1.00 0.00 C ATOM 980 CD1 TYR A 778 -3.867 4.829 8.335 1.00 0.00 C ATOM 981 CD2 TYR A 778 -3.030 3.604 6.468 1.00 0.00 C ATOM 982 CE1 TYR A 778 -3.152 4.014 9.194 1.00 0.00 C ATOM 983 CE2 TYR A 778 -2.315 2.784 7.319 1.00 0.00 C ATOM 984 CZ TYR A 778 -2.378 2.993 8.680 1.00 0.00 C ATOM 985 OH TYR A 778 -1.657 2.180 9.529 1.00 0.00 O ATOM 0 H TYR A 778 -4.438 7.323 3.761 1.00 0.00 H new ATOM 0 HA TYR A 778 -3.897 7.460 6.654 1.00 0.00 H new ATOM 0 HB2 TYR A 778 -5.577 5.733 6.446 1.00 0.00 H new ATOM 0 HB3 TYR A 778 -4.749 5.016 5.078 1.00 0.00 H new ATOM 0 HD1 TYR A 778 -4.473 5.625 8.740 1.00 0.00 H new ATOM 0 HD2 TYR A 778 -2.977 3.438 5.402 1.00 0.00 H new ATOM 0 HE1 TYR A 778 -3.199 4.176 10.261 1.00 0.00 H new ATOM 0 HE2 TYR A 778 -1.710 1.983 6.920 1.00 0.00 H new ATOM 0 HH TYR A 778 -1.168 1.512 9.005 1.00 0.00 H new ATOM 995 N VAL A 779 -1.550 7.071 6.204 1.00 0.00 N ATOM 996 CA VAL A 779 -0.136 6.953 5.917 1.00 0.00 C ATOM 997 C VAL A 779 0.352 5.550 6.248 1.00 0.00 C ATOM 998 O VAL A 779 0.485 5.180 7.414 1.00 0.00 O ATOM 999 CB VAL A 779 0.710 7.995 6.672 1.00 0.00 C ATOM 1000 CG1 VAL A 779 2.121 8.055 6.106 1.00 0.00 C ATOM 1001 CG2 VAL A 779 0.057 9.358 6.623 1.00 0.00 C ATOM 0 H VAL A 779 -1.768 7.458 7.122 1.00 0.00 H new ATOM 0 HA VAL A 779 -0.010 7.146 4.852 1.00 0.00 H new ATOM 0 HB VAL A 779 0.773 7.687 7.716 1.00 0.00 H new ATOM 0 HG11 VAL A 779 2.701 8.797 6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 779 2.595 7.078 6.205 1.00 0.00 H new ATOM 0 HG13 VAL A 779 2.079 8.332 5.053 1.00 0.00 H new ATOM 0 HG21 VAL A 779 0.674 10.076 7.163 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -0.045 9.675 5.585 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -0.929 9.306 7.085 1.00 0.00 H new ATOM 1011 N ILE A 780 0.590 4.774 5.206 1.00 0.00 N ATOM 1012 CA ILE A 780 1.023 3.397 5.347 1.00 0.00 C ATOM 1013 C ILE A 780 2.498 3.332 5.709 1.00 0.00 C ATOM 1014 O ILE A 780 3.331 3.991 5.095 1.00 0.00 O ATOM 1015 CB ILE A 780 0.786 2.603 4.046 1.00 0.00 C ATOM 1016 CG1 ILE A 780 -0.689 2.567 3.682 1.00 0.00 C ATOM 1017 CG2 ILE A 780 1.318 1.185 4.166 1.00 0.00 C ATOM 1018 CD1 ILE A 780 -0.943 1.825 2.391 1.00 0.00 C ATOM 0 H ILE A 780 0.488 5.081 4.239 1.00 0.00 H new ATOM 0 HA ILE A 780 0.433 2.951 6.147 1.00 0.00 H new ATOM 0 HB ILE A 780 1.328 3.117 3.252 1.00 0.00 H new ATOM 0 HG12 ILE A 780 -1.248 2.092 4.488 1.00 0.00 H new ATOM 0 HG13 ILE A 780 -1.064 3.587 3.592 1.00 0.00 H new ATOM 0 HG21 ILE A 780 1.137 0.649 3.235 1.00 0.00 H new ATOM 0 HG22 ILE A 780 2.389 1.214 4.366 1.00 0.00 H new ATOM 0 HG23 ILE A 780 0.810 0.674 4.984 1.00 0.00 H new ATOM 0 HD11 ILE A 780 -2.011 1.827 2.174 1.00 0.00 H new ATOM 0 HD12 ILE A 780 -0.407 2.315 1.578 1.00 0.00 H new ATOM 0 HD13 ILE A 780 -0.594 0.797 2.488 1.00 0.00 H new ATOM 1030 N LYS A 781 2.816 2.530 6.703 1.00 0.00 N ATOM 1031 CA LYS A 781 4.186 2.367 7.133 1.00 0.00 C ATOM 1032 C LYS A 781 4.632 0.936 6.930 1.00 0.00 C ATOM 1033 O LYS A 781 4.167 0.017 7.606 1.00 0.00 O ATOM 1034 CB LYS A 781 4.353 2.811 8.570 1.00 0.00 C ATOM 1035 CG LYS A 781 4.354 4.320 8.680 1.00 0.00 C ATOM 1036 CD LYS A 781 4.997 4.775 9.959 1.00 0.00 C ATOM 1037 CE LYS A 781 4.096 4.523 11.153 1.00 0.00 C ATOM 1038 NZ LYS A 781 4.712 4.980 12.423 1.00 0.00 N ATOM 0 H LYS A 781 2.139 1.978 7.230 1.00 0.00 H new ATOM 0 HA LYS A 781 4.826 3.004 6.522 1.00 0.00 H new ATOM 0 HB2 LYS A 781 3.546 2.400 9.176 1.00 0.00 H new ATOM 0 HB3 LYS A 781 5.286 2.414 8.970 1.00 0.00 H new ATOM 0 HG2 LYS A 781 4.887 4.748 7.831 1.00 0.00 H new ATOM 0 HG3 LYS A 781 3.330 4.691 8.634 1.00 0.00 H new ATOM 0 HD2 LYS A 781 5.943 4.252 10.098 1.00 0.00 H new ATOM 0 HD3 LYS A 781 5.228 5.838 9.894 1.00 0.00 H new ATOM 0 HE2 LYS A 781 3.147 5.038 11.005 1.00 0.00 H new ATOM 0 HE3 LYS A 781 3.874 3.458 11.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 781 4.063 4.789 13.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 781 5.605 4.471 12.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 781 4.900 6.001 12.370 1.00 0.00 H new ATOM 1052 N THR A 782 5.514 0.753 5.966 1.00 0.00 N ATOM 1053 CA THR A 782 5.981 -0.565 5.601 1.00 0.00 C ATOM 1054 C THR A 782 7.066 -1.010 6.577 1.00 0.00 C ATOM 1055 O THR A 782 7.814 -0.173 7.101 1.00 0.00 O ATOM 1056 CB THR A 782 6.537 -0.595 4.164 1.00 0.00 C ATOM 1057 OG1 THR A 782 7.938 -0.304 4.169 1.00 0.00 O ATOM 1058 CG2 THR A 782 5.810 0.423 3.291 1.00 0.00 C ATOM 0 H THR A 782 5.923 1.510 5.419 1.00 0.00 H new ATOM 0 HA THR A 782 5.132 -1.247 5.647 1.00 0.00 H new ATOM 0 HB THR A 782 6.378 -1.593 3.756 1.00 0.00 H new ATOM 0 HG1 THR A 782 8.277 -0.312 3.250 1.00 0.00 H new ATOM 0 HG21 THR A 782 6.214 0.389 2.279 1.00 0.00 H new ATOM 0 HG22 THR A 782 4.746 0.186 3.265 1.00 0.00 H new ATOM 0 HG23 THR A 782 5.949 1.422 3.704 1.00 0.00 H new ATOM 1066 N PRO A 783 7.167 -2.324 6.819 1.00 0.00 N ATOM 1067 CA PRO A 783 8.134 -2.910 7.763 1.00 0.00 C ATOM 1068 C PRO A 783 9.569 -2.450 7.522 1.00 0.00 C ATOM 1069 O PRO A 783 9.906 -1.944 6.452 1.00 0.00 O ATOM 1070 CB PRO A 783 8.022 -4.410 7.491 1.00 0.00 C ATOM 1071 CG PRO A 783 6.649 -4.596 6.953 1.00 0.00 C ATOM 1072 CD PRO A 783 6.332 -3.351 6.181 1.00 0.00 C ATOM 0 HA PRO A 783 7.913 -2.614 8.788 1.00 0.00 H new ATOM 0 HB2 PRO A 783 8.775 -4.740 6.776 1.00 0.00 H new ATOM 0 HB3 PRO A 783 8.172 -4.990 8.402 1.00 0.00 H new ATOM 0 HG2 PRO A 783 6.598 -5.476 6.312 1.00 0.00 H new ATOM 0 HG3 PRO A 783 5.932 -4.747 7.760 1.00 0.00 H new ATOM 0 HD2 PRO A 783 6.573 -3.463 5.124 1.00 0.00 H new ATOM 0 HD3 PRO A 783 5.273 -3.101 6.242 1.00 0.00 H new ATOM 1080 N VAL A 784 10.400 -2.624 8.540 1.00 0.00 N ATOM 1081 CA VAL A 784 11.810 -2.296 8.460 1.00 0.00 C ATOM 1082 C VAL A 784 12.516 -3.143 7.412 1.00 0.00 C ATOM 1083 O VAL A 784 12.504 -4.375 7.481 1.00 0.00 O ATOM 1084 CB VAL A 784 12.486 -2.495 9.830 1.00 0.00 C ATOM 1085 CG1 VAL A 784 13.998 -2.401 9.723 1.00 0.00 C ATOM 1086 CG2 VAL A 784 11.953 -1.475 10.811 1.00 0.00 C ATOM 0 H VAL A 784 10.112 -2.997 9.444 1.00 0.00 H new ATOM 0 HA VAL A 784 11.890 -1.249 8.167 1.00 0.00 H new ATOM 0 HB VAL A 784 12.250 -3.496 10.190 1.00 0.00 H new ATOM 0 HG11 VAL A 784 14.442 -2.546 10.708 1.00 0.00 H new ATOM 0 HG12 VAL A 784 14.363 -3.171 9.043 1.00 0.00 H new ATOM 0 HG13 VAL A 784 14.275 -1.418 9.341 1.00 0.00 H new ATOM 0 HG21 VAL A 784 12.432 -1.617 11.780 1.00 0.00 H new ATOM 0 HG22 VAL A 784 12.167 -0.471 10.444 1.00 0.00 H new ATOM 0 HG23 VAL A 784 10.875 -1.601 10.917 1.00 0.00 H new ATOM 1096 N PHE A 785 13.126 -2.474 6.451 1.00 0.00 N ATOM 1097 CA PHE A 785 13.873 -3.154 5.410 1.00 0.00 C ATOM 1098 C PHE A 785 15.366 -3.045 5.667 1.00 0.00 C ATOM 1099 O PHE A 785 16.009 -2.057 5.310 1.00 0.00 O ATOM 1100 CB PHE A 785 13.519 -2.617 4.024 1.00 0.00 C ATOM 1101 CG PHE A 785 12.170 -3.078 3.566 1.00 0.00 C ATOM 1102 CD1 PHE A 785 11.071 -2.264 3.713 1.00 0.00 C ATOM 1103 CD2 PHE A 785 12.003 -4.330 3.003 1.00 0.00 C ATOM 1104 CE1 PHE A 785 9.819 -2.684 3.308 1.00 0.00 C ATOM 1105 CE2 PHE A 785 10.757 -4.760 2.594 1.00 0.00 C ATOM 1106 CZ PHE A 785 9.662 -3.935 2.747 1.00 0.00 C ATOM 0 H PHE A 785 13.118 -1.457 6.370 1.00 0.00 H new ATOM 0 HA PHE A 785 13.594 -4.207 5.434 1.00 0.00 H new ATOM 0 HB2 PHE A 785 13.542 -1.527 4.042 1.00 0.00 H new ATOM 0 HB3 PHE A 785 14.274 -2.940 3.307 1.00 0.00 H new ATOM 0 HD1 PHE A 785 11.189 -1.284 4.151 1.00 0.00 H new ATOM 0 HD2 PHE A 785 12.858 -4.979 2.882 1.00 0.00 H new ATOM 0 HE1 PHE A 785 8.965 -2.035 3.430 1.00 0.00 H new ATOM 0 HE2 PHE A 785 10.640 -5.740 2.155 1.00 0.00 H new ATOM 0 HZ PHE A 785 8.685 -4.267 2.429 1.00 0.00 H new ATOM 1116 N THR A 786 15.914 -4.073 6.288 1.00 0.00 N ATOM 1117 CA THR A 786 17.329 -4.116 6.607 1.00 0.00 C ATOM 1118 C THR A 786 18.121 -4.637 5.424 1.00 0.00 C ATOM 1119 O THR A 786 19.103 -5.367 5.568 1.00 0.00 O ATOM 1120 CB THR A 786 17.572 -4.981 7.845 1.00 0.00 C ATOM 1121 OG1 THR A 786 17.018 -6.291 7.660 1.00 0.00 O ATOM 1122 CG2 THR A 786 16.927 -4.320 9.040 1.00 0.00 C ATOM 0 H THR A 786 15.393 -4.899 6.584 1.00 0.00 H new ATOM 0 HA THR A 786 17.667 -3.103 6.827 1.00 0.00 H new ATOM 0 HB THR A 786 18.645 -5.080 8.007 1.00 0.00 H new ATOM 0 HG1 THR A 786 17.184 -6.832 8.460 1.00 0.00 H new ATOM 0 HG21 THR A 786 17.095 -4.930 9.928 1.00 0.00 H new ATOM 0 HG22 THR A 786 17.364 -3.333 9.190 1.00 0.00 H new ATOM 0 HG23 THR A 786 15.856 -4.220 8.866 1.00 0.00 H new ATOM 1130 N THR A 787 17.669 -4.241 4.251 1.00 0.00 N ATOM 1131 CA THR A 787 18.297 -4.620 2.999 1.00 0.00 C ATOM 1132 C THR A 787 17.900 -3.651 1.899 1.00 0.00 C ATOM 1133 O THR A 787 16.732 -3.595 1.504 1.00 0.00 O ATOM 1134 CB THR A 787 17.929 -6.044 2.562 1.00 0.00 C ATOM 1135 OG1 THR A 787 18.253 -6.990 3.592 1.00 0.00 O ATOM 1136 CG2 THR A 787 18.664 -6.414 1.282 1.00 0.00 C ATOM 0 H THR A 787 16.850 -3.643 4.138 1.00 0.00 H new ATOM 0 HA THR A 787 19.373 -4.587 3.168 1.00 0.00 H new ATOM 0 HB THR A 787 16.855 -6.073 2.380 1.00 0.00 H new ATOM 0 HG1 THR A 787 18.850 -6.570 4.246 1.00 0.00 H new ATOM 0 HG21 THR A 787 18.392 -7.427 0.986 1.00 0.00 H new ATOM 0 HG22 THR A 787 18.388 -5.718 0.490 1.00 0.00 H new ATOM 0 HG23 THR A 787 19.739 -6.362 1.452 1.00 0.00 H new ATOM 1144 N GLY A 788 18.861 -2.850 1.457 1.00 0.00 N ATOM 1145 CA GLY A 788 18.641 -1.982 0.323 1.00 0.00 C ATOM 1146 C GLY A 788 18.153 -2.718 -0.907 1.00 0.00 C ATOM 1147 O GLY A 788 18.677 -3.771 -1.276 1.00 0.00 O ATOM 0 H GLY A 788 19.792 -2.788 1.868 1.00 0.00 H new ATOM 0 HA2 GLY A 788 17.912 -1.218 0.594 1.00 0.00 H new ATOM 0 HA3 GLY A 788 19.570 -1.465 0.084 1.00 0.00 H new ATOM 1151 N GLY A 789 17.145 -2.139 -1.529 1.00 0.00 N ATOM 1152 CA GLY A 789 16.554 -2.694 -2.730 1.00 0.00 C ATOM 1153 C GLY A 789 15.446 -1.799 -3.245 1.00 0.00 C ATOM 1154 O GLY A 789 15.281 -0.680 -2.756 1.00 0.00 O ATOM 0 H GLY A 789 16.713 -1.270 -1.216 1.00 0.00 H new ATOM 0 HA2 GLY A 789 17.319 -2.811 -3.497 1.00 0.00 H new ATOM 0 HA3 GLY A 789 16.158 -3.688 -2.520 1.00 0.00 H new ATOM 1158 N ASP A 790 14.685 -2.268 -4.221 1.00 0.00 N ATOM 1159 CA ASP A 790 13.534 -1.518 -4.694 1.00 0.00 C ATOM 1160 C ASP A 790 12.268 -2.289 -4.366 1.00 0.00 C ATOM 1161 O ASP A 790 12.174 -3.488 -4.641 1.00 0.00 O ATOM 1162 CB ASP A 790 13.588 -1.257 -6.204 1.00 0.00 C ATOM 1163 CG ASP A 790 14.786 -0.447 -6.656 1.00 0.00 C ATOM 1164 OD1 ASP A 790 15.864 -1.038 -6.864 1.00 0.00 O ATOM 1165 OD2 ASP A 790 14.639 0.776 -6.853 1.00 0.00 O ATOM 0 H ASP A 790 14.842 -3.156 -4.697 1.00 0.00 H new ATOM 0 HA ASP A 790 13.541 -0.551 -4.192 1.00 0.00 H new ATOM 0 HB2 ASP A 790 13.594 -2.214 -6.726 1.00 0.00 H new ATOM 0 HB3 ASP A 790 12.679 -0.736 -6.503 1.00 0.00 H new ATOM 1170 N TYR A 791 11.307 -1.608 -3.771 1.00 0.00 N ATOM 1171 CA TYR A 791 10.051 -2.229 -3.385 1.00 0.00 C ATOM 1172 C TYR A 791 8.895 -1.376 -3.862 1.00 0.00 C ATOM 1173 O TYR A 791 8.821 -0.201 -3.539 1.00 0.00 O ATOM 1174 CB TYR A 791 9.972 -2.388 -1.863 1.00 0.00 C ATOM 1175 CG TYR A 791 11.133 -3.143 -1.268 1.00 0.00 C ATOM 1176 CD1 TYR A 791 12.307 -2.488 -0.935 1.00 0.00 C ATOM 1177 CD2 TYR A 791 11.058 -4.508 -1.047 1.00 0.00 C ATOM 1178 CE1 TYR A 791 13.378 -3.174 -0.399 1.00 0.00 C ATOM 1179 CE2 TYR A 791 12.124 -5.202 -0.507 1.00 0.00 C ATOM 1180 CZ TYR A 791 13.283 -4.530 -0.188 1.00 0.00 C ATOM 1181 OH TYR A 791 14.351 -5.214 0.350 1.00 0.00 O ATOM 0 H TYR A 791 11.372 -0.616 -3.542 1.00 0.00 H new ATOM 0 HA TYR A 791 9.996 -3.216 -3.844 1.00 0.00 H new ATOM 0 HB2 TYR A 791 9.921 -1.400 -1.406 1.00 0.00 H new ATOM 0 HB3 TYR A 791 9.046 -2.905 -1.609 1.00 0.00 H new ATOM 0 HD1 TYR A 791 12.386 -1.423 -1.097 1.00 0.00 H new ATOM 0 HD2 TYR A 791 10.152 -5.039 -1.301 1.00 0.00 H new ATOM 0 HE1 TYR A 791 14.287 -2.648 -0.146 1.00 0.00 H new ATOM 0 HE2 TYR A 791 12.049 -6.266 -0.336 1.00 0.00 H new ATOM 0 HH TYR A 791 15.016 -4.575 0.681 1.00 0.00 H new ATOM 1191 N ILE A 792 8.001 -1.952 -4.632 1.00 0.00 N ATOM 1192 CA ILE A 792 6.868 -1.205 -5.122 1.00 0.00 C ATOM 1193 C ILE A 792 5.629 -1.585 -4.343 1.00 0.00 C ATOM 1194 O ILE A 792 5.200 -2.736 -4.355 1.00 0.00 O ATOM 1195 CB ILE A 792 6.656 -1.430 -6.628 1.00 0.00 C ATOM 1196 CG1 ILE A 792 7.841 -0.851 -7.405 1.00 0.00 C ATOM 1197 CG2 ILE A 792 5.358 -0.779 -7.080 1.00 0.00 C ATOM 1198 CD1 ILE A 792 8.144 -1.576 -8.693 1.00 0.00 C ATOM 0 H ILE A 792 8.036 -2.927 -4.930 1.00 0.00 H new ATOM 0 HA ILE A 792 7.068 -0.143 -4.977 1.00 0.00 H new ATOM 0 HB ILE A 792 6.590 -2.500 -6.824 1.00 0.00 H new ATOM 0 HG12 ILE A 792 7.639 0.196 -7.629 1.00 0.00 H new ATOM 0 HG13 ILE A 792 8.726 -0.876 -6.769 1.00 0.00 H new ATOM 0 HG21 ILE A 792 5.220 -0.946 -8.148 1.00 0.00 H new ATOM 0 HG22 ILE A 792 4.522 -1.216 -6.534 1.00 0.00 H new ATOM 0 HG23 ILE A 792 5.400 0.292 -6.883 1.00 0.00 H new ATOM 0 HD11 ILE A 792 8.996 -1.105 -9.184 1.00 0.00 H new ATOM 0 HD12 ILE A 792 8.380 -2.618 -8.477 1.00 0.00 H new ATOM 0 HD13 ILE A 792 7.275 -1.529 -9.350 1.00 0.00 H new ATOM 1210 N LEU A 793 5.086 -0.614 -3.640 1.00 0.00 N ATOM 1211 CA LEU A 793 3.876 -0.811 -2.886 1.00 0.00 C ATOM 1212 C LEU A 793 2.697 -0.631 -3.820 1.00 0.00 C ATOM 1213 O LEU A 793 2.379 0.481 -4.246 1.00 0.00 O ATOM 1214 CB LEU A 793 3.817 0.176 -1.716 1.00 0.00 C ATOM 1215 CG LEU A 793 2.648 -0.013 -0.751 1.00 0.00 C ATOM 1216 CD1 LEU A 793 3.147 0.029 0.687 1.00 0.00 C ATOM 1217 CD2 LEU A 793 1.602 1.062 -0.975 1.00 0.00 C ATOM 0 H LEU A 793 5.472 0.328 -3.578 1.00 0.00 H new ATOM 0 HA LEU A 793 3.849 -1.816 -2.465 1.00 0.00 H new ATOM 0 HB2 LEU A 793 4.746 0.099 -1.152 1.00 0.00 H new ATOM 0 HB3 LEU A 793 3.772 1.188 -2.119 1.00 0.00 H new ATOM 0 HG LEU A 793 2.192 -0.985 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 793 2.307 -0.107 1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 793 3.873 -0.769 0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 793 3.619 0.992 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 793 0.775 0.915 -0.281 1.00 0.00 H new ATOM 0 HD22 LEU A 793 2.047 2.043 -0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 793 1.232 1.002 -1.998 1.00 0.00 H new ATOM 1229 N SER A 794 2.085 -1.742 -4.156 1.00 0.00 N ATOM 1230 CA SER A 794 0.973 -1.768 -5.072 1.00 0.00 C ATOM 1231 C SER A 794 -0.253 -2.294 -4.339 1.00 0.00 C ATOM 1232 O SER A 794 -0.179 -2.617 -3.154 1.00 0.00 O ATOM 1233 CB SER A 794 1.322 -2.651 -6.274 1.00 0.00 C ATOM 1234 OG SER A 794 0.362 -2.535 -7.312 1.00 0.00 O ATOM 0 H SER A 794 2.348 -2.660 -3.798 1.00 0.00 H new ATOM 0 HA SER A 794 0.758 -0.765 -5.441 1.00 0.00 H new ATOM 0 HB2 SER A 794 2.305 -2.373 -6.655 1.00 0.00 H new ATOM 0 HB3 SER A 794 1.387 -3.691 -5.954 1.00 0.00 H new ATOM 0 HG SER A 794 0.620 -3.111 -8.062 1.00 0.00 H new ATOM 1240 N LEU A 795 -1.373 -2.375 -5.028 1.00 0.00 N ATOM 1241 CA LEU A 795 -2.616 -2.780 -4.399 1.00 0.00 C ATOM 1242 C LEU A 795 -2.998 -4.194 -4.807 1.00 0.00 C ATOM 1243 O LEU A 795 -3.017 -4.523 -5.997 1.00 0.00 O ATOM 1244 CB LEU A 795 -3.715 -1.812 -4.778 1.00 0.00 C ATOM 1245 CG LEU A 795 -3.412 -0.350 -4.474 1.00 0.00 C ATOM 1246 CD1 LEU A 795 -4.616 0.484 -4.821 1.00 0.00 C ATOM 1247 CD2 LEU A 795 -3.007 -0.158 -3.015 1.00 0.00 C ATOM 0 H LEU A 795 -1.449 -2.166 -6.023 1.00 0.00 H new ATOM 0 HA LEU A 795 -2.479 -2.768 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 795 -3.916 -1.912 -5.844 1.00 0.00 H new ATOM 0 HB3 LEU A 795 -4.627 -2.096 -4.253 1.00 0.00 H new ATOM 0 HG LEU A 795 -2.566 -0.027 -5.081 1.00 0.00 H new ATOM 0 HD11 LEU A 795 -4.407 1.532 -4.606 1.00 0.00 H new ATOM 0 HD12 LEU A 795 -4.845 0.369 -5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 795 -5.469 0.155 -4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 795 -2.798 0.896 -2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 795 -3.819 -0.485 -2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 795 -2.114 -0.747 -2.805 1.00 0.00 H new ATOM 1259 N VAL A 796 -3.319 -5.021 -3.817 1.00 0.00 N ATOM 1260 CA VAL A 796 -3.650 -6.417 -4.066 1.00 0.00 C ATOM 1261 C VAL A 796 -5.137 -6.590 -4.337 1.00 0.00 C ATOM 1262 O VAL A 796 -5.530 -7.063 -5.402 1.00 0.00 O ATOM 1263 CB VAL A 796 -3.246 -7.313 -2.871 1.00 0.00 C ATOM 1264 CG1 VAL A 796 -3.831 -8.714 -3.004 1.00 0.00 C ATOM 1265 CG2 VAL A 796 -1.742 -7.390 -2.777 1.00 0.00 C ATOM 0 H VAL A 796 -3.357 -4.747 -2.835 1.00 0.00 H new ATOM 0 HA VAL A 796 -3.087 -6.723 -4.947 1.00 0.00 H new ATOM 0 HB VAL A 796 -3.647 -6.867 -1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 796 -3.528 -9.318 -2.148 1.00 0.00 H new ATOM 0 HG12 VAL A 796 -4.919 -8.652 -3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 796 -3.465 -9.175 -3.921 1.00 0.00 H new ATOM 0 HG21 VAL A 796 -1.462 -8.022 -1.934 1.00 0.00 H new ATOM 0 HG22 VAL A 796 -1.341 -7.814 -3.698 1.00 0.00 H new ATOM 0 HG23 VAL A 796 -1.335 -6.389 -2.631 1.00 0.00 H new ATOM 1275 N SER A 797 -5.955 -6.151 -3.392 1.00 0.00 N ATOM 1276 CA SER A 797 -7.397 -6.376 -3.437 1.00 0.00 C ATOM 1277 C SER A 797 -8.077 -5.620 -2.307 1.00 0.00 C ATOM 1278 O SER A 797 -7.417 -5.113 -1.406 1.00 0.00 O ATOM 1279 CB SER A 797 -7.713 -7.873 -3.325 1.00 0.00 C ATOM 1280 OG SER A 797 -7.421 -8.561 -4.531 1.00 0.00 O ATOM 0 H SER A 797 -5.642 -5.630 -2.573 1.00 0.00 H new ATOM 0 HA SER A 797 -7.774 -6.010 -4.392 1.00 0.00 H new ATOM 0 HB2 SER A 797 -7.135 -8.307 -2.509 1.00 0.00 H new ATOM 0 HB3 SER A 797 -8.766 -8.005 -3.076 1.00 0.00 H new ATOM 0 HG SER A 797 -7.004 -7.943 -5.167 1.00 0.00 H new ATOM 1286 N ILE A 798 -9.389 -5.549 -2.361 1.00 0.00 N ATOM 1287 CA ILE A 798 -10.161 -4.754 -1.427 1.00 0.00 C ATOM 1288 C ILE A 798 -11.425 -5.517 -1.069 1.00 0.00 C ATOM 1289 O ILE A 798 -11.772 -6.479 -1.741 1.00 0.00 O ATOM 1290 CB ILE A 798 -10.508 -3.420 -2.104 1.00 0.00 C ATOM 1291 CG1 ILE A 798 -10.210 -2.204 -1.234 1.00 0.00 C ATOM 1292 CG2 ILE A 798 -11.944 -3.411 -2.585 1.00 0.00 C ATOM 1293 CD1 ILE A 798 -10.909 -2.154 0.089 1.00 0.00 C ATOM 0 H ILE A 798 -9.953 -6.041 -3.054 1.00 0.00 H new ATOM 0 HA ILE A 798 -9.597 -4.559 -0.515 1.00 0.00 H new ATOM 0 HB ILE A 798 -9.851 -3.339 -2.970 1.00 0.00 H new ATOM 0 HG12 ILE A 798 -9.135 -2.164 -1.056 1.00 0.00 H new ATOM 0 HG13 ILE A 798 -10.473 -1.308 -1.795 1.00 0.00 H new ATOM 0 HG21 ILE A 798 -12.163 -2.455 -3.060 1.00 0.00 H new ATOM 0 HG22 ILE A 798 -12.092 -4.216 -3.305 1.00 0.00 H new ATOM 0 HG23 ILE A 798 -12.613 -3.556 -1.737 1.00 0.00 H new ATOM 0 HD11 ILE A 798 -10.620 -1.246 0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 798 -11.987 -2.155 -0.069 1.00 0.00 H new ATOM 0 HD13 ILE A 798 -10.629 -3.025 0.682 1.00 0.00 H new ATOM 1305 N LYS A 799 -12.115 -5.091 -0.037 1.00 0.00 N ATOM 1306 CA LYS A 799 -13.310 -5.797 0.390 1.00 0.00 C ATOM 1307 C LYS A 799 -14.399 -4.840 0.808 1.00 0.00 C ATOM 1308 O LYS A 799 -14.236 -4.069 1.748 1.00 0.00 O ATOM 1309 CB LYS A 799 -12.977 -6.732 1.531 1.00 0.00 C ATOM 1310 CG LYS A 799 -14.125 -7.553 2.080 1.00 0.00 C ATOM 1311 CD LYS A 799 -13.657 -8.281 3.328 1.00 0.00 C ATOM 1312 CE LYS A 799 -14.455 -9.529 3.573 1.00 0.00 C ATOM 1313 NZ LYS A 799 -15.617 -9.296 4.472 1.00 0.00 N ATOM 0 H LYS A 799 -11.877 -4.270 0.519 1.00 0.00 H new ATOM 0 HA LYS A 799 -13.679 -6.374 -0.458 1.00 0.00 H new ATOM 0 HB2 LYS A 799 -12.196 -7.415 1.197 1.00 0.00 H new ATOM 0 HB3 LYS A 799 -12.557 -6.142 2.346 1.00 0.00 H new ATOM 0 HG2 LYS A 799 -14.971 -6.908 2.315 1.00 0.00 H new ATOM 0 HG3 LYS A 799 -14.468 -8.268 1.333 1.00 0.00 H new ATOM 0 HD2 LYS A 799 -12.602 -8.537 3.226 1.00 0.00 H new ATOM 0 HD3 LYS A 799 -13.743 -7.619 4.190 1.00 0.00 H new ATOM 0 HE2 LYS A 799 -14.810 -9.922 2.620 1.00 0.00 H new ATOM 0 HE3 LYS A 799 -13.808 -10.290 4.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 799 -16.362 -9.991 4.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 799 -15.316 -9.397 5.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 799 -15.987 -8.336 4.319 1.00 0.00 H new ATOM 1327 N ASP A 800 -15.500 -4.910 0.095 1.00 0.00 N ATOM 1328 CA ASP A 800 -16.689 -4.145 0.415 1.00 0.00 C ATOM 1329 C ASP A 800 -17.313 -4.703 1.678 1.00 0.00 C ATOM 1330 O ASP A 800 -17.110 -5.872 2.001 1.00 0.00 O ATOM 1331 CB ASP A 800 -17.674 -4.222 -0.751 1.00 0.00 C ATOM 1332 CG ASP A 800 -18.924 -3.398 -0.536 1.00 0.00 C ATOM 1333 OD1 ASP A 800 -19.004 -2.280 -1.076 1.00 0.00 O ATOM 1334 OD2 ASP A 800 -19.844 -3.882 0.156 1.00 0.00 O ATOM 0 H ASP A 800 -15.599 -5.503 -0.729 1.00 0.00 H new ATOM 0 HA ASP A 800 -16.428 -3.100 0.581 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -17.177 -3.884 -1.660 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -17.957 -5.263 -0.910 1.00 0.00 H new ATOM 1339 N SER A 801 -18.095 -3.872 2.366 1.00 0.00 N ATOM 1340 CA SER A 801 -18.628 -4.205 3.681 1.00 0.00 C ATOM 1341 C SER A 801 -19.638 -5.351 3.597 1.00 0.00 C ATOM 1342 O SER A 801 -20.126 -5.841 4.616 1.00 0.00 O ATOM 1343 CB SER A 801 -19.272 -2.962 4.307 1.00 0.00 C ATOM 1344 OG SER A 801 -19.582 -3.171 5.676 1.00 0.00 O ATOM 0 H SER A 801 -18.375 -2.952 2.026 1.00 0.00 H new ATOM 0 HA SER A 801 -17.805 -4.539 4.313 1.00 0.00 H new ATOM 0 HB2 SER A 801 -18.595 -2.113 4.212 1.00 0.00 H new ATOM 0 HB3 SER A 801 -20.181 -2.708 3.762 1.00 0.00 H new ATOM 0 HG SER A 801 -19.941 -4.075 5.796 1.00 0.00 H new ATOM 1350 N THR A 802 -19.943 -5.772 2.379 1.00 0.00 N ATOM 1351 CA THR A 802 -20.789 -6.930 2.148 1.00 0.00 C ATOM 1352 C THR A 802 -19.925 -8.169 1.923 1.00 0.00 C ATOM 1353 O THR A 802 -20.419 -9.243 1.576 1.00 0.00 O ATOM 1354 CB THR A 802 -21.702 -6.701 0.932 1.00 0.00 C ATOM 1355 OG1 THR A 802 -20.930 -6.193 -0.166 1.00 0.00 O ATOM 1356 CG2 THR A 802 -22.807 -5.717 1.268 1.00 0.00 C ATOM 0 H THR A 802 -19.612 -5.321 1.526 1.00 0.00 H new ATOM 0 HA THR A 802 -21.415 -7.082 3.027 1.00 0.00 H new ATOM 0 HB THR A 802 -22.153 -7.654 0.656 1.00 0.00 H new ATOM 0 HG1 THR A 802 -20.825 -5.223 -0.071 1.00 0.00 H new ATOM 0 HG21 THR A 802 -23.441 -5.570 0.394 1.00 0.00 H new ATOM 0 HG22 THR A 802 -23.407 -6.110 2.089 1.00 0.00 H new ATOM 0 HG23 THR A 802 -22.368 -4.764 1.563 1.00 0.00 H new ATOM 1364 N GLY A 803 -18.626 -7.995 2.137 1.00 0.00 N ATOM 1365 CA GLY A 803 -17.664 -9.052 1.910 1.00 0.00 C ATOM 1366 C GLY A 803 -17.403 -9.272 0.439 1.00 0.00 C ATOM 1367 O GLY A 803 -17.123 -10.389 0.007 1.00 0.00 O ATOM 0 H GLY A 803 -18.218 -7.122 2.470 1.00 0.00 H new ATOM 0 HA2 GLY A 803 -16.728 -8.805 2.411 1.00 0.00 H new ATOM 0 HA3 GLY A 803 -18.030 -9.977 2.356 1.00 0.00 H new ATOM 1371 N CYS A 804 -17.480 -8.199 -0.329 1.00 0.00 N ATOM 1372 CA CYS A 804 -17.267 -8.289 -1.765 1.00 0.00 C ATOM 1373 C CYS A 804 -15.845 -7.860 -2.093 1.00 0.00 C ATOM 1374 O CYS A 804 -15.508 -6.681 -2.007 1.00 0.00 O ATOM 1375 CB CYS A 804 -18.280 -7.421 -2.519 1.00 0.00 C ATOM 1376 SG CYS A 804 -18.257 -7.637 -4.314 1.00 0.00 S ATOM 0 H CYS A 804 -17.687 -7.261 0.014 1.00 0.00 H new ATOM 0 HA CYS A 804 -17.411 -9.322 -2.082 1.00 0.00 H new ATOM 0 HB2 CYS A 804 -19.280 -7.648 -2.151 1.00 0.00 H new ATOM 0 HB3 CYS A 804 -18.086 -6.374 -2.289 1.00 0.00 H new ATOM 0 HG CYS A 804 -19.149 -6.862 -4.856 1.00 0.00 H new ATOM 1382 N VAL A 805 -15.011 -8.817 -2.457 1.00 0.00 N ATOM 1383 CA VAL A 805 -13.602 -8.544 -2.673 1.00 0.00 C ATOM 1384 C VAL A 805 -13.373 -8.037 -4.092 1.00 0.00 C ATOM 1385 O VAL A 805 -13.457 -8.793 -5.061 1.00 0.00 O ATOM 1386 CB VAL A 805 -12.737 -9.798 -2.428 1.00 0.00 C ATOM 1387 CG1 VAL A 805 -11.279 -9.420 -2.238 1.00 0.00 C ATOM 1388 CG2 VAL A 805 -13.248 -10.584 -1.228 1.00 0.00 C ATOM 0 H VAL A 805 -15.284 -9.788 -2.609 1.00 0.00 H new ATOM 0 HA VAL A 805 -13.304 -7.777 -1.958 1.00 0.00 H new ATOM 0 HB VAL A 805 -12.812 -10.435 -3.309 1.00 0.00 H new ATOM 0 HG11 VAL A 805 -10.689 -10.320 -2.067 1.00 0.00 H new ATOM 0 HG12 VAL A 805 -10.915 -8.912 -3.131 1.00 0.00 H new ATOM 0 HG13 VAL A 805 -11.184 -8.756 -1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 805 -12.622 -11.463 -1.076 1.00 0.00 H new ATOM 0 HG22 VAL A 805 -13.212 -9.955 -0.339 1.00 0.00 H new ATOM 0 HG23 VAL A 805 -14.276 -10.898 -1.409 1.00 0.00 H new ATOM 1398 N VAL A 806 -13.108 -6.747 -4.200 1.00 0.00 N ATOM 1399 CA VAL A 806 -12.888 -6.101 -5.481 1.00 0.00 C ATOM 1400 C VAL A 806 -11.402 -6.085 -5.808 1.00 0.00 C ATOM 1401 O VAL A 806 -10.565 -5.831 -4.938 1.00 0.00 O ATOM 1402 CB VAL A 806 -13.465 -4.661 -5.480 1.00 0.00 C ATOM 1403 CG1 VAL A 806 -12.913 -3.821 -6.621 1.00 0.00 C ATOM 1404 CG2 VAL A 806 -14.977 -4.702 -5.565 1.00 0.00 C ATOM 0 H VAL A 806 -13.039 -6.117 -3.400 1.00 0.00 H new ATOM 0 HA VAL A 806 -13.410 -6.670 -6.251 1.00 0.00 H new ATOM 0 HB VAL A 806 -13.160 -4.194 -4.544 1.00 0.00 H new ATOM 0 HG11 VAL A 806 -13.346 -2.821 -6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 806 -11.829 -3.751 -6.530 1.00 0.00 H new ATOM 0 HG13 VAL A 806 -13.168 -4.287 -7.573 1.00 0.00 H new ATOM 0 HG21 VAL A 806 -15.369 -3.685 -5.563 1.00 0.00 H new ATOM 0 HG22 VAL A 806 -15.276 -5.205 -6.485 1.00 0.00 H new ATOM 0 HG23 VAL A 806 -15.375 -5.246 -4.708 1.00 0.00 H new ATOM 1414 N GLY A 807 -11.086 -6.390 -7.055 1.00 0.00 N ATOM 1415 CA GLY A 807 -9.701 -6.416 -7.488 1.00 0.00 C ATOM 1416 C GLY A 807 -9.149 -5.021 -7.658 1.00 0.00 C ATOM 1417 O GLY A 807 -9.804 -4.159 -8.247 1.00 0.00 O ATOM 0 H GLY A 807 -11.765 -6.621 -7.780 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -9.101 -6.960 -6.759 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -9.623 -6.957 -8.431 1.00 0.00 H new ATOM 1421 N LEU A 808 -7.952 -4.783 -7.147 1.00 0.00 N ATOM 1422 CA LEU A 808 -7.399 -3.443 -7.136 1.00 0.00 C ATOM 1423 C LEU A 808 -6.419 -3.191 -8.265 1.00 0.00 C ATOM 1424 O LEU A 808 -5.504 -3.977 -8.502 1.00 0.00 O ATOM 1425 CB LEU A 808 -6.730 -3.175 -5.800 1.00 0.00 C ATOM 1426 CG LEU A 808 -7.689 -3.095 -4.627 1.00 0.00 C ATOM 1427 CD1 LEU A 808 -6.947 -2.690 -3.374 1.00 0.00 C ATOM 1428 CD2 LEU A 808 -8.812 -2.134 -4.944 1.00 0.00 C ATOM 0 H LEU A 808 -7.350 -5.497 -6.737 1.00 0.00 H new ATOM 0 HA LEU A 808 -8.232 -2.756 -7.287 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -6.003 -3.963 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -6.176 -2.239 -5.866 1.00 0.00 H new ATOM 0 HG LEU A 808 -8.128 -4.077 -4.449 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -7.645 -2.636 -2.539 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -6.175 -3.427 -3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -6.485 -1.714 -3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -9.496 -2.082 -4.097 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -8.400 -1.144 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -9.351 -2.482 -5.825 1.00 0.00 H new ATOM 1440 N SER A 809 -6.627 -2.081 -8.955 1.00 0.00 N ATOM 1441 CA SER A 809 -5.678 -1.604 -9.939 1.00 0.00 C ATOM 1442 C SER A 809 -5.675 -0.073 -9.936 1.00 0.00 C ATOM 1443 O SER A 809 -6.379 0.567 -10.715 1.00 0.00 O ATOM 1444 CB SER A 809 -6.048 -2.146 -11.325 1.00 0.00 C ATOM 1445 OG SER A 809 -4.959 -2.058 -12.230 1.00 0.00 O ATOM 0 H SER A 809 -7.453 -1.492 -8.848 1.00 0.00 H new ATOM 0 HA SER A 809 -4.678 -1.959 -9.691 1.00 0.00 H new ATOM 0 HB2 SER A 809 -6.365 -3.185 -11.237 1.00 0.00 H new ATOM 0 HB3 SER A 809 -6.896 -1.587 -11.720 1.00 0.00 H new ATOM 0 HG SER A 809 -5.229 -2.413 -13.102 1.00 0.00 H new ATOM 1451 N GLN A 810 -4.879 0.502 -9.044 1.00 0.00 N ATOM 1452 CA GLN A 810 -4.742 1.954 -8.940 1.00 0.00 C ATOM 1453 C GLN A 810 -3.261 2.323 -8.726 1.00 0.00 C ATOM 1454 O GLN A 810 -2.431 1.415 -8.621 1.00 0.00 O ATOM 1455 CB GLN A 810 -5.645 2.504 -7.823 1.00 0.00 C ATOM 1456 CG GLN A 810 -6.810 3.331 -8.365 1.00 0.00 C ATOM 1457 CD GLN A 810 -7.596 4.054 -7.286 1.00 0.00 C ATOM 1458 OE1 GLN A 810 -7.262 5.175 -6.906 1.00 0.00 O ATOM 1459 NE2 GLN A 810 -8.663 3.430 -6.817 1.00 0.00 N ATOM 0 H GLN A 810 -4.312 -0.019 -8.375 1.00 0.00 H new ATOM 0 HA GLN A 810 -5.070 2.418 -9.870 1.00 0.00 H new ATOM 0 HB2 GLN A 810 -6.036 1.674 -7.235 1.00 0.00 H new ATOM 0 HB3 GLN A 810 -5.049 3.120 -7.149 1.00 0.00 H new ATOM 0 HG2 GLN A 810 -6.425 4.063 -9.075 1.00 0.00 H new ATOM 0 HG3 GLN A 810 -7.484 2.676 -8.917 1.00 0.00 H new ATOM 0 HE21 GLN A 810 -8.902 2.500 -7.161 1.00 0.00 H new ATOM 0 HE22 GLN A 810 -9.247 3.878 -6.111 1.00 0.00 H new ATOM 1468 N PRO A 811 -2.895 3.634 -8.706 1.00 0.00 N ATOM 1469 CA PRO A 811 -1.493 4.085 -8.563 1.00 0.00 C ATOM 1470 C PRO A 811 -0.685 3.336 -7.496 1.00 0.00 C ATOM 1471 O PRO A 811 -1.231 2.832 -6.515 1.00 0.00 O ATOM 1472 CB PRO A 811 -1.647 5.546 -8.158 1.00 0.00 C ATOM 1473 CG PRO A 811 -2.898 5.989 -8.826 1.00 0.00 C ATOM 1474 CD PRO A 811 -3.806 4.789 -8.871 1.00 0.00 C ATOM 0 HA PRO A 811 -0.937 3.909 -9.484 1.00 0.00 H new ATOM 0 HB2 PRO A 811 -1.716 5.652 -7.075 1.00 0.00 H new ATOM 0 HB3 PRO A 811 -0.792 6.140 -8.482 1.00 0.00 H new ATOM 0 HG2 PRO A 811 -3.363 6.807 -8.276 1.00 0.00 H new ATOM 0 HG3 PRO A 811 -2.692 6.357 -9.831 1.00 0.00 H new ATOM 0 HD2 PRO A 811 -4.551 4.824 -8.076 1.00 0.00 H new ATOM 0 HD3 PRO A 811 -4.349 4.736 -9.815 1.00 0.00 H new ATOM 1482 N ASP A 812 0.629 3.290 -7.705 1.00 0.00 N ATOM 1483 CA ASP A 812 1.541 2.559 -6.827 1.00 0.00 C ATOM 1484 C ASP A 812 2.621 3.477 -6.263 1.00 0.00 C ATOM 1485 O ASP A 812 2.832 4.593 -6.743 1.00 0.00 O ATOM 1486 CB ASP A 812 2.197 1.393 -7.572 1.00 0.00 C ATOM 1487 CG ASP A 812 2.919 1.830 -8.832 1.00 0.00 C ATOM 1488 OD1 ASP A 812 2.244 2.185 -9.820 1.00 0.00 O ATOM 1489 OD2 ASP A 812 4.167 1.813 -8.847 1.00 0.00 O ATOM 0 H ASP A 812 1.091 3.757 -8.485 1.00 0.00 H new ATOM 0 HA ASP A 812 0.950 2.166 -6.000 1.00 0.00 H new ATOM 0 HB2 ASP A 812 2.904 0.896 -6.908 1.00 0.00 H new ATOM 0 HB3 ASP A 812 1.434 0.659 -7.832 1.00 0.00 H new ATOM 1494 N ALA A 813 3.297 2.982 -5.242 1.00 0.00 N ATOM 1495 CA ALA A 813 4.300 3.742 -4.508 1.00 0.00 C ATOM 1496 C ALA A 813 5.646 3.036 -4.574 1.00 0.00 C ATOM 1497 O ALA A 813 5.804 1.960 -4.015 1.00 0.00 O ATOM 1498 CB ALA A 813 3.872 3.862 -3.065 1.00 0.00 C ATOM 0 H ALA A 813 3.166 2.032 -4.894 1.00 0.00 H new ATOM 0 HA ALA A 813 4.395 4.732 -4.954 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.619 4.430 -2.510 1.00 0.00 H new ATOM 0 HB2 ALA A 813 2.912 4.376 -3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 813 3.776 2.867 -2.630 1.00 0.00 H new ATOM 1504 N LYS A 814 6.620 3.622 -5.240 1.00 0.00 N ATOM 1505 CA LYS A 814 7.905 2.968 -5.379 1.00 0.00 C ATOM 1506 C LYS A 814 8.875 3.401 -4.281 1.00 0.00 C ATOM 1507 O LYS A 814 9.316 4.546 -4.231 1.00 0.00 O ATOM 1508 CB LYS A 814 8.507 3.245 -6.752 1.00 0.00 C ATOM 1509 CG LYS A 814 9.692 2.353 -7.056 1.00 0.00 C ATOM 1510 CD LYS A 814 10.403 2.769 -8.332 1.00 0.00 C ATOM 1511 CE LYS A 814 11.762 2.099 -8.441 1.00 0.00 C ATOM 1512 NZ LYS A 814 12.648 2.469 -7.305 1.00 0.00 N ATOM 0 H LYS A 814 6.549 4.536 -5.687 1.00 0.00 H new ATOM 0 HA LYS A 814 7.738 1.896 -5.278 1.00 0.00 H new ATOM 0 HB2 LYS A 814 7.743 3.101 -7.516 1.00 0.00 H new ATOM 0 HB3 LYS A 814 8.819 4.288 -6.805 1.00 0.00 H new ATOM 0 HG2 LYS A 814 10.394 2.385 -6.223 1.00 0.00 H new ATOM 0 HG3 LYS A 814 9.355 1.321 -7.149 1.00 0.00 H new ATOM 0 HD2 LYS A 814 9.793 2.504 -9.195 1.00 0.00 H new ATOM 0 HD3 LYS A 814 10.525 3.852 -8.348 1.00 0.00 H new ATOM 0 HE2 LYS A 814 11.634 1.017 -8.466 1.00 0.00 H new ATOM 0 HE3 LYS A 814 12.235 2.385 -9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 814 13.602 2.091 -7.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 814 12.695 3.505 -7.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 814 12.267 2.070 -6.423 1.00 0.00 H new ATOM 1526 N ILE A 815 9.196 2.463 -3.411 1.00 0.00 N ATOM 1527 CA ILE A 815 10.170 2.666 -2.354 1.00 0.00 C ATOM 1528 C ILE A 815 11.538 2.206 -2.837 1.00 0.00 C ATOM 1529 O ILE A 815 11.662 1.148 -3.459 1.00 0.00 O ATOM 1530 CB ILE A 815 9.804 1.877 -1.072 1.00 0.00 C ATOM 1531 CG1 ILE A 815 8.432 2.292 -0.531 1.00 0.00 C ATOM 1532 CG2 ILE A 815 10.870 2.065 -0.004 1.00 0.00 C ATOM 1533 CD1 ILE A 815 7.268 1.605 -1.211 1.00 0.00 C ATOM 0 H ILE A 815 8.785 1.530 -3.417 1.00 0.00 H new ATOM 0 HA ILE A 815 10.179 3.728 -2.111 1.00 0.00 H new ATOM 0 HB ILE A 815 9.755 0.821 -1.338 1.00 0.00 H new ATOM 0 HG12 ILE A 815 8.394 2.077 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 815 8.320 3.370 -0.643 1.00 0.00 H new ATOM 0 HG21 ILE A 815 10.594 1.503 0.888 1.00 0.00 H new ATOM 0 HG22 ILE A 815 11.828 1.704 -0.379 1.00 0.00 H new ATOM 0 HG23 ILE A 815 10.953 3.123 0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.333 1.953 -0.771 1.00 0.00 H new ATOM 0 HD12 ILE A 815 7.278 1.840 -2.275 1.00 0.00 H new ATOM 0 HD13 ILE A 815 7.353 0.527 -1.077 1.00 0.00 H new ATOM 1545 N GLN A 816 12.554 3.000 -2.569 1.00 0.00 N ATOM 1546 CA GLN A 816 13.904 2.653 -2.950 1.00 0.00 C ATOM 1547 C GLN A 816 14.834 2.781 -1.748 1.00 0.00 C ATOM 1548 O GLN A 816 15.177 3.886 -1.328 1.00 0.00 O ATOM 1549 CB GLN A 816 14.352 3.574 -4.066 1.00 0.00 C ATOM 1550 CG GLN A 816 15.408 2.976 -4.968 1.00 0.00 C ATOM 1551 CD GLN A 816 16.795 2.965 -4.362 1.00 0.00 C ATOM 1552 OE1 GLN A 816 17.538 3.940 -4.473 1.00 0.00 O ATOM 1553 NE2 GLN A 816 17.169 1.861 -3.738 1.00 0.00 N ATOM 0 H GLN A 816 12.468 3.894 -2.086 1.00 0.00 H new ATOM 0 HA GLN A 816 13.936 1.621 -3.299 1.00 0.00 H new ATOM 0 HB2 GLN A 816 13.486 3.847 -4.669 1.00 0.00 H new ATOM 0 HB3 GLN A 816 14.740 4.495 -3.630 1.00 0.00 H new ATOM 0 HG2 GLN A 816 15.123 1.954 -5.218 1.00 0.00 H new ATOM 0 HG3 GLN A 816 15.434 3.537 -5.902 1.00 0.00 H new ATOM 0 HE21 GLN A 816 16.525 1.073 -3.666 1.00 0.00 H new ATOM 0 HE22 GLN A 816 18.101 1.797 -3.329 1.00 0.00 H new ATOM 1562 N VAL A 817 15.255 1.652 -1.213 1.00 0.00 N ATOM 1563 CA VAL A 817 16.163 1.636 -0.074 1.00 0.00 C ATOM 1564 C VAL A 817 17.573 1.301 -0.521 1.00 0.00 C ATOM 1565 O VAL A 817 17.781 0.505 -1.427 1.00 0.00 O ATOM 1566 CB VAL A 817 15.702 0.669 1.040 1.00 0.00 C ATOM 1567 CG1 VAL A 817 14.946 -0.470 0.464 1.00 0.00 C ATOM 1568 CG2 VAL A 817 16.848 0.196 1.897 1.00 0.00 C ATOM 0 H VAL A 817 14.983 0.728 -1.548 1.00 0.00 H new ATOM 0 HA VAL A 817 16.153 2.639 0.353 1.00 0.00 H new ATOM 0 HB VAL A 817 15.034 1.224 1.698 1.00 0.00 H new ATOM 0 HG11 VAL A 817 14.630 -1.139 1.264 1.00 0.00 H new ATOM 0 HG12 VAL A 817 14.068 -0.095 -0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 817 15.583 -1.014 -0.234 1.00 0.00 H new ATOM 0 HG21 VAL A 817 16.473 -0.481 2.665 1.00 0.00 H new ATOM 0 HG22 VAL A 817 17.575 -0.327 1.276 1.00 0.00 H new ATOM 0 HG23 VAL A 817 17.326 1.053 2.371 1.00 0.00 H new ATOM 1578 N ARG A 818 18.534 1.938 0.097 1.00 0.00 N ATOM 1579 CA ARG A 818 19.931 1.656 -0.160 1.00 0.00 C ATOM 1580 C ARG A 818 20.651 1.525 1.163 1.00 0.00 C ATOM 1581 O ARG A 818 20.053 1.720 2.209 1.00 0.00 O ATOM 1582 CB ARG A 818 20.584 2.766 -0.991 1.00 0.00 C ATOM 1583 CG ARG A 818 20.129 2.818 -2.438 1.00 0.00 C ATOM 1584 CD ARG A 818 20.539 1.570 -3.198 1.00 0.00 C ATOM 1585 NE ARG A 818 20.172 1.649 -4.608 1.00 0.00 N ATOM 1586 CZ ARG A 818 20.016 0.590 -5.401 1.00 0.00 C ATOM 1587 NH1 ARG A 818 20.176 -0.635 -4.920 1.00 0.00 N ATOM 1588 NH2 ARG A 818 19.693 0.759 -6.674 1.00 0.00 N ATOM 0 H ARG A 818 18.375 2.667 0.793 1.00 0.00 H new ATOM 0 HA ARG A 818 20.001 0.729 -0.729 1.00 0.00 H new ATOM 0 HB2 ARG A 818 20.372 3.727 -0.522 1.00 0.00 H new ATOM 0 HB3 ARG A 818 21.665 2.632 -0.968 1.00 0.00 H new ATOM 0 HG2 ARG A 818 19.045 2.928 -2.475 1.00 0.00 H new ATOM 0 HG3 ARG A 818 20.555 3.696 -2.923 1.00 0.00 H new ATOM 0 HD2 ARG A 818 21.616 1.428 -3.110 1.00 0.00 H new ATOM 0 HD3 ARG A 818 20.065 0.698 -2.747 1.00 0.00 H new ATOM 0 HE ARG A 818 20.026 2.574 -5.012 1.00 0.00 H new ATOM 0 HH11 ARG A 818 20.420 -0.770 -3.939 1.00 0.00 H new ATOM 0 HH12 ARG A 818 20.055 -1.443 -5.531 1.00 0.00 H new ATOM 0 HH21 ARG A 818 19.564 1.700 -7.047 1.00 0.00 H new ATOM 0 HH22 ARG A 818 19.573 -0.051 -7.282 1.00 0.00 H new ATOM 1602 N ARG A 819 21.918 1.179 1.126 1.00 0.00 N ATOM 1603 CA ARG A 819 22.721 1.168 2.333 1.00 0.00 C ATOM 1604 C ARG A 819 23.062 2.596 2.734 1.00 0.00 C ATOM 1605 O ARG A 819 23.108 3.489 1.884 1.00 0.00 O ATOM 1606 CB ARG A 819 23.988 0.364 2.118 1.00 0.00 C ATOM 1607 CG ARG A 819 23.849 -1.111 2.457 1.00 0.00 C ATOM 1608 CD ARG A 819 22.860 -1.819 1.545 1.00 0.00 C ATOM 1609 NE ARG A 819 23.369 -1.968 0.184 1.00 0.00 N ATOM 1610 CZ ARG A 819 23.032 -2.967 -0.633 1.00 0.00 C ATOM 1611 NH1 ARG A 819 22.235 -3.943 -0.210 1.00 0.00 N ATOM 1612 NH2 ARG A 819 23.509 -3.002 -1.870 1.00 0.00 N ATOM 0 H ARG A 819 22.415 0.902 0.279 1.00 0.00 H new ATOM 0 HA ARG A 819 22.150 0.699 3.135 1.00 0.00 H new ATOM 0 HB2 ARG A 819 24.294 0.460 1.076 1.00 0.00 H new ATOM 0 HB3 ARG A 819 24.785 0.792 2.725 1.00 0.00 H new ATOM 0 HG2 ARG A 819 24.823 -1.594 2.378 1.00 0.00 H new ATOM 0 HG3 ARG A 819 23.525 -1.215 3.492 1.00 0.00 H new ATOM 0 HD2 ARG A 819 22.632 -2.803 1.955 1.00 0.00 H new ATOM 0 HD3 ARG A 819 21.925 -1.259 1.522 1.00 0.00 H new ATOM 0 HE ARG A 819 24.022 -1.265 -0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 819 21.877 -3.931 0.745 1.00 0.00 H new ATOM 0 HH12 ARG A 819 21.982 -4.704 -0.840 1.00 0.00 H new ATOM 0 HH21 ARG A 819 24.134 -2.265 -2.197 1.00 0.00 H new ATOM 0 HH22 ARG A 819 23.251 -3.766 -2.495 1.00 0.00 H new ATOM 1626 N ASP A 820 23.288 2.817 4.017 1.00 0.00 N ATOM 1627 CA ASP A 820 23.595 4.150 4.511 1.00 0.00 C ATOM 1628 C ASP A 820 25.046 4.495 4.211 1.00 0.00 C ATOM 1629 O ASP A 820 25.333 5.560 3.669 1.00 99.99 O ATOM 1630 CB ASP A 820 23.324 4.263 6.015 1.00 0.00 C ATOM 1631 CG ASP A 820 24.299 3.462 6.851 1.00 0.00 C ATOM 1632 OD1 ASP A 820 24.110 2.235 6.974 1.00 0.00 O ATOM 1633 OD2 ASP A 820 25.249 4.057 7.402 1.00 0.00 O ATOM 0 H ASP A 820 23.265 2.093 4.735 1.00 0.00 H new ATOM 0 HA ASP A 820 22.944 4.859 3.999 1.00 0.00 H new ATOM 0 HB2 ASP A 820 23.375 5.311 6.311 1.00 0.00 H new ATOM 0 HB3 ASP A 820 22.310 3.922 6.223 1.00 0.00 H new TER 1638 ASP A 820