USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 541 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 43 ASN : amide:sc= -2.22! C(o=-2.2!,f=-4.2!) USER MOD Set 1.2: A 92 SER OG : rot 160:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -135:sc= 1.08 (180deg=0.0312!) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.0966 F(o=-0.98,f=-0.097) USER MOD Single : A 53 SER OG : rot 180:sc= -0.256 USER MOD Single : A 62 GLN :FLIP amide:sc= 0 F(o=-0.83,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -2.19! C(o=-2.2!,f=-3.4!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 68:sc= 0.283 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot -37:sc= 0.0962 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 675 N ASN A 43 14.314 -2.158 -2.356 1.00 0.00 N ATOM 676 CA ASN A 43 15.203 -1.788 -1.300 1.00 0.00 C ATOM 677 C ASN A 43 16.573 -2.255 -1.632 1.00 0.00 C ATOM 678 O ASN A 43 16.735 -3.305 -2.250 1.00 0.00 O ATOM 679 CB ASN A 43 14.769 -2.400 0.035 1.00 0.00 C ATOM 680 CG ASN A 43 13.358 -2.031 0.442 1.00 0.00 C ATOM 681 OD1 ASN A 43 13.124 -0.986 1.042 1.00 0.00 O ATOM 682 ND2 ASN A 43 12.417 -2.910 0.186 1.00 0.00 N ATOM 0 HA ASN A 43 15.184 -0.703 -1.199 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.847 -3.485 -0.030 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.459 -2.077 0.814 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.459 -2.734 0.488 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.644 -3.769 -0.315 1.00 0.00 H new ATOM 689 N LEU A 44 17.556 -1.488 -1.255 1.00 0.00 N ATOM 690 CA LEU A 44 18.929 -1.854 -1.511 1.00 0.00 C ATOM 691 C LEU A 44 19.784 -1.666 -0.274 1.00 0.00 C ATOM 692 O LEU A 44 19.409 -0.947 0.683 1.00 0.00 O ATOM 693 CB LEU A 44 19.541 -1.045 -2.680 1.00 0.00 C ATOM 694 CG LEU A 44 18.930 -1.236 -4.081 1.00 0.00 C ATOM 695 CD1 LEU A 44 19.681 -0.396 -5.098 1.00 0.00 C ATOM 696 CD2 LEU A 44 18.970 -2.695 -4.499 1.00 0.00 C ATOM 0 H LEU A 44 17.436 -0.600 -0.767 1.00 0.00 H new ATOM 0 HA LEU A 44 18.919 -2.908 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 44 19.474 0.013 -2.427 1.00 0.00 H new ATOM 0 HB3 LEU A 44 20.601 -1.292 -2.740 1.00 0.00 H new ATOM 0 HG LEU A 44 17.889 -0.914 -4.040 1.00 0.00 H new ATOM 0 HD11 LEU A 44 19.240 -0.539 -6.085 1.00 0.00 H new ATOM 0 HD12 LEU A 44 19.616 0.656 -4.820 1.00 0.00 H new ATOM 0 HD13 LEU A 44 20.727 -0.701 -5.120 1.00 0.00 H new ATOM 0 HD21 LEU A 44 18.532 -2.801 -5.492 1.00 0.00 H new ATOM 0 HD22 LEU A 44 20.004 -3.039 -4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 44 18.402 -3.293 -3.786 1.00 0.00 H new ATOM 708 N ILE A 45 20.900 -2.330 -0.281 1.00 0.00 N ATOM 709 CA ILE A 45 21.908 -2.189 0.712 1.00 0.00 C ATOM 710 C ILE A 45 23.220 -1.848 0.050 1.00 0.00 C ATOM 711 O ILE A 45 23.606 -2.460 -0.958 1.00 0.00 O ATOM 712 CB ILE A 45 22.030 -3.425 1.672 1.00 0.00 C ATOM 713 CG1 ILE A 45 23.438 -3.553 2.205 1.00 0.00 C ATOM 714 CG2 ILE A 45 21.709 -4.664 0.970 1.00 0.00 C ATOM 715 CD1 ILE A 45 23.607 -4.474 3.376 1.00 0.00 C ATOM 0 H ILE A 45 21.137 -3.007 -1.006 1.00 0.00 H new ATOM 0 HA ILE A 45 21.612 -1.368 1.365 1.00 0.00 H new ATOM 0 HB ILE A 45 21.328 -3.263 2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 45 24.083 -3.899 1.397 1.00 0.00 H new ATOM 0 HG13 ILE A 45 23.790 -2.562 2.491 1.00 0.00 H new ATOM 0 HG21 ILE A 45 21.801 -5.506 1.657 1.00 0.00 H new ATOM 0 HG22 ILE A 45 20.688 -4.614 0.592 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.398 -4.799 0.136 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.654 -4.491 3.677 1.00 0.00 H new ATOM 0 HD12 ILE A 45 22.996 -4.122 4.207 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.293 -5.480 3.096 1.00 0.00 H new ATOM 727 N VAL A 46 23.877 -0.869 0.600 1.00 0.00 N ATOM 728 CA VAL A 46 25.095 -0.372 0.064 1.00 0.00 C ATOM 729 C VAL A 46 26.255 -0.677 1.031 1.00 0.00 C ATOM 730 O VAL A 46 26.183 -0.394 2.234 1.00 0.00 O ATOM 731 CB VAL A 46 24.973 1.142 -0.225 1.00 0.00 C ATOM 732 CG1 VAL A 46 26.265 1.697 -0.759 1.00 0.00 C ATOM 733 CG2 VAL A 46 23.849 1.411 -1.212 1.00 0.00 C ATOM 0 H VAL A 46 23.570 -0.391 1.447 1.00 0.00 H new ATOM 0 HA VAL A 46 25.307 -0.871 -0.882 1.00 0.00 H new ATOM 0 HB VAL A 46 24.745 1.641 0.717 1.00 0.00 H new ATOM 0 HG11 VAL A 46 26.150 2.763 -0.953 1.00 0.00 H new ATOM 0 HG12 VAL A 46 27.057 1.545 -0.026 1.00 0.00 H new ATOM 0 HG13 VAL A 46 26.525 1.185 -1.686 1.00 0.00 H new ATOM 0 HG21 VAL A 46 23.780 2.482 -1.402 1.00 0.00 H new ATOM 0 HG22 VAL A 46 24.053 0.889 -2.147 1.00 0.00 H new ATOM 0 HG23 VAL A 46 22.907 1.055 -0.796 1.00 0.00 H new ATOM 743 N LYS A 47 27.283 -1.284 0.504 1.00 0.00 N ATOM 744 CA LYS A 47 28.461 -1.708 1.259 1.00 0.00 C ATOM 745 C LYS A 47 29.705 -1.327 0.479 1.00 0.00 C ATOM 746 O LYS A 47 29.815 -1.660 -0.682 1.00 0.00 O ATOM 747 CB LYS A 47 28.436 -3.233 1.414 1.00 0.00 C ATOM 748 CG LYS A 47 27.282 -3.786 2.247 1.00 0.00 C ATOM 749 CD LYS A 47 27.504 -3.630 3.748 1.00 0.00 C ATOM 750 CE LYS A 47 28.727 -4.417 4.185 1.00 0.00 C ATOM 751 NZ LYS A 47 28.773 -4.656 5.636 1.00 0.00 N ATOM 0 H LYS A 47 27.339 -1.510 -0.489 1.00 0.00 H new ATOM 0 HA LYS A 47 28.463 -1.230 2.239 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.394 -3.682 0.422 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.375 -3.551 1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 47 26.361 -3.275 1.966 1.00 0.00 H new ATOM 0 HG3 LYS A 47 27.145 -4.842 2.013 1.00 0.00 H new ATOM 0 HD2 LYS A 47 27.634 -2.576 3.996 1.00 0.00 H new ATOM 0 HD3 LYS A 47 26.626 -3.979 4.291 1.00 0.00 H new ATOM 0 HE2 LYS A 47 28.740 -5.375 3.665 1.00 0.00 H new ATOM 0 HE3 LYS A 47 29.625 -3.878 3.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 29.732 -4.463 5.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 28.095 -4.028 6.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 28.525 -5.647 5.833 1.00 0.00 H new ATOM 764 N ALA A 48 30.639 -0.655 1.098 1.00 0.00 N ATOM 765 CA ALA A 48 31.840 -0.244 0.397 1.00 0.00 C ATOM 766 C ALA A 48 33.024 -0.205 1.332 1.00 0.00 C ATOM 767 O ALA A 48 32.853 -0.264 2.552 1.00 0.00 O ATOM 768 CB ALA A 48 31.638 1.109 -0.279 1.00 0.00 C ATOM 0 H ALA A 48 30.598 -0.379 2.079 1.00 0.00 H new ATOM 0 HA ALA A 48 32.047 -0.982 -0.378 1.00 0.00 H new ATOM 0 HB1 ALA A 48 32.552 1.396 -0.798 1.00 0.00 H new ATOM 0 HB2 ALA A 48 30.820 1.039 -0.996 1.00 0.00 H new ATOM 0 HB3 ALA A 48 31.397 1.860 0.474 1.00 0.00 H new ATOM 774 N ASP A 49 34.218 -0.082 0.753 1.00 0.00 N ATOM 775 CA ASP A 49 35.483 -0.062 1.497 1.00 0.00 C ATOM 776 C ASP A 49 35.633 1.227 2.302 1.00 0.00 C ATOM 777 O ASP A 49 36.400 1.293 3.277 1.00 0.00 O ATOM 778 CB ASP A 49 36.681 -0.260 0.544 1.00 0.00 C ATOM 779 CG ASP A 49 36.932 0.911 -0.394 1.00 0.00 C ATOM 780 OD1 ASP A 49 36.095 1.165 -1.297 1.00 0.00 O ATOM 781 OD2 ASP A 49 37.992 1.570 -0.270 1.00 0.00 O ATOM 0 H ASP A 49 34.339 0.008 -0.256 1.00 0.00 H new ATOM 0 HA ASP A 49 35.468 -0.892 2.203 1.00 0.00 H new ATOM 0 HB2 ASP A 49 37.578 -0.434 1.138 1.00 0.00 H new ATOM 0 HB3 ASP A 49 36.513 -1.158 -0.051 1.00 0.00 H new ATOM 786 N VAL A 50 34.915 2.251 1.889 1.00 0.00 N ATOM 787 CA VAL A 50 34.849 3.496 2.621 1.00 0.00 C ATOM 788 C VAL A 50 33.393 3.905 2.803 1.00 0.00 C ATOM 789 O VAL A 50 32.574 3.762 1.875 1.00 0.00 O ATOM 790 CB VAL A 50 35.677 4.663 1.987 1.00 0.00 C ATOM 791 CG1 VAL A 50 37.166 4.426 2.139 1.00 0.00 C ATOM 792 CG2 VAL A 50 35.347 4.857 0.527 1.00 0.00 C ATOM 0 H VAL A 50 34.360 2.242 1.033 1.00 0.00 H new ATOM 0 HA VAL A 50 35.315 3.309 3.589 1.00 0.00 H new ATOM 0 HB VAL A 50 35.402 5.569 2.528 1.00 0.00 H new ATOM 0 HG11 VAL A 50 37.714 5.254 1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 50 37.417 4.357 3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 50 37.439 3.496 1.640 1.00 0.00 H new ATOM 0 HG21 VAL A 50 35.943 5.676 0.125 1.00 0.00 H new ATOM 0 HG22 VAL A 50 35.571 3.942 -0.021 1.00 0.00 H new ATOM 0 HG23 VAL A 50 34.288 5.093 0.422 1.00 0.00 H new ATOM 802 N GLN A 51 33.059 4.425 3.982 1.00 0.00 N ATOM 803 CA GLN A 51 31.679 4.788 4.290 1.00 0.00 C ATOM 804 C GLN A 51 31.177 5.969 3.491 1.00 0.00 C ATOM 805 O GLN A 51 30.033 6.297 3.547 1.00 0.00 O ATOM 806 CB GLN A 51 31.389 4.950 5.812 1.00 0.00 C ATOM 807 CG GLN A 51 32.346 5.833 6.602 1.00 0.00 C ATOM 808 CD GLN A 51 32.240 7.333 6.316 1.00 0.00 C ATOM 809 OE1 GLN A 51 31.053 7.817 6.024 1.00 0.00 O flip ATOM 810 NE2 GLN A 51 33.226 8.051 6.398 1.00 0.00 N flip ATOM 0 H GLN A 51 33.722 4.604 4.736 1.00 0.00 H new ATOM 0 HA GLN A 51 31.099 3.923 3.967 1.00 0.00 H new ATOM 0 HB2 GLN A 51 30.383 5.353 5.925 1.00 0.00 H new ATOM 0 HB3 GLN A 51 31.388 3.959 6.265 1.00 0.00 H new ATOM 0 HG2 GLN A 51 32.171 5.669 7.665 1.00 0.00 H new ATOM 0 HG3 GLN A 51 33.366 5.511 6.394 1.00 0.00 H new ATOM 0 HE21 GLN A 51 34.134 7.646 6.626 1.00 0.00 H new ATOM 0 HE22 GLN A 51 33.141 9.055 6.238 1.00 0.00 H new ATOM 819 N GLY A 52 32.022 6.599 2.750 1.00 0.00 N ATOM 820 CA GLY A 52 31.548 7.681 1.959 1.00 0.00 C ATOM 821 C GLY A 52 31.151 7.247 0.580 1.00 0.00 C ATOM 822 O GLY A 52 30.451 7.975 -0.115 1.00 0.00 O ATOM 0 H GLY A 52 33.018 6.392 2.675 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.692 8.142 2.453 1.00 0.00 H new ATOM 0 HA3 GLY A 52 32.324 8.443 1.888 1.00 0.00 H new ATOM 826 N SER A 53 31.533 6.032 0.190 1.00 0.00 N ATOM 827 CA SER A 53 31.120 5.528 -1.095 1.00 0.00 C ATOM 828 C SER A 53 29.744 5.005 -0.904 1.00 0.00 C ATOM 829 O SER A 53 28.907 5.041 -1.803 1.00 0.00 O ATOM 830 CB SER A 53 32.049 4.431 -1.610 1.00 0.00 C ATOM 831 OG SER A 53 33.362 4.910 -1.790 1.00 0.00 O ATOM 0 H SER A 53 32.115 5.399 0.739 1.00 0.00 H new ATOM 0 HA SER A 53 31.155 6.319 -1.844 1.00 0.00 H new ATOM 0 HB2 SER A 53 32.057 3.599 -0.906 1.00 0.00 H new ATOM 0 HB3 SER A 53 31.669 4.044 -2.555 1.00 0.00 H new ATOM 0 HG SER A 53 33.933 4.184 -2.119 1.00 0.00 H new ATOM 837 N VAL A 54 29.487 4.562 0.326 1.00 0.00 N ATOM 838 CA VAL A 54 28.192 4.144 0.659 1.00 0.00 C ATOM 839 C VAL A 54 27.288 5.364 0.722 1.00 0.00 C ATOM 840 O VAL A 54 26.240 5.366 0.134 1.00 0.00 O ATOM 841 CB VAL A 54 28.097 3.296 1.956 1.00 0.00 C ATOM 842 CG1 VAL A 54 29.007 2.103 1.941 1.00 0.00 C ATOM 843 CG2 VAL A 54 28.236 4.058 3.238 1.00 0.00 C ATOM 0 H VAL A 54 30.173 4.496 1.078 1.00 0.00 H new ATOM 0 HA VAL A 54 27.863 3.463 -0.126 1.00 0.00 H new ATOM 0 HB VAL A 54 27.066 2.944 1.942 1.00 0.00 H new ATOM 0 HG11 VAL A 54 28.896 1.549 2.873 1.00 0.00 H new ATOM 0 HG12 VAL A 54 28.747 1.457 1.102 1.00 0.00 H new ATOM 0 HG13 VAL A 54 30.040 2.435 1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.154 3.371 4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 54 29.208 4.551 3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 54 27.447 4.807 3.303 1.00 0.00 H new ATOM 853 N GLU A 55 27.775 6.435 1.369 1.00 0.00 N ATOM 854 CA GLU A 55 27.026 7.694 1.482 1.00 0.00 C ATOM 855 C GLU A 55 26.714 8.273 0.123 1.00 0.00 C ATOM 856 O GLU A 55 25.599 8.683 -0.127 1.00 0.00 O ATOM 857 CB GLU A 55 27.783 8.740 2.292 1.00 0.00 C ATOM 858 CG GLU A 55 27.953 8.416 3.758 1.00 0.00 C ATOM 859 CD GLU A 55 26.646 8.260 4.490 1.00 0.00 C ATOM 860 OE1 GLU A 55 25.868 9.236 4.563 1.00 0.00 O ATOM 861 OE2 GLU A 55 26.378 7.164 5.030 1.00 0.00 O ATOM 0 H GLU A 55 28.688 6.452 1.823 1.00 0.00 H new ATOM 0 HA GLU A 55 26.099 7.447 1.999 1.00 0.00 H new ATOM 0 HB2 GLU A 55 28.770 8.876 1.849 1.00 0.00 H new ATOM 0 HB3 GLU A 55 27.261 9.693 2.205 1.00 0.00 H new ATOM 0 HG2 GLU A 55 28.528 7.495 3.855 1.00 0.00 H new ATOM 0 HG3 GLU A 55 28.535 9.206 4.232 1.00 0.00 H new ATOM 868 N ALA A 56 27.706 8.289 -0.749 1.00 0.00 N ATOM 869 CA ALA A 56 27.548 8.818 -2.099 1.00 0.00 C ATOM 870 C ALA A 56 26.444 8.089 -2.858 1.00 0.00 C ATOM 871 O ALA A 56 25.623 8.719 -3.543 1.00 0.00 O ATOM 872 CB ALA A 56 28.853 8.728 -2.859 1.00 0.00 C ATOM 0 H ALA A 56 28.642 7.938 -0.546 1.00 0.00 H new ATOM 0 HA ALA A 56 27.260 9.866 -2.012 1.00 0.00 H new ATOM 0 HB1 ALA A 56 28.717 9.127 -3.864 1.00 0.00 H new ATOM 0 HB2 ALA A 56 29.617 9.306 -2.339 1.00 0.00 H new ATOM 0 HB3 ALA A 56 29.166 7.686 -2.922 1.00 0.00 H new ATOM 878 N LEU A 57 26.403 6.781 -2.718 1.00 0.00 N ATOM 879 CA LEU A 57 25.389 5.996 -3.371 1.00 0.00 C ATOM 880 C LEU A 57 24.049 6.153 -2.646 1.00 0.00 C ATOM 881 O LEU A 57 23.018 6.347 -3.280 1.00 0.00 O ATOM 882 CB LEU A 57 25.834 4.531 -3.491 1.00 0.00 C ATOM 883 CG LEU A 57 24.884 3.567 -4.213 1.00 0.00 C ATOM 884 CD1 LEU A 57 24.511 4.100 -5.593 1.00 0.00 C ATOM 885 CD2 LEU A 57 25.547 2.211 -4.363 1.00 0.00 C ATOM 0 H LEU A 57 27.063 6.243 -2.156 1.00 0.00 H new ATOM 0 HA LEU A 57 25.246 6.362 -4.388 1.00 0.00 H new ATOM 0 HB2 LEU A 57 26.793 4.511 -4.008 1.00 0.00 H new ATOM 0 HB3 LEU A 57 26.006 4.147 -2.486 1.00 0.00 H new ATOM 0 HG LEU A 57 23.976 3.473 -3.617 1.00 0.00 H new ATOM 0 HD11 LEU A 57 23.837 3.398 -6.084 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.016 5.066 -5.489 1.00 0.00 H new ATOM 0 HD13 LEU A 57 25.413 4.217 -6.194 1.00 0.00 H new ATOM 0 HD21 LEU A 57 24.869 1.529 -4.876 1.00 0.00 H new ATOM 0 HD22 LEU A 57 26.464 2.316 -4.943 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.786 1.812 -3.377 1.00 0.00 H new ATOM 897 N VAL A 58 24.088 6.135 -1.317 1.00 0.00 N ATOM 898 CA VAL A 58 22.904 6.347 -0.477 1.00 0.00 C ATOM 899 C VAL A 58 22.233 7.661 -0.801 1.00 0.00 C ATOM 900 O VAL A 58 21.033 7.709 -0.992 1.00 0.00 O ATOM 901 CB VAL A 58 23.259 6.303 1.039 1.00 0.00 C ATOM 902 CG1 VAL A 58 22.136 6.867 1.909 1.00 0.00 C ATOM 903 CG2 VAL A 58 23.538 4.882 1.448 1.00 0.00 C ATOM 0 H VAL A 58 24.944 5.973 -0.786 1.00 0.00 H new ATOM 0 HA VAL A 58 22.214 5.532 -0.695 1.00 0.00 H new ATOM 0 HB VAL A 58 24.142 6.924 1.189 1.00 0.00 H new ATOM 0 HG11 VAL A 58 22.428 6.816 2.958 1.00 0.00 H new ATOM 0 HG12 VAL A 58 21.949 7.905 1.634 1.00 0.00 H new ATOM 0 HG13 VAL A 58 21.229 6.283 1.756 1.00 0.00 H new ATOM 0 HG21 VAL A 58 23.786 4.851 2.509 1.00 0.00 H new ATOM 0 HG22 VAL A 58 22.655 4.270 1.264 1.00 0.00 H new ATOM 0 HG23 VAL A 58 24.375 4.494 0.868 1.00 0.00 H new ATOM 913 N ALA A 59 23.019 8.703 -0.922 1.00 0.00 N ATOM 914 CA ALA A 59 22.521 10.042 -1.203 1.00 0.00 C ATOM 915 C ALA A 59 21.828 10.145 -2.562 1.00 0.00 C ATOM 916 O ALA A 59 21.093 11.094 -2.809 1.00 0.00 O ATOM 917 CB ALA A 59 23.629 11.067 -1.080 1.00 0.00 C ATOM 0 H ALA A 59 24.033 8.653 -0.829 1.00 0.00 H new ATOM 0 HA ALA A 59 21.762 10.257 -0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 59 23.232 12.059 -1.295 1.00 0.00 H new ATOM 0 HB2 ALA A 59 24.031 11.048 -0.067 1.00 0.00 H new ATOM 0 HB3 ALA A 59 24.422 10.832 -1.790 1.00 0.00 H new ATOM 923 N ALA A 60 22.051 9.182 -3.427 1.00 0.00 N ATOM 924 CA ALA A 60 21.407 9.173 -4.722 1.00 0.00 C ATOM 925 C ALA A 60 20.216 8.248 -4.655 1.00 0.00 C ATOM 926 O ALA A 60 19.200 8.450 -5.311 1.00 0.00 O ATOM 927 CB ALA A 60 22.374 8.698 -5.785 1.00 0.00 C ATOM 0 H ALA A 60 22.675 8.393 -3.257 1.00 0.00 H new ATOM 0 HA ALA A 60 21.084 10.181 -4.982 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.876 8.696 -6.755 1.00 0.00 H new ATOM 0 HB2 ALA A 60 23.234 9.367 -5.820 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.709 7.688 -5.547 1.00 0.00 H new ATOM 933 N LEU A 61 20.342 7.293 -3.780 1.00 0.00 N ATOM 934 CA LEU A 61 19.398 6.225 -3.592 1.00 0.00 C ATOM 935 C LEU A 61 18.206 6.700 -2.739 1.00 0.00 C ATOM 936 O LEU A 61 17.099 6.225 -2.880 1.00 0.00 O ATOM 937 CB LEU A 61 20.143 5.072 -2.903 1.00 0.00 C ATOM 938 CG LEU A 61 20.132 3.704 -3.582 1.00 0.00 C ATOM 939 CD1 LEU A 61 18.721 3.163 -3.672 1.00 0.00 C ATOM 940 CD2 LEU A 61 20.770 3.781 -4.959 1.00 0.00 C ATOM 0 H LEU A 61 21.141 7.233 -3.149 1.00 0.00 H new ATOM 0 HA LEU A 61 18.994 5.895 -4.549 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.183 5.374 -2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.723 4.953 -1.904 1.00 0.00 H new ATOM 0 HG LEU A 61 20.721 3.017 -2.974 1.00 0.00 H new ATOM 0 HD11 LEU A 61 18.736 2.188 -4.159 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.305 3.062 -2.669 1.00 0.00 H new ATOM 0 HD13 LEU A 61 18.105 3.849 -4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.751 2.795 -5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 61 20.215 4.485 -5.578 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.802 4.118 -4.863 1.00 0.00 H new ATOM 952 N GLN A 62 18.451 7.638 -1.860 1.00 0.00 N ATOM 953 CA GLN A 62 17.391 8.193 -1.036 1.00 0.00 C ATOM 954 C GLN A 62 16.637 9.293 -1.767 1.00 0.00 C ATOM 955 O GLN A 62 15.505 9.614 -1.421 1.00 0.00 O ATOM 956 CB GLN A 62 17.935 8.711 0.302 1.00 0.00 C ATOM 957 CG GLN A 62 19.049 9.738 0.170 1.00 0.00 C ATOM 958 CD GLN A 62 19.577 10.245 1.498 1.00 0.00 C ATOM 959 OE1 GLN A 62 19.485 9.450 2.535 1.00 0.00 O flip ATOM 960 NE2 GLN A 62 20.057 11.372 1.589 1.00 0.00 N flip ATOM 0 H GLN A 62 19.374 8.038 -1.691 1.00 0.00 H new ATOM 0 HA GLN A 62 16.690 7.385 -0.827 1.00 0.00 H new ATOM 0 HB2 GLN A 62 17.115 9.153 0.868 1.00 0.00 H new ATOM 0 HB3 GLN A 62 18.303 7.865 0.883 1.00 0.00 H new ATOM 0 HG2 GLN A 62 19.872 9.297 -0.393 1.00 0.00 H new ATOM 0 HG3 GLN A 62 18.683 10.584 -0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 62 20.116 11.969 0.764 1.00 0.00 H new ATOM 0 HE22 GLN A 62 20.397 11.710 2.489 1.00 0.00 H new ATOM 969 N LYS A 63 17.245 9.847 -2.800 1.00 0.00 N ATOM 970 CA LYS A 63 16.622 10.943 -3.521 1.00 0.00 C ATOM 971 C LYS A 63 15.883 10.445 -4.756 1.00 0.00 C ATOM 972 O LYS A 63 15.407 11.248 -5.566 1.00 0.00 O ATOM 973 CB LYS A 63 17.622 12.055 -3.887 1.00 0.00 C ATOM 974 CG LYS A 63 18.694 11.645 -4.870 1.00 0.00 C ATOM 975 CD LYS A 63 19.609 12.805 -5.255 1.00 0.00 C ATOM 976 CE LYS A 63 18.862 13.923 -5.970 1.00 0.00 C ATOM 977 NZ LYS A 63 19.780 14.977 -6.446 1.00 0.00 N ATOM 0 H LYS A 63 18.157 9.561 -3.155 1.00 0.00 H new ATOM 0 HA LYS A 63 15.893 11.385 -2.842 1.00 0.00 H new ATOM 0 HB2 LYS A 63 17.070 12.898 -4.303 1.00 0.00 H new ATOM 0 HB3 LYS A 63 18.102 12.408 -2.974 1.00 0.00 H new ATOM 0 HG2 LYS A 63 19.292 10.843 -4.437 1.00 0.00 H new ATOM 0 HG3 LYS A 63 18.225 11.243 -5.768 1.00 0.00 H new ATOM 0 HD2 LYS A 63 20.082 13.204 -4.358 1.00 0.00 H new ATOM 0 HD3 LYS A 63 20.407 12.436 -5.899 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.312 13.510 -6.816 1.00 0.00 H new ATOM 0 HE3 LYS A 63 18.126 14.359 -5.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.235 15.721 -6.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 20.286 15.388 -5.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 20.466 14.566 -7.110 1.00 0.00 H new ATOM 1098 N VAL A 71 12.950 3.100 -5.351 1.00 0.00 N ATOM 1099 CA VAL A 71 14.147 2.399 -5.016 1.00 0.00 C ATOM 1100 C VAL A 71 14.786 3.192 -3.902 1.00 0.00 C ATOM 1101 O VAL A 71 14.962 4.392 -4.046 1.00 0.00 O ATOM 1102 CB VAL A 71 15.120 2.321 -6.230 1.00 0.00 C ATOM 1103 CG1 VAL A 71 16.316 1.443 -5.909 1.00 0.00 C ATOM 1104 CG2 VAL A 71 14.406 1.820 -7.486 1.00 0.00 C ATOM 0 HA VAL A 71 13.925 1.373 -4.723 1.00 0.00 H new ATOM 0 HB VAL A 71 15.478 3.331 -6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 71 16.981 1.404 -6.772 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.853 1.857 -5.056 1.00 0.00 H new ATOM 0 HG13 VAL A 71 15.974 0.436 -5.669 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.113 1.777 -8.314 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.002 0.824 -7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.593 2.501 -7.738 1.00 0.00 H new ATOM 1114 N LYS A 72 15.062 2.560 -2.788 1.00 0.00 N ATOM 1115 CA LYS A 72 15.641 3.256 -1.654 1.00 0.00 C ATOM 1116 C LYS A 72 16.426 2.282 -0.772 1.00 0.00 C ATOM 1117 O LYS A 72 16.205 1.075 -0.809 1.00 0.00 O ATOM 1118 CB LYS A 72 14.545 4.074 -0.896 1.00 0.00 C ATOM 1119 CG LYS A 72 15.037 4.888 0.312 1.00 0.00 C ATOM 1120 CD LYS A 72 14.115 6.079 0.621 1.00 0.00 C ATOM 1121 CE LYS A 72 12.674 5.688 0.960 1.00 0.00 C ATOM 1122 NZ LYS A 72 12.543 4.992 2.256 1.00 0.00 N ATOM 0 H LYS A 72 14.897 1.565 -2.637 1.00 0.00 H new ATOM 0 HA LYS A 72 16.368 3.990 -2.000 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.073 4.757 -1.603 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.773 3.384 -0.556 1.00 0.00 H new ATOM 0 HG2 LYS A 72 15.096 4.239 1.186 1.00 0.00 H new ATOM 0 HG3 LYS A 72 16.046 5.252 0.117 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.533 6.640 1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.105 6.748 -0.239 1.00 0.00 H new ATOM 0 HE2 LYS A 72 12.056 6.586 0.974 1.00 0.00 H new ATOM 0 HE3 LYS A 72 12.285 5.045 0.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 11.544 4.756 2.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 13.107 4.118 2.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 12.885 5.611 3.019 1.00 0.00 H new ATOM 1135 N ILE A 73 17.336 2.812 -0.001 1.00 0.00 N ATOM 1136 CA ILE A 73 18.252 2.022 0.798 1.00 0.00 C ATOM 1137 C ILE A 73 17.771 1.787 2.219 1.00 0.00 C ATOM 1138 O ILE A 73 16.941 2.534 2.738 1.00 0.00 O ATOM 1139 CB ILE A 73 19.675 2.647 0.820 1.00 0.00 C ATOM 1140 CG1 ILE A 73 19.647 4.201 0.854 1.00 0.00 C ATOM 1141 CG2 ILE A 73 20.484 2.150 -0.347 1.00 0.00 C ATOM 1142 CD1 ILE A 73 18.986 4.822 2.070 1.00 0.00 C ATOM 0 H ILE A 73 17.469 3.819 0.096 1.00 0.00 H new ATOM 0 HA ILE A 73 18.293 1.049 0.308 1.00 0.00 H new ATOM 0 HB ILE A 73 20.152 2.325 1.746 1.00 0.00 H new ATOM 0 HG12 ILE A 73 20.673 4.566 0.795 1.00 0.00 H new ATOM 0 HG13 ILE A 73 19.131 4.556 -0.038 1.00 0.00 H new ATOM 0 HG21 ILE A 73 21.478 2.597 -0.317 1.00 0.00 H new ATOM 0 HG22 ILE A 73 20.572 1.065 -0.293 1.00 0.00 H new ATOM 0 HG23 ILE A 73 19.989 2.428 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.023 5.908 1.989 1.00 0.00 H new ATOM 0 HD12 ILE A 73 17.947 4.497 2.125 1.00 0.00 H new ATOM 0 HD13 ILE A 73 19.513 4.507 2.971 1.00 0.00 H new ATOM 1154 N ILE A 74 18.266 0.728 2.825 1.00 0.00 N ATOM 1155 CA ILE A 74 17.921 0.408 4.208 1.00 0.00 C ATOM 1156 C ILE A 74 19.180 0.396 5.075 1.00 0.00 C ATOM 1157 O ILE A 74 19.157 0.773 6.246 1.00 0.00 O ATOM 1158 CB ILE A 74 17.279 -1.014 4.333 1.00 0.00 C ATOM 1159 CG1 ILE A 74 16.166 -1.230 3.302 1.00 0.00 C ATOM 1160 CG2 ILE A 74 16.734 -1.234 5.751 1.00 0.00 C ATOM 1161 CD1 ILE A 74 15.002 -0.290 3.439 1.00 0.00 C ATOM 0 H ILE A 74 18.910 0.069 2.387 1.00 0.00 H new ATOM 0 HA ILE A 74 17.212 1.169 4.535 1.00 0.00 H new ATOM 0 HB ILE A 74 18.064 -1.744 4.133 1.00 0.00 H new ATOM 0 HG12 ILE A 74 16.588 -1.123 2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 74 15.802 -2.254 3.387 1.00 0.00 H new ATOM 0 HG21 ILE A 74 16.291 -2.228 5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.548 -1.148 6.471 1.00 0.00 H new ATOM 0 HG23 ILE A 74 15.975 -0.483 5.970 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.262 -0.513 2.671 1.00 0.00 H new ATOM 0 HD12 ILE A 74 14.551 -0.411 4.424 1.00 0.00 H new ATOM 0 HD13 ILE A 74 15.348 0.737 3.322 1.00 0.00 H new ATOM 1173 N HIS A 75 20.278 0.008 4.488 1.00 0.00 N ATOM 1174 CA HIS A 75 21.470 -0.270 5.253 1.00 0.00 C ATOM 1175 C HIS A 75 22.717 0.030 4.426 1.00 0.00 C ATOM 1176 O HIS A 75 22.871 -0.468 3.314 1.00 0.00 O ATOM 1177 CB HIS A 75 21.385 -1.756 5.715 1.00 0.00 C ATOM 1178 CG HIS A 75 22.557 -2.369 6.461 1.00 0.00 C ATOM 1179 ND1 HIS A 75 23.523 -1.666 7.144 1.00 0.00 N ATOM 1180 CD2 HIS A 75 22.902 -3.669 6.578 1.00 0.00 C ATOM 1181 CE1 HIS A 75 24.418 -2.510 7.629 1.00 0.00 C ATOM 1182 NE2 HIS A 75 24.065 -3.732 7.298 1.00 0.00 N ATOM 0 H HIS A 75 20.376 -0.124 3.481 1.00 0.00 H new ATOM 0 HA HIS A 75 21.542 0.370 6.132 1.00 0.00 H new ATOM 0 HB2 HIS A 75 20.505 -1.852 6.351 1.00 0.00 H new ATOM 0 HB3 HIS A 75 21.206 -2.365 4.829 1.00 0.00 H new ATOM 0 HD2 HIS A 75 22.357 -4.510 6.175 1.00 0.00 H new ATOM 0 HE1 HIS A 75 25.293 -2.240 8.202 1.00 0.00 H new ATOM 0 HE2 HIS A 75 24.572 -4.584 7.537 1.00 0.00 H new ATOM 1190 N ALA A 76 23.563 0.868 4.966 1.00 0.00 N ATOM 1191 CA ALA A 76 24.815 1.253 4.361 1.00 0.00 C ATOM 1192 C ALA A 76 25.858 1.226 5.440 1.00 0.00 C ATOM 1193 O ALA A 76 25.610 1.736 6.535 1.00 0.00 O ATOM 1194 CB ALA A 76 24.699 2.649 3.798 1.00 0.00 C ATOM 0 H ALA A 76 23.396 1.316 5.867 1.00 0.00 H new ATOM 0 HA ALA A 76 25.080 0.575 3.550 1.00 0.00 H new ATOM 0 HB1 ALA A 76 25.646 2.937 3.342 1.00 0.00 H new ATOM 0 HB2 ALA A 76 23.911 2.673 3.045 1.00 0.00 H new ATOM 0 HB3 ALA A 76 24.456 3.346 4.600 1.00 0.00 H new ATOM 1200 N ALA A 77 26.986 0.614 5.178 1.00 0.00 N ATOM 1201 CA ALA A 77 28.028 0.506 6.182 1.00 0.00 C ATOM 1202 C ALA A 77 29.375 0.322 5.529 1.00 0.00 C ATOM 1203 O ALA A 77 29.456 -0.164 4.381 1.00 0.00 O ATOM 1204 CB ALA A 77 27.742 -0.664 7.124 1.00 0.00 C ATOM 0 H ALA A 77 27.211 0.182 4.282 1.00 0.00 H new ATOM 0 HA ALA A 77 28.042 1.430 6.760 1.00 0.00 H new ATOM 0 HB1 ALA A 77 28.533 -0.731 7.871 1.00 0.00 H new ATOM 0 HB2 ALA A 77 26.785 -0.505 7.622 1.00 0.00 H new ATOM 0 HB3 ALA A 77 27.704 -1.591 6.552 1.00 0.00 H new ATOM 1210 N VAL A 78 30.423 0.693 6.225 1.00 0.00 N ATOM 1211 CA VAL A 78 31.755 0.511 5.721 1.00 0.00 C ATOM 1212 C VAL A 78 32.346 -0.809 6.228 1.00 0.00 C ATOM 1213 O VAL A 78 32.856 -0.929 7.350 1.00 0.00 O ATOM 1214 CB VAL A 78 32.691 1.725 6.010 1.00 0.00 C ATOM 1215 CG1 VAL A 78 32.743 2.094 7.481 1.00 0.00 C ATOM 1216 CG2 VAL A 78 34.076 1.471 5.482 1.00 0.00 C ATOM 0 H VAL A 78 30.374 1.125 7.148 1.00 0.00 H new ATOM 0 HA VAL A 78 31.682 0.456 4.635 1.00 0.00 H new ATOM 0 HB VAL A 78 32.261 2.578 5.485 1.00 0.00 H new ATOM 0 HG11 VAL A 78 33.410 2.945 7.619 1.00 0.00 H new ATOM 0 HG12 VAL A 78 31.743 2.357 7.826 1.00 0.00 H new ATOM 0 HG13 VAL A 78 33.114 1.245 8.056 1.00 0.00 H new ATOM 0 HG21 VAL A 78 34.710 2.331 5.695 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.492 0.586 5.963 1.00 0.00 H new ATOM 0 HG23 VAL A 78 34.031 1.312 4.405 1.00 0.00 H new ATOM 1226 N GLY A 79 32.197 -1.800 5.429 1.00 0.00 N ATOM 1227 CA GLY A 79 32.695 -3.075 5.745 1.00 0.00 C ATOM 1228 C GLY A 79 32.453 -3.995 4.622 1.00 0.00 C ATOM 1229 O GLY A 79 31.781 -3.621 3.642 1.00 0.00 O ATOM 0 H GLY A 79 31.720 -1.742 4.529 1.00 0.00 H new ATOM 0 HA2 GLY A 79 33.763 -3.017 5.956 1.00 0.00 H new ATOM 0 HA3 GLY A 79 32.212 -3.451 6.647 1.00 0.00 H new ATOM 1233 N ALA A 80 32.948 -5.177 4.739 1.00 0.00 N ATOM 1234 CA ALA A 80 32.728 -6.185 3.756 1.00 0.00 C ATOM 1235 C ALA A 80 31.382 -6.832 4.026 1.00 0.00 C ATOM 1236 O ALA A 80 30.781 -6.593 5.085 1.00 0.00 O ATOM 1237 CB ALA A 80 33.854 -7.201 3.804 1.00 0.00 C ATOM 0 H ALA A 80 33.523 -5.477 5.526 1.00 0.00 H new ATOM 0 HA ALA A 80 32.717 -5.753 2.755 1.00 0.00 H new ATOM 0 HB1 ALA A 80 33.682 -7.970 3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 80 34.803 -6.703 3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 80 33.887 -7.661 4.792 1.00 0.00 H new ATOM 1243 N ILE A 81 30.894 -7.613 3.091 1.00 0.00 N ATOM 1244 CA ILE A 81 29.586 -8.241 3.237 1.00 0.00 C ATOM 1245 C ILE A 81 29.657 -9.324 4.284 1.00 0.00 C ATOM 1246 O ILE A 81 30.455 -10.268 4.155 1.00 0.00 O ATOM 1247 CB ILE A 81 29.019 -8.825 1.884 1.00 0.00 C ATOM 1248 CG1 ILE A 81 28.636 -7.721 0.892 1.00 0.00 C ATOM 1249 CG2 ILE A 81 27.816 -9.739 2.110 1.00 0.00 C ATOM 1250 CD1 ILE A 81 29.778 -6.950 0.300 1.00 0.00 C ATOM 0 H ILE A 81 31.376 -7.833 2.220 1.00 0.00 H new ATOM 0 HA ILE A 81 28.892 -7.461 3.549 1.00 0.00 H new ATOM 0 HB ILE A 81 29.831 -9.413 1.456 1.00 0.00 H new ATOM 0 HG12 ILE A 81 28.066 -8.171 0.079 1.00 0.00 H new ATOM 0 HG13 ILE A 81 27.972 -7.020 1.397 1.00 0.00 H new ATOM 0 HG21 ILE A 81 27.461 -10.117 1.151 1.00 0.00 H new ATOM 0 HG22 ILE A 81 28.109 -10.576 2.744 1.00 0.00 H new ATOM 0 HG23 ILE A 81 27.019 -9.177 2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 81 29.391 -6.196 -0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 81 30.339 -6.462 1.097 1.00 0.00 H new ATOM 0 HD13 ILE A 81 30.435 -7.631 -0.242 1.00 0.00 H new ATOM 1262 N THR A 82 28.869 -9.188 5.315 1.00 0.00 N ATOM 1263 CA THR A 82 28.856 -10.159 6.353 1.00 0.00 C ATOM 1264 C THR A 82 27.444 -10.765 6.468 1.00 0.00 C ATOM 1265 O THR A 82 26.494 -10.260 5.853 1.00 0.00 O ATOM 1266 CB THR A 82 29.335 -9.551 7.711 1.00 0.00 C ATOM 1267 OG1 THR A 82 29.557 -10.587 8.681 1.00 0.00 O ATOM 1268 CG2 THR A 82 28.323 -8.560 8.275 1.00 0.00 C ATOM 0 H THR A 82 28.227 -8.407 5.451 1.00 0.00 H new ATOM 0 HA THR A 82 29.559 -10.954 6.103 1.00 0.00 H new ATOM 0 HB THR A 82 30.268 -9.025 7.509 1.00 0.00 H new ATOM 0 HG1 THR A 82 29.858 -10.187 9.524 1.00 0.00 H new ATOM 0 HG21 THR A 82 28.693 -8.160 9.219 1.00 0.00 H new ATOM 0 HG22 THR A 82 28.179 -7.744 7.567 1.00 0.00 H new ATOM 0 HG23 THR A 82 27.373 -9.067 8.443 1.00 0.00 H new ATOM 1276 N GLU A 83 27.315 -11.843 7.231 1.00 0.00 N ATOM 1277 CA GLU A 83 26.034 -12.538 7.423 1.00 0.00 C ATOM 1278 C GLU A 83 24.955 -11.604 7.988 1.00 0.00 C ATOM 1279 O GLU A 83 23.780 -11.708 7.623 1.00 0.00 O ATOM 1280 CB GLU A 83 26.223 -13.738 8.344 1.00 0.00 C ATOM 1281 CG GLU A 83 27.147 -14.796 7.789 1.00 0.00 C ATOM 1282 CD GLU A 83 27.463 -15.865 8.796 1.00 0.00 C ATOM 1283 OE1 GLU A 83 26.730 -16.876 8.871 1.00 0.00 O ATOM 1284 OE2 GLU A 83 28.463 -15.708 9.532 1.00 0.00 O ATOM 0 H GLU A 83 28.093 -12.266 7.738 1.00 0.00 H new ATOM 0 HA GLU A 83 25.694 -12.880 6.445 1.00 0.00 H new ATOM 0 HB2 GLU A 83 26.616 -13.392 9.300 1.00 0.00 H new ATOM 0 HB3 GLU A 83 25.250 -14.187 8.543 1.00 0.00 H new ATOM 0 HG2 GLU A 83 26.688 -15.251 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 83 28.074 -14.328 7.457 1.00 0.00 H new ATOM 1291 N SER A 84 25.368 -10.680 8.844 1.00 0.00 N ATOM 1292 CA SER A 84 24.473 -9.715 9.462 1.00 0.00 C ATOM 1293 C SER A 84 23.818 -8.812 8.383 1.00 0.00 C ATOM 1294 O SER A 84 22.663 -8.369 8.528 1.00 0.00 O ATOM 1295 CB SER A 84 25.257 -8.876 10.497 1.00 0.00 C ATOM 1296 OG SER A 84 24.406 -8.089 11.306 1.00 0.00 O ATOM 0 H SER A 84 26.342 -10.579 9.131 1.00 0.00 H new ATOM 0 HA SER A 84 23.671 -10.243 9.978 1.00 0.00 H new ATOM 0 HB2 SER A 84 25.844 -9.541 11.131 1.00 0.00 H new ATOM 0 HB3 SER A 84 25.962 -8.227 9.977 1.00 0.00 H new ATOM 0 HG SER A 84 24.944 -7.577 11.946 1.00 0.00 H new ATOM 1302 N ASP A 85 24.541 -8.592 7.279 1.00 0.00 N ATOM 1303 CA ASP A 85 24.030 -7.790 6.165 1.00 0.00 C ATOM 1304 C ASP A 85 23.027 -8.594 5.400 1.00 0.00 C ATOM 1305 O ASP A 85 21.985 -8.086 4.982 1.00 0.00 O ATOM 1306 CB ASP A 85 25.137 -7.377 5.187 1.00 0.00 C ATOM 1307 CG ASP A 85 26.174 -6.476 5.765 1.00 0.00 C ATOM 1308 OD1 ASP A 85 25.857 -5.322 6.150 1.00 0.00 O ATOM 1309 OD2 ASP A 85 27.340 -6.886 5.819 1.00 0.00 O ATOM 0 H ASP A 85 25.482 -8.959 7.135 1.00 0.00 H new ATOM 0 HA ASP A 85 23.589 -6.890 6.594 1.00 0.00 H new ATOM 0 HB2 ASP A 85 25.625 -8.276 4.811 1.00 0.00 H new ATOM 0 HB3 ASP A 85 24.680 -6.881 4.331 1.00 0.00 H new ATOM 1314 N ILE A 86 23.332 -9.870 5.248 1.00 0.00 N ATOM 1315 CA ILE A 86 22.490 -10.790 4.503 1.00 0.00 C ATOM 1316 C ILE A 86 21.124 -10.940 5.184 1.00 0.00 C ATOM 1317 O ILE A 86 20.089 -11.059 4.513 1.00 0.00 O ATOM 1318 CB ILE A 86 23.164 -12.174 4.349 1.00 0.00 C ATOM 1319 CG1 ILE A 86 24.588 -12.033 3.783 1.00 0.00 C ATOM 1320 CG2 ILE A 86 22.338 -13.045 3.436 1.00 0.00 C ATOM 1321 CD1 ILE A 86 24.655 -11.368 2.423 1.00 0.00 C ATOM 0 H ILE A 86 24.171 -10.299 5.638 1.00 0.00 H new ATOM 0 HA ILE A 86 22.345 -10.373 3.507 1.00 0.00 H new ATOM 0 HB ILE A 86 23.229 -12.635 5.335 1.00 0.00 H new ATOM 0 HG12 ILE A 86 25.191 -11.458 4.486 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.038 -13.023 3.713 1.00 0.00 H new ATOM 0 HG21 ILE A 86 22.817 -14.019 3.331 1.00 0.00 H new ATOM 0 HG22 ILE A 86 21.342 -13.174 3.859 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.257 -12.572 2.457 1.00 0.00 H new ATOM 0 HD11 ILE A 86 25.694 -11.308 2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 86 24.082 -11.953 1.703 1.00 0.00 H new ATOM 0 HD13 ILE A 86 24.237 -10.363 2.488 1.00 0.00 H new ATOM 1333 N SER A 87 21.123 -10.850 6.510 1.00 0.00 N ATOM 1334 CA SER A 87 19.897 -10.900 7.292 1.00 0.00 C ATOM 1335 C SER A 87 18.942 -9.750 6.920 1.00 0.00 C ATOM 1336 O SER A 87 17.740 -9.841 7.123 1.00 0.00 O ATOM 1337 CB SER A 87 20.236 -10.854 8.775 1.00 0.00 C ATOM 1338 OG SER A 87 21.115 -11.916 9.127 1.00 0.00 O ATOM 0 H SER A 87 21.969 -10.741 7.069 1.00 0.00 H new ATOM 0 HA SER A 87 19.384 -11.835 7.067 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.699 -9.897 9.017 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.321 -10.923 9.364 1.00 0.00 H new ATOM 0 HG SER A 87 21.988 -11.772 8.705 1.00 0.00 H new ATOM 1344 N LEU A 88 19.486 -8.672 6.388 1.00 0.00 N ATOM 1345 CA LEU A 88 18.676 -7.572 5.935 1.00 0.00 C ATOM 1346 C LEU A 88 18.270 -7.816 4.494 1.00 0.00 C ATOM 1347 O LEU A 88 17.135 -7.503 4.086 1.00 0.00 O ATOM 1348 CB LEU A 88 19.439 -6.218 6.103 1.00 0.00 C ATOM 1349 CG LEU A 88 18.754 -4.920 5.586 1.00 0.00 C ATOM 1350 CD1 LEU A 88 18.927 -4.737 4.076 1.00 0.00 C ATOM 1351 CD2 LEU A 88 17.276 -4.949 5.926 1.00 0.00 C ATOM 0 H LEU A 88 20.490 -8.540 6.261 1.00 0.00 H new ATOM 0 HA LEU A 88 17.774 -7.504 6.543 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.649 -6.084 7.164 1.00 0.00 H new ATOM 0 HB3 LEU A 88 20.400 -6.312 5.597 1.00 0.00 H new ATOM 0 HG LEU A 88 19.238 -4.077 6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.432 -3.818 3.762 1.00 0.00 H new ATOM 0 HD12 LEU A 88 19.989 -4.678 3.836 1.00 0.00 H new ATOM 0 HD13 LEU A 88 18.483 -5.585 3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 88 16.801 -4.038 5.562 1.00 0.00 H new ATOM 0 HD22 LEU A 88 16.811 -5.814 5.454 1.00 0.00 H new ATOM 0 HD23 LEU A 88 17.153 -5.015 7.007 1.00 0.00 H new ATOM 1363 N ALA A 89 19.188 -8.384 3.747 1.00 0.00 N ATOM 1364 CA ALA A 89 19.018 -8.634 2.341 1.00 0.00 C ATOM 1365 C ALA A 89 17.740 -9.425 2.051 1.00 0.00 C ATOM 1366 O ALA A 89 16.858 -8.931 1.372 1.00 0.00 O ATOM 1367 CB ALA A 89 20.252 -9.320 1.786 1.00 0.00 C ATOM 0 H ALA A 89 20.091 -8.690 4.110 1.00 0.00 H new ATOM 0 HA ALA A 89 18.902 -7.677 1.833 1.00 0.00 H new ATOM 0 HB1 ALA A 89 20.116 -9.506 0.721 1.00 0.00 H new ATOM 0 HB2 ALA A 89 21.122 -8.680 1.935 1.00 0.00 H new ATOM 0 HB3 ALA A 89 20.406 -10.267 2.303 1.00 0.00 H new ATOM 1373 N THR A 90 17.605 -10.610 2.616 1.00 0.00 N ATOM 1374 CA THR A 90 16.388 -11.401 2.385 1.00 0.00 C ATOM 1375 C THR A 90 15.165 -10.780 3.098 1.00 0.00 C ATOM 1376 O THR A 90 14.036 -10.908 2.629 1.00 0.00 O ATOM 1377 CB THR A 90 16.573 -12.909 2.774 1.00 0.00 C ATOM 1378 OG1 THR A 90 15.328 -13.636 2.694 1.00 0.00 O ATOM 1379 CG2 THR A 90 17.183 -13.056 4.158 1.00 0.00 C ATOM 0 H THR A 90 18.297 -11.047 3.225 1.00 0.00 H new ATOM 0 HA THR A 90 16.196 -11.374 1.312 1.00 0.00 H new ATOM 0 HB THR A 90 17.264 -13.340 2.049 1.00 0.00 H new ATOM 0 HG1 THR A 90 15.479 -14.572 2.941 1.00 0.00 H new ATOM 0 HG21 THR A 90 17.297 -14.114 4.395 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.160 -12.572 4.178 1.00 0.00 H new ATOM 0 HG23 THR A 90 16.531 -12.587 4.895 1.00 0.00 H new ATOM 1387 N ALA A 91 15.417 -10.044 4.183 1.00 0.00 N ATOM 1388 CA ALA A 91 14.352 -9.428 4.968 1.00 0.00 C ATOM 1389 C ALA A 91 13.590 -8.385 4.169 1.00 0.00 C ATOM 1390 O ALA A 91 12.386 -8.510 3.935 1.00 0.00 O ATOM 1391 CB ALA A 91 14.910 -8.801 6.228 1.00 0.00 C ATOM 0 H ALA A 91 16.356 -9.861 4.537 1.00 0.00 H new ATOM 0 HA ALA A 91 13.655 -10.221 5.239 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.099 -8.347 6.798 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.394 -9.568 6.832 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.639 -8.035 5.962 1.00 0.00 H new ATOM 1397 N SER A 92 14.295 -7.384 3.714 1.00 0.00 N ATOM 1398 CA SER A 92 13.665 -6.300 3.023 1.00 0.00 C ATOM 1399 C SER A 92 13.758 -6.494 1.507 1.00 0.00 C ATOM 1400 O SER A 92 13.346 -5.617 0.735 1.00 0.00 O ATOM 1401 CB SER A 92 14.295 -4.971 3.462 1.00 0.00 C ATOM 1402 OG SER A 92 13.577 -3.863 2.959 1.00 0.00 O ATOM 0 H SER A 92 15.307 -7.300 3.811 1.00 0.00 H new ATOM 0 HA SER A 92 12.606 -6.279 3.280 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.323 -4.923 4.551 1.00 0.00 H new ATOM 0 HB3 SER A 92 15.327 -4.925 3.114 1.00 0.00 H new ATOM 0 HG SER A 92 13.787 -3.068 3.492 1.00 0.00 H new ATOM 1408 N ASN A 93 14.301 -7.644 1.095 1.00 0.00 N ATOM 1409 CA ASN A 93 14.440 -8.020 -0.338 1.00 0.00 C ATOM 1410 C ASN A 93 15.439 -7.119 -1.021 1.00 0.00 C ATOM 1411 O ASN A 93 15.365 -6.860 -2.228 1.00 0.00 O ATOM 1412 CB ASN A 93 13.082 -8.022 -1.082 1.00 0.00 C ATOM 1413 CG ASN A 93 12.172 -9.159 -0.653 1.00 0.00 C ATOM 1414 OD1 ASN A 93 12.203 -10.249 -1.234 1.00 0.00 O ATOM 1415 ND2 ASN A 93 11.358 -8.924 0.349 1.00 0.00 N ATOM 0 H ASN A 93 14.661 -8.350 1.738 1.00 0.00 H new ATOM 0 HA ASN A 93 14.812 -9.044 -0.374 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.576 -7.073 -0.906 1.00 0.00 H new ATOM 0 HB3 ASN A 93 13.262 -8.093 -2.155 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.723 -9.654 0.672 1.00 0.00 H new ATOM 0 HD22 ASN A 93 11.360 -8.011 0.805 1.00 0.00 H new ATOM 1422 N ALA A 94 16.418 -6.712 -0.255 1.00 0.00 N ATOM 1423 CA ALA A 94 17.441 -5.832 -0.715 1.00 0.00 C ATOM 1424 C ALA A 94 18.631 -6.642 -1.180 1.00 0.00 C ATOM 1425 O ALA A 94 19.053 -7.559 -0.505 1.00 0.00 O ATOM 1426 CB ALA A 94 17.853 -4.903 0.417 1.00 0.00 C ATOM 0 H ALA A 94 16.521 -6.992 0.720 1.00 0.00 H new ATOM 0 HA ALA A 94 17.068 -5.237 -1.549 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.635 -4.229 0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.991 -4.321 0.742 1.00 0.00 H new ATOM 0 HB3 ALA A 94 18.229 -5.493 1.253 1.00 0.00 H new ATOM 1432 N ILE A 95 19.153 -6.327 -2.326 1.00 0.00 N ATOM 1433 CA ILE A 95 20.343 -7.001 -2.794 1.00 0.00 C ATOM 1434 C ILE A 95 21.547 -6.174 -2.411 1.00 0.00 C ATOM 1435 O ILE A 95 21.448 -4.938 -2.273 1.00 0.00 O ATOM 1436 CB ILE A 95 20.339 -7.291 -4.320 1.00 0.00 C ATOM 1437 CG1 ILE A 95 20.163 -5.997 -5.137 1.00 0.00 C ATOM 1438 CG2 ILE A 95 19.255 -8.312 -4.656 1.00 0.00 C ATOM 1439 CD1 ILE A 95 20.242 -6.185 -6.638 1.00 0.00 C ATOM 0 H ILE A 95 18.784 -5.615 -2.956 1.00 0.00 H new ATOM 0 HA ILE A 95 20.377 -7.980 -2.315 1.00 0.00 H new ATOM 0 HB ILE A 95 21.306 -7.712 -4.593 1.00 0.00 H new ATOM 0 HG12 ILE A 95 19.198 -5.555 -4.889 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.928 -5.283 -4.832 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.260 -8.509 -5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 95 19.448 -9.239 -4.116 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.281 -7.918 -4.364 1.00 0.00 H new ATOM 0 HD11 ILE A 95 20.107 -5.223 -7.133 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.216 -6.596 -6.902 1.00 0.00 H new ATOM 0 HD13 ILE A 95 19.459 -6.871 -6.960 1.00 0.00 H new ATOM 1451 N VAL A 96 22.658 -6.824 -2.230 1.00 0.00 N ATOM 1452 CA VAL A 96 23.825 -6.162 -1.711 1.00 0.00 C ATOM 1453 C VAL A 96 24.801 -5.824 -2.810 1.00 0.00 C ATOM 1454 O VAL A 96 25.239 -6.705 -3.566 1.00 0.00 O ATOM 1455 CB VAL A 96 24.555 -7.035 -0.661 1.00 0.00 C ATOM 1456 CG1 VAL A 96 25.630 -6.245 0.049 1.00 0.00 C ATOM 1457 CG2 VAL A 96 23.593 -7.674 0.334 1.00 0.00 C ATOM 0 H VAL A 96 22.784 -7.815 -2.434 1.00 0.00 H new ATOM 0 HA VAL A 96 23.473 -5.245 -1.239 1.00 0.00 H new ATOM 0 HB VAL A 96 25.033 -7.850 -1.204 1.00 0.00 H new ATOM 0 HG11 VAL A 96 26.127 -6.882 0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 96 26.360 -5.890 -0.678 1.00 0.00 H new ATOM 0 HG13 VAL A 96 25.179 -5.392 0.557 1.00 0.00 H new ATOM 0 HG21 VAL A 96 24.155 -8.275 1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.048 -6.894 0.866 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.887 -8.310 -0.200 1.00 0.00 H new ATOM 1467 N ILE A 97 25.131 -4.569 -2.904 1.00 0.00 N ATOM 1468 CA ILE A 97 26.148 -4.132 -3.805 1.00 0.00 C ATOM 1469 C ILE A 97 27.378 -3.726 -2.981 1.00 0.00 C ATOM 1470 O ILE A 97 27.341 -2.774 -2.191 1.00 0.00 O ATOM 1471 CB ILE A 97 25.655 -2.987 -4.766 1.00 0.00 C ATOM 1472 CG1 ILE A 97 26.766 -2.532 -5.731 1.00 0.00 C ATOM 1473 CG2 ILE A 97 25.063 -1.797 -4.011 1.00 0.00 C ATOM 1474 CD1 ILE A 97 27.255 -3.613 -6.679 1.00 0.00 C ATOM 0 H ILE A 97 24.701 -3.823 -2.357 1.00 0.00 H new ATOM 0 HA ILE A 97 26.416 -4.952 -4.471 1.00 0.00 H new ATOM 0 HB ILE A 97 24.850 -3.418 -5.361 1.00 0.00 H new ATOM 0 HG12 ILE A 97 26.398 -1.690 -6.318 1.00 0.00 H new ATOM 0 HG13 ILE A 97 27.611 -2.168 -5.147 1.00 0.00 H new ATOM 0 HG21 ILE A 97 24.740 -1.038 -4.724 1.00 0.00 H new ATOM 0 HG22 ILE A 97 24.208 -2.129 -3.422 1.00 0.00 H new ATOM 0 HG23 ILE A 97 25.818 -1.374 -3.349 1.00 0.00 H new ATOM 0 HD11 ILE A 97 28.036 -3.207 -7.322 1.00 0.00 H new ATOM 0 HD12 ILE A 97 27.656 -4.447 -6.104 1.00 0.00 H new ATOM 0 HD13 ILE A 97 26.424 -3.962 -7.293 1.00 0.00 H new ATOM 1486 N GLY A 98 28.426 -4.506 -3.108 1.00 0.00 N ATOM 1487 CA GLY A 98 29.628 -4.273 -2.370 1.00 0.00 C ATOM 1488 C GLY A 98 30.683 -3.666 -3.235 1.00 0.00 C ATOM 1489 O GLY A 98 30.793 -4.006 -4.411 1.00 0.00 O ATOM 0 H GLY A 98 28.461 -5.316 -3.727 1.00 0.00 H new ATOM 0 HA2 GLY A 98 29.419 -3.612 -1.529 1.00 0.00 H new ATOM 0 HA3 GLY A 98 29.991 -5.213 -1.955 1.00 0.00 H new ATOM 1493 N PHE A 99 31.498 -2.821 -2.670 1.00 0.00 N ATOM 1494 CA PHE A 99 32.484 -2.108 -3.455 1.00 0.00 C ATOM 1495 C PHE A 99 33.863 -2.376 -2.957 1.00 0.00 C ATOM 1496 O PHE A 99 34.221 -1.969 -1.857 1.00 0.00 O ATOM 1497 CB PHE A 99 32.204 -0.604 -3.513 1.00 0.00 C ATOM 1498 CG PHE A 99 30.966 -0.240 -4.281 1.00 0.00 C ATOM 1499 CD1 PHE A 99 30.987 -0.206 -5.667 1.00 0.00 C ATOM 1500 CD2 PHE A 99 29.786 0.064 -3.627 1.00 0.00 C ATOM 1501 CE1 PHE A 99 29.858 0.128 -6.383 1.00 0.00 C ATOM 1502 CE2 PHE A 99 28.653 0.398 -4.337 1.00 0.00 C ATOM 1503 CZ PHE A 99 28.689 0.431 -5.719 1.00 0.00 C ATOM 0 H PHE A 99 31.505 -2.605 -1.673 1.00 0.00 H new ATOM 0 HA PHE A 99 32.409 -2.485 -4.475 1.00 0.00 H new ATOM 0 HB2 PHE A 99 32.113 -0.223 -2.496 1.00 0.00 H new ATOM 0 HB3 PHE A 99 33.060 -0.103 -3.966 1.00 0.00 H new ATOM 0 HD1 PHE A 99 31.900 -0.444 -6.192 1.00 0.00 H new ATOM 0 HD2 PHE A 99 29.752 0.039 -2.548 1.00 0.00 H new ATOM 0 HE1 PHE A 99 29.889 0.152 -7.462 1.00 0.00 H new ATOM 0 HE2 PHE A 99 27.738 0.634 -3.814 1.00 0.00 H new ATOM 0 HZ PHE A 99 27.802 0.694 -6.277 1.00 0.00 H new ATOM 1513 N ASN A 100 34.599 -3.133 -3.761 1.00 0.00 N ATOM 1514 CA ASN A 100 36.003 -3.570 -3.528 1.00 0.00 C ATOM 1515 C ASN A 100 36.152 -4.554 -2.357 1.00 0.00 C ATOM 1516 O ASN A 100 36.966 -5.445 -2.413 1.00 0.00 O ATOM 1517 CB ASN A 100 36.986 -2.385 -3.384 1.00 0.00 C ATOM 1518 CG ASN A 100 38.450 -2.837 -3.394 1.00 0.00 C ATOM 1519 OD1 ASN A 100 39.060 -2.973 -4.460 1.00 0.00 O ATOM 1520 ND2 ASN A 100 39.021 -3.057 -2.242 1.00 0.00 N ATOM 0 H ASN A 100 34.230 -3.486 -4.644 1.00 0.00 H new ATOM 0 HA ASN A 100 36.276 -4.113 -4.433 1.00 0.00 H new ATOM 0 HB2 ASN A 100 36.821 -1.679 -4.197 1.00 0.00 H new ATOM 0 HB3 ASN A 100 36.778 -1.855 -2.454 1.00 0.00 H new ATOM 0 HD21 ASN A 100 39.997 -3.350 -2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 100 38.491 -2.936 -1.379 1.00 0.00 H new ATOM 1527 N VAL A 101 35.342 -4.380 -1.346 1.00 0.00 N ATOM 1528 CA VAL A 101 35.335 -5.176 -0.117 1.00 0.00 C ATOM 1529 C VAL A 101 35.281 -6.699 -0.271 1.00 0.00 C ATOM 1530 O VAL A 101 36.133 -7.391 0.272 1.00 0.00 O ATOM 1531 CB VAL A 101 34.210 -4.762 0.826 1.00 0.00 C ATOM 1532 CG1 VAL A 101 34.603 -3.547 1.633 1.00 0.00 C ATOM 1533 CG2 VAL A 101 32.904 -4.484 0.080 1.00 0.00 C ATOM 0 H VAL A 101 34.631 -3.649 -1.343 1.00 0.00 H new ATOM 0 HA VAL A 101 36.318 -4.947 0.295 1.00 0.00 H new ATOM 0 HB VAL A 101 34.041 -5.603 1.499 1.00 0.00 H new ATOM 0 HG11 VAL A 101 33.784 -3.271 2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 101 35.490 -3.774 2.224 1.00 0.00 H new ATOM 0 HG13 VAL A 101 34.819 -2.717 0.960 1.00 0.00 H new ATOM 0 HG21 VAL A 101 32.133 -4.193 0.793 1.00 0.00 H new ATOM 0 HG22 VAL A 101 33.059 -3.677 -0.637 1.00 0.00 H new ATOM 0 HG23 VAL A 101 32.588 -5.383 -0.449 1.00 0.00 H new ATOM 1543 N ARG A 102 34.277 -7.199 -1.002 1.00 0.00 N ATOM 1544 CA ARG A 102 33.971 -8.646 -1.109 1.00 0.00 C ATOM 1545 C ARG A 102 33.252 -9.145 0.168 1.00 0.00 C ATOM 1546 O ARG A 102 33.073 -8.370 1.099 1.00 0.00 O ATOM 1547 CB ARG A 102 35.194 -9.520 -1.504 1.00 0.00 C ATOM 1548 CG ARG A 102 35.711 -9.214 -2.886 1.00 0.00 C ATOM 1549 CD ARG A 102 36.950 -8.339 -2.878 1.00 0.00 C ATOM 1550 NE ARG A 102 38.087 -8.940 -2.167 1.00 0.00 N ATOM 1551 CZ ARG A 102 39.185 -8.271 -1.770 1.00 0.00 C ATOM 1552 NH1 ARG A 102 39.217 -6.937 -1.827 1.00 0.00 N ATOM 1553 NH2 ARG A 102 40.220 -8.935 -1.265 1.00 0.00 N ATOM 0 H ARG A 102 33.643 -6.612 -1.544 1.00 0.00 H new ATOM 0 HA ARG A 102 33.283 -8.765 -1.946 1.00 0.00 H new ATOM 0 HB2 ARG A 102 35.994 -9.365 -0.780 1.00 0.00 H new ATOM 0 HB3 ARG A 102 34.915 -10.572 -1.451 1.00 0.00 H new ATOM 0 HG2 ARG A 102 35.937 -10.149 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 102 34.927 -8.718 -3.459 1.00 0.00 H new ATOM 0 HD2 ARG A 102 37.244 -8.130 -3.907 1.00 0.00 H new ATOM 0 HD3 ARG A 102 36.707 -7.383 -2.415 1.00 0.00 H new ATOM 0 HE ARG A 102 38.040 -9.938 -1.959 1.00 0.00 H new ATOM 0 HH11 ARG A 102 38.407 -6.422 -2.172 1.00 0.00 H new ATOM 0 HH12 ARG A 102 40.051 -6.434 -1.525 1.00 0.00 H new ATOM 0 HH21 ARG A 102 40.181 -9.951 -1.179 1.00 0.00 H new ATOM 0 HH22 ARG A 102 41.053 -8.429 -0.964 1.00 0.00 H new ATOM 1566 N PRO A 103 32.712 -10.380 0.203 1.00 0.00 N ATOM 1567 CA PRO A 103 32.075 -10.899 1.396 1.00 0.00 C ATOM 1568 C PRO A 103 32.993 -11.749 2.230 1.00 0.00 C ATOM 1569 O PRO A 103 34.151 -12.019 1.872 1.00 0.00 O ATOM 1570 CB PRO A 103 30.979 -11.825 0.854 1.00 0.00 C ATOM 1571 CG PRO A 103 31.270 -12.004 -0.606 1.00 0.00 C ATOM 1572 CD PRO A 103 32.588 -11.340 -0.896 1.00 0.00 C ATOM 0 HA PRO A 103 31.735 -10.077 2.027 1.00 0.00 H new ATOM 0 HB2 PRO A 103 30.987 -12.783 1.373 1.00 0.00 H new ATOM 0 HB3 PRO A 103 29.991 -11.389 1.004 1.00 0.00 H new ATOM 0 HG2 PRO A 103 31.312 -13.063 -0.860 1.00 0.00 H new ATOM 0 HG3 PRO A 103 30.478 -11.562 -1.211 1.00 0.00 H new ATOM 0 HD2 PRO A 103 33.410 -12.056 -0.903 1.00 0.00 H new ATOM 0 HD3 PRO A 103 32.588 -10.846 -1.868 1.00 0.00 H new ATOM 1580 N ASP A 104 32.474 -12.132 3.348 1.00 0.00 N ATOM 1581 CA ASP A 104 33.052 -13.145 4.181 1.00 0.00 C ATOM 1582 C ASP A 104 32.604 -14.472 3.583 1.00 0.00 C ATOM 1583 O ASP A 104 31.530 -14.527 2.955 1.00 0.00 O ATOM 1584 CB ASP A 104 32.503 -12.991 5.609 1.00 0.00 C ATOM 1585 CG ASP A 104 32.943 -14.079 6.558 1.00 0.00 C ATOM 1586 OD1 ASP A 104 33.991 -13.938 7.225 1.00 0.00 O ATOM 1587 OD2 ASP A 104 32.231 -15.086 6.674 1.00 0.00 O ATOM 0 H ASP A 104 31.610 -11.740 3.723 1.00 0.00 H new ATOM 0 HA ASP A 104 34.139 -13.079 4.228 1.00 0.00 H new ATOM 0 HB2 ASP A 104 32.820 -12.027 6.007 1.00 0.00 H new ATOM 0 HB3 ASP A 104 31.414 -12.977 5.569 1.00 0.00 H new ATOM 1592 N ALA A 105 33.394 -15.512 3.728 1.00 0.00 N ATOM 1593 CA ALA A 105 33.058 -16.819 3.174 1.00 0.00 C ATOM 1594 C ALA A 105 31.734 -17.356 3.712 1.00 0.00 C ATOM 1595 O ALA A 105 31.023 -18.054 3.016 1.00 0.00 O ATOM 1596 CB ALA A 105 34.178 -17.812 3.403 1.00 0.00 C ATOM 0 H ALA A 105 34.283 -15.484 4.228 1.00 0.00 H new ATOM 0 HA ALA A 105 32.933 -16.683 2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 105 33.900 -18.777 2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 105 35.087 -17.452 2.921 1.00 0.00 H new ATOM 0 HB3 ALA A 105 34.354 -17.922 4.473 1.00 0.00 H new ATOM 1602 N ASN A 106 31.383 -17.003 4.926 1.00 0.00 N ATOM 1603 CA ASN A 106 30.116 -17.447 5.471 1.00 0.00 C ATOM 1604 C ASN A 106 29.000 -16.568 4.966 1.00 0.00 C ATOM 1605 O ASN A 106 27.900 -17.025 4.755 1.00 0.00 O ATOM 1606 CB ASN A 106 30.103 -17.465 6.984 1.00 0.00 C ATOM 1607 CG ASN A 106 31.022 -18.489 7.601 1.00 0.00 C ATOM 1608 OD1 ASN A 106 32.210 -18.227 7.831 1.00 0.00 O ATOM 1609 ND2 ASN A 106 30.481 -19.640 7.914 1.00 0.00 N ATOM 0 H ASN A 106 31.943 -16.420 5.548 1.00 0.00 H new ATOM 0 HA ASN A 106 29.969 -18.473 5.133 1.00 0.00 H new ATOM 0 HB2 ASN A 106 30.382 -16.477 7.350 1.00 0.00 H new ATOM 0 HB3 ASN A 106 29.085 -17.655 7.325 1.00 0.00 H new ATOM 0 HD21 ASN A 106 31.043 -20.362 8.365 1.00 0.00 H new ATOM 0 HD22 ASN A 106 29.498 -19.815 7.707 1.00 0.00 H new ATOM 1616 N ALA A 107 29.296 -15.299 4.756 1.00 0.00 N ATOM 1617 CA ALA A 107 28.314 -14.368 4.222 1.00 0.00 C ATOM 1618 C ALA A 107 27.886 -14.764 2.822 1.00 0.00 C ATOM 1619 O ALA A 107 26.709 -14.719 2.494 1.00 0.00 O ATOM 1620 CB ALA A 107 28.857 -12.975 4.205 1.00 0.00 C ATOM 0 H ALA A 107 30.209 -14.887 4.947 1.00 0.00 H new ATOM 0 HA ALA A 107 27.443 -14.403 4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.105 -12.296 3.802 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.112 -12.672 5.220 1.00 0.00 H new ATOM 0 HB3 ALA A 107 29.750 -12.940 3.580 1.00 0.00 H new ATOM 1626 N LYS A 108 28.854 -15.157 2.007 1.00 0.00 N ATOM 1627 CA LYS A 108 28.577 -15.584 0.646 1.00 0.00 C ATOM 1628 C LYS A 108 27.731 -16.885 0.633 1.00 0.00 C ATOM 1629 O LYS A 108 26.986 -17.145 -0.320 1.00 0.00 O ATOM 1630 CB LYS A 108 29.885 -15.763 -0.144 1.00 0.00 C ATOM 1631 CG LYS A 108 30.679 -17.012 0.188 1.00 0.00 C ATOM 1632 CD LYS A 108 31.970 -17.089 -0.609 1.00 0.00 C ATOM 1633 CE LYS A 108 31.702 -17.155 -2.105 1.00 0.00 C ATOM 1634 NZ LYS A 108 32.942 -17.296 -2.866 1.00 0.00 N ATOM 0 H LYS A 108 29.840 -15.189 2.267 1.00 0.00 H new ATOM 0 HA LYS A 108 27.992 -14.805 0.157 1.00 0.00 H new ATOM 0 HB2 LYS A 108 29.648 -15.775 -1.208 1.00 0.00 H new ATOM 0 HB3 LYS A 108 30.518 -14.893 0.032 1.00 0.00 H new ATOM 0 HG2 LYS A 108 30.908 -17.024 1.253 1.00 0.00 H new ATOM 0 HG3 LYS A 108 30.072 -17.894 -0.017 1.00 0.00 H new ATOM 0 HD2 LYS A 108 32.587 -16.218 -0.388 1.00 0.00 H new ATOM 0 HD3 LYS A 108 32.536 -17.968 -0.301 1.00 0.00 H new ATOM 0 HE2 LYS A 108 31.044 -17.997 -2.321 1.00 0.00 H new ATOM 0 HE3 LYS A 108 31.180 -16.252 -2.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 32.723 -17.338 -3.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 33.559 -16.480 -2.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 33.427 -18.170 -2.580 1.00 0.00 H new ATOM 1647 N ARG A 109 27.849 -17.683 1.710 1.00 0.00 N ATOM 1648 CA ARG A 109 27.126 -18.857 1.901 1.00 0.00 C ATOM 1649 C ARG A 109 25.706 -18.504 2.297 1.00 0.00 C ATOM 1650 O ARG A 109 24.727 -18.974 1.689 1.00 0.00 O ATOM 1651 CB ARG A 109 27.761 -19.565 3.060 1.00 0.00 C ATOM 1652 CG ARG A 109 29.007 -20.365 2.801 1.00 0.00 C ATOM 1653 CD ARG A 109 29.386 -21.183 4.036 1.00 0.00 C ATOM 1654 NE ARG A 109 28.246 -21.975 4.538 1.00 0.00 N ATOM 1655 CZ ARG A 109 28.172 -22.541 5.752 1.00 0.00 C ATOM 1656 NH1 ARG A 109 29.224 -22.530 6.574 1.00 0.00 N ATOM 1657 NH2 ARG A 109 27.051 -23.148 6.123 1.00 0.00 N ATOM 0 H ARG A 109 28.490 -17.478 2.477 1.00 0.00 H new ATOM 0 HA ARG A 109 27.120 -19.466 0.997 1.00 0.00 H new ATOM 0 HB2 ARG A 109 27.995 -18.819 3.820 1.00 0.00 H new ATOM 0 HB3 ARG A 109 27.017 -20.235 3.490 1.00 0.00 H new ATOM 0 HG2 ARG A 109 28.849 -21.030 1.952 1.00 0.00 H new ATOM 0 HG3 ARG A 109 29.826 -19.697 2.535 1.00 0.00 H new ATOM 0 HD2 ARG A 109 30.213 -21.850 3.791 1.00 0.00 H new ATOM 0 HD3 ARG A 109 29.738 -20.514 4.821 1.00 0.00 H new ATOM 0 HE ARG A 109 27.451 -22.102 3.912 1.00 0.00 H new ATOM 0 HH11 ARG A 109 30.095 -22.088 6.281 1.00 0.00 H new ATOM 0 HH12 ARG A 109 29.156 -22.963 7.495 1.00 0.00 H new ATOM 0 HH21 ARG A 109 26.255 -23.181 5.487 1.00 0.00 H new ATOM 0 HH22 ARG A 109 26.986 -23.581 7.044 1.00 0.00 H new ATOM 1670 N ALA A 110 25.625 -17.667 3.330 1.00 0.00 N ATOM 1671 CA ALA A 110 24.394 -17.185 3.896 1.00 0.00 C ATOM 1672 C ALA A 110 23.542 -16.595 2.835 1.00 0.00 C ATOM 1673 O ALA A 110 22.426 -16.997 2.692 1.00 0.00 O ATOM 1674 CB ALA A 110 24.679 -16.163 4.988 1.00 0.00 C ATOM 0 H ALA A 110 26.451 -17.301 3.803 1.00 0.00 H new ATOM 0 HA ALA A 110 23.859 -18.023 4.343 1.00 0.00 H new ATOM 0 HB1 ALA A 110 23.738 -15.807 5.407 1.00 0.00 H new ATOM 0 HB2 ALA A 110 25.274 -16.627 5.774 1.00 0.00 H new ATOM 0 HB3 ALA A 110 25.229 -15.322 4.565 1.00 0.00 H new ATOM 1680 N ALA A 111 24.138 -15.716 2.030 1.00 0.00 N ATOM 1681 CA ALA A 111 23.467 -15.021 0.936 1.00 0.00 C ATOM 1682 C ALA A 111 22.648 -15.952 0.079 1.00 0.00 C ATOM 1683 O ALA A 111 21.474 -15.710 -0.176 1.00 0.00 O ATOM 1684 CB ALA A 111 24.489 -14.300 0.068 1.00 0.00 C ATOM 0 H ALA A 111 25.122 -15.463 2.124 1.00 0.00 H new ATOM 0 HA ALA A 111 22.785 -14.301 1.388 1.00 0.00 H new ATOM 0 HB1 ALA A 111 23.977 -13.785 -0.745 1.00 0.00 H new ATOM 0 HB2 ALA A 111 25.032 -13.574 0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 111 25.190 -15.024 -0.346 1.00 0.00 H new ATOM 1690 N GLU A 112 23.238 -17.037 -0.309 1.00 0.00 N ATOM 1691 CA GLU A 112 22.615 -17.920 -1.217 1.00 0.00 C ATOM 1692 C GLU A 112 21.539 -18.732 -0.510 1.00 0.00 C ATOM 1693 O GLU A 112 20.435 -18.907 -1.033 1.00 0.00 O ATOM 1694 CB GLU A 112 23.691 -18.772 -1.849 1.00 0.00 C ATOM 1695 CG GLU A 112 23.349 -19.427 -3.154 1.00 0.00 C ATOM 1696 CD GLU A 112 22.228 -20.430 -3.082 1.00 0.00 C ATOM 1697 OE1 GLU A 112 22.365 -21.455 -2.378 1.00 0.00 O ATOM 1698 OE2 GLU A 112 21.184 -20.205 -3.718 1.00 0.00 O ATOM 0 H GLU A 112 24.166 -17.328 -0.000 1.00 0.00 H new ATOM 0 HA GLU A 112 22.101 -17.377 -2.010 1.00 0.00 H new ATOM 0 HB2 GLU A 112 24.573 -18.150 -2.001 1.00 0.00 H new ATOM 0 HB3 GLU A 112 23.969 -19.551 -1.139 1.00 0.00 H new ATOM 0 HG2 GLU A 112 23.080 -18.653 -3.873 1.00 0.00 H new ATOM 0 HG3 GLU A 112 24.239 -19.925 -3.539 1.00 0.00 H new ATOM 1705 N SER A 113 21.814 -19.129 0.703 1.00 0.00 N ATOM 1706 CA SER A 113 20.860 -19.883 1.490 1.00 0.00 C ATOM 1707 C SER A 113 19.775 -18.913 2.018 1.00 0.00 C ATOM 1708 O SER A 113 18.853 -19.284 2.767 1.00 0.00 O ATOM 1709 CB SER A 113 21.625 -20.596 2.625 1.00 0.00 C ATOM 1710 OG SER A 113 20.801 -21.472 3.389 1.00 0.00 O ATOM 0 H SER A 113 22.698 -18.943 1.177 1.00 0.00 H new ATOM 0 HA SER A 113 20.355 -20.645 0.897 1.00 0.00 H new ATOM 0 HB2 SER A 113 22.451 -21.164 2.197 1.00 0.00 H new ATOM 0 HB3 SER A 113 22.062 -19.848 3.287 1.00 0.00 H new ATOM 0 HG SER A 113 19.910 -21.077 3.490 1.00 0.00 H new ATOM 1716 N GLU A 114 19.890 -17.696 1.591 1.00 0.00 N ATOM 1717 CA GLU A 114 19.041 -16.644 1.946 1.00 0.00 C ATOM 1718 C GLU A 114 18.414 -15.996 0.787 1.00 0.00 C ATOM 1719 O GLU A 114 17.867 -14.909 0.928 1.00 0.00 O ATOM 1720 CB GLU A 114 19.775 -15.663 2.754 1.00 0.00 C ATOM 1721 CG GLU A 114 19.667 -16.030 4.195 1.00 0.00 C ATOM 1722 CD GLU A 114 20.485 -15.246 5.173 1.00 0.00 C ATOM 1723 OE1 GLU A 114 20.089 -14.146 5.549 1.00 0.00 O ATOM 1724 OE2 GLU A 114 21.511 -15.775 5.646 1.00 0.00 O ATOM 0 H GLU A 114 20.628 -17.411 0.948 1.00 0.00 H new ATOM 0 HA GLU A 114 18.228 -17.070 2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 114 20.822 -15.636 2.451 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.370 -14.664 2.590 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.620 -15.943 4.486 1.00 0.00 H new ATOM 0 HG3 GLU A 114 19.939 -17.081 4.295 1.00 0.00 H new ATOM 1731 N LYS A 115 18.492 -16.652 -0.380 1.00 0.00 N ATOM 1732 CA LYS A 115 17.809 -16.217 -1.549 1.00 0.00 C ATOM 1733 C LYS A 115 18.315 -14.875 -2.107 1.00 0.00 C ATOM 1734 O LYS A 115 17.740 -14.330 -3.063 1.00 0.00 O ATOM 1735 CB LYS A 115 16.360 -16.127 -1.187 1.00 0.00 C ATOM 1736 CG LYS A 115 15.631 -17.448 -1.052 1.00 0.00 C ATOM 1737 CD LYS A 115 14.200 -17.207 -0.587 1.00 0.00 C ATOM 1738 CE LYS A 115 13.402 -18.492 -0.477 1.00 0.00 C ATOM 1739 NZ LYS A 115 12.000 -18.236 -0.056 1.00 0.00 N ATOM 0 H LYS A 115 19.041 -17.501 -0.512 1.00 0.00 H new ATOM 0 HA LYS A 115 17.991 -16.933 -2.351 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.273 -15.588 -0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.852 -15.529 -1.944 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.628 -17.971 -2.008 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.151 -18.089 -0.340 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.215 -16.708 0.382 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.703 -16.533 -1.285 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.405 -19.005 -1.439 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.881 -19.157 0.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.487 -19.138 0.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.996 -17.769 0.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.535 -17.622 -0.754 1.00 0.00 H new ATOM 1752 N VAL A 116 19.387 -14.362 -1.563 1.00 0.00 N ATOM 1753 CA VAL A 116 19.858 -13.065 -1.968 1.00 0.00 C ATOM 1754 C VAL A 116 21.188 -13.130 -2.655 1.00 0.00 C ATOM 1755 O VAL A 116 22.008 -13.993 -2.363 1.00 0.00 O ATOM 1756 CB VAL A 116 19.860 -12.056 -0.809 1.00 0.00 C ATOM 1757 CG1 VAL A 116 18.439 -11.642 -0.509 1.00 0.00 C ATOM 1758 CG2 VAL A 116 20.493 -12.668 0.431 1.00 0.00 C ATOM 0 H VAL A 116 19.947 -14.819 -0.843 1.00 0.00 H new ATOM 0 HA VAL A 116 19.143 -12.697 -2.704 1.00 0.00 H new ATOM 0 HB VAL A 116 20.445 -11.183 -1.098 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.434 -10.926 0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 116 18.000 -11.182 -1.394 1.00 0.00 H new ATOM 0 HG13 VAL A 116 17.856 -12.519 -0.229 1.00 0.00 H new ATOM 0 HG21 VAL A 116 20.485 -11.939 1.241 1.00 0.00 H new ATOM 0 HG22 VAL A 116 19.927 -13.550 0.731 1.00 0.00 H new ATOM 0 HG23 VAL A 116 21.521 -12.955 0.211 1.00 0.00 H new ATOM 1768 N ASP A 117 21.391 -12.252 -3.589 1.00 0.00 N ATOM 1769 CA ASP A 117 22.611 -12.261 -4.352 1.00 0.00 C ATOM 1770 C ASP A 117 23.436 -11.028 -4.056 1.00 0.00 C ATOM 1771 O ASP A 117 22.925 -9.892 -4.074 1.00 0.00 O ATOM 1772 CB ASP A 117 22.318 -12.372 -5.856 1.00 0.00 C ATOM 1773 CG ASP A 117 23.574 -12.371 -6.711 1.00 0.00 C ATOM 1774 OD1 ASP A 117 24.178 -13.456 -6.916 1.00 0.00 O ATOM 1775 OD2 ASP A 117 23.976 -11.296 -7.210 1.00 0.00 O ATOM 0 H ASP A 117 20.730 -11.518 -3.845 1.00 0.00 H new ATOM 0 HA ASP A 117 23.188 -13.137 -4.056 1.00 0.00 H new ATOM 0 HB2 ASP A 117 21.759 -13.288 -6.044 1.00 0.00 H new ATOM 0 HB3 ASP A 117 21.680 -11.541 -6.158 1.00 0.00 H new ATOM 1780 N ILE A 118 24.680 -11.250 -3.736 1.00 0.00 N ATOM 1781 CA ILE A 118 25.620 -10.198 -3.465 1.00 0.00 C ATOM 1782 C ILE A 118 26.465 -9.911 -4.715 1.00 0.00 C ATOM 1783 O ILE A 118 26.930 -10.839 -5.390 1.00 0.00 O ATOM 1784 CB ILE A 118 26.517 -10.590 -2.263 1.00 0.00 C ATOM 1785 CG1 ILE A 118 27.155 -11.975 -2.474 1.00 0.00 C ATOM 1786 CG2 ILE A 118 25.720 -10.558 -0.971 1.00 0.00 C ATOM 1787 CD1 ILE A 118 27.898 -12.487 -1.272 1.00 0.00 C ATOM 0 H ILE A 118 25.077 -12.186 -3.655 1.00 0.00 H new ATOM 0 HA ILE A 118 25.079 -9.288 -3.206 1.00 0.00 H new ATOM 0 HB ILE A 118 27.322 -9.859 -2.191 1.00 0.00 H new ATOM 0 HG12 ILE A 118 26.374 -12.688 -2.739 1.00 0.00 H new ATOM 0 HG13 ILE A 118 27.841 -11.924 -3.320 1.00 0.00 H new ATOM 0 HG21 ILE A 118 26.366 -10.836 -0.138 1.00 0.00 H new ATOM 0 HG22 ILE A 118 25.331 -9.553 -0.809 1.00 0.00 H new ATOM 0 HG23 ILE A 118 24.891 -11.262 -1.038 1.00 0.00 H new ATOM 0 HD11 ILE A 118 28.320 -13.467 -1.495 1.00 0.00 H new ATOM 0 HD12 ILE A 118 28.701 -11.795 -1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 118 27.212 -12.571 -0.429 1.00 0.00 H new ATOM 1799 N ARG A 119 26.624 -8.653 -5.044 1.00 0.00 N ATOM 1800 CA ARG A 119 27.376 -8.269 -6.219 1.00 0.00 C ATOM 1801 C ARG A 119 28.569 -7.434 -5.785 1.00 0.00 C ATOM 1802 O ARG A 119 28.435 -6.556 -4.939 1.00 0.00 O ATOM 1803 CB ARG A 119 26.462 -7.500 -7.185 1.00 0.00 C ATOM 1804 CG ARG A 119 27.020 -7.305 -8.596 1.00 0.00 C ATOM 1805 CD ARG A 119 27.445 -8.637 -9.222 1.00 0.00 C ATOM 1806 NE ARG A 119 26.438 -9.704 -9.037 1.00 0.00 N ATOM 1807 CZ ARG A 119 26.442 -10.886 -9.661 1.00 0.00 C ATOM 1808 NH1 ARG A 119 27.289 -11.123 -10.667 1.00 0.00 N ATOM 1809 NH2 ARG A 119 25.586 -11.824 -9.288 1.00 0.00 N ATOM 0 H ARG A 119 26.241 -7.871 -4.513 1.00 0.00 H new ATOM 0 HA ARG A 119 27.746 -9.149 -6.745 1.00 0.00 H new ATOM 0 HB2 ARG A 119 25.511 -8.028 -7.258 1.00 0.00 H new ATOM 0 HB3 ARG A 119 26.251 -6.520 -6.757 1.00 0.00 H new ATOM 0 HG2 ARG A 119 26.266 -6.831 -9.224 1.00 0.00 H new ATOM 0 HG3 ARG A 119 27.875 -6.630 -8.560 1.00 0.00 H new ATOM 0 HD2 ARG A 119 27.623 -8.492 -10.288 1.00 0.00 H new ATOM 0 HD3 ARG A 119 28.390 -8.955 -8.782 1.00 0.00 H new ATOM 0 HE ARG A 119 25.679 -9.523 -8.380 1.00 0.00 H new ATOM 0 HH11 ARG A 119 27.941 -10.398 -10.966 1.00 0.00 H new ATOM 0 HH12 ARG A 119 27.283 -12.029 -11.136 1.00 0.00 H new ATOM 0 HH21 ARG A 119 24.929 -11.642 -8.529 1.00 0.00 H new ATOM 0 HH22 ARG A 119 25.583 -12.728 -9.760 1.00 0.00 H new ATOM 1822 N LEU A 120 29.733 -7.720 -6.336 1.00 0.00 N ATOM 1823 CA LEU A 120 30.947 -7.064 -5.896 1.00 0.00 C ATOM 1824 C LEU A 120 31.610 -6.257 -6.980 1.00 0.00 C ATOM 1825 O LEU A 120 31.765 -6.729 -8.112 1.00 0.00 O ATOM 1826 CB LEU A 120 31.969 -8.070 -5.325 1.00 0.00 C ATOM 1827 CG LEU A 120 31.620 -8.758 -4.000 1.00 0.00 C ATOM 1828 CD1 LEU A 120 31.229 -7.734 -2.960 1.00 0.00 C ATOM 1829 CD2 LEU A 120 30.544 -9.827 -4.159 1.00 0.00 C ATOM 0 H LEU A 120 29.863 -8.399 -7.086 1.00 0.00 H new ATOM 0 HA LEU A 120 30.629 -6.380 -5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 120 32.132 -8.845 -6.074 1.00 0.00 H new ATOM 0 HB3 LEU A 120 32.917 -7.549 -5.194 1.00 0.00 H new ATOM 0 HG LEU A 120 32.517 -9.276 -3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 120 30.984 -8.239 -2.026 1.00 0.00 H new ATOM 0 HD12 LEU A 120 32.060 -7.048 -2.795 1.00 0.00 H new ATOM 0 HD13 LEU A 120 30.360 -7.175 -3.308 1.00 0.00 H new ATOM 0 HD21 LEU A 120 30.336 -10.281 -3.190 1.00 0.00 H new ATOM 0 HD22 LEU A 120 29.634 -9.372 -4.549 1.00 0.00 H new ATOM 0 HD23 LEU A 120 30.892 -10.593 -4.852 1.00 0.00 H new