USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=9 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= 0.273 K(o=0.98,f=0.16) USER MOD Set 1.2: A 72 LYS NZ :NH3+ -117:sc= 0.712 (180deg=0.166) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0.937! (180deg=0.937!) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.51 K(o=-1.5,f=-4.2!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -0.377 K(o=-0.38,f=-3.3!) USER MOD Single : A 82 THR OG1 : rot 180:sc=-0.00595 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0173 USER MOD Single : A 87 SER OG : rot 180:sc= 0.00909 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot -38:sc= 0.762 USER MOD Single : A 93 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.52) USER MOD Single : A 100 ASN : amide:sc= -0.15 K(o=-0.15,f=-1.3!) USER MOD Single : A 106 ASN : amide:sc= 0.371 K(o=0.37,f=-3.7!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot -37:sc= 0.0843 USER MOD Single : A 115 LYS NZ :NH3+ -137:sc= -0.246 (180deg=-1.94!) USER MOD ----------------------------------------------------------------- ATOM 675 N ASN A 43 14.283 -1.754 -2.734 1.00 0.00 N ATOM 676 CA ASN A 43 15.103 -1.406 -1.612 1.00 0.00 C ATOM 677 C ASN A 43 16.465 -2.003 -1.793 1.00 0.00 C ATOM 678 O ASN A 43 16.589 -3.129 -2.287 1.00 0.00 O ATOM 679 CB ASN A 43 14.494 -1.845 -0.279 1.00 0.00 C ATOM 680 CG ASN A 43 13.356 -0.951 0.213 1.00 0.00 C ATOM 681 OD1 ASN A 43 13.590 0.033 0.929 1.00 0.00 O ATOM 682 ND2 ASN A 43 12.133 -1.293 -0.112 1.00 0.00 N ATOM 0 HA ASN A 43 15.175 -0.319 -1.574 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.123 -2.865 -0.380 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.279 -1.865 0.477 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.343 -0.744 0.226 1.00 0.00 H new ATOM 0 HD22 ASN A 43 11.971 -2.108 -0.703 1.00 0.00 H new ATOM 689 N LEU A 44 17.486 -1.260 -1.440 1.00 0.00 N ATOM 690 CA LEU A 44 18.855 -1.702 -1.621 1.00 0.00 C ATOM 691 C LEU A 44 19.706 -1.449 -0.381 1.00 0.00 C ATOM 692 O LEU A 44 19.335 -0.678 0.517 1.00 0.00 O ATOM 693 CB LEU A 44 19.500 -0.980 -2.819 1.00 0.00 C ATOM 694 CG LEU A 44 18.870 -1.213 -4.200 1.00 0.00 C ATOM 695 CD1 LEU A 44 19.561 -0.352 -5.245 1.00 0.00 C ATOM 696 CD2 LEU A 44 18.958 -2.678 -4.593 1.00 0.00 C ATOM 0 H LEU A 44 17.396 -0.335 -1.020 1.00 0.00 H new ATOM 0 HA LEU A 44 18.818 -2.776 -1.804 1.00 0.00 H new ATOM 0 HB2 LEU A 44 19.484 0.091 -2.617 1.00 0.00 H new ATOM 0 HB3 LEU A 44 20.547 -1.279 -2.870 1.00 0.00 H new ATOM 0 HG LEU A 44 17.818 -0.932 -4.147 1.00 0.00 H new ATOM 0 HD11 LEU A 44 19.105 -0.527 -6.220 1.00 0.00 H new ATOM 0 HD12 LEU A 44 19.455 0.699 -4.978 1.00 0.00 H new ATOM 0 HD13 LEU A 44 20.619 -0.611 -5.288 1.00 0.00 H new ATOM 0 HD21 LEU A 44 18.506 -2.819 -5.575 1.00 0.00 H new ATOM 0 HD22 LEU A 44 20.004 -2.983 -4.628 1.00 0.00 H new ATOM 0 HD23 LEU A 44 18.428 -3.284 -3.859 1.00 0.00 H new ATOM 708 N ILE A 45 20.831 -2.110 -0.344 1.00 0.00 N ATOM 709 CA ILE A 45 21.832 -1.923 0.674 1.00 0.00 C ATOM 710 C ILE A 45 23.116 -1.478 0.011 1.00 0.00 C ATOM 711 O ILE A 45 23.505 -2.018 -1.038 1.00 0.00 O ATOM 712 CB ILE A 45 22.047 -3.193 1.583 1.00 0.00 C ATOM 713 CG1 ILE A 45 23.406 -3.148 2.261 1.00 0.00 C ATOM 714 CG2 ILE A 45 22.011 -4.417 0.767 1.00 0.00 C ATOM 715 CD1 ILE A 45 23.517 -3.917 3.553 1.00 0.00 C ATOM 0 H ILE A 45 21.085 -2.812 -1.039 1.00 0.00 H new ATOM 0 HA ILE A 45 21.482 -1.151 1.359 1.00 0.00 H new ATOM 0 HB ILE A 45 21.250 -3.197 2.327 1.00 0.00 H new ATOM 0 HG12 ILE A 45 24.152 -3.533 1.565 1.00 0.00 H new ATOM 0 HG13 ILE A 45 23.660 -2.106 2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 45 22.161 -5.286 1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 45 21.044 -4.495 0.270 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.802 -4.378 0.018 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.527 -3.817 3.950 1.00 0.00 H new ATOM 0 HD12 ILE A 45 22.802 -3.521 4.275 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.302 -4.970 3.369 1.00 0.00 H new ATOM 727 N VAL A 46 23.744 -0.490 0.581 1.00 0.00 N ATOM 728 CA VAL A 46 24.928 0.065 0.001 1.00 0.00 C ATOM 729 C VAL A 46 26.162 -0.221 0.866 1.00 0.00 C ATOM 730 O VAL A 46 26.191 0.083 2.069 1.00 0.00 O ATOM 731 CB VAL A 46 24.777 1.593 -0.259 1.00 0.00 C ATOM 732 CG1 VAL A 46 26.061 2.177 -0.799 1.00 0.00 C ATOM 733 CG2 VAL A 46 23.647 1.869 -1.240 1.00 0.00 C ATOM 0 H VAL A 46 23.451 -0.051 1.454 1.00 0.00 H new ATOM 0 HA VAL A 46 25.072 -0.423 -0.963 1.00 0.00 H new ATOM 0 HB VAL A 46 24.543 2.065 0.695 1.00 0.00 H new ATOM 0 HG11 VAL A 46 25.930 3.245 -0.972 1.00 0.00 H new ATOM 0 HG12 VAL A 46 26.863 2.022 -0.077 1.00 0.00 H new ATOM 0 HG13 VAL A 46 26.318 1.686 -1.738 1.00 0.00 H new ATOM 0 HG21 VAL A 46 23.562 2.943 -1.405 1.00 0.00 H new ATOM 0 HG22 VAL A 46 23.858 1.372 -2.187 1.00 0.00 H new ATOM 0 HG23 VAL A 46 22.710 1.489 -0.832 1.00 0.00 H new ATOM 743 N LYS A 47 27.139 -0.844 0.247 1.00 0.00 N ATOM 744 CA LYS A 47 28.428 -1.150 0.843 1.00 0.00 C ATOM 745 C LYS A 47 29.532 -0.774 -0.114 1.00 0.00 C ATOM 746 O LYS A 47 29.360 -0.863 -1.342 1.00 0.00 O ATOM 747 CB LYS A 47 28.569 -2.637 1.168 1.00 0.00 C ATOM 748 CG LYS A 47 27.825 -3.109 2.391 1.00 0.00 C ATOM 749 CD LYS A 47 28.028 -4.595 2.571 1.00 0.00 C ATOM 750 CE LYS A 47 27.443 -5.087 3.868 1.00 0.00 C ATOM 751 NZ LYS A 47 28.216 -4.630 5.047 1.00 0.00 N ATOM 0 H LYS A 47 27.059 -1.164 -0.718 1.00 0.00 H new ATOM 0 HA LYS A 47 28.498 -0.579 1.769 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.223 -3.213 0.309 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.627 -2.863 1.298 1.00 0.00 H new ATOM 0 HG2 LYS A 47 28.180 -2.575 3.272 1.00 0.00 H new ATOM 0 HG3 LYS A 47 26.763 -2.887 2.290 1.00 0.00 H new ATOM 0 HD2 LYS A 47 27.567 -5.128 1.739 1.00 0.00 H new ATOM 0 HD3 LYS A 47 29.094 -4.822 2.544 1.00 0.00 H new ATOM 0 HE2 LYS A 47 26.414 -4.738 3.954 1.00 0.00 H new ATOM 0 HE3 LYS A 47 27.411 -6.176 3.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 27.774 -4.995 5.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 29.192 -4.984 4.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 28.226 -3.590 5.074 1.00 0.00 H new ATOM 764 N ALA A 48 30.652 -0.367 0.425 1.00 0.00 N ATOM 765 CA ALA A 48 31.802 -0.013 -0.361 1.00 0.00 C ATOM 766 C ALA A 48 33.028 -0.060 0.516 1.00 0.00 C ATOM 767 O ALA A 48 32.903 -0.047 1.736 1.00 0.00 O ATOM 768 CB ALA A 48 31.634 1.372 -0.972 1.00 0.00 C ATOM 0 H ALA A 48 30.791 -0.272 1.431 1.00 0.00 H new ATOM 0 HA ALA A 48 31.912 -0.724 -1.180 1.00 0.00 H new ATOM 0 HB1 ALA A 48 32.516 1.619 -1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 48 30.753 1.382 -1.614 1.00 0.00 H new ATOM 0 HB3 ALA A 48 31.512 2.108 -0.177 1.00 0.00 H new ATOM 774 N ASP A 49 34.201 -0.128 -0.101 1.00 0.00 N ATOM 775 CA ASP A 49 35.480 -0.162 0.638 1.00 0.00 C ATOM 776 C ASP A 49 35.880 1.263 1.035 1.00 0.00 C ATOM 777 O ASP A 49 36.817 1.494 1.798 1.00 0.00 O ATOM 778 CB ASP A 49 36.565 -0.840 -0.230 1.00 0.00 C ATOM 779 CG ASP A 49 37.902 -1.031 0.472 1.00 0.00 C ATOM 780 OD1 ASP A 49 37.952 -1.734 1.497 1.00 0.00 O ATOM 781 OD2 ASP A 49 38.946 -0.530 -0.038 1.00 0.00 O ATOM 0 H ASP A 49 34.305 -0.161 -1.115 1.00 0.00 H new ATOM 0 HA ASP A 49 35.369 -0.747 1.551 1.00 0.00 H new ATOM 0 HB2 ASP A 49 36.197 -1.813 -0.556 1.00 0.00 H new ATOM 0 HB3 ASP A 49 36.722 -0.242 -1.127 1.00 0.00 H new ATOM 786 N VAL A 50 35.141 2.209 0.491 1.00 0.00 N ATOM 787 CA VAL A 50 35.271 3.606 0.774 1.00 0.00 C ATOM 788 C VAL A 50 33.980 4.038 1.451 1.00 0.00 C ATOM 789 O VAL A 50 32.897 3.855 0.880 1.00 0.00 O ATOM 790 CB VAL A 50 35.438 4.411 -0.537 1.00 0.00 C ATOM 791 CG1 VAL A 50 35.479 5.896 -0.258 1.00 0.00 C ATOM 792 CG2 VAL A 50 36.681 3.976 -1.291 1.00 0.00 C ATOM 0 H VAL A 50 34.406 2.007 -0.187 1.00 0.00 H new ATOM 0 HA VAL A 50 36.143 3.786 1.403 1.00 0.00 H new ATOM 0 HB VAL A 50 34.571 4.205 -1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 50 35.597 6.439 -1.196 1.00 0.00 H new ATOM 0 HG12 VAL A 50 34.550 6.201 0.224 1.00 0.00 H new ATOM 0 HG13 VAL A 50 36.319 6.120 0.399 1.00 0.00 H new ATOM 0 HG21 VAL A 50 36.773 4.558 -2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 50 37.560 4.139 -0.668 1.00 0.00 H new ATOM 0 HG23 VAL A 50 36.604 2.918 -1.540 1.00 0.00 H new ATOM 802 N GLN A 51 34.078 4.605 2.636 1.00 0.00 N ATOM 803 CA GLN A 51 32.901 4.980 3.412 1.00 0.00 C ATOM 804 C GLN A 51 32.004 5.942 2.676 1.00 0.00 C ATOM 805 O GLN A 51 30.831 5.701 2.541 1.00 0.00 O ATOM 806 CB GLN A 51 33.266 5.559 4.764 1.00 0.00 C ATOM 807 CG GLN A 51 32.047 5.877 5.611 1.00 0.00 C ATOM 808 CD GLN A 51 32.381 6.593 6.882 1.00 0.00 C ATOM 809 OE1 GLN A 51 33.463 6.423 7.455 1.00 0.00 O ATOM 810 NE2 GLN A 51 31.467 7.391 7.339 1.00 0.00 N ATOM 0 H GLN A 51 34.966 4.820 3.090 1.00 0.00 H new ATOM 0 HA GLN A 51 32.351 4.052 3.568 1.00 0.00 H new ATOM 0 HB2 GLN A 51 33.901 4.852 5.298 1.00 0.00 H new ATOM 0 HB3 GLN A 51 33.851 6.467 4.620 1.00 0.00 H new ATOM 0 HG2 GLN A 51 31.357 6.488 5.028 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.527 4.949 5.850 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.588 7.502 6.834 1.00 0.00 H new ATOM 0 HE22 GLN A 51 31.627 7.908 8.204 1.00 0.00 H new ATOM 819 N GLY A 52 32.544 6.987 2.149 1.00 0.00 N ATOM 820 CA GLY A 52 31.695 7.947 1.504 1.00 0.00 C ATOM 821 C GLY A 52 31.216 7.519 0.137 1.00 0.00 C ATOM 822 O GLY A 52 30.492 8.248 -0.518 1.00 0.00 O ATOM 0 H GLY A 52 33.541 7.202 2.147 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.829 8.136 2.139 1.00 0.00 H new ATOM 0 HA3 GLY A 52 32.234 8.890 1.411 1.00 0.00 H new ATOM 826 N SER A 53 31.555 6.307 -0.265 1.00 0.00 N ATOM 827 CA SER A 53 31.088 5.792 -1.508 1.00 0.00 C ATOM 828 C SER A 53 29.736 5.179 -1.214 1.00 0.00 C ATOM 829 O SER A 53 28.901 4.997 -2.106 1.00 0.00 O ATOM 830 CB SER A 53 32.082 4.765 -2.089 1.00 0.00 C ATOM 831 OG SER A 53 31.704 4.307 -3.382 1.00 0.00 O ATOM 0 H SER A 53 32.154 5.672 0.263 1.00 0.00 H new ATOM 0 HA SER A 53 31.002 6.570 -2.266 1.00 0.00 H new ATOM 0 HB2 SER A 53 33.073 5.215 -2.143 1.00 0.00 H new ATOM 0 HB3 SER A 53 32.155 3.913 -1.413 1.00 0.00 H new ATOM 0 HG SER A 53 32.365 3.661 -3.706 1.00 0.00 H new ATOM 837 N VAL A 54 29.510 4.895 0.074 1.00 0.00 N ATOM 838 CA VAL A 54 28.243 4.433 0.498 1.00 0.00 C ATOM 839 C VAL A 54 27.346 5.644 0.650 1.00 0.00 C ATOM 840 O VAL A 54 26.258 5.696 0.102 1.00 0.00 O ATOM 841 CB VAL A 54 28.283 3.576 1.822 1.00 0.00 C ATOM 842 CG1 VAL A 54 29.333 2.493 1.785 1.00 0.00 C ATOM 843 CG2 VAL A 54 28.320 4.359 3.139 1.00 0.00 C ATOM 0 H VAL A 54 30.204 4.986 0.816 1.00 0.00 H new ATOM 0 HA VAL A 54 27.855 3.747 -0.255 1.00 0.00 H new ATOM 0 HB VAL A 54 27.302 3.101 1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 54 29.314 1.936 2.722 1.00 0.00 H new ATOM 0 HG12 VAL A 54 29.128 1.816 0.956 1.00 0.00 H new ATOM 0 HG13 VAL A 54 30.316 2.944 1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.346 3.662 3.976 1.00 0.00 H new ATOM 0 HG22 VAL A 54 29.210 4.988 3.163 1.00 0.00 H new ATOM 0 HG23 VAL A 54 27.431 4.985 3.215 1.00 0.00 H new ATOM 853 N GLU A 55 27.898 6.654 1.301 1.00 0.00 N ATOM 854 CA GLU A 55 27.222 7.912 1.600 1.00 0.00 C ATOM 855 C GLU A 55 26.720 8.599 0.344 1.00 0.00 C ATOM 856 O GLU A 55 25.549 8.958 0.262 1.00 0.00 O ATOM 857 CB GLU A 55 28.156 8.840 2.374 1.00 0.00 C ATOM 858 CG GLU A 55 28.580 8.292 3.726 1.00 0.00 C ATOM 859 CD GLU A 55 27.423 8.189 4.688 1.00 0.00 C ATOM 860 OE1 GLU A 55 26.659 7.210 4.636 1.00 0.00 O ATOM 861 OE2 GLU A 55 27.252 9.106 5.512 1.00 0.00 O ATOM 0 H GLU A 55 28.857 6.624 1.648 1.00 0.00 H new ATOM 0 HA GLU A 55 26.352 7.680 2.215 1.00 0.00 H new ATOM 0 HB2 GLU A 55 29.046 9.029 1.773 1.00 0.00 H new ATOM 0 HB3 GLU A 55 27.661 9.800 2.520 1.00 0.00 H new ATOM 0 HG2 GLU A 55 29.028 7.307 3.593 1.00 0.00 H new ATOM 0 HG3 GLU A 55 29.348 8.937 4.153 1.00 0.00 H new ATOM 868 N ALA A 56 27.600 8.745 -0.641 1.00 0.00 N ATOM 869 CA ALA A 56 27.256 9.404 -1.901 1.00 0.00 C ATOM 870 C ALA A 56 26.085 8.713 -2.595 1.00 0.00 C ATOM 871 O ALA A 56 25.177 9.376 -3.109 1.00 0.00 O ATOM 872 CB ALA A 56 28.464 9.450 -2.823 1.00 0.00 C ATOM 0 H ALA A 56 28.564 8.414 -0.592 1.00 0.00 H new ATOM 0 HA ALA A 56 26.949 10.424 -1.668 1.00 0.00 H new ATOM 0 HB1 ALA A 56 28.191 9.943 -3.756 1.00 0.00 H new ATOM 0 HB2 ALA A 56 29.269 10.005 -2.341 1.00 0.00 H new ATOM 0 HB3 ALA A 56 28.799 8.435 -3.034 1.00 0.00 H new ATOM 878 N LEU A 57 26.089 7.388 -2.565 1.00 0.00 N ATOM 879 CA LEU A 57 25.055 6.612 -3.208 1.00 0.00 C ATOM 880 C LEU A 57 23.764 6.681 -2.393 1.00 0.00 C ATOM 881 O LEU A 57 22.692 6.890 -2.944 1.00 0.00 O ATOM 882 CB LEU A 57 25.535 5.164 -3.431 1.00 0.00 C ATOM 883 CG LEU A 57 24.571 4.200 -4.143 1.00 0.00 C ATOM 884 CD1 LEU A 57 24.118 4.772 -5.479 1.00 0.00 C ATOM 885 CD2 LEU A 57 25.256 2.862 -4.374 1.00 0.00 C ATOM 0 H LEU A 57 26.804 6.831 -2.097 1.00 0.00 H new ATOM 0 HA LEU A 57 24.840 7.032 -4.190 1.00 0.00 H new ATOM 0 HB2 LEU A 57 26.460 5.201 -4.006 1.00 0.00 H new ATOM 0 HB3 LEU A 57 25.781 4.737 -2.459 1.00 0.00 H new ATOM 0 HG LEU A 57 23.696 4.062 -3.507 1.00 0.00 H new ATOM 0 HD11 LEU A 57 23.437 4.072 -5.963 1.00 0.00 H new ATOM 0 HD12 LEU A 57 23.606 5.720 -5.314 1.00 0.00 H new ATOM 0 HD13 LEU A 57 24.986 4.934 -6.118 1.00 0.00 H new ATOM 0 HD21 LEU A 57 24.568 2.183 -4.879 1.00 0.00 H new ATOM 0 HD22 LEU A 57 26.141 3.008 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.550 2.434 -3.416 1.00 0.00 H new ATOM 897 N VAL A 58 23.888 6.564 -1.075 1.00 0.00 N ATOM 898 CA VAL A 58 22.747 6.665 -0.154 1.00 0.00 C ATOM 899 C VAL A 58 22.056 8.009 -0.287 1.00 0.00 C ATOM 900 O VAL A 58 20.841 8.081 -0.324 1.00 0.00 O ATOM 901 CB VAL A 58 23.185 6.439 1.319 1.00 0.00 C ATOM 902 CG1 VAL A 58 22.072 6.779 2.314 1.00 0.00 C ATOM 903 CG2 VAL A 58 23.606 5.007 1.500 1.00 0.00 C ATOM 0 H VAL A 58 24.780 6.396 -0.609 1.00 0.00 H new ATOM 0 HA VAL A 58 22.042 5.880 -0.428 1.00 0.00 H new ATOM 0 HB VAL A 58 24.020 7.109 1.523 1.00 0.00 H new ATOM 0 HG11 VAL A 58 22.426 6.605 3.330 1.00 0.00 H new ATOM 0 HG12 VAL A 58 21.791 7.826 2.202 1.00 0.00 H new ATOM 0 HG13 VAL A 58 21.205 6.148 2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 58 23.914 4.846 2.533 1.00 0.00 H new ATOM 0 HG22 VAL A 58 22.770 4.349 1.264 1.00 0.00 H new ATOM 0 HG23 VAL A 58 24.440 4.786 0.834 1.00 0.00 H new ATOM 913 N ALA A 59 22.837 9.045 -0.438 1.00 0.00 N ATOM 914 CA ALA A 59 22.321 10.407 -0.546 1.00 0.00 C ATOM 915 C ALA A 59 21.558 10.646 -1.844 1.00 0.00 C ATOM 916 O ALA A 59 20.865 11.654 -1.991 1.00 0.00 O ATOM 917 CB ALA A 59 23.435 11.413 -0.362 1.00 0.00 C ATOM 0 H ALA A 59 23.854 8.981 -0.491 1.00 0.00 H new ATOM 0 HA ALA A 59 21.598 10.543 0.258 1.00 0.00 H new ATOM 0 HB1 ALA A 59 23.031 12.422 -0.446 1.00 0.00 H new ATOM 0 HB2 ALA A 59 23.884 11.282 0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 59 24.193 11.261 -1.130 1.00 0.00 H new ATOM 923 N ALA A 60 21.669 9.733 -2.764 1.00 0.00 N ATOM 924 CA ALA A 60 20.930 9.824 -3.991 1.00 0.00 C ATOM 925 C ALA A 60 19.773 8.874 -3.898 1.00 0.00 C ATOM 926 O ALA A 60 18.693 9.134 -4.365 1.00 0.00 O ATOM 927 CB ALA A 60 21.812 9.461 -5.168 1.00 0.00 C ATOM 0 H ALA A 60 22.268 8.911 -2.688 1.00 0.00 H new ATOM 0 HA ALA A 60 20.575 10.843 -4.143 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.236 9.535 -6.091 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.659 10.146 -5.213 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.176 8.441 -5.049 1.00 0.00 H new ATOM 933 N LEU A 61 20.008 7.821 -3.191 1.00 0.00 N ATOM 934 CA LEU A 61 19.080 6.734 -3.044 1.00 0.00 C ATOM 935 C LEU A 61 17.944 7.110 -2.087 1.00 0.00 C ATOM 936 O LEU A 61 16.840 6.618 -2.196 1.00 0.00 O ATOM 937 CB LEU A 61 19.856 5.533 -2.518 1.00 0.00 C ATOM 938 CG LEU A 61 19.877 4.255 -3.369 1.00 0.00 C ATOM 939 CD1 LEU A 61 18.490 3.665 -3.507 1.00 0.00 C ATOM 940 CD2 LEU A 61 20.483 4.523 -4.739 1.00 0.00 C ATOM 0 H LEU A 61 20.879 7.682 -2.679 1.00 0.00 H new ATOM 0 HA LEU A 61 18.622 6.497 -4.004 1.00 0.00 H new ATOM 0 HB2 LEU A 61 20.888 5.846 -2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.449 5.276 -1.540 1.00 0.00 H new ATOM 0 HG LEU A 61 20.503 3.527 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU A 61 18.538 2.761 -4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.100 3.418 -2.520 1.00 0.00 H new ATOM 0 HD13 LEU A 61 17.832 4.390 -3.986 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.486 3.602 -5.322 1.00 0.00 H new ATOM 0 HD22 LEU A 61 19.892 5.278 -5.257 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.506 4.881 -4.621 1.00 0.00 H new ATOM 952 N GLN A 62 18.229 7.989 -1.158 1.00 0.00 N ATOM 953 CA GLN A 62 17.225 8.430 -0.198 1.00 0.00 C ATOM 954 C GLN A 62 16.347 9.541 -0.770 1.00 0.00 C ATOM 955 O GLN A 62 15.305 9.858 -0.218 1.00 0.00 O ATOM 956 CB GLN A 62 17.877 8.894 1.108 1.00 0.00 C ATOM 957 CG GLN A 62 18.787 10.107 0.968 1.00 0.00 C ATOM 958 CD GLN A 62 19.477 10.491 2.266 1.00 0.00 C ATOM 959 OE1 GLN A 62 20.586 11.020 2.249 1.00 0.00 O ATOM 960 NE2 GLN A 62 18.839 10.246 3.385 1.00 0.00 N ATOM 0 H GLN A 62 19.147 8.418 -1.039 1.00 0.00 H new ATOM 0 HA GLN A 62 16.588 7.571 0.015 1.00 0.00 H new ATOM 0 HB2 GLN A 62 17.092 9.127 1.828 1.00 0.00 H new ATOM 0 HB3 GLN A 62 18.455 8.069 1.523 1.00 0.00 H new ATOM 0 HG2 GLN A 62 19.542 9.901 0.210 1.00 0.00 H new ATOM 0 HG3 GLN A 62 18.201 10.954 0.612 1.00 0.00 H new ATOM 0 HE21 GLN A 62 17.919 9.805 3.362 1.00 0.00 H new ATOM 0 HE22 GLN A 62 19.262 10.496 4.279 1.00 0.00 H new ATOM 969 N LYS A 63 16.770 10.137 -1.875 1.00 0.00 N ATOM 970 CA LYS A 63 15.985 11.211 -2.465 1.00 0.00 C ATOM 971 C LYS A 63 15.099 10.712 -3.598 1.00 0.00 C ATOM 972 O LYS A 63 14.442 11.513 -4.270 1.00 0.00 O ATOM 973 CB LYS A 63 16.878 12.424 -2.902 1.00 0.00 C ATOM 974 CG LYS A 63 17.985 12.156 -3.947 1.00 0.00 C ATOM 975 CD LYS A 63 17.473 11.857 -5.370 1.00 0.00 C ATOM 976 CE LYS A 63 16.759 13.050 -5.999 1.00 0.00 C ATOM 977 NZ LYS A 63 16.297 12.756 -7.378 1.00 0.00 N ATOM 0 H LYS A 63 17.630 9.903 -2.371 1.00 0.00 H new ATOM 0 HA LYS A 63 15.319 11.580 -1.685 1.00 0.00 H new ATOM 0 HB2 LYS A 63 16.222 13.199 -3.298 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.351 12.833 -2.009 1.00 0.00 H new ATOM 0 HG2 LYS A 63 18.644 13.023 -3.988 1.00 0.00 H new ATOM 0 HG3 LYS A 63 18.588 11.313 -3.609 1.00 0.00 H new ATOM 0 HD2 LYS A 63 18.313 11.567 -6.001 1.00 0.00 H new ATOM 0 HD3 LYS A 63 16.792 11.007 -5.336 1.00 0.00 H new ATOM 0 HE2 LYS A 63 15.905 13.328 -5.382 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.432 13.907 -6.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 15.817 13.592 -7.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 17.115 12.515 -7.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 15.635 11.954 -7.359 1.00 0.00 H new ATOM 1098 N VAL A 71 12.664 3.645 -4.942 1.00 0.00 N ATOM 1099 CA VAL A 71 13.880 2.903 -4.723 1.00 0.00 C ATOM 1100 C VAL A 71 14.541 3.555 -3.532 1.00 0.00 C ATOM 1101 O VAL A 71 14.814 4.739 -3.566 1.00 0.00 O ATOM 1102 CB VAL A 71 14.858 2.966 -5.947 1.00 0.00 C ATOM 1103 CG1 VAL A 71 16.045 2.036 -5.742 1.00 0.00 C ATOM 1104 CG2 VAL A 71 14.151 2.646 -7.265 1.00 0.00 C ATOM 0 HA VAL A 71 13.647 1.849 -4.569 1.00 0.00 H new ATOM 0 HB VAL A 71 15.223 3.991 -6.011 1.00 0.00 H new ATOM 0 HG11 VAL A 71 16.709 2.098 -6.604 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.588 2.332 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 71 15.690 1.012 -5.630 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.867 2.702 -8.085 1.00 0.00 H new ATOM 0 HG22 VAL A 71 13.731 1.641 -7.218 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.351 3.367 -7.433 1.00 0.00 H new ATOM 1114 N LYS A 72 14.739 2.825 -2.482 1.00 0.00 N ATOM 1115 CA LYS A 72 15.295 3.390 -1.278 1.00 0.00 C ATOM 1116 C LYS A 72 16.283 2.425 -0.656 1.00 0.00 C ATOM 1117 O LYS A 72 16.289 1.241 -0.959 1.00 0.00 O ATOM 1118 CB LYS A 72 14.150 3.703 -0.285 1.00 0.00 C ATOM 1119 CG LYS A 72 14.569 4.343 1.045 1.00 0.00 C ATOM 1120 CD LYS A 72 13.384 4.528 1.992 1.00 0.00 C ATOM 1121 CE LYS A 72 12.746 3.187 2.386 1.00 0.00 C ATOM 1122 NZ LYS A 72 13.710 2.281 3.064 1.00 0.00 N ATOM 0 H LYS A 72 14.525 1.829 -2.426 1.00 0.00 H new ATOM 0 HA LYS A 72 15.823 4.312 -1.520 1.00 0.00 H new ATOM 0 HB2 LYS A 72 13.440 4.368 -0.778 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.620 2.775 -0.068 1.00 0.00 H new ATOM 0 HG2 LYS A 72 15.323 3.719 1.526 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.032 5.310 0.851 1.00 0.00 H new ATOM 0 HD2 LYS A 72 13.716 5.049 2.890 1.00 0.00 H new ATOM 0 HD3 LYS A 72 12.634 5.160 1.515 1.00 0.00 H new ATOM 0 HE2 LYS A 72 11.898 3.371 3.046 1.00 0.00 H new ATOM 0 HE3 LYS A 72 12.356 2.697 1.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 13.845 1.425 2.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.622 2.768 3.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.338 2.015 3.998 1.00 0.00 H new ATOM 1135 N ILE A 73 17.125 2.937 0.174 1.00 0.00 N ATOM 1136 CA ILE A 73 18.058 2.142 0.916 1.00 0.00 C ATOM 1137 C ILE A 73 17.510 1.803 2.296 1.00 0.00 C ATOM 1138 O ILE A 73 16.527 2.404 2.742 1.00 0.00 O ATOM 1139 CB ILE A 73 19.450 2.827 1.026 1.00 0.00 C ATOM 1140 CG1 ILE A 73 19.358 4.373 1.185 1.00 0.00 C ATOM 1141 CG2 ILE A 73 20.306 2.470 -0.161 1.00 0.00 C ATOM 1142 CD1 ILE A 73 18.677 4.882 2.447 1.00 0.00 C ATOM 0 H ILE A 73 17.190 3.937 0.364 1.00 0.00 H new ATOM 0 HA ILE A 73 18.197 1.213 0.364 1.00 0.00 H new ATOM 0 HB ILE A 73 19.914 2.447 1.936 1.00 0.00 H new ATOM 0 HG12 ILE A 73 20.368 4.781 1.153 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.825 4.774 0.323 1.00 0.00 H new ATOM 0 HG21 ILE A 73 21.277 2.957 -0.069 1.00 0.00 H new ATOM 0 HG22 ILE A 73 20.444 1.389 -0.198 1.00 0.00 H new ATOM 0 HG23 ILE A 73 19.817 2.805 -1.076 1.00 0.00 H new ATOM 0 HD11 ILE A 73 18.674 5.972 2.444 1.00 0.00 H new ATOM 0 HD12 ILE A 73 17.651 4.516 2.479 1.00 0.00 H new ATOM 0 HD13 ILE A 73 19.218 4.523 3.322 1.00 0.00 H new ATOM 1154 N ILE A 74 18.078 0.812 2.932 1.00 0.00 N ATOM 1155 CA ILE A 74 17.696 0.506 4.307 1.00 0.00 C ATOM 1156 C ILE A 74 18.925 0.623 5.184 1.00 0.00 C ATOM 1157 O ILE A 74 18.858 1.053 6.334 1.00 0.00 O ATOM 1158 CB ILE A 74 17.160 -0.962 4.541 1.00 0.00 C ATOM 1159 CG1 ILE A 74 16.241 -1.488 3.442 1.00 0.00 C ATOM 1160 CG2 ILE A 74 16.449 -1.074 5.882 1.00 0.00 C ATOM 1161 CD1 ILE A 74 16.984 -2.036 2.251 1.00 0.00 C ATOM 0 H ILE A 74 18.797 0.205 2.538 1.00 0.00 H new ATOM 0 HA ILE A 74 16.895 1.207 4.542 1.00 0.00 H new ATOM 0 HB ILE A 74 18.053 -1.587 4.525 1.00 0.00 H new ATOM 0 HG12 ILE A 74 15.604 -2.270 3.855 1.00 0.00 H new ATOM 0 HG13 ILE A 74 15.584 -0.683 3.112 1.00 0.00 H new ATOM 0 HG21 ILE A 74 16.089 -2.094 6.019 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.143 -0.823 6.684 1.00 0.00 H new ATOM 0 HG23 ILE A 74 15.604 -0.385 5.905 1.00 0.00 H new ATOM 0 HD11 ILE A 74 16.270 -2.392 1.509 1.00 0.00 H new ATOM 0 HD12 ILE A 74 17.600 -1.250 1.814 1.00 0.00 H new ATOM 0 HD13 ILE A 74 17.621 -2.862 2.568 1.00 0.00 H new ATOM 1173 N HIS A 75 20.061 0.279 4.612 1.00 0.00 N ATOM 1174 CA HIS A 75 21.240 0.074 5.384 1.00 0.00 C ATOM 1175 C HIS A 75 22.479 0.361 4.545 1.00 0.00 C ATOM 1176 O HIS A 75 22.669 -0.203 3.462 1.00 0.00 O ATOM 1177 CB HIS A 75 21.188 -1.384 5.894 1.00 0.00 C ATOM 1178 CG HIS A 75 22.312 -1.900 6.754 1.00 0.00 C ATOM 1179 ND1 HIS A 75 23.235 -1.120 7.424 1.00 0.00 N ATOM 1180 CD2 HIS A 75 22.654 -3.175 7.017 1.00 0.00 C ATOM 1181 CE1 HIS A 75 24.093 -1.907 8.046 1.00 0.00 C ATOM 1182 NE2 HIS A 75 23.758 -3.157 7.812 1.00 0.00 N ATOM 0 H HIS A 75 20.179 0.138 3.609 1.00 0.00 H new ATOM 0 HA HIS A 75 21.294 0.755 6.234 1.00 0.00 H new ATOM 0 HB2 HIS A 75 20.262 -1.502 6.457 1.00 0.00 H new ATOM 0 HB3 HIS A 75 21.116 -2.035 5.022 1.00 0.00 H new ATOM 0 HD2 HIS A 75 22.142 -4.057 6.660 1.00 0.00 H new ATOM 0 HE1 HIS A 75 24.929 -1.580 8.646 1.00 0.00 H new ATOM 0 HE2 HIS A 75 24.246 -3.979 8.168 1.00 0.00 H new ATOM 1190 N ALA A 76 23.254 1.274 5.029 1.00 0.00 N ATOM 1191 CA ALA A 76 24.515 1.664 4.456 1.00 0.00 C ATOM 1192 C ALA A 76 25.585 1.204 5.392 1.00 0.00 C ATOM 1193 O ALA A 76 25.390 1.254 6.614 1.00 0.00 O ATOM 1194 CB ALA A 76 24.538 3.162 4.332 1.00 0.00 C ATOM 0 H ALA A 76 23.022 1.797 5.873 1.00 0.00 H new ATOM 0 HA ALA A 76 24.667 1.227 3.469 1.00 0.00 H new ATOM 0 HB1 ALA A 76 25.487 3.477 3.899 1.00 0.00 H new ATOM 0 HB2 ALA A 76 23.720 3.486 3.688 1.00 0.00 H new ATOM 0 HB3 ALA A 76 24.423 3.611 5.319 1.00 0.00 H new ATOM 1200 N ALA A 77 26.667 0.695 4.876 1.00 0.00 N ATOM 1201 CA ALA A 77 27.723 0.223 5.731 1.00 0.00 C ATOM 1202 C ALA A 77 29.042 0.215 5.022 1.00 0.00 C ATOM 1203 O ALA A 77 29.150 -0.278 3.894 1.00 0.00 O ATOM 1204 CB ALA A 77 27.406 -1.180 6.250 1.00 0.00 C ATOM 0 H ALA A 77 26.843 0.596 3.876 1.00 0.00 H new ATOM 0 HA ALA A 77 27.793 0.911 6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 77 28.216 -1.521 6.895 1.00 0.00 H new ATOM 0 HB2 ALA A 77 26.476 -1.156 6.817 1.00 0.00 H new ATOM 0 HB3 ALA A 77 27.300 -1.864 5.408 1.00 0.00 H new ATOM 1210 N VAL A 78 30.036 0.748 5.663 1.00 0.00 N ATOM 1211 CA VAL A 78 31.360 0.659 5.154 1.00 0.00 C ATOM 1212 C VAL A 78 32.009 -0.551 5.793 1.00 0.00 C ATOM 1213 O VAL A 78 32.447 -0.545 6.951 1.00 0.00 O ATOM 1214 CB VAL A 78 32.196 1.964 5.371 1.00 0.00 C ATOM 1215 CG1 VAL A 78 32.213 2.422 6.832 1.00 0.00 C ATOM 1216 CG2 VAL A 78 33.616 1.792 4.832 1.00 0.00 C ATOM 0 H VAL A 78 29.949 1.252 6.546 1.00 0.00 H new ATOM 0 HA VAL A 78 31.323 0.544 4.071 1.00 0.00 H new ATOM 0 HB VAL A 78 31.701 2.754 4.806 1.00 0.00 H new ATOM 0 HG11 VAL A 78 32.808 3.331 6.921 1.00 0.00 H new ATOM 0 HG12 VAL A 78 31.194 2.621 7.163 1.00 0.00 H new ATOM 0 HG13 VAL A 78 32.650 1.640 7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 78 34.180 2.711 4.993 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.106 0.969 5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 78 33.576 1.573 3.765 1.00 0.00 H new ATOM 1226 N GLY A 79 31.913 -1.609 5.095 1.00 0.00 N ATOM 1227 CA GLY A 79 32.436 -2.833 5.525 1.00 0.00 C ATOM 1228 C GLY A 79 32.210 -3.828 4.469 1.00 0.00 C ATOM 1229 O GLY A 79 31.546 -3.518 3.457 1.00 0.00 O ATOM 0 H GLY A 79 31.456 -1.647 4.184 1.00 0.00 H new ATOM 0 HA2 GLY A 79 33.501 -2.738 5.735 1.00 0.00 H new ATOM 0 HA3 GLY A 79 31.955 -3.147 6.451 1.00 0.00 H new ATOM 1233 N ALA A 80 32.700 -4.999 4.656 1.00 0.00 N ATOM 1234 CA ALA A 80 32.489 -6.021 3.697 1.00 0.00 C ATOM 1235 C ALA A 80 31.177 -6.730 3.969 1.00 0.00 C ATOM 1236 O ALA A 80 30.366 -6.284 4.793 1.00 0.00 O ATOM 1237 CB ALA A 80 33.656 -6.973 3.636 1.00 0.00 C ATOM 0 H ALA A 80 33.252 -5.275 5.468 1.00 0.00 H new ATOM 0 HA ALA A 80 32.419 -5.563 2.710 1.00 0.00 H new ATOM 0 HB1 ALA A 80 33.459 -7.743 2.890 1.00 0.00 H new ATOM 0 HB2 ALA A 80 34.558 -6.426 3.363 1.00 0.00 H new ATOM 0 HB3 ALA A 80 33.796 -7.440 4.611 1.00 0.00 H new ATOM 1243 N ILE A 81 30.951 -7.804 3.284 1.00 0.00 N ATOM 1244 CA ILE A 81 29.700 -8.470 3.352 1.00 0.00 C ATOM 1245 C ILE A 81 29.765 -9.561 4.384 1.00 0.00 C ATOM 1246 O ILE A 81 30.418 -10.595 4.185 1.00 0.00 O ATOM 1247 CB ILE A 81 29.358 -9.027 1.971 1.00 0.00 C ATOM 1248 CG1 ILE A 81 29.430 -7.880 0.968 1.00 0.00 C ATOM 1249 CG2 ILE A 81 27.959 -9.646 1.979 1.00 0.00 C ATOM 1250 CD1 ILE A 81 29.702 -8.314 -0.427 1.00 0.00 C ATOM 0 H ILE A 81 31.632 -8.241 2.663 1.00 0.00 H new ATOM 0 HA ILE A 81 28.915 -7.775 3.649 1.00 0.00 H new ATOM 0 HB ILE A 81 30.065 -9.809 1.695 1.00 0.00 H new ATOM 0 HG12 ILE A 81 28.488 -7.332 0.990 1.00 0.00 H new ATOM 0 HG13 ILE A 81 30.210 -7.186 1.280 1.00 0.00 H new ATOM 0 HG21 ILE A 81 27.729 -10.039 0.988 1.00 0.00 H new ATOM 0 HG22 ILE A 81 27.924 -10.456 2.708 1.00 0.00 H new ATOM 0 HG23 ILE A 81 27.226 -8.885 2.247 1.00 0.00 H new ATOM 0 HD11 ILE A 81 29.738 -7.441 -1.079 1.00 0.00 H new ATOM 0 HD12 ILE A 81 30.658 -8.836 -0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 81 28.909 -8.984 -0.761 1.00 0.00 H new ATOM 1262 N THR A 82 29.144 -9.313 5.493 1.00 0.00 N ATOM 1263 CA THR A 82 29.125 -10.260 6.543 1.00 0.00 C ATOM 1264 C THR A 82 27.738 -10.865 6.601 1.00 0.00 C ATOM 1265 O THR A 82 26.785 -10.300 6.041 1.00 0.00 O ATOM 1266 CB THR A 82 29.547 -9.632 7.913 1.00 0.00 C ATOM 1267 OG1 THR A 82 29.608 -10.643 8.923 1.00 0.00 O ATOM 1268 CG2 THR A 82 28.575 -8.548 8.353 1.00 0.00 C ATOM 0 H THR A 82 28.639 -8.448 5.689 1.00 0.00 H new ATOM 0 HA THR A 82 29.860 -11.040 6.344 1.00 0.00 H new ATOM 0 HB THR A 82 30.531 -9.183 7.777 1.00 0.00 H new ATOM 0 HG1 THR A 82 29.875 -10.239 9.775 1.00 0.00 H new ATOM 0 HG21 THR A 82 28.899 -8.134 9.308 1.00 0.00 H new ATOM 0 HG22 THR A 82 28.550 -7.756 7.604 1.00 0.00 H new ATOM 0 HG23 THR A 82 27.578 -8.976 8.463 1.00 0.00 H new ATOM 1276 N GLU A 83 27.616 -11.990 7.259 1.00 0.00 N ATOM 1277 CA GLU A 83 26.376 -12.731 7.334 1.00 0.00 C ATOM 1278 C GLU A 83 25.273 -11.896 7.994 1.00 0.00 C ATOM 1279 O GLU A 83 24.118 -11.936 7.578 1.00 0.00 O ATOM 1280 CB GLU A 83 26.618 -14.008 8.115 1.00 0.00 C ATOM 1281 CG GLU A 83 25.483 -14.987 8.067 1.00 0.00 C ATOM 1282 CD GLU A 83 25.780 -16.226 8.841 1.00 0.00 C ATOM 1283 OE1 GLU A 83 26.823 -16.854 8.586 1.00 0.00 O ATOM 1284 OE2 GLU A 83 24.973 -16.611 9.708 1.00 0.00 O ATOM 0 H GLU A 83 28.386 -12.426 7.767 1.00 0.00 H new ATOM 0 HA GLU A 83 26.041 -12.973 6.326 1.00 0.00 H new ATOM 0 HB2 GLU A 83 27.515 -14.491 7.729 1.00 0.00 H new ATOM 0 HB3 GLU A 83 26.817 -13.751 9.156 1.00 0.00 H new ATOM 0 HG2 GLU A 83 24.583 -14.518 8.465 1.00 0.00 H new ATOM 0 HG3 GLU A 83 25.274 -15.249 7.030 1.00 0.00 H new ATOM 1291 N SER A 84 25.665 -11.092 8.960 1.00 0.00 N ATOM 1292 CA SER A 84 24.749 -10.260 9.728 1.00 0.00 C ATOM 1293 C SER A 84 24.164 -9.109 8.869 1.00 0.00 C ATOM 1294 O SER A 84 23.246 -8.410 9.288 1.00 0.00 O ATOM 1295 CB SER A 84 25.522 -9.703 10.905 1.00 0.00 C ATOM 1296 OG SER A 84 26.394 -10.707 11.419 1.00 0.00 O ATOM 0 H SER A 84 26.640 -10.993 9.241 1.00 0.00 H new ATOM 0 HA SER A 84 23.903 -10.858 10.066 1.00 0.00 H new ATOM 0 HB2 SER A 84 26.097 -8.830 10.596 1.00 0.00 H new ATOM 0 HB3 SER A 84 24.833 -9.372 11.682 1.00 0.00 H new ATOM 0 HG SER A 84 26.896 -10.346 12.180 1.00 0.00 H new ATOM 1302 N ASP A 85 24.723 -8.911 7.692 1.00 0.00 N ATOM 1303 CA ASP A 85 24.209 -7.917 6.751 1.00 0.00 C ATOM 1304 C ASP A 85 23.286 -8.577 5.768 1.00 0.00 C ATOM 1305 O ASP A 85 22.319 -7.984 5.294 1.00 0.00 O ATOM 1306 CB ASP A 85 25.337 -7.220 5.985 1.00 0.00 C ATOM 1307 CG ASP A 85 25.961 -6.064 6.718 1.00 0.00 C ATOM 1308 OD1 ASP A 85 25.300 -5.045 6.918 1.00 0.00 O ATOM 1309 OD2 ASP A 85 27.162 -6.115 6.995 1.00 0.00 O ATOM 0 H ASP A 85 25.538 -9.425 7.357 1.00 0.00 H new ATOM 0 HA ASP A 85 23.673 -7.165 7.330 1.00 0.00 H new ATOM 0 HB2 ASP A 85 26.112 -7.952 5.758 1.00 0.00 H new ATOM 0 HB3 ASP A 85 24.947 -6.863 5.032 1.00 0.00 H new ATOM 1314 N ILE A 86 23.583 -9.823 5.479 1.00 0.00 N ATOM 1315 CA ILE A 86 22.821 -10.610 4.530 1.00 0.00 C ATOM 1316 C ILE A 86 21.434 -10.955 5.060 1.00 0.00 C ATOM 1317 O ILE A 86 20.483 -11.139 4.287 1.00 0.00 O ATOM 1318 CB ILE A 86 23.610 -11.857 4.160 1.00 0.00 C ATOM 1319 CG1 ILE A 86 24.901 -11.402 3.493 1.00 0.00 C ATOM 1320 CG2 ILE A 86 22.811 -12.797 3.261 1.00 0.00 C ATOM 1321 CD1 ILE A 86 25.766 -12.510 3.048 1.00 0.00 C ATOM 0 H ILE A 86 24.366 -10.325 5.898 1.00 0.00 H new ATOM 0 HA ILE A 86 22.662 -10.014 3.631 1.00 0.00 H new ATOM 0 HB ILE A 86 23.833 -12.433 5.058 1.00 0.00 H new ATOM 0 HG12 ILE A 86 24.654 -10.779 2.633 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.458 -10.777 4.191 1.00 0.00 H new ATOM 0 HG21 ILE A 86 23.414 -13.673 3.023 1.00 0.00 H new ATOM 0 HG22 ILE A 86 21.904 -13.111 3.777 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.543 -12.279 2.340 1.00 0.00 H new ATOM 0 HD11 ILE A 86 26.665 -12.106 2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 86 26.045 -13.121 3.906 1.00 0.00 H new ATOM 0 HD13 ILE A 86 25.228 -13.123 2.325 1.00 0.00 H new ATOM 1333 N SER A 87 21.311 -10.990 6.358 1.00 0.00 N ATOM 1334 CA SER A 87 20.046 -11.212 6.991 1.00 0.00 C ATOM 1335 C SER A 87 19.006 -10.148 6.531 1.00 0.00 C ATOM 1336 O SER A 87 17.834 -10.472 6.285 1.00 0.00 O ATOM 1337 CB SER A 87 20.249 -11.223 8.501 1.00 0.00 C ATOM 1338 OG SER A 87 21.002 -10.098 8.902 1.00 0.00 O ATOM 0 H SER A 87 22.089 -10.865 7.006 1.00 0.00 H new ATOM 0 HA SER A 87 19.640 -12.179 6.696 1.00 0.00 H new ATOM 0 HB2 SER A 87 19.282 -11.221 9.005 1.00 0.00 H new ATOM 0 HB3 SER A 87 20.762 -12.137 8.799 1.00 0.00 H new ATOM 0 HG SER A 87 21.124 -10.116 9.874 1.00 0.00 H new ATOM 1344 N LEU A 88 19.476 -8.902 6.346 1.00 0.00 N ATOM 1345 CA LEU A 88 18.661 -7.808 5.836 1.00 0.00 C ATOM 1346 C LEU A 88 18.357 -8.023 4.364 1.00 0.00 C ATOM 1347 O LEU A 88 17.249 -7.714 3.897 1.00 0.00 O ATOM 1348 CB LEU A 88 19.385 -6.437 6.074 1.00 0.00 C ATOM 1349 CG LEU A 88 18.773 -5.133 5.461 1.00 0.00 C ATOM 1350 CD1 LEU A 88 19.076 -4.988 3.966 1.00 0.00 C ATOM 1351 CD2 LEU A 88 17.275 -5.099 5.695 1.00 0.00 C ATOM 0 H LEU A 88 20.439 -8.634 6.550 1.00 0.00 H new ATOM 0 HA LEU A 88 17.714 -7.786 6.375 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.461 -6.289 7.151 1.00 0.00 H new ATOM 0 HB3 LEU A 88 20.402 -6.533 5.693 1.00 0.00 H new ATOM 0 HG LEU A 88 19.243 -4.290 5.967 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.629 -4.067 3.592 1.00 0.00 H new ATOM 0 HD12 LEU A 88 20.155 -4.955 3.815 1.00 0.00 H new ATOM 0 HD13 LEU A 88 18.660 -5.839 3.426 1.00 0.00 H new ATOM 0 HD21 LEU A 88 16.860 -4.188 5.264 1.00 0.00 H new ATOM 0 HD22 LEU A 88 16.813 -5.966 5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 88 17.074 -5.119 6.766 1.00 0.00 H new ATOM 1363 N ALA A 89 19.329 -8.552 3.654 1.00 0.00 N ATOM 1364 CA ALA A 89 19.250 -8.736 2.221 1.00 0.00 C ATOM 1365 C ALA A 89 17.982 -9.476 1.803 1.00 0.00 C ATOM 1366 O ALA A 89 17.179 -8.929 1.076 1.00 0.00 O ATOM 1367 CB ALA A 89 20.503 -9.401 1.683 1.00 0.00 C ATOM 0 H ALA A 89 20.208 -8.871 4.061 1.00 0.00 H new ATOM 0 HA ALA A 89 19.188 -7.745 1.771 1.00 0.00 H new ATOM 0 HB1 ALA A 89 20.414 -9.526 0.604 1.00 0.00 H new ATOM 0 HB2 ALA A 89 21.370 -8.779 1.906 1.00 0.00 H new ATOM 0 HB3 ALA A 89 20.627 -10.377 2.152 1.00 0.00 H new ATOM 1373 N THR A 90 17.765 -10.679 2.296 1.00 0.00 N ATOM 1374 CA THR A 90 16.538 -11.392 1.946 1.00 0.00 C ATOM 1375 C THR A 90 15.311 -10.750 2.634 1.00 0.00 C ATOM 1376 O THR A 90 14.222 -10.724 2.073 1.00 0.00 O ATOM 1377 CB THR A 90 16.618 -12.923 2.252 1.00 0.00 C ATOM 1378 OG1 THR A 90 15.372 -13.570 1.924 1.00 0.00 O ATOM 1379 CG2 THR A 90 16.987 -13.194 3.698 1.00 0.00 C ATOM 0 H THR A 90 18.397 -11.178 2.922 1.00 0.00 H new ATOM 0 HA THR A 90 16.419 -11.298 0.867 1.00 0.00 H new ATOM 0 HB THR A 90 17.410 -13.337 1.628 1.00 0.00 H new ATOM 0 HG1 THR A 90 15.439 -14.528 2.120 1.00 0.00 H new ATOM 0 HG21 THR A 90 17.031 -14.270 3.867 1.00 0.00 H new ATOM 0 HG22 THR A 90 17.960 -12.752 3.914 1.00 0.00 H new ATOM 0 HG23 THR A 90 16.235 -12.755 4.354 1.00 0.00 H new ATOM 1387 N ALA A 91 15.530 -10.157 3.819 1.00 0.00 N ATOM 1388 CA ALA A 91 14.459 -9.542 4.619 1.00 0.00 C ATOM 1389 C ALA A 91 13.743 -8.431 3.868 1.00 0.00 C ATOM 1390 O ALA A 91 12.517 -8.437 3.735 1.00 0.00 O ATOM 1391 CB ALA A 91 15.018 -8.996 5.919 1.00 0.00 C ATOM 0 H ALA A 91 16.453 -10.091 4.248 1.00 0.00 H new ATOM 0 HA ALA A 91 13.731 -10.325 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.214 -8.544 6.500 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.467 -9.808 6.491 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.776 -8.243 5.702 1.00 0.00 H new ATOM 1397 N SER A 92 14.506 -7.492 3.366 1.00 0.00 N ATOM 1398 CA SER A 92 13.954 -6.365 2.656 1.00 0.00 C ATOM 1399 C SER A 92 14.098 -6.559 1.166 1.00 0.00 C ATOM 1400 O SER A 92 13.858 -5.632 0.394 1.00 0.00 O ATOM 1401 CB SER A 92 14.584 -5.040 3.126 1.00 0.00 C ATOM 1402 OG SER A 92 13.964 -3.916 2.499 1.00 0.00 O ATOM 0 H SER A 92 15.523 -7.487 3.438 1.00 0.00 H new ATOM 0 HA SER A 92 12.890 -6.305 2.883 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.488 -4.954 4.208 1.00 0.00 H new ATOM 0 HB3 SER A 92 15.650 -5.042 2.900 1.00 0.00 H new ATOM 0 HG SER A 92 13.759 -4.134 1.566 1.00 0.00 H new ATOM 1408 N ASN A 93 14.554 -7.751 0.781 1.00 0.00 N ATOM 1409 CA ASN A 93 14.730 -8.174 -0.628 1.00 0.00 C ATOM 1410 C ASN A 93 15.708 -7.272 -1.367 1.00 0.00 C ATOM 1411 O ASN A 93 15.714 -7.172 -2.597 1.00 0.00 O ATOM 1412 CB ASN A 93 13.374 -8.424 -1.406 1.00 0.00 C ATOM 1413 CG ASN A 93 12.432 -7.227 -1.582 1.00 0.00 C ATOM 1414 OD1 ASN A 93 12.540 -6.444 -2.533 1.00 0.00 O ATOM 1415 ND2 ASN A 93 11.449 -7.126 -0.718 1.00 0.00 N ATOM 0 H ASN A 93 14.821 -8.474 1.449 1.00 0.00 H new ATOM 0 HA ASN A 93 15.187 -9.163 -0.592 1.00 0.00 H new ATOM 0 HB2 ASN A 93 13.619 -8.808 -2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 93 12.827 -9.210 -0.886 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.752 -6.389 -0.823 1.00 0.00 H new ATOM 0 HD22 ASN A 93 11.382 -7.785 0.058 1.00 0.00 H new ATOM 1422 N ALA A 94 16.630 -6.746 -0.588 1.00 0.00 N ATOM 1423 CA ALA A 94 17.643 -5.854 -1.041 1.00 0.00 C ATOM 1424 C ALA A 94 18.889 -6.657 -1.358 1.00 0.00 C ATOM 1425 O ALA A 94 19.312 -7.470 -0.560 1.00 0.00 O ATOM 1426 CB ALA A 94 17.959 -4.871 0.075 1.00 0.00 C ATOM 0 H ALA A 94 16.685 -6.943 0.411 1.00 0.00 H new ATOM 0 HA ALA A 94 17.308 -5.317 -1.929 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.734 -4.180 -0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 94 17.060 -4.311 0.332 1.00 0.00 H new ATOM 0 HB3 ALA A 94 18.310 -5.416 0.951 1.00 0.00 H new ATOM 1432 N ILE A 95 19.475 -6.438 -2.494 1.00 0.00 N ATOM 1433 CA ILE A 95 20.674 -7.163 -2.842 1.00 0.00 C ATOM 1434 C ILE A 95 21.926 -6.390 -2.462 1.00 0.00 C ATOM 1435 O ILE A 95 21.961 -5.140 -2.539 1.00 0.00 O ATOM 1436 CB ILE A 95 20.697 -7.690 -4.324 1.00 0.00 C ATOM 1437 CG1 ILE A 95 20.230 -6.637 -5.367 1.00 0.00 C ATOM 1438 CG2 ILE A 95 19.872 -8.959 -4.450 1.00 0.00 C ATOM 1439 CD1 ILE A 95 21.179 -5.484 -5.609 1.00 0.00 C ATOM 0 H ILE A 95 19.153 -5.771 -3.195 1.00 0.00 H new ATOM 0 HA ILE A 95 20.663 -8.070 -2.237 1.00 0.00 H new ATOM 0 HB ILE A 95 21.741 -7.905 -4.553 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.056 -7.145 -6.316 1.00 0.00 H new ATOM 0 HG13 ILE A 95 19.272 -6.232 -5.042 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.899 -9.310 -5.482 1.00 0.00 H new ATOM 0 HG22 ILE A 95 20.283 -9.727 -3.795 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.841 -8.752 -4.164 1.00 0.00 H new ATOM 0 HD11 ILE A 95 20.753 -4.812 -6.354 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.336 -4.940 -4.677 1.00 0.00 H new ATOM 0 HD13 ILE A 95 22.133 -5.868 -5.970 1.00 0.00 H new ATOM 1451 N VAL A 96 22.932 -7.112 -2.031 1.00 0.00 N ATOM 1452 CA VAL A 96 24.139 -6.514 -1.523 1.00 0.00 C ATOM 1453 C VAL A 96 25.174 -6.402 -2.611 1.00 0.00 C ATOM 1454 O VAL A 96 25.667 -7.414 -3.145 1.00 0.00 O ATOM 1455 CB VAL A 96 24.754 -7.323 -0.344 1.00 0.00 C ATOM 1456 CG1 VAL A 96 25.903 -6.559 0.298 1.00 0.00 C ATOM 1457 CG2 VAL A 96 23.711 -7.703 0.694 1.00 0.00 C ATOM 0 H VAL A 96 22.935 -8.132 -2.023 1.00 0.00 H new ATOM 0 HA VAL A 96 23.859 -5.526 -1.158 1.00 0.00 H new ATOM 0 HB VAL A 96 25.146 -8.250 -0.761 1.00 0.00 H new ATOM 0 HG11 VAL A 96 26.316 -7.145 1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 96 26.680 -6.378 -0.445 1.00 0.00 H new ATOM 0 HG13 VAL A 96 25.538 -5.606 0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 96 24.186 -8.266 1.498 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.258 -6.800 1.102 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.940 -8.316 0.228 1.00 0.00 H new ATOM 1467 N ILE A 97 25.478 -5.191 -2.954 1.00 0.00 N ATOM 1468 CA ILE A 97 26.513 -4.903 -3.894 1.00 0.00 C ATOM 1469 C ILE A 97 27.599 -4.209 -3.116 1.00 0.00 C ATOM 1470 O ILE A 97 27.341 -3.211 -2.433 1.00 0.00 O ATOM 1471 CB ILE A 97 26.032 -3.962 -5.038 1.00 0.00 C ATOM 1472 CG1 ILE A 97 24.770 -4.511 -5.732 1.00 0.00 C ATOM 1473 CG2 ILE A 97 27.147 -3.733 -6.059 1.00 0.00 C ATOM 1474 CD1 ILE A 97 24.942 -5.866 -6.371 1.00 0.00 C ATOM 0 H ILE A 97 25.009 -4.364 -2.584 1.00 0.00 H new ATOM 0 HA ILE A 97 26.847 -5.827 -4.366 1.00 0.00 H new ATOM 0 HB ILE A 97 25.773 -3.005 -4.585 1.00 0.00 H new ATOM 0 HG12 ILE A 97 23.965 -4.569 -4.999 1.00 0.00 H new ATOM 0 HG13 ILE A 97 24.454 -3.801 -6.497 1.00 0.00 H new ATOM 0 HG21 ILE A 97 26.788 -3.073 -6.848 1.00 0.00 H new ATOM 0 HG22 ILE A 97 28.004 -3.275 -5.565 1.00 0.00 H new ATOM 0 HG23 ILE A 97 27.445 -4.688 -6.492 1.00 0.00 H new ATOM 0 HD11 ILE A 97 24.004 -6.172 -6.834 1.00 0.00 H new ATOM 0 HD12 ILE A 97 25.722 -5.814 -7.131 1.00 0.00 H new ATOM 0 HD13 ILE A 97 25.225 -6.594 -5.610 1.00 0.00 H new ATOM 1486 N GLY A 98 28.767 -4.749 -3.162 1.00 0.00 N ATOM 1487 CA GLY A 98 29.855 -4.164 -2.456 1.00 0.00 C ATOM 1488 C GLY A 98 30.900 -3.677 -3.407 1.00 0.00 C ATOM 1489 O GLY A 98 30.867 -4.006 -4.602 1.00 0.00 O ATOM 0 H GLY A 98 28.995 -5.597 -3.682 1.00 0.00 H new ATOM 0 HA2 GLY A 98 29.496 -3.335 -1.846 1.00 0.00 H new ATOM 0 HA3 GLY A 98 30.289 -4.896 -1.775 1.00 0.00 H new ATOM 1493 N PHE A 99 31.840 -2.926 -2.924 1.00 0.00 N ATOM 1494 CA PHE A 99 32.878 -2.447 -3.792 1.00 0.00 C ATOM 1495 C PHE A 99 34.193 -3.048 -3.367 1.00 0.00 C ATOM 1496 O PHE A 99 34.825 -2.571 -2.445 1.00 0.00 O ATOM 1497 CB PHE A 99 32.918 -0.906 -3.812 1.00 0.00 C ATOM 1498 CG PHE A 99 33.942 -0.309 -4.739 1.00 0.00 C ATOM 1499 CD1 PHE A 99 33.970 -0.654 -6.083 1.00 0.00 C ATOM 1500 CD2 PHE A 99 34.875 0.597 -4.264 1.00 0.00 C ATOM 1501 CE1 PHE A 99 34.910 -0.106 -6.934 1.00 0.00 C ATOM 1502 CE2 PHE A 99 35.814 1.151 -5.112 1.00 0.00 C ATOM 1503 CZ PHE A 99 35.831 0.798 -6.448 1.00 0.00 C ATOM 0 H PHE A 99 31.914 -2.633 -1.950 1.00 0.00 H new ATOM 0 HA PHE A 99 32.673 -2.760 -4.816 1.00 0.00 H new ATOM 0 HB2 PHE A 99 31.933 -0.536 -4.096 1.00 0.00 H new ATOM 0 HB3 PHE A 99 33.113 -0.549 -2.801 1.00 0.00 H new ATOM 0 HD1 PHE A 99 33.248 -1.359 -6.468 1.00 0.00 H new ATOM 0 HD2 PHE A 99 34.868 0.873 -3.220 1.00 0.00 H new ATOM 0 HE1 PHE A 99 34.924 -0.385 -7.977 1.00 0.00 H new ATOM 0 HE2 PHE A 99 36.535 1.860 -4.731 1.00 0.00 H new ATOM 0 HZ PHE A 99 36.566 1.230 -7.111 1.00 0.00 H new ATOM 1513 N ASN A 100 34.521 -4.179 -4.011 1.00 0.00 N ATOM 1514 CA ASN A 100 35.781 -4.967 -3.813 1.00 0.00 C ATOM 1515 C ASN A 100 35.934 -5.488 -2.366 1.00 0.00 C ATOM 1516 O ASN A 100 36.941 -6.071 -1.993 1.00 0.00 O ATOM 1517 CB ASN A 100 37.017 -4.151 -4.229 1.00 0.00 C ATOM 1518 CG ASN A 100 38.230 -5.030 -4.458 1.00 0.00 C ATOM 1519 OD1 ASN A 100 38.098 -6.180 -4.898 1.00 0.00 O ATOM 1520 ND2 ASN A 100 39.394 -4.522 -4.169 1.00 0.00 N ATOM 0 H ASN A 100 33.907 -4.597 -4.710 1.00 0.00 H new ATOM 0 HA ASN A 100 35.706 -5.840 -4.461 1.00 0.00 H new ATOM 0 HB2 ASN A 100 36.795 -3.596 -5.141 1.00 0.00 H new ATOM 0 HB3 ASN A 100 37.243 -3.416 -3.456 1.00 0.00 H new ATOM 0 HD21 ASN A 100 40.240 -5.076 -4.303 1.00 0.00 H new ATOM 0 HD22 ASN A 100 39.460 -3.570 -3.809 1.00 0.00 H new ATOM 1527 N VAL A 101 34.883 -5.352 -1.605 1.00 0.00 N ATOM 1528 CA VAL A 101 34.892 -5.700 -0.197 1.00 0.00 C ATOM 1529 C VAL A 101 34.981 -7.183 0.036 1.00 0.00 C ATOM 1530 O VAL A 101 35.785 -7.622 0.842 1.00 0.00 O ATOM 1531 CB VAL A 101 33.712 -5.104 0.586 1.00 0.00 C ATOM 1532 CG1 VAL A 101 33.937 -3.636 0.854 1.00 0.00 C ATOM 1533 CG2 VAL A 101 32.382 -5.309 -0.132 1.00 0.00 C ATOM 0 H VAL A 101 33.988 -4.995 -1.939 1.00 0.00 H new ATOM 0 HA VAL A 101 35.802 -5.244 0.193 1.00 0.00 H new ATOM 0 HB VAL A 101 33.659 -5.637 1.535 1.00 0.00 H new ATOM 0 HG11 VAL A 101 33.090 -3.234 1.409 1.00 0.00 H new ATOM 0 HG12 VAL A 101 34.848 -3.508 1.439 1.00 0.00 H new ATOM 0 HG13 VAL A 101 34.036 -3.104 -0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 101 31.578 -4.871 0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.418 -4.827 -1.109 1.00 0.00 H new ATOM 0 HG23 VAL A 101 32.198 -6.376 -0.260 1.00 0.00 H new ATOM 1543 N ARG A 102 34.138 -7.941 -0.677 1.00 0.00 N ATOM 1544 CA ARG A 102 34.140 -9.415 -0.665 1.00 0.00 C ATOM 1545 C ARG A 102 33.527 -9.973 0.642 1.00 0.00 C ATOM 1546 O ARG A 102 33.655 -9.365 1.700 1.00 0.00 O ATOM 1547 CB ARG A 102 35.563 -9.927 -0.982 1.00 0.00 C ATOM 1548 CG ARG A 102 36.025 -9.370 -2.328 1.00 0.00 C ATOM 1549 CD ARG A 102 37.492 -9.530 -2.611 1.00 0.00 C ATOM 1550 NE ARG A 102 38.358 -8.817 -1.652 1.00 0.00 N ATOM 1551 CZ ARG A 102 39.574 -9.249 -1.249 1.00 0.00 C ATOM 1552 NH1 ARG A 102 40.000 -10.474 -1.576 1.00 0.00 N ATOM 1553 NH2 ARG A 102 40.350 -8.471 -0.507 1.00 0.00 N ATOM 0 H ARG A 102 33.424 -7.545 -1.288 1.00 0.00 H new ATOM 0 HA ARG A 102 33.489 -9.798 -1.450 1.00 0.00 H new ATOM 0 HB2 ARG A 102 36.253 -9.622 -0.195 1.00 0.00 H new ATOM 0 HB3 ARG A 102 35.570 -11.017 -1.007 1.00 0.00 H new ATOM 0 HG2 ARG A 102 35.462 -9.862 -3.121 1.00 0.00 H new ATOM 0 HG3 ARG A 102 35.775 -8.310 -2.371 1.00 0.00 H new ATOM 0 HD2 ARG A 102 37.743 -10.591 -2.596 1.00 0.00 H new ATOM 0 HD3 ARG A 102 37.702 -9.167 -3.617 1.00 0.00 H new ATOM 0 HE ARG A 102 38.015 -7.937 -1.266 1.00 0.00 H new ATOM 0 HH11 ARG A 102 39.406 -11.089 -2.133 1.00 0.00 H new ATOM 0 HH12 ARG A 102 40.919 -10.793 -1.269 1.00 0.00 H new ATOM 0 HH21 ARG A 102 40.031 -7.541 -0.237 1.00 0.00 H new ATOM 0 HH22 ARG A 102 41.266 -8.803 -0.206 1.00 0.00 H new ATOM 1566 N PRO A 103 32.792 -11.084 0.592 1.00 0.00 N ATOM 1567 CA PRO A 103 32.119 -11.605 1.762 1.00 0.00 C ATOM 1568 C PRO A 103 32.969 -12.507 2.607 1.00 0.00 C ATOM 1569 O PRO A 103 34.074 -12.906 2.228 1.00 0.00 O ATOM 1570 CB PRO A 103 30.970 -12.444 1.201 1.00 0.00 C ATOM 1571 CG PRO A 103 31.187 -12.530 -0.279 1.00 0.00 C ATOM 1572 CD PRO A 103 32.546 -11.942 -0.575 1.00 0.00 C ATOM 0 HA PRO A 103 31.824 -10.776 2.405 1.00 0.00 H new ATOM 0 HB2 PRO A 103 30.960 -13.437 1.650 1.00 0.00 H new ATOM 0 HB3 PRO A 103 30.008 -11.983 1.426 1.00 0.00 H new ATOM 0 HG2 PRO A 103 31.137 -13.566 -0.614 1.00 0.00 H new ATOM 0 HG3 PRO A 103 30.409 -11.984 -0.813 1.00 0.00 H new ATOM 0 HD2 PRO A 103 33.308 -12.715 -0.676 1.00 0.00 H new ATOM 0 HD3 PRO A 103 32.546 -11.371 -1.504 1.00 0.00 H new ATOM 1580 N ASP A 104 32.442 -12.800 3.753 1.00 0.00 N ATOM 1581 CA ASP A 104 32.983 -13.805 4.614 1.00 0.00 C ATOM 1582 C ASP A 104 32.544 -15.139 4.038 1.00 0.00 C ATOM 1583 O ASP A 104 31.494 -15.202 3.372 1.00 0.00 O ATOM 1584 CB ASP A 104 32.421 -13.636 6.029 1.00 0.00 C ATOM 1585 CG ASP A 104 32.925 -14.684 6.989 1.00 0.00 C ATOM 1586 OD1 ASP A 104 34.023 -14.512 7.556 1.00 0.00 O ATOM 1587 OD2 ASP A 104 32.233 -15.699 7.193 1.00 0.00 O ATOM 0 H ASP A 104 31.610 -12.341 4.124 1.00 0.00 H new ATOM 0 HA ASP A 104 34.069 -13.736 4.675 1.00 0.00 H new ATOM 0 HB2 ASP A 104 32.687 -12.648 6.405 1.00 0.00 H new ATOM 0 HB3 ASP A 104 31.333 -13.680 5.990 1.00 0.00 H new ATOM 1592 N ALA A 105 33.302 -16.179 4.258 1.00 0.00 N ATOM 1593 CA ALA A 105 32.983 -17.492 3.724 1.00 0.00 C ATOM 1594 C ALA A 105 31.636 -18.011 4.226 1.00 0.00 C ATOM 1595 O ALA A 105 30.964 -18.761 3.537 1.00 0.00 O ATOM 1596 CB ALA A 105 34.087 -18.476 4.024 1.00 0.00 C ATOM 0 H ALA A 105 34.159 -16.149 4.811 1.00 0.00 H new ATOM 0 HA ALA A 105 32.899 -17.386 2.642 1.00 0.00 H new ATOM 0 HB1 ALA A 105 33.826 -19.452 3.615 1.00 0.00 H new ATOM 0 HB2 ALA A 105 35.016 -18.130 3.571 1.00 0.00 H new ATOM 0 HB3 ALA A 105 34.218 -18.558 5.103 1.00 0.00 H new ATOM 1602 N ASN A 106 31.223 -17.600 5.407 1.00 0.00 N ATOM 1603 CA ASN A 106 29.922 -18.029 5.896 1.00 0.00 C ATOM 1604 C ASN A 106 28.850 -17.124 5.377 1.00 0.00 C ATOM 1605 O ASN A 106 27.720 -17.546 5.174 1.00 0.00 O ATOM 1606 CB ASN A 106 29.845 -18.083 7.400 1.00 0.00 C ATOM 1607 CG ASN A 106 30.739 -19.126 8.016 1.00 0.00 C ATOM 1608 OD1 ASN A 106 30.996 -20.184 7.424 1.00 0.00 O ATOM 1609 ND2 ASN A 106 31.222 -18.856 9.198 1.00 0.00 N ATOM 0 H ASN A 106 31.748 -16.988 6.032 1.00 0.00 H new ATOM 0 HA ASN A 106 29.773 -19.044 5.526 1.00 0.00 H new ATOM 0 HB2 ASN A 106 30.110 -17.106 7.804 1.00 0.00 H new ATOM 0 HB3 ASN A 106 28.814 -18.281 7.695 1.00 0.00 H new ATOM 0 HD21 ASN A 106 31.833 -19.526 9.665 1.00 0.00 H new ATOM 0 HD22 ASN A 106 30.989 -17.975 9.655 1.00 0.00 H new ATOM 1616 N ALA A 107 29.205 -15.878 5.137 1.00 0.00 N ATOM 1617 CA ALA A 107 28.272 -14.930 4.581 1.00 0.00 C ATOM 1618 C ALA A 107 27.875 -15.363 3.181 1.00 0.00 C ATOM 1619 O ALA A 107 26.701 -15.401 2.851 1.00 0.00 O ATOM 1620 CB ALA A 107 28.859 -13.529 4.565 1.00 0.00 C ATOM 0 H ALA A 107 30.135 -15.502 5.320 1.00 0.00 H new ATOM 0 HA ALA A 107 27.383 -14.906 5.211 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.133 -12.835 4.140 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.100 -13.224 5.583 1.00 0.00 H new ATOM 0 HB3 ALA A 107 29.765 -13.521 3.960 1.00 0.00 H new ATOM 1626 N LYS A 108 28.865 -15.747 2.384 1.00 0.00 N ATOM 1627 CA LYS A 108 28.625 -16.193 1.014 1.00 0.00 C ATOM 1628 C LYS A 108 27.693 -17.432 0.981 1.00 0.00 C ATOM 1629 O LYS A 108 26.923 -17.620 0.034 1.00 0.00 O ATOM 1630 CB LYS A 108 29.984 -16.422 0.272 1.00 0.00 C ATOM 1631 CG LYS A 108 30.781 -17.698 0.614 1.00 0.00 C ATOM 1632 CD LYS A 108 30.290 -18.946 -0.136 1.00 0.00 C ATOM 1633 CE LYS A 108 30.481 -18.808 -1.643 1.00 0.00 C ATOM 1634 NZ LYS A 108 30.023 -20.003 -2.384 1.00 0.00 N ATOM 0 H LYS A 108 29.846 -15.759 2.663 1.00 0.00 H new ATOM 0 HA LYS A 108 28.096 -15.409 0.472 1.00 0.00 H new ATOM 0 HB2 LYS A 108 29.784 -16.428 -0.800 1.00 0.00 H new ATOM 0 HB3 LYS A 108 30.624 -15.563 0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 108 31.833 -17.534 0.380 1.00 0.00 H new ATOM 0 HG3 LYS A 108 30.718 -17.880 1.687 1.00 0.00 H new ATOM 0 HD2 LYS A 108 30.831 -19.822 0.221 1.00 0.00 H new ATOM 0 HD3 LYS A 108 29.235 -19.112 0.084 1.00 0.00 H new ATOM 0 HE2 LYS A 108 29.934 -17.934 -1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 108 31.535 -18.633 -1.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 30.174 -19.859 -3.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 30.562 -20.835 -2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 29.011 -20.157 -2.203 1.00 0.00 H new ATOM 1647 N ARG A 109 27.753 -18.243 2.046 1.00 0.00 N ATOM 1648 CA ARG A 109 26.966 -19.380 2.216 1.00 0.00 C ATOM 1649 C ARG A 109 25.542 -18.970 2.540 1.00 0.00 C ATOM 1650 O ARG A 109 24.581 -19.406 1.882 1.00 0.00 O ATOM 1651 CB ARG A 109 27.532 -20.102 3.401 1.00 0.00 C ATOM 1652 CG ARG A 109 28.751 -20.955 3.180 1.00 0.00 C ATOM 1653 CD ARG A 109 29.071 -21.776 4.429 1.00 0.00 C ATOM 1654 NE ARG A 109 30.043 -22.849 4.161 1.00 0.00 N ATOM 1655 CZ ARG A 109 30.942 -23.332 5.032 1.00 0.00 C ATOM 1656 NH1 ARG A 109 31.112 -22.759 6.213 1.00 0.00 N ATOM 1657 NH2 ARG A 109 31.682 -24.380 4.707 1.00 0.00 N ATOM 0 H ARG A 109 28.393 -18.080 2.823 1.00 0.00 H new ATOM 0 HA ARG A 109 26.962 -19.996 1.317 1.00 0.00 H new ATOM 0 HB2 ARG A 109 27.775 -19.360 4.162 1.00 0.00 H new ATOM 0 HB3 ARG A 109 26.748 -20.737 3.813 1.00 0.00 H new ATOM 0 HG2 ARG A 109 28.586 -21.621 2.333 1.00 0.00 H new ATOM 0 HG3 ARG A 109 29.602 -20.323 2.927 1.00 0.00 H new ATOM 0 HD2 ARG A 109 29.465 -21.117 5.203 1.00 0.00 H new ATOM 0 HD3 ARG A 109 28.151 -22.212 4.820 1.00 0.00 H new ATOM 0 HE ARG A 109 30.032 -23.263 3.229 1.00 0.00 H new ATOM 0 HH11 ARG A 109 30.557 -21.942 6.468 1.00 0.00 H new ATOM 0 HH12 ARG A 109 31.798 -23.134 6.868 1.00 0.00 H new ATOM 0 HH21 ARG A 109 31.569 -24.821 3.794 1.00 0.00 H new ATOM 0 HH22 ARG A 109 32.365 -24.747 5.369 1.00 0.00 H new ATOM 1670 N ALA A 110 25.437 -18.111 3.553 1.00 0.00 N ATOM 1671 CA ALA A 110 24.186 -17.598 4.054 1.00 0.00 C ATOM 1672 C ALA A 110 23.398 -16.996 2.944 1.00 0.00 C ATOM 1673 O ALA A 110 22.295 -17.402 2.715 1.00 0.00 O ATOM 1674 CB ALA A 110 24.438 -16.561 5.131 1.00 0.00 C ATOM 0 H ALA A 110 26.249 -17.750 4.054 1.00 0.00 H new ATOM 0 HA ALA A 110 23.618 -18.423 4.485 1.00 0.00 H new ATOM 0 HB1 ALA A 110 23.485 -16.182 5.501 1.00 0.00 H new ATOM 0 HB2 ALA A 110 24.991 -17.017 5.953 1.00 0.00 H new ATOM 0 HB3 ALA A 110 25.019 -15.738 4.715 1.00 0.00 H new ATOM 1680 N ALA A 111 24.051 -16.108 2.195 1.00 0.00 N ATOM 1681 CA ALA A 111 23.461 -15.369 1.079 1.00 0.00 C ATOM 1682 C ALA A 111 22.672 -16.248 0.164 1.00 0.00 C ATOM 1683 O ALA A 111 21.517 -15.977 -0.153 1.00 0.00 O ATOM 1684 CB ALA A 111 24.552 -14.700 0.261 1.00 0.00 C ATOM 0 H ALA A 111 25.032 -15.876 2.352 1.00 0.00 H new ATOM 0 HA ALA A 111 22.790 -14.631 1.518 1.00 0.00 H new ATOM 0 HB1 ALA A 111 24.102 -14.153 -0.567 1.00 0.00 H new ATOM 0 HB2 ALA A 111 25.108 -14.008 0.893 1.00 0.00 H new ATOM 0 HB3 ALA A 111 25.230 -15.458 -0.131 1.00 0.00 H new ATOM 1690 N GLU A 112 23.265 -17.325 -0.212 1.00 0.00 N ATOM 1691 CA GLU A 112 22.707 -18.153 -1.203 1.00 0.00 C ATOM 1692 C GLU A 112 21.614 -19.017 -0.614 1.00 0.00 C ATOM 1693 O GLU A 112 20.601 -19.275 -1.252 1.00 0.00 O ATOM 1694 CB GLU A 112 23.825 -18.935 -1.836 1.00 0.00 C ATOM 1695 CG GLU A 112 23.644 -19.340 -3.282 1.00 0.00 C ATOM 1696 CD GLU A 112 22.662 -20.457 -3.526 1.00 0.00 C ATOM 1697 OE1 GLU A 112 22.985 -21.605 -3.180 1.00 0.00 O ATOM 1698 OE2 GLU A 112 21.579 -20.216 -4.108 1.00 0.00 O ATOM 0 H GLU A 112 24.155 -17.652 0.165 1.00 0.00 H new ATOM 0 HA GLU A 112 22.222 -17.569 -1.985 1.00 0.00 H new ATOM 0 HB2 GLU A 112 24.737 -18.343 -1.761 1.00 0.00 H new ATOM 0 HB3 GLU A 112 23.982 -19.839 -1.248 1.00 0.00 H new ATOM 0 HG2 GLU A 112 23.321 -18.466 -3.848 1.00 0.00 H new ATOM 0 HG3 GLU A 112 24.613 -19.638 -3.681 1.00 0.00 H new ATOM 1705 N SER A 113 21.769 -19.376 0.618 1.00 0.00 N ATOM 1706 CA SER A 113 20.768 -20.138 1.300 1.00 0.00 C ATOM 1707 C SER A 113 19.642 -19.176 1.750 1.00 0.00 C ATOM 1708 O SER A 113 18.616 -19.585 2.294 1.00 0.00 O ATOM 1709 CB SER A 113 21.423 -20.853 2.486 1.00 0.00 C ATOM 1710 OG SER A 113 20.526 -21.744 3.151 1.00 0.00 O ATOM 0 H SER A 113 22.589 -19.152 1.181 1.00 0.00 H new ATOM 0 HA SER A 113 20.328 -20.895 0.652 1.00 0.00 H new ATOM 0 HB2 SER A 113 22.291 -21.411 2.135 1.00 0.00 H new ATOM 0 HB3 SER A 113 21.787 -20.111 3.197 1.00 0.00 H new ATOM 0 HG SER A 113 19.629 -21.350 3.172 1.00 0.00 H new ATOM 1716 N GLU A 114 19.851 -17.914 1.457 1.00 0.00 N ATOM 1717 CA GLU A 114 18.981 -16.846 1.792 1.00 0.00 C ATOM 1718 C GLU A 114 18.426 -16.177 0.601 1.00 0.00 C ATOM 1719 O GLU A 114 17.899 -15.082 0.712 1.00 0.00 O ATOM 1720 CB GLU A 114 19.692 -15.841 2.624 1.00 0.00 C ATOM 1721 CG GLU A 114 19.682 -16.228 4.071 1.00 0.00 C ATOM 1722 CD GLU A 114 20.229 -15.218 5.062 1.00 0.00 C ATOM 1723 OE1 GLU A 114 21.429 -15.268 5.390 1.00 0.00 O ATOM 1724 OE2 GLU A 114 19.429 -14.425 5.613 1.00 0.00 O ATOM 0 H GLU A 114 20.681 -17.604 0.951 1.00 0.00 H new ATOM 0 HA GLU A 114 18.153 -17.282 2.352 1.00 0.00 H new ATOM 0 HB2 GLU A 114 20.721 -15.742 2.279 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.220 -14.866 2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.654 -16.455 4.353 1.00 0.00 H new ATOM 0 HG3 GLU A 114 20.253 -17.150 4.178 1.00 0.00 H new ATOM 1731 N LYS A 115 18.562 -16.811 -0.549 1.00 0.00 N ATOM 1732 CA LYS A 115 17.945 -16.355 -1.754 1.00 0.00 C ATOM 1733 C LYS A 115 18.493 -15.016 -2.278 1.00 0.00 C ATOM 1734 O LYS A 115 17.943 -14.436 -3.234 1.00 0.00 O ATOM 1735 CB LYS A 115 16.468 -16.283 -1.476 1.00 0.00 C ATOM 1736 CG LYS A 115 15.780 -17.635 -1.479 1.00 0.00 C ATOM 1737 CD LYS A 115 14.315 -17.604 -0.992 1.00 0.00 C ATOM 1738 CE LYS A 115 13.333 -16.873 -1.933 1.00 0.00 C ATOM 1739 NZ LYS A 115 13.453 -15.390 -1.922 1.00 0.00 N ATOM 0 H LYS A 115 19.111 -17.663 -0.661 1.00 0.00 H new ATOM 0 HA LYS A 115 18.171 -17.055 -2.558 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.312 -15.808 -0.507 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.997 -15.644 -2.223 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.806 -18.040 -2.490 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.346 -18.319 -0.847 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.971 -18.629 -0.856 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.283 -17.125 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.492 -17.230 -2.951 1.00 0.00 H new ATOM 0 HE3 LYS A 115 12.314 -17.144 -1.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.504 -14.965 -1.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 13.979 -15.091 -1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.960 -15.076 -2.774 1.00 0.00 H new ATOM 1752 N VAL A 116 19.566 -14.540 -1.700 1.00 0.00 N ATOM 1753 CA VAL A 116 20.125 -13.274 -2.109 1.00 0.00 C ATOM 1754 C VAL A 116 21.506 -13.419 -2.677 1.00 0.00 C ATOM 1755 O VAL A 116 22.346 -14.130 -2.145 1.00 0.00 O ATOM 1756 CB VAL A 116 20.091 -12.217 -0.992 1.00 0.00 C ATOM 1757 CG1 VAL A 116 18.678 -11.699 -0.835 1.00 0.00 C ATOM 1758 CG2 VAL A 116 20.577 -12.809 0.327 1.00 0.00 C ATOM 0 H VAL A 116 20.070 -15.007 -0.946 1.00 0.00 H new ATOM 0 HA VAL A 116 19.478 -12.911 -2.908 1.00 0.00 H new ATOM 0 HB VAL A 116 20.755 -11.396 -1.263 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.651 -10.950 -0.044 1.00 0.00 H new ATOM 0 HG12 VAL A 116 18.349 -11.250 -1.772 1.00 0.00 H new ATOM 0 HG13 VAL A 116 18.015 -12.524 -0.576 1.00 0.00 H new ATOM 0 HG21 VAL A 116 20.545 -12.044 1.103 1.00 0.00 H new ATOM 0 HG22 VAL A 116 19.933 -13.642 0.611 1.00 0.00 H new ATOM 0 HG23 VAL A 116 21.601 -13.165 0.211 1.00 0.00 H new ATOM 1768 N ASP A 117 21.732 -12.801 -3.787 1.00 0.00 N ATOM 1769 CA ASP A 117 23.022 -12.877 -4.408 1.00 0.00 C ATOM 1770 C ASP A 117 23.816 -11.670 -4.050 1.00 0.00 C ATOM 1771 O ASP A 117 23.345 -10.540 -4.190 1.00 0.00 O ATOM 1772 CB ASP A 117 22.943 -13.018 -5.932 1.00 0.00 C ATOM 1773 CG ASP A 117 22.236 -14.271 -6.386 1.00 0.00 C ATOM 1774 OD1 ASP A 117 22.810 -15.381 -6.267 1.00 0.00 O ATOM 1775 OD2 ASP A 117 21.078 -14.178 -6.861 1.00 0.00 O ATOM 0 H ASP A 117 21.045 -12.237 -4.287 1.00 0.00 H new ATOM 0 HA ASP A 117 23.509 -13.777 -4.034 1.00 0.00 H new ATOM 0 HB2 ASP A 117 22.427 -12.150 -6.343 1.00 0.00 H new ATOM 0 HB3 ASP A 117 23.953 -13.012 -6.342 1.00 0.00 H new ATOM 1780 N ILE A 118 24.988 -11.899 -3.551 1.00 0.00 N ATOM 1781 CA ILE A 118 25.862 -10.846 -3.177 1.00 0.00 C ATOM 1782 C ILE A 118 26.988 -10.750 -4.195 1.00 0.00 C ATOM 1783 O ILE A 118 27.620 -11.757 -4.544 1.00 0.00 O ATOM 1784 CB ILE A 118 26.414 -11.073 -1.748 1.00 0.00 C ATOM 1785 CG1 ILE A 118 27.141 -12.424 -1.661 1.00 0.00 C ATOM 1786 CG2 ILE A 118 25.269 -11.022 -0.734 1.00 0.00 C ATOM 1787 CD1 ILE A 118 27.696 -12.731 -0.310 1.00 0.00 C ATOM 0 H ILE A 118 25.365 -12.833 -3.392 1.00 0.00 H new ATOM 0 HA ILE A 118 25.314 -9.904 -3.165 1.00 0.00 H new ATOM 0 HB ILE A 118 27.128 -10.282 -1.518 1.00 0.00 H new ATOM 0 HG12 ILE A 118 26.449 -13.216 -1.946 1.00 0.00 H new ATOM 0 HG13 ILE A 118 27.954 -12.434 -2.387 1.00 0.00 H new ATOM 0 HG21 ILE A 118 25.664 -11.182 0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 118 24.784 -10.047 -0.781 1.00 0.00 H new ATOM 0 HG23 ILE A 118 24.542 -11.800 -0.966 1.00 0.00 H new ATOM 0 HD11 ILE A 118 28.193 -13.701 -0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 118 28.415 -11.961 -0.028 1.00 0.00 H new ATOM 0 HD13 ILE A 118 26.886 -12.755 0.419 1.00 0.00 H new ATOM 1799 N ARG A 119 27.220 -9.580 -4.700 1.00 0.00 N ATOM 1800 CA ARG A 119 28.244 -9.403 -5.697 1.00 0.00 C ATOM 1801 C ARG A 119 28.958 -8.099 -5.486 1.00 0.00 C ATOM 1802 O ARG A 119 28.389 -7.138 -4.961 1.00 0.00 O ATOM 1803 CB ARG A 119 27.698 -9.571 -7.119 1.00 0.00 C ATOM 1804 CG ARG A 119 26.567 -8.655 -7.470 1.00 0.00 C ATOM 1805 CD ARG A 119 25.956 -9.019 -8.804 1.00 0.00 C ATOM 1806 NE ARG A 119 24.858 -8.119 -9.145 1.00 0.00 N ATOM 1807 CZ ARG A 119 23.621 -8.494 -9.488 1.00 0.00 C ATOM 1808 NH1 ARG A 119 23.298 -9.789 -9.534 1.00 0.00 N ATOM 1809 NH2 ARG A 119 22.711 -7.566 -9.784 1.00 0.00 N ATOM 0 H ARG A 119 26.718 -8.730 -4.443 1.00 0.00 H new ATOM 0 HA ARG A 119 28.982 -10.196 -5.578 1.00 0.00 H new ATOM 0 HB2 ARG A 119 28.511 -9.409 -7.827 1.00 0.00 H new ATOM 0 HB3 ARG A 119 27.365 -10.601 -7.246 1.00 0.00 H new ATOM 0 HG2 ARG A 119 25.804 -8.703 -6.693 1.00 0.00 H new ATOM 0 HG3 ARG A 119 26.926 -7.626 -7.501 1.00 0.00 H new ATOM 0 HD2 ARG A 119 26.720 -8.976 -9.581 1.00 0.00 H new ATOM 0 HD3 ARG A 119 25.592 -10.046 -8.772 1.00 0.00 H new ATOM 0 HE ARG A 119 25.051 -7.118 -9.119 1.00 0.00 H new ATOM 0 HH11 ARG A 119 23.996 -10.497 -9.307 1.00 0.00 H new ATOM 0 HH12 ARG A 119 22.353 -10.070 -9.796 1.00 0.00 H new ATOM 0 HH21 ARG A 119 22.960 -6.578 -9.748 1.00 0.00 H new ATOM 0 HH22 ARG A 119 21.765 -7.844 -10.047 1.00 0.00 H new ATOM 1822 N LEU A 120 30.206 -8.073 -5.847 1.00 0.00 N ATOM 1823 CA LEU A 120 31.048 -6.961 -5.535 1.00 0.00 C ATOM 1824 C LEU A 120 32.142 -6.775 -6.550 1.00 0.00 C ATOM 1825 O LEU A 120 32.670 -7.741 -7.060 1.00 0.00 O ATOM 1826 CB LEU A 120 31.631 -7.072 -4.072 1.00 0.00 C ATOM 1827 CG LEU A 120 32.206 -8.442 -3.543 1.00 0.00 C ATOM 1828 CD1 LEU A 120 31.128 -9.495 -3.351 1.00 0.00 C ATOM 1829 CD2 LEU A 120 33.322 -8.988 -4.413 1.00 0.00 C ATOM 0 H LEU A 120 30.667 -8.821 -6.365 1.00 0.00 H new ATOM 0 HA LEU A 120 30.423 -6.069 -5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 120 32.428 -6.334 -3.986 1.00 0.00 H new ATOM 0 HB3 LEU A 120 30.840 -6.768 -3.386 1.00 0.00 H new ATOM 0 HG LEU A 120 32.629 -8.211 -2.565 1.00 0.00 H new ATOM 0 HD11 LEU A 120 31.581 -10.417 -2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 120 30.396 -9.138 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 120 30.633 -9.686 -4.303 1.00 0.00 H new ATOM 0 HD21 LEU A 120 33.677 -9.932 -3.999 1.00 0.00 H new ATOM 0 HD22 LEU A 120 32.948 -9.153 -5.423 1.00 0.00 H new ATOM 0 HD23 LEU A 120 34.144 -8.272 -4.442 1.00 0.00 H new