USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 787 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 46 TYR OH : rot 60:sc= 1.04 USER MOD Set 1.2: A 70 THR OG1 : rot -177:sc= 0.973 USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0919 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 17:sc= 1.19 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 43:sc= 1.21 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -2.09! C(o=-2.1!,f=-1.2!) USER MOD Single : A 23 THR OG1 : rot 130:sc= -0.349 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl -166:sc= -0.726 (180deg=-1.51) USER MOD Single : A 51 LYS NZ :NH3+ -116:sc= 1.31 (180deg=0.513) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 MET CE :methyl -124:sc= -1.41 (180deg=-5.38!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= -0.82 USER MOD Single : A 79 GLN : amide:sc= -0.0897 K(o=-0.09,f=-1.6!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 80:sc= 0.199 USER MOD Single : A 94 LYS NZ :NH3+ -105:sc= 0.57 (180deg=0.00414) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 101 HIS : no HD1:sc= -0.0756 X(o=-0.076,f=-0.076) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -1:sc= 0.558 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -29.491 -13.249 53.506 1.00 0.00 N ATOM 2 CA GLY A 1 -28.314 -13.996 53.103 1.00 0.00 C ATOM 3 C GLY A 1 -27.829 -13.611 51.720 1.00 0.00 C ATOM 4 O GLY A 1 -28.424 -12.759 51.060 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.292 -12.738 54.389 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.742 -12.568 52.761 1.00 0.00 H new ATOM 0 H3 GLY A 1 -30.284 -13.905 53.657 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -27.515 -13.827 53.825 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -28.540 -15.062 53.122 1.00 0.00 H new ATOM 8 N SER A 2 -26.743 -14.238 51.280 1.00 0.00 N ATOM 9 CA SER A 2 -26.173 -13.953 49.968 1.00 0.00 C ATOM 10 C SER A 2 -25.016 -14.898 49.660 1.00 0.00 C ATOM 11 O SER A 2 -24.389 -15.445 50.567 1.00 0.00 O ATOM 12 CB SER A 2 -25.693 -12.502 49.902 1.00 0.00 C ATOM 13 OG SER A 2 -24.847 -12.194 50.997 1.00 0.00 O ATOM 0 H SER A 2 -26.240 -14.947 51.813 1.00 0.00 H new ATOM 0 HA SER A 2 -26.951 -14.106 49.220 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.158 -12.335 48.967 1.00 0.00 H new ATOM 0 HB3 SER A 2 -26.552 -11.831 49.902 1.00 0.00 H new ATOM 0 HG SER A 2 -24.552 -11.262 50.931 1.00 0.00 H new ATOM 19 N SER A 3 -24.739 -15.085 48.374 1.00 0.00 N ATOM 20 CA SER A 3 -23.660 -15.967 47.945 1.00 0.00 C ATOM 21 C SER A 3 -23.433 -15.856 46.440 1.00 0.00 C ATOM 22 O SER A 3 -24.211 -15.220 45.729 1.00 0.00 O ATOM 23 CB SER A 3 -23.977 -17.416 48.319 1.00 0.00 C ATOM 24 OG SER A 3 -23.593 -17.694 49.654 1.00 0.00 O ATOM 0 H SER A 3 -25.247 -14.638 47.611 1.00 0.00 H new ATOM 0 HA SER A 3 -22.748 -15.659 48.456 1.00 0.00 H new ATOM 0 HB2 SER A 3 -25.044 -17.601 48.198 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.458 -18.092 47.640 1.00 0.00 H new ATOM 0 HG SER A 3 -23.461 -16.852 50.138 1.00 0.00 H new ATOM 30 N GLY A 4 -22.361 -16.480 45.961 1.00 0.00 N ATOM 31 CA GLY A 4 -22.050 -16.440 44.544 1.00 0.00 C ATOM 32 C GLY A 4 -20.667 -16.979 44.239 1.00 0.00 C ATOM 33 O GLY A 4 -19.779 -16.946 45.090 1.00 0.00 O ATOM 0 H GLY A 4 -21.702 -17.013 46.529 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.792 -17.021 43.996 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.123 -15.412 44.188 1.00 0.00 H new ATOM 37 N SER A 5 -20.484 -17.479 43.021 1.00 0.00 N ATOM 38 CA SER A 5 -19.201 -18.033 42.606 1.00 0.00 C ATOM 39 C SER A 5 -19.216 -18.388 41.123 1.00 0.00 C ATOM 40 O SER A 5 -20.244 -18.791 40.580 1.00 0.00 O ATOM 41 CB SER A 5 -18.866 -19.274 43.436 1.00 0.00 C ATOM 42 OG SER A 5 -17.465 -19.457 43.537 1.00 0.00 O ATOM 0 H SER A 5 -21.209 -17.512 42.304 1.00 0.00 H new ATOM 0 HA SER A 5 -18.435 -17.275 42.772 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.296 -19.175 44.433 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.319 -20.154 42.979 1.00 0.00 H new ATOM 0 HG SER A 5 -17.277 -20.255 44.073 1.00 0.00 H new ATOM 48 N SER A 6 -18.067 -18.233 40.472 1.00 0.00 N ATOM 49 CA SER A 6 -17.947 -18.533 39.050 1.00 0.00 C ATOM 50 C SER A 6 -16.485 -18.517 38.613 1.00 0.00 C ATOM 51 O SER A 6 -15.597 -18.169 39.390 1.00 0.00 O ATOM 52 CB SER A 6 -18.749 -17.525 38.226 1.00 0.00 C ATOM 53 OG SER A 6 -20.084 -17.963 38.043 1.00 0.00 O ATOM 0 H SER A 6 -17.206 -17.901 40.907 1.00 0.00 H new ATOM 0 HA SER A 6 -18.348 -19.532 38.879 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.746 -16.557 38.727 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.273 -17.383 37.256 1.00 0.00 H new ATOM 0 HG SER A 6 -20.427 -18.329 38.885 1.00 0.00 H new ATOM 59 N GLY A 7 -16.244 -18.896 37.362 1.00 0.00 N ATOM 60 CA GLY A 7 -14.890 -18.919 36.841 1.00 0.00 C ATOM 61 C GLY A 7 -14.786 -19.667 35.527 1.00 0.00 C ATOM 62 O GLY A 7 -15.419 -20.707 35.345 1.00 0.00 O ATOM 0 H GLY A 7 -16.963 -19.188 36.700 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.540 -17.896 36.702 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.230 -19.384 37.573 1.00 0.00 H new ATOM 66 N ASP A 8 -13.986 -19.137 34.608 1.00 0.00 N ATOM 67 CA ASP A 8 -13.802 -19.761 33.303 1.00 0.00 C ATOM 68 C ASP A 8 -12.716 -19.044 32.506 1.00 0.00 C ATOM 69 O ASP A 8 -12.911 -17.921 32.042 1.00 0.00 O ATOM 70 CB ASP A 8 -15.116 -19.753 32.520 1.00 0.00 C ATOM 71 CG ASP A 8 -15.998 -20.940 32.856 1.00 0.00 C ATOM 72 OD1 ASP A 8 -15.449 -22.010 33.194 1.00 0.00 O ATOM 73 OD2 ASP A 8 -17.236 -20.798 32.781 1.00 0.00 O ATOM 0 H ASP A 8 -13.455 -18.277 34.743 1.00 0.00 H new ATOM 0 HA ASP A 8 -13.489 -20.793 33.462 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.657 -18.831 32.733 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -14.899 -19.756 31.452 1.00 0.00 H new ATOM 78 N LYS A 9 -11.572 -19.701 32.352 1.00 0.00 N ATOM 79 CA LYS A 9 -10.454 -19.129 31.612 1.00 0.00 C ATOM 80 C LYS A 9 -9.951 -20.100 30.548 1.00 0.00 C ATOM 81 O LYS A 9 -9.625 -21.248 30.848 1.00 0.00 O ATOM 82 CB LYS A 9 -9.314 -18.767 32.567 1.00 0.00 C ATOM 83 CG LYS A 9 -9.790 -18.301 33.932 1.00 0.00 C ATOM 84 CD LYS A 9 -9.942 -19.464 34.898 1.00 0.00 C ATOM 85 CE LYS A 9 -8.589 -20.005 35.336 1.00 0.00 C ATOM 86 NZ LYS A 9 -8.669 -20.701 36.650 1.00 0.00 N ATOM 0 H LYS A 9 -11.395 -20.631 32.730 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.805 -18.224 31.116 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.668 -19.635 32.694 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -8.708 -17.982 32.115 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.081 -17.580 34.339 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -10.745 -17.786 33.829 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.506 -19.141 35.773 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -10.517 -20.259 34.424 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.213 -20.696 34.582 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.874 -19.185 35.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.727 -21.055 36.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -9.004 -20.035 37.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.332 -21.499 36.580 1.00 0.00 H new ATOM 100 N ILE A 10 -9.890 -19.630 29.307 1.00 0.00 N ATOM 101 CA ILE A 10 -9.424 -20.457 28.200 1.00 0.00 C ATOM 102 C ILE A 10 -9.096 -19.605 26.978 1.00 0.00 C ATOM 103 O ILE A 10 -9.852 -18.705 26.617 1.00 0.00 O ATOM 104 CB ILE A 10 -10.472 -21.515 27.808 1.00 0.00 C ATOM 105 CG1 ILE A 10 -9.921 -22.429 26.712 1.00 0.00 C ATOM 106 CG2 ILE A 10 -11.757 -20.843 27.348 1.00 0.00 C ATOM 107 CD1 ILE A 10 -9.001 -23.511 27.233 1.00 0.00 C ATOM 0 H ILE A 10 -10.157 -18.682 29.042 1.00 0.00 H new ATOM 0 HA ILE A 10 -8.520 -20.962 28.541 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.697 -22.124 28.684 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -10.754 -22.894 26.185 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -9.381 -21.824 25.983 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.488 -21.604 27.074 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.157 -20.230 28.156 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -11.549 -20.213 26.484 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.648 -24.121 26.401 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -8.148 -23.053 27.734 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -9.543 -24.140 27.940 1.00 0.00 H new ATOM 119 N GLU A 11 -7.964 -19.899 26.346 1.00 0.00 N ATOM 120 CA GLU A 11 -7.537 -19.161 25.163 1.00 0.00 C ATOM 121 C GLU A 11 -6.667 -20.032 24.263 1.00 0.00 C ATOM 122 O GLU A 11 -5.692 -20.632 24.715 1.00 0.00 O ATOM 123 CB GLU A 11 -6.768 -17.902 25.571 1.00 0.00 C ATOM 124 CG GLU A 11 -7.665 -16.729 25.926 1.00 0.00 C ATOM 125 CD GLU A 11 -6.893 -15.557 26.500 1.00 0.00 C ATOM 126 OE1 GLU A 11 -6.208 -14.860 25.723 1.00 0.00 O ATOM 127 OE2 GLU A 11 -6.975 -15.336 27.727 1.00 0.00 O ATOM 0 H GLU A 11 -7.327 -20.642 26.633 1.00 0.00 H new ATOM 0 HA GLU A 11 -8.428 -18.870 24.606 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.134 -18.135 26.426 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.108 -17.609 24.755 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.202 -16.404 25.035 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.414 -17.055 26.648 1.00 0.00 H new ATOM 134 N SER A 12 -7.027 -20.097 22.985 1.00 0.00 N ATOM 135 CA SER A 12 -6.283 -20.899 22.020 1.00 0.00 C ATOM 136 C SER A 12 -6.698 -20.555 20.593 1.00 0.00 C ATOM 137 O SER A 12 -7.871 -20.301 20.319 1.00 0.00 O ATOM 138 CB SER A 12 -6.506 -22.389 22.283 1.00 0.00 C ATOM 139 OG SER A 12 -5.379 -23.151 21.888 1.00 0.00 O ATOM 0 H SER A 12 -7.829 -19.604 22.594 1.00 0.00 H new ATOM 0 HA SER A 12 -5.223 -20.672 22.136 1.00 0.00 H new ATOM 0 HB2 SER A 12 -6.703 -22.549 23.343 1.00 0.00 H new ATOM 0 HB3 SER A 12 -7.388 -22.729 21.740 1.00 0.00 H new ATOM 0 HG SER A 12 -5.546 -24.100 22.068 1.00 0.00 H new ATOM 145 N LYS A 13 -5.726 -20.548 19.687 1.00 0.00 N ATOM 146 CA LYS A 13 -5.988 -20.237 18.286 1.00 0.00 C ATOM 147 C LYS A 13 -4.769 -20.548 17.423 1.00 0.00 C ATOM 148 O LYS A 13 -3.752 -19.855 17.494 1.00 0.00 O ATOM 149 CB LYS A 13 -6.372 -18.764 18.133 1.00 0.00 C ATOM 150 CG LYS A 13 -7.292 -18.495 16.955 1.00 0.00 C ATOM 151 CD LYS A 13 -7.438 -17.006 16.690 1.00 0.00 C ATOM 152 CE LYS A 13 -8.535 -16.392 17.547 1.00 0.00 C ATOM 153 NZ LYS A 13 -8.622 -14.917 17.364 1.00 0.00 N ATOM 0 H LYS A 13 -4.749 -20.754 19.898 1.00 0.00 H new ATOM 0 HA LYS A 13 -6.818 -20.859 17.950 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.859 -18.427 19.048 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -5.465 -18.171 18.018 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.899 -18.987 16.065 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.273 -18.928 17.152 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.492 -16.505 16.894 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.664 -16.843 15.636 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -9.492 -16.847 17.292 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -8.345 -16.617 18.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -9.381 -14.537 17.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -7.717 -14.480 17.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -8.829 -14.702 16.368 1.00 0.00 H new ATOM 167 N LEU A 14 -4.877 -21.591 16.608 1.00 0.00 N ATOM 168 CA LEU A 14 -3.784 -21.993 15.730 1.00 0.00 C ATOM 169 C LEU A 14 -4.256 -22.088 14.282 1.00 0.00 C ATOM 170 O LEU A 14 -5.047 -22.965 13.932 1.00 0.00 O ATOM 171 CB LEU A 14 -3.209 -23.337 16.180 1.00 0.00 C ATOM 172 CG LEU A 14 -1.961 -23.815 15.438 1.00 0.00 C ATOM 173 CD1 LEU A 14 -0.729 -23.074 15.933 1.00 0.00 C ATOM 174 CD2 LEU A 14 -1.784 -25.317 15.604 1.00 0.00 C ATOM 0 H LEU A 14 -5.711 -22.174 16.537 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.005 -21.233 15.790 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.973 -23.271 17.242 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.984 -24.096 16.072 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.088 -23.599 14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.150 -23.428 15.393 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.854 -22.005 15.762 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.598 -23.258 16.999 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.891 -25.639 15.069 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.679 -25.556 16.662 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.655 -25.833 15.200 1.00 0.00 H new ATOM 186 N LEU A 15 -3.764 -21.181 13.445 1.00 0.00 N ATOM 187 CA LEU A 15 -4.134 -21.163 12.034 1.00 0.00 C ATOM 188 C LEU A 15 -3.020 -20.556 11.187 1.00 0.00 C ATOM 189 O LEU A 15 -2.515 -19.475 11.490 1.00 0.00 O ATOM 190 CB LEU A 15 -5.429 -20.375 11.835 1.00 0.00 C ATOM 191 CG LEU A 15 -6.701 -21.023 12.383 1.00 0.00 C ATOM 192 CD1 LEU A 15 -6.928 -20.612 13.830 1.00 0.00 C ATOM 193 CD2 LEU A 15 -7.901 -20.650 11.526 1.00 0.00 C ATOM 0 H LEU A 15 -3.108 -20.449 13.719 1.00 0.00 H new ATOM 0 HA LEU A 15 -4.290 -22.193 11.712 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.312 -19.398 12.304 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.565 -20.202 10.767 1.00 0.00 H new ATOM 0 HG LEU A 15 -6.578 -22.106 12.349 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -7.838 -21.082 14.203 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -6.080 -20.930 14.436 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -7.030 -19.528 13.889 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.797 -21.120 11.931 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -8.027 -19.567 11.528 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -7.740 -20.995 10.505 1.00 0.00 H new ATOM 205 N ALA A 16 -2.642 -21.258 10.123 1.00 0.00 N ATOM 206 CA ALA A 16 -1.592 -20.785 9.230 1.00 0.00 C ATOM 207 C ALA A 16 -1.643 -21.511 7.890 1.00 0.00 C ATOM 208 O ALA A 16 -2.037 -22.675 7.817 1.00 0.00 O ATOM 209 CB ALA A 16 -0.227 -20.966 9.879 1.00 0.00 C ATOM 0 H ALA A 16 -3.048 -22.156 9.859 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.757 -19.724 9.045 1.00 0.00 H new ATOM 0 HB1 ALA A 16 0.548 -20.609 9.201 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -0.187 -20.397 10.808 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -0.063 -22.022 10.093 1.00 0.00 H new ATOM 215 N LYS A 17 -1.242 -20.817 6.831 1.00 0.00 N ATOM 216 CA LYS A 17 -1.241 -21.394 5.492 1.00 0.00 C ATOM 217 C LYS A 17 -0.113 -20.810 4.648 1.00 0.00 C ATOM 218 O LYS A 17 0.179 -19.617 4.723 1.00 0.00 O ATOM 219 CB LYS A 17 -2.587 -21.146 4.806 1.00 0.00 C ATOM 220 CG LYS A 17 -2.932 -19.674 4.660 1.00 0.00 C ATOM 221 CD LYS A 17 -4.168 -19.474 3.799 1.00 0.00 C ATOM 222 CE LYS A 17 -4.539 -18.003 3.689 1.00 0.00 C ATOM 223 NZ LYS A 17 -5.398 -17.561 4.822 1.00 0.00 N ATOM 0 H LYS A 17 -0.913 -19.852 6.874 1.00 0.00 H new ATOM 0 HA LYS A 17 -1.081 -22.468 5.587 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.573 -21.607 3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -3.373 -21.640 5.377 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -3.100 -19.239 5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.089 -19.144 4.217 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -3.989 -19.880 2.804 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.003 -20.030 4.225 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -3.631 -17.400 3.665 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.061 -17.830 2.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -5.629 -16.553 4.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -6.276 -18.118 4.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -4.890 -17.702 5.718 1.00 0.00 H new ATOM 237 N LYS A 18 0.517 -21.659 3.843 1.00 0.00 N ATOM 238 CA LYS A 18 1.612 -21.227 2.982 1.00 0.00 C ATOM 239 C LYS A 18 1.185 -21.226 1.517 1.00 0.00 C ATOM 240 O LYS A 18 1.929 -21.668 0.643 1.00 0.00 O ATOM 241 CB LYS A 18 2.826 -22.140 3.169 1.00 0.00 C ATOM 242 CG LYS A 18 3.751 -21.700 4.290 1.00 0.00 C ATOM 243 CD LYS A 18 3.109 -21.899 5.653 1.00 0.00 C ATOM 244 CE LYS A 18 3.352 -23.303 6.184 1.00 0.00 C ATOM 245 NZ LYS A 18 4.677 -23.422 6.853 1.00 0.00 N ATOM 0 H LYS A 18 0.288 -22.650 3.769 1.00 0.00 H new ATOM 0 HA LYS A 18 1.883 -20.210 3.264 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.480 -23.154 3.372 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.390 -22.176 2.237 1.00 0.00 H new ATOM 0 HG2 LYS A 18 4.681 -22.266 4.239 1.00 0.00 H new ATOM 0 HG3 LYS A 18 4.010 -20.649 4.158 1.00 0.00 H new ATOM 0 HD2 LYS A 18 3.510 -21.169 6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.037 -21.716 5.581 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.564 -23.566 6.890 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.295 -24.017 5.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.804 -24.394 7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.431 -23.196 6.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.723 -22.759 7.653 1.00 0.00 H new ATOM 259 N ALA A 19 -0.018 -20.724 1.257 1.00 0.00 N ATOM 260 CA ALA A 19 -0.543 -20.663 -0.101 1.00 0.00 C ATOM 261 C ALA A 19 -0.362 -19.270 -0.696 1.00 0.00 C ATOM 262 O ALA A 19 -1.219 -18.402 -0.537 1.00 0.00 O ATOM 263 CB ALA A 19 -2.012 -21.060 -0.119 1.00 0.00 C ATOM 0 H ALA A 19 -0.647 -20.354 1.969 1.00 0.00 H new ATOM 0 HA ALA A 19 0.019 -21.368 -0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -2.390 -21.010 -1.140 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -2.119 -22.077 0.258 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.581 -20.378 0.513 1.00 0.00 H new ATOM 269 N GLU A 20 0.758 -19.066 -1.383 1.00 0.00 N ATOM 270 CA GLU A 20 1.050 -17.777 -2.000 1.00 0.00 C ATOM 271 C GLU A 20 1.589 -17.962 -3.416 1.00 0.00 C ATOM 272 O GLU A 20 2.347 -18.894 -3.687 1.00 0.00 O ATOM 273 CB GLU A 20 2.062 -17.000 -1.155 1.00 0.00 C ATOM 274 CG GLU A 20 1.973 -15.494 -1.332 1.00 0.00 C ATOM 275 CD GLU A 20 0.736 -14.902 -0.684 1.00 0.00 C ATOM 276 OE1 GLU A 20 0.575 -15.065 0.544 1.00 0.00 O ATOM 277 OE2 GLU A 20 -0.071 -14.277 -1.404 1.00 0.00 O ATOM 0 H GLU A 20 1.477 -19.775 -1.526 1.00 0.00 H new ATOM 0 HA GLU A 20 0.121 -17.210 -2.054 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.908 -17.244 -0.104 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.068 -17.329 -1.414 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.861 -15.029 -0.904 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.970 -15.257 -2.396 1.00 0.00 H new ATOM 284 N VAL A 21 1.191 -17.069 -4.315 1.00 0.00 N ATOM 285 CA VAL A 21 1.633 -17.132 -5.703 1.00 0.00 C ATOM 286 C VAL A 21 2.473 -15.914 -6.068 1.00 0.00 C ATOM 287 O VAL A 21 3.636 -16.041 -6.450 1.00 0.00 O ATOM 288 CB VAL A 21 0.437 -17.225 -6.670 1.00 0.00 C ATOM 289 CG1 VAL A 21 0.916 -17.239 -8.113 1.00 0.00 C ATOM 290 CG2 VAL A 21 -0.399 -18.459 -6.365 1.00 0.00 C ATOM 0 H VAL A 21 0.563 -16.293 -4.107 1.00 0.00 H new ATOM 0 HA VAL A 21 2.241 -18.032 -5.801 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.190 -16.345 -6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.057 -17.305 -8.781 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.468 -16.323 -8.322 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.566 -18.099 -8.272 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.239 -18.509 -7.057 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.216 -19.352 -6.476 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.774 -18.401 -5.343 1.00 0.00 H new ATOM 300 N ASN A 22 1.877 -14.732 -5.948 1.00 0.00 N ATOM 301 CA ASN A 22 2.571 -13.489 -6.265 1.00 0.00 C ATOM 302 C ASN A 22 2.296 -12.427 -5.206 1.00 0.00 C ATOM 303 O ASN A 22 1.157 -11.995 -5.024 1.00 0.00 O ATOM 304 CB ASN A 22 2.140 -12.977 -7.641 1.00 0.00 C ATOM 305 CG ASN A 22 0.873 -12.146 -7.578 1.00 0.00 C ATOM 306 OD1 ASN A 22 0.856 -10.988 -7.996 1.00 0.00 O ATOM 307 ND2 ASN A 22 -0.195 -12.735 -7.054 1.00 0.00 N ATOM 0 H ASN A 22 0.915 -14.609 -5.633 1.00 0.00 H new ATOM 0 HA ASN A 22 3.642 -13.693 -6.279 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.943 -12.378 -8.071 1.00 0.00 H new ATOM 0 HB3 ASN A 22 1.983 -13.825 -8.308 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -1.076 -12.226 -6.985 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -0.135 -13.697 -6.720 1.00 0.00 H new ATOM 314 N THR A 23 3.347 -12.007 -4.509 1.00 0.00 N ATOM 315 CA THR A 23 3.220 -10.996 -3.467 1.00 0.00 C ATOM 316 C THR A 23 4.028 -9.750 -3.809 1.00 0.00 C ATOM 317 O THR A 23 5.094 -9.838 -4.419 1.00 0.00 O ATOM 318 CB THR A 23 3.682 -11.535 -2.100 1.00 0.00 C ATOM 319 OG1 THR A 23 3.331 -12.918 -1.975 1.00 0.00 O ATOM 320 CG2 THR A 23 3.053 -10.743 -0.965 1.00 0.00 C ATOM 0 H THR A 23 4.297 -12.352 -4.648 1.00 0.00 H new ATOM 0 HA THR A 23 2.163 -10.736 -3.407 1.00 0.00 H new ATOM 0 HB THR A 23 4.765 -11.428 -2.039 1.00 0.00 H new ATOM 0 HG1 THR A 23 4.116 -13.430 -1.689 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.394 -11.142 -0.010 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.346 -9.696 -1.046 1.00 0.00 H new ATOM 0 HG23 THR A 23 1.967 -10.822 -1.024 1.00 0.00 H new ATOM 328 N ILE A 24 3.516 -8.590 -3.411 1.00 0.00 N ATOM 329 CA ILE A 24 4.193 -7.326 -3.674 1.00 0.00 C ATOM 330 C ILE A 24 5.158 -6.974 -2.547 1.00 0.00 C ATOM 331 O ILE A 24 4.842 -7.102 -1.364 1.00 0.00 O ATOM 332 CB ILE A 24 3.186 -6.175 -3.851 1.00 0.00 C ATOM 333 CG1 ILE A 24 1.941 -6.666 -4.593 1.00 0.00 C ATOM 334 CG2 ILE A 24 3.831 -5.017 -4.599 1.00 0.00 C ATOM 335 CD1 ILE A 24 0.845 -5.627 -4.689 1.00 0.00 C ATOM 0 H ILE A 24 2.635 -8.499 -2.905 1.00 0.00 H new ATOM 0 HA ILE A 24 4.752 -7.454 -4.601 1.00 0.00 H new ATOM 0 HB ILE A 24 2.883 -5.823 -2.865 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.226 -6.976 -5.599 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.550 -7.548 -4.086 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.107 -4.211 -4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.690 -4.653 -4.035 1.00 0.00 H new ATOM 0 HG23 ILE A 24 4.159 -5.356 -5.582 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -0.006 -6.044 -5.227 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.532 -5.334 -3.687 1.00 0.00 H new ATOM 0 HD13 ILE A 24 1.218 -4.753 -5.222 1.00 0.00 H new ATOM 347 N PRO A 25 6.362 -6.517 -2.921 1.00 0.00 N ATOM 348 CA PRO A 25 7.397 -6.135 -1.956 1.00 0.00 C ATOM 349 C PRO A 25 7.041 -4.860 -1.198 1.00 0.00 C ATOM 350 O PRO A 25 7.805 -4.394 -0.354 1.00 0.00 O ATOM 351 CB PRO A 25 8.632 -5.908 -2.832 1.00 0.00 C ATOM 352 CG PRO A 25 8.086 -5.562 -4.174 1.00 0.00 C ATOM 353 CD PRO A 25 6.806 -6.339 -4.313 1.00 0.00 C ATOM 0 HA PRO A 25 7.536 -6.894 -1.186 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.254 -5.104 -2.438 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.255 -6.801 -2.876 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.903 -4.491 -4.257 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.791 -5.827 -4.962 1.00 0.00 H new ATOM 0 HD2 PRO A 25 6.068 -5.796 -4.904 1.00 0.00 H new ATOM 0 HD3 PRO A 25 6.969 -7.296 -4.808 1.00 0.00 H new ATOM 361 N GLY A 26 5.874 -4.301 -1.505 1.00 0.00 N ATOM 362 CA GLY A 26 5.437 -3.086 -0.843 1.00 0.00 C ATOM 363 C GLY A 26 4.648 -2.176 -1.763 1.00 0.00 C ATOM 364 O GLY A 26 4.783 -2.248 -2.985 1.00 0.00 O ATOM 0 H GLY A 26 5.224 -4.668 -2.200 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.823 -3.346 0.019 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.307 -2.549 -0.465 1.00 0.00 H new ATOM 368 N PHE A 27 3.820 -1.318 -1.177 1.00 0.00 N ATOM 369 CA PHE A 27 3.003 -0.392 -1.953 1.00 0.00 C ATOM 370 C PHE A 27 3.145 1.032 -1.424 1.00 0.00 C ATOM 371 O PHE A 27 3.265 1.249 -0.218 1.00 0.00 O ATOM 372 CB PHE A 27 1.534 -0.819 -1.915 1.00 0.00 C ATOM 373 CG PHE A 27 0.624 0.099 -2.680 1.00 0.00 C ATOM 374 CD1 PHE A 27 0.798 0.293 -4.041 1.00 0.00 C ATOM 375 CD2 PHE A 27 -0.406 0.767 -2.038 1.00 0.00 C ATOM 376 CE1 PHE A 27 -0.038 1.137 -4.747 1.00 0.00 C ATOM 377 CE2 PHE A 27 -1.246 1.613 -2.739 1.00 0.00 C ATOM 378 CZ PHE A 27 -1.062 1.797 -4.095 1.00 0.00 C ATOM 0 H PHE A 27 3.697 -1.244 -0.167 1.00 0.00 H new ATOM 0 HA PHE A 27 3.353 -0.414 -2.985 1.00 0.00 H new ATOM 0 HB2 PHE A 27 1.446 -1.827 -2.321 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.203 -0.864 -0.877 1.00 0.00 H new ATOM 0 HD1 PHE A 27 1.596 -0.221 -4.556 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.555 0.625 -0.978 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.109 1.281 -5.807 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.045 2.129 -2.227 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.717 2.456 -4.645 1.00 0.00 H new ATOM 388 N ASP A 28 3.130 1.999 -2.334 1.00 0.00 N ATOM 389 CA ASP A 28 3.256 3.403 -1.960 1.00 0.00 C ATOM 390 C ASP A 28 2.093 4.220 -2.516 1.00 0.00 C ATOM 391 O ASP A 28 1.646 5.184 -1.896 1.00 0.00 O ATOM 392 CB ASP A 28 4.583 3.971 -2.467 1.00 0.00 C ATOM 393 CG ASP A 28 4.882 3.558 -3.894 1.00 0.00 C ATOM 394 OD1 ASP A 28 5.368 2.425 -4.094 1.00 0.00 O ATOM 395 OD2 ASP A 28 4.630 4.367 -4.812 1.00 0.00 O ATOM 0 H ASP A 28 3.032 1.837 -3.336 1.00 0.00 H new ATOM 0 HA ASP A 28 3.234 3.467 -0.872 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.557 5.059 -2.405 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.391 3.634 -1.817 1.00 0.00 H new ATOM 400 N GLY A 29 1.609 3.828 -3.691 1.00 0.00 N ATOM 401 CA GLY A 29 0.504 4.535 -4.311 1.00 0.00 C ATOM 402 C GLY A 29 -0.547 4.964 -3.307 1.00 0.00 C ATOM 403 O GLY A 29 -1.460 4.201 -2.990 1.00 0.00 O ATOM 0 H GLY A 29 1.963 3.034 -4.224 1.00 0.00 H new ATOM 0 HA2 GLY A 29 0.885 5.414 -4.831 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.043 3.895 -5.063 1.00 0.00 H new ATOM 407 N VAL A 30 -0.418 6.187 -2.803 1.00 0.00 N ATOM 408 CA VAL A 30 -1.364 6.716 -1.828 1.00 0.00 C ATOM 409 C VAL A 30 -2.791 6.299 -2.165 1.00 0.00 C ATOM 410 O VAL A 30 -3.213 6.366 -3.320 1.00 0.00 O ATOM 411 CB VAL A 30 -1.293 8.252 -1.753 1.00 0.00 C ATOM 412 CG1 VAL A 30 -1.610 8.868 -3.107 1.00 0.00 C ATOM 413 CG2 VAL A 30 -2.240 8.778 -0.685 1.00 0.00 C ATOM 0 H VAL A 30 0.333 6.830 -3.054 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.086 6.300 -0.860 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.278 8.538 -1.479 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.555 9.954 -3.034 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.888 8.517 -3.845 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.614 8.575 -3.414 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.177 9.865 -0.646 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.261 8.483 -0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.962 8.363 0.284 1.00 0.00 H new ATOM 423 N VAL A 31 -3.533 5.869 -1.149 1.00 0.00 N ATOM 424 CA VAL A 31 -4.914 5.443 -1.337 1.00 0.00 C ATOM 425 C VAL A 31 -5.808 6.623 -1.700 1.00 0.00 C ATOM 426 O VAL A 31 -5.468 7.778 -1.442 1.00 0.00 O ATOM 427 CB VAL A 31 -5.469 4.763 -0.071 1.00 0.00 C ATOM 428 CG1 VAL A 31 -6.846 4.175 -0.341 1.00 0.00 C ATOM 429 CG2 VAL A 31 -4.509 3.691 0.422 1.00 0.00 C ATOM 0 H VAL A 31 -3.200 5.807 -0.187 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.915 4.724 -2.156 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.569 5.516 0.711 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.222 3.699 0.564 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.528 4.970 -0.643 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.776 3.435 -1.138 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.917 3.221 1.317 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.375 2.938 -0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.546 4.145 0.657 1.00 0.00 H new ATOM 439 N LYS A 32 -6.956 6.326 -2.301 1.00 0.00 N ATOM 440 CA LYS A 32 -7.902 7.361 -2.700 1.00 0.00 C ATOM 441 C LYS A 32 -9.170 7.293 -1.855 1.00 0.00 C ATOM 442 O LYS A 32 -9.711 8.321 -1.446 1.00 0.00 O ATOM 443 CB LYS A 32 -8.255 7.215 -4.182 1.00 0.00 C ATOM 444 CG LYS A 32 -7.044 7.212 -5.098 1.00 0.00 C ATOM 445 CD LYS A 32 -6.684 8.617 -5.551 1.00 0.00 C ATOM 446 CE LYS A 32 -5.701 9.276 -4.595 1.00 0.00 C ATOM 447 NZ LYS A 32 -5.084 10.494 -5.188 1.00 0.00 N ATOM 0 H LYS A 32 -7.253 5.376 -2.522 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.431 8.331 -2.540 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.811 6.288 -4.325 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.917 8.031 -4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.195 6.767 -4.579 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.247 6.589 -5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.251 8.578 -6.551 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.588 9.222 -5.619 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -6.215 9.542 -3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.919 8.564 -4.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.421 10.914 -4.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -4.572 10.236 -6.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -5.828 11.184 -5.417 1.00 0.00 H new ATOM 461 N ASP A 33 -9.638 6.077 -1.595 1.00 0.00 N ATOM 462 CA ASP A 33 -10.842 5.876 -0.797 1.00 0.00 C ATOM 463 C ASP A 33 -10.829 4.502 -0.133 1.00 0.00 C ATOM 464 O ASP A 33 -10.163 3.581 -0.603 1.00 0.00 O ATOM 465 CB ASP A 33 -12.089 6.023 -1.669 1.00 0.00 C ATOM 466 CG ASP A 33 -12.470 7.473 -1.895 1.00 0.00 C ATOM 467 OD1 ASP A 33 -13.245 8.017 -1.080 1.00 0.00 O ATOM 468 OD2 ASP A 33 -11.993 8.065 -2.886 1.00 0.00 O ATOM 0 H ASP A 33 -9.202 5.216 -1.925 1.00 0.00 H new ATOM 0 HA ASP A 33 -10.863 6.637 -0.017 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -11.914 5.542 -2.631 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -12.922 5.501 -1.198 1.00 0.00 H new ATOM 473 N ALA A 34 -11.570 4.374 0.964 1.00 0.00 N ATOM 474 CA ALA A 34 -11.645 3.113 1.691 1.00 0.00 C ATOM 475 C ALA A 34 -11.751 1.932 0.733 1.00 0.00 C ATOM 476 O ALA A 34 -11.048 0.934 0.885 1.00 0.00 O ATOM 477 CB ALA A 34 -12.826 3.127 2.650 1.00 0.00 C ATOM 0 H ALA A 34 -12.126 5.128 1.368 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.726 2.998 2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.870 2.179 3.187 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.706 3.942 3.363 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.749 3.269 2.088 1.00 0.00 H new ATOM 483 N GLU A 35 -12.636 2.052 -0.252 1.00 0.00 N ATOM 484 CA GLU A 35 -12.834 0.992 -1.233 1.00 0.00 C ATOM 485 C GLU A 35 -11.523 0.646 -1.932 1.00 0.00 C ATOM 486 O GLU A 35 -11.207 -0.527 -2.133 1.00 0.00 O ATOM 487 CB GLU A 35 -13.881 1.414 -2.267 1.00 0.00 C ATOM 488 CG GLU A 35 -15.242 1.720 -1.666 1.00 0.00 C ATOM 489 CD GLU A 35 -16.370 1.562 -2.667 1.00 0.00 C ATOM 490 OE1 GLU A 35 -16.698 2.554 -3.351 1.00 0.00 O ATOM 491 OE2 GLU A 35 -16.926 0.448 -2.765 1.00 0.00 O ATOM 0 H GLU A 35 -13.226 2.872 -0.391 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.189 0.106 -0.707 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.521 2.296 -2.797 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.990 0.620 -3.006 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.418 1.058 -0.818 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.244 2.739 -1.280 1.00 0.00 H new ATOM 498 N GLU A 36 -10.766 1.674 -2.301 1.00 0.00 N ATOM 499 CA GLU A 36 -9.490 1.478 -2.979 1.00 0.00 C ATOM 500 C GLU A 36 -8.466 0.847 -2.040 1.00 0.00 C ATOM 501 O GLU A 36 -7.653 0.021 -2.455 1.00 0.00 O ATOM 502 CB GLU A 36 -8.958 2.811 -3.510 1.00 0.00 C ATOM 503 CG GLU A 36 -7.649 2.685 -4.270 1.00 0.00 C ATOM 504 CD GLU A 36 -7.852 2.305 -5.724 1.00 0.00 C ATOM 505 OE1 GLU A 36 -8.190 1.132 -5.989 1.00 0.00 O ATOM 506 OE2 GLU A 36 -7.674 3.181 -6.596 1.00 0.00 O ATOM 0 H GLU A 36 -11.014 2.651 -2.142 1.00 0.00 H new ATOM 0 HA GLU A 36 -9.654 0.801 -3.817 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -9.707 3.256 -4.165 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.818 3.496 -2.674 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.110 3.631 -4.218 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.023 1.935 -3.786 1.00 0.00 H new ATOM 513 N ALA A 37 -8.512 1.243 -0.772 1.00 0.00 N ATOM 514 CA ALA A 37 -7.590 0.716 0.227 1.00 0.00 C ATOM 515 C ALA A 37 -7.789 -0.783 0.421 1.00 0.00 C ATOM 516 O ALA A 37 -6.838 -1.516 0.694 1.00 0.00 O ATOM 517 CB ALA A 37 -7.768 1.450 1.548 1.00 0.00 C ATOM 0 H ALA A 37 -9.178 1.927 -0.412 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.573 0.877 -0.131 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.074 1.047 2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.568 2.512 1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.790 1.318 1.903 1.00 0.00 H new ATOM 523 N VAL A 38 -9.032 -1.234 0.278 1.00 0.00 N ATOM 524 CA VAL A 38 -9.355 -2.647 0.438 1.00 0.00 C ATOM 525 C VAL A 38 -8.767 -3.477 -0.698 1.00 0.00 C ATOM 526 O VAL A 38 -8.118 -4.496 -0.463 1.00 0.00 O ATOM 527 CB VAL A 38 -10.878 -2.871 0.487 1.00 0.00 C ATOM 528 CG1 VAL A 38 -11.201 -4.356 0.419 1.00 0.00 C ATOM 529 CG2 VAL A 38 -11.468 -2.246 1.742 1.00 0.00 C ATOM 0 H VAL A 38 -9.831 -0.642 0.052 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.917 -2.968 1.383 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.328 -2.385 -0.379 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.281 -4.495 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -10.812 -4.771 -0.511 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -10.741 -4.867 1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -12.545 -2.414 1.760 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.015 -2.701 2.623 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.268 -1.175 1.744 1.00 0.00 H new ATOM 539 N ARG A 39 -8.997 -3.032 -1.929 1.00 0.00 N ATOM 540 CA ARG A 39 -8.490 -3.735 -3.101 1.00 0.00 C ATOM 541 C ARG A 39 -6.970 -3.866 -3.042 1.00 0.00 C ATOM 542 O ARG A 39 -6.431 -4.972 -3.084 1.00 0.00 O ATOM 543 CB ARG A 39 -8.899 -3.000 -4.379 1.00 0.00 C ATOM 544 CG ARG A 39 -10.350 -3.223 -4.771 1.00 0.00 C ATOM 545 CD ARG A 39 -10.562 -3.016 -6.263 1.00 0.00 C ATOM 546 NE ARG A 39 -10.265 -4.222 -7.031 1.00 0.00 N ATOM 547 CZ ARG A 39 -11.013 -5.319 -6.995 1.00 0.00 C ATOM 548 NH1 ARG A 39 -12.098 -5.361 -6.234 1.00 0.00 N ATOM 549 NH2 ARG A 39 -10.677 -6.377 -7.722 1.00 0.00 N ATOM 0 H ARG A 39 -9.531 -2.189 -2.140 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.924 -4.735 -3.109 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.728 -1.932 -4.245 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.256 -3.325 -5.197 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -10.651 -4.234 -4.496 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.988 -2.538 -4.213 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -11.594 -2.716 -6.444 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -9.927 -2.200 -6.609 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.438 -4.222 -7.628 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -12.360 -4.550 -5.674 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.671 -6.205 -6.208 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.844 -6.348 -8.309 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -11.252 -7.219 -7.694 1.00 0.00 H new ATOM 563 N ILE A 40 -6.287 -2.730 -2.945 1.00 0.00 N ATOM 564 CA ILE A 40 -4.831 -2.719 -2.879 1.00 0.00 C ATOM 565 C ILE A 40 -4.322 -3.672 -1.804 1.00 0.00 C ATOM 566 O ILE A 40 -3.441 -4.494 -2.055 1.00 0.00 O ATOM 567 CB ILE A 40 -4.292 -1.305 -2.593 1.00 0.00 C ATOM 568 CG1 ILE A 40 -4.638 -0.360 -3.746 1.00 0.00 C ATOM 569 CG2 ILE A 40 -2.787 -1.347 -2.370 1.00 0.00 C ATOM 570 CD1 ILE A 40 -4.748 1.089 -3.327 1.00 0.00 C ATOM 0 H ILE A 40 -6.718 -1.806 -2.910 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.468 -3.048 -3.853 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.765 -0.929 -1.686 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.875 -0.449 -4.520 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.582 -0.674 -4.191 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.421 -0.340 -2.169 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.563 -1.991 -1.520 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.298 -1.740 -3.261 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -4.995 1.701 -4.195 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.531 1.192 -2.575 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.797 1.420 -2.909 1.00 0.00 H new ATOM 582 N ALA A 41 -4.884 -3.558 -0.605 1.00 0.00 N ATOM 583 CA ALA A 41 -4.490 -4.412 0.508 1.00 0.00 C ATOM 584 C ALA A 41 -4.539 -5.885 0.114 1.00 0.00 C ATOM 585 O ALA A 41 -3.518 -6.573 0.119 1.00 0.00 O ATOM 586 CB ALA A 41 -5.383 -4.156 1.713 1.00 0.00 C ATOM 0 H ALA A 41 -5.614 -2.882 -0.380 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.462 -4.168 0.774 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.077 -4.801 2.536 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.294 -3.113 2.017 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.419 -4.370 1.450 1.00 0.00 H new ATOM 592 N ARG A 42 -5.732 -6.362 -0.225 1.00 0.00 N ATOM 593 CA ARG A 42 -5.915 -7.754 -0.619 1.00 0.00 C ATOM 594 C ARG A 42 -4.767 -8.221 -1.510 1.00 0.00 C ATOM 595 O ARG A 42 -4.282 -9.344 -1.374 1.00 0.00 O ATOM 596 CB ARG A 42 -7.247 -7.928 -1.351 1.00 0.00 C ATOM 597 CG ARG A 42 -8.460 -7.611 -0.492 1.00 0.00 C ATOM 598 CD ARG A 42 -9.668 -7.254 -1.344 1.00 0.00 C ATOM 599 NE ARG A 42 -10.454 -8.432 -1.700 1.00 0.00 N ATOM 600 CZ ARG A 42 -11.084 -9.192 -0.811 1.00 0.00 C ATOM 601 NH1 ARG A 42 -11.021 -8.897 0.480 1.00 0.00 N ATOM 602 NH2 ARG A 42 -11.779 -10.248 -1.212 1.00 0.00 N ATOM 0 H ARG A 42 -6.587 -5.805 -0.235 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.923 -8.364 0.284 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.256 -7.283 -2.230 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.324 -8.955 -1.709 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.697 -8.470 0.136 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.227 -6.782 0.177 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -10.298 -6.548 -0.802 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.335 -6.752 -2.253 1.00 0.00 H new ATOM 0 HE ARG A 42 -10.523 -8.685 -2.686 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.488 -8.085 0.792 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.505 -9.482 1.161 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.830 -10.478 -2.204 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.262 -10.830 -0.528 1.00 0.00 H new ATOM 616 N GLU A 43 -4.340 -7.352 -2.421 1.00 0.00 N ATOM 617 CA GLU A 43 -3.251 -7.678 -3.334 1.00 0.00 C ATOM 618 C GLU A 43 -1.942 -7.867 -2.574 1.00 0.00 C ATOM 619 O GLU A 43 -1.153 -8.759 -2.888 1.00 0.00 O ATOM 620 CB GLU A 43 -3.090 -6.576 -4.384 1.00 0.00 C ATOM 621 CG GLU A 43 -3.945 -6.785 -5.623 1.00 0.00 C ATOM 622 CD GLU A 43 -3.503 -5.922 -6.788 1.00 0.00 C ATOM 623 OE1 GLU A 43 -2.389 -6.148 -7.305 1.00 0.00 O ATOM 624 OE2 GLU A 43 -4.271 -5.020 -7.183 1.00 0.00 O ATOM 0 H GLU A 43 -4.731 -6.418 -2.546 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.498 -8.614 -3.835 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.346 -5.617 -3.934 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.043 -6.519 -4.681 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -3.903 -7.834 -5.916 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -4.985 -6.562 -5.384 1.00 0.00 H new ATOM 631 N ILE A 44 -1.718 -7.022 -1.574 1.00 0.00 N ATOM 632 CA ILE A 44 -0.505 -7.096 -0.769 1.00 0.00 C ATOM 633 C ILE A 44 -0.501 -8.345 0.106 1.00 0.00 C ATOM 634 O ILE A 44 0.553 -8.906 0.401 1.00 0.00 O ATOM 635 CB ILE A 44 -0.348 -5.854 0.128 1.00 0.00 C ATOM 636 CG1 ILE A 44 -0.089 -4.611 -0.725 1.00 0.00 C ATOM 637 CG2 ILE A 44 0.781 -6.062 1.127 1.00 0.00 C ATOM 638 CD1 ILE A 44 0.137 -3.356 0.088 1.00 0.00 C ATOM 0 H ILE A 44 -2.360 -6.278 -1.302 1.00 0.00 H new ATOM 0 HA ILE A 44 0.333 -7.140 -1.465 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.275 -5.705 0.682 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.783 -4.788 -1.355 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.937 -4.455 -1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 44 0.880 -5.176 1.754 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.558 -6.926 1.753 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.714 -6.233 0.591 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.314 -2.515 -0.583 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.743 -3.154 0.698 1.00 0.00 H new ATOM 0 HD13 ILE A 44 1.003 -3.493 0.735 1.00 0.00 H new ATOM 650 N GLY A 45 -1.690 -8.777 0.516 1.00 0.00 N ATOM 651 CA GLY A 45 -1.802 -9.958 1.352 1.00 0.00 C ATOM 652 C GLY A 45 -1.845 -9.621 2.829 1.00 0.00 C ATOM 653 O GLY A 45 -0.828 -9.262 3.421 1.00 0.00 O ATOM 0 H GLY A 45 -2.577 -8.330 0.284 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.704 -10.507 1.081 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.957 -10.618 1.158 1.00 0.00 H new ATOM 657 N TYR A 46 -3.027 -9.736 3.426 1.00 0.00 N ATOM 658 CA TYR A 46 -3.199 -9.437 4.842 1.00 0.00 C ATOM 659 C TYR A 46 -2.315 -10.336 5.701 1.00 0.00 C ATOM 660 O TYR A 46 -1.955 -11.448 5.314 1.00 0.00 O ATOM 661 CB TYR A 46 -4.665 -9.608 5.247 1.00 0.00 C ATOM 662 CG TYR A 46 -5.584 -8.569 4.645 1.00 0.00 C ATOM 663 CD1 TYR A 46 -6.190 -8.779 3.413 1.00 0.00 C ATOM 664 CD2 TYR A 46 -5.847 -7.378 5.311 1.00 0.00 C ATOM 665 CE1 TYR A 46 -7.031 -7.832 2.860 1.00 0.00 C ATOM 666 CE2 TYR A 46 -6.687 -6.426 4.766 1.00 0.00 C ATOM 667 CZ TYR A 46 -7.276 -6.658 3.540 1.00 0.00 C ATOM 668 OH TYR A 46 -8.113 -5.713 2.993 1.00 0.00 O ATOM 0 H TYR A 46 -3.879 -10.034 2.951 1.00 0.00 H new ATOM 0 HA TYR A 46 -2.901 -8.401 5.006 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -5.004 -10.599 4.945 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -4.741 -9.562 6.333 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -6.001 -9.698 2.878 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.387 -7.193 6.271 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -7.494 -8.011 1.901 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.881 -5.506 5.297 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.003 -6.102 2.859 1.00 0.00 H new ATOM 678 N PRO A 47 -1.956 -9.844 6.896 1.00 0.00 N ATOM 679 CA PRO A 47 -2.378 -8.521 7.367 1.00 0.00 C ATOM 680 C PRO A 47 -1.711 -7.390 6.591 1.00 0.00 C ATOM 681 O PRO A 47 -0.643 -7.570 6.007 1.00 0.00 O ATOM 682 CB PRO A 47 -1.927 -8.504 8.829 1.00 0.00 C ATOM 683 CG PRO A 47 -0.794 -9.470 8.888 1.00 0.00 C ATOM 684 CD PRO A 47 -1.110 -10.540 7.880 1.00 0.00 C ATOM 0 HA PRO A 47 -3.449 -8.364 7.235 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.613 -7.506 9.135 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.736 -8.802 9.496 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.150 -8.979 8.653 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.693 -9.893 9.888 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.205 -10.939 7.421 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -1.633 -11.380 8.337 1.00 0.00 H new ATOM 692 N VAL A 48 -2.349 -6.223 6.589 1.00 0.00 N ATOM 693 CA VAL A 48 -1.817 -5.062 5.887 1.00 0.00 C ATOM 694 C VAL A 48 -1.848 -3.822 6.772 1.00 0.00 C ATOM 695 O VAL A 48 -2.897 -3.447 7.295 1.00 0.00 O ATOM 696 CB VAL A 48 -2.605 -4.778 4.595 1.00 0.00 C ATOM 697 CG1 VAL A 48 -2.587 -5.992 3.679 1.00 0.00 C ATOM 698 CG2 VAL A 48 -4.033 -4.368 4.922 1.00 0.00 C ATOM 0 H VAL A 48 -3.235 -6.058 7.066 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.784 -5.294 5.630 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.124 -3.952 4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.149 -5.771 2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.557 -6.235 3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.042 -6.840 4.190 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.576 -4.171 3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.526 -5.172 5.468 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.021 -3.467 5.535 1.00 0.00 H new ATOM 708 N MET A 49 -0.692 -3.188 6.936 1.00 0.00 N ATOM 709 CA MET A 49 -0.587 -1.988 7.758 1.00 0.00 C ATOM 710 C MET A 49 -1.033 -0.755 6.978 1.00 0.00 C ATOM 711 O MET A 49 -0.912 -0.707 5.753 1.00 0.00 O ATOM 712 CB MET A 49 0.850 -1.803 8.248 1.00 0.00 C ATOM 713 CG MET A 49 1.096 -0.460 8.916 1.00 0.00 C ATOM 714 SD MET A 49 2.841 -0.165 9.260 1.00 0.00 S ATOM 715 CE MET A 49 3.345 -1.775 9.861 1.00 0.00 C ATOM 0 H MET A 49 0.186 -3.485 6.510 1.00 0.00 H new ATOM 0 HA MET A 49 -1.244 -2.109 8.619 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.090 -2.599 8.952 1.00 0.00 H new ATOM 0 HB3 MET A 49 1.530 -1.909 7.403 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.717 0.335 8.275 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.533 -0.414 9.848 1.00 0.00 H new ATOM 0 HE1 MET A 49 4.319 -1.695 10.344 1.00 0.00 H new ATOM 0 HE2 MET A 49 2.612 -2.141 10.580 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.411 -2.471 9.025 1.00 0.00 H new ATOM 725 N ILE A 50 -1.549 0.238 7.694 1.00 0.00 N ATOM 726 CA ILE A 50 -2.012 1.470 7.068 1.00 0.00 C ATOM 727 C ILE A 50 -1.470 2.695 7.798 1.00 0.00 C ATOM 728 O ILE A 50 -1.748 2.901 8.980 1.00 0.00 O ATOM 729 CB ILE A 50 -3.550 1.544 7.039 1.00 0.00 C ATOM 730 CG1 ILE A 50 -4.113 0.511 6.060 1.00 0.00 C ATOM 731 CG2 ILE A 50 -4.006 2.944 6.660 1.00 0.00 C ATOM 732 CD1 ILE A 50 -5.551 0.135 6.339 1.00 0.00 C ATOM 0 H ILE A 50 -1.657 0.213 8.708 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.637 1.463 6.045 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.929 1.317 8.036 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.039 0.905 5.046 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.497 -0.387 6.098 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.095 2.980 6.644 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.630 3.660 7.391 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.620 3.198 5.673 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.883 -0.601 5.607 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.629 -0.289 7.340 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.179 1.023 6.272 1.00 0.00 H new ATOM 744 N LYS A 51 -0.695 3.506 7.087 1.00 0.00 N ATOM 745 CA LYS A 51 -0.116 4.713 7.664 1.00 0.00 C ATOM 746 C LYS A 51 -0.614 5.958 6.937 1.00 0.00 C ATOM 747 O LYS A 51 -1.313 5.861 5.929 1.00 0.00 O ATOM 748 CB LYS A 51 1.412 4.650 7.601 1.00 0.00 C ATOM 749 CG LYS A 51 1.980 3.284 7.944 1.00 0.00 C ATOM 750 CD LYS A 51 2.114 2.409 6.709 1.00 0.00 C ATOM 751 CE LYS A 51 3.459 2.609 6.028 1.00 0.00 C ATOM 752 NZ LYS A 51 4.499 1.693 6.575 1.00 0.00 N ATOM 0 H LYS A 51 -0.453 3.349 6.109 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.429 4.773 8.706 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.737 4.928 6.599 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.826 5.389 8.287 1.00 0.00 H new ATOM 0 HG2 LYS A 51 2.956 3.403 8.414 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.333 2.792 8.671 1.00 0.00 H new ATOM 0 HD2 LYS A 51 1.999 1.362 6.989 1.00 0.00 H new ATOM 0 HD3 LYS A 51 1.312 2.641 6.008 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.353 2.439 4.957 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.781 3.642 6.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.246 2.251 7.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.066 1.053 7.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.912 1.134 5.801 1.00 0.00 H new ATOM 766 N ALA A 52 -0.250 7.126 7.456 1.00 0.00 N ATOM 767 CA ALA A 52 -0.658 8.389 6.854 1.00 0.00 C ATOM 768 C ALA A 52 0.437 8.945 5.948 1.00 0.00 C ATOM 769 O ALA A 52 1.475 9.405 6.424 1.00 0.00 O ATOM 770 CB ALA A 52 -1.014 9.399 7.935 1.00 0.00 C ATOM 0 H ALA A 52 0.326 7.224 8.292 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.540 8.202 6.242 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.317 10.337 7.471 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.835 9.012 8.539 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.146 9.572 8.571 1.00 0.00 H new ATOM 776 N SER A 53 0.198 8.897 4.642 1.00 0.00 N ATOM 777 CA SER A 53 1.166 9.392 3.670 1.00 0.00 C ATOM 778 C SER A 53 1.764 10.719 4.125 1.00 0.00 C ATOM 779 O SER A 53 2.980 10.906 4.101 1.00 0.00 O ATOM 780 CB SER A 53 0.505 9.561 2.300 1.00 0.00 C ATOM 781 OG SER A 53 1.448 9.401 1.255 1.00 0.00 O ATOM 0 H SER A 53 -0.657 8.521 4.232 1.00 0.00 H new ATOM 0 HA SER A 53 1.969 8.660 3.590 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.296 8.830 2.187 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.047 10.548 2.233 1.00 0.00 H new ATOM 0 HG SER A 53 1.000 9.512 0.390 1.00 0.00 H new ATOM 787 N ALA A 54 0.899 11.639 4.541 1.00 0.00 N ATOM 788 CA ALA A 54 1.341 12.949 5.004 1.00 0.00 C ATOM 789 C ALA A 54 2.628 12.839 5.814 1.00 0.00 C ATOM 790 O ALA A 54 3.559 13.621 5.626 1.00 0.00 O ATOM 791 CB ALA A 54 0.249 13.611 5.832 1.00 0.00 C ATOM 0 H ALA A 54 -0.111 11.501 4.567 1.00 0.00 H new ATOM 0 HA ALA A 54 1.545 13.567 4.130 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.592 14.588 6.172 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.647 13.732 5.223 1.00 0.00 H new ATOM 0 HB3 ALA A 54 0.019 12.987 6.696 1.00 0.00 H new ATOM 797 N GLY A 55 2.674 11.864 6.716 1.00 0.00 N ATOM 798 CA GLY A 55 3.852 11.671 7.541 1.00 0.00 C ATOM 799 C GLY A 55 4.233 10.210 7.676 1.00 0.00 C ATOM 800 O GLY A 55 5.342 9.815 7.318 1.00 0.00 O ATOM 0 H GLY A 55 1.916 11.204 6.890 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.688 12.223 7.110 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.671 12.089 8.531 1.00 0.00 H new ATOM 804 N GLY A 56 3.311 9.405 8.195 1.00 0.00 N ATOM 805 CA GLY A 56 3.576 7.989 8.369 1.00 0.00 C ATOM 806 C GLY A 56 4.821 7.728 9.193 1.00 0.00 C ATOM 807 O GLY A 56 5.025 8.349 10.236 1.00 0.00 O ATOM 0 H GLY A 56 2.385 9.708 8.498 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.719 7.519 8.852 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.687 7.521 7.391 1.00 0.00 H new ATOM 811 N GLY A 57 5.657 6.806 8.726 1.00 0.00 N ATOM 812 CA GLY A 57 6.877 6.480 9.441 1.00 0.00 C ATOM 813 C GLY A 57 6.753 5.202 10.247 1.00 0.00 C ATOM 814 O GLY A 57 7.740 4.502 10.469 1.00 0.00 O ATOM 0 H GLY A 57 5.511 6.279 7.865 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.696 6.379 8.729 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.135 7.303 10.108 1.00 0.00 H new ATOM 818 N GLY A 58 5.536 4.898 10.688 1.00 0.00 N ATOM 819 CA GLY A 58 5.309 3.698 11.471 1.00 0.00 C ATOM 820 C GLY A 58 5.009 4.002 12.925 1.00 0.00 C ATOM 821 O GLY A 58 5.590 3.398 13.827 1.00 0.00 O ATOM 0 H GLY A 58 4.703 5.462 10.517 1.00 0.00 H new ATOM 0 HA2 GLY A 58 4.478 3.139 11.041 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.189 3.057 11.411 1.00 0.00 H new ATOM 825 N LYS A 59 4.100 4.943 13.155 1.00 0.00 N ATOM 826 CA LYS A 59 3.723 5.328 14.510 1.00 0.00 C ATOM 827 C LYS A 59 2.385 6.061 14.515 1.00 0.00 C ATOM 828 O LYS A 59 2.135 6.923 13.674 1.00 0.00 O ATOM 829 CB LYS A 59 4.804 6.216 15.130 1.00 0.00 C ATOM 830 CG LYS A 59 4.413 6.803 16.475 1.00 0.00 C ATOM 831 CD LYS A 59 4.807 5.885 17.620 1.00 0.00 C ATOM 832 CE LYS A 59 4.506 6.517 18.970 1.00 0.00 C ATOM 833 NZ LYS A 59 4.995 5.676 20.098 1.00 0.00 N ATOM 0 H LYS A 59 3.610 5.454 12.420 1.00 0.00 H new ATOM 0 HA LYS A 59 3.623 4.419 15.104 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.717 5.633 15.250 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.033 7.029 14.441 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.894 7.773 16.603 1.00 0.00 H new ATOM 0 HG3 LYS A 59 3.337 6.975 16.499 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.270 4.940 17.532 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.870 5.655 17.554 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.972 7.501 19.022 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.431 6.668 19.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 4.771 6.141 21.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.532 4.746 20.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 6.025 5.553 20.018 1.00 0.00 H new ATOM 847 N GLY A 60 1.527 5.712 15.470 1.00 0.00 N ATOM 848 CA GLY A 60 0.226 6.347 15.567 1.00 0.00 C ATOM 849 C GLY A 60 -0.702 5.942 14.439 1.00 0.00 C ATOM 850 O GLY A 60 -1.678 6.634 14.151 1.00 0.00 O ATOM 0 H GLY A 60 1.710 5.001 16.178 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.232 6.087 16.521 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.352 7.430 15.559 1.00 0.00 H new ATOM 854 N MET A 61 -0.398 4.818 13.799 1.00 0.00 N ATOM 855 CA MET A 61 -1.213 4.322 12.696 1.00 0.00 C ATOM 856 C MET A 61 -1.982 3.071 13.108 1.00 0.00 C ATOM 857 O MET A 61 -1.817 2.568 14.220 1.00 0.00 O ATOM 858 CB MET A 61 -0.334 4.018 11.481 1.00 0.00 C ATOM 859 CG MET A 61 0.209 2.598 11.464 1.00 0.00 C ATOM 860 SD MET A 61 1.213 2.221 12.913 1.00 0.00 S ATOM 861 CE MET A 61 0.313 0.832 13.597 1.00 0.00 C ATOM 0 H MET A 61 0.407 4.233 14.025 1.00 0.00 H new ATOM 0 HA MET A 61 -1.932 5.097 12.431 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.912 4.188 10.573 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.501 4.718 11.463 1.00 0.00 H new ATOM 0 HG2 MET A 61 -0.623 1.896 11.411 1.00 0.00 H new ATOM 0 HG3 MET A 61 0.807 2.453 10.564 1.00 0.00 H new ATOM 0 HE1 MET A 61 0.040 1.048 14.630 1.00 0.00 H new ATOM 0 HE2 MET A 61 -0.590 0.660 13.012 1.00 0.00 H new ATOM 0 HE3 MET A 61 0.941 -0.059 13.567 1.00 0.00 H new ATOM 871 N ARG A 62 -2.821 2.573 12.206 1.00 0.00 N ATOM 872 CA ARG A 62 -3.616 1.381 12.477 1.00 0.00 C ATOM 873 C ARG A 62 -3.354 0.304 11.429 1.00 0.00 C ATOM 874 O ARG A 62 -2.922 0.599 10.314 1.00 0.00 O ATOM 875 CB ARG A 62 -5.105 1.731 12.504 1.00 0.00 C ATOM 876 CG ARG A 62 -5.959 0.703 13.227 1.00 0.00 C ATOM 877 CD ARG A 62 -7.437 0.893 12.923 1.00 0.00 C ATOM 878 NE ARG A 62 -8.287 0.368 13.988 1.00 0.00 N ATOM 879 CZ ARG A 62 -8.539 -0.925 14.157 1.00 0.00 C ATOM 880 NH1 ARG A 62 -8.008 -1.821 13.336 1.00 0.00 N ATOM 881 NH2 ARG A 62 -9.323 -1.325 15.151 1.00 0.00 N ATOM 0 H ARG A 62 -2.968 2.976 11.281 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.324 0.993 13.453 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -5.233 2.701 12.985 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.464 1.834 11.480 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.652 -0.300 12.931 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.794 0.783 14.302 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.645 1.954 12.783 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.681 0.394 11.985 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.710 1.031 14.638 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.404 -1.518 12.572 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.204 -2.813 13.469 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.732 -0.639 15.785 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -9.516 -2.318 15.280 1.00 0.00 H new ATOM 895 N ILE A 63 -3.619 -0.946 11.794 1.00 0.00 N ATOM 896 CA ILE A 63 -3.413 -2.067 10.886 1.00 0.00 C ATOM 897 C ILE A 63 -4.707 -2.845 10.670 1.00 0.00 C ATOM 898 O ILE A 63 -5.532 -2.960 11.576 1.00 0.00 O ATOM 899 CB ILE A 63 -2.331 -3.028 11.414 1.00 0.00 C ATOM 900 CG1 ILE A 63 -1.024 -2.273 11.661 1.00 0.00 C ATOM 901 CG2 ILE A 63 -2.112 -4.169 10.432 1.00 0.00 C ATOM 902 CD1 ILE A 63 0.029 -3.101 12.363 1.00 0.00 C ATOM 0 H ILE A 63 -3.977 -1.208 12.713 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.082 -1.647 9.936 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.670 -3.449 12.361 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.627 -1.929 10.706 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.234 -1.385 12.258 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.345 -4.840 10.819 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.043 -4.720 10.301 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.791 -3.766 9.472 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.928 -2.502 12.505 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.349 -3.424 13.333 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.268 -3.975 11.758 1.00 0.00 H new ATOM 914 N ALA A 64 -4.876 -3.379 9.465 1.00 0.00 N ATOM 915 CA ALA A 64 -6.067 -4.149 9.131 1.00 0.00 C ATOM 916 C ALA A 64 -5.705 -5.576 8.733 1.00 0.00 C ATOM 917 O ALA A 64 -4.637 -5.821 8.171 1.00 0.00 O ATOM 918 CB ALA A 64 -6.841 -3.467 8.012 1.00 0.00 C ATOM 0 H ALA A 64 -4.203 -3.292 8.704 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.699 -4.196 10.018 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.728 -4.054 7.773 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.141 -2.469 8.333 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.209 -3.389 7.128 1.00 0.00 H new ATOM 924 N TRP A 65 -6.599 -6.513 9.027 1.00 0.00 N ATOM 925 CA TRP A 65 -6.372 -7.916 8.699 1.00 0.00 C ATOM 926 C TRP A 65 -7.390 -8.408 7.677 1.00 0.00 C ATOM 927 O TRP A 65 -7.214 -9.466 7.072 1.00 0.00 O ATOM 928 CB TRP A 65 -6.444 -8.774 9.963 1.00 0.00 C ATOM 929 CG TRP A 65 -5.330 -8.504 10.930 1.00 0.00 C ATOM 930 CD1 TRP A 65 -5.148 -7.374 11.675 1.00 0.00 C ATOM 931 CD2 TRP A 65 -4.245 -9.379 11.253 1.00 0.00 C ATOM 932 NE1 TRP A 65 -4.014 -7.494 12.442 1.00 0.00 N ATOM 933 CE2 TRP A 65 -3.443 -8.716 12.202 1.00 0.00 C ATOM 934 CE3 TRP A 65 -3.874 -10.660 10.835 1.00 0.00 C ATOM 935 CZ2 TRP A 65 -2.293 -9.291 12.737 1.00 0.00 C ATOM 936 CZ3 TRP A 65 -2.732 -11.229 11.367 1.00 0.00 C ATOM 937 CH2 TRP A 65 -1.953 -10.545 12.310 1.00 0.00 C ATOM 0 H TRP A 65 -7.488 -6.327 9.492 1.00 0.00 H new ATOM 0 HA TRP A 65 -5.377 -8.005 8.264 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -7.398 -8.596 10.460 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -6.423 -9.827 9.681 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -5.799 -6.513 11.663 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -3.656 -6.788 13.085 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.469 -11.196 10.110 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -1.691 -8.765 13.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.435 -12.218 11.050 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -1.067 -11.017 12.707 1.00 0.00 H new ATOM 948 N ASP A 66 -8.454 -7.635 7.489 1.00 0.00 N ATOM 949 CA ASP A 66 -9.500 -7.993 6.538 1.00 0.00 C ATOM 950 C ASP A 66 -10.181 -6.745 5.984 1.00 0.00 C ATOM 951 O ASP A 66 -10.084 -5.663 6.565 1.00 0.00 O ATOM 952 CB ASP A 66 -10.535 -8.901 7.203 1.00 0.00 C ATOM 953 CG ASP A 66 -9.898 -9.944 8.100 1.00 0.00 C ATOM 954 OD1 ASP A 66 -9.587 -9.615 9.264 1.00 0.00 O ATOM 955 OD2 ASP A 66 -9.710 -11.089 7.639 1.00 0.00 O ATOM 0 H ASP A 66 -8.615 -6.757 7.982 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.036 -8.530 5.711 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -11.224 -8.293 7.790 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.125 -9.399 6.434 1.00 0.00 H new ATOM 960 N ASP A 67 -10.868 -6.902 4.858 1.00 0.00 N ATOM 961 CA ASP A 67 -11.565 -5.788 4.226 1.00 0.00 C ATOM 962 C ASP A 67 -12.255 -4.916 5.270 1.00 0.00 C ATOM 963 O ASP A 67 -11.981 -3.721 5.373 1.00 0.00 O ATOM 964 CB ASP A 67 -12.591 -6.307 3.218 1.00 0.00 C ATOM 965 CG ASP A 67 -13.429 -5.194 2.620 1.00 0.00 C ATOM 966 OD1 ASP A 67 -13.361 -4.058 3.133 1.00 0.00 O ATOM 967 OD2 ASP A 67 -14.153 -5.460 1.637 1.00 0.00 O ATOM 0 H ASP A 67 -10.957 -7.790 4.364 1.00 0.00 H new ATOM 0 HA ASP A 67 -10.827 -5.180 3.702 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -12.074 -6.838 2.419 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.246 -7.027 3.708 1.00 0.00 H new ATOM 972 N GLU A 68 -13.152 -5.523 6.041 1.00 0.00 N ATOM 973 CA GLU A 68 -13.883 -4.800 7.076 1.00 0.00 C ATOM 974 C GLU A 68 -12.945 -3.902 7.878 1.00 0.00 C ATOM 975 O GLU A 68 -13.264 -2.746 8.156 1.00 0.00 O ATOM 976 CB GLU A 68 -14.590 -5.782 8.012 1.00 0.00 C ATOM 977 CG GLU A 68 -13.646 -6.749 8.706 1.00 0.00 C ATOM 978 CD GLU A 68 -14.367 -7.694 9.647 1.00 0.00 C ATOM 979 OE1 GLU A 68 -15.296 -7.239 10.347 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.003 -8.888 9.685 1.00 0.00 O ATOM 0 H GLU A 68 -13.390 -6.512 5.969 1.00 0.00 H new ATOM 0 HA GLU A 68 -14.629 -4.173 6.588 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -15.140 -5.220 8.767 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.324 -6.351 7.441 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.110 -7.329 7.955 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.900 -6.184 9.265 1.00 0.00 H new ATOM 987 N GLU A 69 -11.787 -4.443 8.245 1.00 0.00 N ATOM 988 CA GLU A 69 -10.804 -3.691 9.016 1.00 0.00 C ATOM 989 C GLU A 69 -10.162 -2.601 8.162 1.00 0.00 C ATOM 990 O GLU A 69 -9.984 -1.468 8.612 1.00 0.00 O ATOM 991 CB GLU A 69 -9.725 -4.629 9.561 1.00 0.00 C ATOM 992 CG GLU A 69 -10.245 -5.628 10.580 1.00 0.00 C ATOM 993 CD GLU A 69 -9.158 -6.135 11.508 1.00 0.00 C ATOM 994 OE1 GLU A 69 -8.188 -5.387 11.750 1.00 0.00 O ATOM 995 OE2 GLU A 69 -9.278 -7.280 11.992 1.00 0.00 O ATOM 0 H GLU A 69 -11.507 -5.398 8.021 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.320 -3.218 9.852 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.274 -5.172 8.730 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.935 -4.033 10.019 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -11.033 -5.162 11.171 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.695 -6.473 10.058 1.00 0.00 H new ATOM 1002 N THR A 70 -9.815 -2.951 6.928 1.00 0.00 N ATOM 1003 CA THR A 70 -9.191 -2.005 6.011 1.00 0.00 C ATOM 1004 C THR A 70 -10.003 -0.718 5.913 1.00 0.00 C ATOM 1005 O THR A 70 -9.457 0.381 6.017 1.00 0.00 O ATOM 1006 CB THR A 70 -9.033 -2.607 4.603 1.00 0.00 C ATOM 1007 OG1 THR A 70 -8.334 -3.855 4.679 1.00 0.00 O ATOM 1008 CG2 THR A 70 -8.281 -1.654 3.687 1.00 0.00 C ATOM 0 H THR A 70 -9.956 -3.884 6.540 1.00 0.00 H new ATOM 0 HA THR A 70 -8.204 -1.779 6.414 1.00 0.00 H new ATOM 0 HB THR A 70 -10.028 -2.773 4.190 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.193 -4.207 3.775 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.182 -2.102 2.698 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.831 -0.716 3.607 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.290 -1.460 4.098 1.00 0.00 H new ATOM 1016 N ARG A 71 -11.309 -0.862 5.714 1.00 0.00 N ATOM 1017 CA ARG A 71 -12.196 0.290 5.601 1.00 0.00 C ATOM 1018 C ARG A 71 -12.282 1.041 6.926 1.00 0.00 C ATOM 1019 O ARG A 71 -12.092 2.257 6.976 1.00 0.00 O ATOM 1020 CB ARG A 71 -13.592 -0.156 5.163 1.00 0.00 C ATOM 1021 CG ARG A 71 -13.586 -1.091 3.965 1.00 0.00 C ATOM 1022 CD ARG A 71 -14.961 -1.690 3.718 1.00 0.00 C ATOM 1023 NE ARG A 71 -15.511 -2.312 4.920 1.00 0.00 N ATOM 1024 CZ ARG A 71 -16.775 -2.704 5.032 1.00 0.00 C ATOM 1025 NH1 ARG A 71 -17.616 -2.540 4.019 1.00 0.00 N ATOM 1026 NH2 ARG A 71 -17.201 -3.263 6.158 1.00 0.00 N ATOM 0 H ARG A 71 -11.776 -1.764 5.628 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.784 0.962 4.848 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -14.084 -0.654 5.999 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.187 0.725 4.922 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -13.261 -0.546 3.079 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.864 -1.891 4.130 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -15.639 -0.910 3.371 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -14.895 -2.433 2.923 1.00 0.00 H new ATOM 0 HE ARG A 71 -14.890 -2.453 5.717 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -17.292 -2.112 3.152 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -18.586 -2.842 4.108 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -16.557 -3.392 6.939 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -18.172 -3.564 6.243 1.00 0.00 H new ATOM 1040 N ASP A 72 -12.571 0.310 7.997 1.00 0.00 N ATOM 1041 CA ASP A 72 -12.682 0.907 9.323 1.00 0.00 C ATOM 1042 C ASP A 72 -11.410 1.666 9.686 1.00 0.00 C ATOM 1043 O ASP A 72 -11.459 2.696 10.356 1.00 0.00 O ATOM 1044 CB ASP A 72 -12.962 -0.173 10.370 1.00 0.00 C ATOM 1045 CG ASP A 72 -14.446 -0.411 10.573 1.00 0.00 C ATOM 1046 OD1 ASP A 72 -15.181 -0.464 9.565 1.00 0.00 O ATOM 1047 OD2 ASP A 72 -14.871 -0.544 11.740 1.00 0.00 O ATOM 0 H ASP A 72 -12.733 -0.697 7.973 1.00 0.00 H new ATOM 0 HA ASP A 72 -13.513 1.612 9.308 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -12.486 -1.104 10.063 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -12.511 0.118 11.318 1.00 0.00 H new ATOM 1052 N GLY A 73 -10.270 1.149 9.238 1.00 0.00 N ATOM 1053 CA GLY A 73 -9.000 1.790 9.526 1.00 0.00 C ATOM 1054 C GLY A 73 -8.712 2.950 8.595 1.00 0.00 C ATOM 1055 O GLY A 73 -8.172 3.974 9.015 1.00 0.00 O ATOM 0 H GLY A 73 -10.203 0.297 8.681 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -9.002 2.147 10.556 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.199 1.055 9.445 1.00 0.00 H new ATOM 1059 N PHE A 74 -9.071 2.791 7.325 1.00 0.00 N ATOM 1060 CA PHE A 74 -8.846 3.834 6.331 1.00 0.00 C ATOM 1061 C PHE A 74 -9.641 5.091 6.671 1.00 0.00 C ATOM 1062 O PHE A 74 -9.224 6.206 6.355 1.00 0.00 O ATOM 1063 CB PHE A 74 -9.234 3.332 4.938 1.00 0.00 C ATOM 1064 CG PHE A 74 -9.276 4.417 3.900 1.00 0.00 C ATOM 1065 CD1 PHE A 74 -8.146 4.734 3.165 1.00 0.00 C ATOM 1066 CD2 PHE A 74 -10.446 5.119 3.660 1.00 0.00 C ATOM 1067 CE1 PHE A 74 -8.182 5.732 2.210 1.00 0.00 C ATOM 1068 CE2 PHE A 74 -10.488 6.119 2.706 1.00 0.00 C ATOM 1069 CZ PHE A 74 -9.355 6.425 1.979 1.00 0.00 C ATOM 0 H PHE A 74 -9.519 1.950 6.960 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.785 4.084 6.337 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -8.523 2.568 4.625 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.212 2.854 4.992 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.226 4.195 3.340 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -11.336 4.882 4.225 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.293 5.970 1.644 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -11.406 6.660 2.530 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.385 7.204 1.232 1.00 0.00 H new ATOM 1079 N ARG A 75 -10.788 4.903 7.315 1.00 0.00 N ATOM 1080 CA ARG A 75 -11.642 6.020 7.697 1.00 0.00 C ATOM 1081 C ARG A 75 -11.025 6.809 8.848 1.00 0.00 C ATOM 1082 O ARG A 75 -10.880 8.029 8.771 1.00 0.00 O ATOM 1083 CB ARG A 75 -13.030 5.516 8.096 1.00 0.00 C ATOM 1084 CG ARG A 75 -13.817 4.919 6.941 1.00 0.00 C ATOM 1085 CD ARG A 75 -15.178 4.414 7.395 1.00 0.00 C ATOM 1086 NE ARG A 75 -16.159 4.434 6.313 1.00 0.00 N ATOM 1087 CZ ARG A 75 -16.569 5.546 5.714 1.00 0.00 C ATOM 1088 NH1 ARG A 75 -16.085 6.723 6.088 1.00 0.00 N ATOM 1089 NH2 ARG A 75 -17.464 5.483 4.737 1.00 0.00 N ATOM 0 H ARG A 75 -11.147 3.987 7.583 1.00 0.00 H new ATOM 0 HA ARG A 75 -11.737 6.682 6.836 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.923 4.765 8.878 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.598 6.342 8.523 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -13.948 5.670 6.162 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.252 4.098 6.500 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.079 3.397 7.775 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.536 5.030 8.220 1.00 0.00 H new ATOM 0 HE ARG A 75 -16.550 3.545 6.000 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -15.396 6.776 6.838 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -16.402 7.575 5.626 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -17.838 4.580 4.445 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -17.778 6.338 4.277 1.00 0.00 H new ATOM 1103 N LEU A 76 -10.665 6.103 9.914 1.00 0.00 N ATOM 1104 CA LEU A 76 -10.063 6.737 11.083 1.00 0.00 C ATOM 1105 C LEU A 76 -8.678 7.284 10.753 1.00 0.00 C ATOM 1106 O LEU A 76 -8.416 8.476 10.914 1.00 0.00 O ATOM 1107 CB LEU A 76 -9.967 5.737 12.237 1.00 0.00 C ATOM 1108 CG LEU A 76 -11.242 4.954 12.554 1.00 0.00 C ATOM 1109 CD1 LEU A 76 -10.922 3.735 13.404 1.00 0.00 C ATOM 1110 CD2 LEU A 76 -12.254 5.846 13.258 1.00 0.00 C ATOM 0 H LEU A 76 -10.779 5.093 9.994 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.700 7.569 11.383 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -9.174 5.025 12.009 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.663 6.276 13.134 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.679 4.613 11.615 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -11.841 3.190 13.620 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.233 3.085 12.864 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -10.462 4.054 14.339 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.155 5.273 13.476 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.826 6.217 14.189 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.507 6.688 12.614 1.00 0.00 H new ATOM 1122 N SER A 77 -7.795 6.406 10.289 1.00 0.00 N ATOM 1123 CA SER A 77 -6.436 6.801 9.938 1.00 0.00 C ATOM 1124 C SER A 77 -6.444 8.024 9.026 1.00 0.00 C ATOM 1125 O SER A 77 -5.474 8.779 8.973 1.00 0.00 O ATOM 1126 CB SER A 77 -5.708 5.644 9.251 1.00 0.00 C ATOM 1127 OG SER A 77 -5.307 4.663 10.192 1.00 0.00 O ATOM 0 H SER A 77 -7.996 5.416 10.147 1.00 0.00 H new ATOM 0 HA SER A 77 -5.910 7.058 10.857 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.361 5.191 8.505 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.834 6.023 8.722 1.00 0.00 H new ATOM 0 HG SER A 77 -4.846 3.934 9.728 1.00 0.00 H new ATOM 1133 N SER A 78 -7.548 8.213 8.309 1.00 0.00 N ATOM 1134 CA SER A 78 -7.683 9.342 7.396 1.00 0.00 C ATOM 1135 C SER A 78 -7.929 10.636 8.166 1.00 0.00 C ATOM 1136 O SER A 78 -7.183 11.605 8.025 1.00 0.00 O ATOM 1137 CB SER A 78 -8.827 9.095 6.412 1.00 0.00 C ATOM 1138 OG SER A 78 -9.167 10.282 5.717 1.00 0.00 O ATOM 0 H SER A 78 -8.362 7.599 8.343 1.00 0.00 H new ATOM 0 HA SER A 78 -6.751 9.442 6.840 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.537 8.323 5.699 1.00 0.00 H new ATOM 0 HB3 SER A 78 -9.699 8.722 6.949 1.00 0.00 H new ATOM 0 HG SER A 78 -9.900 10.097 5.093 1.00 0.00 H new ATOM 1144 N GLN A 79 -8.980 10.643 8.979 1.00 0.00 N ATOM 1145 CA GLN A 79 -9.326 11.818 9.770 1.00 0.00 C ATOM 1146 C GLN A 79 -8.118 12.319 10.555 1.00 0.00 C ATOM 1147 O GLN A 79 -8.020 13.505 10.869 1.00 0.00 O ATOM 1148 CB GLN A 79 -10.473 11.494 10.728 1.00 0.00 C ATOM 1149 CG GLN A 79 -11.667 10.841 10.049 1.00 0.00 C ATOM 1150 CD GLN A 79 -12.970 11.110 10.775 1.00 0.00 C ATOM 1151 OE1 GLN A 79 -13.149 12.165 11.384 1.00 0.00 O ATOM 1152 NE2 GLN A 79 -13.890 10.155 10.713 1.00 0.00 N ATOM 0 H GLN A 79 -9.607 9.849 9.107 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.645 12.605 9.086 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.105 10.832 11.512 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.800 12.413 11.214 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -11.743 11.208 9.025 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -11.503 9.765 9.991 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -13.700 9.296 10.197 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -14.787 10.280 11.181 1.00 0.00 H new ATOM 1161 N GLU A 80 -7.203 11.408 10.870 1.00 0.00 N ATOM 1162 CA GLU A 80 -6.003 11.759 11.620 1.00 0.00 C ATOM 1163 C GLU A 80 -5.074 12.634 10.782 1.00 0.00 C ATOM 1164 O GLU A 80 -4.854 13.803 11.096 1.00 0.00 O ATOM 1165 CB GLU A 80 -5.266 10.495 12.067 1.00 0.00 C ATOM 1166 CG GLU A 80 -5.894 9.819 13.273 1.00 0.00 C ATOM 1167 CD GLU A 80 -5.925 10.716 14.495 1.00 0.00 C ATOM 1168 OE1 GLU A 80 -4.875 11.307 14.824 1.00 0.00 O ATOM 1169 OE2 GLU A 80 -6.999 10.826 15.123 1.00 0.00 O ATOM 0 H GLU A 80 -7.270 10.422 10.618 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.308 12.323 12.501 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.239 9.788 11.238 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.233 10.751 12.302 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.911 9.514 13.025 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.337 8.912 13.507 1.00 0.00 H new ATOM 1176 N ALA A 81 -4.531 12.057 9.715 1.00 0.00 N ATOM 1177 CA ALA A 81 -3.628 12.783 8.831 1.00 0.00 C ATOM 1178 C ALA A 81 -4.253 14.092 8.361 1.00 0.00 C ATOM 1179 O ALA A 81 -3.547 15.037 8.010 1.00 0.00 O ATOM 1180 CB ALA A 81 -3.249 11.918 7.637 1.00 0.00 C ATOM 0 H ALA A 81 -4.701 11.089 9.442 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.725 13.023 9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.574 12.473 6.985 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.753 11.013 7.987 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.148 11.648 7.083 1.00 0.00 H new ATOM 1186 N ALA A 82 -5.581 14.139 8.355 1.00 0.00 N ATOM 1187 CA ALA A 82 -6.301 15.333 7.929 1.00 0.00 C ATOM 1188 C ALA A 82 -5.983 16.518 8.834 1.00 0.00 C ATOM 1189 O ALA A 82 -5.620 17.594 8.359 1.00 0.00 O ATOM 1190 CB ALA A 82 -7.799 15.067 7.912 1.00 0.00 C ATOM 0 H ALA A 82 -6.180 13.364 8.640 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.975 15.583 6.919 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.325 15.967 7.592 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.016 14.254 7.219 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.131 14.789 8.913 1.00 0.00 H new ATOM 1196 N SER A 83 -6.121 16.314 10.140 1.00 0.00 N ATOM 1197 CA SER A 83 -5.853 17.368 11.111 1.00 0.00 C ATOM 1198 C SER A 83 -4.364 17.437 11.439 1.00 0.00 C ATOM 1199 O SER A 83 -3.785 18.521 11.521 1.00 0.00 O ATOM 1200 CB SER A 83 -6.658 17.129 12.390 1.00 0.00 C ATOM 1201 OG SER A 83 -6.533 18.223 13.283 1.00 0.00 O ATOM 0 H SER A 83 -6.417 15.428 10.550 1.00 0.00 H new ATOM 0 HA SER A 83 -6.156 18.319 10.672 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.708 16.978 12.140 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.312 16.217 12.876 1.00 0.00 H new ATOM 0 HG SER A 83 -7.058 18.047 14.092 1.00 0.00 H new ATOM 1207 N SER A 84 -3.751 16.273 11.626 1.00 0.00 N ATOM 1208 CA SER A 84 -2.331 16.200 11.950 1.00 0.00 C ATOM 1209 C SER A 84 -1.519 17.115 11.037 1.00 0.00 C ATOM 1210 O SER A 84 -1.015 18.152 11.468 1.00 0.00 O ATOM 1211 CB SER A 84 -1.830 14.760 11.823 1.00 0.00 C ATOM 1212 OG SER A 84 -2.386 13.937 12.834 1.00 0.00 O ATOM 0 H SER A 84 -4.215 15.367 11.559 1.00 0.00 H new ATOM 0 HA SER A 84 -2.201 16.533 12.980 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.093 14.365 10.842 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.742 14.742 11.892 1.00 0.00 H new ATOM 0 HG SER A 84 -3.294 13.673 12.578 1.00 0.00 H new ATOM 1218 N PHE A 85 -1.396 16.722 9.774 1.00 0.00 N ATOM 1219 CA PHE A 85 -0.644 17.504 8.799 1.00 0.00 C ATOM 1220 C PHE A 85 -1.566 18.447 8.031 1.00 0.00 C ATOM 1221 O PHE A 85 -1.323 19.651 7.963 1.00 0.00 O ATOM 1222 CB PHE A 85 0.084 16.578 7.823 1.00 0.00 C ATOM 1223 CG PHE A 85 1.105 15.695 8.483 1.00 0.00 C ATOM 1224 CD1 PHE A 85 0.750 14.445 8.966 1.00 0.00 C ATOM 1225 CD2 PHE A 85 2.418 16.114 8.620 1.00 0.00 C ATOM 1226 CE1 PHE A 85 1.687 13.631 9.574 1.00 0.00 C ATOM 1227 CE2 PHE A 85 3.359 15.304 9.227 1.00 0.00 C ATOM 1228 CZ PHE A 85 2.993 14.061 9.703 1.00 0.00 C ATOM 0 H PHE A 85 -1.807 15.866 9.401 1.00 0.00 H new ATOM 0 HA PHE A 85 0.091 18.102 9.339 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.649 15.954 7.312 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.576 17.182 7.060 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.270 14.104 8.866 1.00 0.00 H new ATOM 0 HD2 PHE A 85 2.710 17.085 8.248 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.398 12.660 9.948 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.379 15.643 9.329 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.727 13.425 10.176 1.00 0.00 H new ATOM 1238 N GLY A 86 -2.626 17.889 7.454 1.00 0.00 N ATOM 1239 CA GLY A 86 -3.568 18.693 6.698 1.00 0.00 C ATOM 1240 C GLY A 86 -4.263 17.900 5.608 1.00 0.00 C ATOM 1241 O GLY A 86 -5.369 18.244 5.191 1.00 0.00 O ATOM 0 H GLY A 86 -2.849 16.895 7.497 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.315 19.105 7.376 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.043 19.537 6.251 1.00 0.00 H new ATOM 1245 N ASP A 87 -3.614 16.838 5.146 1.00 0.00 N ATOM 1246 CA ASP A 87 -4.176 15.995 4.097 1.00 0.00 C ATOM 1247 C ASP A 87 -4.643 14.659 4.667 1.00 0.00 C ATOM 1248 O ASP A 87 -4.351 14.326 5.815 1.00 0.00 O ATOM 1249 CB ASP A 87 -3.143 15.760 2.994 1.00 0.00 C ATOM 1250 CG ASP A 87 -3.022 16.942 2.052 1.00 0.00 C ATOM 1251 OD1 ASP A 87 -4.018 17.261 1.371 1.00 0.00 O ATOM 1252 OD2 ASP A 87 -1.931 17.547 1.997 1.00 0.00 O ATOM 0 H ASP A 87 -2.698 16.540 5.481 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.038 16.510 3.673 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.172 15.559 3.447 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.419 14.872 2.425 1.00 0.00 H new ATOM 1257 N ASP A 88 -5.372 13.899 3.856 1.00 0.00 N ATOM 1258 CA ASP A 88 -5.880 12.599 4.279 1.00 0.00 C ATOM 1259 C ASP A 88 -5.162 11.470 3.546 1.00 0.00 C ATOM 1260 O ASP A 88 -5.562 10.309 3.631 1.00 0.00 O ATOM 1261 CB ASP A 88 -7.386 12.510 4.027 1.00 0.00 C ATOM 1262 CG ASP A 88 -7.722 12.426 2.551 1.00 0.00 C ATOM 1263 OD1 ASP A 88 -6.968 12.998 1.737 1.00 0.00 O ATOM 1264 OD2 ASP A 88 -8.739 11.786 2.211 1.00 0.00 O ATOM 0 H ASP A 88 -5.624 14.161 2.903 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.691 12.493 5.347 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -7.786 11.634 4.538 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.876 13.383 4.459 1.00 0.00 H new ATOM 1269 N ARG A 89 -4.100 11.819 2.828 1.00 0.00 N ATOM 1270 CA ARG A 89 -3.327 10.836 2.078 1.00 0.00 C ATOM 1271 C ARG A 89 -2.847 9.711 2.991 1.00 0.00 C ATOM 1272 O ARG A 89 -2.099 9.945 3.941 1.00 0.00 O ATOM 1273 CB ARG A 89 -2.129 11.505 1.402 1.00 0.00 C ATOM 1274 CG ARG A 89 -2.510 12.663 0.495 1.00 0.00 C ATOM 1275 CD ARG A 89 -2.764 12.195 -0.930 1.00 0.00 C ATOM 1276 NE ARG A 89 -3.011 13.312 -1.837 1.00 0.00 N ATOM 1277 CZ ARG A 89 -4.139 14.012 -1.851 1.00 0.00 C ATOM 1278 NH1 ARG A 89 -5.119 13.713 -1.009 1.00 0.00 N ATOM 1279 NH2 ARG A 89 -4.289 15.015 -2.707 1.00 0.00 N ATOM 0 H ARG A 89 -3.755 12.776 2.750 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.975 10.409 1.313 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.444 11.866 2.170 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.589 10.760 0.818 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.404 13.152 0.883 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.713 13.407 0.498 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.905 11.625 -1.283 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -3.621 11.521 -0.943 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.276 13.569 -2.496 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -5.007 12.944 -0.349 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.985 14.252 -1.022 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -3.537 15.249 -3.355 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.156 15.552 -2.717 1.00 0.00 H new ATOM 1293 N LEU A 90 -3.283 8.492 2.698 1.00 0.00 N ATOM 1294 CA LEU A 90 -2.899 7.330 3.492 1.00 0.00 C ATOM 1295 C LEU A 90 -1.946 6.429 2.713 1.00 0.00 C ATOM 1296 O LEU A 90 -1.646 6.685 1.546 1.00 0.00 O ATOM 1297 CB LEU A 90 -4.140 6.539 3.909 1.00 0.00 C ATOM 1298 CG LEU A 90 -5.060 7.219 4.924 1.00 0.00 C ATOM 1299 CD1 LEU A 90 -6.054 6.221 5.496 1.00 0.00 C ATOM 1300 CD2 LEU A 90 -4.244 7.860 6.037 1.00 0.00 C ATOM 0 H LEU A 90 -3.903 8.282 1.916 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.385 7.685 4.385 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.721 6.316 3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.815 5.585 4.325 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.618 8.003 4.412 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.700 6.723 6.216 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.661 5.809 4.690 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.515 5.414 5.993 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.915 8.339 6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.659 7.094 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.573 8.606 5.612 1.00 0.00 H new ATOM 1312 N LEU A 91 -1.474 5.372 3.365 1.00 0.00 N ATOM 1313 CA LEU A 91 -0.556 4.430 2.733 1.00 0.00 C ATOM 1314 C LEU A 91 -0.904 2.994 3.112 1.00 0.00 C ATOM 1315 O LEU A 91 -1.784 2.755 3.939 1.00 0.00 O ATOM 1316 CB LEU A 91 0.885 4.742 3.139 1.00 0.00 C ATOM 1317 CG LEU A 91 1.603 5.803 2.304 1.00 0.00 C ATOM 1318 CD1 LEU A 91 2.985 6.084 2.872 1.00 0.00 C ATOM 1319 CD2 LEU A 91 1.700 5.363 0.851 1.00 0.00 C ATOM 0 H LEU A 91 -1.712 5.146 4.331 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.653 4.535 1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.886 5.066 4.180 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.463 3.819 3.092 1.00 0.00 H new ATOM 0 HG LEU A 91 1.022 6.724 2.345 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.481 6.841 2.265 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.891 6.444 3.896 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.575 5.168 2.863 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.214 6.130 0.272 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.258 4.428 0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.698 5.215 0.448 1.00 0.00 H new ATOM 1331 N ILE A 92 -0.205 2.042 2.503 1.00 0.00 N ATOM 1332 CA ILE A 92 -0.438 0.629 2.779 1.00 0.00 C ATOM 1333 C ILE A 92 0.808 -0.200 2.487 1.00 0.00 C ATOM 1334 O ILE A 92 1.298 -0.224 1.359 1.00 0.00 O ATOM 1335 CB ILE A 92 -1.613 0.080 1.948 1.00 0.00 C ATOM 1336 CG1 ILE A 92 -2.864 0.934 2.167 1.00 0.00 C ATOM 1337 CG2 ILE A 92 -1.886 -1.372 2.313 1.00 0.00 C ATOM 1338 CD1 ILE A 92 -4.060 0.469 1.366 1.00 0.00 C ATOM 0 H ILE A 92 0.527 2.223 1.816 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.684 0.550 3.838 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.345 0.125 0.892 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.120 0.924 3.226 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.640 1.967 1.903 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.719 -1.746 1.718 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -0.998 -1.971 2.112 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.137 -1.440 3.372 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -4.910 1.120 1.570 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -3.822 0.506 0.303 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.310 -0.554 1.647 1.00 0.00 H new ATOM 1350 N GLU A 93 1.313 -0.880 3.511 1.00 0.00 N ATOM 1351 CA GLU A 93 2.501 -1.712 3.364 1.00 0.00 C ATOM 1352 C GLU A 93 2.287 -3.084 3.997 1.00 0.00 C ATOM 1353 O GLU A 93 1.535 -3.225 4.961 1.00 0.00 O ATOM 1354 CB GLU A 93 3.712 -1.028 4.000 1.00 0.00 C ATOM 1355 CG GLU A 93 4.294 0.092 3.154 1.00 0.00 C ATOM 1356 CD GLU A 93 5.747 0.376 3.481 1.00 0.00 C ATOM 1357 OE1 GLU A 93 6.000 1.198 4.387 1.00 0.00 O ATOM 1358 OE2 GLU A 93 6.630 -0.222 2.832 1.00 0.00 O ATOM 0 H GLU A 93 0.918 -0.871 4.451 1.00 0.00 H new ATOM 0 HA GLU A 93 2.688 -1.848 2.299 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.423 -0.626 4.971 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.486 -1.774 4.182 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.208 -0.172 2.100 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.708 0.998 3.305 1.00 0.00 H new ATOM 1365 N LYS A 94 2.953 -4.094 3.447 1.00 0.00 N ATOM 1366 CA LYS A 94 2.838 -5.455 3.956 1.00 0.00 C ATOM 1367 C LYS A 94 3.197 -5.513 5.438 1.00 0.00 C ATOM 1368 O LYS A 94 4.220 -4.974 5.861 1.00 0.00 O ATOM 1369 CB LYS A 94 3.747 -6.397 3.163 1.00 0.00 C ATOM 1370 CG LYS A 94 3.842 -7.792 3.755 1.00 0.00 C ATOM 1371 CD LYS A 94 2.593 -8.608 3.465 1.00 0.00 C ATOM 1372 CE LYS A 94 2.903 -10.095 3.389 1.00 0.00 C ATOM 1373 NZ LYS A 94 1.692 -10.927 3.628 1.00 0.00 N ATOM 0 H LYS A 94 3.579 -3.995 2.648 1.00 0.00 H new ATOM 0 HA LYS A 94 1.803 -5.775 3.838 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.377 -6.470 2.140 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.746 -5.965 3.110 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.714 -8.303 3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.989 -7.721 4.833 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.852 -8.429 4.244 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.152 -8.279 2.524 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.317 -10.330 2.409 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.666 -10.345 4.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.737 -11.339 4.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.842 -10.334 3.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.650 -11.690 2.923 1.00 0.00 H new ATOM 1387 N PHE A 95 2.351 -6.173 6.221 1.00 0.00 N ATOM 1388 CA PHE A 95 2.579 -6.303 7.656 1.00 0.00 C ATOM 1389 C PHE A 95 3.033 -7.717 8.009 1.00 0.00 C ATOM 1390 O PHE A 95 2.282 -8.679 7.846 1.00 0.00 O ATOM 1391 CB PHE A 95 1.306 -5.955 8.430 1.00 0.00 C ATOM 1392 CG PHE A 95 1.490 -5.964 9.921 1.00 0.00 C ATOM 1393 CD1 PHE A 95 2.215 -4.964 10.548 1.00 0.00 C ATOM 1394 CD2 PHE A 95 0.938 -6.972 10.694 1.00 0.00 C ATOM 1395 CE1 PHE A 95 2.386 -4.969 11.920 1.00 0.00 C ATOM 1396 CE2 PHE A 95 1.105 -6.982 12.066 1.00 0.00 C ATOM 1397 CZ PHE A 95 1.831 -5.980 12.680 1.00 0.00 C ATOM 0 H PHE A 95 1.501 -6.627 5.886 1.00 0.00 H new ATOM 0 HA PHE A 95 3.369 -5.606 7.938 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.960 -4.969 8.120 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.523 -6.665 8.164 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.652 -4.171 9.958 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.371 -7.759 10.219 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.953 -4.183 12.397 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.668 -7.773 12.658 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.964 -5.987 13.752 1.00 0.00 H new ATOM 1407 N ILE A 96 4.265 -7.833 8.491 1.00 0.00 N ATOM 1408 CA ILE A 96 4.818 -9.128 8.868 1.00 0.00 C ATOM 1409 C ILE A 96 5.349 -9.104 10.297 1.00 0.00 C ATOM 1410 O ILE A 96 6.323 -8.413 10.597 1.00 0.00 O ATOM 1411 CB ILE A 96 5.953 -9.553 7.917 1.00 0.00 C ATOM 1412 CG1 ILE A 96 5.567 -9.265 6.465 1.00 0.00 C ATOM 1413 CG2 ILE A 96 6.275 -11.028 8.103 1.00 0.00 C ATOM 1414 CD1 ILE A 96 6.620 -9.686 5.464 1.00 0.00 C ATOM 0 H ILE A 96 4.899 -7.046 8.630 1.00 0.00 H new ATOM 0 HA ILE A 96 4.006 -9.851 8.797 1.00 0.00 H new ATOM 0 HB ILE A 96 6.844 -8.973 8.157 1.00 0.00 H new ATOM 0 HG12 ILE A 96 4.634 -9.780 6.237 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.377 -8.197 6.353 1.00 0.00 H new ATOM 0 HG21 ILE A 96 7.079 -11.313 7.424 1.00 0.00 H new ATOM 0 HG22 ILE A 96 6.589 -11.205 9.132 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.388 -11.624 7.886 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.278 -9.451 4.456 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.548 -9.152 5.666 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.793 -10.759 5.548 1.00 0.00 H new ATOM 1426 N ASP A 97 4.704 -9.865 11.174 1.00 0.00 N ATOM 1427 CA ASP A 97 5.113 -9.935 12.572 1.00 0.00 C ATOM 1428 C ASP A 97 6.155 -11.029 12.780 1.00 0.00 C ATOM 1429 O ASP A 97 7.212 -10.790 13.364 1.00 0.00 O ATOM 1430 CB ASP A 97 3.900 -10.191 13.468 1.00 0.00 C ATOM 1431 CG ASP A 97 4.294 -10.670 14.852 1.00 0.00 C ATOM 1432 OD1 ASP A 97 4.664 -9.822 15.691 1.00 0.00 O ATOM 1433 OD2 ASP A 97 4.231 -11.893 15.097 1.00 0.00 O ATOM 0 H ASP A 97 3.896 -10.442 10.942 1.00 0.00 H new ATOM 0 HA ASP A 97 5.559 -8.978 12.842 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.317 -9.274 13.556 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.256 -10.935 12.999 1.00 0.00 H new ATOM 1438 N ASN A 98 5.850 -12.229 12.299 1.00 0.00 N ATOM 1439 CA ASN A 98 6.760 -13.361 12.433 1.00 0.00 C ATOM 1440 C ASN A 98 7.647 -13.496 11.199 1.00 0.00 C ATOM 1441 O ASN A 98 7.319 -13.017 10.113 1.00 0.00 O ATOM 1442 CB ASN A 98 5.971 -14.653 12.651 1.00 0.00 C ATOM 1443 CG ASN A 98 5.590 -14.860 14.105 1.00 0.00 C ATOM 1444 OD1 ASN A 98 6.449 -15.085 14.957 1.00 0.00 O ATOM 1445 ND2 ASN A 98 4.296 -14.784 14.394 1.00 0.00 N ATOM 0 H ASN A 98 4.979 -12.443 11.813 1.00 0.00 H new ATOM 0 HA ASN A 98 7.398 -13.182 13.299 1.00 0.00 H new ATOM 0 HB2 ASN A 98 5.068 -14.631 12.041 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.566 -15.500 12.310 1.00 0.00 H new ATOM 0 HD21 ASN A 98 3.980 -14.914 15.355 1.00 0.00 H new ATOM 0 HD22 ASN A 98 3.619 -14.595 13.655 1.00 0.00 H new ATOM 1452 N PRO A 99 8.798 -14.163 11.367 1.00 0.00 N ATOM 1453 CA PRO A 99 9.755 -14.378 10.278 1.00 0.00 C ATOM 1454 C PRO A 99 9.230 -15.351 9.228 1.00 0.00 C ATOM 1455 O PRO A 99 8.345 -16.160 9.506 1.00 0.00 O ATOM 1456 CB PRO A 99 10.976 -14.966 10.990 1.00 0.00 C ATOM 1457 CG PRO A 99 10.427 -15.603 12.219 1.00 0.00 C ATOM 1458 CD PRO A 99 9.253 -14.761 12.634 1.00 0.00 C ATOM 0 HA PRO A 99 9.965 -13.458 9.732 1.00 0.00 H new ATOM 0 HB2 PRO A 99 11.488 -15.695 10.361 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.702 -14.191 11.236 1.00 0.00 H new ATOM 0 HG2 PRO A 99 10.120 -16.630 12.022 1.00 0.00 H new ATOM 0 HG3 PRO A 99 11.178 -15.640 13.008 1.00 0.00 H new ATOM 0 HD2 PRO A 99 8.471 -15.362 13.098 1.00 0.00 H new ATOM 0 HD3 PRO A 99 9.541 -13.999 13.358 1.00 0.00 H new ATOM 1466 N ARG A 100 9.783 -15.268 8.022 1.00 0.00 N ATOM 1467 CA ARG A 100 9.369 -16.142 6.931 1.00 0.00 C ATOM 1468 C ARG A 100 10.531 -16.410 5.979 1.00 0.00 C ATOM 1469 O ARG A 100 11.608 -15.828 6.117 1.00 0.00 O ATOM 1470 CB ARG A 100 8.201 -15.518 6.164 1.00 0.00 C ATOM 1471 CG ARG A 100 6.927 -15.402 6.985 1.00 0.00 C ATOM 1472 CD ARG A 100 5.836 -14.671 6.218 1.00 0.00 C ATOM 1473 NE ARG A 100 5.063 -15.575 5.370 1.00 0.00 N ATOM 1474 CZ ARG A 100 5.433 -15.928 4.144 1.00 0.00 C ATOM 1475 NH1 ARG A 100 6.558 -15.456 3.625 1.00 0.00 N ATOM 1476 NH2 ARG A 100 4.676 -16.755 3.434 1.00 0.00 N ATOM 0 H ARG A 100 10.518 -14.605 7.776 1.00 0.00 H new ATOM 0 HA ARG A 100 9.047 -17.091 7.361 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.492 -14.526 5.819 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.998 -16.118 5.277 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.577 -16.397 7.258 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.138 -14.872 7.914 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.168 -14.175 6.922 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.286 -13.892 5.602 1.00 0.00 H new ATOM 0 HE ARG A 100 4.192 -15.956 5.739 1.00 0.00 H new ATOM 0 HH11 ARG A 100 7.142 -14.820 4.167 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.839 -15.729 2.683 1.00 0.00 H new ATOM 0 HH21 ARG A 100 3.810 -17.120 3.830 1.00 0.00 H new ATOM 0 HH22 ARG A 100 4.961 -17.026 2.493 1.00 0.00 H new ATOM 1490 N HIS A 101 10.306 -17.295 5.013 1.00 0.00 N ATOM 1491 CA HIS A 101 11.335 -17.641 4.038 1.00 0.00 C ATOM 1492 C HIS A 101 10.761 -17.650 2.624 1.00 0.00 C ATOM 1493 O HIS A 101 9.547 -17.573 2.436 1.00 0.00 O ATOM 1494 CB HIS A 101 11.939 -19.007 4.365 1.00 0.00 C ATOM 1495 CG HIS A 101 12.174 -19.223 5.828 1.00 0.00 C ATOM 1496 ND1 HIS A 101 11.441 -20.112 6.585 1.00 0.00 N ATOM 1497 CD2 HIS A 101 13.069 -18.661 6.673 1.00 0.00 C ATOM 1498 CE1 HIS A 101 11.873 -20.086 7.833 1.00 0.00 C ATOM 1499 NE2 HIS A 101 12.862 -19.214 7.913 1.00 0.00 N ATOM 0 H HIS A 101 9.421 -17.785 4.884 1.00 0.00 H new ATOM 0 HA HIS A 101 12.119 -16.885 4.089 1.00 0.00 H new ATOM 0 HB2 HIS A 101 11.275 -19.787 3.993 1.00 0.00 H new ATOM 0 HB3 HIS A 101 12.885 -19.113 3.834 1.00 0.00 H new ATOM 0 HD2 HIS A 101 13.809 -17.916 6.419 1.00 0.00 H new ATOM 0 HE1 HIS A 101 11.484 -20.677 8.649 1.00 0.00 H new ATOM 0 HE2 HIS A 101 13.387 -18.988 8.758 1.00 0.00 H new ATOM 1508 N ILE A 102 11.643 -17.744 1.634 1.00 0.00 N ATOM 1509 CA ILE A 102 11.224 -17.763 0.238 1.00 0.00 C ATOM 1510 C ILE A 102 11.479 -19.127 -0.394 1.00 0.00 C ATOM 1511 O ILE A 102 12.244 -19.934 0.135 1.00 0.00 O ATOM 1512 CB ILE A 102 11.953 -16.684 -0.583 1.00 0.00 C ATOM 1513 CG1 ILE A 102 13.384 -16.504 -0.073 1.00 0.00 C ATOM 1514 CG2 ILE A 102 11.194 -15.367 -0.522 1.00 0.00 C ATOM 1515 CD1 ILE A 102 14.166 -15.449 -0.824 1.00 0.00 C ATOM 0 H ILE A 102 12.651 -17.808 1.773 1.00 0.00 H new ATOM 0 HA ILE A 102 10.154 -17.555 0.227 1.00 0.00 H new ATOM 0 HB ILE A 102 11.996 -17.008 -1.623 1.00 0.00 H new ATOM 0 HG12 ILE A 102 13.354 -16.238 0.984 1.00 0.00 H new ATOM 0 HG13 ILE A 102 13.910 -17.456 -0.147 1.00 0.00 H new ATOM 0 HG21 ILE A 102 11.723 -14.615 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.192 -15.505 -0.929 1.00 0.00 H new ATOM 0 HG23 ILE A 102 11.122 -15.036 0.514 1.00 0.00 H new ATOM 0 HD11 ILE A 102 15.171 -15.376 -0.408 1.00 0.00 H new ATOM 0 HD12 ILE A 102 14.228 -15.723 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 102 13.663 -14.487 -0.729 1.00 0.00 H new ATOM 1527 N SER A 103 10.835 -19.377 -1.529 1.00 0.00 N ATOM 1528 CA SER A 103 10.991 -20.644 -2.233 1.00 0.00 C ATOM 1529 C SER A 103 11.901 -20.483 -3.448 1.00 0.00 C ATOM 1530 O SER A 103 12.899 -21.189 -3.588 1.00 0.00 O ATOM 1531 CB SER A 103 9.627 -21.180 -2.671 1.00 0.00 C ATOM 1532 OG SER A 103 9.770 -22.265 -3.572 1.00 0.00 O ATOM 0 H SER A 103 10.200 -18.719 -1.981 1.00 0.00 H new ATOM 0 HA SER A 103 11.451 -21.357 -1.548 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.061 -21.502 -1.797 1.00 0.00 H new ATOM 0 HB3 SER A 103 9.055 -20.383 -3.145 1.00 0.00 H new ATOM 0 HG SER A 103 8.884 -22.590 -3.836 1.00 0.00 H new ATOM 1538 N GLY A 104 11.547 -19.547 -4.324 1.00 0.00 N ATOM 1539 CA GLY A 104 12.341 -19.309 -5.515 1.00 0.00 C ATOM 1540 C GLY A 104 11.511 -18.781 -6.668 1.00 0.00 C ATOM 1541 O GLY A 104 10.285 -18.899 -6.685 1.00 0.00 O ATOM 0 H GLY A 104 10.725 -18.950 -4.230 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.132 -18.596 -5.284 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.827 -20.237 -5.816 1.00 0.00 H new ATOM 1545 N PRO A 105 12.184 -18.180 -7.661 1.00 0.00 N ATOM 1546 CA PRO A 105 11.521 -17.619 -8.841 1.00 0.00 C ATOM 1547 C PRO A 105 10.946 -18.698 -9.752 1.00 0.00 C ATOM 1548 O PRO A 105 10.385 -18.400 -10.806 1.00 0.00 O ATOM 1549 CB PRO A 105 12.645 -16.861 -9.553 1.00 0.00 C ATOM 1550 CG PRO A 105 13.896 -17.542 -9.116 1.00 0.00 C ATOM 1551 CD PRO A 105 13.646 -18.004 -7.708 1.00 0.00 C ATOM 0 HA PRO A 105 10.670 -16.993 -8.571 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.528 -16.904 -10.636 1.00 0.00 H new ATOM 0 HB3 PRO A 105 12.650 -15.807 -9.275 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.130 -18.384 -9.767 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.746 -16.861 -9.158 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.170 -18.935 -7.492 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.986 -17.270 -6.978 1.00 0.00 H new ATOM 1559 N SER A 106 11.090 -19.953 -9.338 1.00 0.00 N ATOM 1560 CA SER A 106 10.588 -21.078 -10.119 1.00 0.00 C ATOM 1561 C SER A 106 9.238 -20.744 -10.746 1.00 0.00 C ATOM 1562 O SER A 106 8.278 -20.424 -10.045 1.00 0.00 O ATOM 1563 CB SER A 106 10.460 -22.322 -9.238 1.00 0.00 C ATOM 1564 OG SER A 106 9.336 -22.226 -8.381 1.00 0.00 O ATOM 0 H SER A 106 11.550 -20.216 -8.467 1.00 0.00 H new ATOM 0 HA SER A 106 11.301 -21.280 -10.918 1.00 0.00 H new ATOM 0 HB2 SER A 106 10.368 -23.208 -9.866 1.00 0.00 H new ATOM 0 HB3 SER A 106 11.365 -22.445 -8.643 1.00 0.00 H new ATOM 0 HG SER A 106 8.882 -21.370 -8.531 1.00 0.00 H new ATOM 1570 N SER A 107 9.172 -20.822 -12.071 1.00 0.00 N ATOM 1571 CA SER A 107 7.941 -20.524 -12.795 1.00 0.00 C ATOM 1572 C SER A 107 6.791 -21.390 -12.288 1.00 0.00 C ATOM 1573 O SER A 107 5.729 -20.882 -11.931 1.00 0.00 O ATOM 1574 CB SER A 107 8.140 -20.748 -14.295 1.00 0.00 C ATOM 1575 OG SER A 107 8.954 -19.733 -14.858 1.00 0.00 O ATOM 0 H SER A 107 9.957 -21.089 -12.666 1.00 0.00 H new ATOM 0 HA SER A 107 7.690 -19.478 -12.622 1.00 0.00 H new ATOM 0 HB2 SER A 107 8.600 -21.722 -14.463 1.00 0.00 H new ATOM 0 HB3 SER A 107 7.172 -20.762 -14.796 1.00 0.00 H new ATOM 0 HG SER A 107 9.068 -19.899 -15.817 1.00 0.00 H new ATOM 1581 N GLY A 108 7.012 -22.700 -12.261 1.00 0.00 N ATOM 1582 CA GLY A 108 5.987 -23.616 -11.797 1.00 0.00 C ATOM 1583 C GLY A 108 4.812 -23.702 -12.751 1.00 0.00 C ATOM 1584 O GLY A 108 3.806 -24.346 -12.452 1.00 0.00 O ATOM 0 H GLY A 108 7.883 -23.144 -12.552 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.421 -24.608 -11.669 1.00 0.00 H new ATOM 0 HA3 GLY A 108 5.633 -23.295 -10.817 1.00 0.00 H new TER 1588 GLY A 108