USER MOD reduce.3.24.130724 H: found=0, std=0, add=619, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 513 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: M 68 LYS NZ :NH3+ -159:sc= 1.23 (180deg=0.778) USER MOD Set 1.2: M 99 SER OG : rot 180:sc= 0.734 USER MOD Single : M 25 MET CE :methyl 166:sc=-0.00935 (180deg=-0.15) USER MOD Single : M 32 SER OG : rot 90:sc= 1.23 USER MOD Single : M 36 SER OG : rot 180:sc= 0 USER MOD Single : M 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : M 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : M 52 TYR OH : rot 180:sc= 0 USER MOD Single : M 54 THR OG1 : rot 89:sc= 1.26 USER MOD Single : M 58 GLN : amide:sc= 0.896 K(o=0.9,f=0) USER MOD Single : M 59 SER OG : rot 180:sc= 0 USER MOD Single : M 61 SER OG : rot 180:sc= 0 USER MOD Single : M 71 LYS NZ :NH3+ -168:sc= 0.719 (180deg=0.625) USER MOD Single : M 74 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : M 78 LYS NZ :NH3+ -178:sc= 1.21 (180deg=1.18) USER MOD Single : M 79 GLN : amide:sc= 0.81 K(o=0.81,f=-1.2) USER MOD Single : M 82 SER OG : rot -45:sc= 0.0235 USER MOD Single : M 83 SER OG : rot 180:sc= 0 USER MOD Single : M 84 ASN : amide:sc= 0.946 K(o=0.95,f=-1.7!) USER MOD Single : M 85 MET CE :methyl -107:sc= 0 (180deg=-0.043) USER MOD Single : M 89 SER OG : rot 111:sc= 1.27 USER MOD Single : M 96 GLN : amide:sc= 0.826 K(o=0.83,f=-0.16) USER MOD Single : M 98 SER OG : rot -74:sc= 1.18 USER MOD ----------------------------------------------------------------- ATOM 1 N MET M 25 2.350 -14.329 10.490 1.00 0.00 N ATOM 2 CA MET M 25 3.246 -13.535 9.645 1.00 0.00 C ATOM 3 C MET M 25 2.506 -12.390 8.931 1.00 0.00 C ATOM 4 O MET M 25 1.273 -12.328 8.906 1.00 0.00 O ATOM 5 CB MET M 25 3.943 -14.446 8.619 1.00 0.00 C ATOM 6 CG MET M 25 4.883 -15.461 9.283 1.00 0.00 C ATOM 7 SD MET M 25 6.185 -16.098 8.190 1.00 0.00 S ATOM 8 CE MET M 25 7.261 -14.638 8.159 1.00 0.00 C ATOM 0 HA MET M 25 3.994 -13.079 10.293 1.00 0.00 H new ATOM 0 HB2 MET M 25 3.189 -14.978 8.038 1.00 0.00 H new ATOM 0 HB3 MET M 25 4.511 -13.833 7.919 1.00 0.00 H new ATOM 0 HG2 MET M 25 5.349 -14.994 10.150 1.00 0.00 H new ATOM 0 HG3 MET M 25 4.292 -16.299 9.652 1.00 0.00 H new ATOM 0 HE1 MET M 25 8.232 -14.910 7.746 1.00 0.00 H new ATOM 0 HE2 MET M 25 6.807 -13.864 7.540 1.00 0.00 H new ATOM 0 HE3 MET M 25 7.391 -14.261 9.173 1.00 0.00 H new ATOM 16 N ALA M 26 3.285 -11.491 8.326 1.00 0.00 N ATOM 17 CA ALA M 26 2.841 -10.289 7.615 1.00 0.00 C ATOM 18 C ALA M 26 3.701 -10.049 6.347 1.00 0.00 C ATOM 19 O ALA M 26 4.820 -10.574 6.280 1.00 0.00 O ATOM 20 CB ALA M 26 2.940 -9.111 8.598 1.00 0.00 C ATOM 0 H ALA M 26 4.300 -11.587 8.318 1.00 0.00 H new ATOM 0 HA ALA M 26 1.812 -10.401 7.273 1.00 0.00 H new ATOM 0 HB1 ALA M 26 2.617 -8.196 8.103 1.00 0.00 H new ATOM 0 HB2 ALA M 26 2.301 -9.302 9.460 1.00 0.00 H new ATOM 0 HB3 ALA M 26 3.972 -8.999 8.929 1.00 0.00 H new ATOM 26 N PRO M 27 3.223 -9.263 5.358 1.00 0.00 N ATOM 27 CA PRO M 27 3.899 -9.027 4.076 1.00 0.00 C ATOM 28 C PRO M 27 5.382 -8.635 4.162 1.00 0.00 C ATOM 29 O PRO M 27 6.197 -9.130 3.386 1.00 0.00 O ATOM 30 CB PRO M 27 3.085 -7.934 3.375 1.00 0.00 C ATOM 31 CG PRO M 27 1.672 -8.176 3.899 1.00 0.00 C ATOM 32 CD PRO M 27 1.909 -8.626 5.341 1.00 0.00 C ATOM 0 HA PRO M 27 3.930 -9.968 3.527 1.00 0.00 H new ATOM 0 HB2 PRO M 27 3.445 -6.937 3.628 1.00 0.00 H new ATOM 0 HB3 PRO M 27 3.135 -8.025 2.290 1.00 0.00 H new ATOM 0 HG2 PRO M 27 1.065 -7.272 3.854 1.00 0.00 H new ATOM 0 HG3 PRO M 27 1.152 -8.939 3.319 1.00 0.00 H new ATOM 0 HD2 PRO M 27 1.879 -7.777 6.024 1.00 0.00 H new ATOM 0 HD3 PRO M 27 1.135 -9.322 5.664 1.00 0.00 H new ATOM 37 N GLU M 28 5.762 -7.781 5.116 1.00 0.00 N ATOM 38 CA GLU M 28 7.159 -7.354 5.299 1.00 0.00 C ATOM 39 C GLU M 28 8.046 -8.478 5.860 1.00 0.00 C ATOM 40 O GLU M 28 9.196 -8.636 5.440 1.00 0.00 O ATOM 41 CB GLU M 28 7.219 -6.140 6.240 1.00 0.00 C ATOM 42 CG GLU M 28 6.593 -4.887 5.613 1.00 0.00 C ATOM 43 CD GLU M 28 6.690 -3.687 6.567 1.00 0.00 C ATOM 44 OE1 GLU M 28 5.745 -3.454 7.360 1.00 0.00 O ATOM 45 OE2 GLU M 28 7.713 -2.960 6.535 1.00 0.00 O ATOM 0 H GLU M 28 5.114 -7.364 5.784 1.00 0.00 H new ATOM 0 HA GLU M 28 7.544 -7.087 4.315 1.00 0.00 H new ATOM 0 HB2 GLU M 28 6.700 -6.377 7.169 1.00 0.00 H new ATOM 0 HB3 GLU M 28 8.258 -5.934 6.499 1.00 0.00 H new ATOM 0 HG2 GLU M 28 7.099 -4.653 4.676 1.00 0.00 H new ATOM 0 HG3 GLU M 28 5.548 -5.080 5.371 1.00 0.00 H new ATOM 50 N ARG M 29 7.508 -9.291 6.779 1.00 0.00 N ATOM 51 CA ARG M 29 8.230 -10.409 7.421 1.00 0.00 C ATOM 52 C ARG M 29 8.453 -11.575 6.466 1.00 0.00 C ATOM 53 O ARG M 29 9.564 -12.094 6.388 1.00 0.00 O ATOM 54 CB ARG M 29 7.486 -10.860 8.683 1.00 0.00 C ATOM 55 CG ARG M 29 7.699 -9.847 9.818 1.00 0.00 C ATOM 56 CD ARG M 29 6.823 -10.172 11.029 1.00 0.00 C ATOM 57 NE ARG M 29 7.121 -11.505 11.593 1.00 0.00 N ATOM 58 CZ ARG M 29 6.252 -12.334 12.140 1.00 0.00 C ATOM 59 NH1 ARG M 29 5.025 -11.986 12.407 1.00 0.00 N ATOM 60 NH2 ARG M 29 6.586 -13.559 12.422 1.00 0.00 N ATOM 0 H ARG M 29 6.546 -9.193 7.105 1.00 0.00 H new ATOM 0 HA ARG M 29 9.218 -10.047 7.705 1.00 0.00 H new ATOM 0 HB2 ARG M 29 6.422 -10.959 8.470 1.00 0.00 H new ATOM 0 HB3 ARG M 29 7.842 -11.843 8.992 1.00 0.00 H new ATOM 0 HG2 ARG M 29 8.748 -9.847 10.115 1.00 0.00 H new ATOM 0 HG3 ARG M 29 7.469 -8.844 9.460 1.00 0.00 H new ATOM 0 HD2 ARG M 29 6.972 -9.413 11.797 1.00 0.00 H new ATOM 0 HD3 ARG M 29 5.773 -10.129 10.738 1.00 0.00 H new ATOM 0 HE ARG M 29 8.092 -11.814 11.556 1.00 0.00 H new ATOM 0 HH11 ARG M 29 4.705 -11.042 12.193 1.00 0.00 H new ATOM 0 HH12 ARG M 29 4.385 -12.658 12.830 1.00 0.00 H new ATOM 0 HH21 ARG M 29 7.530 -13.890 12.221 1.00 0.00 H new ATOM 0 HH22 ARG M 29 5.904 -14.189 12.845 1.00 0.00 H new ATOM 71 N LEU M 30 7.428 -11.957 5.697 1.00 0.00 N ATOM 72 CA LEU M 30 7.546 -13.026 4.689 1.00 0.00 C ATOM 73 C LEU M 30 8.457 -12.636 3.505 1.00 0.00 C ATOM 74 O LEU M 30 9.113 -13.502 2.926 1.00 0.00 O ATOM 75 CB LEU M 30 6.152 -13.556 4.298 1.00 0.00 C ATOM 76 CG LEU M 30 5.218 -12.593 3.535 1.00 0.00 C ATOM 77 CD1 LEU M 30 5.422 -12.633 2.019 1.00 0.00 C ATOM 78 CD2 LEU M 30 3.759 -12.965 3.807 1.00 0.00 C ATOM 0 H LEU M 30 6.499 -11.540 5.752 1.00 0.00 H new ATOM 0 HA LEU M 30 8.071 -13.870 5.137 1.00 0.00 H new ATOM 0 HB2 LEU M 30 6.289 -14.448 3.687 1.00 0.00 H new ATOM 0 HB3 LEU M 30 5.642 -13.869 5.209 1.00 0.00 H new ATOM 0 HG LEU M 30 5.459 -11.592 3.892 1.00 0.00 H new ATOM 0 HD11 LEU M 30 4.736 -11.934 1.541 1.00 0.00 H new ATOM 0 HD12 LEU M 30 6.449 -12.353 1.782 1.00 0.00 H new ATOM 0 HD13 LEU M 30 5.227 -13.641 1.652 1.00 0.00 H new ATOM 0 HD21 LEU M 30 3.103 -12.283 3.267 1.00 0.00 H new ATOM 0 HD22 LEU M 30 3.575 -13.986 3.473 1.00 0.00 H new ATOM 0 HD23 LEU M 30 3.558 -12.891 4.876 1.00 0.00 H new ATOM 89 N ARG M 31 8.551 -11.335 3.186 1.00 0.00 N ATOM 90 CA ARG M 31 9.482 -10.791 2.175 1.00 0.00 C ATOM 91 C ARG M 31 10.926 -10.780 2.697 1.00 0.00 C ATOM 92 O ARG M 31 11.852 -11.135 1.971 1.00 0.00 O ATOM 93 CB ARG M 31 9.012 -9.377 1.775 1.00 0.00 C ATOM 94 CG ARG M 31 9.855 -8.741 0.657 1.00 0.00 C ATOM 95 CD ARG M 31 9.290 -7.366 0.289 1.00 0.00 C ATOM 96 NE ARG M 31 10.064 -6.734 -0.801 1.00 0.00 N ATOM 97 CZ ARG M 31 9.835 -5.549 -1.347 1.00 0.00 C ATOM 98 NH1 ARG M 31 8.856 -4.782 -0.950 1.00 0.00 N ATOM 99 NH2 ARG M 31 10.600 -5.108 -2.304 1.00 0.00 N ATOM 0 H ARG M 31 7.975 -10.618 3.628 1.00 0.00 H new ATOM 0 HA ARG M 31 9.475 -11.432 1.293 1.00 0.00 H new ATOM 0 HB2 ARG M 31 7.972 -9.427 1.451 1.00 0.00 H new ATOM 0 HB3 ARG M 31 9.042 -8.732 2.653 1.00 0.00 H new ATOM 0 HG2 ARG M 31 10.890 -8.642 0.983 1.00 0.00 H new ATOM 0 HG3 ARG M 31 9.858 -9.388 -0.220 1.00 0.00 H new ATOM 0 HD2 ARG M 31 8.249 -7.470 -0.016 1.00 0.00 H new ATOM 0 HD3 ARG M 31 9.302 -6.720 1.167 1.00 0.00 H new ATOM 0 HE ARG M 31 10.854 -7.264 -1.170 1.00 0.00 H new ATOM 0 HH11 ARG M 31 8.240 -5.090 -0.198 1.00 0.00 H new ATOM 0 HH12 ARG M 31 8.707 -3.875 -1.392 1.00 0.00 H new ATOM 0 HH21 ARG M 31 11.380 -5.676 -2.636 1.00 0.00 H new ATOM 0 HH22 ARG M 31 10.420 -4.195 -2.721 1.00 0.00 H new ATOM 110 N SER M 32 11.105 -10.434 3.975 1.00 0.00 N ATOM 111 CA SER M 32 12.405 -10.415 4.679 1.00 0.00 C ATOM 112 C SER M 32 12.947 -11.806 5.046 1.00 0.00 C ATOM 113 O SER M 32 14.104 -11.915 5.451 1.00 0.00 O ATOM 114 CB SER M 32 12.304 -9.581 5.963 1.00 0.00 C ATOM 115 OG SER M 32 11.865 -8.260 5.684 1.00 0.00 O ATOM 0 H SER M 32 10.329 -10.149 4.573 1.00 0.00 H new ATOM 0 HA SER M 32 13.105 -9.973 3.971 1.00 0.00 H new ATOM 0 HB2 SER M 32 11.611 -10.058 6.656 1.00 0.00 H new ATOM 0 HB3 SER M 32 13.276 -9.548 6.456 1.00 0.00 H new ATOM 0 HG SER M 32 10.887 -8.225 5.727 1.00 0.00 H new ATOM 120 N ARG M 33 12.150 -12.877 4.896 1.00 0.00 N ATOM 121 CA ARG M 33 12.480 -14.257 5.309 1.00 0.00 C ATOM 122 C ARG M 33 13.780 -14.814 4.710 1.00 0.00 C ATOM 123 O ARG M 33 14.476 -15.598 5.357 1.00 0.00 O ATOM 124 CB ARG M 33 11.273 -15.163 4.977 1.00 0.00 C ATOM 125 CG ARG M 33 11.297 -16.554 5.637 1.00 0.00 C ATOM 126 CD ARG M 33 11.197 -16.460 7.160 1.00 0.00 C ATOM 127 NE ARG M 33 11.200 -17.788 7.797 1.00 0.00 N ATOM 128 CZ ARG M 33 12.257 -18.440 8.249 1.00 0.00 C ATOM 129 NH1 ARG M 33 13.481 -18.038 8.073 1.00 0.00 N ATOM 130 NH2 ARG M 33 12.125 -19.550 8.907 1.00 0.00 N ATOM 0 H ARG M 33 11.226 -12.807 4.470 1.00 0.00 H new ATOM 0 HA ARG M 33 12.672 -14.239 6.382 1.00 0.00 H new ATOM 0 HB2 ARG M 33 10.360 -14.650 5.280 1.00 0.00 H new ATOM 0 HB3 ARG M 33 11.222 -15.292 3.896 1.00 0.00 H new ATOM 0 HG2 ARG M 33 10.470 -17.152 5.254 1.00 0.00 H new ATOM 0 HG3 ARG M 33 12.217 -17.070 5.364 1.00 0.00 H new ATOM 0 HD2 ARG M 33 12.032 -15.873 7.542 1.00 0.00 H new ATOM 0 HD3 ARG M 33 10.284 -15.930 7.431 1.00 0.00 H new ATOM 0 HE ARG M 33 10.297 -18.250 7.899 1.00 0.00 H new ATOM 0 HH11 ARG M 33 13.666 -17.175 7.562 1.00 0.00 H new ATOM 0 HH12 ARG M 33 14.256 -18.586 8.446 1.00 0.00 H new ATOM 0 HH21 ARG M 33 11.195 -19.932 9.082 1.00 0.00 H new ATOM 0 HH22 ARG M 33 12.951 -20.041 9.249 1.00 0.00 H new ATOM 141 N ALA M 34 14.108 -14.400 3.485 1.00 0.00 N ATOM 142 CA ALA M 34 15.362 -14.740 2.813 1.00 0.00 C ATOM 143 C ALA M 34 16.557 -13.910 3.324 1.00 0.00 C ATOM 144 O ALA M 34 17.630 -14.460 3.574 1.00 0.00 O ATOM 145 CB ALA M 34 15.153 -14.524 1.313 1.00 0.00 C ATOM 0 H ALA M 34 13.497 -13.808 2.922 1.00 0.00 H new ATOM 0 HA ALA M 34 15.611 -15.779 3.029 1.00 0.00 H new ATOM 0 HB1 ALA M 34 16.071 -14.769 0.779 1.00 0.00 H new ATOM 0 HB2 ALA M 34 14.346 -15.167 0.962 1.00 0.00 H new ATOM 0 HB3 ALA M 34 14.893 -13.482 1.128 1.00 0.00 H new ATOM 151 N LEU M 35 16.367 -12.597 3.522 1.00 0.00 N ATOM 152 CA LEU M 35 17.407 -11.688 4.032 1.00 0.00 C ATOM 153 C LEU M 35 17.835 -12.055 5.458 1.00 0.00 C ATOM 154 O LEU M 35 19.031 -12.083 5.749 1.00 0.00 O ATOM 155 CB LEU M 35 16.898 -10.231 4.012 1.00 0.00 C ATOM 156 CG LEU M 35 16.717 -9.609 2.617 1.00 0.00 C ATOM 157 CD1 LEU M 35 15.988 -8.270 2.731 1.00 0.00 C ATOM 158 CD2 LEU M 35 18.064 -9.358 1.938 1.00 0.00 C ATOM 0 H LEU M 35 15.480 -12.131 3.331 1.00 0.00 H new ATOM 0 HA LEU M 35 18.274 -11.788 3.379 1.00 0.00 H new ATOM 0 HB2 LEU M 35 15.942 -10.192 4.534 1.00 0.00 H new ATOM 0 HB3 LEU M 35 17.596 -9.614 4.578 1.00 0.00 H new ATOM 0 HG LEU M 35 16.138 -10.314 2.021 1.00 0.00 H new ATOM 0 HD11 LEU M 35 15.865 -7.837 1.738 1.00 0.00 H new ATOM 0 HD12 LEU M 35 15.009 -8.426 3.183 1.00 0.00 H new ATOM 0 HD13 LEU M 35 16.570 -7.590 3.353 1.00 0.00 H new ATOM 0 HD21 LEU M 35 17.899 -8.918 0.954 1.00 0.00 H new ATOM 0 HD22 LEU M 35 18.656 -8.675 2.546 1.00 0.00 H new ATOM 0 HD23 LEU M 35 18.598 -10.302 1.828 1.00 0.00 H new ATOM 169 N SER M 36 16.881 -12.364 6.341 1.00 0.00 N ATOM 170 CA SER M 36 17.167 -12.711 7.737 1.00 0.00 C ATOM 171 C SER M 36 18.050 -13.956 7.862 1.00 0.00 C ATOM 172 O SER M 36 18.935 -13.982 8.713 1.00 0.00 O ATOM 173 CB SER M 36 15.875 -12.855 8.547 1.00 0.00 C ATOM 174 OG SER M 36 15.058 -13.906 8.064 1.00 0.00 O ATOM 0 H SER M 36 15.888 -12.381 6.108 1.00 0.00 H new ATOM 0 HA SER M 36 17.737 -11.883 8.159 1.00 0.00 H new ATOM 0 HB2 SER M 36 16.122 -13.039 9.593 1.00 0.00 H new ATOM 0 HB3 SER M 36 15.319 -11.918 8.511 1.00 0.00 H new ATOM 0 HG SER M 36 14.245 -13.965 8.608 1.00 0.00 H new ATOM 179 N ALA M 37 17.892 -14.952 6.984 1.00 0.00 N ATOM 180 CA ALA M 37 18.738 -16.146 6.973 1.00 0.00 C ATOM 181 C ALA M 37 20.212 -15.836 6.640 1.00 0.00 C ATOM 182 O ALA M 37 21.114 -16.368 7.294 1.00 0.00 O ATOM 183 CB ALA M 37 18.139 -17.139 5.976 1.00 0.00 C ATOM 0 H ALA M 37 17.173 -14.951 6.261 1.00 0.00 H new ATOM 0 HA ALA M 37 18.755 -16.574 7.975 1.00 0.00 H new ATOM 0 HB1 ALA M 37 18.751 -18.040 5.948 1.00 0.00 H new ATOM 0 HB2 ALA M 37 17.126 -17.398 6.284 1.00 0.00 H new ATOM 0 HB3 ALA M 37 18.112 -16.687 4.984 1.00 0.00 H new ATOM 189 N PHE M 38 20.473 -14.953 5.666 1.00 0.00 N ATOM 190 CA PHE M 38 21.827 -14.479 5.352 1.00 0.00 C ATOM 191 C PHE M 38 22.406 -13.658 6.524 1.00 0.00 C ATOM 192 O PHE M 38 23.545 -13.890 6.937 1.00 0.00 O ATOM 193 CB PHE M 38 21.819 -13.659 4.045 1.00 0.00 C ATOM 194 CG PHE M 38 21.973 -14.481 2.776 1.00 0.00 C ATOM 195 CD1 PHE M 38 20.858 -15.102 2.182 1.00 0.00 C ATOM 196 CD2 PHE M 38 23.236 -14.609 2.163 1.00 0.00 C ATOM 197 CE1 PHE M 38 21.002 -15.837 0.991 1.00 0.00 C ATOM 198 CE2 PHE M 38 23.383 -15.353 0.975 1.00 0.00 C ATOM 199 CZ PHE M 38 22.263 -15.962 0.383 1.00 0.00 C ATOM 0 H PHE M 38 19.749 -14.547 5.073 1.00 0.00 H new ATOM 0 HA PHE M 38 22.473 -15.345 5.205 1.00 0.00 H new ATOM 0 HB2 PHE M 38 20.884 -13.101 3.988 1.00 0.00 H new ATOM 0 HB3 PHE M 38 22.625 -12.927 4.087 1.00 0.00 H new ATOM 0 HD1 PHE M 38 19.886 -15.014 2.644 1.00 0.00 H new ATOM 0 HD2 PHE M 38 24.098 -14.133 2.607 1.00 0.00 H new ATOM 0 HE1 PHE M 38 20.140 -16.307 0.542 1.00 0.00 H new ATOM 0 HE2 PHE M 38 24.357 -15.455 0.519 1.00 0.00 H new ATOM 0 HZ PHE M 38 22.371 -16.523 -0.534 1.00 0.00 H new ATOM 208 N LYS M 39 21.609 -12.750 7.109 1.00 0.00 N ATOM 209 CA LYS M 39 22.000 -11.924 8.269 1.00 0.00 C ATOM 210 C LYS M 39 22.320 -12.735 9.532 1.00 0.00 C ATOM 211 O LYS M 39 23.272 -12.398 10.235 1.00 0.00 O ATOM 212 CB LYS M 39 20.926 -10.861 8.548 1.00 0.00 C ATOM 213 CG LYS M 39 20.913 -9.773 7.463 1.00 0.00 C ATOM 214 CD LYS M 39 19.845 -8.720 7.766 1.00 0.00 C ATOM 215 CE LYS M 39 19.851 -7.630 6.687 1.00 0.00 C ATOM 216 NZ LYS M 39 18.883 -6.544 6.999 1.00 0.00 N ATOM 0 H LYS M 39 20.659 -12.564 6.786 1.00 0.00 H new ATOM 0 HA LYS M 39 22.935 -11.434 7.998 1.00 0.00 H new ATOM 0 HB2 LYS M 39 19.947 -11.337 8.599 1.00 0.00 H new ATOM 0 HB3 LYS M 39 21.109 -10.404 9.520 1.00 0.00 H new ATOM 0 HG2 LYS M 39 21.893 -9.298 7.405 1.00 0.00 H new ATOM 0 HG3 LYS M 39 20.720 -10.225 6.490 1.00 0.00 H new ATOM 0 HD2 LYS M 39 18.863 -9.191 7.811 1.00 0.00 H new ATOM 0 HD3 LYS M 39 20.031 -8.275 8.743 1.00 0.00 H new ATOM 0 HE2 LYS M 39 20.853 -7.210 6.599 1.00 0.00 H new ATOM 0 HE3 LYS M 39 19.604 -8.072 5.722 1.00 0.00 H new ATOM 0 HZ1 LYS M 39 18.914 -5.825 6.248 1.00 0.00 H new ATOM 0 HZ2 LYS M 39 17.924 -6.941 7.059 1.00 0.00 H new ATOM 0 HZ3 LYS M 39 19.134 -6.106 7.908 1.00 0.00 H new ATOM 226 N LEU M 40 21.592 -13.827 9.800 1.00 0.00 N ATOM 227 CA LEU M 40 21.872 -14.761 10.908 1.00 0.00 C ATOM 228 C LEU M 40 23.252 -15.433 10.771 1.00 0.00 C ATOM 229 O LEU M 40 23.923 -15.665 11.779 1.00 0.00 O ATOM 230 CB LEU M 40 20.771 -15.838 10.982 1.00 0.00 C ATOM 231 CG LEU M 40 19.449 -15.374 11.622 1.00 0.00 C ATOM 232 CD1 LEU M 40 18.377 -16.447 11.413 1.00 0.00 C ATOM 233 CD2 LEU M 40 19.578 -15.130 13.129 1.00 0.00 C ATOM 0 H LEU M 40 20.778 -14.094 9.246 1.00 0.00 H new ATOM 0 HA LEU M 40 21.882 -14.178 11.829 1.00 0.00 H new ATOM 0 HB2 LEU M 40 20.563 -16.194 9.973 1.00 0.00 H new ATOM 0 HB3 LEU M 40 21.153 -16.688 11.548 1.00 0.00 H new ATOM 0 HG LEU M 40 19.179 -14.434 11.141 1.00 0.00 H new ATOM 0 HD11 LEU M 40 17.441 -16.119 11.866 1.00 0.00 H new ATOM 0 HD12 LEU M 40 18.227 -16.608 10.345 1.00 0.00 H new ATOM 0 HD13 LEU M 40 18.699 -17.378 11.879 1.00 0.00 H new ATOM 0 HD21 LEU M 40 18.617 -14.805 13.528 1.00 0.00 H new ATOM 0 HD22 LEU M 40 19.882 -16.053 13.622 1.00 0.00 H new ATOM 0 HD23 LEU M 40 20.326 -14.358 13.310 1.00 0.00 H new ATOM 244 N ARG M 41 23.690 -15.711 9.534 1.00 0.00 N ATOM 245 CA ARG M 41 25.032 -16.253 9.219 1.00 0.00 C ATOM 246 C ARG M 41 26.126 -15.171 9.141 1.00 0.00 C ATOM 247 O ARG M 41 27.310 -15.503 9.070 1.00 0.00 O ATOM 248 CB ARG M 41 24.954 -17.103 7.933 1.00 0.00 C ATOM 249 CG ARG M 41 24.663 -18.582 8.236 1.00 0.00 C ATOM 250 CD ARG M 41 23.289 -18.849 8.861 1.00 0.00 C ATOM 251 NE ARG M 41 23.176 -20.269 9.244 1.00 0.00 N ATOM 252 CZ ARG M 41 22.266 -21.156 8.880 1.00 0.00 C ATOM 253 NH1 ARG M 41 21.260 -20.892 8.099 1.00 0.00 N ATOM 254 NH2 ARG M 41 22.336 -22.381 9.304 1.00 0.00 N ATOM 0 H ARG M 41 23.115 -15.565 8.705 1.00 0.00 H new ATOM 0 HA ARG M 41 25.336 -16.892 10.048 1.00 0.00 H new ATOM 0 HB2 ARG M 41 24.174 -16.706 7.283 1.00 0.00 H new ATOM 0 HB3 ARG M 41 25.895 -17.023 7.388 1.00 0.00 H new ATOM 0 HG2 ARG M 41 24.743 -19.151 7.310 1.00 0.00 H new ATOM 0 HG3 ARG M 41 25.433 -18.959 8.909 1.00 0.00 H new ATOM 0 HD2 ARG M 41 23.150 -18.215 9.737 1.00 0.00 H new ATOM 0 HD3 ARG M 41 22.502 -18.591 8.153 1.00 0.00 H new ATOM 0 HE ARG M 41 23.899 -20.614 9.876 1.00 0.00 H new ATOM 0 HH11 ARG M 41 21.137 -19.950 7.727 1.00 0.00 H new ATOM 0 HH12 ARG M 41 20.594 -21.627 7.859 1.00 0.00 H new ATOM 0 HH21 ARG M 41 23.097 -22.664 9.922 1.00 0.00 H new ATOM 0 HH22 ARG M 41 21.630 -23.060 9.019 1.00 0.00 H new ATOM 265 N GLY M 42 25.742 -13.893 9.185 1.00 0.00 N ATOM 266 CA GLY M 42 26.632 -12.725 9.231 1.00 0.00 C ATOM 267 C GLY M 42 26.783 -11.973 7.900 1.00 0.00 C ATOM 268 O GLY M 42 27.557 -11.016 7.834 1.00 0.00 O ATOM 0 H GLY M 42 24.757 -13.630 9.190 1.00 0.00 H new ATOM 0 HA2 GLY M 42 26.257 -12.031 9.983 1.00 0.00 H new ATOM 0 HA3 GLY M 42 27.618 -13.051 9.561 1.00 0.00 H new ATOM 272 N LEU M 43 26.091 -12.402 6.838 1.00 0.00 N ATOM 273 CA LEU M 43 26.207 -11.834 5.489 1.00 0.00 C ATOM 274 C LEU M 43 25.298 -10.608 5.275 1.00 0.00 C ATOM 275 O LEU M 43 24.340 -10.371 6.015 1.00 0.00 O ATOM 276 CB LEU M 43 25.892 -12.924 4.436 1.00 0.00 C ATOM 277 CG LEU M 43 26.873 -14.104 4.260 1.00 0.00 C ATOM 278 CD1 LEU M 43 28.333 -13.658 4.202 1.00 0.00 C ATOM 279 CD2 LEU M 43 26.726 -15.181 5.334 1.00 0.00 C ATOM 0 H LEU M 43 25.421 -13.169 6.893 1.00 0.00 H new ATOM 0 HA LEU M 43 27.233 -11.486 5.372 1.00 0.00 H new ATOM 0 HB2 LEU M 43 24.915 -13.342 4.678 1.00 0.00 H new ATOM 0 HB3 LEU M 43 25.796 -12.429 3.469 1.00 0.00 H new ATOM 0 HG LEU M 43 26.596 -14.537 3.299 1.00 0.00 H new ATOM 0 HD11 LEU M 43 28.975 -14.530 4.078 1.00 0.00 H new ATOM 0 HD12 LEU M 43 28.473 -12.981 3.360 1.00 0.00 H new ATOM 0 HD13 LEU M 43 28.594 -13.145 5.128 1.00 0.00 H new ATOM 0 HD21 LEU M 43 27.445 -15.979 5.150 1.00 0.00 H new ATOM 0 HD22 LEU M 43 26.913 -14.744 6.315 1.00 0.00 H new ATOM 0 HD23 LEU M 43 25.716 -15.589 5.305 1.00 0.00 H new ATOM 290 N LEU M 44 25.579 -9.861 4.203 1.00 0.00 N ATOM 291 CA LEU M 44 24.832 -8.690 3.727 1.00 0.00 C ATOM 292 C LEU M 44 24.510 -8.852 2.233 1.00 0.00 C ATOM 293 O LEU M 44 25.260 -8.426 1.353 1.00 0.00 O ATOM 294 CB LEU M 44 25.625 -7.398 4.027 1.00 0.00 C ATOM 295 CG LEU M 44 25.744 -7.044 5.521 1.00 0.00 C ATOM 296 CD1 LEU M 44 26.658 -5.827 5.682 1.00 0.00 C ATOM 297 CD2 LEU M 44 24.395 -6.705 6.160 1.00 0.00 C ATOM 0 H LEU M 44 26.381 -10.069 3.608 1.00 0.00 H new ATOM 0 HA LEU M 44 23.883 -8.612 4.257 1.00 0.00 H new ATOM 0 HB2 LEU M 44 26.628 -7.499 3.611 1.00 0.00 H new ATOM 0 HB3 LEU M 44 25.147 -6.567 3.508 1.00 0.00 H new ATOM 0 HG LEU M 44 26.148 -7.924 6.021 1.00 0.00 H new ATOM 0 HD11 LEU M 44 26.744 -5.574 6.739 1.00 0.00 H new ATOM 0 HD12 LEU M 44 27.645 -6.058 5.283 1.00 0.00 H new ATOM 0 HD13 LEU M 44 26.236 -4.981 5.140 1.00 0.00 H new ATOM 0 HD21 LEU M 44 24.541 -6.464 7.213 1.00 0.00 H new ATOM 0 HD22 LEU M 44 23.956 -5.848 5.649 1.00 0.00 H new ATOM 0 HD23 LEU M 44 23.726 -7.561 6.074 1.00 0.00 H new ATOM 308 N LEU M 45 23.405 -9.544 1.946 1.00 0.00 N ATOM 309 CA LEU M 45 22.895 -9.784 0.592 1.00 0.00 C ATOM 310 C LEU M 45 22.472 -8.466 -0.096 1.00 0.00 C ATOM 311 O LEU M 45 21.640 -7.723 0.435 1.00 0.00 O ATOM 312 CB LEU M 45 21.724 -10.780 0.718 1.00 0.00 C ATOM 313 CG LEU M 45 21.217 -11.347 -0.616 1.00 0.00 C ATOM 314 CD1 LEU M 45 22.252 -12.261 -1.269 1.00 0.00 C ATOM 315 CD2 LEU M 45 19.963 -12.183 -0.385 1.00 0.00 C ATOM 0 H LEU M 45 22.823 -9.966 2.670 1.00 0.00 H new ATOM 0 HA LEU M 45 23.674 -10.205 -0.044 1.00 0.00 H new ATOM 0 HB2 LEU M 45 22.036 -11.608 1.354 1.00 0.00 H new ATOM 0 HB3 LEU M 45 20.896 -10.284 1.224 1.00 0.00 H new ATOM 0 HG LEU M 45 21.014 -10.495 -1.265 1.00 0.00 H new ATOM 0 HD11 LEU M 45 21.858 -12.643 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU M 45 23.166 -11.698 -1.460 1.00 0.00 H new ATOM 0 HD13 LEU M 45 22.473 -13.095 -0.603 1.00 0.00 H new ATOM 0 HD21 LEU M 45 19.611 -12.581 -1.337 1.00 0.00 H new ATOM 0 HD22 LEU M 45 20.194 -13.007 0.290 1.00 0.00 H new ATOM 0 HD23 LEU M 45 19.186 -11.559 0.057 1.00 0.00 H new ATOM 326 N ARG M 46 23.041 -8.165 -1.273 1.00 0.00 N ATOM 327 CA ARG M 46 22.728 -6.966 -2.081 1.00 0.00 C ATOM 328 C ARG M 46 21.280 -6.948 -2.602 1.00 0.00 C ATOM 329 O ARG M 46 20.645 -7.991 -2.752 1.00 0.00 O ATOM 330 CB ARG M 46 23.713 -6.868 -3.269 1.00 0.00 C ATOM 331 CG ARG M 46 25.161 -6.518 -2.878 1.00 0.00 C ATOM 332 CD ARG M 46 25.335 -5.153 -2.207 1.00 0.00 C ATOM 333 NE ARG M 46 24.856 -4.037 -3.049 1.00 0.00 N ATOM 334 CZ ARG M 46 24.757 -2.768 -2.686 1.00 0.00 C ATOM 335 NH1 ARG M 46 25.086 -2.354 -1.493 1.00 0.00 N ATOM 336 NH2 ARG M 46 24.322 -1.878 -3.531 1.00 0.00 N ATOM 0 H ARG M 46 23.749 -8.760 -1.704 1.00 0.00 H new ATOM 0 HA ARG M 46 22.836 -6.103 -1.423 1.00 0.00 H new ATOM 0 HB2 ARG M 46 23.715 -7.819 -3.801 1.00 0.00 H new ATOM 0 HB3 ARG M 46 23.347 -6.114 -3.966 1.00 0.00 H new ATOM 0 HG2 ARG M 46 25.536 -7.288 -2.204 1.00 0.00 H new ATOM 0 HG3 ARG M 46 25.781 -6.548 -3.774 1.00 0.00 H new ATOM 0 HD2 ARG M 46 24.794 -5.147 -1.261 1.00 0.00 H new ATOM 0 HD3 ARG M 46 26.388 -5.000 -1.973 1.00 0.00 H new ATOM 0 HE ARG M 46 24.574 -4.267 -4.002 1.00 0.00 H new ATOM 0 HH11 ARG M 46 25.434 -3.017 -0.801 1.00 0.00 H new ATOM 0 HH12 ARG M 46 24.995 -1.367 -1.253 1.00 0.00 H new ATOM 0 HH21 ARG M 46 24.057 -2.158 -4.475 1.00 0.00 H new ATOM 0 HH22 ARG M 46 24.247 -0.901 -3.249 1.00 0.00 H new ATOM 347 N GLY M 47 20.795 -5.764 -2.984 1.00 0.00 N ATOM 348 CA GLY M 47 19.450 -5.564 -3.553 1.00 0.00 C ATOM 349 C GLY M 47 19.232 -6.204 -4.935 1.00 0.00 C ATOM 350 O GLY M 47 18.102 -6.530 -5.295 1.00 0.00 O ATOM 0 H GLY M 47 21.331 -4.900 -2.907 1.00 0.00 H new ATOM 0 HA2 GLY M 47 18.714 -5.970 -2.860 1.00 0.00 H new ATOM 0 HA3 GLY M 47 19.259 -4.494 -3.630 1.00 0.00 H new ATOM 354 N GLU M 48 20.302 -6.433 -5.710 1.00 0.00 N ATOM 355 CA GLU M 48 20.224 -7.175 -6.983 1.00 0.00 C ATOM 356 C GLU M 48 20.250 -8.699 -6.732 1.00 0.00 C ATOM 357 O GLU M 48 19.629 -9.474 -7.459 1.00 0.00 O ATOM 358 CB GLU M 48 21.386 -6.752 -7.897 1.00 0.00 C ATOM 359 CG GLU M 48 21.127 -7.094 -9.365 1.00 0.00 C ATOM 360 CD GLU M 48 22.206 -6.488 -10.277 1.00 0.00 C ATOM 361 OE1 GLU M 48 21.942 -5.447 -10.930 1.00 0.00 O ATOM 362 OE2 GLU M 48 23.332 -7.039 -10.351 1.00 0.00 O ATOM 0 H GLU M 48 21.242 -6.113 -5.477 1.00 0.00 H new ATOM 0 HA GLU M 48 19.281 -6.937 -7.475 1.00 0.00 H new ATOM 0 HB2 GLU M 48 21.549 -5.679 -7.800 1.00 0.00 H new ATOM 0 HB3 GLU M 48 22.301 -7.244 -7.568 1.00 0.00 H new ATOM 0 HG2 GLU M 48 21.107 -8.177 -9.491 1.00 0.00 H new ATOM 0 HG3 GLU M 48 20.146 -6.721 -9.660 1.00 0.00 H new ATOM 367 N ALA M 49 20.933 -9.121 -5.661 1.00 0.00 N ATOM 368 CA ALA M 49 21.080 -10.520 -5.262 1.00 0.00 C ATOM 369 C ALA M 49 19.805 -11.085 -4.615 1.00 0.00 C ATOM 370 O ALA M 49 19.392 -12.198 -4.948 1.00 0.00 O ATOM 371 CB ALA M 49 22.264 -10.598 -4.300 1.00 0.00 C ATOM 0 H ALA M 49 21.412 -8.477 -5.032 1.00 0.00 H new ATOM 0 HA ALA M 49 21.256 -11.132 -6.147 1.00 0.00 H new ATOM 0 HB1 ALA M 49 22.405 -11.630 -3.980 1.00 0.00 H new ATOM 0 HB2 ALA M 49 23.165 -10.248 -4.803 1.00 0.00 H new ATOM 0 HB3 ALA M 49 22.068 -9.972 -3.430 1.00 0.00 H new ATOM 377 N ILE M 50 19.144 -10.312 -3.740 1.00 0.00 N ATOM 378 CA ILE M 50 17.849 -10.681 -3.142 1.00 0.00 C ATOM 379 C ILE M 50 16.797 -10.912 -4.230 1.00 0.00 C ATOM 380 O ILE M 50 16.103 -11.926 -4.210 1.00 0.00 O ATOM 381 CB ILE M 50 17.388 -9.645 -2.082 1.00 0.00 C ATOM 382 CG1 ILE M 50 16.101 -10.046 -1.323 1.00 0.00 C ATOM 383 CG2 ILE M 50 17.124 -8.257 -2.664 1.00 0.00 C ATOM 384 CD1 ILE M 50 16.112 -11.428 -0.664 1.00 0.00 C ATOM 0 H ILE M 50 19.494 -9.407 -3.425 1.00 0.00 H new ATOM 0 HA ILE M 50 17.978 -11.623 -2.609 1.00 0.00 H new ATOM 0 HB ILE M 50 18.235 -9.623 -1.396 1.00 0.00 H new ATOM 0 HG12 ILE M 50 15.910 -9.299 -0.552 1.00 0.00 H new ATOM 0 HG13 ILE M 50 15.264 -10.005 -2.020 1.00 0.00 H new ATOM 0 HG21 ILE M 50 16.805 -7.583 -1.868 1.00 0.00 H new ATOM 0 HG22 ILE M 50 18.037 -7.874 -3.120 1.00 0.00 H new ATOM 0 HG23 ILE M 50 16.341 -8.322 -3.419 1.00 0.00 H new ATOM 0 HD11 ILE M 50 15.160 -11.600 -0.162 1.00 0.00 H new ATOM 0 HD12 ILE M 50 16.264 -12.193 -1.425 1.00 0.00 H new ATOM 0 HD13 ILE M 50 16.920 -11.477 0.066 1.00 0.00 H new ATOM 395 N LYS M 51 16.736 -10.031 -5.239 1.00 0.00 N ATOM 396 CA LYS M 51 15.857 -10.147 -6.413 1.00 0.00 C ATOM 397 C LYS M 51 16.151 -11.408 -7.230 1.00 0.00 C ATOM 398 O LYS M 51 15.217 -12.110 -7.614 1.00 0.00 O ATOM 399 CB LYS M 51 15.993 -8.864 -7.253 1.00 0.00 C ATOM 400 CG LYS M 51 15.007 -8.832 -8.432 1.00 0.00 C ATOM 401 CD LYS M 51 15.006 -7.483 -9.167 1.00 0.00 C ATOM 402 CE LYS M 51 16.354 -7.167 -9.832 1.00 0.00 C ATOM 403 NZ LYS M 51 16.299 -5.896 -10.604 1.00 0.00 N ATOM 0 H LYS M 51 17.315 -9.192 -5.262 1.00 0.00 H new ATOM 0 HA LYS M 51 14.824 -10.251 -6.082 1.00 0.00 H new ATOM 0 HB2 LYS M 51 15.823 -7.996 -6.616 1.00 0.00 H new ATOM 0 HB3 LYS M 51 17.012 -8.787 -7.632 1.00 0.00 H new ATOM 0 HG2 LYS M 51 15.262 -9.624 -9.136 1.00 0.00 H new ATOM 0 HG3 LYS M 51 14.002 -9.042 -8.066 1.00 0.00 H new ATOM 0 HD2 LYS M 51 14.224 -7.489 -9.926 1.00 0.00 H new ATOM 0 HD3 LYS M 51 14.759 -6.690 -8.461 1.00 0.00 H new ATOM 0 HE2 LYS M 51 17.129 -7.097 -9.069 1.00 0.00 H new ATOM 0 HE3 LYS M 51 16.633 -7.985 -10.496 1.00 0.00 H new ATOM 0 HZ1 LYS M 51 17.226 -5.714 -11.039 1.00 0.00 H new ATOM 0 HZ2 LYS M 51 15.576 -5.973 -11.348 1.00 0.00 H new ATOM 0 HZ3 LYS M 51 16.057 -5.112 -9.965 1.00 0.00 H new ATOM 413 N TYR M 52 17.427 -11.731 -7.447 1.00 0.00 N ATOM 414 CA TYR M 52 17.840 -12.933 -8.174 1.00 0.00 C ATOM 415 C TYR M 52 17.326 -14.215 -7.499 1.00 0.00 C ATOM 416 O TYR M 52 16.627 -15.003 -8.144 1.00 0.00 O ATOM 417 CB TYR M 52 19.369 -12.955 -8.334 1.00 0.00 C ATOM 418 CG TYR M 52 19.845 -14.130 -9.160 1.00 0.00 C ATOM 419 CD1 TYR M 52 20.093 -15.370 -8.542 1.00 0.00 C ATOM 420 CD2 TYR M 52 19.954 -14.008 -10.557 1.00 0.00 C ATOM 421 CE1 TYR M 52 20.406 -16.500 -9.321 1.00 0.00 C ATOM 422 CE2 TYR M 52 20.282 -15.131 -11.341 1.00 0.00 C ATOM 423 CZ TYR M 52 20.480 -16.385 -10.728 1.00 0.00 C ATOM 424 OH TYR M 52 20.717 -17.474 -11.510 1.00 0.00 O ATOM 0 H TYR M 52 18.208 -11.162 -7.121 1.00 0.00 H new ATOM 0 HA TYR M 52 17.389 -12.900 -9.166 1.00 0.00 H new ATOM 0 HB2 TYR M 52 19.696 -12.028 -8.804 1.00 0.00 H new ATOM 0 HB3 TYR M 52 19.834 -12.994 -7.349 1.00 0.00 H new ATOM 0 HD1 TYR M 52 20.043 -15.455 -7.466 1.00 0.00 H new ATOM 0 HD2 TYR M 52 19.786 -13.051 -11.029 1.00 0.00 H new ATOM 0 HE1 TYR M 52 20.589 -17.452 -8.845 1.00 0.00 H new ATOM 0 HE2 TYR M 52 20.382 -15.032 -12.412 1.00 0.00 H new ATOM 0 HH TYR M 52 20.733 -17.203 -12.452 1.00 0.00 H new ATOM 433 N LEU M 53 17.600 -14.415 -6.198 1.00 0.00 N ATOM 434 CA LEU M 53 17.092 -15.604 -5.496 1.00 0.00 C ATOM 435 C LEU M 53 15.582 -15.554 -5.213 1.00 0.00 C ATOM 436 O LEU M 53 14.947 -16.600 -5.108 1.00 0.00 O ATOM 437 CB LEU M 53 17.981 -16.016 -4.306 1.00 0.00 C ATOM 438 CG LEU M 53 18.171 -15.049 -3.127 1.00 0.00 C ATOM 439 CD1 LEU M 53 16.927 -14.899 -2.251 1.00 0.00 C ATOM 440 CD2 LEU M 53 19.287 -15.600 -2.238 1.00 0.00 C ATOM 0 H LEU M 53 18.158 -13.784 -5.623 1.00 0.00 H new ATOM 0 HA LEU M 53 17.180 -16.438 -6.192 1.00 0.00 H new ATOM 0 HB2 LEU M 53 17.576 -16.945 -3.904 1.00 0.00 H new ATOM 0 HB3 LEU M 53 18.970 -16.245 -4.702 1.00 0.00 H new ATOM 0 HG LEU M 53 18.399 -14.071 -3.551 1.00 0.00 H new ATOM 0 HD11 LEU M 53 17.135 -14.202 -1.440 1.00 0.00 H new ATOM 0 HD12 LEU M 53 16.102 -14.519 -2.853 1.00 0.00 H new ATOM 0 HD13 LEU M 53 16.656 -15.869 -1.835 1.00 0.00 H new ATOM 0 HD21 LEU M 53 19.442 -14.931 -1.392 1.00 0.00 H new ATOM 0 HD22 LEU M 53 19.007 -16.588 -1.873 1.00 0.00 H new ATOM 0 HD23 LEU M 53 20.209 -15.675 -2.815 1.00 0.00 H new ATOM 451 N THR M 54 14.971 -14.364 -5.166 1.00 0.00 N ATOM 452 CA THR M 54 13.509 -14.200 -5.042 1.00 0.00 C ATOM 453 C THR M 54 12.798 -14.797 -6.263 1.00 0.00 C ATOM 454 O THR M 54 11.789 -15.488 -6.114 1.00 0.00 O ATOM 455 CB THR M 54 13.149 -12.712 -4.857 1.00 0.00 C ATOM 456 OG1 THR M 54 13.555 -12.289 -3.573 1.00 0.00 O ATOM 457 CG2 THR M 54 11.671 -12.355 -4.964 1.00 0.00 C ATOM 0 H THR M 54 15.476 -13.479 -5.213 1.00 0.00 H new ATOM 0 HA THR M 54 13.168 -14.740 -4.159 1.00 0.00 H new ATOM 0 HB THR M 54 13.663 -12.218 -5.682 1.00 0.00 H new ATOM 0 HG1 THR M 54 14.482 -11.972 -3.611 1.00 0.00 H new ATOM 0 HG21 THR M 54 11.544 -11.283 -4.816 1.00 0.00 H new ATOM 0 HG22 THR M 54 11.300 -12.632 -5.951 1.00 0.00 H new ATOM 0 HG23 THR M 54 11.110 -12.895 -4.201 1.00 0.00 H new ATOM 465 N GLU M 55 13.348 -14.600 -7.467 1.00 0.00 N ATOM 466 CA GLU M 55 12.843 -15.219 -8.702 1.00 0.00 C ATOM 467 C GLU M 55 13.189 -16.720 -8.786 1.00 0.00 C ATOM 468 O GLU M 55 12.370 -17.504 -9.267 1.00 0.00 O ATOM 469 CB GLU M 55 13.403 -14.484 -9.933 1.00 0.00 C ATOM 470 CG GLU M 55 12.853 -13.059 -10.095 1.00 0.00 C ATOM 471 CD GLU M 55 11.355 -13.052 -10.460 1.00 0.00 C ATOM 472 OE1 GLU M 55 11.019 -13.268 -11.650 1.00 0.00 O ATOM 473 OE2 GLU M 55 10.504 -12.826 -9.566 1.00 0.00 O ATOM 0 H GLU M 55 14.162 -14.003 -7.615 1.00 0.00 H new ATOM 0 HA GLU M 55 11.757 -15.132 -8.685 1.00 0.00 H new ATOM 0 HB2 GLU M 55 14.489 -14.440 -9.857 1.00 0.00 H new ATOM 0 HB3 GLU M 55 13.169 -15.060 -10.828 1.00 0.00 H new ATOM 0 HG2 GLU M 55 13.002 -12.506 -9.168 1.00 0.00 H new ATOM 0 HG3 GLU M 55 13.417 -12.540 -10.870 1.00 0.00 H new ATOM 478 N ALA M 56 14.352 -17.148 -8.278 1.00 0.00 N ATOM 479 CA ALA M 56 14.756 -18.561 -8.233 1.00 0.00 C ATOM 480 C ALA M 56 13.941 -19.426 -7.239 1.00 0.00 C ATOM 481 O ALA M 56 13.961 -20.657 -7.333 1.00 0.00 O ATOM 482 CB ALA M 56 16.257 -18.638 -7.918 1.00 0.00 C ATOM 0 H ALA M 56 15.048 -16.516 -7.882 1.00 0.00 H new ATOM 0 HA ALA M 56 14.544 -18.985 -9.214 1.00 0.00 H new ATOM 0 HB1 ALA M 56 16.568 -19.682 -7.882 1.00 0.00 H new ATOM 0 HB2 ALA M 56 16.819 -18.118 -8.694 1.00 0.00 H new ATOM 0 HB3 ALA M 56 16.451 -18.168 -6.954 1.00 0.00 H new ATOM 488 N LEU M 57 13.220 -18.796 -6.303 1.00 0.00 N ATOM 489 CA LEU M 57 12.464 -19.425 -5.203 1.00 0.00 C ATOM 490 C LEU M 57 10.962 -19.057 -5.241 1.00 0.00 C ATOM 491 O LEU M 57 10.234 -19.320 -4.284 1.00 0.00 O ATOM 492 CB LEU M 57 13.115 -19.032 -3.859 1.00 0.00 C ATOM 493 CG LEU M 57 14.594 -19.441 -3.686 1.00 0.00 C ATOM 494 CD1 LEU M 57 15.157 -18.842 -2.396 1.00 0.00 C ATOM 495 CD2 LEU M 57 14.771 -20.957 -3.611 1.00 0.00 C ATOM 0 H LEU M 57 13.142 -17.779 -6.288 1.00 0.00 H new ATOM 0 HA LEU M 57 12.508 -20.508 -5.321 1.00 0.00 H new ATOM 0 HB2 LEU M 57 13.040 -17.951 -3.743 1.00 0.00 H new ATOM 0 HB3 LEU M 57 12.536 -19.480 -3.051 1.00 0.00 H new ATOM 0 HG LEU M 57 15.125 -19.065 -4.560 1.00 0.00 H new ATOM 0 HD11 LEU M 57 16.200 -19.136 -2.283 1.00 0.00 H new ATOM 0 HD12 LEU M 57 15.089 -17.755 -2.440 1.00 0.00 H new ATOM 0 HD13 LEU M 57 14.583 -19.207 -1.544 1.00 0.00 H new ATOM 0 HD21 LEU M 57 15.828 -21.194 -3.489 1.00 0.00 H new ATOM 0 HD22 LEU M 57 14.211 -21.347 -2.761 1.00 0.00 H new ATOM 0 HD23 LEU M 57 14.400 -21.412 -4.529 1.00 0.00 H new ATOM 506 N GLN M 58 10.480 -18.468 -6.347 1.00 0.00 N ATOM 507 CA GLN M 58 9.107 -17.955 -6.514 1.00 0.00 C ATOM 508 C GLN M 58 7.981 -18.995 -6.326 1.00 0.00 C ATOM 509 O GLN M 58 6.825 -18.619 -6.108 1.00 0.00 O ATOM 510 CB GLN M 58 8.985 -17.253 -7.878 1.00 0.00 C ATOM 511 CG GLN M 58 9.048 -18.210 -9.085 1.00 0.00 C ATOM 512 CD GLN M 58 8.989 -17.448 -10.408 1.00 0.00 C ATOM 513 OE1 GLN M 58 7.927 -17.157 -10.948 1.00 0.00 O ATOM 514 NE2 GLN M 58 10.119 -17.095 -10.982 1.00 0.00 N ATOM 0 H GLN M 58 11.054 -18.330 -7.179 1.00 0.00 H new ATOM 0 HA GLN M 58 8.954 -17.248 -5.699 1.00 0.00 H new ATOM 0 HB2 GLN M 58 8.043 -16.706 -7.910 1.00 0.00 H new ATOM 0 HB3 GLN M 58 9.784 -16.517 -7.969 1.00 0.00 H new ATOM 0 HG2 GLN M 58 9.968 -18.793 -9.041 1.00 0.00 H new ATOM 0 HG3 GLN M 58 8.220 -18.917 -9.034 1.00 0.00 H new ATOM 0 HE21 GLN M 58 11.009 -17.331 -10.543 1.00 0.00 H new ATOM 0 HE22 GLN M 58 10.105 -16.586 -11.866 1.00 0.00 H new ATOM 521 N SER M 59 8.308 -20.290 -6.393 1.00 0.00 N ATOM 522 CA SER M 59 7.373 -21.424 -6.289 1.00 0.00 C ATOM 523 C SER M 59 7.768 -22.466 -5.222 1.00 0.00 C ATOM 524 O SER M 59 7.099 -23.496 -5.082 1.00 0.00 O ATOM 525 CB SER M 59 7.231 -22.082 -7.666 1.00 0.00 C ATOM 526 OG SER M 59 8.489 -22.547 -8.140 1.00 0.00 O ATOM 0 H SER M 59 9.273 -20.593 -6.527 1.00 0.00 H new ATOM 0 HA SER M 59 6.416 -21.022 -5.956 1.00 0.00 H new ATOM 0 HB2 SER M 59 6.531 -22.915 -7.605 1.00 0.00 H new ATOM 0 HB3 SER M 59 6.813 -21.366 -8.374 1.00 0.00 H new ATOM 0 HG SER M 59 8.373 -22.964 -9.019 1.00 0.00 H new ATOM 531 N ILE M 60 8.835 -22.216 -4.451 1.00 0.00 N ATOM 532 CA ILE M 60 9.261 -23.076 -3.331 1.00 0.00 C ATOM 533 C ILE M 60 8.249 -23.021 -2.172 1.00 0.00 C ATOM 534 O ILE M 60 7.683 -21.970 -1.854 1.00 0.00 O ATOM 535 CB ILE M 60 10.708 -22.708 -2.905 1.00 0.00 C ATOM 536 CG1 ILE M 60 11.724 -23.438 -3.815 1.00 0.00 C ATOM 537 CG2 ILE M 60 11.044 -22.936 -1.418 1.00 0.00 C ATOM 538 CD1 ILE M 60 11.914 -24.936 -3.525 1.00 0.00 C ATOM 0 H ILE M 60 9.435 -21.403 -4.586 1.00 0.00 H new ATOM 0 HA ILE M 60 9.278 -24.116 -3.656 1.00 0.00 H new ATOM 0 HB ILE M 60 10.780 -21.628 -3.034 1.00 0.00 H new ATOM 0 HG12 ILE M 60 11.405 -23.324 -4.851 1.00 0.00 H new ATOM 0 HG13 ILE M 60 12.690 -22.942 -3.722 1.00 0.00 H new ATOM 0 HG21 ILE M 60 12.078 -22.647 -1.230 1.00 0.00 H new ATOM 0 HG22 ILE M 60 10.380 -22.333 -0.798 1.00 0.00 H new ATOM 0 HG23 ILE M 60 10.912 -23.990 -1.173 1.00 0.00 H new ATOM 0 HD11 ILE M 60 12.646 -25.351 -4.218 1.00 0.00 H new ATOM 0 HD12 ILE M 60 12.268 -25.067 -2.502 1.00 0.00 H new ATOM 0 HD13 ILE M 60 10.963 -25.454 -3.649 1.00 0.00 H new ATOM 549 N SER M 61 8.040 -24.176 -1.534 1.00 0.00 N ATOM 550 CA SER M 61 7.179 -24.367 -0.357 1.00 0.00 C ATOM 551 C SER M 61 7.552 -23.425 0.799 1.00 0.00 C ATOM 552 O SER M 61 8.705 -23.385 1.230 1.00 0.00 O ATOM 553 CB SER M 61 7.292 -25.836 0.079 1.00 0.00 C ATOM 554 OG SER M 61 6.587 -26.669 -0.827 1.00 0.00 O ATOM 0 H SER M 61 8.485 -25.043 -1.835 1.00 0.00 H new ATOM 0 HA SER M 61 6.151 -24.124 -0.626 1.00 0.00 H new ATOM 0 HB2 SER M 61 8.340 -26.132 0.117 1.00 0.00 H new ATOM 0 HB3 SER M 61 6.890 -25.957 1.085 1.00 0.00 H new ATOM 0 HG SER M 61 6.666 -27.603 -0.542 1.00 0.00 H new ATOM 559 N GLU M 62 6.579 -22.679 1.334 1.00 0.00 N ATOM 560 CA GLU M 62 6.800 -21.646 2.366 1.00 0.00 C ATOM 561 C GLU M 62 7.468 -22.157 3.657 1.00 0.00 C ATOM 562 O GLU M 62 8.318 -21.473 4.228 1.00 0.00 O ATOM 563 CB GLU M 62 5.484 -20.914 2.682 1.00 0.00 C ATOM 564 CG GLU M 62 4.360 -21.808 3.228 1.00 0.00 C ATOM 565 CD GLU M 62 3.063 -21.003 3.435 1.00 0.00 C ATOM 566 OE1 GLU M 62 2.281 -20.852 2.462 1.00 0.00 O ATOM 567 OE2 GLU M 62 2.812 -20.518 4.568 1.00 0.00 O ATOM 0 H GLU M 62 5.600 -22.773 1.062 1.00 0.00 H new ATOM 0 HA GLU M 62 7.517 -20.949 1.934 1.00 0.00 H new ATOM 0 HB2 GLU M 62 5.688 -20.128 3.409 1.00 0.00 H new ATOM 0 HB3 GLU M 62 5.131 -20.425 1.774 1.00 0.00 H new ATOM 0 HG2 GLU M 62 4.175 -22.629 2.536 1.00 0.00 H new ATOM 0 HG3 GLU M 62 4.671 -22.252 4.174 1.00 0.00 H new ATOM 572 N LEU M 63 7.132 -23.381 4.090 1.00 0.00 N ATOM 573 CA LEU M 63 7.717 -24.044 5.265 1.00 0.00 C ATOM 574 C LEU M 63 9.091 -24.703 4.998 1.00 0.00 C ATOM 575 O LEU M 63 9.746 -25.179 5.926 1.00 0.00 O ATOM 576 CB LEU M 63 6.699 -25.036 5.867 1.00 0.00 C ATOM 577 CG LEU M 63 6.390 -26.306 5.039 1.00 0.00 C ATOM 578 CD1 LEU M 63 5.716 -27.342 5.936 1.00 0.00 C ATOM 579 CD2 LEU M 63 5.449 -26.058 3.856 1.00 0.00 C ATOM 0 H LEU M 63 6.428 -23.952 3.621 1.00 0.00 H new ATOM 0 HA LEU M 63 7.930 -23.266 5.998 1.00 0.00 H new ATOM 0 HB2 LEU M 63 7.066 -25.349 6.844 1.00 0.00 H new ATOM 0 HB3 LEU M 63 5.763 -24.503 6.034 1.00 0.00 H new ATOM 0 HG LEU M 63 7.348 -26.647 4.647 1.00 0.00 H new ATOM 0 HD11 LEU M 63 5.497 -28.238 5.356 1.00 0.00 H new ATOM 0 HD12 LEU M 63 6.382 -27.597 6.761 1.00 0.00 H new ATOM 0 HD13 LEU M 63 4.788 -26.931 6.333 1.00 0.00 H new ATOM 0 HD21 LEU M 63 5.279 -26.994 3.324 1.00 0.00 H new ATOM 0 HD22 LEU M 63 4.498 -25.671 4.222 1.00 0.00 H new ATOM 0 HD23 LEU M 63 5.899 -25.332 3.179 1.00 0.00 H new ATOM 590 N GLU M 64 9.541 -24.710 3.740 1.00 0.00 N ATOM 591 CA GLU M 64 10.818 -25.277 3.275 1.00 0.00 C ATOM 592 C GLU M 64 11.811 -24.196 2.801 1.00 0.00 C ATOM 593 O GLU M 64 12.960 -24.515 2.481 1.00 0.00 O ATOM 594 CB GLU M 64 10.546 -26.253 2.115 1.00 0.00 C ATOM 595 CG GLU M 64 9.644 -27.448 2.466 1.00 0.00 C ATOM 596 CD GLU M 64 10.218 -28.335 3.589 1.00 0.00 C ATOM 597 OE1 GLU M 64 11.412 -28.726 3.523 1.00 0.00 O ATOM 598 OE2 GLU M 64 9.471 -28.684 4.537 1.00 0.00 O ATOM 0 H GLU M 64 9.001 -24.301 2.978 1.00 0.00 H new ATOM 0 HA GLU M 64 11.273 -25.791 4.122 1.00 0.00 H new ATOM 0 HB2 GLU M 64 10.087 -25.700 1.295 1.00 0.00 H new ATOM 0 HB3 GLU M 64 11.500 -26.633 1.749 1.00 0.00 H new ATOM 0 HG2 GLU M 64 8.664 -27.078 2.769 1.00 0.00 H new ATOM 0 HG3 GLU M 64 9.493 -28.055 1.574 1.00 0.00 H new ATOM 603 N LEU M 65 11.398 -22.921 2.762 1.00 0.00 N ATOM 604 CA LEU M 65 12.171 -21.793 2.232 1.00 0.00 C ATOM 605 C LEU M 65 13.523 -21.642 2.938 1.00 0.00 C ATOM 606 O LEU M 65 14.539 -21.419 2.280 1.00 0.00 O ATOM 607 CB LEU M 65 11.319 -20.518 2.367 1.00 0.00 C ATOM 608 CG LEU M 65 11.999 -19.219 1.888 1.00 0.00 C ATOM 609 CD1 LEU M 65 12.297 -19.241 0.386 1.00 0.00 C ATOM 610 CD2 LEU M 65 11.103 -18.020 2.195 1.00 0.00 C ATOM 0 H LEU M 65 10.482 -22.639 3.112 1.00 0.00 H new ATOM 0 HA LEU M 65 12.400 -21.975 1.182 1.00 0.00 H new ATOM 0 HB2 LEU M 65 10.397 -20.655 1.803 1.00 0.00 H new ATOM 0 HB3 LEU M 65 11.038 -20.397 3.413 1.00 0.00 H new ATOM 0 HG LEU M 65 12.946 -19.137 2.422 1.00 0.00 H new ATOM 0 HD11 LEU M 65 12.775 -18.305 0.096 1.00 0.00 H new ATOM 0 HD12 LEU M 65 12.962 -20.074 0.159 1.00 0.00 H new ATOM 0 HD13 LEU M 65 11.366 -19.359 -0.168 1.00 0.00 H new ATOM 0 HD21 LEU M 65 11.589 -17.106 1.854 1.00 0.00 H new ATOM 0 HD22 LEU M 65 10.149 -18.137 1.681 1.00 0.00 H new ATOM 0 HD23 LEU M 65 10.931 -17.960 3.270 1.00 0.00 H new ATOM 621 N GLU M 66 13.546 -21.782 4.267 1.00 0.00 N ATOM 622 CA GLU M 66 14.780 -21.681 5.046 1.00 0.00 C ATOM 623 C GLU M 66 15.745 -22.839 4.734 1.00 0.00 C ATOM 624 O GLU M 66 16.908 -22.601 4.413 1.00 0.00 O ATOM 625 CB GLU M 66 14.445 -21.621 6.546 1.00 0.00 C ATOM 626 CG GLU M 66 15.690 -21.356 7.406 1.00 0.00 C ATOM 627 CD GLU M 66 15.320 -21.247 8.895 1.00 0.00 C ATOM 628 OE1 GLU M 66 15.495 -22.235 9.652 1.00 0.00 O ATOM 629 OE2 GLU M 66 14.833 -20.170 9.315 1.00 0.00 O ATOM 0 H GLU M 66 12.715 -21.967 4.828 1.00 0.00 H new ATOM 0 HA GLU M 66 15.291 -20.761 4.764 1.00 0.00 H new ATOM 0 HB2 GLU M 66 13.710 -20.836 6.722 1.00 0.00 H new ATOM 0 HB3 GLU M 66 13.987 -22.561 6.853 1.00 0.00 H new ATOM 0 HG2 GLU M 66 16.411 -22.161 7.265 1.00 0.00 H new ATOM 0 HG3 GLU M 66 16.172 -20.435 7.079 1.00 0.00 H new ATOM 634 N ASP M 67 15.269 -24.090 4.778 1.00 0.00 N ATOM 635 CA ASP M 67 16.080 -25.282 4.485 1.00 0.00 C ATOM 636 C ASP M 67 16.616 -25.291 3.041 1.00 0.00 C ATOM 637 O ASP M 67 17.725 -25.767 2.783 1.00 0.00 O ATOM 638 CB ASP M 67 15.249 -26.542 4.768 1.00 0.00 C ATOM 639 CG ASP M 67 16.097 -27.821 4.637 1.00 0.00 C ATOM 640 OD1 ASP M 67 16.766 -28.206 5.626 1.00 0.00 O ATOM 641 OD2 ASP M 67 16.092 -28.450 3.551 1.00 0.00 O ATOM 0 H ASP M 67 14.302 -24.307 5.020 1.00 0.00 H new ATOM 0 HA ASP M 67 16.954 -25.263 5.136 1.00 0.00 H new ATOM 0 HB2 ASP M 67 14.830 -26.484 5.772 1.00 0.00 H new ATOM 0 HB3 ASP M 67 14.410 -26.589 4.074 1.00 0.00 H new ATOM 645 N LYS M 68 15.845 -24.743 2.092 1.00 0.00 N ATOM 646 CA LYS M 68 16.248 -24.556 0.694 1.00 0.00 C ATOM 647 C LYS M 68 17.329 -23.480 0.561 1.00 0.00 C ATOM 648 O LYS M 68 18.416 -23.760 0.059 1.00 0.00 O ATOM 649 CB LYS M 68 14.987 -24.213 -0.121 1.00 0.00 C ATOM 650 CG LYS M 68 15.283 -23.765 -1.557 1.00 0.00 C ATOM 651 CD LYS M 68 16.040 -24.811 -2.384 1.00 0.00 C ATOM 652 CE LYS M 68 16.185 -24.307 -3.823 1.00 0.00 C ATOM 653 NZ LYS M 68 16.920 -25.274 -4.674 1.00 0.00 N ATOM 0 H LYS M 68 14.900 -24.409 2.282 1.00 0.00 H new ATOM 0 HA LYS M 68 16.693 -25.473 0.307 1.00 0.00 H new ATOM 0 HB2 LYS M 68 14.335 -25.086 -0.150 1.00 0.00 H new ATOM 0 HB3 LYS M 68 14.438 -23.422 0.391 1.00 0.00 H new ATOM 0 HG2 LYS M 68 14.343 -23.531 -2.056 1.00 0.00 H new ATOM 0 HG3 LYS M 68 15.867 -22.845 -1.528 1.00 0.00 H new ATOM 0 HD2 LYS M 68 17.023 -24.994 -1.949 1.00 0.00 H new ATOM 0 HD3 LYS M 68 15.504 -25.760 -2.371 1.00 0.00 H new ATOM 0 HE2 LYS M 68 15.197 -24.128 -4.247 1.00 0.00 H new ATOM 0 HE3 LYS M 68 16.710 -23.351 -3.822 1.00 0.00 H new ATOM 0 HZ1 LYS M 68 17.307 -24.782 -5.504 1.00 0.00 H new ATOM 0 HZ2 LYS M 68 17.698 -25.696 -4.128 1.00 0.00 H new ATOM 0 HZ3 LYS M 68 16.271 -26.024 -4.988 1.00 0.00 H new ATOM 663 N LEU M 69 17.048 -22.258 1.017 1.00 0.00 N ATOM 664 CA LEU M 69 17.958 -21.111 0.912 1.00 0.00 C ATOM 665 C LEU M 69 19.258 -21.315 1.708 1.00 0.00 C ATOM 666 O LEU M 69 20.301 -20.766 1.359 1.00 0.00 O ATOM 667 CB LEU M 69 17.178 -19.856 1.328 1.00 0.00 C ATOM 668 CG LEU M 69 17.971 -18.542 1.233 1.00 0.00 C ATOM 669 CD1 LEU M 69 17.110 -17.426 0.646 1.00 0.00 C ATOM 670 CD2 LEU M 69 18.395 -18.108 2.630 1.00 0.00 C ATOM 0 H LEU M 69 16.167 -22.032 1.478 1.00 0.00 H new ATOM 0 HA LEU M 69 18.296 -20.995 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU M 69 16.289 -19.774 0.702 1.00 0.00 H new ATOM 0 HB3 LEU M 69 16.834 -19.983 2.355 1.00 0.00 H new ATOM 0 HG LEU M 69 18.835 -18.716 0.592 1.00 0.00 H new ATOM 0 HD11 LEU M 69 17.694 -16.507 0.589 1.00 0.00 H new ATOM 0 HD12 LEU M 69 16.780 -17.709 -0.354 1.00 0.00 H new ATOM 0 HD13 LEU M 69 16.240 -17.264 1.283 1.00 0.00 H new ATOM 0 HD21 LEU M 69 18.958 -17.177 2.567 1.00 0.00 H new ATOM 0 HD22 LEU M 69 17.510 -17.956 3.248 1.00 0.00 H new ATOM 0 HD23 LEU M 69 19.021 -18.880 3.077 1.00 0.00 H new ATOM 681 N GLU M 70 19.236 -22.171 2.726 1.00 0.00 N ATOM 682 CA GLU M 70 20.428 -22.548 3.497 1.00 0.00 C ATOM 683 C GLU M 70 21.484 -23.250 2.624 1.00 0.00 C ATOM 684 O GLU M 70 22.685 -23.106 2.863 1.00 0.00 O ATOM 685 CB GLU M 70 20.004 -23.414 4.697 1.00 0.00 C ATOM 686 CG GLU M 70 21.169 -23.825 5.598 1.00 0.00 C ATOM 687 CD GLU M 70 20.649 -24.409 6.921 1.00 0.00 C ATOM 688 OE1 GLU M 70 20.333 -23.617 7.843 1.00 0.00 O ATOM 689 OE2 GLU M 70 20.578 -25.655 7.060 1.00 0.00 O ATOM 0 H GLU M 70 18.383 -22.630 3.046 1.00 0.00 H new ATOM 0 HA GLU M 70 20.905 -21.641 3.869 1.00 0.00 H new ATOM 0 HB2 GLU M 70 19.273 -22.865 5.290 1.00 0.00 H new ATOM 0 HB3 GLU M 70 19.506 -24.311 4.329 1.00 0.00 H new ATOM 0 HG2 GLU M 70 21.788 -24.562 5.087 1.00 0.00 H new ATOM 0 HG3 GLU M 70 21.802 -22.961 5.799 1.00 0.00 H new ATOM 694 N LYS M 71 21.063 -23.956 1.566 1.00 0.00 N ATOM 695 CA LYS M 71 21.971 -24.589 0.594 1.00 0.00 C ATOM 696 C LYS M 71 22.683 -23.538 -0.266 1.00 0.00 C ATOM 697 O LYS M 71 23.855 -23.711 -0.593 1.00 0.00 O ATOM 698 CB LYS M 71 21.201 -25.595 -0.280 1.00 0.00 C ATOM 699 CG LYS M 71 20.532 -26.697 0.558 1.00 0.00 C ATOM 700 CD LYS M 71 19.767 -27.685 -0.333 1.00 0.00 C ATOM 701 CE LYS M 71 19.058 -28.760 0.508 1.00 0.00 C ATOM 702 NZ LYS M 71 17.871 -28.229 1.231 1.00 0.00 N ATOM 0 H LYS M 71 20.076 -24.106 1.357 1.00 0.00 H new ATOM 0 HA LYS M 71 22.738 -25.132 1.146 1.00 0.00 H new ATOM 0 HB2 LYS M 71 20.441 -25.067 -0.856 1.00 0.00 H new ATOM 0 HB3 LYS M 71 21.885 -26.050 -0.996 1.00 0.00 H new ATOM 0 HG2 LYS M 71 21.289 -27.232 1.131 1.00 0.00 H new ATOM 0 HG3 LYS M 71 19.847 -26.246 1.276 1.00 0.00 H new ATOM 0 HD2 LYS M 71 19.033 -27.145 -0.932 1.00 0.00 H new ATOM 0 HD3 LYS M 71 20.458 -28.161 -1.029 1.00 0.00 H new ATOM 0 HE2 LYS M 71 18.747 -29.578 -0.142 1.00 0.00 H new ATOM 0 HE3 LYS M 71 19.762 -29.175 1.229 1.00 0.00 H new ATOM 0 HZ1 LYS M 71 17.552 -28.926 1.933 1.00 0.00 H new ATOM 0 HZ2 LYS M 71 18.126 -27.344 1.713 1.00 0.00 H new ATOM 0 HZ3 LYS M 71 17.105 -28.045 0.552 1.00 0.00 H new ATOM 712 N ILE M 72 21.990 -22.436 -0.583 1.00 0.00 N ATOM 713 CA ILE M 72 22.569 -21.282 -1.289 1.00 0.00 C ATOM 714 C ILE M 72 23.654 -20.672 -0.395 1.00 0.00 C ATOM 715 O ILE M 72 24.798 -20.559 -0.822 1.00 0.00 O ATOM 716 CB ILE M 72 21.507 -20.215 -1.653 1.00 0.00 C ATOM 717 CG1 ILE M 72 20.301 -20.820 -2.410 1.00 0.00 C ATOM 718 CG2 ILE M 72 22.148 -19.083 -2.478 1.00 0.00 C ATOM 719 CD1 ILE M 72 19.129 -19.842 -2.553 1.00 0.00 C ATOM 0 H ILE M 72 21.003 -22.318 -0.355 1.00 0.00 H new ATOM 0 HA ILE M 72 22.992 -21.627 -2.233 1.00 0.00 H new ATOM 0 HB ILE M 72 21.125 -19.806 -0.717 1.00 0.00 H new ATOM 0 HG12 ILE M 72 20.624 -21.138 -3.401 1.00 0.00 H new ATOM 0 HG13 ILE M 72 19.960 -21.712 -1.884 1.00 0.00 H new ATOM 0 HG21 ILE M 72 21.390 -18.340 -2.727 1.00 0.00 H new ATOM 0 HG22 ILE M 72 22.940 -18.612 -1.896 1.00 0.00 H new ATOM 0 HG23 ILE M 72 22.568 -19.495 -3.396 1.00 0.00 H new ATOM 0 HD11 ILE M 72 18.315 -20.326 -3.093 1.00 0.00 H new ATOM 0 HD12 ILE M 72 18.782 -19.543 -1.564 1.00 0.00 H new ATOM 0 HD13 ILE M 72 19.456 -18.960 -3.104 1.00 0.00 H new ATOM 730 N ILE M 73 23.327 -20.370 0.870 1.00 0.00 N ATOM 731 CA ILE M 73 24.274 -19.802 1.845 1.00 0.00 C ATOM 732 C ILE M 73 25.525 -20.685 1.975 1.00 0.00 C ATOM 733 O ILE M 73 26.638 -20.181 1.841 1.00 0.00 O ATOM 734 CB ILE M 73 23.587 -19.553 3.210 1.00 0.00 C ATOM 735 CG1 ILE M 73 22.462 -18.499 3.069 1.00 0.00 C ATOM 736 CG2 ILE M 73 24.615 -19.069 4.251 1.00 0.00 C ATOM 737 CD1 ILE M 73 21.581 -18.330 4.318 1.00 0.00 C ATOM 0 H ILE M 73 22.391 -20.514 1.250 1.00 0.00 H new ATOM 0 HA ILE M 73 24.605 -18.831 1.475 1.00 0.00 H new ATOM 0 HB ILE M 73 23.153 -20.495 3.546 1.00 0.00 H new ATOM 0 HG12 ILE M 73 22.912 -17.537 2.826 1.00 0.00 H new ATOM 0 HG13 ILE M 73 21.827 -18.776 2.227 1.00 0.00 H new ATOM 0 HG21 ILE M 73 24.115 -18.899 5.204 1.00 0.00 H new ATOM 0 HG22 ILE M 73 25.389 -19.826 4.377 1.00 0.00 H new ATOM 0 HG23 ILE M 73 25.069 -18.139 3.909 1.00 0.00 H new ATOM 0 HD11 ILE M 73 20.821 -17.572 4.127 1.00 0.00 H new ATOM 0 HD12 ILE M 73 21.097 -19.278 4.553 1.00 0.00 H new ATOM 0 HD13 ILE M 73 22.199 -18.020 5.160 1.00 0.00 H new ATOM 748 N ASN M 74 25.373 -22.004 2.128 1.00 0.00 N ATOM 749 CA ASN M 74 26.509 -22.935 2.202 1.00 0.00 C ATOM 750 C ASN M 74 27.393 -22.961 0.930 1.00 0.00 C ATOM 751 O ASN M 74 28.584 -23.260 1.029 1.00 0.00 O ATOM 752 CB ASN M 74 25.999 -24.344 2.550 1.00 0.00 C ATOM 753 CG ASN M 74 25.811 -24.539 4.046 1.00 0.00 C ATOM 754 OD1 ASN M 74 26.692 -25.017 4.747 1.00 0.00 O ATOM 755 ND2 ASN M 74 24.663 -24.203 4.584 1.00 0.00 N ATOM 0 H ASN M 74 24.463 -22.458 2.204 1.00 0.00 H new ATOM 0 HA ASN M 74 27.163 -22.568 2.993 1.00 0.00 H new ATOM 0 HB2 ASN M 74 25.051 -24.520 2.041 1.00 0.00 H new ATOM 0 HB3 ASN M 74 26.705 -25.086 2.175 1.00 0.00 H new ATOM 0 HD21 ASN M 74 24.508 -24.341 5.583 1.00 0.00 H new ATOM 0 HD22 ASN M 74 23.925 -23.804 4.004 1.00 0.00 H new ATOM 761 N ALA M 75 26.849 -22.624 -0.248 1.00 0.00 N ATOM 762 CA ALA M 75 27.616 -22.503 -1.494 1.00 0.00 C ATOM 763 C ALA M 75 28.244 -21.102 -1.664 1.00 0.00 C ATOM 764 O ALA M 75 29.260 -20.953 -2.343 1.00 0.00 O ATOM 765 CB ALA M 75 26.706 -22.875 -2.666 1.00 0.00 C ATOM 0 H ALA M 75 25.855 -22.426 -0.363 1.00 0.00 H new ATOM 0 HA ALA M 75 28.459 -23.193 -1.461 1.00 0.00 H new ATOM 0 HB1 ALA M 75 27.262 -22.790 -3.600 1.00 0.00 H new ATOM 0 HB2 ALA M 75 26.356 -23.900 -2.544 1.00 0.00 H new ATOM 0 HB3 ALA M 75 25.850 -22.200 -2.691 1.00 0.00 H new ATOM 771 N VAL M 76 27.667 -20.070 -1.038 1.00 0.00 N ATOM 772 CA VAL M 76 28.222 -18.703 -0.975 1.00 0.00 C ATOM 773 C VAL M 76 29.426 -18.666 -0.022 1.00 0.00 C ATOM 774 O VAL M 76 30.441 -18.039 -0.315 1.00 0.00 O ATOM 775 CB VAL M 76 27.136 -17.706 -0.514 1.00 0.00 C ATOM 776 CG1 VAL M 76 27.690 -16.319 -0.194 1.00 0.00 C ATOM 777 CG2 VAL M 76 26.066 -17.544 -1.598 1.00 0.00 C ATOM 0 H VAL M 76 26.778 -20.159 -0.547 1.00 0.00 H new ATOM 0 HA VAL M 76 28.557 -18.412 -1.971 1.00 0.00 H new ATOM 0 HB VAL M 76 26.715 -18.128 0.399 1.00 0.00 H new ATOM 0 HG11 VAL M 76 26.877 -15.667 0.124 1.00 0.00 H new ATOM 0 HG12 VAL M 76 28.426 -16.397 0.606 1.00 0.00 H new ATOM 0 HG13 VAL M 76 28.163 -15.902 -1.083 1.00 0.00 H new ATOM 0 HG21 VAL M 76 25.308 -16.838 -1.258 1.00 0.00 H new ATOM 0 HG22 VAL M 76 26.527 -17.169 -2.512 1.00 0.00 H new ATOM 0 HG23 VAL M 76 25.600 -18.509 -1.797 1.00 0.00 H new ATOM 787 N GLU M 77 29.341 -19.398 1.096 1.00 0.00 N ATOM 788 CA GLU M 77 30.381 -19.492 2.141 1.00 0.00 C ATOM 789 C GLU M 77 31.741 -20.065 1.673 1.00 0.00 C ATOM 790 O GLU M 77 32.739 -19.895 2.379 1.00 0.00 O ATOM 791 CB GLU M 77 29.858 -20.326 3.326 1.00 0.00 C ATOM 792 CG GLU M 77 28.911 -19.546 4.245 1.00 0.00 C ATOM 793 CD GLU M 77 28.527 -20.387 5.478 1.00 0.00 C ATOM 794 OE1 GLU M 77 29.104 -20.159 6.571 1.00 0.00 O ATOM 795 OE2 GLU M 77 27.659 -21.288 5.368 1.00 0.00 O ATOM 0 H GLU M 77 28.519 -19.963 1.310 1.00 0.00 H new ATOM 0 HA GLU M 77 30.582 -18.461 2.433 1.00 0.00 H new ATOM 0 HB2 GLU M 77 29.339 -21.204 2.942 1.00 0.00 H new ATOM 0 HB3 GLU M 77 30.705 -20.686 3.910 1.00 0.00 H new ATOM 0 HG2 GLU M 77 29.389 -18.620 4.565 1.00 0.00 H new ATOM 0 HG3 GLU M 77 28.012 -19.267 3.695 1.00 0.00 H new ATOM 800 N LYS M 78 31.804 -20.714 0.495 1.00 0.00 N ATOM 801 CA LYS M 78 33.016 -21.377 -0.036 1.00 0.00 C ATOM 802 C LYS M 78 33.584 -20.754 -1.323 1.00 0.00 C ATOM 803 O LYS M 78 34.562 -21.266 -1.876 1.00 0.00 O ATOM 804 CB LYS M 78 32.762 -22.895 -0.166 1.00 0.00 C ATOM 805 CG LYS M 78 31.761 -23.261 -1.274 1.00 0.00 C ATOM 806 CD LYS M 78 31.682 -24.782 -1.458 1.00 0.00 C ATOM 807 CE LYS M 78 30.812 -25.117 -2.672 1.00 0.00 C ATOM 808 NZ LYS M 78 30.818 -26.576 -2.961 1.00 0.00 N ATOM 0 H LYS M 78 31.000 -20.795 -0.128 1.00 0.00 H new ATOM 0 HA LYS M 78 33.811 -21.209 0.691 1.00 0.00 H new ATOM 0 HB2 LYS M 78 33.709 -23.397 -0.364 1.00 0.00 H new ATOM 0 HB3 LYS M 78 32.392 -23.275 0.786 1.00 0.00 H new ATOM 0 HG2 LYS M 78 30.775 -22.869 -1.023 1.00 0.00 H new ATOM 0 HG3 LYS M 78 32.062 -22.792 -2.211 1.00 0.00 H new ATOM 0 HD2 LYS M 78 32.683 -25.193 -1.593 1.00 0.00 H new ATOM 0 HD3 LYS M 78 31.265 -25.244 -0.563 1.00 0.00 H new ATOM 0 HE2 LYS M 78 29.790 -24.785 -2.491 1.00 0.00 H new ATOM 0 HE3 LYS M 78 31.175 -24.571 -3.543 1.00 0.00 H new ATOM 0 HZ1 LYS M 78 30.246 -26.764 -3.809 1.00 0.00 H new ATOM 0 HZ2 LYS M 78 31.795 -26.894 -3.124 1.00 0.00 H new ATOM 0 HZ3 LYS M 78 30.417 -27.092 -2.152 1.00 0.00 H new ATOM 818 N GLN M 79 32.995 -19.656 -1.805 1.00 0.00 N ATOM 819 CA GLN M 79 33.491 -18.889 -2.953 1.00 0.00 C ATOM 820 C GLN M 79 34.601 -17.912 -2.526 1.00 0.00 C ATOM 821 O GLN M 79 34.663 -17.532 -1.350 1.00 0.00 O ATOM 822 CB GLN M 79 32.323 -18.123 -3.596 1.00 0.00 C ATOM 823 CG GLN M 79 31.477 -19.059 -4.470 1.00 0.00 C ATOM 824 CD GLN M 79 30.309 -18.320 -5.109 1.00 0.00 C ATOM 825 OE1 GLN M 79 30.471 -17.395 -5.895 1.00 0.00 O ATOM 826 NE2 GLN M 79 29.086 -18.689 -4.791 1.00 0.00 N ATOM 0 H GLN M 79 32.143 -19.267 -1.401 1.00 0.00 H new ATOM 0 HA GLN M 79 33.918 -19.580 -3.680 1.00 0.00 H new ATOM 0 HB2 GLN M 79 31.700 -17.681 -2.819 1.00 0.00 H new ATOM 0 HB3 GLN M 79 32.709 -17.302 -4.201 1.00 0.00 H new ATOM 0 HG2 GLN M 79 32.102 -19.496 -5.249 1.00 0.00 H new ATOM 0 HG3 GLN M 79 31.100 -19.883 -3.864 1.00 0.00 H new ATOM 0 HE21 GLN M 79 28.939 -19.458 -4.137 1.00 0.00 H new ATOM 0 HE22 GLN M 79 28.285 -18.206 -5.198 1.00 0.00 H new ATOM 833 N PRO M 80 35.479 -17.479 -3.453 1.00 0.00 N ATOM 834 CA PRO M 80 36.523 -16.508 -3.147 1.00 0.00 C ATOM 835 C PRO M 80 35.946 -15.094 -2.971 1.00 0.00 C ATOM 836 O PRO M 80 35.403 -14.498 -3.907 1.00 0.00 O ATOM 837 CB PRO M 80 37.521 -16.605 -4.308 1.00 0.00 C ATOM 838 CG PRO M 80 36.665 -17.064 -5.488 1.00 0.00 C ATOM 839 CD PRO M 80 35.600 -17.944 -4.830 1.00 0.00 C ATOM 0 HA PRO M 80 37.014 -16.720 -2.197 1.00 0.00 H new ATOM 0 HB2 PRO M 80 37.996 -15.645 -4.508 1.00 0.00 H new ATOM 0 HB3 PRO M 80 38.318 -17.316 -4.092 1.00 0.00 H new ATOM 0 HG2 PRO M 80 36.220 -16.220 -6.014 1.00 0.00 H new ATOM 0 HG3 PRO M 80 37.252 -17.621 -6.218 1.00 0.00 H new ATOM 0 HD2 PRO M 80 34.648 -17.860 -5.354 1.00 0.00 H new ATOM 0 HD3 PRO M 80 35.889 -18.994 -4.862 1.00 0.00 H new ATOM 844 N LEU M 81 36.069 -14.555 -1.756 1.00 0.00 N ATOM 845 CA LEU M 81 35.665 -13.194 -1.367 1.00 0.00 C ATOM 846 C LEU M 81 36.495 -12.679 -0.171 1.00 0.00 C ATOM 847 O LEU M 81 37.240 -13.435 0.459 1.00 0.00 O ATOM 848 CB LEU M 81 34.132 -13.127 -1.139 1.00 0.00 C ATOM 849 CG LEU M 81 33.458 -14.252 -0.319 1.00 0.00 C ATOM 850 CD1 LEU M 81 33.958 -14.345 1.124 1.00 0.00 C ATOM 851 CD2 LEU M 81 31.944 -14.029 -0.286 1.00 0.00 C ATOM 0 H LEU M 81 36.471 -15.077 -0.977 1.00 0.00 H new ATOM 0 HA LEU M 81 35.885 -12.510 -2.187 1.00 0.00 H new ATOM 0 HB2 LEU M 81 33.911 -12.180 -0.647 1.00 0.00 H new ATOM 0 HB3 LEU M 81 33.652 -13.097 -2.117 1.00 0.00 H new ATOM 0 HG LEU M 81 33.718 -15.185 -0.818 1.00 0.00 H new ATOM 0 HD11 LEU M 81 33.441 -15.156 1.637 1.00 0.00 H new ATOM 0 HD12 LEU M 81 35.030 -14.540 1.126 1.00 0.00 H new ATOM 0 HD13 LEU M 81 33.760 -13.405 1.639 1.00 0.00 H new ATOM 0 HD21 LEU M 81 31.472 -14.823 0.292 1.00 0.00 H new ATOM 0 HD22 LEU M 81 31.728 -13.066 0.176 1.00 0.00 H new ATOM 0 HD23 LEU M 81 31.552 -14.039 -1.303 1.00 0.00 H new ATOM 862 N SER M 82 36.377 -11.381 0.127 1.00 0.00 N ATOM 863 CA SER M 82 37.167 -10.676 1.161 1.00 0.00 C ATOM 864 C SER M 82 36.305 -9.782 2.081 1.00 0.00 C ATOM 865 O SER M 82 36.823 -8.993 2.879 1.00 0.00 O ATOM 866 CB SER M 82 38.287 -9.886 0.467 1.00 0.00 C ATOM 867 OG SER M 82 39.366 -9.627 1.350 1.00 0.00 O ATOM 0 H SER M 82 35.715 -10.770 -0.352 1.00 0.00 H new ATOM 0 HA SER M 82 37.603 -11.418 1.829 1.00 0.00 H new ATOM 0 HB2 SER M 82 38.648 -10.446 -0.395 1.00 0.00 H new ATOM 0 HB3 SER M 82 37.889 -8.943 0.091 1.00 0.00 H new ATOM 0 HG SER M 82 39.017 -9.314 2.210 1.00 0.00 H new ATOM 872 N SER M 83 34.978 -9.905 1.987 1.00 0.00 N ATOM 873 CA SER M 83 33.991 -9.215 2.836 1.00 0.00 C ATOM 874 C SER M 83 32.708 -10.050 2.986 1.00 0.00 C ATOM 875 O SER M 83 32.522 -11.061 2.302 1.00 0.00 O ATOM 876 CB SER M 83 33.666 -7.825 2.261 1.00 0.00 C ATOM 877 OG SER M 83 32.974 -7.927 1.026 1.00 0.00 O ATOM 0 H SER M 83 34.541 -10.510 1.292 1.00 0.00 H new ATOM 0 HA SER M 83 34.428 -9.090 3.827 1.00 0.00 H new ATOM 0 HB2 SER M 83 33.060 -7.266 2.975 1.00 0.00 H new ATOM 0 HB3 SER M 83 34.589 -7.263 2.118 1.00 0.00 H new ATOM 0 HG SER M 83 32.779 -7.029 0.685 1.00 0.00 H new ATOM 882 N ASN M 84 31.803 -9.635 3.880 1.00 0.00 N ATOM 883 CA ASN M 84 30.524 -10.312 4.137 1.00 0.00 C ATOM 884 C ASN M 84 29.395 -9.872 3.179 1.00 0.00 C ATOM 885 O ASN M 84 28.261 -10.331 3.310 1.00 0.00 O ATOM 886 CB ASN M 84 30.146 -10.111 5.619 1.00 0.00 C ATOM 887 CG ASN M 84 29.677 -8.704 5.976 1.00 0.00 C ATOM 888 OD1 ASN M 84 30.115 -7.700 5.425 1.00 0.00 O ATOM 889 ND2 ASN M 84 28.770 -8.585 6.914 1.00 0.00 N ATOM 0 H ASN M 84 31.940 -8.805 4.456 1.00 0.00 H new ATOM 0 HA ASN M 84 30.652 -11.376 3.936 1.00 0.00 H new ATOM 0 HB2 ASN M 84 29.357 -10.818 5.877 1.00 0.00 H new ATOM 0 HB3 ASN M 84 31.010 -10.358 6.236 1.00 0.00 H new ATOM 0 HD21 ASN M 84 28.432 -7.661 7.182 1.00 0.00 H new ATOM 0 HD22 ASN M 84 28.402 -9.417 7.376 1.00 0.00 H new ATOM 895 N MET M 85 29.671 -8.971 2.231 1.00 0.00 N ATOM 896 CA MET M 85 28.686 -8.483 1.267 1.00 0.00 C ATOM 897 C MET M 85 28.569 -9.431 0.066 1.00 0.00 C ATOM 898 O MET M 85 29.567 -9.753 -0.581 1.00 0.00 O ATOM 899 CB MET M 85 29.062 -7.053 0.859 1.00 0.00 C ATOM 900 CG MET M 85 27.958 -6.366 0.047 1.00 0.00 C ATOM 901 SD MET M 85 27.866 -4.573 0.314 1.00 0.00 S ATOM 902 CE MET M 85 27.075 -4.566 1.951 1.00 0.00 C ATOM 0 H MET M 85 30.596 -8.557 2.112 1.00 0.00 H new ATOM 0 HA MET M 85 27.697 -8.460 1.724 1.00 0.00 H new ATOM 0 HB2 MET M 85 29.270 -6.466 1.754 1.00 0.00 H new ATOM 0 HB3 MET M 85 29.980 -7.075 0.272 1.00 0.00 H new ATOM 0 HG2 MET M 85 28.125 -6.559 -1.013 1.00 0.00 H new ATOM 0 HG3 MET M 85 26.998 -6.813 0.305 1.00 0.00 H new ATOM 0 HE1 MET M 85 26.038 -4.246 1.852 1.00 0.00 H new ATOM 0 HE2 MET M 85 27.106 -5.570 2.375 1.00 0.00 H new ATOM 0 HE3 MET M 85 27.606 -3.878 2.609 1.00 0.00 H new ATOM 910 N ILE M 86 27.339 -9.853 -0.252 1.00 0.00 N ATOM 911 CA ILE M 86 27.045 -10.870 -1.275 1.00 0.00 C ATOM 912 C ILE M 86 26.306 -10.248 -2.462 1.00 0.00 C ATOM 913 O ILE M 86 25.124 -9.913 -2.371 1.00 0.00 O ATOM 914 CB ILE M 86 26.261 -12.052 -0.657 1.00 0.00 C ATOM 915 CG1 ILE M 86 26.941 -12.651 0.596 1.00 0.00 C ATOM 916 CG2 ILE M 86 26.001 -13.150 -1.701 1.00 0.00 C ATOM 917 CD1 ILE M 86 28.413 -13.065 0.424 1.00 0.00 C ATOM 0 H ILE M 86 26.501 -9.491 0.203 1.00 0.00 H new ATOM 0 HA ILE M 86 27.986 -11.267 -1.655 1.00 0.00 H new ATOM 0 HB ILE M 86 25.308 -11.638 -0.328 1.00 0.00 H new ATOM 0 HG12 ILE M 86 26.880 -11.921 1.403 1.00 0.00 H new ATOM 0 HG13 ILE M 86 26.372 -13.525 0.913 1.00 0.00 H new ATOM 0 HG21 ILE M 86 25.448 -13.968 -1.239 1.00 0.00 H new ATOM 0 HG22 ILE M 86 25.418 -12.738 -2.525 1.00 0.00 H new ATOM 0 HG23 ILE M 86 26.952 -13.524 -2.081 1.00 0.00 H new ATOM 0 HD11 ILE M 86 28.789 -13.471 1.363 1.00 0.00 H new ATOM 0 HD12 ILE M 86 28.489 -13.823 -0.356 1.00 0.00 H new ATOM 0 HD13 ILE M 86 29.005 -12.194 0.143 1.00 0.00 H new ATOM 928 N GLU M 87 27.023 -10.057 -3.573 1.00 0.00 N ATOM 929 CA GLU M 87 26.460 -9.575 -4.842 1.00 0.00 C ATOM 930 C GLU M 87 25.681 -10.658 -5.616 1.00 0.00 C ATOM 931 O GLU M 87 25.796 -11.853 -5.336 1.00 0.00 O ATOM 932 CB GLU M 87 27.570 -8.963 -5.717 1.00 0.00 C ATOM 933 CG GLU M 87 28.637 -9.935 -6.228 1.00 0.00 C ATOM 934 CD GLU M 87 29.580 -9.228 -7.219 1.00 0.00 C ATOM 935 OE1 GLU M 87 29.252 -9.176 -8.429 1.00 0.00 O ATOM 936 OE2 GLU M 87 30.647 -8.718 -6.799 1.00 0.00 O ATOM 0 H GLU M 87 28.026 -10.235 -3.619 1.00 0.00 H new ATOM 0 HA GLU M 87 25.731 -8.805 -4.591 1.00 0.00 H new ATOM 0 HB2 GLU M 87 27.103 -8.483 -6.577 1.00 0.00 H new ATOM 0 HB3 GLU M 87 28.066 -8.179 -5.144 1.00 0.00 H new ATOM 0 HG2 GLU M 87 29.211 -10.329 -5.389 1.00 0.00 H new ATOM 0 HG3 GLU M 87 28.160 -10.785 -6.715 1.00 0.00 H new ATOM 941 N ARG M 88 24.932 -10.243 -6.650 1.00 0.00 N ATOM 942 CA ARG M 88 24.182 -11.153 -7.536 1.00 0.00 C ATOM 943 C ARG M 88 25.079 -12.230 -8.121 1.00 0.00 C ATOM 944 O ARG M 88 24.720 -13.398 -8.081 1.00 0.00 O ATOM 945 CB ARG M 88 23.515 -10.350 -8.671 1.00 0.00 C ATOM 946 CG ARG M 88 22.800 -11.282 -9.669 1.00 0.00 C ATOM 947 CD ARG M 88 22.045 -10.517 -10.757 1.00 0.00 C ATOM 948 NE ARG M 88 21.890 -11.373 -11.946 1.00 0.00 N ATOM 949 CZ ARG M 88 21.133 -11.184 -13.007 1.00 0.00 C ATOM 950 NH1 ARG M 88 20.328 -10.165 -13.133 1.00 0.00 N ATOM 951 NH2 ARG M 88 21.194 -12.058 -13.966 1.00 0.00 N ATOM 0 H ARG M 88 24.828 -9.259 -6.898 1.00 0.00 H new ATOM 0 HA ARG M 88 23.416 -11.646 -6.938 1.00 0.00 H new ATOM 0 HB2 ARG M 88 22.798 -9.646 -8.249 1.00 0.00 H new ATOM 0 HB3 ARG M 88 24.268 -9.762 -9.195 1.00 0.00 H new ATOM 0 HG2 ARG M 88 23.534 -11.939 -10.136 1.00 0.00 H new ATOM 0 HG3 ARG M 88 22.101 -11.919 -9.127 1.00 0.00 H new ATOM 0 HD2 ARG M 88 21.067 -10.210 -10.387 1.00 0.00 H new ATOM 0 HD3 ARG M 88 22.586 -9.608 -11.019 1.00 0.00 H new ATOM 0 HE ARG M 88 22.445 -12.229 -11.948 1.00 0.00 H new ATOM 0 HH11 ARG M 88 20.265 -9.470 -12.389 1.00 0.00 H new ATOM 0 HH12 ARG M 88 19.762 -10.063 -13.975 1.00 0.00 H new ATOM 0 HH21 ARG M 88 21.816 -12.862 -13.884 1.00 0.00 H new ATOM 0 HH22 ARG M 88 20.620 -11.940 -14.801 1.00 0.00 H new ATOM 962 N SER M 89 26.242 -11.844 -8.643 1.00 0.00 N ATOM 963 CA SER M 89 27.175 -12.742 -9.336 1.00 0.00 C ATOM 964 C SER M 89 27.634 -13.922 -8.464 1.00 0.00 C ATOM 965 O SER M 89 27.866 -15.020 -8.968 1.00 0.00 O ATOM 966 CB SER M 89 28.407 -11.960 -9.815 1.00 0.00 C ATOM 967 OG SER M 89 28.087 -10.667 -10.305 1.00 0.00 O ATOM 0 H SER M 89 26.572 -10.880 -8.597 1.00 0.00 H new ATOM 0 HA SER M 89 26.631 -13.155 -10.186 1.00 0.00 H new ATOM 0 HB2 SER M 89 29.114 -11.865 -8.990 1.00 0.00 H new ATOM 0 HB3 SER M 89 28.907 -12.527 -10.600 1.00 0.00 H new ATOM 0 HG SER M 89 28.429 -9.989 -9.686 1.00 0.00 H new ATOM 972 N VAL M 90 27.727 -13.704 -7.144 1.00 0.00 N ATOM 973 CA VAL M 90 28.047 -14.734 -6.141 1.00 0.00 C ATOM 974 C VAL M 90 26.878 -15.714 -5.954 1.00 0.00 C ATOM 975 O VAL M 90 27.080 -16.929 -5.937 1.00 0.00 O ATOM 976 CB VAL M 90 28.441 -14.043 -4.817 1.00 0.00 C ATOM 977 CG1 VAL M 90 28.716 -15.035 -3.685 1.00 0.00 C ATOM 978 CG2 VAL M 90 29.715 -13.200 -4.985 1.00 0.00 C ATOM 0 H VAL M 90 27.578 -12.783 -6.732 1.00 0.00 H new ATOM 0 HA VAL M 90 28.892 -15.329 -6.489 1.00 0.00 H new ATOM 0 HB VAL M 90 27.584 -13.421 -4.559 1.00 0.00 H new ATOM 0 HG11 VAL M 90 28.988 -14.490 -2.781 1.00 0.00 H new ATOM 0 HG12 VAL M 90 27.821 -15.628 -3.496 1.00 0.00 H new ATOM 0 HG13 VAL M 90 29.535 -15.695 -3.971 1.00 0.00 H new ATOM 0 HG21 VAL M 90 29.966 -12.727 -4.036 1.00 0.00 H new ATOM 0 HG22 VAL M 90 30.538 -13.843 -5.299 1.00 0.00 H new ATOM 0 HG23 VAL M 90 29.546 -12.432 -5.740 1.00 0.00 H new ATOM 988 N VAL M 91 25.638 -15.218 -5.876 1.00 0.00 N ATOM 989 CA VAL M 91 24.416 -16.053 -5.809 1.00 0.00 C ATOM 990 C VAL M 91 24.179 -16.815 -7.122 1.00 0.00 C ATOM 991 O VAL M 91 23.810 -17.989 -7.105 1.00 0.00 O ATOM 992 CB VAL M 91 23.179 -15.201 -5.467 1.00 0.00 C ATOM 993 CG1 VAL M 91 21.917 -16.061 -5.339 1.00 0.00 C ATOM 994 CG2 VAL M 91 23.363 -14.473 -4.130 1.00 0.00 C ATOM 0 H VAL M 91 25.444 -14.217 -5.857 1.00 0.00 H new ATOM 0 HA VAL M 91 24.571 -16.782 -5.013 1.00 0.00 H new ATOM 0 HB VAL M 91 23.068 -14.488 -6.284 1.00 0.00 H new ATOM 0 HG11 VAL M 91 21.066 -15.424 -5.097 1.00 0.00 H new ATOM 0 HG12 VAL M 91 21.730 -16.575 -6.282 1.00 0.00 H new ATOM 0 HG13 VAL M 91 22.057 -16.796 -4.547 1.00 0.00 H new ATOM 0 HG21 VAL M 91 22.475 -13.879 -3.914 1.00 0.00 H new ATOM 0 HG22 VAL M 91 23.513 -15.204 -3.335 1.00 0.00 H new ATOM 0 HG23 VAL M 91 24.232 -13.818 -4.189 1.00 0.00 H new ATOM 1004 N GLU M 92 24.441 -16.172 -8.261 1.00 0.00 N ATOM 1005 CA GLU M 92 24.314 -16.721 -9.619 1.00 0.00 C ATOM 1006 C GLU M 92 25.220 -17.950 -9.857 1.00 0.00 C ATOM 1007 O GLU M 92 24.950 -18.763 -10.742 1.00 0.00 O ATOM 1008 CB GLU M 92 24.605 -15.596 -10.629 1.00 0.00 C ATOM 1009 CG GLU M 92 24.010 -15.822 -12.022 1.00 0.00 C ATOM 1010 CD GLU M 92 24.175 -14.569 -12.903 1.00 0.00 C ATOM 1011 OE1 GLU M 92 25.241 -14.419 -13.550 1.00 0.00 O ATOM 1012 OE2 GLU M 92 23.243 -13.726 -12.958 1.00 0.00 O ATOM 0 H GLU M 92 24.764 -15.205 -8.265 1.00 0.00 H new ATOM 0 HA GLU M 92 23.296 -17.086 -9.753 1.00 0.00 H new ATOM 0 HB2 GLU M 92 24.218 -14.658 -10.230 1.00 0.00 H new ATOM 0 HB3 GLU M 92 25.685 -15.480 -10.724 1.00 0.00 H new ATOM 0 HG2 GLU M 92 24.500 -16.672 -12.497 1.00 0.00 H new ATOM 0 HG3 GLU M 92 22.953 -16.072 -11.934 1.00 0.00 H new ATOM 1017 N ALA M 93 26.258 -18.111 -9.028 1.00 0.00 N ATOM 1018 CA ALA M 93 27.160 -19.261 -8.986 1.00 0.00 C ATOM 1019 C ALA M 93 26.798 -20.251 -7.853 1.00 0.00 C ATOM 1020 O ALA M 93 26.936 -21.461 -8.029 1.00 0.00 O ATOM 1021 CB ALA M 93 28.592 -18.730 -8.827 1.00 0.00 C ATOM 0 H ALA M 93 26.501 -17.404 -8.334 1.00 0.00 H new ATOM 0 HA ALA M 93 27.066 -19.827 -9.913 1.00 0.00 H new ATOM 0 HB1 ALA M 93 29.289 -19.567 -8.793 1.00 0.00 H new ATOM 0 HB2 ALA M 93 28.838 -18.088 -9.673 1.00 0.00 H new ATOM 0 HB3 ALA M 93 28.667 -18.157 -7.903 1.00 0.00 H new ATOM 1027 N ALA M 94 26.280 -19.772 -6.712 1.00 0.00 N ATOM 1028 CA ALA M 94 25.796 -20.608 -5.601 1.00 0.00 C ATOM 1029 C ALA M 94 24.551 -21.442 -5.953 1.00 0.00 C ATOM 1030 O ALA M 94 24.434 -22.602 -5.553 1.00 0.00 O ATOM 1031 CB ALA M 94 25.506 -19.688 -4.408 1.00 0.00 C ATOM 0 H ALA M 94 26.184 -18.773 -6.531 1.00 0.00 H new ATOM 0 HA ALA M 94 26.573 -21.334 -5.362 1.00 0.00 H new ATOM 0 HB1 ALA M 94 25.145 -20.283 -3.569 1.00 0.00 H new ATOM 0 HB2 ALA M 94 26.420 -19.169 -4.118 1.00 0.00 H new ATOM 0 HB3 ALA M 94 24.747 -18.958 -4.688 1.00 0.00 H new ATOM 1037 N VAL M 95 23.631 -20.881 -6.745 1.00 0.00 N ATOM 1038 CA VAL M 95 22.422 -21.579 -7.233 1.00 0.00 C ATOM 1039 C VAL M 95 22.751 -22.819 -8.085 1.00 0.00 C ATOM 1040 O VAL M 95 21.997 -23.790 -8.082 1.00 0.00 O ATOM 1041 CB VAL M 95 21.508 -20.589 -7.981 1.00 0.00 C ATOM 1042 CG1 VAL M 95 22.080 -20.174 -9.340 1.00 0.00 C ATOM 1043 CG2 VAL M 95 20.095 -21.140 -8.185 1.00 0.00 C ATOM 0 H VAL M 95 23.700 -19.918 -7.073 1.00 0.00 H new ATOM 0 HA VAL M 95 21.885 -21.958 -6.364 1.00 0.00 H new ATOM 0 HB VAL M 95 21.456 -19.710 -7.338 1.00 0.00 H new ATOM 0 HG11 VAL M 95 21.397 -19.476 -9.825 1.00 0.00 H new ATOM 0 HG12 VAL M 95 23.048 -19.693 -9.196 1.00 0.00 H new ATOM 0 HG13 VAL M 95 22.203 -21.056 -9.968 1.00 0.00 H new ATOM 0 HG21 VAL M 95 19.491 -20.405 -8.716 1.00 0.00 H new ATOM 0 HG22 VAL M 95 20.144 -22.059 -8.768 1.00 0.00 H new ATOM 0 HG23 VAL M 95 19.642 -21.349 -7.216 1.00 0.00 H new ATOM 1053 N GLN M 96 23.911 -22.824 -8.753 1.00 0.00 N ATOM 1054 CA GLN M 96 24.395 -23.918 -9.616 1.00 0.00 C ATOM 1055 C GLN M 96 24.755 -25.198 -8.834 1.00 0.00 C ATOM 1056 O GLN M 96 24.805 -26.283 -9.416 1.00 0.00 O ATOM 1057 CB GLN M 96 25.623 -23.456 -10.426 1.00 0.00 C ATOM 1058 CG GLN M 96 25.483 -22.090 -11.125 1.00 0.00 C ATOM 1059 CD GLN M 96 24.376 -22.019 -12.178 1.00 0.00 C ATOM 1060 OE1 GLN M 96 23.972 -23.000 -12.791 1.00 0.00 O ATOM 1061 NE2 GLN M 96 23.840 -20.844 -12.427 1.00 0.00 N ATOM 0 H GLN M 96 24.564 -22.041 -8.709 1.00 0.00 H new ATOM 0 HA GLN M 96 23.569 -24.167 -10.283 1.00 0.00 H new ATOM 0 HB2 GLN M 96 26.483 -23.416 -9.757 1.00 0.00 H new ATOM 0 HB3 GLN M 96 25.842 -24.210 -11.182 1.00 0.00 H new ATOM 0 HG2 GLN M 96 25.295 -21.328 -10.369 1.00 0.00 H new ATOM 0 HG3 GLN M 96 26.432 -21.841 -11.599 1.00 0.00 H new ATOM 0 HE21 GLN M 96 24.166 -20.018 -11.925 1.00 0.00 H new ATOM 0 HE22 GLN M 96 23.099 -20.759 -13.122 1.00 0.00 H new ATOM 1068 N GLU M 97 24.990 -25.085 -7.521 1.00 0.00 N ATOM 1069 CA GLU M 97 25.319 -26.201 -6.618 1.00 0.00 C ATOM 1070 C GLU M 97 24.214 -26.495 -5.589 1.00 0.00 C ATOM 1071 O GLU M 97 24.283 -27.504 -4.879 1.00 0.00 O ATOM 1072 CB GLU M 97 26.626 -25.898 -5.876 1.00 0.00 C ATOM 1073 CG GLU M 97 27.833 -25.792 -6.820 1.00 0.00 C ATOM 1074 CD GLU M 97 29.143 -25.696 -6.021 1.00 0.00 C ATOM 1075 OE1 GLU M 97 29.733 -24.592 -5.927 1.00 0.00 O ATOM 1076 OE2 GLU M 97 29.596 -26.733 -5.473 1.00 0.00 O ATOM 0 H GLU M 97 24.956 -24.186 -7.040 1.00 0.00 H new ATOM 0 HA GLU M 97 25.422 -27.087 -7.244 1.00 0.00 H new ATOM 0 HB2 GLU M 97 26.518 -24.964 -5.325 1.00 0.00 H new ATOM 0 HB3 GLU M 97 26.812 -26.682 -5.142 1.00 0.00 H new ATOM 0 HG2 GLU M 97 27.865 -26.662 -7.476 1.00 0.00 H new ATOM 0 HG3 GLU M 97 27.726 -24.915 -7.458 1.00 0.00 H new ATOM 1081 N SER M 98 23.188 -25.638 -5.517 1.00 0.00 N ATOM 1082 CA SER M 98 22.098 -25.725 -4.529 1.00 0.00 C ATOM 1083 C SER M 98 20.695 -25.891 -5.141 1.00 0.00 C ATOM 1084 O SER M 98 19.707 -25.958 -4.401 1.00 0.00 O ATOM 1085 CB SER M 98 22.159 -24.527 -3.577 1.00 0.00 C ATOM 1086 OG SER M 98 22.121 -23.295 -4.273 1.00 0.00 O ATOM 0 H SER M 98 23.088 -24.848 -6.155 1.00 0.00 H new ATOM 0 HA SER M 98 22.263 -26.645 -3.969 1.00 0.00 H new ATOM 0 HB2 SER M 98 21.323 -24.575 -2.879 1.00 0.00 H new ATOM 0 HB3 SER M 98 23.072 -24.581 -2.984 1.00 0.00 H new ATOM 0 HG SER M 98 22.985 -23.139 -4.709 1.00 0.00 H new ATOM 1091 N SER M 99 20.593 -25.995 -6.476 1.00 0.00 N ATOM 1092 CA SER M 99 19.362 -26.267 -7.249 1.00 0.00 C ATOM 1093 C SER M 99 19.599 -27.275 -8.378 1.00 0.00 C ATOM 1094 O SER M 99 20.599 -27.150 -9.122 1.00 0.00 O ATOM 1095 CB SER M 99 18.784 -24.981 -7.845 1.00 0.00 C ATOM 1096 OG SER M 99 18.489 -24.066 -6.804 1.00 0.00 O ATOM 1097 OXT SER M 99 18.770 -28.206 -8.518 1.00 0.00 O ATOM 0 H SER M 99 21.408 -25.887 -7.080 1.00 0.00 H new ATOM 0 HA SER M 99 18.650 -26.695 -6.544 1.00 0.00 H new ATOM 0 HB2 SER M 99 19.497 -24.538 -8.541 1.00 0.00 H new ATOM 0 HB3 SER M 99 17.881 -25.205 -8.413 1.00 0.00 H new ATOM 0 HG SER M 99 18.121 -23.243 -7.187 1.00 0.00 H new TER 1102 SER M 99