USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 613 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 114 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00706) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -15:sc= -0.464 USER MOD Single : A 88 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0329) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0272) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HE2:sc= -0.858 K(o=-0.86,f=-3!) USER MOD Single : A 102 TYR OH : rot 92:sc= 1.21 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= -0.0117 (180deg=-0.0117) USER MOD Single : A 115 SER OG : rot -103:sc= 0.251 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 86:sc= 0.315 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -145:sc= 0.0743 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -114:sc= -0.367 (180deg=-2!) USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 72 25.491 -10.466 11.681 1.00 0.00 N ATOM 2 CA ARG A 72 25.453 -9.137 12.279 1.00 0.00 C ATOM 3 C ARG A 72 25.933 -9.178 13.727 1.00 0.00 C ATOM 4 O ARG A 72 25.127 -9.236 14.657 1.00 0.00 O ATOM 5 CB ARG A 72 24.035 -8.567 12.216 1.00 0.00 C ATOM 6 CG ARG A 72 22.949 -9.629 12.279 1.00 0.00 C ATOM 7 CD ARG A 72 21.561 -9.010 12.213 1.00 0.00 C ATOM 8 NE ARG A 72 21.251 -8.503 10.879 1.00 0.00 N ATOM 9 CZ ARG A 72 20.089 -7.944 10.556 1.00 0.00 C ATOM 10 NH1 ARG A 72 19.134 -7.822 11.467 1.00 0.00 N ATOM 11 NH2 ARG A 72 19.882 -7.507 9.321 1.00 0.00 N ATOM 0 HA ARG A 72 26.123 -8.491 11.711 1.00 0.00 H new ATOM 0 HB2 ARG A 72 23.896 -7.868 13.041 1.00 0.00 H new ATOM 0 HB3 ARG A 72 23.922 -7.998 11.293 1.00 0.00 H new ATOM 0 HG2 ARG A 72 23.076 -10.330 11.454 1.00 0.00 H new ATOM 0 HG3 ARG A 72 23.050 -10.201 13.202 1.00 0.00 H new ATOM 0 HD2 ARG A 72 20.818 -9.754 12.500 1.00 0.00 H new ATOM 0 HD3 ARG A 72 21.492 -8.196 12.935 1.00 0.00 H new ATOM 0 HE ARG A 72 21.965 -8.582 10.155 1.00 0.00 H new ATOM 0 HH11 ARG A 72 19.290 -8.157 12.418 1.00 0.00 H new ATOM 0 HH12 ARG A 72 18.243 -7.393 11.217 1.00 0.00 H new ATOM 0 HH21 ARG A 72 20.615 -7.600 8.618 1.00 0.00 H new ATOM 0 HH22 ARG A 72 18.990 -7.078 9.075 1.00 0.00 H new ATOM 25 N ARG A 73 27.249 -9.148 13.910 1.00 0.00 N ATOM 26 CA ARG A 73 27.835 -9.183 15.244 1.00 0.00 C ATOM 27 C ARG A 73 26.992 -8.381 16.230 1.00 0.00 C ATOM 28 O ARG A 73 26.912 -8.718 17.411 1.00 0.00 O ATOM 29 CB ARG A 73 29.263 -8.634 15.212 1.00 0.00 C ATOM 30 CG ARG A 73 29.349 -7.190 14.745 1.00 0.00 C ATOM 31 CD ARG A 73 30.734 -6.609 14.982 1.00 0.00 C ATOM 32 NE ARG A 73 30.894 -6.114 16.347 1.00 0.00 N ATOM 33 CZ ARG A 73 32.069 -5.805 16.884 1.00 0.00 C ATOM 34 NH1 ARG A 73 33.181 -5.940 16.175 1.00 0.00 N ATOM 35 NH2 ARG A 73 32.133 -5.360 18.132 1.00 0.00 N ATOM 0 H ARG A 73 27.929 -9.100 13.151 1.00 0.00 H new ATOM 0 HA ARG A 73 27.860 -10.221 15.575 1.00 0.00 H new ATOM 0 HB2 ARG A 73 29.695 -8.711 16.210 1.00 0.00 H new ATOM 0 HB3 ARG A 73 29.868 -9.257 14.553 1.00 0.00 H new ATOM 0 HG2 ARG A 73 29.107 -7.135 13.684 1.00 0.00 H new ATOM 0 HG3 ARG A 73 28.607 -6.591 15.273 1.00 0.00 H new ATOM 0 HD2 ARG A 73 31.486 -7.372 14.783 1.00 0.00 H new ATOM 0 HD3 ARG A 73 30.911 -5.796 14.278 1.00 0.00 H new ATOM 0 HE ARG A 73 30.057 -5.999 16.919 1.00 0.00 H new ATOM 0 HH11 ARG A 73 33.135 -6.282 15.215 1.00 0.00 H new ATOM 0 HH12 ARG A 73 34.082 -5.702 16.589 1.00 0.00 H new ATOM 0 HH21 ARG A 73 31.279 -5.255 18.680 1.00 0.00 H new ATOM 0 HH22 ARG A 73 33.036 -5.123 18.543 1.00 0.00 H new ATOM 49 N GLU A 74 26.366 -7.317 15.737 1.00 0.00 N ATOM 50 CA GLU A 74 25.530 -6.466 16.576 1.00 0.00 C ATOM 51 C GLU A 74 24.347 -7.250 17.138 1.00 0.00 C ATOM 52 O GLU A 74 24.089 -8.384 16.733 1.00 0.00 O ATOM 53 CB GLU A 74 25.025 -5.263 15.777 1.00 0.00 C ATOM 54 CG GLU A 74 26.104 -4.236 15.475 1.00 0.00 C ATOM 55 CD GLU A 74 27.075 -4.707 14.410 1.00 0.00 C ATOM 56 OE1 GLU A 74 26.685 -5.564 13.589 1.00 0.00 O ATOM 57 OE2 GLU A 74 28.225 -4.219 14.397 1.00 0.00 O ATOM 0 H GLU A 74 26.422 -7.024 14.762 1.00 0.00 H new ATOM 0 HA GLU A 74 26.137 -6.111 17.409 1.00 0.00 H new ATOM 0 HB2 GLU A 74 24.597 -5.615 14.838 1.00 0.00 H new ATOM 0 HB3 GLU A 74 24.221 -4.780 16.333 1.00 0.00 H new ATOM 0 HG2 GLU A 74 25.636 -3.307 15.149 1.00 0.00 H new ATOM 0 HG3 GLU A 74 26.654 -4.012 16.389 1.00 0.00 H new ATOM 64 N THR A 75 23.631 -6.637 18.075 1.00 0.00 N ATOM 65 CA THR A 75 22.477 -7.276 18.695 1.00 0.00 C ATOM 66 C THR A 75 21.232 -6.405 18.569 1.00 0.00 C ATOM 67 O THR A 75 21.181 -5.296 19.102 1.00 0.00 O ATOM 68 CB THR A 75 22.733 -7.574 20.185 1.00 0.00 C ATOM 69 OG1 THR A 75 21.550 -8.112 20.787 1.00 0.00 O ATOM 70 CG2 THR A 75 23.155 -6.313 20.924 1.00 0.00 C ATOM 0 H THR A 75 23.830 -5.698 18.421 1.00 0.00 H new ATOM 0 HA THR A 75 22.314 -8.215 18.167 1.00 0.00 H new ATOM 0 HB THR A 75 23.540 -8.304 20.254 1.00 0.00 H new ATOM 0 HG1 THR A 75 21.721 -8.300 21.733 1.00 0.00 H new ATOM 0 HG21 THR A 75 23.330 -6.548 21.974 1.00 0.00 H new ATOM 0 HG22 THR A 75 24.071 -5.922 20.482 1.00 0.00 H new ATOM 0 HG23 THR A 75 22.366 -5.565 20.846 1.00 0.00 H new ATOM 78 N THR A 76 20.229 -6.913 17.861 1.00 0.00 N ATOM 79 CA THR A 76 18.984 -6.181 17.665 1.00 0.00 C ATOM 80 C THR A 76 17.951 -7.038 16.942 1.00 0.00 C ATOM 81 O THR A 76 18.140 -7.409 15.783 1.00 0.00 O ATOM 82 CB THR A 76 19.214 -4.887 16.863 1.00 0.00 C ATOM 83 OG1 THR A 76 17.957 -4.324 16.470 1.00 0.00 O ATOM 84 CG2 THR A 76 20.062 -5.158 15.629 1.00 0.00 C ATOM 0 H THR A 76 20.254 -7.829 17.413 1.00 0.00 H new ATOM 0 HA THR A 76 18.609 -5.923 18.655 1.00 0.00 H new ATOM 0 HB THR A 76 19.745 -4.180 17.501 1.00 0.00 H new ATOM 0 HG1 THR A 76 18.112 -3.501 15.962 1.00 0.00 H new ATOM 0 HG21 THR A 76 20.211 -4.229 15.079 1.00 0.00 H new ATOM 0 HG22 THR A 76 21.029 -5.559 15.933 1.00 0.00 H new ATOM 0 HG23 THR A 76 19.554 -5.881 14.990 1.00 0.00 H new ATOM 92 N ASP A 77 16.858 -7.347 17.631 1.00 0.00 N ATOM 93 CA ASP A 77 15.793 -8.158 17.053 1.00 0.00 C ATOM 94 C ASP A 77 14.503 -7.353 16.928 1.00 0.00 C ATOM 95 O ASP A 77 13.865 -7.027 17.929 1.00 0.00 O ATOM 96 CB ASP A 77 15.551 -9.403 17.907 1.00 0.00 C ATOM 97 CG ASP A 77 14.512 -10.327 17.302 1.00 0.00 C ATOM 98 OD1 ASP A 77 14.641 -10.662 16.106 1.00 0.00 O ATOM 99 OD2 ASP A 77 13.569 -10.714 18.024 1.00 0.00 O ATOM 0 H ASP A 77 16.686 -7.048 18.591 1.00 0.00 H new ATOM 0 HA ASP A 77 16.105 -8.466 16.055 1.00 0.00 H new ATOM 0 HB2 ASP A 77 16.489 -9.945 18.028 1.00 0.00 H new ATOM 0 HB3 ASP A 77 15.228 -9.100 18.903 1.00 0.00 H new ATOM 104 N ILE A 78 14.128 -7.035 15.693 1.00 0.00 N ATOM 105 CA ILE A 78 12.915 -6.268 15.438 1.00 0.00 C ATOM 106 C ILE A 78 12.886 -4.991 16.272 1.00 0.00 C ATOM 107 O ILE A 78 11.833 -4.574 16.751 1.00 0.00 O ATOM 108 CB ILE A 78 11.652 -7.095 15.742 1.00 0.00 C ATOM 109 CG1 ILE A 78 11.810 -8.521 15.212 1.00 0.00 C ATOM 110 CG2 ILE A 78 10.425 -6.431 15.134 1.00 0.00 C ATOM 111 CD1 ILE A 78 10.802 -9.494 15.785 1.00 0.00 C ATOM 0 H ILE A 78 14.646 -7.296 14.854 1.00 0.00 H new ATOM 0 HA ILE A 78 12.923 -6.008 14.380 1.00 0.00 H new ATOM 0 HB ILE A 78 11.518 -7.142 16.823 1.00 0.00 H new ATOM 0 HG12 ILE A 78 11.715 -8.509 14.126 1.00 0.00 H new ATOM 0 HG13 ILE A 78 12.815 -8.875 15.440 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.540 -7.027 15.357 1.00 0.00 H new ATOM 0 HG22 ILE A 78 10.305 -5.433 15.555 1.00 0.00 H new ATOM 0 HG23 ILE A 78 10.549 -6.357 14.054 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.974 -10.485 15.365 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.912 -9.535 16.869 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.794 -9.163 15.535 1.00 0.00 H new ATOM 123 N GLY A 79 14.052 -4.374 16.441 1.00 0.00 N ATOM 124 CA GLY A 79 14.138 -3.150 17.215 1.00 0.00 C ATOM 125 C GLY A 79 12.910 -2.276 17.056 1.00 0.00 C ATOM 126 O GLY A 79 12.014 -2.293 17.899 1.00 0.00 O ATOM 0 H GLY A 79 14.938 -4.700 16.056 1.00 0.00 H new ATOM 0 HA2 GLY A 79 14.270 -3.398 18.268 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.021 -2.590 16.907 1.00 0.00 H new ATOM 130 N GLY A 80 12.870 -1.507 15.972 1.00 0.00 N ATOM 131 CA GLY A 80 11.739 -0.631 15.726 1.00 0.00 C ATOM 132 C GLY A 80 11.667 -0.168 14.285 1.00 0.00 C ATOM 133 O GLY A 80 11.866 1.010 13.993 1.00 0.00 O ATOM 0 H GLY A 80 13.600 -1.475 15.260 1.00 0.00 H new ATOM 0 HA2 GLY A 80 10.817 -1.152 15.983 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.807 0.238 16.381 1.00 0.00 H new ATOM 137 N GLY A 81 11.382 -1.099 13.379 1.00 0.00 N ATOM 138 CA GLY A 81 11.291 -0.761 11.971 1.00 0.00 C ATOM 139 C GLY A 81 10.032 -1.304 11.324 1.00 0.00 C ATOM 140 O GLY A 81 9.559 -2.384 11.679 1.00 0.00 O ATOM 0 H GLY A 81 11.213 -2.081 13.596 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.315 0.323 11.859 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.163 -1.155 11.449 1.00 0.00 H new ATOM 144 N LYS A 82 9.486 -0.553 10.374 1.00 0.00 N ATOM 145 CA LYS A 82 8.274 -0.964 9.676 1.00 0.00 C ATOM 146 C LYS A 82 8.609 -1.601 8.331 1.00 0.00 C ATOM 147 O LYS A 82 7.918 -1.377 7.337 1.00 0.00 O ATOM 148 CB LYS A 82 7.350 0.238 9.466 1.00 0.00 C ATOM 149 CG LYS A 82 8.073 1.485 8.988 1.00 0.00 C ATOM 150 CD LYS A 82 7.107 2.634 8.753 1.00 0.00 C ATOM 151 CE LYS A 82 7.839 3.961 8.626 1.00 0.00 C ATOM 152 NZ LYS A 82 8.731 3.991 7.434 1.00 0.00 N ATOM 0 H LYS A 82 9.864 0.344 10.070 1.00 0.00 H new ATOM 0 HA LYS A 82 7.764 -1.705 10.292 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.582 -0.027 8.739 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.839 0.461 10.403 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.818 1.780 9.727 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.609 1.265 8.065 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.531 2.447 7.847 1.00 0.00 H new ATOM 0 HD3 LYS A 82 6.396 2.687 9.577 1.00 0.00 H new ATOM 0 HE2 LYS A 82 7.113 4.771 8.557 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.429 4.138 9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.186 4.924 7.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.461 3.256 7.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.170 3.814 6.576 1.00 0.00 H new ATOM 166 N TYR A 83 9.671 -2.398 8.308 1.00 0.00 N ATOM 167 CA TYR A 83 10.098 -3.067 7.085 1.00 0.00 C ATOM 168 C TYR A 83 9.866 -4.572 7.178 1.00 0.00 C ATOM 169 O TYR A 83 10.406 -5.243 8.058 1.00 0.00 O ATOM 170 CB TYR A 83 11.577 -2.784 6.813 1.00 0.00 C ATOM 171 CG TYR A 83 11.953 -1.328 6.967 1.00 0.00 C ATOM 172 CD1 TYR A 83 11.010 -0.324 6.782 1.00 0.00 C ATOM 173 CD2 TYR A 83 13.250 -0.955 7.295 1.00 0.00 C ATOM 174 CE1 TYR A 83 11.349 1.009 6.920 1.00 0.00 C ATOM 175 CE2 TYR A 83 13.598 0.374 7.437 1.00 0.00 C ATOM 176 CZ TYR A 83 12.644 1.352 7.248 1.00 0.00 C ATOM 177 OH TYR A 83 12.986 2.678 7.387 1.00 0.00 O ATOM 0 H TYR A 83 10.252 -2.597 9.122 1.00 0.00 H new ATOM 0 HA TYR A 83 9.502 -2.676 6.260 1.00 0.00 H new ATOM 0 HB2 TYR A 83 12.184 -3.381 7.494 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.820 -3.108 5.801 1.00 0.00 H new ATOM 0 HD1 TYR A 83 9.995 -0.590 6.526 1.00 0.00 H new ATOM 0 HD2 TYR A 83 14.000 -1.718 7.442 1.00 0.00 H new ATOM 0 HE1 TYR A 83 10.604 1.777 6.772 1.00 0.00 H new ATOM 0 HE2 TYR A 83 14.611 0.646 7.694 1.00 0.00 H new ATOM 0 HH TYR A 83 13.935 2.748 7.621 1.00 0.00 H new ATOM 187 N THR A 84 9.058 -5.097 6.262 1.00 0.00 N ATOM 188 CA THR A 84 8.752 -6.522 6.239 1.00 0.00 C ATOM 189 C THR A 84 9.090 -7.135 4.885 1.00 0.00 C ATOM 190 O THR A 84 9.124 -8.357 4.736 1.00 0.00 O ATOM 191 CB THR A 84 7.267 -6.783 6.552 1.00 0.00 C ATOM 192 OG1 THR A 84 7.001 -8.190 6.525 1.00 0.00 O ATOM 193 CG2 THR A 84 6.370 -6.073 5.550 1.00 0.00 C ATOM 0 H THR A 84 8.604 -4.556 5.526 1.00 0.00 H new ATOM 0 HA THR A 84 9.365 -6.989 7.009 1.00 0.00 H new ATOM 0 HB THR A 84 7.054 -6.392 7.547 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.745 -8.655 6.089 1.00 0.00 H new ATOM 0 HG21 THR A 84 5.326 -6.272 5.791 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.554 -5.000 5.594 1.00 0.00 H new ATOM 0 HG23 THR A 84 6.586 -6.438 4.546 1.00 0.00 H new ATOM 201 N PHE A 85 9.339 -6.279 3.899 1.00 0.00 N ATOM 202 CA PHE A 85 9.674 -6.738 2.556 1.00 0.00 C ATOM 203 C PHE A 85 8.737 -7.857 2.113 1.00 0.00 C ATOM 204 O PHE A 85 9.172 -8.851 1.533 1.00 0.00 O ATOM 205 CB PHE A 85 11.125 -7.222 2.506 1.00 0.00 C ATOM 206 CG PHE A 85 11.537 -7.743 1.159 1.00 0.00 C ATOM 207 CD1 PHE A 85 10.830 -7.393 0.020 1.00 0.00 C ATOM 208 CD2 PHE A 85 12.632 -8.583 1.032 1.00 0.00 C ATOM 209 CE1 PHE A 85 11.207 -7.870 -1.221 1.00 0.00 C ATOM 210 CE2 PHE A 85 13.014 -9.062 -0.207 1.00 0.00 C ATOM 211 CZ PHE A 85 12.300 -8.707 -1.335 1.00 0.00 C ATOM 0 H PHE A 85 9.315 -5.265 4.005 1.00 0.00 H new ATOM 0 HA PHE A 85 9.555 -5.897 1.872 1.00 0.00 H new ATOM 0 HB2 PHE A 85 11.784 -6.400 2.786 1.00 0.00 H new ATOM 0 HB3 PHE A 85 11.263 -8.008 3.249 1.00 0.00 H new ATOM 0 HD1 PHE A 85 9.974 -6.740 0.103 1.00 0.00 H new ATOM 0 HD2 PHE A 85 13.193 -8.866 1.910 1.00 0.00 H new ATOM 0 HE1 PHE A 85 10.648 -7.589 -2.101 1.00 0.00 H new ATOM 0 HE2 PHE A 85 13.871 -9.714 -0.293 1.00 0.00 H new ATOM 0 HZ PHE A 85 12.596 -9.083 -2.303 1.00 0.00 H new ATOM 221 N GLU A 86 7.448 -7.687 2.392 1.00 0.00 N ATOM 222 CA GLU A 86 6.449 -8.684 2.024 1.00 0.00 C ATOM 223 C GLU A 86 5.383 -8.076 1.118 1.00 0.00 C ATOM 224 O GLU A 86 4.737 -8.781 0.341 1.00 0.00 O ATOM 225 CB GLU A 86 5.796 -9.270 3.278 1.00 0.00 C ATOM 226 CG GLU A 86 6.655 -10.305 3.985 1.00 0.00 C ATOM 227 CD GLU A 86 6.128 -10.658 5.362 1.00 0.00 C ATOM 228 OE1 GLU A 86 4.893 -10.742 5.522 1.00 0.00 O ATOM 229 OE2 GLU A 86 6.953 -10.850 6.280 1.00 0.00 O ATOM 0 H GLU A 86 7.071 -6.869 2.871 1.00 0.00 H new ATOM 0 HA GLU A 86 6.952 -9.482 1.479 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.572 -8.460 3.973 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.845 -9.726 3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.704 -11.208 3.376 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.673 -9.926 4.076 1.00 0.00 H new ATOM 236 N LEU A 87 5.203 -6.764 1.224 1.00 0.00 N ATOM 237 CA LEU A 87 4.214 -6.060 0.414 1.00 0.00 C ATOM 238 C LEU A 87 4.192 -6.601 -1.012 1.00 0.00 C ATOM 239 O LEU A 87 3.140 -6.667 -1.647 1.00 0.00 O ATOM 240 CB LEU A 87 4.514 -4.560 0.399 1.00 0.00 C ATOM 241 CG LEU A 87 5.094 -3.978 1.688 1.00 0.00 C ATOM 242 CD1 LEU A 87 4.468 -4.645 2.903 1.00 0.00 C ATOM 243 CD2 LEU A 87 6.607 -4.135 1.711 1.00 0.00 C ATOM 0 H LEU A 87 5.728 -6.166 1.862 1.00 0.00 H new ATOM 0 HA LEU A 87 3.233 -6.224 0.859 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.212 -4.358 -0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.592 -4.028 0.167 1.00 0.00 H new ATOM 0 HG LEU A 87 4.859 -2.914 1.722 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.893 -4.218 3.812 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.391 -4.480 2.894 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.671 -5.716 2.876 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.002 -3.715 2.636 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.864 -5.193 1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.040 -3.610 0.860 1.00 0.00 H new ATOM 255 N LYS A 88 5.362 -6.989 -1.509 1.00 0.00 N ATOM 256 CA LYS A 88 5.478 -7.527 -2.859 1.00 0.00 C ATOM 257 C LYS A 88 4.327 -8.480 -3.166 1.00 0.00 C ATOM 258 O LYS A 88 4.285 -9.602 -2.663 1.00 0.00 O ATOM 259 CB LYS A 88 6.814 -8.255 -3.027 1.00 0.00 C ATOM 260 CG LYS A 88 7.041 -8.796 -4.428 1.00 0.00 C ATOM 261 CD LYS A 88 7.237 -7.675 -5.434 1.00 0.00 C ATOM 262 CE LYS A 88 6.717 -8.063 -6.809 1.00 0.00 C ATOM 263 NZ LYS A 88 7.433 -9.247 -7.359 1.00 0.00 N ATOM 0 H LYS A 88 6.243 -6.941 -0.997 1.00 0.00 H new ATOM 0 HA LYS A 88 5.434 -6.693 -3.560 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.625 -7.571 -2.775 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.860 -9.080 -2.316 1.00 0.00 H new ATOM 0 HG2 LYS A 88 7.916 -9.446 -4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.189 -9.408 -4.725 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.721 -6.780 -5.088 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.296 -7.426 -5.501 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.651 -8.280 -6.746 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.831 -7.221 -7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.109 -9.428 -8.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.456 -9.062 -7.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.234 -10.079 -6.767 1.00 0.00 H new ATOM 277 N GLY A 89 3.394 -8.024 -3.997 1.00 0.00 N ATOM 278 CA GLY A 89 2.255 -8.849 -4.358 1.00 0.00 C ATOM 279 C GLY A 89 1.022 -8.526 -3.538 1.00 0.00 C ATOM 280 O GLY A 89 -0.098 -8.563 -4.047 1.00 0.00 O ATOM 0 H GLY A 89 3.406 -7.099 -4.426 1.00 0.00 H new ATOM 0 HA2 GLY A 89 2.031 -8.710 -5.416 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.513 -9.899 -4.222 1.00 0.00 H new ATOM 284 N LYS A 90 1.226 -8.209 -2.264 1.00 0.00 N ATOM 285 CA LYS A 90 0.123 -7.878 -1.371 1.00 0.00 C ATOM 286 C LYS A 90 -0.680 -6.699 -1.912 1.00 0.00 C ATOM 287 O LYS A 90 -0.172 -5.895 -2.692 1.00 0.00 O ATOM 288 CB LYS A 90 0.652 -7.550 0.027 1.00 0.00 C ATOM 289 CG LYS A 90 1.194 -8.758 0.771 1.00 0.00 C ATOM 290 CD LYS A 90 1.628 -8.396 2.181 1.00 0.00 C ATOM 291 CE LYS A 90 1.874 -9.637 3.025 1.00 0.00 C ATOM 292 NZ LYS A 90 1.745 -9.353 4.481 1.00 0.00 N ATOM 0 H LYS A 90 2.147 -8.174 -1.827 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.535 -8.745 -1.310 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.441 -6.802 -0.058 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.150 -7.102 0.614 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.430 -9.534 0.813 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.040 -9.174 0.224 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.537 -7.797 2.140 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.861 -7.781 2.652 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.164 -10.415 2.743 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.871 -10.025 2.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.920 -10.224 5.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.439 -8.629 4.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.785 -9.007 4.683 1.00 0.00 H new ATOM 306 N VAL A 91 -1.937 -6.602 -1.490 1.00 0.00 N ATOM 307 CA VAL A 91 -2.810 -5.520 -1.930 1.00 0.00 C ATOM 308 C VAL A 91 -3.002 -4.486 -0.826 1.00 0.00 C ATOM 309 O VAL A 91 -3.234 -4.834 0.331 1.00 0.00 O ATOM 310 CB VAL A 91 -4.187 -6.052 -2.367 1.00 0.00 C ATOM 311 CG1 VAL A 91 -5.088 -4.907 -2.805 1.00 0.00 C ATOM 312 CG2 VAL A 91 -4.034 -7.076 -3.481 1.00 0.00 C ATOM 0 H VAL A 91 -2.373 -7.260 -0.844 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.324 -5.049 -2.784 1.00 0.00 H new ATOM 0 HB VAL A 91 -4.654 -6.544 -1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -6.057 -5.303 -3.110 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.224 -4.213 -1.975 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.629 -4.383 -3.644 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.017 -7.441 -3.777 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.546 -6.611 -4.338 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.428 -7.911 -3.127 1.00 0.00 H new ATOM 322 N GLY A 92 -2.905 -3.212 -1.193 1.00 0.00 N ATOM 323 CA GLY A 92 -3.072 -2.146 -0.222 1.00 0.00 C ATOM 324 C GLY A 92 -4.130 -1.143 -0.638 1.00 0.00 C ATOM 325 O GLY A 92 -4.697 -1.242 -1.727 1.00 0.00 O ATOM 0 H GLY A 92 -2.714 -2.899 -2.145 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.343 -2.576 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.121 -1.631 -0.085 1.00 0.00 H new ATOM 329 N LYS A 93 -4.399 -0.175 0.231 1.00 0.00 N ATOM 330 CA LYS A 93 -5.397 0.851 -0.050 1.00 0.00 C ATOM 331 C LYS A 93 -4.767 2.239 -0.045 1.00 0.00 C ATOM 332 O LYS A 93 -3.935 2.552 0.807 1.00 0.00 O ATOM 333 CB LYS A 93 -6.527 0.788 0.980 1.00 0.00 C ATOM 334 CG LYS A 93 -7.787 1.517 0.547 1.00 0.00 C ATOM 335 CD LYS A 93 -8.550 2.070 1.739 1.00 0.00 C ATOM 336 CE LYS A 93 -9.513 1.040 2.310 1.00 0.00 C ATOM 337 NZ LYS A 93 -10.732 0.893 1.467 1.00 0.00 N ATOM 0 H LYS A 93 -3.940 -0.079 1.137 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.807 0.661 -1.042 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.771 -0.256 1.176 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.175 1.215 1.919 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.523 2.332 -0.127 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.428 0.836 -0.012 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.846 2.379 2.512 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.103 2.959 1.438 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -9.009 0.077 2.391 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.802 1.334 3.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -11.428 0.301 1.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -11.143 1.831 1.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -10.477 0.445 0.564 1.00 0.00 H new ATOM 351 N VAL A 94 -5.169 3.070 -1.002 1.00 0.00 N ATOM 352 CA VAL A 94 -4.645 4.427 -1.106 1.00 0.00 C ATOM 353 C VAL A 94 -5.284 5.344 -0.070 1.00 0.00 C ATOM 354 O VAL A 94 -6.258 6.039 -0.357 1.00 0.00 O ATOM 355 CB VAL A 94 -4.882 5.014 -2.510 1.00 0.00 C ATOM 356 CG1 VAL A 94 -3.881 4.443 -3.504 1.00 0.00 C ATOM 357 CG2 VAL A 94 -6.309 4.747 -2.965 1.00 0.00 C ATOM 0 H VAL A 94 -5.856 2.827 -1.716 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.572 4.367 -0.921 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.736 6.093 -2.463 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.064 4.869 -4.490 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.869 4.690 -3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.992 3.360 -3.551 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.459 5.169 -3.959 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.486 3.672 -2.996 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.006 5.209 -2.266 1.00 0.00 H new ATOM 367 N VAL A 95 -4.728 5.341 1.138 1.00 0.00 N ATOM 368 CA VAL A 95 -5.242 6.174 2.218 1.00 0.00 C ATOM 369 C VAL A 95 -5.092 7.655 1.889 1.00 0.00 C ATOM 370 O VAL A 95 -5.752 8.506 2.487 1.00 0.00 O ATOM 371 CB VAL A 95 -4.520 5.879 3.547 1.00 0.00 C ATOM 372 CG1 VAL A 95 -4.893 4.498 4.062 1.00 0.00 C ATOM 373 CG2 VAL A 95 -3.014 6.005 3.373 1.00 0.00 C ATOM 0 H VAL A 95 -3.922 4.771 1.393 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.300 5.934 2.326 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.840 6.613 4.286 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.374 4.307 5.001 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.969 4.449 4.226 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.604 3.746 3.328 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.519 5.794 4.321 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.674 5.294 2.620 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.768 7.018 3.053 1.00 0.00 H new ATOM 383 N LYS A 96 -4.220 7.958 0.933 1.00 0.00 N ATOM 384 CA LYS A 96 -3.983 9.337 0.522 1.00 0.00 C ATOM 385 C LYS A 96 -3.069 9.391 -0.698 1.00 0.00 C ATOM 386 O LYS A 96 -2.247 8.499 -0.909 1.00 0.00 O ATOM 387 CB LYS A 96 -3.365 10.135 1.672 1.00 0.00 C ATOM 388 CG LYS A 96 -3.713 11.613 1.643 1.00 0.00 C ATOM 389 CD LYS A 96 -2.698 12.410 0.841 1.00 0.00 C ATOM 390 CE LYS A 96 -1.554 12.897 1.718 1.00 0.00 C ATOM 391 NZ LYS A 96 -1.880 14.188 2.386 1.00 0.00 N ATOM 0 H LYS A 96 -3.665 7.267 0.428 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.942 9.781 0.255 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -3.699 9.710 2.619 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.281 10.025 1.638 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -4.705 11.746 1.210 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.756 11.998 2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -2.303 11.792 0.035 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.190 13.264 0.375 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -1.329 12.144 2.473 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -0.657 13.018 1.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -1.076 14.487 2.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.070 14.913 1.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -2.721 14.066 2.985 1.00 0.00 H new ATOM 405 N ILE A 97 -3.217 10.442 -1.497 1.00 0.00 N ATOM 406 CA ILE A 97 -2.403 10.613 -2.693 1.00 0.00 C ATOM 407 C ILE A 97 -1.685 11.958 -2.683 1.00 0.00 C ATOM 408 O ILE A 97 -2.253 12.973 -2.280 1.00 0.00 O ATOM 409 CB ILE A 97 -3.254 10.508 -3.973 1.00 0.00 C ATOM 410 CG1 ILE A 97 -3.903 9.126 -4.068 1.00 0.00 C ATOM 411 CG2 ILE A 97 -2.399 10.783 -5.201 1.00 0.00 C ATOM 412 CD1 ILE A 97 -5.220 9.025 -3.331 1.00 0.00 C ATOM 0 H ILE A 97 -3.894 11.188 -1.337 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.665 9.810 -2.689 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.044 11.257 -3.929 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.064 8.880 -5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.214 8.382 -3.668 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.014 10.705 -6.097 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.979 11.787 -5.135 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.590 10.054 -5.252 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -5.622 8.018 -3.441 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.063 9.239 -2.274 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.925 9.745 -3.746 1.00 0.00 H new ATOM 424 N ALA A 98 -0.433 11.959 -3.129 1.00 0.00 N ATOM 425 CA ALA A 98 0.361 13.180 -3.175 1.00 0.00 C ATOM 426 C ALA A 98 1.371 13.135 -4.316 1.00 0.00 C ATOM 427 O ALA A 98 2.078 12.144 -4.493 1.00 0.00 O ATOM 428 CB ALA A 98 1.072 13.397 -1.847 1.00 0.00 C ATOM 0 H ALA A 98 0.053 11.127 -3.464 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.314 14.017 -3.355 1.00 0.00 H new ATOM 0 HB1 ALA A 98 1.662 14.313 -1.895 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.334 13.482 -1.049 1.00 0.00 H new ATOM 0 HB3 ALA A 98 1.730 12.552 -1.644 1.00 0.00 H new ATOM 434 N GLU A 99 1.432 14.215 -5.089 1.00 0.00 N ATOM 435 CA GLU A 99 2.354 14.297 -6.215 1.00 0.00 C ATOM 436 C GLU A 99 3.745 13.814 -5.815 1.00 0.00 C ATOM 437 O GLU A 99 4.344 12.980 -6.495 1.00 0.00 O ATOM 438 CB GLU A 99 2.432 15.734 -6.736 1.00 0.00 C ATOM 439 CG GLU A 99 2.741 15.827 -8.221 1.00 0.00 C ATOM 440 CD GLU A 99 1.566 15.420 -9.088 1.00 0.00 C ATOM 441 OE1 GLU A 99 1.169 14.237 -9.033 1.00 0.00 O ATOM 442 OE2 GLU A 99 1.043 16.284 -9.822 1.00 0.00 O ATOM 0 H GLU A 99 0.854 15.045 -4.956 1.00 0.00 H new ATOM 0 HA GLU A 99 1.977 13.651 -7.008 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.484 16.235 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.199 16.272 -6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.031 16.849 -8.465 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.595 15.190 -8.451 1.00 0.00 H new ATOM 449 N ASP A 100 4.253 14.343 -4.707 1.00 0.00 N ATOM 450 CA ASP A 100 5.573 13.966 -4.215 1.00 0.00 C ATOM 451 C ASP A 100 5.636 12.471 -3.919 1.00 0.00 C ATOM 452 O ASP A 100 6.661 11.826 -4.142 1.00 0.00 O ATOM 453 CB ASP A 100 5.918 14.763 -2.956 1.00 0.00 C ATOM 454 CG ASP A 100 4.712 14.990 -2.066 1.00 0.00 C ATOM 455 OD1 ASP A 100 4.226 14.010 -1.463 1.00 0.00 O ATOM 456 OD2 ASP A 100 4.254 16.148 -1.972 1.00 0.00 O ATOM 0 H ASP A 100 3.771 15.034 -4.133 1.00 0.00 H new ATOM 0 HA ASP A 100 6.302 14.195 -4.992 1.00 0.00 H new ATOM 0 HB2 ASP A 100 6.687 14.233 -2.393 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.340 15.726 -3.243 1.00 0.00 H new ATOM 461 N HIS A 101 4.533 11.926 -3.415 1.00 0.00 N ATOM 462 CA HIS A 101 4.463 10.506 -3.088 1.00 0.00 C ATOM 463 C HIS A 101 3.032 10.095 -2.756 1.00 0.00 C ATOM 464 O HIS A 101 2.201 10.933 -2.404 1.00 0.00 O ATOM 465 CB HIS A 101 5.384 10.186 -1.910 1.00 0.00 C ATOM 466 CG HIS A 101 4.863 10.672 -0.593 1.00 0.00 C ATOM 467 ND1 HIS A 101 5.056 11.959 -0.137 1.00 0.00 N ATOM 468 CD2 HIS A 101 4.151 10.037 0.367 1.00 0.00 C ATOM 469 CE1 HIS A 101 4.486 12.093 1.048 1.00 0.00 C ATOM 470 NE2 HIS A 101 3.930 10.941 1.376 1.00 0.00 N ATOM 0 H HIS A 101 3.676 12.446 -3.224 1.00 0.00 H new ATOM 0 HA HIS A 101 4.792 9.941 -3.960 1.00 0.00 H new ATOM 0 HB2 HIS A 101 5.531 9.107 -1.857 1.00 0.00 H new ATOM 0 HB3 HIS A 101 6.361 10.633 -2.092 1.00 0.00 H new ATOM 0 HD1 HIS A 101 5.560 12.692 -0.636 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.818 9.010 0.344 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.477 12.992 1.646 1.00 0.00 H new ATOM 479 N TYR A 102 2.751 8.802 -2.871 1.00 0.00 N ATOM 480 CA TYR A 102 1.420 8.280 -2.586 1.00 0.00 C ATOM 481 C TYR A 102 1.411 7.493 -1.279 1.00 0.00 C ATOM 482 O TYR A 102 2.423 6.916 -0.882 1.00 0.00 O ATOM 483 CB TYR A 102 0.941 7.390 -3.734 1.00 0.00 C ATOM 484 CG TYR A 102 0.998 8.063 -5.087 1.00 0.00 C ATOM 485 CD1 TYR A 102 2.207 8.491 -5.622 1.00 0.00 C ATOM 486 CD2 TYR A 102 -0.157 8.270 -5.830 1.00 0.00 C ATOM 487 CE1 TYR A 102 2.263 9.107 -6.857 1.00 0.00 C ATOM 488 CE2 TYR A 102 -0.111 8.884 -7.067 1.00 0.00 C ATOM 489 CZ TYR A 102 1.102 9.301 -7.576 1.00 0.00 C ATOM 490 OH TYR A 102 1.154 9.914 -8.807 1.00 0.00 O ATOM 0 H TYR A 102 3.428 8.096 -3.160 1.00 0.00 H new ATOM 0 HA TYR A 102 0.741 9.126 -2.484 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.551 6.487 -3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -0.084 7.077 -3.536 1.00 0.00 H new ATOM 0 HD1 TYR A 102 3.118 8.339 -5.063 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.108 7.945 -5.434 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.211 9.435 -7.258 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -1.019 9.037 -7.632 1.00 0.00 H new ATOM 0 HH TYR A 102 1.243 9.234 -9.507 1.00 0.00 H new ATOM 500 N LEU A 103 0.260 7.475 -0.616 1.00 0.00 N ATOM 501 CA LEU A 103 0.117 6.758 0.647 1.00 0.00 C ATOM 502 C LEU A 103 -0.753 5.517 0.473 1.00 0.00 C ATOM 503 O LEU A 103 -1.960 5.618 0.253 1.00 0.00 O ATOM 504 CB LEU A 103 -0.490 7.675 1.711 1.00 0.00 C ATOM 505 CG LEU A 103 0.486 8.610 2.426 1.00 0.00 C ATOM 506 CD1 LEU A 103 -0.224 9.381 3.527 1.00 0.00 C ATOM 507 CD2 LEU A 103 1.659 7.824 2.994 1.00 0.00 C ATOM 0 H LEU A 103 -0.587 7.948 -0.931 1.00 0.00 H new ATOM 0 HA LEU A 103 1.108 6.442 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.264 8.281 1.241 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.982 7.054 2.460 1.00 0.00 H new ATOM 0 HG LEU A 103 0.872 9.326 1.700 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.486 10.041 4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.029 9.974 3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.638 8.681 4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.343 8.506 3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.291 7.085 3.706 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.184 7.317 2.184 1.00 0.00 H new ATOM 519 N VAL A 104 -0.133 4.346 0.575 1.00 0.00 N ATOM 520 CA VAL A 104 -0.851 3.085 0.433 1.00 0.00 C ATOM 521 C VAL A 104 -0.680 2.212 1.671 1.00 0.00 C ATOM 522 O VAL A 104 0.432 1.808 2.008 1.00 0.00 O ATOM 523 CB VAL A 104 -0.370 2.302 -0.804 1.00 0.00 C ATOM 524 CG1 VAL A 104 -1.497 1.453 -1.370 1.00 0.00 C ATOM 525 CG2 VAL A 104 0.173 3.254 -1.859 1.00 0.00 C ATOM 0 H VAL A 104 0.866 4.244 0.756 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.905 3.333 0.310 1.00 0.00 H new ATOM 0 HB VAL A 104 0.437 1.635 -0.499 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.138 0.907 -2.243 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.835 0.745 -0.613 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.327 2.097 -1.660 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.508 2.684 -2.725 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.612 3.947 -2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.012 3.814 -1.446 1.00 0.00 H new ATOM 535 N GLU A 105 -1.790 1.926 2.344 1.00 0.00 N ATOM 536 CA GLU A 105 -1.763 1.101 3.546 1.00 0.00 C ATOM 537 C GLU A 105 -1.686 -0.380 3.187 1.00 0.00 C ATOM 538 O GLU A 105 -2.685 -0.992 2.811 1.00 0.00 O ATOM 539 CB GLU A 105 -3.003 1.366 4.402 1.00 0.00 C ATOM 540 CG GLU A 105 -3.033 0.567 5.694 1.00 0.00 C ATOM 541 CD GLU A 105 -2.423 1.320 6.860 1.00 0.00 C ATOM 542 OE1 GLU A 105 -2.463 2.568 6.845 1.00 0.00 O ATOM 543 OE2 GLU A 105 -1.906 0.662 7.786 1.00 0.00 O ATOM 0 H GLU A 105 -2.719 2.253 2.077 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.873 1.366 4.117 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -3.049 2.429 4.641 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -3.894 1.131 3.819 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -4.065 0.309 5.933 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.495 -0.370 5.550 1.00 0.00 H new ATOM 550 N VAL A 106 -0.491 -0.950 3.306 1.00 0.00 N ATOM 551 CA VAL A 106 -0.282 -2.359 2.995 1.00 0.00 C ATOM 552 C VAL A 106 -0.051 -3.173 4.263 1.00 0.00 C ATOM 553 O VAL A 106 0.683 -2.753 5.157 1.00 0.00 O ATOM 554 CB VAL A 106 0.917 -2.554 2.048 1.00 0.00 C ATOM 555 CG1 VAL A 106 0.972 -3.987 1.543 1.00 0.00 C ATOM 556 CG2 VAL A 106 0.843 -1.573 0.887 1.00 0.00 C ATOM 0 H VAL A 106 0.347 -0.458 3.616 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.187 -2.711 2.500 1.00 0.00 H new ATOM 0 HB VAL A 106 1.833 -2.356 2.604 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.826 -4.105 0.876 1.00 0.00 H new ATOM 0 HG12 VAL A 106 1.076 -4.667 2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.054 -4.218 1.002 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.698 -1.724 0.228 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.079 -1.738 0.330 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.857 -0.553 1.271 1.00 0.00 H new ATOM 566 N GLU A 107 -0.682 -4.341 4.334 1.00 0.00 N ATOM 567 CA GLU A 107 -0.545 -5.214 5.494 1.00 0.00 C ATOM 568 C GLU A 107 -0.801 -4.445 6.787 1.00 0.00 C ATOM 569 O GLU A 107 -0.267 -4.787 7.841 1.00 0.00 O ATOM 570 CB GLU A 107 0.851 -5.840 5.527 1.00 0.00 C ATOM 571 CG GLU A 107 1.939 -4.876 5.970 1.00 0.00 C ATOM 572 CD GLU A 107 3.142 -5.586 6.560 1.00 0.00 C ATOM 573 OE1 GLU A 107 3.242 -6.820 6.398 1.00 0.00 O ATOM 574 OE2 GLU A 107 3.984 -4.906 7.184 1.00 0.00 O ATOM 0 H GLU A 107 -1.293 -4.704 3.602 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.289 -6.007 5.410 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.840 -6.697 6.200 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.094 -6.218 4.534 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.258 -4.277 5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.530 -4.187 6.709 1.00 0.00 H new ATOM 581 N GLY A 108 -1.621 -3.403 6.696 1.00 0.00 N ATOM 582 CA GLY A 108 -1.934 -2.601 7.865 1.00 0.00 C ATOM 583 C GLY A 108 -0.837 -1.608 8.196 1.00 0.00 C ATOM 584 O GLY A 108 -0.641 -1.255 9.359 1.00 0.00 O ATOM 0 H GLY A 108 -2.074 -3.100 5.834 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.867 -2.064 7.694 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.096 -3.258 8.720 1.00 0.00 H new ATOM 588 N ASP A 109 -0.120 -1.157 7.172 1.00 0.00 N ATOM 589 CA ASP A 109 0.963 -0.199 7.360 1.00 0.00 C ATOM 590 C ASP A 109 1.063 0.748 6.169 1.00 0.00 C ATOM 591 O ASP A 109 1.119 0.313 5.019 1.00 0.00 O ATOM 592 CB ASP A 109 2.291 -0.931 7.560 1.00 0.00 C ATOM 593 CG ASP A 109 2.437 -1.496 8.959 1.00 0.00 C ATOM 594 OD1 ASP A 109 1.888 -2.588 9.217 1.00 0.00 O ATOM 595 OD2 ASP A 109 3.098 -0.847 9.796 1.00 0.00 O ATOM 0 H ASP A 109 -0.270 -1.440 6.203 1.00 0.00 H new ATOM 0 HA ASP A 109 0.744 0.389 8.251 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.369 -1.741 6.835 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.114 -0.245 7.361 1.00 0.00 H new ATOM 600 N LYS A 110 1.086 2.046 6.452 1.00 0.00 N ATOM 601 CA LYS A 110 1.179 3.056 5.404 1.00 0.00 C ATOM 602 C LYS A 110 2.550 3.021 4.736 1.00 0.00 C ATOM 603 O LYS A 110 3.575 3.207 5.391 1.00 0.00 O ATOM 604 CB LYS A 110 0.919 4.448 5.985 1.00 0.00 C ATOM 605 CG LYS A 110 -0.400 4.559 6.730 1.00 0.00 C ATOM 606 CD LYS A 110 -0.704 5.997 7.114 1.00 0.00 C ATOM 607 CE LYS A 110 -1.437 6.729 6.001 1.00 0.00 C ATOM 608 NZ LYS A 110 -2.008 8.022 6.469 1.00 0.00 N ATOM 0 H LYS A 110 1.042 2.424 7.399 1.00 0.00 H new ATOM 0 HA LYS A 110 0.421 2.835 4.652 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.732 4.708 6.663 1.00 0.00 H new ATOM 0 HB3 LYS A 110 0.933 5.179 5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.205 4.170 6.106 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.365 3.941 7.627 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -1.309 6.012 8.021 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.226 6.518 7.342 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.751 6.913 5.174 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.237 6.097 5.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.499 8.490 5.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.682 7.845 7.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -1.242 8.636 6.813 1.00 0.00 H new ATOM 622 N TRP A 111 2.560 2.784 3.429 1.00 0.00 N ATOM 623 CA TRP A 111 3.805 2.727 2.672 1.00 0.00 C ATOM 624 C TRP A 111 3.924 3.920 1.730 1.00 0.00 C ATOM 625 O TRP A 111 2.994 4.716 1.601 1.00 0.00 O ATOM 626 CB TRP A 111 3.883 1.423 1.877 1.00 0.00 C ATOM 627 CG TRP A 111 4.140 0.220 2.732 1.00 0.00 C ATOM 628 CD1 TRP A 111 3.205 -0.593 3.306 1.00 0.00 C ATOM 629 CD2 TRP A 111 5.417 -0.304 3.112 1.00 0.00 C ATOM 630 NE1 TRP A 111 3.823 -1.591 4.020 1.00 0.00 N ATOM 631 CE2 TRP A 111 5.180 -1.437 3.916 1.00 0.00 C ATOM 632 CE3 TRP A 111 6.737 0.072 2.850 1.00 0.00 C ATOM 633 CZ2 TRP A 111 6.216 -2.193 4.459 1.00 0.00 C ATOM 634 CZ3 TRP A 111 7.763 -0.680 3.390 1.00 0.00 C ATOM 635 CH2 TRP A 111 7.498 -1.802 4.186 1.00 0.00 C ATOM 0 H TRP A 111 1.720 2.628 2.872 1.00 0.00 H new ATOM 0 HA TRP A 111 4.634 2.763 3.379 1.00 0.00 H new ATOM 0 HB2 TRP A 111 2.949 1.281 1.334 1.00 0.00 H new ATOM 0 HB3 TRP A 111 4.675 1.507 1.133 1.00 0.00 H new ATOM 0 HD1 TRP A 111 2.136 -0.470 3.212 1.00 0.00 H new ATOM 0 HE1 TRP A 111 3.348 -2.327 4.543 1.00 0.00 H new ATOM 0 HE3 TRP A 111 6.952 0.935 2.237 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 6.014 -3.058 5.074 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 8.787 -0.398 3.195 1.00 0.00 H new ATOM 0 HH2 TRP A 111 8.322 -2.369 4.592 1.00 0.00 H new ATOM 646 N ILE A 112 5.074 4.037 1.073 1.00 0.00 N ATOM 647 CA ILE A 112 5.313 5.132 0.142 1.00 0.00 C ATOM 648 C ILE A 112 5.479 4.615 -1.283 1.00 0.00 C ATOM 649 O ILE A 112 6.569 4.206 -1.683 1.00 0.00 O ATOM 650 CB ILE A 112 6.564 5.940 0.532 1.00 0.00 C ATOM 651 CG1 ILE A 112 6.343 6.649 1.870 1.00 0.00 C ATOM 652 CG2 ILE A 112 6.906 6.946 -0.557 1.00 0.00 C ATOM 653 CD1 ILE A 112 6.357 5.714 3.059 1.00 0.00 C ATOM 0 H ILE A 112 5.854 3.387 1.169 1.00 0.00 H new ATOM 0 HA ILE A 112 4.441 5.784 0.191 1.00 0.00 H new ATOM 0 HB ILE A 112 7.403 5.253 0.641 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.117 7.405 2.003 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.387 7.173 1.841 1.00 0.00 H new ATOM 0 HG21 ILE A 112 7.793 7.509 -0.266 1.00 0.00 H new ATOM 0 HG22 ILE A 112 7.101 6.419 -1.491 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.070 7.631 -0.695 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.194 6.285 3.973 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.565 4.973 2.948 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.321 5.209 3.113 1.00 0.00 H new ATOM 665 N ALA A 113 4.391 4.639 -2.046 1.00 0.00 N ATOM 666 CA ALA A 113 4.418 4.177 -3.429 1.00 0.00 C ATOM 667 C ALA A 113 4.234 5.338 -4.399 1.00 0.00 C ATOM 668 O ALA A 113 3.785 6.418 -4.014 1.00 0.00 O ATOM 669 CB ALA A 113 3.342 3.124 -3.653 1.00 0.00 C ATOM 0 H ALA A 113 3.480 4.973 -1.730 1.00 0.00 H new ATOM 0 HA ALA A 113 5.394 3.731 -3.619 1.00 0.00 H new ATOM 0 HB1 ALA A 113 3.373 2.787 -4.689 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.519 2.277 -2.991 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.363 3.553 -3.440 1.00 0.00 H new ATOM 675 N TYR A 114 4.585 5.110 -5.660 1.00 0.00 N ATOM 676 CA TYR A 114 4.463 6.139 -6.686 1.00 0.00 C ATOM 677 C TYR A 114 3.893 5.557 -7.976 1.00 0.00 C ATOM 678 O TYR A 114 4.457 4.627 -8.553 1.00 0.00 O ATOM 679 CB TYR A 114 5.824 6.781 -6.960 1.00 0.00 C ATOM 680 CG TYR A 114 6.912 5.781 -7.276 1.00 0.00 C ATOM 681 CD1 TYR A 114 7.379 4.903 -6.305 1.00 0.00 C ATOM 682 CD2 TYR A 114 7.475 5.714 -8.545 1.00 0.00 C ATOM 683 CE1 TYR A 114 8.374 3.987 -6.590 1.00 0.00 C ATOM 684 CE2 TYR A 114 8.469 4.801 -8.838 1.00 0.00 C ATOM 685 CZ TYR A 114 8.915 3.940 -7.857 1.00 0.00 C ATOM 686 OH TYR A 114 9.907 3.030 -8.145 1.00 0.00 O ATOM 0 H TYR A 114 4.956 4.221 -5.996 1.00 0.00 H new ATOM 0 HA TYR A 114 3.777 6.902 -6.319 1.00 0.00 H new ATOM 0 HB2 TYR A 114 5.727 7.476 -7.794 1.00 0.00 H new ATOM 0 HB3 TYR A 114 6.122 7.367 -6.090 1.00 0.00 H new ATOM 0 HD1 TYR A 114 6.957 4.937 -5.311 1.00 0.00 H new ATOM 0 HD2 TYR A 114 7.129 6.388 -9.315 1.00 0.00 H new ATOM 0 HE1 TYR A 114 8.726 3.312 -5.824 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.895 4.761 -9.830 1.00 0.00 H new ATOM 0 HH TYR A 114 10.178 3.127 -9.082 1.00 0.00 H new ATOM 696 N SER A 115 2.772 6.113 -8.424 1.00 0.00 N ATOM 697 CA SER A 115 2.123 5.648 -9.644 1.00 0.00 C ATOM 698 C SER A 115 1.962 6.790 -10.643 1.00 0.00 C ATOM 699 O SER A 115 1.421 7.846 -10.314 1.00 0.00 O ATOM 700 CB SER A 115 0.756 5.041 -9.321 1.00 0.00 C ATOM 701 OG SER A 115 -0.022 4.885 -10.495 1.00 0.00 O ATOM 0 H SER A 115 2.294 6.886 -7.960 1.00 0.00 H new ATOM 0 HA SER A 115 2.755 4.882 -10.093 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.889 4.073 -8.838 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.228 5.681 -8.613 1.00 0.00 H new ATOM 0 HG SER A 115 -0.697 5.594 -10.537 1.00 0.00 H new ATOM 707 N ASP A 116 2.436 6.571 -11.865 1.00 0.00 N ATOM 708 CA ASP A 116 2.345 7.580 -12.913 1.00 0.00 C ATOM 709 C ASP A 116 0.888 7.884 -13.248 1.00 0.00 C ATOM 710 O ASP A 116 0.570 8.960 -13.754 1.00 0.00 O ATOM 711 CB ASP A 116 3.082 7.111 -14.168 1.00 0.00 C ATOM 712 CG ASP A 116 4.395 6.424 -13.845 1.00 0.00 C ATOM 713 OD1 ASP A 116 4.364 5.368 -13.179 1.00 0.00 O ATOM 714 OD2 ASP A 116 5.453 6.943 -14.259 1.00 0.00 O ATOM 0 H ASP A 116 2.887 5.703 -12.154 1.00 0.00 H new ATOM 0 HA ASP A 116 2.814 8.493 -12.546 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.444 6.425 -14.726 1.00 0.00 H new ATOM 0 HB3 ASP A 116 3.273 7.967 -14.815 1.00 0.00 H new ATOM 719 N GLU A 117 0.008 6.929 -12.964 1.00 0.00 N ATOM 720 CA GLU A 117 -1.414 7.095 -13.238 1.00 0.00 C ATOM 721 C GLU A 117 -2.141 7.654 -12.018 1.00 0.00 C ATOM 722 O GLU A 117 -2.234 6.997 -10.981 1.00 0.00 O ATOM 723 CB GLU A 117 -2.037 5.760 -13.649 1.00 0.00 C ATOM 724 CG GLU A 117 -1.655 5.316 -15.051 1.00 0.00 C ATOM 725 CD GLU A 117 -1.745 3.813 -15.232 1.00 0.00 C ATOM 726 OE1 GLU A 117 -1.044 3.084 -14.499 1.00 0.00 O ATOM 727 OE2 GLU A 117 -2.517 3.365 -16.106 1.00 0.00 O ATOM 0 H GLU A 117 0.255 6.033 -12.544 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.519 7.804 -14.059 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.732 4.992 -12.938 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -3.122 5.840 -13.585 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.308 5.805 -15.774 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -0.638 5.644 -15.268 1.00 0.00 H new ATOM 734 N LYS A 118 -2.655 8.872 -12.149 1.00 0.00 N ATOM 735 CA LYS A 118 -3.375 9.521 -11.060 1.00 0.00 C ATOM 736 C LYS A 118 -4.276 8.527 -10.335 1.00 0.00 C ATOM 737 O LYS A 118 -5.147 7.904 -10.944 1.00 0.00 O ATOM 738 CB LYS A 118 -4.210 10.686 -11.595 1.00 0.00 C ATOM 739 CG LYS A 118 -4.636 10.514 -13.043 1.00 0.00 C ATOM 740 CD LYS A 118 -3.750 11.313 -13.984 1.00 0.00 C ATOM 741 CE LYS A 118 -4.178 11.141 -15.433 1.00 0.00 C ATOM 742 NZ LYS A 118 -5.219 12.132 -15.826 1.00 0.00 N ATOM 0 H LYS A 118 -2.586 9.430 -13.000 1.00 0.00 H new ATOM 0 HA LYS A 118 -2.641 9.904 -10.351 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.099 10.800 -10.975 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -3.635 11.607 -11.501 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -4.595 9.459 -13.312 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.672 10.833 -13.159 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -3.790 12.368 -13.715 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -2.714 10.994 -13.869 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -3.310 11.249 -16.083 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -4.563 10.132 -15.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -5.484 11.981 -16.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -6.058 12.012 -15.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -4.843 13.095 -15.710 1.00 0.00 H new ATOM 756 N LEU A 119 -4.063 8.384 -9.031 1.00 0.00 N ATOM 757 CA LEU A 119 -4.858 7.467 -8.222 1.00 0.00 C ATOM 758 C LEU A 119 -5.985 8.206 -7.508 1.00 0.00 C ATOM 759 O LEU A 119 -5.935 9.425 -7.346 1.00 0.00 O ATOM 760 CB LEU A 119 -3.970 6.757 -7.199 1.00 0.00 C ATOM 761 CG LEU A 119 -2.840 5.900 -7.771 1.00 0.00 C ATOM 762 CD1 LEU A 119 -2.121 5.154 -6.658 1.00 0.00 C ATOM 763 CD2 LEU A 119 -3.382 4.925 -8.806 1.00 0.00 C ATOM 0 H LEU A 119 -3.346 8.891 -8.512 1.00 0.00 H new ATOM 0 HA LEU A 119 -5.300 6.725 -8.887 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.532 7.510 -6.543 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.602 6.122 -6.578 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.123 6.558 -8.262 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.320 4.549 -7.084 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.699 5.870 -5.953 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.827 4.507 -6.138 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.564 4.323 -9.202 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.120 4.272 -8.340 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.851 5.480 -9.618 1.00 0.00 H new ATOM 775 N SER A 120 -6.999 7.460 -7.083 1.00 0.00 N ATOM 776 CA SER A 120 -8.140 8.045 -6.387 1.00 0.00 C ATOM 777 C SER A 120 -8.283 7.456 -4.987 1.00 0.00 C ATOM 778 O SER A 120 -8.202 6.241 -4.801 1.00 0.00 O ATOM 779 CB SER A 120 -9.424 7.813 -7.185 1.00 0.00 C ATOM 780 OG SER A 120 -9.162 7.783 -8.577 1.00 0.00 O ATOM 0 H SER A 120 -7.054 6.449 -7.208 1.00 0.00 H new ATOM 0 HA SER A 120 -7.967 9.117 -6.294 1.00 0.00 H new ATOM 0 HB2 SER A 120 -9.882 6.873 -6.878 1.00 0.00 H new ATOM 0 HB3 SER A 120 -10.141 8.604 -6.964 1.00 0.00 H new ATOM 0 HG SER A 120 -8.897 6.877 -8.841 1.00 0.00 H new ATOM 786 N LEU A 121 -8.497 8.325 -4.006 1.00 0.00 N ATOM 787 CA LEU A 121 -8.653 7.892 -2.621 1.00 0.00 C ATOM 788 C LEU A 121 -9.648 6.741 -2.519 1.00 0.00 C ATOM 789 O LEU A 121 -10.774 6.836 -3.006 1.00 0.00 O ATOM 790 CB LEU A 121 -9.115 9.061 -1.750 1.00 0.00 C ATOM 791 CG LEU A 121 -8.235 10.311 -1.781 1.00 0.00 C ATOM 792 CD1 LEU A 121 -9.067 11.556 -1.512 1.00 0.00 C ATOM 793 CD2 LEU A 121 -7.106 10.193 -0.768 1.00 0.00 C ATOM 0 H LEU A 121 -8.567 9.333 -4.143 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.684 7.542 -2.264 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.122 9.342 -2.059 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -9.183 8.715 -0.719 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.797 10.399 -2.775 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -8.424 12.436 -1.538 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -9.840 11.649 -2.275 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.534 11.477 -0.530 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.490 11.091 -0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -7.525 10.080 0.232 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.494 9.323 -1.005 1.00 0.00 H new ATOM 805 N GLY A 122 -9.226 5.654 -1.880 1.00 0.00 N ATOM 806 CA GLY A 122 -10.093 4.502 -1.723 1.00 0.00 C ATOM 807 C GLY A 122 -9.907 3.481 -2.828 1.00 0.00 C ATOM 808 O GLY A 122 -10.606 2.469 -2.872 1.00 0.00 O ATOM 0 H GLY A 122 -8.298 5.551 -1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -9.895 4.031 -0.760 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.132 4.832 -1.709 1.00 0.00 H new ATOM 812 N ASP A 123 -8.963 3.748 -3.724 1.00 0.00 N ATOM 813 CA ASP A 123 -8.687 2.845 -4.836 1.00 0.00 C ATOM 814 C ASP A 123 -7.769 1.709 -4.397 1.00 0.00 C ATOM 815 O ASP A 123 -6.664 1.944 -3.908 1.00 0.00 O ATOM 816 CB ASP A 123 -8.052 3.611 -5.997 1.00 0.00 C ATOM 817 CG ASP A 123 -9.010 4.601 -6.630 1.00 0.00 C ATOM 818 OD1 ASP A 123 -10.081 4.852 -6.039 1.00 0.00 O ATOM 819 OD2 ASP A 123 -8.689 5.126 -7.718 1.00 0.00 O ATOM 0 H ASP A 123 -8.376 4.582 -3.702 1.00 0.00 H new ATOM 0 HA ASP A 123 -9.633 2.417 -5.168 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -7.170 4.142 -5.639 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.713 2.903 -6.753 1.00 0.00 H new ATOM 824 N ARG A 124 -8.235 0.477 -4.576 1.00 0.00 N ATOM 825 CA ARG A 124 -7.457 -0.697 -4.196 1.00 0.00 C ATOM 826 C ARG A 124 -6.346 -0.963 -5.208 1.00 0.00 C ATOM 827 O ARG A 124 -6.608 -1.179 -6.391 1.00 0.00 O ATOM 828 CB ARG A 124 -8.364 -1.923 -4.085 1.00 0.00 C ATOM 829 CG ARG A 124 -7.819 -3.003 -3.165 1.00 0.00 C ATOM 830 CD ARG A 124 -8.937 -3.833 -2.555 1.00 0.00 C ATOM 831 NE ARG A 124 -9.474 -3.221 -1.343 1.00 0.00 N ATOM 832 CZ ARG A 124 -10.652 -3.540 -0.818 1.00 0.00 C ATOM 833 NH1 ARG A 124 -11.412 -4.459 -1.397 1.00 0.00 N ATOM 834 NH2 ARG A 124 -11.072 -2.939 0.288 1.00 0.00 N ATOM 0 H ARG A 124 -9.147 0.266 -4.981 1.00 0.00 H new ATOM 0 HA ARG A 124 -7.002 -0.502 -3.225 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -9.343 -1.609 -3.722 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -8.513 -2.345 -5.079 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -7.146 -3.653 -3.724 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -7.231 -2.543 -2.371 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.737 -3.955 -3.285 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -8.563 -4.830 -2.323 1.00 0.00 H new ATOM 0 HE ARG A 124 -8.914 -2.509 -0.874 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.093 -4.923 -2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -12.316 -4.702 -0.992 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -10.490 -2.231 0.736 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.977 -3.185 0.690 1.00 0.00 H new ATOM 848 N VAL A 125 -5.104 -0.944 -4.735 1.00 0.00 N ATOM 849 CA VAL A 125 -3.953 -1.184 -5.597 1.00 0.00 C ATOM 850 C VAL A 125 -3.079 -2.306 -5.048 1.00 0.00 C ATOM 851 O VAL A 125 -3.019 -2.524 -3.838 1.00 0.00 O ATOM 852 CB VAL A 125 -3.098 0.087 -5.758 1.00 0.00 C ATOM 853 CG1 VAL A 125 -3.933 1.224 -6.326 1.00 0.00 C ATOM 854 CG2 VAL A 125 -2.478 0.483 -4.427 1.00 0.00 C ATOM 0 H VAL A 125 -4.869 -0.765 -3.759 1.00 0.00 H new ATOM 0 HA VAL A 125 -4.343 -1.476 -6.572 1.00 0.00 H new ATOM 0 HB VAL A 125 -2.291 -0.125 -6.460 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.312 2.113 -6.433 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -4.325 0.936 -7.302 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -4.762 1.439 -5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -1.877 1.383 -4.559 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.268 0.677 -3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -1.844 -0.327 -4.066 1.00 0.00 H new ATOM 864 N MET A 126 -2.402 -3.015 -5.946 1.00 0.00 N ATOM 865 CA MET A 126 -1.529 -4.114 -5.550 1.00 0.00 C ATOM 866 C MET A 126 -0.066 -3.764 -5.804 1.00 0.00 C ATOM 867 O MET A 126 0.264 -3.108 -6.792 1.00 0.00 O ATOM 868 CB MET A 126 -1.900 -5.387 -6.312 1.00 0.00 C ATOM 869 CG MET A 126 -1.028 -6.582 -5.960 1.00 0.00 C ATOM 870 SD MET A 126 -1.838 -8.157 -6.297 1.00 0.00 S ATOM 871 CE MET A 126 -1.753 -8.206 -8.086 1.00 0.00 C ATOM 0 H MET A 126 -2.441 -2.848 -6.952 1.00 0.00 H new ATOM 0 HA MET A 126 -1.663 -4.286 -4.482 1.00 0.00 H new ATOM 0 HB2 MET A 126 -2.941 -5.634 -6.105 1.00 0.00 H new ATOM 0 HB3 MET A 126 -1.824 -5.195 -7.382 1.00 0.00 H new ATOM 0 HG2 MET A 126 -0.098 -6.528 -6.526 1.00 0.00 H new ATOM 0 HG3 MET A 126 -0.761 -6.534 -4.904 1.00 0.00 H new ATOM 0 HE1 MET A 126 -2.215 -9.125 -8.447 1.00 0.00 H new ATOM 0 HE2 MET A 126 -2.282 -7.347 -8.499 1.00 0.00 H new ATOM 0 HE3 MET A 126 -0.710 -8.176 -8.402 1.00 0.00 H new ATOM 881 N VAL A 127 0.808 -4.205 -4.904 1.00 0.00 N ATOM 882 CA VAL A 127 2.236 -3.939 -5.031 1.00 0.00 C ATOM 883 C VAL A 127 2.823 -4.657 -6.241 1.00 0.00 C ATOM 884 O VAL A 127 2.959 -5.881 -6.244 1.00 0.00 O ATOM 885 CB VAL A 127 3.002 -4.373 -3.768 1.00 0.00 C ATOM 886 CG1 VAL A 127 4.474 -4.007 -3.883 1.00 0.00 C ATOM 887 CG2 VAL A 127 2.383 -3.745 -2.528 1.00 0.00 C ATOM 0 H VAL A 127 0.552 -4.748 -4.079 1.00 0.00 H new ATOM 0 HA VAL A 127 2.347 -2.863 -5.162 1.00 0.00 H new ATOM 0 HB VAL A 127 2.929 -5.456 -3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 127 4.999 -4.322 -2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.907 -4.509 -4.748 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.572 -2.928 -4.002 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.937 -4.062 -1.644 1.00 0.00 H new ATOM 0 HG22 VAL A 127 2.424 -2.659 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.344 -4.063 -2.439 1.00 0.00 H new ATOM 897 N VAL A 128 3.172 -3.888 -7.267 1.00 0.00 N ATOM 898 CA VAL A 128 3.747 -4.451 -8.483 1.00 0.00 C ATOM 899 C VAL A 128 5.181 -4.914 -8.250 1.00 0.00 C ATOM 900 O VAL A 128 5.597 -5.956 -8.756 1.00 0.00 O ATOM 901 CB VAL A 128 3.730 -3.430 -9.636 1.00 0.00 C ATOM 902 CG1 VAL A 128 3.704 -4.142 -10.980 1.00 0.00 C ATOM 903 CG2 VAL A 128 2.541 -2.491 -9.499 1.00 0.00 C ATOM 0 H VAL A 128 3.067 -2.874 -7.281 1.00 0.00 H new ATOM 0 HA VAL A 128 3.132 -5.308 -8.757 1.00 0.00 H new ATOM 0 HB VAL A 128 4.642 -2.835 -9.584 1.00 0.00 H new ATOM 0 HG11 VAL A 128 3.692 -3.404 -11.782 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.590 -4.769 -11.077 1.00 0.00 H new ATOM 0 HG13 VAL A 128 2.811 -4.763 -11.045 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.545 -1.776 -10.322 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.617 -3.068 -9.524 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.608 -1.955 -8.553 1.00 0.00 H new ATOM 913 N ASP A 129 5.931 -4.133 -7.480 1.00 0.00 N ATOM 914 CA ASP A 129 7.318 -4.464 -7.177 1.00 0.00 C ATOM 915 C ASP A 129 7.914 -3.460 -6.195 1.00 0.00 C ATOM 916 O ASP A 129 7.635 -2.263 -6.268 1.00 0.00 O ATOM 917 CB ASP A 129 8.149 -4.495 -8.461 1.00 0.00 C ATOM 918 CG ASP A 129 9.464 -5.228 -8.282 1.00 0.00 C ATOM 919 OD1 ASP A 129 9.442 -6.377 -7.793 1.00 0.00 O ATOM 920 OD2 ASP A 129 10.516 -4.652 -8.631 1.00 0.00 O ATOM 0 H ASP A 129 5.601 -3.267 -7.055 1.00 0.00 H new ATOM 0 HA ASP A 129 7.338 -5.452 -6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.573 -4.976 -9.252 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.347 -3.474 -8.787 1.00 0.00 H new ATOM 925 N VAL A 130 8.736 -3.955 -5.276 1.00 0.00 N ATOM 926 CA VAL A 130 9.372 -3.102 -4.279 1.00 0.00 C ATOM 927 C VAL A 130 10.891 -3.153 -4.400 1.00 0.00 C ATOM 928 O VAL A 130 11.479 -4.228 -4.511 1.00 0.00 O ATOM 929 CB VAL A 130 8.968 -3.512 -2.850 1.00 0.00 C ATOM 930 CG1 VAL A 130 7.554 -4.072 -2.834 1.00 0.00 C ATOM 931 CG2 VAL A 130 9.956 -4.522 -2.287 1.00 0.00 C ATOM 0 H VAL A 130 8.978 -4.943 -5.201 1.00 0.00 H new ATOM 0 HA VAL A 130 9.029 -2.085 -4.468 1.00 0.00 H new ATOM 0 HB VAL A 130 8.989 -2.625 -2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 130 7.287 -4.356 -1.816 1.00 0.00 H new ATOM 0 HG12 VAL A 130 6.858 -3.314 -3.194 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.502 -4.948 -3.481 1.00 0.00 H new ATOM 0 HG21 VAL A 130 9.656 -4.801 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 130 9.969 -5.410 -2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 130 10.952 -4.081 -2.260 1.00 0.00 H new ATOM 941 N ASP A 131 11.519 -1.983 -4.378 1.00 0.00 N ATOM 942 CA ASP A 131 12.971 -1.893 -4.484 1.00 0.00 C ATOM 943 C ASP A 131 13.603 -1.674 -3.113 1.00 0.00 C ATOM 944 O ASP A 131 14.817 -1.507 -2.997 1.00 0.00 O ATOM 945 CB ASP A 131 13.366 -0.756 -5.429 1.00 0.00 C ATOM 946 CG ASP A 131 14.693 -1.010 -6.116 1.00 0.00 C ATOM 947 OD1 ASP A 131 14.958 -2.173 -6.484 1.00 0.00 O ATOM 948 OD2 ASP A 131 15.467 -0.044 -6.286 1.00 0.00 O ATOM 0 H ASP A 131 11.046 -1.084 -4.288 1.00 0.00 H new ATOM 0 HA ASP A 131 13.340 -2.836 -4.888 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.589 -0.627 -6.182 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.423 0.176 -4.867 1.00 0.00 H new ATOM 953 N GLY A 132 12.771 -1.674 -2.076 1.00 0.00 N ATOM 954 CA GLY A 132 13.267 -1.474 -0.727 1.00 0.00 C ATOM 955 C GLY A 132 12.250 -0.794 0.169 1.00 0.00 C ATOM 956 O GLY A 132 11.621 -1.440 1.009 1.00 0.00 O ATOM 0 H GLY A 132 11.762 -1.809 -2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 132 13.539 -2.438 -0.297 1.00 0.00 H new ATOM 0 HA3 GLY A 132 14.175 -0.873 -0.762 1.00 0.00 H new ATOM 960 N LEU A 133 12.089 0.513 -0.007 1.00 0.00 N ATOM 961 CA LEU A 133 11.142 1.281 0.794 1.00 0.00 C ATOM 962 C LEU A 133 10.047 1.879 -0.083 1.00 0.00 C ATOM 963 O LEU A 133 9.117 2.515 0.413 1.00 0.00 O ATOM 964 CB LEU A 133 11.870 2.394 1.550 1.00 0.00 C ATOM 965 CG LEU A 133 12.493 1.999 2.889 1.00 0.00 C ATOM 966 CD1 LEU A 133 13.588 2.981 3.279 1.00 0.00 C ATOM 967 CD2 LEU A 133 11.428 1.927 3.973 1.00 0.00 C ATOM 0 H LEU A 133 12.601 1.063 -0.697 1.00 0.00 H new ATOM 0 HA LEU A 133 10.678 0.605 1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 133 12.658 2.787 0.907 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.166 3.207 1.725 1.00 0.00 H new ATOM 0 HG LEU A 133 12.941 1.011 2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 133 14.020 2.684 4.235 1.00 0.00 H new ATOM 0 HD12 LEU A 133 14.365 2.982 2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 133 13.165 3.982 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.890 1.644 4.919 1.00 0.00 H new ATOM 0 HD22 LEU A 133 10.950 2.901 4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 133 10.679 1.184 3.699 1.00 0.00 H new ATOM 979 N LYS A 134 10.162 1.669 -1.390 1.00 0.00 N ATOM 980 CA LYS A 134 9.180 2.183 -2.338 1.00 0.00 C ATOM 981 C LYS A 134 8.535 1.047 -3.124 1.00 0.00 C ATOM 982 O LYS A 134 9.094 0.566 -4.111 1.00 0.00 O ATOM 983 CB LYS A 134 9.840 3.173 -3.300 1.00 0.00 C ATOM 984 CG LYS A 134 10.655 4.248 -2.602 1.00 0.00 C ATOM 985 CD LYS A 134 10.676 5.540 -3.402 1.00 0.00 C ATOM 986 CE LYS A 134 9.363 6.296 -3.275 1.00 0.00 C ATOM 987 NZ LYS A 134 9.188 7.293 -4.367 1.00 0.00 N ATOM 0 H LYS A 134 10.926 1.146 -1.817 1.00 0.00 H new ATOM 0 HA LYS A 134 8.402 2.697 -1.774 1.00 0.00 H new ATOM 0 HB2 LYS A 134 10.488 2.625 -3.984 1.00 0.00 H new ATOM 0 HB3 LYS A 134 9.068 3.649 -3.904 1.00 0.00 H new ATOM 0 HG2 LYS A 134 10.237 4.438 -1.613 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.675 3.894 -2.454 1.00 0.00 H new ATOM 0 HD2 LYS A 134 11.495 6.170 -3.055 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.868 5.316 -4.451 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.534 5.589 -3.293 1.00 0.00 H new ATOM 0 HE3 LYS A 134 9.328 6.804 -2.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 8.693 8.129 -3.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.120 7.576 -4.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.629 6.871 -5.136 1.00 0.00 H new ATOM 1001 N LEU A 135 7.357 0.622 -2.683 1.00 0.00 N ATOM 1002 CA LEU A 135 6.635 -0.458 -3.347 1.00 0.00 C ATOM 1003 C LEU A 135 5.665 0.095 -4.388 1.00 0.00 C ATOM 1004 O LEU A 135 4.745 0.844 -4.059 1.00 0.00 O ATOM 1005 CB LEU A 135 5.873 -1.297 -2.319 1.00 0.00 C ATOM 1006 CG LEU A 135 5.369 -0.549 -1.084 1.00 0.00 C ATOM 1007 CD1 LEU A 135 4.095 -1.191 -0.556 1.00 0.00 C ATOM 1008 CD2 LEU A 135 6.441 -0.519 -0.004 1.00 0.00 C ATOM 0 H LEU A 135 6.881 1.009 -1.868 1.00 0.00 H new ATOM 0 HA LEU A 135 7.363 -1.090 -3.855 1.00 0.00 H new ATOM 0 HB2 LEU A 135 5.018 -1.755 -2.816 1.00 0.00 H new ATOM 0 HB3 LEU A 135 6.522 -2.108 -1.988 1.00 0.00 H new ATOM 0 HG LEU A 135 5.143 0.478 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 135 3.750 -0.646 0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 135 3.325 -1.160 -1.327 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.295 -2.228 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.065 0.017 0.867 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.699 -1.539 0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.328 -0.014 -0.386 1.00 0.00 H new ATOM 1020 N LYS A 136 5.877 -0.281 -5.644 1.00 0.00 N ATOM 1021 CA LYS A 136 5.021 0.173 -6.734 1.00 0.00 C ATOM 1022 C LYS A 136 3.558 -0.154 -6.449 1.00 0.00 C ATOM 1023 O LYS A 136 3.247 -0.889 -5.512 1.00 0.00 O ATOM 1024 CB LYS A 136 5.452 -0.474 -8.052 1.00 0.00 C ATOM 1025 CG LYS A 136 5.305 0.442 -9.255 1.00 0.00 C ATOM 1026 CD LYS A 136 6.591 1.201 -9.538 1.00 0.00 C ATOM 1027 CE LYS A 136 7.484 0.443 -10.509 1.00 0.00 C ATOM 1028 NZ LYS A 136 8.441 1.348 -11.204 1.00 0.00 N ATOM 0 H LYS A 136 6.635 -0.900 -5.933 1.00 0.00 H new ATOM 0 HA LYS A 136 5.124 1.255 -6.817 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.493 -0.788 -7.970 1.00 0.00 H new ATOM 0 HB3 LYS A 136 4.859 -1.374 -8.216 1.00 0.00 H new ATOM 0 HG2 LYS A 136 5.029 -0.146 -10.130 1.00 0.00 H new ATOM 0 HG3 LYS A 136 4.495 1.150 -9.078 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.353 2.181 -9.951 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.128 1.370 -8.605 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.037 -0.325 -9.969 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.866 -0.068 -11.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.031 0.794 -11.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.913 2.066 -11.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 9.048 1.817 -10.502 1.00 0.00 H new ATOM 1042 N VAL A 137 2.664 0.395 -7.265 1.00 0.00 N ATOM 1043 CA VAL A 137 1.235 0.159 -7.103 1.00 0.00 C ATOM 1044 C VAL A 137 0.508 0.243 -8.440 1.00 0.00 C ATOM 1045 O VAL A 137 0.716 1.177 -9.215 1.00 0.00 O ATOM 1046 CB VAL A 137 0.607 1.171 -6.126 1.00 0.00 C ATOM 1047 CG1 VAL A 137 1.255 1.063 -4.754 1.00 0.00 C ATOM 1048 CG2 VAL A 137 0.729 2.585 -6.672 1.00 0.00 C ATOM 0 H VAL A 137 2.905 1.006 -8.045 1.00 0.00 H new ATOM 0 HA VAL A 137 1.125 -0.846 -6.696 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.452 0.937 -6.020 1.00 0.00 H new ATOM 0 HG11 VAL A 137 0.798 1.786 -4.078 1.00 0.00 H new ATOM 0 HG12 VAL A 137 1.110 0.057 -4.361 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.322 1.269 -4.838 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.280 3.287 -5.969 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.782 2.832 -6.809 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.213 2.651 -7.630 1.00 0.00 H new ATOM 1058 N LYS A 138 -0.346 -0.739 -8.706 1.00 0.00 N ATOM 1059 CA LYS A 138 -1.106 -0.778 -9.950 1.00 0.00 C ATOM 1060 C LYS A 138 -2.606 -0.784 -9.671 1.00 0.00 C ATOM 1061 O LYS A 138 -3.097 -1.592 -8.883 1.00 0.00 O ATOM 1062 CB LYS A 138 -0.724 -2.013 -10.767 1.00 0.00 C ATOM 1063 CG LYS A 138 -0.988 -3.324 -10.048 1.00 0.00 C ATOM 1064 CD LYS A 138 -0.323 -4.493 -10.755 1.00 0.00 C ATOM 1065 CE LYS A 138 -0.994 -4.794 -12.087 1.00 0.00 C ATOM 1066 NZ LYS A 138 -0.454 -3.945 -13.185 1.00 0.00 N ATOM 0 H LYS A 138 -0.530 -1.520 -8.076 1.00 0.00 H new ATOM 0 HA LYS A 138 -0.864 0.117 -10.522 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -1.280 -2.004 -11.704 1.00 0.00 H new ATOM 0 HB3 LYS A 138 0.334 -1.956 -11.023 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -0.619 -3.259 -9.025 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -2.063 -3.497 -9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 138 0.731 -4.268 -10.920 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -0.364 -5.376 -10.118 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.850 -5.845 -12.337 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -2.068 -4.632 -11.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -1.198 -3.303 -13.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 0.349 -3.387 -12.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -0.135 -4.551 -13.968 1.00 0.00 H new ATOM 1080 N ARG A 139 -3.328 0.121 -10.324 1.00 0.00 N ATOM 1081 CA ARG A 139 -4.772 0.219 -10.146 1.00 0.00 C ATOM 1082 C ARG A 139 -5.461 -1.074 -10.572 1.00 0.00 C ATOM 1083 O ARG A 139 -5.420 -1.454 -11.742 1.00 0.00 O ATOM 1084 CB ARG A 139 -5.327 1.395 -10.951 1.00 0.00 C ATOM 1085 CG ARG A 139 -6.846 1.458 -10.968 1.00 0.00 C ATOM 1086 CD ARG A 139 -7.383 2.259 -9.792 1.00 0.00 C ATOM 1087 NE ARG A 139 -8.683 2.856 -10.085 1.00 0.00 N ATOM 1088 CZ ARG A 139 -8.859 3.843 -10.957 1.00 0.00 C ATOM 1089 NH1 ARG A 139 -7.823 4.339 -11.619 1.00 0.00 N ATOM 1090 NH2 ARG A 139 -10.073 4.334 -11.169 1.00 0.00 N ATOM 0 H ARG A 139 -2.937 0.796 -10.981 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.973 0.385 -9.088 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -4.938 2.325 -10.536 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -4.963 1.327 -11.976 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -7.182 1.910 -11.901 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -7.254 0.448 -10.938 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -7.470 1.610 -8.921 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -6.673 3.045 -9.534 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.501 2.496 -9.593 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -6.888 3.963 -11.459 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -7.961 5.097 -12.288 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -10.873 3.954 -10.662 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -10.207 5.092 -11.839 1.00 0.00 H new ATOM 1104 N ILE A 140 -6.093 -1.744 -9.614 1.00 0.00 N ATOM 1105 CA ILE A 140 -6.791 -2.993 -9.891 1.00 0.00 C ATOM 1106 C ILE A 140 -8.282 -2.867 -9.595 1.00 0.00 C ATOM 1107 O ILE A 140 -8.694 -2.290 -8.589 1.00 0.00 O ATOM 1108 CB ILE A 140 -6.212 -4.157 -9.064 1.00 0.00 C ATOM 1109 CG1 ILE A 140 -6.303 -3.844 -7.569 1.00 0.00 C ATOM 1110 CG2 ILE A 140 -4.770 -4.426 -9.468 1.00 0.00 C ATOM 1111 CD1 ILE A 140 -5.946 -5.017 -6.684 1.00 0.00 C ATOM 0 H ILE A 140 -6.136 -1.443 -8.640 1.00 0.00 H new ATOM 0 HA ILE A 140 -6.650 -3.205 -10.951 1.00 0.00 H new ATOM 0 HB ILE A 140 -6.799 -5.054 -9.264 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -5.639 -3.011 -7.339 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.316 -3.518 -7.335 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -4.374 -5.251 -8.876 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -4.731 -4.687 -10.525 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -4.170 -3.533 -9.293 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -6.032 -4.723 -5.638 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.626 -5.845 -6.886 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -4.922 -5.330 -6.890 1.00 0.00 H new ATOM 1123 N PRO A 141 -9.112 -3.422 -10.491 1.00 0.00 N ATOM 1124 CA PRO A 141 -10.570 -3.386 -10.347 1.00 0.00 C ATOM 1125 C PRO A 141 -11.061 -4.266 -9.202 1.00 0.00 C ATOM 1126 O PRO A 141 -10.473 -5.301 -8.886 1.00 0.00 O ATOM 1127 CB PRO A 141 -11.072 -3.926 -11.688 1.00 0.00 C ATOM 1128 CG PRO A 141 -9.958 -4.774 -12.196 1.00 0.00 C ATOM 1129 CD PRO A 141 -8.691 -4.126 -11.713 1.00 0.00 C ATOM 0 HA PRO A 141 -10.932 -2.385 -10.112 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -11.986 -4.506 -11.564 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -11.300 -3.116 -12.381 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -10.042 -5.794 -11.821 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -9.976 -4.832 -13.284 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -7.916 -4.864 -11.505 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -8.284 -3.437 -12.454 1.00 0.00 H new ATOM 1137 N PRO A 142 -12.164 -3.848 -8.564 1.00 0.00 N ATOM 1138 CA PRO A 142 -12.759 -4.584 -7.444 1.00 0.00 C ATOM 1139 C PRO A 142 -13.394 -5.898 -7.887 1.00 0.00 C ATOM 1140 O PRO A 142 -13.461 -6.194 -9.079 1.00 0.00 O ATOM 1141 CB PRO A 142 -13.828 -3.624 -6.916 1.00 0.00 C ATOM 1142 CG PRO A 142 -14.180 -2.770 -8.085 1.00 0.00 C ATOM 1143 CD PRO A 142 -12.917 -2.624 -8.887 1.00 0.00 C ATOM 0 HA PRO A 142 -12.015 -4.865 -6.699 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -14.698 -4.166 -6.545 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -13.448 -3.025 -6.088 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -14.969 -3.229 -8.680 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -14.551 -1.798 -7.760 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -13.125 -2.550 -9.954 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -12.365 -1.727 -8.607 1.00 0.00 H new ATOM 1151 N GLN A 143 -13.859 -6.680 -6.918 1.00 0.00 N ATOM 1152 CA GLN A 143 -14.489 -7.963 -7.210 1.00 0.00 C ATOM 1153 C GLN A 143 -15.956 -7.777 -7.581 1.00 0.00 C ATOM 1154 O GLN A 143 -16.434 -8.337 -8.569 1.00 0.00 O ATOM 1155 CB GLN A 143 -14.369 -8.899 -6.005 1.00 0.00 C ATOM 1156 CG GLN A 143 -14.307 -10.370 -6.382 1.00 0.00 C ATOM 1157 CD GLN A 143 -13.880 -11.251 -5.225 1.00 0.00 C ATOM 1158 OE1 GLN A 143 -14.666 -11.532 -4.320 1.00 0.00 O ATOM 1159 NE2 GLN A 143 -12.628 -11.693 -5.248 1.00 0.00 N ATOM 0 H GLN A 143 -13.812 -6.449 -5.926 1.00 0.00 H new ATOM 0 HA GLN A 143 -13.973 -8.409 -8.060 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.473 -8.639 -5.441 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -15.220 -8.737 -5.344 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -15.286 -10.692 -6.737 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -13.610 -10.500 -7.209 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -12.010 -11.435 -6.018 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -12.284 -12.290 -4.496 1.00 0.00 H new ATOM 1168 N LEU A 144 -16.668 -6.988 -6.783 1.00 0.00 N ATOM 1169 CA LEU A 144 -18.082 -6.728 -7.027 1.00 0.00 C ATOM 1170 C LEU A 144 -18.263 -5.702 -8.141 1.00 0.00 C ATOM 1171 O LEU A 144 -19.055 -4.769 -8.016 1.00 0.00 O ATOM 1172 CB LEU A 144 -18.758 -6.233 -5.747 1.00 0.00 C ATOM 1173 CG LEU A 144 -19.020 -7.290 -4.674 1.00 0.00 C ATOM 1174 CD1 LEU A 144 -17.847 -7.374 -3.711 1.00 0.00 C ATOM 1175 CD2 LEU A 144 -20.307 -6.980 -3.923 1.00 0.00 C ATOM 0 H LEU A 144 -16.289 -6.517 -5.961 1.00 0.00 H new ATOM 0 HA LEU A 144 -18.549 -7.662 -7.339 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -18.138 -5.449 -5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -19.709 -5.774 -6.017 1.00 0.00 H new ATOM 0 HG LEU A 144 -19.132 -8.257 -5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -18.051 -8.131 -2.954 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -16.944 -7.643 -4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -17.703 -6.408 -3.228 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -20.478 -7.743 -3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -20.223 -6.004 -3.445 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -21.143 -6.971 -4.622 1.00 0.00 H new ATOM 1187 N GLU A 145 -17.524 -5.884 -9.231 1.00 0.00 N ATOM 1188 CA GLU A 145 -17.604 -4.974 -10.368 1.00 0.00 C ATOM 1189 C GLU A 145 -18.646 -5.452 -11.375 1.00 0.00 C ATOM 1190 O GLU A 145 -18.390 -6.363 -12.162 1.00 0.00 O ATOM 1191 CB GLU A 145 -16.239 -4.851 -11.049 1.00 0.00 C ATOM 1192 CG GLU A 145 -16.228 -3.883 -12.220 1.00 0.00 C ATOM 1193 CD GLU A 145 -15.196 -4.248 -13.269 1.00 0.00 C ATOM 1194 OE1 GLU A 145 -14.060 -4.598 -12.888 1.00 0.00 O ATOM 1195 OE2 GLU A 145 -15.526 -4.184 -14.472 1.00 0.00 O ATOM 0 H GLU A 145 -16.864 -6.652 -9.351 1.00 0.00 H new ATOM 0 HA GLU A 145 -17.906 -3.995 -9.996 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -15.503 -4.526 -10.313 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -15.927 -5.835 -11.399 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -17.216 -3.863 -12.679 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -16.027 -2.877 -11.853 1.00 0.00 H new TER 1202 GLU A 145