USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 703 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 16 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 20 ASN : amide:sc= -0.101 K(o=-0.1,f=-0.64) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -111:sc= 0.146 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.217 USER MOD Single : A 15 SER OG : rot 105:sc= 1.16 USER MOD Single : A 19 HIS : no HD1:sc= -0.241 X(o=-0.24,f=-0.0031) USER MOD Single : A 21 THR OG1 : rot 94:sc= 1.25 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 163:sc= 1.26 (180deg=1.01) USER MOD Single : A 31 SER OG : rot 180:sc= 0.2 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 34:sc= 0.255 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 103:sc= 1.12 USER MOD Single : A 59 TYR OH : rot 149:sc= 1.03 USER MOD Single : A 64 SER OG : rot 170:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -100:sc= 0.203 USER MOD Single : A 84 SER OG : rot -32:sc= 0.339 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.013 3.968 -9.987 1.00 10.00 N ATOM 2 CA MET A 1 -14.914 4.492 -11.042 1.00 10.00 C ATOM 3 C MET A 1 -14.559 5.943 -11.359 1.00 10.00 C ATOM 4 O MET A 1 -13.879 6.563 -10.549 1.00 10.00 O ATOM 5 CB MET A 1 -16.398 4.360 -10.645 1.00 10.00 C ATOM 6 CG MET A 1 -16.842 5.329 -9.536 1.00 10.00 C ATOM 7 SD MET A 1 -18.584 5.187 -9.058 1.00 10.00 S ATOM 8 CE MET A 1 -18.542 3.687 -8.042 1.00 10.00 C ATOM 0 H1 MET A 1 -13.380 3.251 -10.396 1.00 10.00 H new ATOM 0 H2 MET A 1 -13.447 4.748 -9.595 1.00 10.00 H new ATOM 0 H3 MET A 1 -14.580 3.537 -9.229 1.00 10.00 H new ATOM 0 HA MET A 1 -14.770 3.890 -11.939 1.00 10.00 H new ATOM 0 HB2 MET A 1 -17.015 4.528 -11.528 1.00 10.00 H new ATOM 0 HB3 MET A 1 -16.585 3.338 -10.315 1.00 10.00 H new ATOM 0 HG2 MET A 1 -16.223 5.160 -8.655 1.00 10.00 H new ATOM 0 HG3 MET A 1 -16.652 6.350 -9.867 1.00 10.00 H new ATOM 0 HE1 MET A 1 -19.544 3.469 -7.674 1.00 10.00 H new ATOM 0 HE2 MET A 1 -18.186 2.850 -8.643 1.00 10.00 H new ATOM 0 HE3 MET A 1 -17.870 3.838 -7.197 1.00 10.00 H new ATOM 18 N SER A 2 -15.042 6.480 -12.490 1.00 10.00 N ATOM 19 CA SER A 2 -14.971 7.912 -12.851 1.00 10.00 C ATOM 20 C SER A 2 -13.584 8.561 -12.667 1.00 10.00 C ATOM 21 O SER A 2 -13.476 9.713 -12.236 1.00 10.00 O ATOM 22 CB SER A 2 -16.073 8.684 -12.110 1.00 10.00 C ATOM 23 OG SER A 2 -17.339 8.100 -12.355 1.00 10.00 O ATOM 0 H SER A 2 -15.507 5.917 -13.202 1.00 10.00 H new ATOM 0 HA SER A 2 -15.141 7.969 -13.926 1.00 10.00 H new ATOM 0 HB2 SER A 2 -15.868 8.685 -11.040 1.00 10.00 H new ATOM 0 HB3 SER A 2 -16.077 9.725 -12.435 1.00 10.00 H new ATOM 0 HG SER A 2 -18.030 8.603 -11.874 1.00 10.00 H new ATOM 29 N LEU A 3 -12.531 7.792 -12.964 1.00 10.00 N ATOM 30 CA LEU A 3 -11.128 8.148 -12.758 1.00 10.00 C ATOM 31 C LEU A 3 -10.703 9.393 -13.566 1.00 10.00 C ATOM 32 O LEU A 3 -11.396 9.837 -14.484 1.00 10.00 O ATOM 33 CB LEU A 3 -10.267 6.907 -13.072 1.00 10.00 C ATOM 34 CG LEU A 3 -10.480 5.736 -12.085 1.00 10.00 C ATOM 35 CD1 LEU A 3 -9.886 4.445 -12.643 1.00 10.00 C ATOM 36 CD2 LEU A 3 -9.840 6.013 -10.721 1.00 10.00 C ATOM 0 H LEU A 3 -12.641 6.864 -13.372 1.00 10.00 H new ATOM 0 HA LEU A 3 -10.977 8.437 -11.718 1.00 10.00 H new ATOM 0 HB2 LEU A 3 -10.493 6.565 -14.082 1.00 10.00 H new ATOM 0 HB3 LEU A 3 -9.215 7.193 -13.061 1.00 10.00 H new ATOM 0 HG LEU A 3 -11.557 5.630 -11.956 1.00 10.00 H new ATOM 0 HD11 LEU A 3 -10.047 3.634 -11.933 1.00 10.00 H new ATOM 0 HD12 LEU A 3 -10.370 4.201 -13.589 1.00 10.00 H new ATOM 0 HD13 LEU A 3 -8.816 4.577 -12.806 1.00 10.00 H new ATOM 0 HD21 LEU A 3 -10.014 5.165 -10.059 1.00 10.00 H new ATOM 0 HD22 LEU A 3 -8.768 6.162 -10.846 1.00 10.00 H new ATOM 0 HD23 LEU A 3 -10.283 6.909 -10.287 1.00 10.00 H new ATOM 48 N ARG A 4 -9.549 9.967 -13.203 1.00 10.00 N ATOM 49 CA ARG A 4 -9.076 11.277 -13.672 1.00 10.00 C ATOM 50 C ARG A 4 -7.755 11.188 -14.447 1.00 10.00 C ATOM 51 O ARG A 4 -7.106 10.144 -14.501 1.00 10.00 O ATOM 52 CB ARG A 4 -8.951 12.215 -12.448 1.00 10.00 C ATOM 53 CG ARG A 4 -10.119 13.197 -12.285 1.00 10.00 C ATOM 54 CD ARG A 4 -11.491 12.540 -12.076 1.00 10.00 C ATOM 55 NE ARG A 4 -12.518 13.575 -11.865 1.00 10.00 N ATOM 56 CZ ARG A 4 -13.835 13.420 -11.899 1.00 10.00 C ATOM 57 NH1 ARG A 4 -14.415 12.257 -12.076 1.00 10.00 N ATOM 58 NH2 ARG A 4 -14.615 14.466 -11.752 1.00 10.00 N ATOM 0 H ARG A 4 -8.899 9.520 -12.556 1.00 10.00 H new ATOM 0 HA ARG A 4 -9.801 11.678 -14.380 1.00 10.00 H new ATOM 0 HB2 ARG A 4 -8.873 11.608 -11.546 1.00 10.00 H new ATOM 0 HB3 ARG A 4 -8.024 12.782 -12.532 1.00 10.00 H new ATOM 0 HG2 ARG A 4 -9.911 13.849 -11.436 1.00 10.00 H new ATOM 0 HG3 ARG A 4 -10.167 13.832 -13.170 1.00 10.00 H new ATOM 0 HD2 ARG A 4 -11.748 11.932 -12.943 1.00 10.00 H new ATOM 0 HD3 ARG A 4 -11.456 11.870 -11.217 1.00 10.00 H new ATOM 0 HE ARG A 4 -12.178 14.517 -11.671 1.00 10.00 H new ATOM 0 HH11 ARG A 4 -13.848 11.417 -12.195 1.00 10.00 H new ATOM 0 HH12 ARG A 4 -15.433 12.192 -12.094 1.00 10.00 H new ATOM 0 HH21 ARG A 4 -14.207 15.391 -11.613 1.00 10.00 H new ATOM 0 HH22 ARG A 4 -15.629 14.354 -11.777 1.00 10.00 H new ATOM 72 N LYS A 5 -7.372 12.315 -15.063 1.00 10.00 N ATOM 73 CA LYS A 5 -6.051 12.522 -15.666 1.00 10.00 C ATOM 74 C LYS A 5 -5.036 12.519 -14.523 1.00 10.00 C ATOM 75 O LYS A 5 -5.064 13.427 -13.699 1.00 10.00 O ATOM 76 CB LYS A 5 -5.987 13.868 -16.417 1.00 10.00 C ATOM 77 CG LYS A 5 -6.588 13.867 -17.831 1.00 10.00 C ATOM 78 CD LYS A 5 -8.099 13.605 -17.884 1.00 10.00 C ATOM 79 CE LYS A 5 -8.601 13.821 -19.315 1.00 10.00 C ATOM 80 NZ LYS A 5 -10.048 13.525 -19.436 1.00 10.00 N ATOM 0 H LYS A 5 -7.986 13.124 -15.157 1.00 10.00 H new ATOM 0 HA LYS A 5 -5.841 11.735 -16.391 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -6.504 14.621 -15.822 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.944 14.177 -16.485 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -6.383 14.830 -18.299 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -6.080 13.108 -18.427 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -8.315 12.587 -17.561 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -8.620 14.274 -17.199 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -8.414 14.852 -19.615 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -8.040 13.183 -19.998 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -10.354 13.682 -20.418 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -10.223 12.534 -19.173 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -10.585 14.151 -18.802 1.00 10.00 H new ATOM 94 N LEU A 6 -4.144 11.529 -14.498 1.00 10.00 N ATOM 95 CA LEU A 6 -3.294 11.276 -13.339 1.00 10.00 C ATOM 96 C LEU A 6 -2.179 12.324 -13.238 1.00 10.00 C ATOM 97 O LEU A 6 -1.289 12.393 -14.085 1.00 10.00 O ATOM 98 CB LEU A 6 -2.694 9.860 -13.451 1.00 10.00 C ATOM 99 CG LEU A 6 -3.695 8.700 -13.284 1.00 10.00 C ATOM 100 CD1 LEU A 6 -2.959 7.368 -13.462 1.00 10.00 C ATOM 101 CD2 LEU A 6 -4.354 8.716 -11.904 1.00 10.00 C ATOM 0 H LEU A 6 -3.992 10.886 -15.275 1.00 10.00 H new ATOM 0 HA LEU A 6 -3.897 11.346 -12.434 1.00 10.00 H new ATOM 0 HB2 LEU A 6 -2.213 9.764 -14.424 1.00 10.00 H new ATOM 0 HB3 LEU A 6 -1.913 9.754 -12.698 1.00 10.00 H new ATOM 0 HG LEU A 6 -4.473 8.818 -14.038 1.00 10.00 H new ATOM 0 HD11 LEU A 6 -3.663 6.545 -13.345 1.00 10.00 H new ATOM 0 HD12 LEU A 6 -2.516 7.327 -14.457 1.00 10.00 H new ATOM 0 HD13 LEU A 6 -2.173 7.283 -12.711 1.00 10.00 H new ATOM 0 HD21 LEU A 6 -5.053 7.883 -11.825 1.00 10.00 H new ATOM 0 HD22 LEU A 6 -3.588 8.622 -11.134 1.00 10.00 H new ATOM 0 HD23 LEU A 6 -4.891 9.655 -11.768 1.00 10.00 H new ATOM 113 N THR A 7 -2.236 13.129 -12.174 1.00 10.00 N ATOM 114 CA THR A 7 -1.236 14.139 -11.822 1.00 10.00 C ATOM 115 C THR A 7 -0.922 14.072 -10.320 1.00 10.00 C ATOM 116 O THR A 7 -1.295 13.112 -9.647 1.00 10.00 O ATOM 117 CB THR A 7 -1.707 15.525 -12.307 1.00 10.00 C ATOM 118 OG1 THR A 7 -0.655 16.459 -12.198 1.00 10.00 O ATOM 119 CG2 THR A 7 -2.925 16.085 -11.567 1.00 10.00 C ATOM 0 H THR A 7 -3.009 13.093 -11.509 1.00 10.00 H new ATOM 0 HA THR A 7 -0.293 13.940 -12.331 1.00 10.00 H new ATOM 0 HB THR A 7 -2.010 15.372 -13.343 1.00 10.00 H new ATOM 0 HG1 THR A 7 -0.962 17.336 -12.510 1.00 10.00 H new ATOM 0 HG21 THR A 7 -3.182 17.062 -11.977 1.00 10.00 H new ATOM 0 HG22 THR A 7 -3.769 15.406 -11.690 1.00 10.00 H new ATOM 0 HG23 THR A 7 -2.692 16.186 -10.507 1.00 10.00 H new ATOM 127 N GLU A 8 -0.207 15.068 -9.789 1.00 10.00 N ATOM 128 CA GLU A 8 0.279 15.123 -8.403 1.00 10.00 C ATOM 129 C GLU A 8 -0.810 14.764 -7.380 1.00 10.00 C ATOM 130 O GLU A 8 -0.567 13.951 -6.492 1.00 10.00 O ATOM 131 CB GLU A 8 0.848 16.525 -8.119 1.00 10.00 C ATOM 132 CG GLU A 8 2.052 16.873 -9.009 1.00 10.00 C ATOM 133 CD GLU A 8 2.499 18.324 -8.801 1.00 10.00 C ATOM 134 OE1 GLU A 8 1.792 19.219 -9.318 1.00 10.00 O ATOM 135 OE2 GLU A 8 3.544 18.524 -8.142 1.00 10.00 O ATOM 0 H GLU A 8 0.060 15.890 -10.331 1.00 10.00 H new ATOM 0 HA GLU A 8 1.063 14.374 -8.294 1.00 10.00 H new ATOM 0 HB2 GLU A 8 0.064 17.267 -8.270 1.00 10.00 H new ATOM 0 HB3 GLU A 8 1.147 16.585 -7.072 1.00 10.00 H new ATOM 0 HG2 GLU A 8 2.879 16.200 -8.784 1.00 10.00 H new ATOM 0 HG3 GLU A 8 1.790 16.718 -10.056 1.00 10.00 H new ATOM 142 N GLY A 9 -2.030 15.290 -7.558 1.00 10.00 N ATOM 143 CA GLY A 9 -3.168 15.006 -6.684 1.00 10.00 C ATOM 144 C GLY A 9 -3.582 13.532 -6.677 1.00 10.00 C ATOM 145 O GLY A 9 -3.722 12.940 -5.608 1.00 10.00 O ATOM 0 H GLY A 9 -2.253 15.930 -8.321 1.00 10.00 H new ATOM 0 HA2 GLY A 9 -2.919 15.310 -5.667 1.00 10.00 H new ATOM 0 HA3 GLY A 9 -4.018 15.612 -6.999 1.00 10.00 H new ATOM 149 N ASP A 10 -3.746 12.923 -7.857 1.00 10.00 N ATOM 150 CA ASP A 10 -4.098 11.508 -7.992 1.00 10.00 C ATOM 151 C ASP A 10 -2.965 10.610 -7.487 1.00 10.00 C ATOM 152 O ASP A 10 -3.216 9.634 -6.789 1.00 10.00 O ATOM 153 CB ASP A 10 -4.381 11.151 -9.460 1.00 10.00 C ATOM 154 CG ASP A 10 -5.160 12.217 -10.226 1.00 10.00 C ATOM 155 OD1 ASP A 10 -4.509 13.243 -10.536 1.00 10.00 O ATOM 156 OD2 ASP A 10 -6.346 11.978 -10.540 1.00 10.00 O ATOM 0 H ASP A 10 -3.637 13.403 -8.750 1.00 10.00 H new ATOM 0 HA ASP A 10 -4.993 11.342 -7.393 1.00 10.00 H new ATOM 0 HB2 ASP A 10 -3.433 10.975 -9.968 1.00 10.00 H new ATOM 0 HB3 ASP A 10 -4.939 10.215 -9.493 1.00 10.00 H new ATOM 161 N LEU A 11 -1.714 10.950 -7.818 1.00 10.00 N ATOM 162 CA LEU A 11 -0.523 10.255 -7.335 1.00 10.00 C ATOM 163 C LEU A 11 -0.363 10.321 -5.808 1.00 10.00 C ATOM 164 O LEU A 11 -0.051 9.290 -5.206 1.00 10.00 O ATOM 165 CB LEU A 11 0.716 10.747 -8.110 1.00 10.00 C ATOM 166 CG LEU A 11 0.920 10.109 -9.507 1.00 10.00 C ATOM 167 CD1 LEU A 11 -0.292 9.970 -10.434 1.00 10.00 C ATOM 168 CD2 LEU A 11 2.018 10.853 -10.273 1.00 10.00 C ATOM 0 H LEU A 11 -1.501 11.730 -8.440 1.00 10.00 H new ATOM 0 HA LEU A 11 -0.640 9.191 -7.539 1.00 10.00 H new ATOM 0 HB2 LEU A 11 0.644 11.828 -8.230 1.00 10.00 H new ATOM 0 HB3 LEU A 11 1.603 10.552 -7.507 1.00 10.00 H new ATOM 0 HG LEU A 11 1.182 9.083 -9.248 1.00 10.00 H new ATOM 0 HD11 LEU A 11 0.018 9.506 -11.370 1.00 10.00 H new ATOM 0 HD12 LEU A 11 -1.048 9.349 -9.954 1.00 10.00 H new ATOM 0 HD13 LEU A 11 -0.709 10.956 -10.638 1.00 10.00 H new ATOM 0 HD21 LEU A 11 2.152 10.395 -11.253 1.00 10.00 H new ATOM 0 HD22 LEU A 11 1.732 11.897 -10.396 1.00 10.00 H new ATOM 0 HD23 LEU A 11 2.953 10.797 -9.715 1.00 10.00 H new ATOM 180 N ASP A 12 -0.639 11.464 -5.168 1.00 10.00 N ATOM 181 CA ASP A 12 -0.703 11.560 -3.704 1.00 10.00 C ATOM 182 C ASP A 12 -1.877 10.749 -3.131 1.00 10.00 C ATOM 183 O ASP A 12 -1.682 9.987 -2.180 1.00 10.00 O ATOM 184 CB ASP A 12 -0.824 13.030 -3.260 1.00 10.00 C ATOM 185 CG ASP A 12 0.478 13.837 -3.353 1.00 10.00 C ATOM 186 OD1 ASP A 12 1.563 13.213 -3.330 1.00 10.00 O ATOM 187 OD2 ASP A 12 0.368 15.084 -3.367 1.00 10.00 O ATOM 0 H ASP A 12 -0.824 12.345 -5.648 1.00 10.00 H new ATOM 0 HA ASP A 12 0.224 11.140 -3.314 1.00 10.00 H new ATOM 0 HB2 ASP A 12 -1.583 13.519 -3.871 1.00 10.00 H new ATOM 0 HB3 ASP A 12 -1.179 13.056 -2.230 1.00 10.00 H new ATOM 192 N GLU A 13 -3.080 10.862 -3.715 1.00 10.00 N ATOM 193 CA GLU A 13 -4.264 10.131 -3.242 1.00 10.00 C ATOM 194 C GLU A 13 -4.072 8.614 -3.343 1.00 10.00 C ATOM 195 O GLU A 13 -4.294 7.913 -2.356 1.00 10.00 O ATOM 196 CB GLU A 13 -5.500 10.603 -4.032 1.00 10.00 C ATOM 197 CG GLU A 13 -6.821 9.942 -3.599 1.00 10.00 C ATOM 198 CD GLU A 13 -7.308 8.875 -4.594 1.00 10.00 C ATOM 199 OE1 GLU A 13 -6.799 7.735 -4.531 1.00 10.00 O ATOM 200 OE2 GLU A 13 -8.200 9.211 -5.406 1.00 10.00 O ATOM 0 H GLU A 13 -3.258 11.459 -4.523 1.00 10.00 H new ATOM 0 HA GLU A 13 -4.415 10.350 -2.185 1.00 10.00 H new ATOM 0 HB2 GLU A 13 -5.595 11.683 -3.923 1.00 10.00 H new ATOM 0 HB3 GLU A 13 -5.338 10.403 -5.091 1.00 10.00 H new ATOM 0 HG2 GLU A 13 -6.689 9.484 -2.619 1.00 10.00 H new ATOM 0 HG3 GLU A 13 -7.588 10.709 -3.492 1.00 10.00 H new ATOM 207 N ILE A 14 -3.530 8.124 -4.465 1.00 10.00 N ATOM 208 CA ILE A 14 -3.232 6.706 -4.672 1.00 10.00 C ATOM 209 C ILE A 14 -2.112 6.257 -3.727 1.00 10.00 C ATOM 210 O ILE A 14 -2.220 5.195 -3.114 1.00 10.00 O ATOM 211 CB ILE A 14 -2.901 6.440 -6.160 1.00 10.00 C ATOM 212 CG1 ILE A 14 -4.186 6.583 -7.014 1.00 10.00 C ATOM 213 CG2 ILE A 14 -2.285 5.041 -6.356 1.00 10.00 C ATOM 214 CD1 ILE A 14 -3.925 6.688 -8.523 1.00 10.00 C ATOM 0 H ILE A 14 -3.284 8.710 -5.263 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.111 6.108 -4.431 1.00 10.00 H new ATOM 0 HB ILE A 14 -2.165 7.176 -6.484 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -4.832 5.725 -6.826 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -4.730 7.469 -6.687 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -2.064 4.885 -7.412 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -1.364 4.965 -5.778 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -2.990 4.282 -6.017 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -4.874 6.785 -9.050 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -3.306 7.562 -8.725 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -3.409 5.791 -8.866 1.00 10.00 H new ATOM 226 N SER A 15 -1.059 7.066 -3.553 1.00 10.00 N ATOM 227 CA SER A 15 0.031 6.738 -2.625 1.00 10.00 C ATOM 228 C SER A 15 -0.478 6.629 -1.182 1.00 10.00 C ATOM 229 O SER A 15 -0.120 5.688 -0.468 1.00 10.00 O ATOM 230 CB SER A 15 1.175 7.754 -2.725 1.00 10.00 C ATOM 231 OG SER A 15 1.645 7.821 -4.053 1.00 10.00 O ATOM 0 H SER A 15 -0.939 7.953 -4.043 1.00 10.00 H new ATOM 0 HA SER A 15 0.423 5.764 -2.916 1.00 10.00 H new ATOM 0 HB2 SER A 15 0.829 8.736 -2.403 1.00 10.00 H new ATOM 0 HB3 SER A 15 1.987 7.467 -2.057 1.00 10.00 H new ATOM 0 HG SER A 15 1.318 8.643 -4.475 1.00 10.00 H new ATOM 237 N SER A 16 -1.382 7.533 -0.776 1.00 10.00 N ATOM 238 CA SER A 16 -2.055 7.447 0.520 1.00 10.00 C ATOM 239 C SER A 16 -3.021 6.264 0.597 1.00 10.00 C ATOM 240 O SER A 16 -3.063 5.618 1.638 1.00 10.00 O ATOM 241 CB SER A 16 -2.820 8.731 0.846 1.00 10.00 C ATOM 242 OG SER A 16 -3.299 8.651 2.180 1.00 10.00 O ATOM 0 H SER A 16 -1.663 8.338 -1.336 1.00 10.00 H new ATOM 0 HA SER A 16 -1.263 7.300 1.254 1.00 10.00 H new ATOM 0 HB2 SER A 16 -2.170 9.598 0.730 1.00 10.00 H new ATOM 0 HB3 SER A 16 -3.652 8.861 0.153 1.00 10.00 H new ATOM 0 HG SER A 16 -3.790 9.470 2.401 1.00 10.00 H new ATOM 248 N PHE A 17 -3.789 5.967 -0.457 1.00 10.00 N ATOM 249 CA PHE A 17 -4.687 4.810 -0.519 1.00 10.00 C ATOM 250 C PHE A 17 -3.920 3.493 -0.347 1.00 10.00 C ATOM 251 O PHE A 17 -4.368 2.610 0.387 1.00 10.00 O ATOM 252 CB PHE A 17 -5.451 4.843 -1.852 1.00 10.00 C ATOM 253 CG PHE A 17 -6.279 3.606 -2.145 1.00 10.00 C ATOM 254 CD1 PHE A 17 -7.498 3.401 -1.471 1.00 10.00 C ATOM 255 CD2 PHE A 17 -5.828 2.657 -3.085 1.00 10.00 C ATOM 256 CE1 PHE A 17 -8.264 2.252 -1.736 1.00 10.00 C ATOM 257 CE2 PHE A 17 -6.596 1.509 -3.348 1.00 10.00 C ATOM 258 CZ PHE A 17 -7.814 1.307 -2.675 1.00 10.00 C ATOM 0 H PHE A 17 -3.804 6.534 -1.305 1.00 10.00 H new ATOM 0 HA PHE A 17 -5.398 4.865 0.305 1.00 10.00 H new ATOM 0 HB2 PHE A 17 -6.109 5.712 -1.855 1.00 10.00 H new ATOM 0 HB3 PHE A 17 -4.734 4.983 -2.661 1.00 10.00 H new ATOM 0 HD1 PHE A 17 -7.845 4.127 -0.750 1.00 10.00 H new ATOM 0 HD2 PHE A 17 -4.893 2.812 -3.603 1.00 10.00 H new ATOM 0 HE1 PHE A 17 -9.199 2.095 -1.218 1.00 10.00 H new ATOM 0 HE2 PHE A 17 -6.250 0.782 -4.068 1.00 10.00 H new ATOM 0 HZ PHE A 17 -8.404 0.426 -2.879 1.00 10.00 H new ATOM 268 N LEU A 18 -2.743 3.376 -0.970 1.00 10.00 N ATOM 269 CA LEU A 18 -1.852 2.229 -0.811 1.00 10.00 C ATOM 270 C LEU A 18 -1.279 2.144 0.608 1.00 10.00 C ATOM 271 O LEU A 18 -1.403 1.092 1.236 1.00 10.00 O ATOM 272 CB LEU A 18 -0.741 2.313 -1.870 1.00 10.00 C ATOM 273 CG LEU A 18 -1.254 2.084 -3.304 1.00 10.00 C ATOM 274 CD1 LEU A 18 -0.164 2.433 -4.320 1.00 10.00 C ATOM 275 CD2 LEU A 18 -1.703 0.641 -3.521 1.00 10.00 C ATOM 0 H LEU A 18 -2.380 4.086 -1.606 1.00 10.00 H new ATOM 0 HA LEU A 18 -2.421 1.312 -0.961 1.00 10.00 H new ATOM 0 HB2 LEU A 18 -0.266 3.292 -1.813 1.00 10.00 H new ATOM 0 HB3 LEU A 18 0.026 1.573 -1.643 1.00 10.00 H new ATOM 0 HG LEU A 18 -2.116 2.736 -3.447 1.00 10.00 H new ATOM 0 HD11 LEU A 18 -0.541 2.266 -5.329 1.00 10.00 H new ATOM 0 HD12 LEU A 18 0.118 3.480 -4.206 1.00 10.00 H new ATOM 0 HD13 LEU A 18 0.708 1.802 -4.149 1.00 10.00 H new ATOM 0 HD21 LEU A 18 -2.058 0.520 -4.545 1.00 10.00 H new ATOM 0 HD22 LEU A 18 -0.863 -0.032 -3.347 1.00 10.00 H new ATOM 0 HD23 LEU A 18 -2.509 0.402 -2.827 1.00 10.00 H new ATOM 287 N HIS A 19 -0.732 3.242 1.150 1.00 10.00 N ATOM 288 CA HIS A 19 -0.264 3.277 2.540 1.00 10.00 C ATOM 289 C HIS A 19 -1.383 2.898 3.523 1.00 10.00 C ATOM 290 O HIS A 19 -1.192 2.015 4.361 1.00 10.00 O ATOM 291 CB HIS A 19 0.316 4.665 2.853 1.00 10.00 C ATOM 292 CG HIS A 19 0.665 4.891 4.308 1.00 10.00 C ATOM 293 ND1 HIS A 19 0.545 6.081 4.988 1.00 10.00 N ATOM 294 CD2 HIS A 19 1.111 3.963 5.214 1.00 10.00 C ATOM 295 CE1 HIS A 19 0.913 5.872 6.264 1.00 10.00 C ATOM 296 NE2 HIS A 19 1.265 4.591 6.452 1.00 10.00 N ATOM 0 H HIS A 19 -0.603 4.118 0.644 1.00 10.00 H new ATOM 0 HA HIS A 19 0.523 2.533 2.662 1.00 10.00 H new ATOM 0 HB2 HIS A 19 1.213 4.813 2.251 1.00 10.00 H new ATOM 0 HB3 HIS A 19 -0.404 5.423 2.544 1.00 10.00 H new ATOM 0 HD2 HIS A 19 1.310 2.922 5.005 1.00 10.00 H new ATOM 0 HE1 HIS A 19 0.924 6.631 7.032 1.00 10.00 H new ATOM 0 HE2 HIS A 19 1.581 4.163 7.322 1.00 10.00 H new ATOM 304 N ASN A 20 -2.564 3.509 3.378 1.00 10.00 N ATOM 305 CA ASN A 20 -3.734 3.214 4.200 1.00 10.00 C ATOM 306 C ASN A 20 -4.191 1.757 4.028 1.00 10.00 C ATOM 307 O ASN A 20 -4.529 1.123 5.018 1.00 10.00 O ATOM 308 CB ASN A 20 -4.865 4.209 3.880 1.00 10.00 C ATOM 309 CG ASN A 20 -4.542 5.657 4.249 1.00 10.00 C ATOM 310 OD1 ASN A 20 -3.608 5.967 4.970 1.00 10.00 O ATOM 311 ND2 ASN A 20 -5.318 6.604 3.756 1.00 10.00 N ATOM 0 H ASN A 20 -2.732 4.230 2.677 1.00 10.00 H new ATOM 0 HA ASN A 20 -3.460 3.333 5.248 1.00 10.00 H new ATOM 0 HB2 ASN A 20 -5.089 4.158 2.815 1.00 10.00 H new ATOM 0 HB3 ASN A 20 -5.766 3.902 4.411 1.00 10.00 H new ATOM 0 HD21 ASN A 20 -5.134 7.582 3.979 1.00 10.00 H new ATOM 0 HD22 ASN A 20 -6.102 6.358 3.152 1.00 10.00 H new ATOM 318 N THR A 21 -4.127 1.188 2.815 1.00 10.00 N ATOM 319 CA THR A 21 -4.480 -0.222 2.574 1.00 10.00 C ATOM 320 C THR A 21 -3.573 -1.164 3.373 1.00 10.00 C ATOM 321 O THR A 21 -4.076 -2.063 4.047 1.00 10.00 O ATOM 322 CB THR A 21 -4.420 -0.569 1.072 1.00 10.00 C ATOM 323 OG1 THR A 21 -5.321 0.229 0.338 1.00 10.00 O ATOM 324 CG2 THR A 21 -4.807 -2.023 0.789 1.00 10.00 C ATOM 0 H THR A 21 -3.831 1.688 1.977 1.00 10.00 H new ATOM 0 HA THR A 21 -5.506 -0.360 2.914 1.00 10.00 H new ATOM 0 HB THR A 21 -3.386 -0.393 0.774 1.00 10.00 H new ATOM 0 HG1 THR A 21 -4.855 1.021 -0.001 1.00 10.00 H new ATOM 0 HG21 THR A 21 -4.748 -2.213 -0.283 1.00 10.00 H new ATOM 0 HG22 THR A 21 -4.124 -2.690 1.314 1.00 10.00 H new ATOM 0 HG23 THR A 21 -5.825 -2.202 1.134 1.00 10.00 H new ATOM 332 N ILE A 22 -2.250 -0.940 3.356 1.00 10.00 N ATOM 333 CA ILE A 22 -1.308 -1.725 4.172 1.00 10.00 C ATOM 334 C ILE A 22 -1.542 -1.466 5.666 1.00 10.00 C ATOM 335 O ILE A 22 -1.577 -2.418 6.443 1.00 10.00 O ATOM 336 CB ILE A 22 0.156 -1.422 3.786 1.00 10.00 C ATOM 337 CG1 ILE A 22 0.383 -1.700 2.295 1.00 10.00 C ATOM 338 CG2 ILE A 22 1.166 -2.255 4.600 1.00 10.00 C ATOM 339 CD1 ILE A 22 1.830 -1.528 1.852 1.00 10.00 C ATOM 0 H ILE A 22 -1.807 -0.220 2.785 1.00 10.00 H new ATOM 0 HA ILE A 22 -1.491 -2.781 3.972 1.00 10.00 H new ATOM 0 HB ILE A 22 0.322 -0.368 4.009 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.063 -2.718 2.072 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.248 -1.031 1.710 1.00 10.00 H new ATOM 0 HG21 ILE A 22 2.180 -2.003 4.289 1.00 10.00 H new ATOM 0 HG22 ILE A 22 1.047 -2.036 5.661 1.00 10.00 H new ATOM 0 HG23 ILE A 22 0.986 -3.316 4.426 1.00 10.00 H new ATOM 0 HD11 ILE A 22 1.912 -1.742 0.786 1.00 10.00 H new ATOM 0 HD12 ILE A 22 2.149 -0.503 2.042 1.00 10.00 H new ATOM 0 HD13 ILE A 22 2.465 -2.216 2.410 1.00 10.00 H new ATOM 351 N SER A 23 -1.735 -0.201 6.064 1.00 10.00 N ATOM 352 CA SER A 23 -2.011 0.183 7.453 1.00 10.00 C ATOM 353 C SER A 23 -3.257 -0.523 8.007 1.00 10.00 C ATOM 354 O SER A 23 -3.153 -1.207 9.025 1.00 10.00 O ATOM 355 CB SER A 23 -2.142 1.705 7.563 1.00 10.00 C ATOM 356 OG SER A 23 -2.114 2.096 8.919 1.00 10.00 O ATOM 0 H SER A 23 -1.703 0.592 5.423 1.00 10.00 H new ATOM 0 HA SER A 23 -1.168 -0.141 8.064 1.00 10.00 H new ATOM 0 HB2 SER A 23 -1.330 2.188 7.020 1.00 10.00 H new ATOM 0 HB3 SER A 23 -3.073 2.032 7.101 1.00 10.00 H new ATOM 0 HG SER A 23 -2.197 3.071 8.980 1.00 10.00 H new ATOM 362 N ASP A 24 -4.395 -0.477 7.298 1.00 10.00 N ATOM 363 CA ASP A 24 -5.571 -1.289 7.617 1.00 10.00 C ATOM 364 C ASP A 24 -5.329 -2.794 7.620 1.00 10.00 C ATOM 365 O ASP A 24 -5.854 -3.466 8.509 1.00 10.00 O ATOM 366 CB ASP A 24 -6.722 -1.006 6.636 1.00 10.00 C ATOM 367 CG ASP A 24 -7.538 0.245 6.953 1.00 10.00 C ATOM 368 OD1 ASP A 24 -7.005 1.371 6.908 1.00 10.00 O ATOM 369 OD2 ASP A 24 -8.730 0.005 7.272 1.00 10.00 O ATOM 0 H ASP A 24 -4.522 0.127 6.486 1.00 10.00 H new ATOM 0 HA ASP A 24 -5.826 -0.992 8.634 1.00 10.00 H new ATOM 0 HB2 ASP A 24 -6.310 -0.909 5.632 1.00 10.00 H new ATOM 0 HB3 ASP A 24 -7.391 -1.866 6.624 1.00 10.00 H new ATOM 374 N PHE A 25 -4.529 -3.335 6.697 1.00 10.00 N ATOM 375 CA PHE A 25 -4.266 -4.770 6.686 1.00 10.00 C ATOM 376 C PHE A 25 -3.452 -5.176 7.921 1.00 10.00 C ATOM 377 O PHE A 25 -3.843 -6.102 8.632 1.00 10.00 O ATOM 378 CB PHE A 25 -3.589 -5.161 5.366 1.00 10.00 C ATOM 379 CG PHE A 25 -3.699 -6.640 5.057 1.00 10.00 C ATOM 380 CD1 PHE A 25 -2.802 -7.552 5.636 1.00 10.00 C ATOM 381 CD2 PHE A 25 -4.717 -7.109 4.204 1.00 10.00 C ATOM 382 CE1 PHE A 25 -2.923 -8.925 5.370 1.00 10.00 C ATOM 383 CE2 PHE A 25 -4.838 -8.484 3.938 1.00 10.00 C ATOM 384 CZ PHE A 25 -3.941 -9.394 4.522 1.00 10.00 C ATOM 0 H PHE A 25 -4.060 -2.808 5.960 1.00 10.00 H new ATOM 0 HA PHE A 25 -5.205 -5.320 6.743 1.00 10.00 H new ATOM 0 HB2 PHE A 25 -4.037 -4.592 4.552 1.00 10.00 H new ATOM 0 HB3 PHE A 25 -2.536 -4.882 5.408 1.00 10.00 H new ATOM 0 HD1 PHE A 25 -2.017 -7.196 6.287 1.00 10.00 H new ATOM 0 HD2 PHE A 25 -5.406 -6.410 3.753 1.00 10.00 H new ATOM 0 HE1 PHE A 25 -2.232 -9.623 5.818 1.00 10.00 H new ATOM 0 HE2 PHE A 25 -5.620 -8.841 3.285 1.00 10.00 H new ATOM 0 HZ PHE A 25 -4.033 -10.451 4.320 1.00 10.00 H new ATOM 394 N ILE A 26 -2.399 -4.420 8.256 1.00 10.00 N ATOM 395 CA ILE A 26 -1.609 -4.612 9.462 1.00 10.00 C ATOM 396 C ILE A 26 -2.492 -4.460 10.709 1.00 10.00 C ATOM 397 O ILE A 26 -2.512 -5.378 11.524 1.00 10.00 O ATOM 398 CB ILE A 26 -0.395 -3.658 9.412 1.00 10.00 C ATOM 399 CG1 ILE A 26 0.610 -4.161 8.346 1.00 10.00 C ATOM 400 CG2 ILE A 26 0.267 -3.562 10.785 1.00 10.00 C ATOM 401 CD1 ILE A 26 1.824 -3.248 8.132 1.00 10.00 C ATOM 0 H ILE A 26 -2.072 -3.644 7.680 1.00 10.00 H new ATOM 0 HA ILE A 26 -1.212 -5.625 9.521 1.00 10.00 H new ATOM 0 HB ILE A 26 -0.732 -2.659 9.136 1.00 10.00 H new ATOM 0 HG12 ILE A 26 0.963 -5.151 8.637 1.00 10.00 H new ATOM 0 HG13 ILE A 26 0.086 -4.275 7.397 1.00 10.00 H new ATOM 0 HG21 ILE A 26 1.120 -2.886 10.731 1.00 10.00 H new ATOM 0 HG22 ILE A 26 -0.452 -3.181 11.510 1.00 10.00 H new ATOM 0 HG23 ILE A 26 0.606 -4.550 11.095 1.00 10.00 H new ATOM 0 HD11 ILE A 26 2.473 -3.678 7.369 1.00 10.00 H new ATOM 0 HD12 ILE A 26 1.486 -2.264 7.808 1.00 10.00 H new ATOM 0 HD13 ILE A 26 2.377 -3.152 9.067 1.00 10.00 H new ATOM 413 N LEU A 27 -3.292 -3.390 10.828 1.00 10.00 N ATOM 414 CA LEU A 27 -4.216 -3.185 11.956 1.00 10.00 C ATOM 415 C LEU A 27 -5.306 -4.265 12.080 1.00 10.00 C ATOM 416 O LEU A 27 -5.848 -4.450 13.169 1.00 10.00 O ATOM 417 CB LEU A 27 -4.858 -1.781 11.870 1.00 10.00 C ATOM 418 CG LEU A 27 -4.174 -0.678 12.702 1.00 10.00 C ATOM 419 CD1 LEU A 27 -4.370 -0.917 14.204 1.00 10.00 C ATOM 420 CD2 LEU A 27 -2.678 -0.514 12.416 1.00 10.00 C ATOM 0 H LEU A 27 -3.317 -2.637 10.140 1.00 10.00 H new ATOM 0 HA LEU A 27 -3.612 -3.267 12.859 1.00 10.00 H new ATOM 0 HB2 LEU A 27 -4.866 -1.469 10.826 1.00 10.00 H new ATOM 0 HB3 LEU A 27 -5.898 -1.858 12.188 1.00 10.00 H new ATOM 0 HG LEU A 27 -4.664 0.246 12.396 1.00 10.00 H new ATOM 0 HD11 LEU A 27 -3.877 -0.124 14.766 1.00 10.00 H new ATOM 0 HD12 LEU A 27 -5.435 -0.918 14.436 1.00 10.00 H new ATOM 0 HD13 LEU A 27 -3.937 -1.879 14.479 1.00 10.00 H new ATOM 0 HD21 LEU A 27 -2.273 0.281 13.042 1.00 10.00 H new ATOM 0 HD22 LEU A 27 -2.161 -1.448 12.636 1.00 10.00 H new ATOM 0 HD23 LEU A 27 -2.534 -0.258 11.366 1.00 10.00 H new ATOM 432 N LYS A 28 -5.610 -4.996 10.999 1.00 10.00 N ATOM 433 CA LYS A 28 -6.518 -6.155 10.995 1.00 10.00 C ATOM 434 C LYS A 28 -5.767 -7.499 10.980 1.00 10.00 C ATOM 435 O LYS A 28 -6.396 -8.550 10.856 1.00 10.00 O ATOM 436 CB LYS A 28 -7.560 -5.983 9.870 1.00 10.00 C ATOM 437 CG LYS A 28 -8.635 -4.975 10.324 1.00 10.00 C ATOM 438 CD LYS A 28 -9.536 -4.423 9.208 1.00 10.00 C ATOM 439 CE LYS A 28 -8.848 -3.254 8.493 1.00 10.00 C ATOM 440 NZ LYS A 28 -9.802 -2.403 7.741 1.00 10.00 N ATOM 0 H LYS A 28 -5.222 -4.794 10.078 1.00 10.00 H new ATOM 0 HA LYS A 28 -7.067 -6.188 11.936 1.00 10.00 H new ATOM 0 HB2 LYS A 28 -7.075 -5.630 8.960 1.00 10.00 H new ATOM 0 HB3 LYS A 28 -8.020 -6.943 9.635 1.00 10.00 H new ATOM 0 HG2 LYS A 28 -9.266 -5.455 11.072 1.00 10.00 H new ATOM 0 HG3 LYS A 28 -8.139 -4.137 10.815 1.00 10.00 H new ATOM 0 HD2 LYS A 28 -9.763 -5.213 8.492 1.00 10.00 H new ATOM 0 HD3 LYS A 28 -10.485 -4.092 9.629 1.00 10.00 H new ATOM 0 HE2 LYS A 28 -8.323 -2.643 9.227 1.00 10.00 H new ATOM 0 HE3 LYS A 28 -8.097 -3.645 7.807 1.00 10.00 H new ATOM 0 HZ1 LYS A 28 -9.355 -1.490 7.522 1.00 10.00 H new ATOM 0 HZ2 LYS A 28 -10.069 -2.879 6.856 1.00 10.00 H new ATOM 0 HZ3 LYS A 28 -10.653 -2.242 8.317 1.00 10.00 H new ATOM 454 N ARG A 29 -4.442 -7.478 11.192 1.00 10.00 N ATOM 455 CA ARG A 29 -3.592 -8.663 11.387 1.00 10.00 C ATOM 456 C ARG A 29 -2.873 -8.692 12.744 1.00 10.00 C ATOM 457 O ARG A 29 -2.787 -9.773 13.320 1.00 10.00 O ATOM 458 CB ARG A 29 -2.577 -8.740 10.236 1.00 10.00 C ATOM 459 CG ARG A 29 -3.195 -9.096 8.873 1.00 10.00 C ATOM 460 CD ARG A 29 -3.014 -10.555 8.443 1.00 10.00 C ATOM 461 NE ARG A 29 -3.601 -11.517 9.387 1.00 10.00 N ATOM 462 CZ ARG A 29 -3.371 -12.826 9.397 1.00 10.00 C ATOM 463 NH1 ARG A 29 -2.615 -13.427 8.509 1.00 10.00 N ATOM 464 NH2 ARG A 29 -3.917 -13.571 10.329 1.00 10.00 N ATOM 0 H ARG A 29 -3.915 -6.606 11.234 1.00 10.00 H new ATOM 0 HA ARG A 29 -4.245 -9.536 11.385 1.00 10.00 H new ATOM 0 HB2 ARG A 29 -2.067 -7.780 10.152 1.00 10.00 H new ATOM 0 HB3 ARG A 29 -1.819 -9.483 10.484 1.00 10.00 H new ATOM 0 HG2 ARG A 29 -4.261 -8.871 8.904 1.00 10.00 H new ATOM 0 HG3 ARG A 29 -2.756 -8.451 8.112 1.00 10.00 H new ATOM 0 HD2 ARG A 29 -3.468 -10.696 7.462 1.00 10.00 H new ATOM 0 HD3 ARG A 29 -1.950 -10.765 8.335 1.00 10.00 H new ATOM 0 HE ARG A 29 -4.238 -11.149 10.093 1.00 10.00 H new ATOM 0 HH11 ARG A 29 -2.172 -12.886 7.766 1.00 10.00 H new ATOM 0 HH12 ARG A 29 -2.470 -14.435 8.561 1.00 10.00 H new ATOM 0 HH21 ARG A 29 -4.513 -13.145 11.039 1.00 10.00 H new ATOM 0 HH22 ARG A 29 -3.746 -14.576 10.344 1.00 10.00 H new ATOM 478 N VAL A 30 -2.400 -7.551 13.269 1.00 10.00 N ATOM 479 CA VAL A 30 -1.721 -7.427 14.575 1.00 10.00 C ATOM 480 C VAL A 30 -2.047 -6.061 15.208 1.00 10.00 C ATOM 481 O VAL A 30 -2.243 -5.072 14.503 1.00 10.00 O ATOM 482 CB VAL A 30 -0.184 -7.595 14.445 1.00 10.00 C ATOM 483 CG1 VAL A 30 0.442 -7.825 15.825 1.00 10.00 C ATOM 484 CG2 VAL A 30 0.262 -8.765 13.558 1.00 10.00 C ATOM 0 H VAL A 30 -2.481 -6.658 12.783 1.00 10.00 H new ATOM 0 HA VAL A 30 -2.089 -8.227 15.217 1.00 10.00 H new ATOM 0 HB VAL A 30 0.152 -6.669 13.978 1.00 10.00 H new ATOM 0 HG11 VAL A 30 1.521 -7.941 15.720 1.00 10.00 H new ATOM 0 HG12 VAL A 30 0.230 -6.971 16.468 1.00 10.00 H new ATOM 0 HG13 VAL A 30 0.021 -8.727 16.270 1.00 10.00 H new ATOM 0 HG21 VAL A 30 1.351 -8.803 13.527 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -0.123 -9.699 13.967 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -0.125 -8.625 12.549 1.00 10.00 H new ATOM 494 N SER A 31 -2.117 -5.986 16.541 1.00 10.00 N ATOM 495 CA SER A 31 -2.472 -4.769 17.274 1.00 10.00 C ATOM 496 C SER A 31 -1.366 -3.712 17.292 1.00 10.00 C ATOM 497 O SER A 31 -0.200 -3.991 17.566 1.00 10.00 O ATOM 498 CB SER A 31 -2.878 -5.086 18.713 1.00 10.00 C ATOM 499 OG SER A 31 -3.285 -3.907 19.388 1.00 10.00 O ATOM 0 H SER A 31 -1.925 -6.782 17.149 1.00 10.00 H new ATOM 0 HA SER A 31 -3.317 -4.349 16.728 1.00 10.00 H new ATOM 0 HB2 SER A 31 -3.691 -5.812 18.716 1.00 10.00 H new ATOM 0 HB3 SER A 31 -2.041 -5.543 19.241 1.00 10.00 H new ATOM 0 HG SER A 31 -3.543 -4.129 20.307 1.00 10.00 H new ATOM 505 N ALA A 32 -1.769 -2.458 17.085 1.00 10.00 N ATOM 506 CA ALA A 32 -0.952 -1.266 17.311 1.00 10.00 C ATOM 507 C ALA A 32 -0.296 -1.239 18.711 1.00 10.00 C ATOM 508 O ALA A 32 0.690 -0.537 18.892 1.00 10.00 O ATOM 509 CB ALA A 32 -1.807 -0.019 17.066 1.00 10.00 C ATOM 0 H ALA A 32 -2.705 -2.237 16.744 1.00 10.00 H new ATOM 0 HA ALA A 32 -0.123 -1.286 16.604 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -1.204 0.874 17.233 1.00 10.00 H new ATOM 0 HB2 ALA A 32 -2.172 -0.024 16.039 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -2.654 -0.018 17.752 1.00 10.00 H new ATOM 515 N LYS A 33 -0.863 -1.937 19.713 1.00 10.00 N ATOM 516 CA LYS A 33 -0.267 -2.095 21.054 1.00 10.00 C ATOM 517 C LYS A 33 0.714 -3.282 21.192 1.00 10.00 C ATOM 518 O LYS A 33 1.304 -3.449 22.254 1.00 10.00 O ATOM 519 CB LYS A 33 -1.384 -2.165 22.109 1.00 10.00 C ATOM 520 CG LYS A 33 -2.172 -0.846 22.175 1.00 10.00 C ATOM 521 CD LYS A 33 -3.224 -0.874 23.289 1.00 10.00 C ATOM 522 CE LYS A 33 -3.942 0.479 23.340 1.00 10.00 C ATOM 523 NZ LYS A 33 -4.971 0.509 24.405 1.00 10.00 N ATOM 0 H LYS A 33 -1.759 -2.413 19.613 1.00 10.00 H new ATOM 0 HA LYS A 33 0.352 -1.213 21.221 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -2.062 -2.985 21.871 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -0.952 -2.382 23.086 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -1.484 -0.018 22.344 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -2.660 -0.664 21.217 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -3.942 -1.673 23.107 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -2.750 -1.084 24.248 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -3.214 1.272 23.514 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -4.409 0.681 22.376 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -5.437 1.439 24.411 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -5.678 -0.232 24.225 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -4.521 0.341 25.327 1.00 10.00 H new ATOM 537 N GLU A 34 0.905 -4.082 20.138 1.00 10.00 N ATOM 538 CA GLU A 34 1.914 -5.157 20.027 1.00 10.00 C ATOM 539 C GLU A 34 3.039 -4.747 19.052 1.00 10.00 C ATOM 540 O GLU A 34 4.188 -5.173 19.169 1.00 10.00 O ATOM 541 CB GLU A 34 1.237 -6.434 19.491 1.00 10.00 C ATOM 542 CG GLU A 34 0.072 -6.949 20.354 1.00 10.00 C ATOM 543 CD GLU A 34 -0.759 -8.023 19.632 1.00 10.00 C ATOM 544 OE1 GLU A 34 -1.301 -7.714 18.541 1.00 10.00 O ATOM 545 OE2 GLU A 34 -0.898 -9.127 20.200 1.00 10.00 O ATOM 0 H GLU A 34 0.336 -3.999 19.295 1.00 10.00 H new ATOM 0 HA GLU A 34 2.343 -5.336 21.013 1.00 10.00 H new ATOM 0 HB2 GLU A 34 0.868 -6.239 18.484 1.00 10.00 H new ATOM 0 HB3 GLU A 34 1.987 -7.221 19.409 1.00 10.00 H new ATOM 0 HG2 GLU A 34 0.466 -7.361 21.283 1.00 10.00 H new ATOM 0 HG3 GLU A 34 -0.574 -6.114 20.624 1.00 10.00 H new ATOM 552 N ILE A 35 2.687 -3.893 18.088 1.00 10.00 N ATOM 553 CA ILE A 35 3.562 -3.177 17.163 1.00 10.00 C ATOM 554 C ILE A 35 4.252 -2.007 17.878 1.00 10.00 C ATOM 555 O ILE A 35 3.596 -1.186 18.512 1.00 10.00 O ATOM 556 CB ILE A 35 2.702 -2.704 15.970 1.00 10.00 C ATOM 557 CG1 ILE A 35 2.250 -3.940 15.159 1.00 10.00 C ATOM 558 CG2 ILE A 35 3.433 -1.694 15.070 1.00 10.00 C ATOM 559 CD1 ILE A 35 1.241 -3.623 14.055 1.00 10.00 C ATOM 0 H ILE A 35 1.706 -3.668 17.923 1.00 10.00 H new ATOM 0 HA ILE A 35 4.356 -3.827 16.796 1.00 10.00 H new ATOM 0 HB ILE A 35 1.834 -2.177 16.366 1.00 10.00 H new ATOM 0 HG12 ILE A 35 3.127 -4.409 14.712 1.00 10.00 H new ATOM 0 HG13 ILE A 35 1.811 -4.668 15.841 1.00 10.00 H new ATOM 0 HG21 ILE A 35 2.779 -1.398 14.249 1.00 10.00 H new ATOM 0 HG22 ILE A 35 3.703 -0.814 15.654 1.00 10.00 H new ATOM 0 HG23 ILE A 35 4.336 -2.153 14.667 1.00 10.00 H new ATOM 0 HD11 ILE A 35 0.973 -4.541 13.532 1.00 10.00 H new ATOM 0 HD12 ILE A 35 0.347 -3.182 14.495 1.00 10.00 H new ATOM 0 HD13 ILE A 35 1.683 -2.919 13.350 1.00 10.00 H new ATOM 571 N VAL A 36 5.581 -1.927 17.772 1.00 10.00 N ATOM 572 CA VAL A 36 6.358 -0.749 18.175 1.00 10.00 C ATOM 573 C VAL A 36 6.129 0.380 17.164 1.00 10.00 C ATOM 574 O VAL A 36 5.754 1.477 17.568 1.00 10.00 O ATOM 575 CB VAL A 36 7.856 -1.107 18.291 1.00 10.00 C ATOM 576 CG1 VAL A 36 8.772 0.122 18.358 1.00 10.00 C ATOM 577 CG2 VAL A 36 8.086 -1.948 19.550 1.00 10.00 C ATOM 0 H VAL A 36 6.154 -2.684 17.401 1.00 10.00 H new ATOM 0 HA VAL A 36 6.026 -0.409 19.156 1.00 10.00 H new ATOM 0 HB VAL A 36 8.111 -1.660 17.387 1.00 10.00 H new ATOM 0 HG11 VAL A 36 9.810 -0.202 18.439 1.00 10.00 H new ATOM 0 HG12 VAL A 36 8.647 0.719 17.454 1.00 10.00 H new ATOM 0 HG13 VAL A 36 8.511 0.723 19.229 1.00 10.00 H new ATOM 0 HG21 VAL A 36 9.143 -2.200 19.631 1.00 10.00 H new ATOM 0 HG22 VAL A 36 7.780 -1.379 20.428 1.00 10.00 H new ATOM 0 HG23 VAL A 36 7.498 -2.864 19.488 1.00 10.00 H new ATOM 587 N ASP A 37 6.321 0.107 15.864 1.00 10.00 N ATOM 588 CA ASP A 37 5.997 1.040 14.774 1.00 10.00 C ATOM 589 C ASP A 37 5.963 0.337 13.396 1.00 10.00 C ATOM 590 O ASP A 37 6.279 -0.851 13.278 1.00 10.00 O ATOM 591 CB ASP A 37 6.990 2.231 14.766 1.00 10.00 C ATOM 592 CG ASP A 37 6.332 3.554 14.349 1.00 10.00 C ATOM 593 OD1 ASP A 37 5.331 3.492 13.597 1.00 10.00 O ATOM 594 OD2 ASP A 37 6.838 4.611 14.785 1.00 10.00 O ATOM 0 H ASP A 37 6.710 -0.777 15.537 1.00 10.00 H new ATOM 0 HA ASP A 37 4.994 1.424 14.959 1.00 10.00 H new ATOM 0 HB2 ASP A 37 7.423 2.344 15.760 1.00 10.00 H new ATOM 0 HB3 ASP A 37 7.811 2.009 14.084 1.00 10.00 H new ATOM 599 N ILE A 38 5.617 1.085 12.342 1.00 10.00 N ATOM 600 CA ILE A 38 5.621 0.641 10.943 1.00 10.00 C ATOM 601 C ILE A 38 6.253 1.702 10.034 1.00 10.00 C ATOM 602 O ILE A 38 5.850 2.863 10.043 1.00 10.00 O ATOM 603 CB ILE A 38 4.198 0.273 10.442 1.00 10.00 C ATOM 604 CG1 ILE A 38 3.113 1.335 10.758 1.00 10.00 C ATOM 605 CG2 ILE A 38 3.798 -1.103 10.989 1.00 10.00 C ATOM 606 CD1 ILE A 38 1.722 1.011 10.192 1.00 10.00 C ATOM 0 H ILE A 38 5.315 2.054 12.444 1.00 10.00 H new ATOM 0 HA ILE A 38 6.227 -0.264 10.898 1.00 10.00 H new ATOM 0 HB ILE A 38 4.252 0.243 9.354 1.00 10.00 H new ATOM 0 HG12 ILE A 38 3.035 1.446 11.840 1.00 10.00 H new ATOM 0 HG13 ILE A 38 3.438 2.297 10.362 1.00 10.00 H new ATOM 0 HG21 ILE A 38 2.799 -1.359 10.636 1.00 10.00 H new ATOM 0 HG22 ILE A 38 4.509 -1.853 10.642 1.00 10.00 H new ATOM 0 HG23 ILE A 38 3.802 -1.077 12.079 1.00 10.00 H new ATOM 0 HD11 ILE A 38 1.026 1.806 10.460 1.00 10.00 H new ATOM 0 HD12 ILE A 38 1.781 0.931 9.107 1.00 10.00 H new ATOM 0 HD13 ILE A 38 1.371 0.066 10.607 1.00 10.00 H new ATOM 618 N ASP A 39 7.210 1.283 9.201 1.00 10.00 N ATOM 619 CA ASP A 39 7.735 2.109 8.110 1.00 10.00 C ATOM 620 C ASP A 39 7.049 1.683 6.817 1.00 10.00 C ATOM 621 O ASP A 39 7.202 0.542 6.392 1.00 10.00 O ATOM 622 CB ASP A 39 9.259 1.958 7.945 1.00 10.00 C ATOM 623 CG ASP A 39 10.100 2.772 8.926 1.00 10.00 C ATOM 624 OD1 ASP A 39 9.682 3.896 9.275 1.00 10.00 O ATOM 625 OD2 ASP A 39 11.199 2.276 9.269 1.00 10.00 O ATOM 0 H ASP A 39 7.643 0.361 9.264 1.00 10.00 H new ATOM 0 HA ASP A 39 7.534 3.154 8.344 1.00 10.00 H new ATOM 0 HB2 ASP A 39 9.518 0.905 8.055 1.00 10.00 H new ATOM 0 HB3 ASP A 39 9.530 2.249 6.930 1.00 10.00 H new ATOM 630 N ILE A 40 6.319 2.593 6.166 1.00 10.00 N ATOM 631 CA ILE A 40 5.746 2.356 4.838 1.00 10.00 C ATOM 632 C ILE A 40 6.082 3.547 3.948 1.00 10.00 C ATOM 633 O ILE A 40 5.776 4.694 4.263 1.00 10.00 O ATOM 634 CB ILE A 40 4.230 2.058 4.906 1.00 10.00 C ATOM 635 CG1 ILE A 40 3.992 0.667 5.532 1.00 10.00 C ATOM 636 CG2 ILE A 40 3.616 2.060 3.490 1.00 10.00 C ATOM 637 CD1 ILE A 40 2.588 0.446 6.078 1.00 10.00 C ATOM 0 H ILE A 40 6.108 3.516 6.545 1.00 10.00 H new ATOM 0 HA ILE A 40 6.186 1.460 4.401 1.00 10.00 H new ATOM 0 HB ILE A 40 3.761 2.832 5.514 1.00 10.00 H new ATOM 0 HG12 ILE A 40 4.199 -0.095 4.780 1.00 10.00 H new ATOM 0 HG13 ILE A 40 4.709 0.520 6.340 1.00 10.00 H new ATOM 0 HG21 ILE A 40 2.549 1.849 3.556 1.00 10.00 H new ATOM 0 HG22 ILE A 40 3.765 3.037 3.030 1.00 10.00 H new ATOM 0 HG23 ILE A 40 4.100 1.296 2.882 1.00 10.00 H new ATOM 0 HD11 ILE A 40 2.514 -0.557 6.497 1.00 10.00 H new ATOM 0 HD12 ILE A 40 2.380 1.181 6.856 1.00 10.00 H new ATOM 0 HD13 ILE A 40 1.863 0.556 5.272 1.00 10.00 H new ATOM 649 N THR A 41 6.716 3.240 2.818 1.00 10.00 N ATOM 650 CA THR A 41 7.071 4.173 1.756 1.00 10.00 C ATOM 651 C THR A 41 6.374 3.714 0.482 1.00 10.00 C ATOM 652 O THR A 41 6.605 2.602 0.007 1.00 10.00 O ATOM 653 CB THR A 41 8.596 4.209 1.577 1.00 10.00 C ATOM 654 OG1 THR A 41 9.178 4.730 2.749 1.00 10.00 O ATOM 655 CG2 THR A 41 9.044 5.098 0.418 1.00 10.00 C ATOM 0 H THR A 41 7.010 2.286 2.610 1.00 10.00 H new ATOM 0 HA THR A 41 6.750 5.185 2.003 1.00 10.00 H new ATOM 0 HB THR A 41 8.911 3.187 1.368 1.00 10.00 H new ATOM 0 HG1 THR A 41 10.152 4.756 2.647 1.00 10.00 H new ATOM 0 HG21 THR A 41 10.131 5.080 0.345 1.00 10.00 H new ATOM 0 HG22 THR A 41 8.612 4.729 -0.512 1.00 10.00 H new ATOM 0 HG23 THR A 41 8.709 6.120 0.593 1.00 10.00 H new ATOM 663 N VAL A 42 5.528 4.585 -0.071 1.00 10.00 N ATOM 664 CA VAL A 42 4.913 4.398 -1.384 1.00 10.00 C ATOM 665 C VAL A 42 5.430 5.508 -2.289 1.00 10.00 C ATOM 666 O VAL A 42 5.258 6.688 -1.986 1.00 10.00 O ATOM 667 CB VAL A 42 3.375 4.383 -1.313 1.00 10.00 C ATOM 668 CG1 VAL A 42 2.791 4.162 -2.714 1.00 10.00 C ATOM 669 CG2 VAL A 42 2.867 3.260 -0.397 1.00 10.00 C ATOM 0 H VAL A 42 5.248 5.452 0.388 1.00 10.00 H new ATOM 0 HA VAL A 42 5.188 3.423 -1.787 1.00 10.00 H new ATOM 0 HB VAL A 42 3.056 5.344 -0.910 1.00 10.00 H new ATOM 0 HG11 VAL A 42 1.703 4.152 -2.657 1.00 10.00 H new ATOM 0 HG12 VAL A 42 3.113 4.968 -3.374 1.00 10.00 H new ATOM 0 HG13 VAL A 42 3.142 3.208 -3.108 1.00 10.00 H new ATOM 0 HG21 VAL A 42 1.777 3.278 -0.369 1.00 10.00 H new ATOM 0 HG22 VAL A 42 3.205 2.297 -0.780 1.00 10.00 H new ATOM 0 HG23 VAL A 42 3.258 3.407 0.610 1.00 10.00 H new ATOM 679 N LEU A 43 6.090 5.113 -3.376 1.00 10.00 N ATOM 680 CA LEU A 43 6.660 6.007 -4.381 1.00 10.00 C ATOM 681 C LEU A 43 5.980 5.742 -5.723 1.00 10.00 C ATOM 682 O LEU A 43 5.741 4.591 -6.071 1.00 10.00 O ATOM 683 CB LEU A 43 8.191 5.818 -4.450 1.00 10.00 C ATOM 684 CG LEU A 43 8.977 7.088 -4.075 1.00 10.00 C ATOM 685 CD1 LEU A 43 8.812 7.453 -2.596 1.00 10.00 C ATOM 686 CD2 LEU A 43 10.467 6.878 -4.353 1.00 10.00 C ATOM 0 H LEU A 43 6.248 4.128 -3.588 1.00 10.00 H new ATOM 0 HA LEU A 43 6.481 7.048 -4.111 1.00 10.00 H new ATOM 0 HB2 LEU A 43 8.481 5.008 -3.781 1.00 10.00 H new ATOM 0 HB3 LEU A 43 8.468 5.512 -5.459 1.00 10.00 H new ATOM 0 HG LEU A 43 8.578 7.901 -4.682 1.00 10.00 H new ATOM 0 HD11 LEU A 43 9.384 8.355 -2.378 1.00 10.00 H new ATOM 0 HD12 LEU A 43 7.758 7.630 -2.380 1.00 10.00 H new ATOM 0 HD13 LEU A 43 9.176 6.634 -1.976 1.00 10.00 H new ATOM 0 HD21 LEU A 43 11.018 7.780 -4.086 1.00 10.00 H new ATOM 0 HD22 LEU A 43 10.833 6.040 -3.760 1.00 10.00 H new ATOM 0 HD23 LEU A 43 10.613 6.664 -5.412 1.00 10.00 H new ATOM 698 N VAL A 44 5.673 6.793 -6.484 1.00 10.00 N ATOM 699 CA VAL A 44 5.064 6.678 -7.812 1.00 10.00 C ATOM 700 C VAL A 44 5.798 7.599 -8.786 1.00 10.00 C ATOM 701 O VAL A 44 6.193 8.709 -8.433 1.00 10.00 O ATOM 702 CB VAL A 44 3.539 6.897 -7.741 1.00 10.00 C ATOM 703 CG1 VAL A 44 3.130 8.205 -7.052 1.00 10.00 C ATOM 704 CG2 VAL A 44 2.891 6.825 -9.131 1.00 10.00 C ATOM 0 H VAL A 44 5.841 7.757 -6.195 1.00 10.00 H new ATOM 0 HA VAL A 44 5.178 5.666 -8.199 1.00 10.00 H new ATOM 0 HB VAL A 44 3.169 6.079 -7.122 1.00 10.00 H new ATOM 0 HG11 VAL A 44 2.043 8.286 -7.042 1.00 10.00 H new ATOM 0 HG12 VAL A 44 3.504 8.209 -6.028 1.00 10.00 H new ATOM 0 HG13 VAL A 44 3.552 9.050 -7.596 1.00 10.00 H new ATOM 0 HG21 VAL A 44 1.816 6.984 -9.040 1.00 10.00 H new ATOM 0 HG22 VAL A 44 3.319 7.596 -9.772 1.00 10.00 H new ATOM 0 HG23 VAL A 44 3.077 5.844 -9.569 1.00 10.00 H new ATOM 714 N GLU A 45 6.013 7.099 -10.003 1.00 10.00 N ATOM 715 CA GLU A 45 6.893 7.685 -11.012 1.00 10.00 C ATOM 716 C GLU A 45 6.309 7.467 -12.418 1.00 10.00 C ATOM 717 O GLU A 45 5.525 6.537 -12.642 1.00 10.00 O ATOM 718 CB GLU A 45 8.283 7.014 -10.873 1.00 10.00 C ATOM 719 CG GLU A 45 9.460 7.998 -10.836 1.00 10.00 C ATOM 720 CD GLU A 45 9.728 8.620 -12.206 1.00 10.00 C ATOM 721 OE1 GLU A 45 8.981 9.562 -12.554 1.00 10.00 O ATOM 722 OE2 GLU A 45 10.633 8.115 -12.906 1.00 10.00 O ATOM 0 H GLU A 45 5.562 6.243 -10.324 1.00 10.00 H new ATOM 0 HA GLU A 45 6.987 8.761 -10.864 1.00 10.00 H new ATOM 0 HB2 GLU A 45 8.295 6.417 -9.961 1.00 10.00 H new ATOM 0 HB3 GLU A 45 8.426 6.326 -11.706 1.00 10.00 H new ATOM 0 HG2 GLU A 45 9.250 8.787 -10.114 1.00 10.00 H new ATOM 0 HG3 GLU A 45 10.355 7.480 -10.491 1.00 10.00 H new ATOM 729 N TYR A 46 6.723 8.297 -13.379 1.00 10.00 N ATOM 730 CA TYR A 46 6.353 8.151 -14.781 1.00 10.00 C ATOM 731 C TYR A 46 7.548 8.518 -15.671 1.00 10.00 C ATOM 732 O TYR A 46 7.820 9.690 -15.928 1.00 10.00 O ATOM 733 CB TYR A 46 5.089 8.967 -15.109 1.00 10.00 C ATOM 734 CG TYR A 46 4.412 8.465 -16.371 1.00 10.00 C ATOM 735 CD1 TYR A 46 5.075 8.528 -17.612 1.00 10.00 C ATOM 736 CD2 TYR A 46 3.164 7.820 -16.279 1.00 10.00 C ATOM 737 CE1 TYR A 46 4.559 7.840 -18.722 1.00 10.00 C ATOM 738 CE2 TYR A 46 2.622 7.162 -17.398 1.00 10.00 C ATOM 739 CZ TYR A 46 3.357 7.113 -18.605 1.00 10.00 C ATOM 740 OH TYR A 46 2.947 6.335 -19.643 1.00 10.00 O ATOM 0 H TYR A 46 7.331 9.096 -13.199 1.00 10.00 H new ATOM 0 HA TYR A 46 6.099 7.110 -14.983 1.00 10.00 H new ATOM 0 HB2 TYR A 46 4.391 8.910 -14.274 1.00 10.00 H new ATOM 0 HB3 TYR A 46 5.355 10.017 -15.231 1.00 10.00 H new ATOM 0 HD1 TYR A 46 5.982 9.106 -17.710 1.00 10.00 H new ATOM 0 HD2 TYR A 46 2.621 7.830 -15.346 1.00 10.00 H new ATOM 0 HE1 TYR A 46 5.083 7.868 -19.666 1.00 10.00 H new ATOM 0 HE2 TYR A 46 1.649 6.697 -17.336 1.00 10.00 H new ATOM 0 HH TYR A 46 3.729 5.957 -20.097 1.00 10.00 H new ATOM 750 N THR A 47 8.242 7.495 -16.175 1.00 10.00 N ATOM 751 CA THR A 47 9.434 7.625 -17.024 1.00 10.00 C ATOM 752 C THR A 47 9.259 6.726 -18.250 1.00 10.00 C ATOM 753 O THR A 47 9.655 5.562 -18.265 1.00 10.00 O ATOM 754 CB THR A 47 10.722 7.437 -16.202 1.00 10.00 C ATOM 755 OG1 THR A 47 11.844 7.634 -17.029 1.00 10.00 O ATOM 756 CG2 THR A 47 10.885 6.097 -15.476 1.00 10.00 C ATOM 0 H THR A 47 7.984 6.524 -16.000 1.00 10.00 H new ATOM 0 HA THR A 47 9.547 8.635 -17.417 1.00 10.00 H new ATOM 0 HB THR A 47 10.641 8.184 -15.412 1.00 10.00 H new ATOM 0 HG1 THR A 47 12.663 7.515 -16.503 1.00 10.00 H new ATOM 0 HG21 THR A 47 11.831 6.089 -14.934 1.00 10.00 H new ATOM 0 HG22 THR A 47 10.063 5.962 -14.773 1.00 10.00 H new ATOM 0 HG23 THR A 47 10.877 5.286 -16.204 1.00 10.00 H new ATOM 764 N ASP A 48 8.529 7.264 -19.240 1.00 10.00 N ATOM 765 CA ASP A 48 7.964 6.591 -20.429 1.00 10.00 C ATOM 766 C ASP A 48 6.860 5.571 -20.063 1.00 10.00 C ATOM 767 O ASP A 48 5.759 5.610 -20.617 1.00 10.00 O ATOM 768 CB ASP A 48 9.078 6.004 -21.314 1.00 10.00 C ATOM 769 CG ASP A 48 8.598 5.758 -22.746 1.00 10.00 C ATOM 770 OD1 ASP A 48 8.192 6.755 -23.384 1.00 10.00 O ATOM 771 OD2 ASP A 48 8.665 4.592 -23.191 1.00 10.00 O ATOM 0 H ASP A 48 8.299 8.258 -19.233 1.00 10.00 H new ATOM 0 HA ASP A 48 7.458 7.346 -21.030 1.00 10.00 H new ATOM 0 HB2 ASP A 48 9.928 6.686 -21.328 1.00 10.00 H new ATOM 0 HB3 ASP A 48 9.429 5.067 -20.882 1.00 10.00 H new ATOM 776 N GLU A 49 7.109 4.759 -19.033 1.00 10.00 N ATOM 777 CA GLU A 49 6.140 3.894 -18.364 1.00 10.00 C ATOM 778 C GLU A 49 5.787 4.448 -16.973 1.00 10.00 C ATOM 779 O GLU A 49 6.572 5.164 -16.344 1.00 10.00 O ATOM 780 CB GLU A 49 6.707 2.473 -18.204 1.00 10.00 C ATOM 781 CG GLU A 49 6.965 1.751 -19.531 1.00 10.00 C ATOM 782 CD GLU A 49 7.264 0.268 -19.278 1.00 10.00 C ATOM 783 OE1 GLU A 49 8.379 -0.025 -18.789 1.00 10.00 O ATOM 784 OE2 GLU A 49 6.358 -0.555 -19.543 1.00 10.00 O ATOM 0 H GLU A 49 8.040 4.685 -18.624 1.00 10.00 H new ATOM 0 HA GLU A 49 5.242 3.862 -18.980 1.00 10.00 H new ATOM 0 HB2 GLU A 49 7.641 2.526 -17.644 1.00 10.00 H new ATOM 0 HB3 GLU A 49 6.012 1.881 -17.609 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.096 1.848 -20.181 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.804 2.215 -20.049 1.00 10.00 H new ATOM 791 N LEU A 50 4.619 4.042 -16.463 1.00 10.00 N ATOM 792 CA LEU A 50 4.143 4.341 -15.112 1.00 10.00 C ATOM 793 C LEU A 50 4.725 3.289 -14.159 1.00 10.00 C ATOM 794 O LEU A 50 4.595 2.089 -14.409 1.00 10.00 O ATOM 795 CB LEU A 50 2.600 4.282 -15.136 1.00 10.00 C ATOM 796 CG LEU A 50 1.859 4.958 -13.963 1.00 10.00 C ATOM 797 CD1 LEU A 50 0.357 4.952 -14.270 1.00 10.00 C ATOM 798 CD2 LEU A 50 2.062 4.277 -12.605 1.00 10.00 C ATOM 0 H LEU A 50 3.959 3.478 -16.998 1.00 10.00 H new ATOM 0 HA LEU A 50 4.456 5.329 -14.774 1.00 10.00 H new ATOM 0 HB2 LEU A 50 2.257 4.740 -16.064 1.00 10.00 H new ATOM 0 HB3 LEU A 50 2.301 3.234 -15.168 1.00 10.00 H new ATOM 0 HG LEU A 50 2.275 5.962 -13.879 1.00 10.00 H new ATOM 0 HD11 LEU A 50 -0.184 5.426 -13.451 1.00 10.00 H new ATOM 0 HD12 LEU A 50 0.172 5.501 -15.193 1.00 10.00 H new ATOM 0 HD13 LEU A 50 0.013 3.924 -14.384 1.00 10.00 H new ATOM 0 HD21 LEU A 50 1.506 4.818 -11.840 1.00 10.00 H new ATOM 0 HD22 LEU A 50 1.703 3.249 -12.656 1.00 10.00 H new ATOM 0 HD23 LEU A 50 3.122 4.278 -12.352 1.00 10.00 H new ATOM 810 N LYS A 51 5.348 3.729 -13.059 1.00 10.00 N ATOM 811 CA LYS A 51 5.967 2.845 -12.066 1.00 10.00 C ATOM 812 C LYS A 51 5.534 3.224 -10.650 1.00 10.00 C ATOM 813 O LYS A 51 5.324 4.396 -10.345 1.00 10.00 O ATOM 814 CB LYS A 51 7.490 2.903 -12.260 1.00 10.00 C ATOM 815 CG LYS A 51 8.244 1.889 -11.381 1.00 10.00 C ATOM 816 CD LYS A 51 9.728 1.772 -11.755 1.00 10.00 C ATOM 817 CE LYS A 51 9.906 1.108 -13.128 1.00 10.00 C ATOM 818 NZ LYS A 51 11.335 0.976 -13.492 1.00 10.00 N ATOM 0 H LYS A 51 5.437 4.719 -12.832 1.00 10.00 H new ATOM 0 HA LYS A 51 5.636 1.816 -12.208 1.00 10.00 H new ATOM 0 HB2 LYS A 51 7.725 2.714 -13.307 1.00 10.00 H new ATOM 0 HB3 LYS A 51 7.843 3.908 -12.030 1.00 10.00 H new ATOM 0 HG2 LYS A 51 8.159 2.186 -10.336 1.00 10.00 H new ATOM 0 HG3 LYS A 51 7.772 0.911 -11.474 1.00 10.00 H new ATOM 0 HD2 LYS A 51 10.182 2.763 -11.766 1.00 10.00 H new ATOM 0 HD3 LYS A 51 10.252 1.190 -10.997 1.00 10.00 H new ATOM 0 HE2 LYS A 51 9.440 0.122 -13.119 1.00 10.00 H new ATOM 0 HE3 LYS A 51 9.390 1.697 -13.887 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 11.415 0.524 -14.425 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 11.773 1.919 -13.526 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 11.822 0.393 -12.782 1.00 10.00 H new ATOM 832 N VAL A 52 5.427 2.214 -9.784 1.00 10.00 N ATOM 833 CA VAL A 52 5.100 2.359 -8.364 1.00 10.00 C ATOM 834 C VAL A 52 6.032 1.454 -7.558 1.00 10.00 C ATOM 835 O VAL A 52 6.223 0.293 -7.918 1.00 10.00 O ATOM 836 CB VAL A 52 3.621 1.990 -8.082 1.00 10.00 C ATOM 837 CG1 VAL A 52 3.256 2.123 -6.593 1.00 10.00 C ATOM 838 CG2 VAL A 52 2.638 2.874 -8.862 1.00 10.00 C ATOM 0 H VAL A 52 5.570 1.243 -10.060 1.00 10.00 H new ATOM 0 HA VAL A 52 5.236 3.400 -8.072 1.00 10.00 H new ATOM 0 HB VAL A 52 3.533 0.952 -8.402 1.00 10.00 H new ATOM 0 HG11 VAL A 52 2.210 1.853 -6.449 1.00 10.00 H new ATOM 0 HG12 VAL A 52 3.887 1.458 -6.003 1.00 10.00 H new ATOM 0 HG13 VAL A 52 3.413 3.152 -6.270 1.00 10.00 H new ATOM 0 HG21 VAL A 52 1.616 2.575 -8.629 1.00 10.00 H new ATOM 0 HG22 VAL A 52 2.784 3.917 -8.580 1.00 10.00 H new ATOM 0 HG23 VAL A 52 2.815 2.759 -9.931 1.00 10.00 H new ATOM 848 N ASP A 53 6.581 1.985 -6.466 1.00 10.00 N ATOM 849 CA ASP A 53 7.259 1.216 -5.431 1.00 10.00 C ATOM 850 C ASP A 53 6.355 1.213 -4.202 1.00 10.00 C ATOM 851 O ASP A 53 5.752 2.231 -3.847 1.00 10.00 O ATOM 852 CB ASP A 53 8.630 1.794 -5.049 1.00 10.00 C ATOM 853 CG ASP A 53 9.335 0.845 -4.067 1.00 10.00 C ATOM 854 OD1 ASP A 53 9.854 -0.174 -4.566 1.00 10.00 O ATOM 855 OD2 ASP A 53 9.282 1.077 -2.832 1.00 10.00 O ATOM 0 H ASP A 53 6.564 2.987 -6.275 1.00 10.00 H new ATOM 0 HA ASP A 53 7.443 0.212 -5.814 1.00 10.00 H new ATOM 0 HB2 ASP A 53 9.241 1.929 -5.942 1.00 10.00 H new ATOM 0 HB3 ASP A 53 8.508 2.777 -4.595 1.00 10.00 H new ATOM 860 N ILE A 54 6.314 0.063 -3.538 1.00 10.00 N ATOM 861 CA ILE A 54 5.693 -0.100 -2.237 1.00 10.00 C ATOM 862 C ILE A 54 6.714 -0.842 -1.389 1.00 10.00 C ATOM 863 O ILE A 54 6.963 -2.027 -1.611 1.00 10.00 O ATOM 864 CB ILE A 54 4.360 -0.868 -2.331 1.00 10.00 C ATOM 865 CG1 ILE A 54 3.342 -0.188 -3.272 1.00 10.00 C ATOM 866 CG2 ILE A 54 3.772 -1.000 -0.922 1.00 10.00 C ATOM 867 CD1 ILE A 54 1.954 -0.846 -3.267 1.00 10.00 C ATOM 0 H ILE A 54 6.722 -0.799 -3.901 1.00 10.00 H new ATOM 0 HA ILE A 54 5.434 0.863 -1.796 1.00 10.00 H new ATOM 0 HB ILE A 54 4.565 -1.850 -2.758 1.00 10.00 H new ATOM 0 HG12 ILE A 54 3.238 0.858 -2.984 1.00 10.00 H new ATOM 0 HG13 ILE A 54 3.736 -0.201 -4.288 1.00 10.00 H new ATOM 0 HG21 ILE A 54 2.827 -1.542 -0.971 1.00 10.00 H new ATOM 0 HG22 ILE A 54 4.470 -1.545 -0.286 1.00 10.00 H new ATOM 0 HG23 ILE A 54 3.600 -0.008 -0.505 1.00 10.00 H new ATOM 0 HD11 ILE A 54 1.296 -0.312 -3.952 1.00 10.00 H new ATOM 0 HD12 ILE A 54 2.043 -1.885 -3.585 1.00 10.00 H new ATOM 0 HD13 ILE A 54 1.537 -0.809 -2.260 1.00 10.00 H new ATOM 879 N SER A 55 7.281 -0.135 -0.415 1.00 10.00 N ATOM 880 CA SER A 55 8.272 -0.678 0.502 1.00 10.00 C ATOM 881 C SER A 55 7.716 -0.535 1.919 1.00 10.00 C ATOM 882 O SER A 55 7.405 0.575 2.350 1.00 10.00 O ATOM 883 CB SER A 55 9.576 0.112 0.314 1.00 10.00 C ATOM 884 OG SER A 55 10.179 -0.169 -0.938 1.00 10.00 O ATOM 0 H SER A 55 7.060 0.845 -0.240 1.00 10.00 H new ATOM 0 HA SER A 55 8.482 -1.731 0.315 1.00 10.00 H new ATOM 0 HB2 SER A 55 9.369 1.180 0.388 1.00 10.00 H new ATOM 0 HB3 SER A 55 10.271 -0.135 1.117 1.00 10.00 H new ATOM 0 HG SER A 55 10.013 0.574 -1.555 1.00 10.00 H new ATOM 890 N ALA A 56 7.580 -1.653 2.643 1.00 10.00 N ATOM 891 CA ALA A 56 7.013 -1.692 3.992 1.00 10.00 C ATOM 892 C ALA A 56 7.894 -2.491 4.963 1.00 10.00 C ATOM 893 O ALA A 56 8.524 -3.472 4.569 1.00 10.00 O ATOM 894 CB ALA A 56 5.578 -2.241 3.929 1.00 10.00 C ATOM 0 H ALA A 56 7.866 -2.570 2.300 1.00 10.00 H new ATOM 0 HA ALA A 56 6.980 -0.676 4.386 1.00 10.00 H new ATOM 0 HB1 ALA A 56 5.155 -2.270 4.933 1.00 10.00 H new ATOM 0 HB2 ALA A 56 4.969 -1.595 3.297 1.00 10.00 H new ATOM 0 HB3 ALA A 56 5.592 -3.248 3.512 1.00 10.00 H new ATOM 900 N GLU A 57 7.867 -2.109 6.242 1.00 10.00 N ATOM 901 CA GLU A 57 8.505 -2.812 7.356 1.00 10.00 C ATOM 902 C GLU A 57 7.626 -2.731 8.615 1.00 10.00 C ATOM 903 O GLU A 57 6.919 -1.743 8.839 1.00 10.00 O ATOM 904 CB GLU A 57 9.914 -2.240 7.628 1.00 10.00 C ATOM 905 CG GLU A 57 11.031 -3.288 7.484 1.00 10.00 C ATOM 906 CD GLU A 57 11.006 -4.361 8.584 1.00 10.00 C ATOM 907 OE1 GLU A 57 9.977 -5.071 8.678 1.00 10.00 O ATOM 908 OE2 GLU A 57 12.015 -4.467 9.315 1.00 10.00 O ATOM 0 H GLU A 57 7.379 -1.265 6.542 1.00 10.00 H new ATOM 0 HA GLU A 57 8.616 -3.862 7.084 1.00 10.00 H new ATOM 0 HB2 GLU A 57 10.105 -1.418 6.938 1.00 10.00 H new ATOM 0 HB3 GLU A 57 9.942 -1.824 8.635 1.00 10.00 H new ATOM 0 HG2 GLU A 57 10.941 -3.773 6.512 1.00 10.00 H new ATOM 0 HG3 GLU A 57 11.997 -2.783 7.501 1.00 10.00 H new ATOM 915 N LEU A 58 7.682 -3.788 9.430 1.00 10.00 N ATOM 916 CA LEU A 58 6.795 -4.036 10.564 1.00 10.00 C ATOM 917 C LEU A 58 7.617 -4.317 11.825 1.00 10.00 C ATOM 918 O LEU A 58 8.130 -5.421 12.009 1.00 10.00 O ATOM 919 CB LEU A 58 5.849 -5.196 10.181 1.00 10.00 C ATOM 920 CG LEU A 58 4.921 -5.702 11.303 1.00 10.00 C ATOM 921 CD1 LEU A 58 3.990 -4.611 11.830 1.00 10.00 C ATOM 922 CD2 LEU A 58 4.058 -6.857 10.785 1.00 10.00 C ATOM 0 H LEU A 58 8.378 -4.524 9.310 1.00 10.00 H new ATOM 0 HA LEU A 58 6.187 -3.161 10.794 1.00 10.00 H new ATOM 0 HB2 LEU A 58 5.232 -4.875 9.342 1.00 10.00 H new ATOM 0 HB3 LEU A 58 6.454 -6.032 9.830 1.00 10.00 H new ATOM 0 HG LEU A 58 5.566 -6.028 12.119 1.00 10.00 H new ATOM 0 HD11 LEU A 58 3.358 -5.021 12.618 1.00 10.00 H new ATOM 0 HD12 LEU A 58 4.583 -3.789 12.231 1.00 10.00 H new ATOM 0 HD13 LEU A 58 3.363 -4.244 11.017 1.00 10.00 H new ATOM 0 HD21 LEU A 58 3.405 -7.210 11.583 1.00 10.00 H new ATOM 0 HD22 LEU A 58 3.453 -6.512 9.947 1.00 10.00 H new ATOM 0 HD23 LEU A 58 4.702 -7.673 10.456 1.00 10.00 H new ATOM 934 N TYR A 59 7.697 -3.333 12.727 1.00 10.00 N ATOM 935 CA TYR A 59 8.483 -3.459 13.948 1.00 10.00 C ATOM 936 C TYR A 59 7.560 -3.880 15.092 1.00 10.00 C ATOM 937 O TYR A 59 6.803 -3.071 15.627 1.00 10.00 O ATOM 938 CB TYR A 59 9.224 -2.146 14.238 1.00 10.00 C ATOM 939 CG TYR A 59 9.968 -1.564 13.047 1.00 10.00 C ATOM 940 CD1 TYR A 59 10.959 -2.313 12.380 1.00 10.00 C ATOM 941 CD2 TYR A 59 9.650 -0.270 12.592 1.00 10.00 C ATOM 942 CE1 TYR A 59 11.644 -1.760 11.281 1.00 10.00 C ATOM 943 CE2 TYR A 59 10.343 0.292 11.510 1.00 10.00 C ATOM 944 CZ TYR A 59 11.349 -0.449 10.850 1.00 10.00 C ATOM 945 OH TYR A 59 12.032 0.092 9.804 1.00 10.00 O ATOM 0 H TYR A 59 7.221 -2.436 12.628 1.00 10.00 H new ATOM 0 HA TYR A 59 9.246 -4.229 13.833 1.00 10.00 H new ATOM 0 HB2 TYR A 59 8.505 -1.409 14.596 1.00 10.00 H new ATOM 0 HB3 TYR A 59 9.935 -2.316 15.046 1.00 10.00 H new ATOM 0 HD1 TYR A 59 11.193 -3.313 12.713 1.00 10.00 H new ATOM 0 HD2 TYR A 59 8.868 0.293 13.079 1.00 10.00 H new ATOM 0 HE1 TYR A 59 12.396 -2.340 10.767 1.00 10.00 H new ATOM 0 HE2 TYR A 59 10.107 1.293 11.181 1.00 10.00 H new ATOM 0 HH TYR A 59 11.451 0.716 9.322 1.00 10.00 H new ATOM 955 N LEU A 60 7.616 -5.163 15.453 1.00 10.00 N ATOM 956 CA LEU A 60 6.909 -5.731 16.601 1.00 10.00 C ATOM 957 C LEU A 60 7.719 -5.566 17.889 1.00 10.00 C ATOM 958 O LEU A 60 8.949 -5.515 17.857 1.00 10.00 O ATOM 959 CB LEU A 60 6.613 -7.219 16.337 1.00 10.00 C ATOM 960 CG LEU A 60 5.447 -7.409 15.354 1.00 10.00 C ATOM 961 CD1 LEU A 60 5.404 -8.848 14.838 1.00 10.00 C ATOM 962 CD2 LEU A 60 4.102 -7.099 16.020 1.00 10.00 C ATOM 0 H LEU A 60 8.168 -5.852 14.942 1.00 10.00 H new ATOM 0 HA LEU A 60 5.970 -5.193 16.732 1.00 10.00 H new ATOM 0 HB2 LEU A 60 7.506 -7.701 15.938 1.00 10.00 H new ATOM 0 HB3 LEU A 60 6.377 -7.714 17.279 1.00 10.00 H new ATOM 0 HG LEU A 60 5.612 -6.719 14.527 1.00 10.00 H new ATOM 0 HD11 LEU A 60 4.571 -8.961 14.144 1.00 10.00 H new ATOM 0 HD12 LEU A 60 6.338 -9.079 14.325 1.00 10.00 H new ATOM 0 HD13 LEU A 60 5.272 -9.532 15.677 1.00 10.00 H new ATOM 0 HD21 LEU A 60 3.297 -7.243 15.299 1.00 10.00 H new ATOM 0 HD22 LEU A 60 3.953 -7.768 16.868 1.00 10.00 H new ATOM 0 HD23 LEU A 60 4.098 -6.066 16.368 1.00 10.00 H new ATOM 974 N ASP A 61 7.020 -5.489 19.024 1.00 10.00 N ATOM 975 CA ASP A 61 7.656 -5.538 20.342 1.00 10.00 C ATOM 976 C ASP A 61 8.449 -6.841 20.556 1.00 10.00 C ATOM 977 O ASP A 61 8.037 -7.914 20.111 1.00 10.00 O ATOM 978 CB ASP A 61 6.601 -5.337 21.441 1.00 10.00 C ATOM 979 CG ASP A 61 7.227 -5.295 22.838 1.00 10.00 C ATOM 980 OD1 ASP A 61 8.359 -4.768 22.948 1.00 10.00 O ATOM 981 OD2 ASP A 61 6.585 -5.830 23.767 1.00 10.00 O ATOM 0 H ASP A 61 6.005 -5.392 19.056 1.00 10.00 H new ATOM 0 HA ASP A 61 8.379 -4.724 20.397 1.00 10.00 H new ATOM 0 HB2 ASP A 61 6.060 -4.409 21.258 1.00 10.00 H new ATOM 0 HB3 ASP A 61 5.871 -6.145 21.395 1.00 10.00 H new ATOM 986 N GLU A 62 9.550 -6.759 21.314 1.00 10.00 N ATOM 987 CA GLU A 62 10.475 -7.861 21.652 1.00 10.00 C ATOM 988 C GLU A 62 9.852 -8.945 22.569 1.00 10.00 C ATOM 989 O GLU A 62 10.553 -9.719 23.219 1.00 10.00 O ATOM 990 CB GLU A 62 11.770 -7.283 22.260 1.00 10.00 C ATOM 991 CG GLU A 62 12.525 -6.360 21.290 1.00 10.00 C ATOM 992 CD GLU A 62 13.905 -5.984 21.844 1.00 10.00 C ATOM 993 OE1 GLU A 62 13.985 -4.965 22.567 1.00 10.00 O ATOM 994 OE2 GLU A 62 14.869 -6.723 21.541 1.00 10.00 O ATOM 0 H GLU A 62 9.840 -5.876 21.733 1.00 10.00 H new ATOM 0 HA GLU A 62 10.707 -8.379 20.721 1.00 10.00 H new ATOM 0 HB2 GLU A 62 11.524 -6.728 23.165 1.00 10.00 H new ATOM 0 HB3 GLU A 62 12.424 -8.103 22.557 1.00 10.00 H new ATOM 0 HG2 GLU A 62 12.640 -6.856 20.326 1.00 10.00 H new ATOM 0 HG3 GLU A 62 11.942 -5.456 21.115 1.00 10.00 H new ATOM 1001 N LEU A 63 8.519 -8.995 22.608 1.00 10.00 N ATOM 1002 CA LEU A 63 7.668 -9.866 23.412 1.00 10.00 C ATOM 1003 C LEU A 63 6.478 -10.412 22.588 1.00 10.00 C ATOM 1004 O LEU A 63 5.597 -11.058 23.150 1.00 10.00 O ATOM 1005 CB LEU A 63 7.200 -9.030 24.622 1.00 10.00 C ATOM 1006 CG LEU A 63 6.712 -9.811 25.857 1.00 10.00 C ATOM 1007 CD1 LEU A 63 7.837 -10.622 26.512 1.00 10.00 C ATOM 1008 CD2 LEU A 63 6.168 -8.822 26.893 1.00 10.00 C ATOM 0 H LEU A 63 7.961 -8.371 22.025 1.00 10.00 H new ATOM 0 HA LEU A 63 8.216 -10.746 23.748 1.00 10.00 H new ATOM 0 HB2 LEU A 63 8.024 -8.387 24.930 1.00 10.00 H new ATOM 0 HB3 LEU A 63 6.392 -8.377 24.292 1.00 10.00 H new ATOM 0 HG LEU A 63 5.940 -10.504 25.522 1.00 10.00 H new ATOM 0 HD11 LEU A 63 7.445 -11.155 27.378 1.00 10.00 H new ATOM 0 HD12 LEU A 63 8.234 -11.339 25.794 1.00 10.00 H new ATOM 0 HD13 LEU A 63 8.633 -9.949 26.831 1.00 10.00 H new ATOM 0 HD21 LEU A 63 5.821 -9.368 27.770 1.00 10.00 H new ATOM 0 HD22 LEU A 63 6.958 -8.130 27.186 1.00 10.00 H new ATOM 0 HD23 LEU A 63 5.338 -8.263 26.461 1.00 10.00 H new ATOM 1020 N SER A 64 6.436 -10.152 21.269 1.00 10.00 N ATOM 1021 CA SER A 64 5.318 -10.498 20.376 1.00 10.00 C ATOM 1022 C SER A 64 5.797 -11.287 19.151 1.00 10.00 C ATOM 1023 O SER A 64 6.816 -10.953 18.549 1.00 10.00 O ATOM 1024 CB SER A 64 4.620 -9.217 19.900 1.00 10.00 C ATOM 1025 OG SER A 64 4.077 -8.499 20.989 1.00 10.00 O ATOM 0 H SER A 64 7.200 -9.683 20.783 1.00 10.00 H new ATOM 0 HA SER A 64 4.625 -11.122 20.940 1.00 10.00 H new ATOM 0 HB2 SER A 64 5.332 -8.589 19.365 1.00 10.00 H new ATOM 0 HB3 SER A 64 3.827 -9.471 19.196 1.00 10.00 H new ATOM 0 HG SER A 64 3.782 -7.616 20.684 1.00 10.00 H new ATOM 1031 N ASP A 65 5.035 -12.310 18.749 1.00 10.00 N ATOM 1032 CA ASP A 65 5.403 -13.297 17.742 1.00 10.00 C ATOM 1033 C ASP A 65 4.203 -13.593 16.828 1.00 10.00 C ATOM 1034 O ASP A 65 3.361 -14.452 17.077 1.00 10.00 O ATOM 1035 CB ASP A 65 5.956 -14.561 18.437 1.00 10.00 C ATOM 1036 CG ASP A 65 5.017 -15.250 19.448 1.00 10.00 C ATOM 1037 OD1 ASP A 65 4.299 -14.537 20.191 1.00 10.00 O ATOM 1038 OD2 ASP A 65 5.086 -16.499 19.516 1.00 10.00 O ATOM 0 H ASP A 65 4.106 -12.475 19.137 1.00 10.00 H new ATOM 0 HA ASP A 65 6.194 -12.906 17.102 1.00 10.00 H new ATOM 0 HB2 ASP A 65 6.222 -15.286 17.668 1.00 10.00 H new ATOM 0 HB3 ASP A 65 6.877 -14.292 18.954 1.00 10.00 H new ATOM 1043 N ALA A 66 4.183 -12.865 15.715 1.00 10.00 N ATOM 1044 CA ALA A 66 3.264 -13.040 14.591 1.00 10.00 C ATOM 1045 C ALA A 66 3.823 -14.009 13.522 1.00 10.00 C ATOM 1046 O ALA A 66 4.896 -14.593 13.689 1.00 10.00 O ATOM 1047 CB ALA A 66 2.969 -11.650 14.011 1.00 10.00 C ATOM 0 H ALA A 66 4.839 -12.099 15.564 1.00 10.00 H new ATOM 0 HA ALA A 66 2.340 -13.502 14.939 1.00 10.00 H new ATOM 0 HB1 ALA A 66 2.284 -11.745 13.168 1.00 10.00 H new ATOM 0 HB2 ALA A 66 2.514 -11.024 14.779 1.00 10.00 H new ATOM 0 HB3 ALA A 66 3.899 -11.192 13.673 1.00 10.00 H new ATOM 1053 N ASP A 67 3.128 -14.153 12.387 1.00 10.00 N ATOM 1054 CA ASP A 67 3.441 -15.181 11.390 1.00 10.00 C ATOM 1055 C ASP A 67 4.540 -14.706 10.409 1.00 10.00 C ATOM 1056 O ASP A 67 4.580 -13.518 10.063 1.00 10.00 O ATOM 1057 CB ASP A 67 2.171 -15.498 10.582 1.00 10.00 C ATOM 1058 CG ASP A 67 1.019 -15.977 11.465 1.00 10.00 C ATOM 1059 OD1 ASP A 67 0.313 -15.095 12.003 1.00 10.00 O ATOM 1060 OD2 ASP A 67 0.862 -17.212 11.581 1.00 10.00 O ATOM 0 H ASP A 67 2.336 -13.562 12.136 1.00 10.00 H new ATOM 0 HA ASP A 67 3.803 -16.064 11.917 1.00 10.00 H new ATOM 0 HB2 ASP A 67 1.860 -14.607 10.036 1.00 10.00 H new ATOM 0 HB3 ASP A 67 2.398 -16.263 9.840 1.00 10.00 H new ATOM 1065 N PRO A 68 5.419 -15.617 9.924 1.00 10.00 N ATOM 1066 CA PRO A 68 6.644 -15.323 9.154 1.00 10.00 C ATOM 1067 C PRO A 68 6.396 -14.866 7.697 1.00 10.00 C ATOM 1068 O PRO A 68 7.058 -15.300 6.757 1.00 10.00 O ATOM 1069 CB PRO A 68 7.495 -16.598 9.266 1.00 10.00 C ATOM 1070 CG PRO A 68 6.445 -17.699 9.340 1.00 10.00 C ATOM 1071 CD PRO A 68 5.363 -17.050 10.200 1.00 10.00 C ATOM 0 HA PRO A 68 7.160 -14.455 9.565 1.00 10.00 H new ATOM 0 HB2 PRO A 68 8.152 -16.723 8.405 1.00 10.00 H new ATOM 0 HB3 PRO A 68 8.130 -16.584 10.152 1.00 10.00 H new ATOM 0 HG2 PRO A 68 6.072 -17.973 8.353 1.00 10.00 H new ATOM 0 HG3 PRO A 68 6.838 -18.608 9.796 1.00 10.00 H new ATOM 0 HD2 PRO A 68 4.380 -17.454 9.957 1.00 10.00 H new ATOM 0 HD3 PRO A 68 5.537 -17.249 11.258 1.00 10.00 H new ATOM 1079 N GLY A 69 5.425 -13.972 7.524 1.00 10.00 N ATOM 1080 CA GLY A 69 5.026 -13.335 6.268 1.00 10.00 C ATOM 1081 C GLY A 69 3.832 -12.376 6.401 1.00 10.00 C ATOM 1082 O GLY A 69 3.309 -11.923 5.388 1.00 10.00 O ATOM 0 H GLY A 69 4.858 -13.651 8.309 1.00 10.00 H new ATOM 0 HA2 GLY A 69 5.877 -12.785 5.866 1.00 10.00 H new ATOM 0 HA3 GLY A 69 4.776 -14.110 5.543 1.00 10.00 H new ATOM 1086 N ILE A 70 3.389 -12.039 7.622 1.00 10.00 N ATOM 1087 CA ILE A 70 2.138 -11.312 7.871 1.00 10.00 C ATOM 1088 C ILE A 70 2.083 -9.896 7.261 1.00 10.00 C ATOM 1089 O ILE A 70 1.000 -9.375 6.998 1.00 10.00 O ATOM 1090 CB ILE A 70 1.885 -11.332 9.395 1.00 10.00 C ATOM 1091 CG1 ILE A 70 0.383 -11.229 9.688 1.00 10.00 C ATOM 1092 CG2 ILE A 70 2.713 -10.273 10.148 1.00 10.00 C ATOM 1093 CD1 ILE A 70 0.041 -11.611 11.130 1.00 10.00 C ATOM 0 H ILE A 70 3.898 -12.268 8.476 1.00 10.00 H new ATOM 0 HA ILE A 70 1.328 -11.820 7.348 1.00 10.00 H new ATOM 0 HB ILE A 70 2.233 -12.291 9.778 1.00 10.00 H new ATOM 0 HG12 ILE A 70 0.047 -10.210 9.496 1.00 10.00 H new ATOM 0 HG13 ILE A 70 -0.163 -11.879 9.004 1.00 10.00 H new ATOM 0 HG21 ILE A 70 2.496 -10.332 11.214 1.00 10.00 H new ATOM 0 HG22 ILE A 70 3.775 -10.457 9.983 1.00 10.00 H new ATOM 0 HG23 ILE A 70 2.455 -9.280 9.780 1.00 10.00 H new ATOM 0 HD11 ILE A 70 -1.034 -11.521 11.285 1.00 10.00 H new ATOM 0 HD12 ILE A 70 0.350 -12.639 11.317 1.00 10.00 H new ATOM 0 HD13 ILE A 70 0.563 -10.945 11.817 1.00 10.00 H new ATOM 1105 N VAL A 71 3.246 -9.281 7.004 1.00 10.00 N ATOM 1106 CA VAL A 71 3.367 -8.025 6.252 1.00 10.00 C ATOM 1107 C VAL A 71 3.441 -8.238 4.738 1.00 10.00 C ATOM 1108 O VAL A 71 2.924 -7.402 4.005 1.00 10.00 O ATOM 1109 CB VAL A 71 4.540 -7.177 6.779 1.00 10.00 C ATOM 1110 CG1 VAL A 71 5.910 -7.859 6.646 1.00 10.00 C ATOM 1111 CG2 VAL A 71 4.603 -5.789 6.129 1.00 10.00 C ATOM 0 H VAL A 71 4.144 -9.649 7.318 1.00 10.00 H new ATOM 0 HA VAL A 71 2.448 -7.464 6.423 1.00 10.00 H new ATOM 0 HB VAL A 71 4.326 -7.065 7.842 1.00 10.00 H new ATOM 0 HG11 VAL A 71 6.684 -7.200 7.038 1.00 10.00 H new ATOM 0 HG12 VAL A 71 5.908 -8.792 7.209 1.00 10.00 H new ATOM 0 HG13 VAL A 71 6.111 -8.070 5.596 1.00 10.00 H new ATOM 0 HG21 VAL A 71 5.448 -5.234 6.537 1.00 10.00 H new ATOM 0 HG22 VAL A 71 4.726 -5.897 5.051 1.00 10.00 H new ATOM 0 HG23 VAL A 71 3.680 -5.248 6.336 1.00 10.00 H new ATOM 1121 N ASP A 72 3.986 -9.361 4.253 1.00 10.00 N ATOM 1122 CA ASP A 72 3.966 -9.713 2.825 1.00 10.00 C ATOM 1123 C ASP A 72 2.520 -9.829 2.319 1.00 10.00 C ATOM 1124 O ASP A 72 2.195 -9.337 1.239 1.00 10.00 O ATOM 1125 CB ASP A 72 4.763 -11.005 2.593 1.00 10.00 C ATOM 1126 CG ASP A 72 5.039 -11.251 1.108 1.00 10.00 C ATOM 1127 OD1 ASP A 72 5.712 -10.385 0.506 1.00 10.00 O ATOM 1128 OD2 ASP A 72 4.603 -12.311 0.609 1.00 10.00 O ATOM 0 H ASP A 72 4.454 -10.052 4.839 1.00 10.00 H new ATOM 0 HA ASP A 72 4.444 -8.920 2.251 1.00 10.00 H new ATOM 0 HB2 ASP A 72 5.708 -10.949 3.133 1.00 10.00 H new ATOM 0 HB3 ASP A 72 4.211 -11.850 3.004 1.00 10.00 H new ATOM 1133 N GLU A 73 1.623 -10.340 3.177 1.00 10.00 N ATOM 1134 CA GLU A 73 0.183 -10.352 2.917 1.00 10.00 C ATOM 1135 C GLU A 73 -0.380 -8.922 2.825 1.00 10.00 C ATOM 1136 O GLU A 73 -1.243 -8.668 1.986 1.00 10.00 O ATOM 1137 CB GLU A 73 -0.556 -11.045 4.072 1.00 10.00 C ATOM 1138 CG GLU A 73 -0.216 -12.512 4.367 1.00 10.00 C ATOM 1139 CD GLU A 73 -1.047 -13.042 5.550 1.00 10.00 C ATOM 1140 OE1 GLU A 73 -1.285 -12.278 6.518 1.00 10.00 O ATOM 1141 OE2 GLU A 73 -1.466 -14.218 5.514 1.00 10.00 O ATOM 0 H GLU A 73 1.881 -10.756 4.072 1.00 10.00 H new ATOM 0 HA GLU A 73 0.034 -10.879 1.974 1.00 10.00 H new ATOM 0 HB2 GLU A 73 -0.371 -10.470 4.979 1.00 10.00 H new ATOM 0 HB3 GLU A 73 -1.625 -10.984 3.869 1.00 10.00 H new ATOM 0 HG2 GLU A 73 -0.408 -13.119 3.482 1.00 10.00 H new ATOM 0 HG3 GLU A 73 0.846 -12.605 4.593 1.00 10.00 H new ATOM 1148 N ALA A 74 0.118 -7.972 3.635 1.00 10.00 N ATOM 1149 CA ALA A 74 -0.308 -6.576 3.556 1.00 10.00 C ATOM 1150 C ALA A 74 0.141 -5.917 2.247 1.00 10.00 C ATOM 1151 O ALA A 74 -0.646 -5.208 1.615 1.00 10.00 O ATOM 1152 CB ALA A 74 0.229 -5.796 4.765 1.00 10.00 C ATOM 0 H ALA A 74 0.819 -8.153 4.353 1.00 10.00 H new ATOM 0 HA ALA A 74 -1.398 -6.556 3.571 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -0.092 -4.757 4.699 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -0.157 -6.238 5.684 1.00 10.00 H new ATOM 0 HB3 ALA A 74 1.318 -5.839 4.771 1.00 10.00 H new ATOM 1158 N VAL A 75 1.391 -6.161 1.824 1.00 10.00 N ATOM 1159 CA VAL A 75 1.899 -5.594 0.573 1.00 10.00 C ATOM 1160 C VAL A 75 1.212 -6.241 -0.638 1.00 10.00 C ATOM 1161 O VAL A 75 0.772 -5.508 -1.518 1.00 10.00 O ATOM 1162 CB VAL A 75 3.438 -5.636 0.457 1.00 10.00 C ATOM 1163 CG1 VAL A 75 3.888 -4.515 -0.484 1.00 10.00 C ATOM 1164 CG2 VAL A 75 4.177 -5.377 1.780 1.00 10.00 C ATOM 0 H VAL A 75 2.061 -6.743 2.328 1.00 10.00 H new ATOM 0 HA VAL A 75 1.642 -4.535 0.585 1.00 10.00 H new ATOM 0 HB VAL A 75 3.679 -6.641 0.109 1.00 10.00 H new ATOM 0 HG11 VAL A 75 4.974 -4.531 -0.576 1.00 10.00 H new ATOM 0 HG12 VAL A 75 3.438 -4.662 -1.466 1.00 10.00 H new ATOM 0 HG13 VAL A 75 3.573 -3.553 -0.080 1.00 10.00 H new ATOM 0 HG21 VAL A 75 5.253 -5.424 1.611 1.00 10.00 H new ATOM 0 HG22 VAL A 75 3.912 -4.389 2.158 1.00 10.00 H new ATOM 0 HG23 VAL A 75 3.891 -6.134 2.511 1.00 10.00 H new ATOM 1174 N ASP A 76 0.988 -7.567 -0.647 1.00 10.00 N ATOM 1175 CA ASP A 76 0.166 -8.242 -1.664 1.00 10.00 C ATOM 1176 C ASP A 76 -1.260 -7.688 -1.691 1.00 10.00 C ATOM 1177 O ASP A 76 -1.761 -7.374 -2.768 1.00 10.00 O ATOM 1178 CB ASP A 76 0.143 -9.761 -1.434 1.00 10.00 C ATOM 1179 CG ASP A 76 -0.675 -10.465 -2.526 1.00 10.00 C ATOM 1180 OD1 ASP A 76 -0.199 -10.484 -3.683 1.00 10.00 O ATOM 1181 OD2 ASP A 76 -1.788 -10.942 -2.208 1.00 10.00 O ATOM 0 H ASP A 76 1.373 -8.201 0.053 1.00 10.00 H new ATOM 0 HA ASP A 76 0.623 -8.044 -2.633 1.00 10.00 H new ATOM 0 HB2 ASP A 76 1.162 -10.148 -1.430 1.00 10.00 H new ATOM 0 HB3 ASP A 76 -0.285 -9.979 -0.455 1.00 10.00 H new ATOM 1186 N ALA A 77 -1.877 -7.440 -0.532 1.00 10.00 N ATOM 1187 CA ALA A 77 -3.216 -6.859 -0.488 1.00 10.00 C ATOM 1188 C ALA A 77 -3.235 -5.451 -1.105 1.00 10.00 C ATOM 1189 O ALA A 77 -4.149 -5.140 -1.868 1.00 10.00 O ATOM 1190 CB ALA A 77 -3.727 -6.853 0.955 1.00 10.00 C ATOM 0 H ALA A 77 -1.470 -7.633 0.383 1.00 10.00 H new ATOM 0 HA ALA A 77 -3.887 -7.473 -1.089 1.00 10.00 H new ATOM 0 HB1 ALA A 77 -4.726 -6.419 0.985 1.00 10.00 H new ATOM 0 HB2 ALA A 77 -3.764 -7.875 1.332 1.00 10.00 H new ATOM 0 HB3 ALA A 77 -3.055 -6.261 1.576 1.00 10.00 H new ATOM 1196 N ALA A 78 -2.207 -4.625 -0.863 1.00 10.00 N ATOM 1197 CA ALA A 78 -2.049 -3.348 -1.556 1.00 10.00 C ATOM 1198 C ALA A 78 -1.775 -3.508 -3.063 1.00 10.00 C ATOM 1199 O ALA A 78 -2.407 -2.809 -3.858 1.00 10.00 O ATOM 1200 CB ALA A 78 -0.962 -2.529 -0.860 1.00 10.00 C ATOM 0 H ALA A 78 -1.470 -4.825 -0.187 1.00 10.00 H new ATOM 0 HA ALA A 78 -2.996 -2.812 -1.496 1.00 10.00 H new ATOM 0 HB1 ALA A 78 -0.840 -1.575 -1.373 1.00 10.00 H new ATOM 0 HB2 ALA A 78 -1.249 -2.349 0.176 1.00 10.00 H new ATOM 0 HB3 ALA A 78 -0.020 -3.078 -0.886 1.00 10.00 H new ATOM 1206 N TYR A 79 -0.905 -4.439 -3.482 1.00 10.00 N ATOM 1207 CA TYR A 79 -0.632 -4.671 -4.905 1.00 10.00 C ATOM 1208 C TYR A 79 -1.877 -5.175 -5.655 1.00 10.00 C ATOM 1209 O TYR A 79 -2.191 -4.656 -6.726 1.00 10.00 O ATOM 1210 CB TYR A 79 0.489 -5.717 -5.067 1.00 10.00 C ATOM 1211 CG TYR A 79 1.899 -5.325 -4.647 1.00 10.00 C ATOM 1212 CD1 TYR A 79 2.520 -4.191 -5.213 1.00 10.00 C ATOM 1213 CD2 TYR A 79 2.633 -6.153 -3.770 1.00 10.00 C ATOM 1214 CE1 TYR A 79 3.856 -3.874 -4.893 1.00 10.00 C ATOM 1215 CE2 TYR A 79 3.980 -5.868 -3.487 1.00 10.00 C ATOM 1216 CZ TYR A 79 4.591 -4.720 -4.032 1.00 10.00 C ATOM 1217 OH TYR A 79 5.881 -4.439 -3.702 1.00 10.00 O ATOM 0 H TYR A 79 -0.378 -5.044 -2.852 1.00 10.00 H new ATOM 0 HA TYR A 79 -0.329 -3.714 -5.331 1.00 10.00 H new ATOM 0 HB2 TYR A 79 0.205 -6.602 -4.497 1.00 10.00 H new ATOM 0 HB3 TYR A 79 0.523 -6.011 -6.116 1.00 10.00 H new ATOM 0 HD1 TYR A 79 1.968 -3.562 -5.896 1.00 10.00 H new ATOM 0 HD2 TYR A 79 2.157 -7.009 -3.315 1.00 10.00 H new ATOM 0 HE1 TYR A 79 4.316 -2.988 -5.304 1.00 10.00 H new ATOM 0 HE2 TYR A 79 4.548 -6.530 -2.851 1.00 10.00 H new ATOM 0 HH TYR A 79 6.223 -5.132 -3.100 1.00 10.00 H new ATOM 1227 N ARG A 80 -2.635 -6.116 -5.072 1.00 10.00 N ATOM 1228 CA ARG A 80 -3.880 -6.640 -5.654 1.00 10.00 C ATOM 1229 C ARG A 80 -5.030 -5.627 -5.580 1.00 10.00 C ATOM 1230 O ARG A 80 -5.868 -5.578 -6.480 1.00 10.00 O ATOM 1231 CB ARG A 80 -4.236 -8.015 -5.062 1.00 10.00 C ATOM 1232 CG ARG A 80 -3.076 -9.028 -5.207 1.00 10.00 C ATOM 1233 CD ARG A 80 -3.500 -10.414 -5.694 1.00 10.00 C ATOM 1234 NE ARG A 80 -3.783 -10.420 -7.143 1.00 10.00 N ATOM 1235 CZ ARG A 80 -4.067 -11.469 -7.896 1.00 10.00 C ATOM 1236 NH1 ARG A 80 -4.162 -12.673 -7.378 1.00 10.00 N ATOM 1237 NH2 ARG A 80 -4.259 -11.341 -9.186 1.00 10.00 N ATOM 0 H ARG A 80 -2.399 -6.539 -4.174 1.00 10.00 H new ATOM 0 HA ARG A 80 -3.707 -6.798 -6.719 1.00 10.00 H new ATOM 0 HB2 ARG A 80 -4.488 -7.901 -4.008 1.00 10.00 H new ATOM 0 HB3 ARG A 80 -5.123 -8.406 -5.561 1.00 10.00 H new ATOM 0 HG2 ARG A 80 -2.341 -8.622 -5.902 1.00 10.00 H new ATOM 0 HG3 ARG A 80 -2.579 -9.132 -4.242 1.00 10.00 H new ATOM 0 HD2 ARG A 80 -2.712 -11.134 -5.474 1.00 10.00 H new ATOM 0 HD3 ARG A 80 -4.387 -10.736 -5.148 1.00 10.00 H new ATOM 0 HE ARG A 80 -3.757 -9.516 -7.615 1.00 10.00 H new ATOM 0 HH11 ARG A 80 -4.016 -12.811 -6.378 1.00 10.00 H new ATOM 0 HH12 ARG A 80 -4.382 -13.470 -7.976 1.00 10.00 H new ATOM 0 HH21 ARG A 80 -4.190 -10.422 -9.623 1.00 10.00 H new ATOM 0 HH22 ARG A 80 -4.477 -12.160 -9.753 1.00 10.00 H new ATOM 1251 N SER A 81 -5.039 -4.760 -4.559 1.00 10.00 N ATOM 1252 CA SER A 81 -5.938 -3.602 -4.502 1.00 10.00 C ATOM 1253 C SER A 81 -5.637 -2.635 -5.654 1.00 10.00 C ATOM 1254 O SER A 81 -6.556 -2.247 -6.370 1.00 10.00 O ATOM 1255 CB SER A 81 -5.807 -2.903 -3.142 1.00 10.00 C ATOM 1256 OG SER A 81 -6.653 -1.777 -3.062 1.00 10.00 O ATOM 0 H SER A 81 -4.423 -4.842 -3.750 1.00 10.00 H new ATOM 0 HA SER A 81 -6.967 -3.943 -4.613 1.00 10.00 H new ATOM 0 HB2 SER A 81 -6.054 -3.604 -2.345 1.00 10.00 H new ATOM 0 HB3 SER A 81 -4.773 -2.596 -2.987 1.00 10.00 H new ATOM 0 HG SER A 81 -6.130 -0.963 -3.220 1.00 10.00 H new ATOM 1262 N LEU A 82 -4.357 -2.320 -5.911 1.00 10.00 N ATOM 1263 CA LEU A 82 -3.937 -1.473 -7.035 1.00 10.00 C ATOM 1264 C LEU A 82 -4.291 -2.115 -8.388 1.00 10.00 C ATOM 1265 O LEU A 82 -4.853 -1.455 -9.263 1.00 10.00 O ATOM 1266 CB LEU A 82 -2.424 -1.203 -6.898 1.00 10.00 C ATOM 1267 CG LEU A 82 -1.835 0.011 -7.648 1.00 10.00 C ATOM 1268 CD1 LEU A 82 -1.594 -0.269 -9.132 1.00 10.00 C ATOM 1269 CD2 LEU A 82 -2.675 1.288 -7.506 1.00 10.00 C ATOM 0 H LEU A 82 -3.580 -2.650 -5.339 1.00 10.00 H new ATOM 0 HA LEU A 82 -4.475 -0.525 -7.006 1.00 10.00 H new ATOM 0 HB2 LEU A 82 -2.201 -1.081 -5.838 1.00 10.00 H new ATOM 0 HB3 LEU A 82 -1.894 -2.094 -7.235 1.00 10.00 H new ATOM 0 HG LEU A 82 -0.875 0.182 -7.160 1.00 10.00 H new ATOM 0 HD11 LEU A 82 -1.180 0.620 -9.607 1.00 10.00 H new ATOM 0 HD12 LEU A 82 -0.893 -1.097 -9.237 1.00 10.00 H new ATOM 0 HD13 LEU A 82 -2.538 -0.530 -9.611 1.00 10.00 H new ATOM 0 HD21 LEU A 82 -2.201 2.099 -8.059 1.00 10.00 H new ATOM 0 HD22 LEU A 82 -3.674 1.113 -7.905 1.00 10.00 H new ATOM 0 HD23 LEU A 82 -2.748 1.560 -6.453 1.00 10.00 H new ATOM 1281 N GLU A 83 -4.056 -3.423 -8.525 1.00 10.00 N ATOM 1282 CA GLU A 83 -4.424 -4.215 -9.703 1.00 10.00 C ATOM 1283 C GLU A 83 -5.940 -4.157 -9.960 1.00 10.00 C ATOM 1284 O GLU A 83 -6.353 -3.949 -11.099 1.00 10.00 O ATOM 1285 CB GLU A 83 -3.964 -5.653 -9.416 1.00 10.00 C ATOM 1286 CG GLU A 83 -4.234 -6.720 -10.487 1.00 10.00 C ATOM 1287 CD GLU A 83 -3.978 -8.142 -9.949 1.00 10.00 C ATOM 1288 OE1 GLU A 83 -3.559 -8.310 -8.781 1.00 10.00 O ATOM 1289 OE2 GLU A 83 -4.239 -9.124 -10.677 1.00 10.00 O ATOM 0 H GLU A 83 -3.593 -3.974 -7.802 1.00 10.00 H new ATOM 0 HA GLU A 83 -3.949 -3.824 -10.603 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -2.890 -5.630 -9.230 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -4.441 -5.979 -8.492 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -5.266 -6.640 -10.829 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -3.596 -6.537 -11.352 1.00 10.00 H new ATOM 1296 N SER A 84 -6.765 -4.231 -8.905 1.00 10.00 N ATOM 1297 CA SER A 84 -8.220 -4.070 -9.007 1.00 10.00 C ATOM 1298 C SER A 84 -8.691 -2.612 -9.131 1.00 10.00 C ATOM 1299 O SER A 84 -9.842 -2.402 -9.511 1.00 10.00 O ATOM 1300 CB SER A 84 -8.907 -4.710 -7.799 1.00 10.00 C ATOM 1301 OG SER A 84 -10.309 -4.663 -7.993 1.00 10.00 O ATOM 0 H SER A 84 -6.439 -4.405 -7.954 1.00 10.00 H new ATOM 0 HA SER A 84 -8.501 -4.571 -9.934 1.00 10.00 H new ATOM 0 HB2 SER A 84 -8.577 -5.742 -7.680 1.00 10.00 H new ATOM 0 HB3 SER A 84 -8.634 -4.181 -6.886 1.00 10.00 H new ATOM 0 HG SER A 84 -10.542 -3.857 -8.499 1.00 10.00 H new ATOM 1307 N PHE A 85 -7.867 -1.617 -8.785 1.00 10.00 N ATOM 1308 CA PHE A 85 -8.173 -0.187 -8.922 1.00 10.00 C ATOM 1309 C PHE A 85 -7.958 0.285 -10.368 1.00 10.00 C ATOM 1310 O PHE A 85 -8.734 1.091 -10.883 1.00 10.00 O ATOM 1311 CB PHE A 85 -7.282 0.586 -7.932 1.00 10.00 C ATOM 1312 CG PHE A 85 -7.539 2.076 -7.766 1.00 10.00 C ATOM 1313 CD1 PHE A 85 -7.189 2.983 -8.786 1.00 10.00 C ATOM 1314 CD2 PHE A 85 -8.025 2.571 -6.539 1.00 10.00 C ATOM 1315 CE1 PHE A 85 -7.307 4.368 -8.577 1.00 10.00 C ATOM 1316 CE2 PHE A 85 -8.144 3.957 -6.330 1.00 10.00 C ATOM 1317 CZ PHE A 85 -7.780 4.857 -7.346 1.00 10.00 C ATOM 0 H PHE A 85 -6.942 -1.788 -8.391 1.00 10.00 H new ATOM 0 HA PHE A 85 -9.222 -0.001 -8.690 1.00 10.00 H new ATOM 0 HB2 PHE A 85 -7.383 0.117 -6.953 1.00 10.00 H new ATOM 0 HB3 PHE A 85 -6.245 0.457 -8.242 1.00 10.00 H new ATOM 0 HD1 PHE A 85 -6.828 2.612 -9.734 1.00 10.00 H new ATOM 0 HD2 PHE A 85 -8.307 1.883 -5.756 1.00 10.00 H new ATOM 0 HE1 PHE A 85 -7.034 5.057 -9.362 1.00 10.00 H new ATOM 0 HE2 PHE A 85 -8.516 4.330 -5.387 1.00 10.00 H new ATOM 0 HZ PHE A 85 -7.863 5.921 -7.182 1.00 10.00 H new ATOM 1327 N LEU A 86 -6.936 -0.253 -11.050 1.00 10.00 N ATOM 1328 CA LEU A 86 -6.619 0.038 -12.456 1.00 10.00 C ATOM 1329 C LEU A 86 -7.619 -0.603 -13.448 1.00 10.00 C ATOM 1330 O LEU A 86 -7.448 -0.475 -14.662 1.00 10.00 O ATOM 1331 CB LEU A 86 -5.154 -0.351 -12.746 1.00 10.00 C ATOM 1332 CG LEU A 86 -4.036 0.568 -12.169 1.00 10.00 C ATOM 1333 CD1 LEU A 86 -3.433 1.487 -13.236 1.00 10.00 C ATOM 1334 CD2 LEU A 86 -4.411 1.489 -10.996 1.00 10.00 C ATOM 0 H LEU A 86 -6.290 -0.920 -10.628 1.00 10.00 H new ATOM 0 HA LEU A 86 -6.728 1.111 -12.614 1.00 10.00 H new ATOM 0 HB2 LEU A 86 -4.992 -1.358 -12.363 1.00 10.00 H new ATOM 0 HB3 LEU A 86 -5.026 -0.397 -13.828 1.00 10.00 H new ATOM 0 HG LEU A 86 -3.338 -0.181 -11.795 1.00 10.00 H new ATOM 0 HD11 LEU A 86 -2.659 2.108 -12.786 1.00 10.00 H new ATOM 0 HD12 LEU A 86 -2.997 0.883 -14.032 1.00 10.00 H new ATOM 0 HD13 LEU A 86 -4.214 2.124 -13.651 1.00 10.00 H new ATOM 0 HD21 LEU A 86 -3.539 2.070 -10.697 1.00 10.00 H new ATOM 0 HD22 LEU A 86 -5.209 2.165 -11.304 1.00 10.00 H new ATOM 0 HD23 LEU A 86 -4.751 0.886 -10.154 1.00 10.00 H new ATOM 1346 N ASP A 87 -8.694 -1.218 -12.937 1.00 10.00 N ATOM 1347 CA ASP A 87 -9.890 -1.675 -13.659 1.00 10.00 C ATOM 1348 C ASP A 87 -10.433 -0.618 -14.640 1.00 10.00 C ATOM 1349 O ASP A 87 -10.909 -0.972 -15.713 1.00 10.00 O ATOM 1350 CB ASP A 87 -10.933 -2.048 -12.586 1.00 10.00 C ATOM 1351 CG ASP A 87 -12.380 -2.121 -13.085 1.00 10.00 C ATOM 1352 OD1 ASP A 87 -12.800 -3.226 -13.491 1.00 10.00 O ATOM 1353 OD2 ASP A 87 -13.059 -1.071 -12.998 1.00 10.00 O ATOM 0 H ASP A 87 -8.756 -1.424 -11.940 1.00 10.00 H new ATOM 0 HA ASP A 87 -9.646 -2.533 -14.285 1.00 10.00 H new ATOM 0 HB2 ASP A 87 -10.663 -3.014 -12.159 1.00 10.00 H new ATOM 0 HB3 ASP A 87 -10.879 -1.317 -11.779 1.00 10.00 H new ATOM 1358 N GLY A 88 -10.284 0.675 -14.315 1.00 10.00 N ATOM 1359 CA GLY A 88 -10.679 1.787 -15.186 1.00 10.00 C ATOM 1360 C GLY A 88 -9.504 2.499 -15.872 1.00 10.00 C ATOM 1361 O GLY A 88 -9.650 3.659 -16.253 1.00 10.00 O ATOM 0 H GLY A 88 -9.881 0.979 -13.429 1.00 10.00 H new ATOM 0 HA2 GLY A 88 -11.358 1.411 -15.951 1.00 10.00 H new ATOM 0 HA3 GLY A 88 -11.236 2.515 -14.596 1.00 10.00 H new ATOM 1365 N PHE A 89 -8.347 1.835 -16.002 1.00 10.00 N ATOM 1366 CA PHE A 89 -7.122 2.388 -16.601 1.00 10.00 C ATOM 1367 C PHE A 89 -6.306 1.399 -17.456 1.00 10.00 C ATOM 1368 O PHE A 89 -5.534 1.858 -18.298 1.00 10.00 O ATOM 1369 CB PHE A 89 -6.196 2.906 -15.485 1.00 10.00 C ATOM 1370 CG PHE A 89 -6.476 4.267 -14.872 1.00 10.00 C ATOM 1371 CD1 PHE A 89 -6.778 5.383 -15.678 1.00 10.00 C ATOM 1372 CD2 PHE A 89 -6.293 4.445 -13.486 1.00 10.00 C ATOM 1373 CE1 PHE A 89 -6.907 6.659 -15.101 1.00 10.00 C ATOM 1374 CE2 PHE A 89 -6.419 5.720 -12.910 1.00 10.00 C ATOM 1375 CZ PHE A 89 -6.721 6.828 -13.720 1.00 10.00 C ATOM 0 H PHE A 89 -8.233 0.872 -15.685 1.00 10.00 H new ATOM 0 HA PHE A 89 -7.467 3.177 -17.269 1.00 10.00 H new ATOM 0 HB2 PHE A 89 -6.209 2.172 -14.679 1.00 10.00 H new ATOM 0 HB3 PHE A 89 -5.181 2.926 -15.882 1.00 10.00 H new ATOM 0 HD1 PHE A 89 -6.911 5.258 -16.742 1.00 10.00 H new ATOM 0 HD2 PHE A 89 -6.054 3.596 -12.863 1.00 10.00 H new ATOM 0 HE1 PHE A 89 -7.149 7.510 -15.721 1.00 10.00 H new ATOM 0 HE2 PHE A 89 -6.284 5.849 -11.846 1.00 10.00 H new ATOM 0 HZ PHE A 89 -6.810 7.810 -13.280 1.00 10.00 H new ATOM 1385 N ARG A 90 -6.421 0.076 -17.249 1.00 10.00 N ATOM 1386 CA ARG A 90 -5.546 -0.930 -17.891 1.00 10.00 C ATOM 1387 C ARG A 90 -6.277 -1.969 -18.745 1.00 10.00 C ATOM 1388 O ARG A 90 -5.610 -2.714 -19.461 1.00 10.00 O ATOM 1389 CB ARG A 90 -4.669 -1.607 -16.824 1.00 10.00 C ATOM 1390 CG ARG A 90 -3.557 -0.687 -16.297 1.00 10.00 C ATOM 1391 CD ARG A 90 -2.435 -0.405 -17.308 1.00 10.00 C ATOM 1392 NE ARG A 90 -1.676 -1.627 -17.637 1.00 10.00 N ATOM 1393 CZ ARG A 90 -0.597 -1.706 -18.405 1.00 10.00 C ATOM 1394 NH1 ARG A 90 -0.098 -0.655 -19.013 1.00 10.00 N ATOM 1395 NH2 ARG A 90 0.009 -2.859 -18.572 1.00 10.00 N ATOM 0 H ARG A 90 -7.124 -0.330 -16.631 1.00 10.00 H new ATOM 0 HA ARG A 90 -4.925 -0.383 -18.600 1.00 10.00 H new ATOM 0 HB2 ARG A 90 -5.297 -1.924 -15.992 1.00 10.00 H new ATOM 0 HB3 ARG A 90 -4.221 -2.507 -17.246 1.00 10.00 H new ATOM 0 HG2 ARG A 90 -4.001 0.261 -15.991 1.00 10.00 H new ATOM 0 HG3 ARG A 90 -3.121 -1.138 -15.405 1.00 10.00 H new ATOM 0 HD2 ARG A 90 -2.863 0.014 -18.219 1.00 10.00 H new ATOM 0 HD3 ARG A 90 -1.758 0.345 -16.900 1.00 10.00 H new ATOM 0 HE ARG A 90 -2.015 -2.500 -17.233 1.00 10.00 H new ATOM 0 HH11 ARG A 90 -0.541 0.257 -18.902 1.00 10.00 H new ATOM 0 HH12 ARG A 90 0.733 -0.750 -19.597 1.00 10.00 H new ATOM 0 HH21 ARG A 90 -0.350 -3.695 -18.111 1.00 10.00 H new ATOM 0 HH22 ARG A 90 0.838 -2.918 -19.163 1.00 10.00 H new ATOM 1409 N GLU A 91 -7.608 -1.960 -18.719 1.00 10.00 N ATOM 1410 CA GLU A 91 -8.500 -2.714 -19.615 1.00 10.00 C ATOM 1411 C GLU A 91 -9.681 -1.834 -20.060 1.00 10.00 C ATOM 1412 O GLU A 91 -9.922 -0.802 -19.390 1.00 10.00 O ATOM 1413 CB GLU A 91 -8.978 -4.020 -18.947 1.00 10.00 C ATOM 1414 CG GLU A 91 -7.838 -5.038 -18.759 1.00 10.00 C ATOM 1415 CD GLU A 91 -8.349 -6.413 -18.304 1.00 10.00 C ATOM 1416 OE1 GLU A 91 -8.785 -7.193 -19.183 1.00 10.00 O ATOM 1417 OE2 GLU A 91 -8.271 -6.690 -17.085 1.00 10.00 O ATOM 1418 OXT GLU A 91 -10.275 -2.175 -21.106 1.00 10.00 O ATOM 0 H GLU A 91 -8.125 -1.401 -18.041 1.00 10.00 H new ATOM 0 HA GLU A 91 -7.941 -2.996 -20.507 1.00 10.00 H new ATOM 0 HB2 GLU A 91 -9.417 -3.788 -17.977 1.00 10.00 H new ATOM 0 HB3 GLU A 91 -9.764 -4.468 -19.554 1.00 10.00 H new ATOM 0 HG2 GLU A 91 -7.294 -5.148 -19.697 1.00 10.00 H new ATOM 0 HG3 GLU A 91 -7.130 -4.655 -18.024 1.00 10.00 H new TER 1425 GLU A 91