USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 753 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 67 MET CE :methyl -121:sc= -2.27! (180deg=-3.38) USER MOD Set 1.2: A 70 SER OG : rot -90:sc= 0.83 USER MOD Set 2.1: A 3 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc=-0.000595 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 33:sc= 0.759 USER MOD Single : A -6 GLY N :NH3+ -129:sc= 0.0791 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -2.54! C(o=-2.5!,f=-4.8!) USER MOD Single : A 33 THR OG1 : rot 130:sc= 0.0789 USER MOD Single : A 36 GLN : amide:sc= -2.93 K(o=-2.9,f=-1.5) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -140:sc= -0.813 USER MOD Single : A 45 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.46) USER MOD Single : A 46 HIS : no HD1:sc= -1.6! C(o=-1.6!,f=-7.1!) USER MOD Single : A 66 ASN : amide:sc= 0.466 X(o=0.47,f=0) USER MOD Single : A 68 ASN : amide:sc= -1.22 K(o=-1.2,f=-0.46) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.487 X(o=-0.49,f=-0.37) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 126:sc= -0.0388 (180deg=-1.14) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0.00442 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -21.416 -22.011 18.184 1.00 0.00 N ATOM 2 CA GLY A -6 -20.994 -20.784 18.833 1.00 0.00 C ATOM 3 C GLY A -6 -20.874 -19.626 17.862 1.00 0.00 C ATOM 4 O GLY A -6 -21.190 -19.763 16.680 1.00 0.00 O ATOM 0 H1 GLY A -6 -22.224 -22.416 18.699 1.00 0.00 H new ATOM 0 H2 GLY A -6 -21.697 -21.806 17.204 1.00 0.00 H new ATOM 0 H3 GLY A -6 -20.630 -22.692 18.184 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -21.708 -20.526 19.615 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -20.033 -20.946 19.320 1.00 0.00 H new ATOM 8 N SER A -5 -20.419 -18.481 18.361 1.00 0.00 N ATOM 9 CA SER A -5 -20.263 -17.293 17.531 1.00 0.00 C ATOM 10 C SER A -5 -19.296 -16.304 18.173 1.00 0.00 C ATOM 11 O SER A -5 -19.559 -15.772 19.251 1.00 0.00 O ATOM 12 CB SER A -5 -21.620 -16.623 17.304 1.00 0.00 C ATOM 13 OG SER A -5 -22.155 -16.131 18.520 1.00 0.00 O ATOM 0 H SER A -5 -20.152 -18.351 19.337 1.00 0.00 H new ATOM 0 HA SER A -5 -19.853 -17.603 16.570 1.00 0.00 H new ATOM 0 HB2 SER A -5 -21.510 -15.804 16.593 1.00 0.00 H new ATOM 0 HB3 SER A -5 -22.313 -17.338 16.861 1.00 0.00 H new ATOM 0 HG SER A -5 -21.424 -15.840 19.105 1.00 0.00 H new ATOM 19 N SER A -4 -18.174 -16.063 17.502 1.00 0.00 N ATOM 20 CA SER A -4 -17.164 -15.141 18.008 1.00 0.00 C ATOM 21 C SER A -4 -17.656 -13.699 17.929 1.00 0.00 C ATOM 22 O SER A -4 -17.690 -12.987 18.932 1.00 0.00 O ATOM 23 CB SER A -4 -15.863 -15.292 17.218 1.00 0.00 C ATOM 24 OG SER A -4 -15.141 -16.437 17.637 1.00 0.00 O ATOM 0 H SER A -4 -17.942 -16.493 16.607 1.00 0.00 H new ATOM 0 HA SER A -4 -16.976 -15.386 19.053 1.00 0.00 H new ATOM 0 HB2 SER A -4 -16.087 -15.369 16.154 1.00 0.00 H new ATOM 0 HB3 SER A -4 -15.248 -14.402 17.351 1.00 0.00 H new ATOM 0 HG SER A -4 -14.315 -16.512 17.115 1.00 0.00 H new ATOM 30 N GLY A -3 -18.036 -13.275 16.728 1.00 0.00 N ATOM 31 CA GLY A -3 -18.522 -11.921 16.538 1.00 0.00 C ATOM 32 C GLY A -3 -20.009 -11.795 16.804 1.00 0.00 C ATOM 33 O GLY A -3 -20.828 -12.070 15.928 1.00 0.00 O ATOM 0 H GLY A -3 -18.016 -13.845 15.883 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -17.979 -11.247 17.201 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -18.311 -11.602 15.517 1.00 0.00 H new ATOM 37 N SER A -2 -20.358 -11.379 18.017 1.00 0.00 N ATOM 38 CA SER A -2 -21.757 -11.223 18.398 1.00 0.00 C ATOM 39 C SER A -2 -22.307 -9.887 17.909 1.00 0.00 C ATOM 40 O SER A -2 -23.254 -9.843 17.124 1.00 0.00 O ATOM 41 CB SER A -2 -21.908 -11.324 19.917 1.00 0.00 C ATOM 42 OG SER A -2 -21.455 -12.580 20.392 1.00 0.00 O ATOM 0 H SER A -2 -19.692 -11.144 18.753 1.00 0.00 H new ATOM 0 HA SER A -2 -22.327 -12.025 17.929 1.00 0.00 H new ATOM 0 HB2 SER A -2 -21.342 -10.525 20.396 1.00 0.00 H new ATOM 0 HB3 SER A -2 -22.953 -11.183 20.192 1.00 0.00 H new ATOM 0 HG SER A -2 -21.560 -12.619 21.366 1.00 0.00 H new ATOM 48 N SER A -1 -21.706 -8.799 18.380 1.00 0.00 N ATOM 49 CA SER A -1 -22.138 -7.460 17.994 1.00 0.00 C ATOM 50 C SER A -1 -20.953 -6.499 17.951 1.00 0.00 C ATOM 51 O SER A -1 -19.857 -6.827 18.402 1.00 0.00 O ATOM 52 CB SER A -1 -23.194 -6.941 18.971 1.00 0.00 C ATOM 53 OG SER A -1 -24.306 -7.817 19.032 1.00 0.00 O ATOM 0 H SER A -1 -20.919 -8.818 19.029 1.00 0.00 H new ATOM 0 HA SER A -1 -22.573 -7.518 16.996 1.00 0.00 H new ATOM 0 HB2 SER A -1 -22.755 -6.835 19.963 1.00 0.00 H new ATOM 0 HB3 SER A -1 -23.525 -5.950 18.661 1.00 0.00 H new ATOM 0 HG SER A -1 -24.966 -7.464 19.664 1.00 0.00 H new ATOM 59 N GLY A 0 -21.184 -5.310 17.403 1.00 0.00 N ATOM 60 CA GLY A 0 -20.128 -4.319 17.309 1.00 0.00 C ATOM 61 C GLY A 0 -20.619 -2.999 16.748 1.00 0.00 C ATOM 62 O GLY A 0 -21.255 -2.964 15.695 1.00 0.00 O ATOM 0 H GLY A 0 -22.083 -5.015 17.023 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -19.701 -4.153 18.298 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -19.328 -4.704 16.676 1.00 0.00 H new ATOM 66 N MET A 1 -20.325 -1.912 17.452 1.00 0.00 N ATOM 67 CA MET A 1 -20.741 -0.584 17.017 1.00 0.00 C ATOM 68 C MET A 1 -19.719 0.020 16.059 1.00 0.00 C ATOM 69 O MET A 1 -18.513 -0.089 16.275 1.00 0.00 O ATOM 70 CB MET A 1 -20.931 0.336 18.225 1.00 0.00 C ATOM 71 CG MET A 1 -19.624 0.826 18.827 1.00 0.00 C ATOM 72 SD MET A 1 -19.875 2.043 20.133 1.00 0.00 S ATOM 73 CE MET A 1 -19.889 3.562 19.183 1.00 0.00 C ATOM 0 H MET A 1 -19.800 -1.924 18.327 1.00 0.00 H new ATOM 0 HA MET A 1 -21.691 -0.683 16.492 1.00 0.00 H new ATOM 0 HB2 MET A 1 -21.529 1.197 17.925 1.00 0.00 H new ATOM 0 HB3 MET A 1 -21.498 -0.195 18.990 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.072 -0.024 19.229 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.008 1.263 18.041 1.00 0.00 H new ATOM 0 HE1 MET A 1 -20.036 4.409 19.853 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.939 3.673 18.661 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.701 3.529 18.456 1.00 0.00 H new ATOM 83 N ALA A 2 -20.211 0.657 15.001 1.00 0.00 N ATOM 84 CA ALA A 2 -19.340 1.279 14.012 1.00 0.00 C ATOM 85 C ALA A 2 -20.040 2.443 13.319 1.00 0.00 C ATOM 86 O ALA A 2 -21.252 2.618 13.447 1.00 0.00 O ATOM 87 CB ALA A 2 -18.885 0.250 12.988 1.00 0.00 C ATOM 0 H ALA A 2 -21.208 0.756 14.807 1.00 0.00 H new ATOM 0 HA ALA A 2 -18.465 1.671 14.530 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -18.235 0.729 12.255 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.339 -0.548 13.492 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -19.755 -0.169 12.482 1.00 0.00 H new ATOM 93 N THR A 3 -19.269 3.240 12.585 1.00 0.00 N ATOM 94 CA THR A 3 -19.814 4.389 11.874 1.00 0.00 C ATOM 95 C THR A 3 -19.814 4.154 10.368 1.00 0.00 C ATOM 96 O THR A 3 -20.811 4.402 9.689 1.00 0.00 O ATOM 97 CB THR A 3 -19.018 5.671 12.183 1.00 0.00 C ATOM 98 OG1 THR A 3 -17.622 5.445 11.961 1.00 0.00 O ATOM 99 CG2 THR A 3 -19.244 6.115 13.620 1.00 0.00 C ATOM 0 H THR A 3 -18.264 3.110 12.468 1.00 0.00 H new ATOM 0 HA THR A 3 -20.840 4.516 12.219 1.00 0.00 H new ATOM 0 HB THR A 3 -19.368 6.460 11.517 1.00 0.00 H new ATOM 0 HG1 THR A 3 -17.123 6.265 12.158 1.00 0.00 H new ATOM 0 HG21 THR A 3 -18.672 7.022 13.815 1.00 0.00 H new ATOM 0 HG22 THR A 3 -20.304 6.314 13.777 1.00 0.00 H new ATOM 0 HG23 THR A 3 -18.918 5.328 14.300 1.00 0.00 H new ATOM 107 N THR A 4 -18.688 3.675 9.849 1.00 0.00 N ATOM 108 CA THR A 4 -18.557 3.407 8.422 1.00 0.00 C ATOM 109 C THR A 4 -18.584 1.909 8.139 1.00 0.00 C ATOM 110 O THR A 4 -17.988 1.118 8.870 1.00 0.00 O ATOM 111 CB THR A 4 -17.254 4.002 7.856 1.00 0.00 C ATOM 112 OG1 THR A 4 -16.906 5.191 8.573 1.00 0.00 O ATOM 113 CG2 THR A 4 -17.403 4.321 6.376 1.00 0.00 C ATOM 0 H THR A 4 -17.853 3.465 10.396 1.00 0.00 H new ATOM 0 HA THR A 4 -19.407 3.882 7.932 1.00 0.00 H new ATOM 0 HB THR A 4 -16.462 3.263 7.974 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.076 5.562 8.208 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.470 4.740 5.998 1.00 0.00 H new ATOM 0 HG22 THR A 4 -17.638 3.408 5.829 1.00 0.00 H new ATOM 0 HG23 THR A 4 -18.207 5.044 6.239 1.00 0.00 H new ATOM 121 N LYS A 5 -19.278 1.525 7.073 1.00 0.00 N ATOM 122 CA LYS A 5 -19.381 0.122 6.691 1.00 0.00 C ATOM 123 C LYS A 5 -18.889 -0.091 5.263 1.00 0.00 C ATOM 124 O LYS A 5 -18.470 -1.189 4.897 1.00 0.00 O ATOM 125 CB LYS A 5 -20.828 -0.358 6.820 1.00 0.00 C ATOM 126 CG LYS A 5 -21.167 -0.905 8.196 1.00 0.00 C ATOM 127 CD LYS A 5 -20.889 -2.396 8.287 1.00 0.00 C ATOM 128 CE LYS A 5 -21.958 -3.207 7.570 1.00 0.00 C ATOM 129 NZ LYS A 5 -21.632 -4.660 7.550 1.00 0.00 N ATOM 0 H LYS A 5 -19.778 2.167 6.458 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.750 -0.459 7.364 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -21.499 0.471 6.592 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -21.013 -1.132 6.075 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -20.584 -0.378 8.952 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -22.218 -0.716 8.415 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -19.913 -2.613 7.852 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -20.845 -2.696 9.334 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -22.919 -3.057 8.063 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -22.064 -2.845 6.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -22.384 -5.178 7.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -20.728 -4.806 7.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -21.556 -5.012 8.526 1.00 0.00 H new ATOM 143 N ARG A 6 -18.941 0.967 4.460 1.00 0.00 N ATOM 144 CA ARG A 6 -18.501 0.896 3.072 1.00 0.00 C ATOM 145 C ARG A 6 -16.978 0.886 2.985 1.00 0.00 C ATOM 146 O ARG A 6 -16.389 0.036 2.316 1.00 0.00 O ATOM 147 CB ARG A 6 -19.060 2.076 2.276 1.00 0.00 C ATOM 148 CG ARG A 6 -20.576 2.075 2.169 1.00 0.00 C ATOM 149 CD ARG A 6 -21.120 3.478 1.947 1.00 0.00 C ATOM 150 NE ARG A 6 -22.403 3.463 1.249 1.00 0.00 N ATOM 151 CZ ARG A 6 -22.940 4.534 0.676 1.00 0.00 C ATOM 152 NH1 ARG A 6 -22.308 5.699 0.716 1.00 0.00 N ATOM 153 NH2 ARG A 6 -24.112 4.441 0.059 1.00 0.00 N ATOM 0 H ARG A 6 -19.284 1.884 4.747 1.00 0.00 H new ATOM 0 HA ARG A 6 -18.879 -0.033 2.645 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -18.738 3.005 2.746 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -18.633 2.061 1.273 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -20.883 1.430 1.346 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -21.006 1.657 3.079 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -21.236 3.978 2.908 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -20.400 4.059 1.370 1.00 0.00 H new ATOM 0 HE ARG A 6 -22.914 2.582 1.199 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -21.407 5.774 1.188 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -22.723 6.520 0.275 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -24.601 3.546 0.025 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -24.524 5.264 -0.381 1.00 0.00 H new ATOM 167 N VAL A 7 -16.345 1.837 3.664 1.00 0.00 N ATOM 168 CA VAL A 7 -14.890 1.938 3.664 1.00 0.00 C ATOM 169 C VAL A 7 -14.266 0.875 4.562 1.00 0.00 C ATOM 170 O VAL A 7 -14.541 0.819 5.761 1.00 0.00 O ATOM 171 CB VAL A 7 -14.424 3.329 4.134 1.00 0.00 C ATOM 172 CG1 VAL A 7 -12.935 3.508 3.878 1.00 0.00 C ATOM 173 CG2 VAL A 7 -15.227 4.420 3.443 1.00 0.00 C ATOM 0 H VAL A 7 -16.817 2.549 4.221 1.00 0.00 H new ATOM 0 HA VAL A 7 -14.561 1.781 2.637 1.00 0.00 H new ATOM 0 HB VAL A 7 -14.595 3.408 5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.624 4.496 4.216 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.378 2.746 4.423 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.735 3.410 2.811 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -14.885 5.396 3.786 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -15.089 4.346 2.364 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -16.284 4.301 3.682 1.00 0.00 H new ATOM 183 N LEU A 8 -13.424 0.033 3.973 1.00 0.00 N ATOM 184 CA LEU A 8 -12.758 -1.030 4.720 1.00 0.00 C ATOM 185 C LEU A 8 -11.315 -0.650 5.038 1.00 0.00 C ATOM 186 O LEU A 8 -10.716 0.181 4.355 1.00 0.00 O ATOM 187 CB LEU A 8 -12.791 -2.336 3.924 1.00 0.00 C ATOM 188 CG LEU A 8 -14.133 -2.702 3.289 1.00 0.00 C ATOM 189 CD1 LEU A 8 -13.989 -3.935 2.410 1.00 0.00 C ATOM 190 CD2 LEU A 8 -15.186 -2.930 4.363 1.00 0.00 C ATOM 0 H LEU A 8 -13.186 0.065 2.982 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.292 -1.171 5.660 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.043 -2.275 3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.491 -3.149 4.585 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.456 -1.871 2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.954 -4.180 1.967 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.266 -3.735 1.619 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.643 -4.774 3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -16.135 -3.189 3.893 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.870 -3.744 5.016 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.309 -2.020 4.951 1.00 0.00 H new ATOM 202 N TYR A 9 -10.763 -1.266 6.077 1.00 0.00 N ATOM 203 CA TYR A 9 -9.390 -0.993 6.486 1.00 0.00 C ATOM 204 C TYR A 9 -8.496 -2.203 6.233 1.00 0.00 C ATOM 205 O TYR A 9 -8.909 -3.346 6.426 1.00 0.00 O ATOM 206 CB TYR A 9 -9.343 -0.610 7.966 1.00 0.00 C ATOM 207 CG TYR A 9 -8.056 -1.005 8.653 1.00 0.00 C ATOM 208 CD1 TYR A 9 -7.804 -2.329 8.992 1.00 0.00 C ATOM 209 CD2 TYR A 9 -7.091 -0.055 8.963 1.00 0.00 C ATOM 210 CE1 TYR A 9 -6.630 -2.695 9.621 1.00 0.00 C ATOM 211 CE2 TYR A 9 -5.913 -0.412 9.590 1.00 0.00 C ATOM 212 CZ TYR A 9 -5.687 -1.732 9.918 1.00 0.00 C ATOM 213 OH TYR A 9 -4.515 -2.093 10.543 1.00 0.00 O ATOM 0 H TYR A 9 -11.245 -1.958 6.651 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.019 -0.159 5.890 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -9.478 0.468 8.058 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.180 -1.082 8.481 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.539 -3.085 8.759 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.265 0.980 8.709 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.451 -3.728 9.879 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.173 0.339 9.822 1.00 0.00 H new ATOM 0 HH TYR A 9 -3.959 -1.298 10.680 1.00 0.00 H new ATOM 223 N VAL A 10 -7.266 -1.942 5.802 1.00 0.00 N ATOM 224 CA VAL A 10 -6.311 -3.008 5.525 1.00 0.00 C ATOM 225 C VAL A 10 -4.972 -2.736 6.202 1.00 0.00 C ATOM 226 O VAL A 10 -4.445 -1.626 6.136 1.00 0.00 O ATOM 227 CB VAL A 10 -6.083 -3.177 4.011 1.00 0.00 C ATOM 228 CG1 VAL A 10 -5.076 -4.286 3.743 1.00 0.00 C ATOM 229 CG2 VAL A 10 -7.399 -3.459 3.303 1.00 0.00 C ATOM 0 H VAL A 10 -6.908 -1.001 5.637 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.737 -3.927 5.926 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.676 -2.246 3.616 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.928 -4.391 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.127 -4.038 4.218 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.451 -5.225 4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.219 -3.576 2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.836 -4.375 3.700 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.086 -2.629 3.467 1.00 0.00 H new ATOM 239 N GLY A 11 -4.426 -3.758 6.853 1.00 0.00 N ATOM 240 CA GLY A 11 -3.152 -3.610 7.533 1.00 0.00 C ATOM 241 C GLY A 11 -2.195 -4.744 7.225 1.00 0.00 C ATOM 242 O GLY A 11 -2.583 -5.749 6.632 1.00 0.00 O ATOM 0 H GLY A 11 -4.843 -4.686 6.922 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.696 -2.664 7.241 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.321 -3.564 8.609 1.00 0.00 H new ATOM 246 N GLY A 12 -0.938 -4.582 7.629 1.00 0.00 N ATOM 247 CA GLY A 12 0.058 -5.608 7.383 1.00 0.00 C ATOM 248 C GLY A 12 0.394 -5.748 5.911 1.00 0.00 C ATOM 249 O GLY A 12 0.586 -6.859 5.414 1.00 0.00 O ATOM 0 H GLY A 12 -0.592 -3.759 8.122 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.965 -5.370 7.939 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.307 -6.563 7.762 1.00 0.00 H new ATOM 253 N LEU A 13 0.464 -4.621 5.212 1.00 0.00 N ATOM 254 CA LEU A 13 0.778 -4.623 3.787 1.00 0.00 C ATOM 255 C LEU A 13 2.280 -4.484 3.560 1.00 0.00 C ATOM 256 O LEU A 13 3.007 -4.005 4.429 1.00 0.00 O ATOM 257 CB LEU A 13 0.036 -3.487 3.081 1.00 0.00 C ATOM 258 CG LEU A 13 -1.482 -3.639 2.976 1.00 0.00 C ATOM 259 CD1 LEU A 13 -2.107 -2.373 2.411 1.00 0.00 C ATOM 260 CD2 LEU A 13 -1.839 -4.842 2.117 1.00 0.00 C ATOM 0 H LEU A 13 0.308 -3.694 5.608 1.00 0.00 H new ATOM 0 HA LEU A 13 0.454 -5.576 3.369 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.252 -2.557 3.607 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.441 -3.386 2.074 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.882 -3.801 3.977 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.188 -2.500 2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.880 -1.532 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.702 -2.179 1.418 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.923 -4.935 2.053 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.427 -4.710 1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.423 -5.745 2.564 1.00 0.00 H new ATOM 272 N ALA A 14 2.737 -4.904 2.385 1.00 0.00 N ATOM 273 CA ALA A 14 4.151 -4.823 2.042 1.00 0.00 C ATOM 274 C ALA A 14 4.528 -3.413 1.601 1.00 0.00 C ATOM 275 O ALA A 14 3.689 -2.513 1.581 1.00 0.00 O ATOM 276 CB ALA A 14 4.488 -5.827 0.950 1.00 0.00 C ATOM 0 H ALA A 14 2.148 -5.304 1.654 1.00 0.00 H new ATOM 0 HA ALA A 14 4.730 -5.065 2.933 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.547 -5.755 0.704 1.00 0.00 H new ATOM 0 HB2 ALA A 14 4.264 -6.835 1.301 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.894 -5.612 0.062 1.00 0.00 H new ATOM 282 N GLU A 15 5.797 -3.227 1.250 1.00 0.00 N ATOM 283 CA GLU A 15 6.285 -1.925 0.811 1.00 0.00 C ATOM 284 C GLU A 15 6.031 -1.723 -0.680 1.00 0.00 C ATOM 285 O GLU A 15 6.222 -0.629 -1.210 1.00 0.00 O ATOM 286 CB GLU A 15 7.780 -1.789 1.108 1.00 0.00 C ATOM 287 CG GLU A 15 8.638 -2.823 0.400 1.00 0.00 C ATOM 288 CD GLU A 15 8.746 -4.121 1.176 1.00 0.00 C ATOM 289 OE1 GLU A 15 9.627 -4.215 2.056 1.00 0.00 O ATOM 290 OE2 GLU A 15 7.950 -5.044 0.902 1.00 0.00 O ATOM 0 H GLU A 15 6.505 -3.961 1.261 1.00 0.00 H new ATOM 0 HA GLU A 15 5.741 -1.157 1.362 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.111 -0.793 0.815 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.937 -1.874 2.183 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.217 -3.027 -0.585 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.636 -2.415 0.242 1.00 0.00 H new ATOM 297 N GLU A 16 5.600 -2.787 -1.351 1.00 0.00 N ATOM 298 CA GLU A 16 5.321 -2.727 -2.781 1.00 0.00 C ATOM 299 C GLU A 16 3.830 -2.525 -3.037 1.00 0.00 C ATOM 300 O GLU A 16 3.422 -2.159 -4.139 1.00 0.00 O ATOM 301 CB GLU A 16 5.800 -4.006 -3.470 1.00 0.00 C ATOM 302 CG GLU A 16 7.260 -3.963 -3.887 1.00 0.00 C ATOM 303 CD GLU A 16 7.656 -5.148 -4.747 1.00 0.00 C ATOM 304 OE1 GLU A 16 7.728 -6.273 -4.210 1.00 0.00 O ATOM 305 OE2 GLU A 16 7.894 -4.949 -5.956 1.00 0.00 O ATOM 0 H GLU A 16 5.437 -3.700 -0.927 1.00 0.00 H new ATOM 0 HA GLU A 16 5.861 -1.876 -3.195 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.648 -4.850 -2.797 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.184 -4.186 -4.351 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.450 -3.041 -4.436 1.00 0.00 H new ATOM 0 HG3 GLU A 16 7.888 -3.939 -2.996 1.00 0.00 H new ATOM 312 N VAL A 17 3.022 -2.766 -2.010 1.00 0.00 N ATOM 313 CA VAL A 17 1.576 -2.611 -2.122 1.00 0.00 C ATOM 314 C VAL A 17 1.181 -1.138 -2.131 1.00 0.00 C ATOM 315 O VAL A 17 1.715 -0.337 -1.364 1.00 0.00 O ATOM 316 CB VAL A 17 0.844 -3.320 -0.968 1.00 0.00 C ATOM 317 CG1 VAL A 17 -0.649 -3.035 -1.026 1.00 0.00 C ATOM 318 CG2 VAL A 17 1.111 -4.818 -1.009 1.00 0.00 C ATOM 0 H VAL A 17 3.344 -3.069 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 17 1.281 -3.070 -3.066 1.00 0.00 H new ATOM 0 HB VAL A 17 1.227 -2.931 -0.025 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.149 -3.545 -0.202 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.818 -1.961 -0.944 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.052 -3.395 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.586 -5.304 -0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.757 -5.225 -1.956 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.182 -5.000 -0.914 1.00 0.00 H new ATOM 328 N ASP A 18 0.242 -0.789 -3.004 1.00 0.00 N ATOM 329 CA ASP A 18 -0.227 0.587 -3.113 1.00 0.00 C ATOM 330 C ASP A 18 -1.658 0.634 -3.638 1.00 0.00 C ATOM 331 O ASP A 18 -2.287 -0.403 -3.849 1.00 0.00 O ATOM 332 CB ASP A 18 0.694 1.391 -4.032 1.00 0.00 C ATOM 333 CG ASP A 18 1.226 0.564 -5.186 1.00 0.00 C ATOM 334 OD1 ASP A 18 2.029 -0.359 -4.934 1.00 0.00 O ATOM 335 OD2 ASP A 18 0.839 0.839 -6.341 1.00 0.00 O ATOM 0 H ASP A 18 -0.209 -1.440 -3.646 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.210 1.030 -2.117 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.150 2.250 -4.425 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.531 1.781 -3.452 1.00 0.00 H new ATOM 340 N ASP A 19 -2.167 1.843 -3.846 1.00 0.00 N ATOM 341 CA ASP A 19 -3.525 2.025 -4.347 1.00 0.00 C ATOM 342 C ASP A 19 -3.783 1.130 -5.554 1.00 0.00 C ATOM 343 O ASP A 19 -4.893 0.632 -5.745 1.00 0.00 O ATOM 344 CB ASP A 19 -3.761 3.489 -4.722 1.00 0.00 C ATOM 345 CG ASP A 19 -2.812 3.970 -5.802 1.00 0.00 C ATOM 346 OD1 ASP A 19 -1.586 3.960 -5.562 1.00 0.00 O ATOM 347 OD2 ASP A 19 -3.295 4.356 -6.887 1.00 0.00 O ATOM 0 H ASP A 19 -1.660 2.712 -3.676 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.219 1.745 -3.555 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -4.789 3.612 -5.064 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.643 4.112 -3.835 1.00 0.00 H new ATOM 352 N LYS A 20 -2.752 0.929 -6.367 1.00 0.00 N ATOM 353 CA LYS A 20 -2.866 0.094 -7.557 1.00 0.00 C ATOM 354 C LYS A 20 -3.073 -1.369 -7.177 1.00 0.00 C ATOM 355 O LYS A 20 -4.048 -1.996 -7.591 1.00 0.00 O ATOM 356 CB LYS A 20 -1.614 0.234 -8.425 1.00 0.00 C ATOM 357 CG LYS A 20 -1.405 1.636 -8.970 1.00 0.00 C ATOM 358 CD LYS A 20 -0.018 1.802 -9.568 1.00 0.00 C ATOM 359 CE LYS A 20 0.149 0.965 -10.828 1.00 0.00 C ATOM 360 NZ LYS A 20 1.560 0.953 -11.302 1.00 0.00 N ATOM 0 H LYS A 20 -1.827 1.333 -6.223 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.734 0.430 -8.125 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.741 -0.052 -7.838 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.680 -0.465 -9.259 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.157 1.848 -9.730 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.547 2.363 -8.170 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.155 2.852 -9.802 1.00 0.00 H new ATOM 0 HD3 LYS A 20 0.733 1.511 -8.834 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.177 -0.056 -10.631 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.495 1.359 -11.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.632 0.372 -12.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.863 1.925 -11.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.171 0.553 -10.562 1.00 0.00 H new ATOM 374 N VAL A 21 -2.150 -1.906 -6.384 1.00 0.00 N ATOM 375 CA VAL A 21 -2.233 -3.294 -5.946 1.00 0.00 C ATOM 376 C VAL A 21 -3.530 -3.554 -5.189 1.00 0.00 C ATOM 377 O VAL A 21 -4.191 -4.572 -5.399 1.00 0.00 O ATOM 378 CB VAL A 21 -1.041 -3.671 -5.046 1.00 0.00 C ATOM 379 CG1 VAL A 21 -1.087 -5.149 -4.690 1.00 0.00 C ATOM 380 CG2 VAL A 21 0.272 -3.318 -5.728 1.00 0.00 C ATOM 0 H VAL A 21 -1.337 -1.401 -6.032 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.210 -3.912 -6.844 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.109 -3.098 -4.121 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.237 -5.397 -4.054 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -2.014 -5.367 -4.159 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.043 -5.744 -5.602 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.104 -3.591 -5.079 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.352 -3.863 -6.668 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.303 -2.247 -5.926 1.00 0.00 H new ATOM 390 N LEU A 22 -3.890 -2.628 -4.307 1.00 0.00 N ATOM 391 CA LEU A 22 -5.110 -2.757 -3.517 1.00 0.00 C ATOM 392 C LEU A 22 -6.346 -2.643 -4.402 1.00 0.00 C ATOM 393 O LEU A 22 -7.398 -3.204 -4.093 1.00 0.00 O ATOM 394 CB LEU A 22 -5.149 -1.685 -2.426 1.00 0.00 C ATOM 395 CG LEU A 22 -4.265 -1.938 -1.204 1.00 0.00 C ATOM 396 CD1 LEU A 22 -4.257 -0.722 -0.290 1.00 0.00 C ATOM 397 CD2 LEU A 22 -4.737 -3.172 -0.450 1.00 0.00 C ATOM 0 H LEU A 22 -3.355 -1.780 -4.121 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.110 -3.742 -3.051 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.857 -0.733 -2.870 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.180 -1.577 -2.088 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.246 -2.115 -1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.623 -0.920 0.574 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.870 0.140 -0.834 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.273 -0.513 0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.096 -3.336 0.416 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.765 -3.025 -0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.689 -4.040 -1.107 1.00 0.00 H new ATOM 409 N HIS A 23 -6.213 -1.915 -5.506 1.00 0.00 N ATOM 410 CA HIS A 23 -7.319 -1.730 -6.439 1.00 0.00 C ATOM 411 C HIS A 23 -7.558 -2.997 -7.256 1.00 0.00 C ATOM 412 O HIS A 23 -8.681 -3.494 -7.333 1.00 0.00 O ATOM 413 CB HIS A 23 -7.036 -0.553 -7.372 1.00 0.00 C ATOM 414 CG HIS A 23 -7.853 -0.573 -8.627 1.00 0.00 C ATOM 415 ND1 HIS A 23 -7.684 -1.513 -9.621 1.00 0.00 N ATOM 416 CD2 HIS A 23 -8.852 0.239 -9.045 1.00 0.00 C ATOM 417 CE1 HIS A 23 -8.541 -1.278 -10.597 1.00 0.00 C ATOM 418 NE2 HIS A 23 -9.263 -0.221 -10.273 1.00 0.00 N ATOM 0 H HIS A 23 -5.350 -1.443 -5.777 1.00 0.00 H new ATOM 0 HA HIS A 23 -8.218 -1.517 -5.861 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -7.228 0.378 -6.838 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.979 -0.556 -7.637 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -9.252 1.090 -8.513 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -8.636 -1.853 -11.506 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -10.005 0.187 -10.842 1.00 0.00 H new ATOM 426 N ALA A 24 -6.495 -3.511 -7.865 1.00 0.00 N ATOM 427 CA ALA A 24 -6.589 -4.719 -8.675 1.00 0.00 C ATOM 428 C ALA A 24 -6.752 -5.957 -7.799 1.00 0.00 C ATOM 429 O ALA A 24 -7.214 -6.999 -8.260 1.00 0.00 O ATOM 430 CB ALA A 24 -5.360 -4.857 -9.562 1.00 0.00 C ATOM 0 H ALA A 24 -5.559 -3.110 -7.813 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.473 -4.634 -9.307 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.444 -5.764 -10.161 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.288 -3.992 -10.221 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.467 -4.915 -8.940 1.00 0.00 H new ATOM 436 N ALA A 25 -6.368 -5.834 -6.532 1.00 0.00 N ATOM 437 CA ALA A 25 -6.474 -6.942 -5.591 1.00 0.00 C ATOM 438 C ALA A 25 -7.878 -7.031 -5.003 1.00 0.00 C ATOM 439 O ALA A 25 -8.261 -8.056 -4.438 1.00 0.00 O ATOM 440 CB ALA A 25 -5.443 -6.792 -4.482 1.00 0.00 C ATOM 0 H ALA A 25 -5.981 -4.978 -6.134 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.277 -7.867 -6.133 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.533 -7.626 -3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.442 -6.786 -4.914 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.614 -5.856 -3.950 1.00 0.00 H new ATOM 446 N PHE A 26 -8.641 -5.952 -5.138 1.00 0.00 N ATOM 447 CA PHE A 26 -10.002 -5.908 -4.619 1.00 0.00 C ATOM 448 C PHE A 26 -11.007 -5.673 -5.743 1.00 0.00 C ATOM 449 O PHE A 26 -12.213 -5.601 -5.507 1.00 0.00 O ATOM 450 CB PHE A 26 -10.133 -4.807 -3.564 1.00 0.00 C ATOM 451 CG PHE A 26 -9.401 -5.108 -2.288 1.00 0.00 C ATOM 452 CD1 PHE A 26 -8.052 -5.425 -2.306 1.00 0.00 C ATOM 453 CD2 PHE A 26 -10.061 -5.076 -1.070 1.00 0.00 C ATOM 454 CE1 PHE A 26 -7.374 -5.703 -1.134 1.00 0.00 C ATOM 455 CE2 PHE A 26 -9.389 -5.353 0.105 1.00 0.00 C ATOM 456 CZ PHE A 26 -8.044 -5.668 0.073 1.00 0.00 C ATOM 0 H PHE A 26 -8.339 -5.096 -5.603 1.00 0.00 H new ATOM 0 HA PHE A 26 -10.219 -6.872 -4.158 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.756 -3.872 -3.978 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -11.189 -4.653 -3.340 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.524 -5.455 -3.248 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -11.113 -4.832 -1.039 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.322 -5.947 -1.162 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.915 -5.323 1.048 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.518 -5.886 0.990 1.00 0.00 H new ATOM 466 N ILE A 27 -10.499 -5.552 -6.965 1.00 0.00 N ATOM 467 CA ILE A 27 -11.351 -5.326 -8.126 1.00 0.00 C ATOM 468 C ILE A 27 -12.352 -6.462 -8.304 1.00 0.00 C ATOM 469 O ILE A 27 -13.470 -6.269 -8.782 1.00 0.00 O ATOM 470 CB ILE A 27 -10.520 -5.183 -9.415 1.00 0.00 C ATOM 471 CG1 ILE A 27 -11.337 -4.476 -10.499 1.00 0.00 C ATOM 472 CG2 ILE A 27 -10.055 -6.548 -9.900 1.00 0.00 C ATOM 473 CD1 ILE A 27 -11.675 -3.041 -10.162 1.00 0.00 C ATOM 0 H ILE A 27 -9.503 -5.607 -7.177 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.890 -4.396 -7.945 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.640 -4.578 -9.197 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.780 -4.499 -11.435 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.261 -5.029 -10.664 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.469 -6.430 -10.812 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.440 -7.017 -9.132 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.922 -7.176 -10.105 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.255 -2.603 -10.975 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.260 -3.011 -9.242 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.755 -2.473 -10.026 1.00 0.00 H new ATOM 485 N PRO A 28 -11.944 -7.677 -7.909 1.00 0.00 N ATOM 486 CA PRO A 28 -12.791 -8.869 -8.012 1.00 0.00 C ATOM 487 C PRO A 28 -14.065 -8.749 -7.183 1.00 0.00 C ATOM 488 O PRO A 28 -15.168 -8.964 -7.686 1.00 0.00 O ATOM 489 CB PRO A 28 -11.900 -9.987 -7.464 1.00 0.00 C ATOM 490 CG PRO A 28 -10.513 -9.454 -7.576 1.00 0.00 C ATOM 491 CD PRO A 28 -10.625 -7.981 -7.330 1.00 0.00 C ATOM 0 HA PRO A 28 -13.132 -9.039 -9.033 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.151 -10.223 -6.430 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.019 -10.906 -8.038 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.853 -9.924 -6.847 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.094 -9.656 -8.562 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.579 -7.739 -6.268 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.826 -7.423 -7.818 1.00 0.00 H new ATOM 499 N PHE A 29 -13.906 -8.403 -5.910 1.00 0.00 N ATOM 500 CA PHE A 29 -15.045 -8.254 -5.010 1.00 0.00 C ATOM 501 C PHE A 29 -16.149 -7.427 -5.663 1.00 0.00 C ATOM 502 O PHE A 29 -17.219 -7.943 -5.982 1.00 0.00 O ATOM 503 CB PHE A 29 -14.605 -7.596 -3.701 1.00 0.00 C ATOM 504 CG PHE A 29 -13.630 -8.423 -2.912 1.00 0.00 C ATOM 505 CD1 PHE A 29 -14.002 -9.654 -2.399 1.00 0.00 C ATOM 506 CD2 PHE A 29 -12.341 -7.968 -2.685 1.00 0.00 C ATOM 507 CE1 PHE A 29 -13.108 -10.418 -1.673 1.00 0.00 C ATOM 508 CE2 PHE A 29 -11.442 -8.727 -1.960 1.00 0.00 C ATOM 509 CZ PHE A 29 -11.826 -9.953 -1.452 1.00 0.00 C ATOM 0 H PHE A 29 -13.000 -8.220 -5.478 1.00 0.00 H new ATOM 0 HA PHE A 29 -15.439 -9.247 -4.794 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.153 -6.630 -3.924 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -15.485 -7.402 -3.087 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.003 -10.022 -2.568 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -12.036 -7.010 -3.079 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -13.411 -11.377 -1.279 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.440 -8.362 -1.791 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.126 -10.547 -0.883 1.00 0.00 H new ATOM 519 N GLY A 30 -15.880 -6.140 -5.857 1.00 0.00 N ATOM 520 CA GLY A 30 -16.859 -5.261 -6.469 1.00 0.00 C ATOM 521 C GLY A 30 -16.219 -4.190 -7.330 1.00 0.00 C ATOM 522 O GLY A 30 -15.177 -4.418 -7.943 1.00 0.00 O ATOM 0 H GLY A 30 -15.001 -5.690 -5.601 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -17.543 -5.852 -7.078 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -17.455 -4.787 -5.689 1.00 0.00 H new ATOM 526 N ASP A 31 -16.845 -3.019 -7.377 1.00 0.00 N ATOM 527 CA ASP A 31 -16.331 -1.909 -8.170 1.00 0.00 C ATOM 528 C ASP A 31 -15.785 -0.805 -7.270 1.00 0.00 C ATOM 529 O ASP A 31 -16.503 0.129 -6.912 1.00 0.00 O ATOM 530 CB ASP A 31 -17.429 -1.349 -9.075 1.00 0.00 C ATOM 531 CG ASP A 31 -16.870 -0.609 -10.274 1.00 0.00 C ATOM 532 OD1 ASP A 31 -15.938 0.202 -10.090 1.00 0.00 O ATOM 533 OD2 ASP A 31 -17.364 -0.840 -11.397 1.00 0.00 O ATOM 0 H ASP A 31 -17.709 -2.814 -6.875 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.517 -2.284 -8.790 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -18.064 -2.166 -9.419 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -18.062 -0.675 -8.498 1.00 0.00 H new ATOM 538 N ILE A 32 -14.512 -0.921 -6.907 1.00 0.00 N ATOM 539 CA ILE A 32 -13.870 0.067 -6.048 1.00 0.00 C ATOM 540 C ILE A 32 -14.153 1.484 -6.535 1.00 0.00 C ATOM 541 O ILE A 32 -13.737 1.873 -7.627 1.00 0.00 O ATOM 542 CB ILE A 32 -12.346 -0.147 -5.985 1.00 0.00 C ATOM 543 CG1 ILE A 32 -12.028 -1.543 -5.444 1.00 0.00 C ATOM 544 CG2 ILE A 32 -11.697 0.923 -5.120 1.00 0.00 C ATOM 545 CD1 ILE A 32 -10.618 -2.000 -5.743 1.00 0.00 C ATOM 0 H ILE A 32 -13.905 -1.689 -7.194 1.00 0.00 H new ATOM 0 HA ILE A 32 -14.288 -0.063 -5.050 1.00 0.00 H new ATOM 0 HB ILE A 32 -11.940 -0.067 -6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -12.182 -1.549 -4.365 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -12.731 -2.258 -5.871 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.620 0.759 -5.085 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -11.900 1.906 -5.544 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -12.105 0.872 -4.111 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.463 -2.997 -5.330 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.465 -2.026 -6.822 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -9.908 -1.307 -5.293 1.00 0.00 H new ATOM 557 N THR A 33 -14.862 2.255 -5.716 1.00 0.00 N ATOM 558 CA THR A 33 -15.200 3.630 -6.061 1.00 0.00 C ATOM 559 C THR A 33 -14.013 4.561 -5.838 1.00 0.00 C ATOM 560 O THR A 33 -13.719 5.417 -6.671 1.00 0.00 O ATOM 561 CB THR A 33 -16.399 4.138 -5.238 1.00 0.00 C ATOM 562 OG1 THR A 33 -16.054 4.183 -3.849 1.00 0.00 O ATOM 563 CG2 THR A 33 -17.611 3.240 -5.436 1.00 0.00 C ATOM 0 H THR A 33 -15.213 1.950 -4.808 1.00 0.00 H new ATOM 0 HA THR A 33 -15.467 3.634 -7.118 1.00 0.00 H new ATOM 0 HB THR A 33 -16.650 5.141 -5.583 1.00 0.00 H new ATOM 0 HG1 THR A 33 -16.288 5.061 -3.482 1.00 0.00 H new ATOM 0 HG21 THR A 33 -18.445 3.619 -4.845 1.00 0.00 H new ATOM 0 HG22 THR A 33 -17.888 3.230 -6.490 1.00 0.00 H new ATOM 0 HG23 THR A 33 -17.369 2.227 -5.115 1.00 0.00 H new ATOM 571 N ASP A 34 -13.336 4.387 -4.708 1.00 0.00 N ATOM 572 CA ASP A 34 -12.179 5.210 -4.376 1.00 0.00 C ATOM 573 C ASP A 34 -11.283 4.505 -3.363 1.00 0.00 C ATOM 574 O ASP A 34 -11.695 3.537 -2.723 1.00 0.00 O ATOM 575 CB ASP A 34 -12.632 6.562 -3.822 1.00 0.00 C ATOM 576 CG ASP A 34 -13.254 7.445 -4.885 1.00 0.00 C ATOM 577 OD1 ASP A 34 -12.510 7.931 -5.762 1.00 0.00 O ATOM 578 OD2 ASP A 34 -14.485 7.651 -4.840 1.00 0.00 O ATOM 0 H ASP A 34 -13.569 3.684 -4.007 1.00 0.00 H new ATOM 0 HA ASP A 34 -11.605 5.373 -5.288 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.353 6.400 -3.021 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -11.777 7.076 -3.382 1.00 0.00 H new ATOM 583 N ILE A 35 -10.056 4.996 -3.223 1.00 0.00 N ATOM 584 CA ILE A 35 -9.102 4.413 -2.288 1.00 0.00 C ATOM 585 C ILE A 35 -8.283 5.494 -1.593 1.00 0.00 C ATOM 586 O ILE A 35 -7.844 6.455 -2.223 1.00 0.00 O ATOM 587 CB ILE A 35 -8.146 3.435 -2.996 1.00 0.00 C ATOM 588 CG1 ILE A 35 -8.939 2.402 -3.798 1.00 0.00 C ATOM 589 CG2 ILE A 35 -7.244 2.748 -1.981 1.00 0.00 C ATOM 590 CD1 ILE A 35 -8.111 1.675 -4.834 1.00 0.00 C ATOM 0 H ILE A 35 -9.699 5.796 -3.745 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.682 3.866 -1.545 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.519 3.999 -3.687 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.369 1.673 -3.111 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.771 2.901 -4.295 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.574 2.060 -2.497 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.656 3.497 -1.450 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -7.855 2.194 -1.268 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.739 0.958 -5.364 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.703 2.394 -5.544 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.294 1.147 -4.342 1.00 0.00 H new ATOM 602 N GLN A 36 -8.080 5.329 -0.290 1.00 0.00 N ATOM 603 CA GLN A 36 -7.312 6.291 0.491 1.00 0.00 C ATOM 604 C GLN A 36 -6.033 5.658 1.030 1.00 0.00 C ATOM 605 O GLN A 36 -6.075 4.630 1.706 1.00 0.00 O ATOM 606 CB GLN A 36 -8.155 6.830 1.649 1.00 0.00 C ATOM 607 CG GLN A 36 -9.371 7.622 1.198 1.00 0.00 C ATOM 608 CD GLN A 36 -10.498 6.733 0.709 1.00 0.00 C ATOM 609 OE1 GLN A 36 -11.208 6.117 1.504 1.00 0.00 O ATOM 610 NE2 GLN A 36 -10.668 6.662 -0.606 1.00 0.00 N ATOM 0 H GLN A 36 -8.437 4.538 0.247 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.039 7.117 -0.165 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -8.484 5.995 2.267 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.531 7.465 2.277 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.729 8.234 2.026 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.080 8.305 0.400 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.056 7.190 -1.229 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.410 6.080 -0.994 1.00 0.00 H new ATOM 619 N ILE A 37 -4.898 6.278 0.725 1.00 0.00 N ATOM 620 CA ILE A 37 -3.607 5.775 1.179 1.00 0.00 C ATOM 621 C ILE A 37 -2.957 6.740 2.165 1.00 0.00 C ATOM 622 O ILE A 37 -2.648 7.886 1.837 1.00 0.00 O ATOM 623 CB ILE A 37 -2.647 5.541 -0.002 1.00 0.00 C ATOM 624 CG1 ILE A 37 -3.198 4.454 -0.927 1.00 0.00 C ATOM 625 CG2 ILE A 37 -1.265 5.160 0.507 1.00 0.00 C ATOM 626 CD1 ILE A 37 -3.217 3.078 -0.300 1.00 0.00 C ATOM 0 H ILE A 37 -4.846 7.129 0.166 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.796 4.824 1.676 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.561 6.467 -0.571 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.211 4.722 -1.226 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.596 4.422 -1.835 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.598 4.998 -0.339 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.872 5.964 1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.333 4.245 1.096 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.620 2.359 -1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.202 2.789 -0.027 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.843 3.093 0.592 1.00 0.00 H new ATOM 638 N PRO A 38 -2.742 6.268 3.401 1.00 0.00 N ATOM 639 CA PRO A 38 -2.124 7.072 4.460 1.00 0.00 C ATOM 640 C PRO A 38 -0.645 7.336 4.198 1.00 0.00 C ATOM 641 O PRO A 38 0.181 6.425 4.266 1.00 0.00 O ATOM 642 CB PRO A 38 -2.299 6.207 5.711 1.00 0.00 C ATOM 643 CG PRO A 38 -2.399 4.812 5.196 1.00 0.00 C ATOM 644 CD PRO A 38 -3.085 4.912 3.861 1.00 0.00 C ATOM 0 HA PRO A 38 -2.580 8.059 4.541 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.454 6.318 6.391 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -3.194 6.489 6.266 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.412 4.362 5.095 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -2.968 4.183 5.881 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.728 4.150 3.168 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.163 4.780 3.952 1.00 0.00 H new ATOM 652 N LEU A 39 -0.317 8.588 3.899 1.00 0.00 N ATOM 653 CA LEU A 39 1.064 8.973 3.628 1.00 0.00 C ATOM 654 C LEU A 39 1.503 10.108 4.547 1.00 0.00 C ATOM 655 O LEU A 39 0.677 10.749 5.197 1.00 0.00 O ATOM 656 CB LEU A 39 1.217 9.397 2.166 1.00 0.00 C ATOM 657 CG LEU A 39 0.958 8.311 1.121 1.00 0.00 C ATOM 658 CD1 LEU A 39 1.322 8.810 -0.269 1.00 0.00 C ATOM 659 CD2 LEU A 39 1.740 7.049 1.459 1.00 0.00 C ATOM 0 H LEU A 39 -0.988 9.354 3.838 1.00 0.00 H new ATOM 0 HA LEU A 39 1.701 8.109 3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.535 10.226 1.976 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.229 9.777 2.023 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.105 8.070 1.131 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.131 8.024 -0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.718 9.685 -0.511 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.378 9.080 -0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.544 6.287 0.705 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.806 7.276 1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.431 6.680 2.437 1.00 0.00 H new ATOM 671 N ASP A 40 2.808 10.352 4.595 1.00 0.00 N ATOM 672 CA ASP A 40 3.358 11.412 5.432 1.00 0.00 C ATOM 673 C ASP A 40 3.563 12.691 4.625 1.00 0.00 C ATOM 674 O ASP A 40 3.407 12.698 3.403 1.00 0.00 O ATOM 675 CB ASP A 40 4.684 10.967 6.051 1.00 0.00 C ATOM 676 CG ASP A 40 4.494 10.259 7.378 1.00 0.00 C ATOM 677 OD1 ASP A 40 4.308 9.024 7.369 1.00 0.00 O ATOM 678 OD2 ASP A 40 4.531 10.939 8.424 1.00 0.00 O ATOM 0 H ASP A 40 3.505 9.830 4.064 1.00 0.00 H new ATOM 0 HA ASP A 40 2.645 11.617 6.230 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.200 10.302 5.358 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.325 11.837 6.195 1.00 0.00 H new ATOM 683 N TYR A 41 3.913 13.770 5.315 1.00 0.00 N ATOM 684 CA TYR A 41 4.136 15.055 4.664 1.00 0.00 C ATOM 685 C TYR A 41 5.622 15.286 4.408 1.00 0.00 C ATOM 686 O TYR A 41 6.009 16.272 3.783 1.00 0.00 O ATOM 687 CB TYR A 41 3.572 16.190 5.520 1.00 0.00 C ATOM 688 CG TYR A 41 4.087 16.188 6.942 1.00 0.00 C ATOM 689 CD1 TYR A 41 3.570 15.310 7.887 1.00 0.00 C ATOM 690 CD2 TYR A 41 5.088 17.064 7.341 1.00 0.00 C ATOM 691 CE1 TYR A 41 4.036 15.305 9.188 1.00 0.00 C ATOM 692 CE2 TYR A 41 5.562 17.065 8.639 1.00 0.00 C ATOM 693 CZ TYR A 41 5.032 16.184 9.558 1.00 0.00 C ATOM 694 OH TYR A 41 5.500 16.183 10.852 1.00 0.00 O ATOM 0 H TYR A 41 4.049 13.780 6.326 1.00 0.00 H new ATOM 0 HA TYR A 41 3.619 15.041 3.705 1.00 0.00 H new ATOM 0 HB2 TYR A 41 3.820 17.144 5.054 1.00 0.00 H new ATOM 0 HB3 TYR A 41 2.485 16.116 5.536 1.00 0.00 H new ATOM 0 HD1 TYR A 41 2.791 14.620 7.600 1.00 0.00 H new ATOM 0 HD2 TYR A 41 5.503 17.757 6.624 1.00 0.00 H new ATOM 0 HE1 TYR A 41 3.623 14.617 9.911 1.00 0.00 H new ATOM 0 HE2 TYR A 41 6.343 17.751 8.932 1.00 0.00 H new ATOM 0 HH TYR A 41 6.201 16.861 10.947 1.00 0.00 H new ATOM 704 N GLU A 42 6.450 14.367 4.897 1.00 0.00 N ATOM 705 CA GLU A 42 7.894 14.470 4.722 1.00 0.00 C ATOM 706 C GLU A 42 8.414 13.353 3.822 1.00 0.00 C ATOM 707 O GLU A 42 9.239 13.586 2.938 1.00 0.00 O ATOM 708 CB GLU A 42 8.599 14.417 6.079 1.00 0.00 C ATOM 709 CG GLU A 42 8.635 15.754 6.800 1.00 0.00 C ATOM 710 CD GLU A 42 9.852 15.903 7.691 1.00 0.00 C ATOM 711 OE1 GLU A 42 10.957 15.513 7.259 1.00 0.00 O ATOM 712 OE2 GLU A 42 9.700 16.411 8.822 1.00 0.00 O ATOM 0 H GLU A 42 6.145 13.544 5.417 1.00 0.00 H new ATOM 0 HA GLU A 42 8.110 15.426 4.246 1.00 0.00 H new ATOM 0 HB2 GLU A 42 8.096 13.686 6.712 1.00 0.00 H new ATOM 0 HB3 GLU A 42 9.620 14.064 5.935 1.00 0.00 H new ATOM 0 HG2 GLU A 42 8.626 16.559 6.065 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.733 15.862 7.402 1.00 0.00 H new ATOM 719 N THR A 43 7.925 12.139 4.053 1.00 0.00 N ATOM 720 CA THR A 43 8.340 10.985 3.265 1.00 0.00 C ATOM 721 C THR A 43 7.241 10.553 2.301 1.00 0.00 C ATOM 722 O THR A 43 7.520 10.015 1.230 1.00 0.00 O ATOM 723 CB THR A 43 8.713 9.794 4.167 1.00 0.00 C ATOM 724 OG1 THR A 43 7.601 9.441 4.997 1.00 0.00 O ATOM 725 CG2 THR A 43 9.915 10.129 5.037 1.00 0.00 C ATOM 0 H THR A 43 7.241 11.929 4.780 1.00 0.00 H new ATOM 0 HA THR A 43 9.219 11.290 2.697 1.00 0.00 H new ATOM 0 HB THR A 43 8.971 8.950 3.528 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.922 9.216 5.895 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.159 9.272 5.665 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.768 10.369 4.402 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.680 10.986 5.668 1.00 0.00 H new ATOM 733 N GLU A 44 5.992 10.793 2.688 1.00 0.00 N ATOM 734 CA GLU A 44 4.852 10.428 1.856 1.00 0.00 C ATOM 735 C GLU A 44 4.740 8.912 1.721 1.00 0.00 C ATOM 736 O GLU A 44 4.382 8.396 0.662 1.00 0.00 O ATOM 737 CB GLU A 44 4.977 11.067 0.471 1.00 0.00 C ATOM 738 CG GLU A 44 5.430 12.517 0.509 1.00 0.00 C ATOM 739 CD GLU A 44 5.114 13.260 -0.775 1.00 0.00 C ATOM 740 OE1 GLU A 44 5.949 13.222 -1.703 1.00 0.00 O ATOM 741 OE2 GLU A 44 4.032 13.878 -0.852 1.00 0.00 O ATOM 0 H GLU A 44 5.744 11.238 3.572 1.00 0.00 H new ATOM 0 HA GLU A 44 3.949 10.800 2.339 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.685 10.489 -0.124 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.013 11.009 -0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.948 13.023 1.345 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.504 12.554 0.691 1.00 0.00 H new ATOM 748 N LYS A 45 5.050 8.203 2.801 1.00 0.00 N ATOM 749 CA LYS A 45 4.985 6.747 2.806 1.00 0.00 C ATOM 750 C LYS A 45 3.902 6.254 3.761 1.00 0.00 C ATOM 751 O LYS A 45 3.527 6.952 4.703 1.00 0.00 O ATOM 752 CB LYS A 45 6.339 6.156 3.205 1.00 0.00 C ATOM 753 CG LYS A 45 6.733 6.454 4.641 1.00 0.00 C ATOM 754 CD LYS A 45 8.221 6.241 4.867 1.00 0.00 C ATOM 755 CE LYS A 45 8.578 6.327 6.343 1.00 0.00 C ATOM 756 NZ LYS A 45 10.040 6.521 6.549 1.00 0.00 N ATOM 0 H LYS A 45 5.349 8.614 3.685 1.00 0.00 H new ATOM 0 HA LYS A 45 4.734 6.416 1.798 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.311 5.076 3.061 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.107 6.547 2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.471 7.483 4.885 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.166 5.812 5.315 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.514 5.266 4.477 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.785 6.989 4.311 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.034 7.153 6.801 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.258 5.416 6.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.204 6.969 7.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.520 5.599 6.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 10.419 7.131 5.796 1.00 0.00 H new ATOM 770 N HIS A 46 3.405 5.046 3.512 1.00 0.00 N ATOM 771 CA HIS A 46 2.367 4.459 4.352 1.00 0.00 C ATOM 772 C HIS A 46 2.955 3.406 5.286 1.00 0.00 C ATOM 773 O HIS A 46 3.928 2.733 4.945 1.00 0.00 O ATOM 774 CB HIS A 46 1.273 3.834 3.485 1.00 0.00 C ATOM 775 CG HIS A 46 1.711 2.591 2.772 1.00 0.00 C ATOM 776 ND1 HIS A 46 1.353 1.324 3.182 1.00 0.00 N ATOM 777 CD2 HIS A 46 2.480 2.426 1.670 1.00 0.00 C ATOM 778 CE1 HIS A 46 1.885 0.433 2.363 1.00 0.00 C ATOM 779 NE2 HIS A 46 2.573 1.076 1.437 1.00 0.00 N ATOM 0 H HIS A 46 3.704 4.455 2.736 1.00 0.00 H new ATOM 0 HA HIS A 46 1.931 5.254 4.957 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.413 3.599 4.113 1.00 0.00 H new ATOM 0 HB3 HIS A 46 0.940 4.567 2.750 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.935 3.210 1.083 1.00 0.00 H new ATOM 0 HE1 HIS A 46 1.776 -0.639 2.438 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.090 0.640 0.673 1.00 0.00 H new ATOM 787 N ARG A 47 2.359 3.271 6.466 1.00 0.00 N ATOM 788 CA ARG A 47 2.825 2.302 7.451 1.00 0.00 C ATOM 789 C ARG A 47 2.264 0.914 7.156 1.00 0.00 C ATOM 790 O ARG A 47 1.845 0.197 8.064 1.00 0.00 O ATOM 791 CB ARG A 47 2.420 2.739 8.860 1.00 0.00 C ATOM 792 CG ARG A 47 2.975 4.096 9.260 1.00 0.00 C ATOM 793 CD ARG A 47 4.336 3.967 9.926 1.00 0.00 C ATOM 794 NE ARG A 47 5.421 3.918 8.950 1.00 0.00 N ATOM 795 CZ ARG A 47 6.641 3.471 9.228 1.00 0.00 C ATOM 796 NH1 ARG A 47 6.929 3.038 10.448 1.00 0.00 N ATOM 797 NH2 ARG A 47 7.575 3.458 8.286 1.00 0.00 N ATOM 0 H ARG A 47 1.553 3.820 6.763 1.00 0.00 H new ATOM 0 HA ARG A 47 3.912 2.256 7.391 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.332 2.768 8.924 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.762 1.991 9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.059 4.730 8.378 1.00 0.00 H new ATOM 0 HG3 ARG A 47 2.281 4.588 9.941 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.492 4.810 10.599 1.00 0.00 H new ATOM 0 HD3 ARG A 47 4.357 3.064 10.536 1.00 0.00 H new ATOM 0 HE ARG A 47 5.232 4.245 8.003 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.213 3.048 11.175 1.00 0.00 H new ATOM 0 HH12 ARG A 47 7.866 2.695 10.660 1.00 0.00 H new ATOM 0 HH21 ARG A 47 7.357 3.791 7.347 1.00 0.00 H new ATOM 0 HH22 ARG A 47 8.511 3.115 8.501 1.00 0.00 H new ATOM 811 N GLY A 48 2.257 0.543 5.879 1.00 0.00 N ATOM 812 CA GLY A 48 1.744 -0.757 5.488 1.00 0.00 C ATOM 813 C GLY A 48 0.268 -0.914 5.793 1.00 0.00 C ATOM 814 O GLY A 48 -0.142 -1.884 6.430 1.00 0.00 O ATOM 0 H GLY A 48 2.597 1.119 5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.909 -0.903 4.420 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.304 -1.536 6.006 1.00 0.00 H new ATOM 818 N PHE A 49 -0.534 0.044 5.339 1.00 0.00 N ATOM 819 CA PHE A 49 -1.973 0.009 5.569 1.00 0.00 C ATOM 820 C PHE A 49 -2.686 1.057 4.719 1.00 0.00 C ATOM 821 O PHE A 49 -2.055 1.961 4.172 1.00 0.00 O ATOM 822 CB PHE A 49 -2.280 0.243 7.050 1.00 0.00 C ATOM 823 CG PHE A 49 -2.174 1.683 7.463 1.00 0.00 C ATOM 824 CD1 PHE A 49 -0.941 2.312 7.522 1.00 0.00 C ATOM 825 CD2 PHE A 49 -3.308 2.408 7.793 1.00 0.00 C ATOM 826 CE1 PHE A 49 -0.841 3.637 7.903 1.00 0.00 C ATOM 827 CE2 PHE A 49 -3.215 3.733 8.174 1.00 0.00 C ATOM 828 CZ PHE A 49 -1.980 4.349 8.228 1.00 0.00 C ATOM 0 H PHE A 49 -0.211 0.854 4.810 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.338 -0.977 5.280 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.287 -0.115 7.265 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -1.594 -0.351 7.654 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.048 1.761 7.267 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.276 1.932 7.752 1.00 0.00 H new ATOM 0 HE1 PHE A 49 0.126 4.115 7.947 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.107 4.286 8.429 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.905 5.385 8.524 1.00 0.00 H new ATOM 838 N ALA A 50 -4.004 0.927 4.612 1.00 0.00 N ATOM 839 CA ALA A 50 -4.803 1.862 3.830 1.00 0.00 C ATOM 840 C ALA A 50 -6.292 1.560 3.967 1.00 0.00 C ATOM 841 O ALA A 50 -6.689 0.674 4.724 1.00 0.00 O ATOM 842 CB ALA A 50 -4.386 1.818 2.368 1.00 0.00 C ATOM 0 H ALA A 50 -4.541 0.183 5.057 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.625 2.865 4.217 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.991 2.521 1.796 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.334 2.090 2.281 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.534 0.811 1.978 1.00 0.00 H new ATOM 848 N PHE A 51 -7.111 2.303 3.230 1.00 0.00 N ATOM 849 CA PHE A 51 -8.557 2.115 3.271 1.00 0.00 C ATOM 850 C PHE A 51 -9.135 2.037 1.861 1.00 0.00 C ATOM 851 O PHE A 51 -8.753 2.806 0.978 1.00 0.00 O ATOM 852 CB PHE A 51 -9.219 3.258 4.043 1.00 0.00 C ATOM 853 CG PHE A 51 -8.596 3.514 5.386 1.00 0.00 C ATOM 854 CD1 PHE A 51 -7.506 4.361 5.508 1.00 0.00 C ATOM 855 CD2 PHE A 51 -9.100 2.907 6.525 1.00 0.00 C ATOM 856 CE1 PHE A 51 -6.931 4.599 6.743 1.00 0.00 C ATOM 857 CE2 PHE A 51 -8.529 3.142 7.762 1.00 0.00 C ATOM 858 CZ PHE A 51 -7.443 3.988 7.870 1.00 0.00 C ATOM 0 H PHE A 51 -6.799 3.040 2.598 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.762 1.174 3.782 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.164 4.169 3.446 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.276 3.030 4.179 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.101 4.840 4.629 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -9.948 2.243 6.446 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.082 5.262 6.826 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -8.932 2.664 8.643 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.995 4.171 8.835 1.00 0.00 H new ATOM 868 N VAL A 52 -10.057 1.102 1.656 1.00 0.00 N ATOM 869 CA VAL A 52 -10.689 0.923 0.355 1.00 0.00 C ATOM 870 C VAL A 52 -12.189 1.187 0.431 1.00 0.00 C ATOM 871 O VAL A 52 -12.853 0.779 1.382 1.00 0.00 O ATOM 872 CB VAL A 52 -10.456 -0.498 -0.192 1.00 0.00 C ATOM 873 CG1 VAL A 52 -11.090 -0.653 -1.565 1.00 0.00 C ATOM 874 CG2 VAL A 52 -8.968 -0.811 -0.244 1.00 0.00 C ATOM 0 H VAL A 52 -10.383 0.456 2.375 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.230 1.644 -0.321 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.931 -1.210 0.483 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.915 -1.663 -1.935 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.163 -0.474 -1.493 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.648 0.067 -2.253 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -8.822 -1.819 -0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.468 -0.094 -0.896 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.547 -0.744 0.759 1.00 0.00 H new ATOM 884 N GLU A 53 -12.715 1.873 -0.580 1.00 0.00 N ATOM 885 CA GLU A 53 -14.137 2.191 -0.626 1.00 0.00 C ATOM 886 C GLU A 53 -14.872 1.263 -1.589 1.00 0.00 C ATOM 887 O GLU A 53 -14.442 1.063 -2.725 1.00 0.00 O ATOM 888 CB GLU A 53 -14.343 3.647 -1.048 1.00 0.00 C ATOM 889 CG GLU A 53 -15.695 4.213 -0.646 1.00 0.00 C ATOM 890 CD GLU A 53 -15.730 5.728 -0.690 1.00 0.00 C ATOM 891 OE1 GLU A 53 -15.209 6.360 0.253 1.00 0.00 O ATOM 892 OE2 GLU A 53 -16.278 6.282 -1.666 1.00 0.00 O ATOM 0 H GLU A 53 -12.179 2.218 -1.376 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.547 2.048 0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.557 4.259 -0.606 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.235 3.721 -2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.463 3.816 -1.310 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -15.940 3.877 0.361 1.00 0.00 H new ATOM 899 N PHE A 54 -15.981 0.697 -1.126 1.00 0.00 N ATOM 900 CA PHE A 54 -16.775 -0.212 -1.944 1.00 0.00 C ATOM 901 C PHE A 54 -18.058 0.464 -2.420 1.00 0.00 C ATOM 902 O PHE A 54 -18.632 1.294 -1.716 1.00 0.00 O ATOM 903 CB PHE A 54 -17.116 -1.478 -1.155 1.00 0.00 C ATOM 904 CG PHE A 54 -15.994 -2.475 -1.108 1.00 0.00 C ATOM 905 CD1 PHE A 54 -14.722 -2.089 -0.716 1.00 0.00 C ATOM 906 CD2 PHE A 54 -16.210 -3.798 -1.458 1.00 0.00 C ATOM 907 CE1 PHE A 54 -13.687 -3.005 -0.672 1.00 0.00 C ATOM 908 CE2 PHE A 54 -15.180 -4.718 -1.415 1.00 0.00 C ATOM 909 CZ PHE A 54 -13.916 -4.320 -1.023 1.00 0.00 C ATOM 0 H PHE A 54 -16.351 0.852 -0.188 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.183 -0.485 -2.817 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -17.387 -1.200 -0.137 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.992 -1.949 -1.601 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.537 -1.061 -0.442 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -17.195 -4.114 -1.768 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.701 -2.692 -0.363 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.363 -5.747 -1.687 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.109 -5.037 -0.991 1.00 0.00 H new ATOM 919 N GLU A 55 -18.500 0.102 -3.621 1.00 0.00 N ATOM 920 CA GLU A 55 -19.714 0.675 -4.191 1.00 0.00 C ATOM 921 C GLU A 55 -20.922 0.384 -3.306 1.00 0.00 C ATOM 922 O GLU A 55 -21.794 1.234 -3.127 1.00 0.00 O ATOM 923 CB GLU A 55 -19.953 0.121 -5.598 1.00 0.00 C ATOM 924 CG GLU A 55 -21.118 0.778 -6.320 1.00 0.00 C ATOM 925 CD GLU A 55 -21.452 0.092 -7.631 1.00 0.00 C ATOM 926 OE1 GLU A 55 -20.630 0.173 -8.568 1.00 0.00 O ATOM 927 OE2 GLU A 55 -22.534 -0.524 -7.719 1.00 0.00 O ATOM 0 H GLU A 55 -18.036 -0.584 -4.217 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.582 1.755 -4.250 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -19.048 0.254 -6.190 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -20.136 -0.951 -5.531 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.995 0.765 -5.673 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -20.879 1.824 -6.512 1.00 0.00 H new ATOM 934 N LEU A 56 -20.965 -0.824 -2.754 1.00 0.00 N ATOM 935 CA LEU A 56 -22.066 -1.229 -1.887 1.00 0.00 C ATOM 936 C LEU A 56 -21.545 -1.738 -0.547 1.00 0.00 C ATOM 937 O LEU A 56 -20.357 -2.023 -0.400 1.00 0.00 O ATOM 938 CB LEU A 56 -22.904 -2.314 -2.566 1.00 0.00 C ATOM 939 CG LEU A 56 -23.564 -1.923 -3.889 1.00 0.00 C ATOM 940 CD1 LEU A 56 -24.164 -3.144 -4.568 1.00 0.00 C ATOM 941 CD2 LEU A 56 -24.630 -0.861 -3.659 1.00 0.00 C ATOM 0 H LEU A 56 -20.251 -1.539 -2.891 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.692 -0.356 -1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.266 -3.180 -2.743 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.684 -2.629 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 56 -22.800 -1.507 -4.545 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -24.629 -2.846 -5.508 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -23.378 -3.873 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -24.916 -3.590 -3.917 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -25.089 -0.594 -4.611 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -25.392 -1.251 -2.985 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -24.173 0.024 -3.217 1.00 0.00 H new ATOM 953 N ALA A 57 -22.442 -1.852 0.427 1.00 0.00 N ATOM 954 CA ALA A 57 -22.073 -2.331 1.753 1.00 0.00 C ATOM 955 C ALA A 57 -21.853 -3.840 1.751 1.00 0.00 C ATOM 956 O ALA A 57 -20.813 -4.325 2.193 1.00 0.00 O ATOM 957 CB ALA A 57 -23.143 -1.953 2.767 1.00 0.00 C ATOM 0 H ALA A 57 -23.430 -1.619 0.322 1.00 0.00 H new ATOM 0 HA ALA A 57 -21.135 -1.854 2.036 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -22.855 -2.317 3.753 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -23.249 -0.869 2.797 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -24.093 -2.402 2.478 1.00 0.00 H new ATOM 963 N GLU A 58 -22.841 -4.576 1.251 1.00 0.00 N ATOM 964 CA GLU A 58 -22.754 -6.031 1.193 1.00 0.00 C ATOM 965 C GLU A 58 -21.395 -6.474 0.660 1.00 0.00 C ATOM 966 O GLU A 58 -20.704 -7.280 1.284 1.00 0.00 O ATOM 967 CB GLU A 58 -23.869 -6.596 0.311 1.00 0.00 C ATOM 968 CG GLU A 58 -23.855 -6.054 -1.109 1.00 0.00 C ATOM 969 CD GLU A 58 -25.137 -6.356 -1.861 1.00 0.00 C ATOM 970 OE1 GLU A 58 -25.355 -7.533 -2.214 1.00 0.00 O ATOM 971 OE2 GLU A 58 -25.922 -5.413 -2.095 1.00 0.00 O ATOM 0 H GLU A 58 -23.709 -4.190 0.881 1.00 0.00 H new ATOM 0 HA GLU A 58 -22.871 -6.417 2.206 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -23.779 -7.682 0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -24.832 -6.370 0.768 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -23.700 -4.975 -1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -23.011 -6.483 -1.650 1.00 0.00 H new ATOM 978 N ASP A 59 -21.018 -5.943 -0.498 1.00 0.00 N ATOM 979 CA ASP A 59 -19.742 -6.282 -1.116 1.00 0.00 C ATOM 980 C ASP A 59 -18.594 -6.099 -0.128 1.00 0.00 C ATOM 981 O ASP A 59 -17.711 -6.950 -0.023 1.00 0.00 O ATOM 982 CB ASP A 59 -19.506 -5.420 -2.357 1.00 0.00 C ATOM 983 CG ASP A 59 -20.294 -5.905 -3.558 1.00 0.00 C ATOM 984 OD1 ASP A 59 -21.521 -5.678 -3.593 1.00 0.00 O ATOM 985 OD2 ASP A 59 -19.683 -6.513 -4.462 1.00 0.00 O ATOM 0 H ASP A 59 -21.579 -5.276 -1.028 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.778 -7.330 -1.414 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -19.782 -4.389 -2.137 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -18.443 -5.420 -2.599 1.00 0.00 H new ATOM 990 N ALA A 60 -18.613 -4.983 0.593 1.00 0.00 N ATOM 991 CA ALA A 60 -17.574 -4.688 1.572 1.00 0.00 C ATOM 992 C ALA A 60 -17.483 -5.789 2.624 1.00 0.00 C ATOM 993 O ALA A 60 -16.410 -6.339 2.869 1.00 0.00 O ATOM 994 CB ALA A 60 -17.839 -3.344 2.234 1.00 0.00 C ATOM 0 H ALA A 60 -19.337 -4.268 0.518 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.619 -4.641 1.049 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -17.055 -3.137 2.963 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.847 -2.560 1.476 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -18.805 -3.371 2.738 1.00 0.00 H new ATOM 1000 N ALA A 61 -18.616 -6.105 3.242 1.00 0.00 N ATOM 1001 CA ALA A 61 -18.664 -7.141 4.267 1.00 0.00 C ATOM 1002 C ALA A 61 -17.968 -8.413 3.794 1.00 0.00 C ATOM 1003 O ALA A 61 -17.155 -8.991 4.515 1.00 0.00 O ATOM 1004 CB ALA A 61 -20.107 -7.438 4.650 1.00 0.00 C ATOM 0 H ALA A 61 -19.513 -5.659 3.051 1.00 0.00 H new ATOM 0 HA ALA A 61 -18.135 -6.773 5.146 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -20.128 -8.213 5.416 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -20.574 -6.533 5.037 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -20.653 -7.781 3.771 1.00 0.00 H new ATOM 1010 N ALA A 62 -18.293 -8.843 2.579 1.00 0.00 N ATOM 1011 CA ALA A 62 -17.697 -10.046 2.010 1.00 0.00 C ATOM 1012 C ALA A 62 -16.186 -9.896 1.869 1.00 0.00 C ATOM 1013 O ALA A 62 -15.431 -10.822 2.162 1.00 0.00 O ATOM 1014 CB ALA A 62 -18.327 -10.359 0.661 1.00 0.00 C ATOM 0 H ALA A 62 -18.965 -8.377 1.970 1.00 0.00 H new ATOM 0 HA ALA A 62 -17.891 -10.875 2.690 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -17.873 -11.259 0.247 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.398 -10.518 0.788 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.162 -9.524 -0.020 1.00 0.00 H new ATOM 1020 N ALA A 63 -15.752 -8.724 1.417 1.00 0.00 N ATOM 1021 CA ALA A 63 -14.331 -8.453 1.239 1.00 0.00 C ATOM 1022 C ALA A 63 -13.559 -8.695 2.531 1.00 0.00 C ATOM 1023 O ALA A 63 -12.445 -9.219 2.510 1.00 0.00 O ATOM 1024 CB ALA A 63 -14.122 -7.025 0.757 1.00 0.00 C ATOM 0 H ALA A 63 -16.364 -7.947 1.167 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.948 -9.140 0.484 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.056 -6.837 0.628 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -14.633 -6.884 -0.195 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.527 -6.330 1.492 1.00 0.00 H new ATOM 1030 N ILE A 64 -14.157 -8.311 3.653 1.00 0.00 N ATOM 1031 CA ILE A 64 -13.525 -8.487 4.955 1.00 0.00 C ATOM 1032 C ILE A 64 -13.432 -9.964 5.325 1.00 0.00 C ATOM 1033 O ILE A 64 -12.353 -10.470 5.635 1.00 0.00 O ATOM 1034 CB ILE A 64 -14.295 -7.740 6.060 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -14.373 -6.247 5.737 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -13.629 -7.962 7.411 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -15.325 -5.484 6.632 1.00 0.00 C ATOM 0 H ILE A 64 -15.079 -7.876 3.687 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.521 -8.070 4.878 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.310 -8.135 6.107 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.377 -5.812 5.825 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.685 -6.124 4.700 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -14.184 -7.428 8.182 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -13.620 -9.027 7.642 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -12.605 -7.590 7.377 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.329 -4.432 6.346 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.330 -5.893 6.527 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.002 -5.576 7.669 1.00 0.00 H new ATOM 1049 N ASP A 65 -14.569 -10.650 5.289 1.00 0.00 N ATOM 1050 CA ASP A 65 -14.616 -12.070 5.617 1.00 0.00 C ATOM 1051 C ASP A 65 -13.546 -12.841 4.850 1.00 0.00 C ATOM 1052 O ASP A 65 -13.034 -13.853 5.327 1.00 0.00 O ATOM 1053 CB ASP A 65 -15.999 -12.643 5.303 1.00 0.00 C ATOM 1054 CG ASP A 65 -16.199 -14.027 5.889 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -15.587 -14.984 5.372 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -16.968 -14.152 6.866 1.00 0.00 O ATOM 0 H ASP A 65 -15.471 -10.246 5.036 1.00 0.00 H new ATOM 0 HA ASP A 65 -14.421 -12.177 6.684 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -16.764 -11.972 5.694 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -16.134 -12.686 4.222 1.00 0.00 H new ATOM 1061 N ASN A 66 -13.214 -12.355 3.658 1.00 0.00 N ATOM 1062 CA ASN A 66 -12.207 -13.000 2.823 1.00 0.00 C ATOM 1063 C ASN A 66 -10.820 -12.428 3.105 1.00 0.00 C ATOM 1064 O ASN A 66 -9.990 -13.073 3.745 1.00 0.00 O ATOM 1065 CB ASN A 66 -12.552 -12.824 1.343 1.00 0.00 C ATOM 1066 CG ASN A 66 -13.644 -13.773 0.888 1.00 0.00 C ATOM 1067 OD1 ASN A 66 -13.398 -14.692 0.108 1.00 0.00 O ATOM 1068 ND2 ASN A 66 -14.860 -13.552 1.375 1.00 0.00 N ATOM 0 H ASN A 66 -13.627 -11.517 3.249 1.00 0.00 H new ATOM 0 HA ASN A 66 -12.199 -14.063 3.063 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -12.870 -11.797 1.166 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -11.658 -12.988 0.742 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -15.635 -14.157 1.104 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -15.018 -12.778 2.020 1.00 0.00 H new ATOM 1075 N MET A 67 -10.578 -11.214 2.622 1.00 0.00 N ATOM 1076 CA MET A 67 -9.293 -10.554 2.824 1.00 0.00 C ATOM 1077 C MET A 67 -8.787 -10.772 4.246 1.00 0.00 C ATOM 1078 O MET A 67 -7.584 -10.882 4.477 1.00 0.00 O ATOM 1079 CB MET A 67 -9.414 -9.056 2.536 1.00 0.00 C ATOM 1080 CG MET A 67 -9.818 -8.743 1.105 1.00 0.00 C ATOM 1081 SD MET A 67 -8.799 -9.602 -0.109 1.00 0.00 S ATOM 1082 CE MET A 67 -7.161 -9.089 0.401 1.00 0.00 C ATOM 0 H MET A 67 -11.254 -10.667 2.088 1.00 0.00 H new ATOM 0 HA MET A 67 -8.575 -10.993 2.131 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.148 -8.622 3.215 1.00 0.00 H new ATOM 0 HB3 MET A 67 -8.459 -8.575 2.749 1.00 0.00 H new ATOM 0 HG2 MET A 67 -10.862 -9.019 0.958 1.00 0.00 H new ATOM 0 HG3 MET A 67 -9.746 -7.668 0.938 1.00 0.00 H new ATOM 0 HE1 MET A 67 -6.668 -8.574 -0.423 1.00 0.00 H new ATOM 0 HE2 MET A 67 -7.240 -8.416 1.255 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.577 -9.965 0.683 1.00 0.00 H new ATOM 1092 N ASN A 68 -9.715 -10.832 5.196 1.00 0.00 N ATOM 1093 CA ASN A 68 -9.362 -11.035 6.597 1.00 0.00 C ATOM 1094 C ASN A 68 -8.355 -12.172 6.745 1.00 0.00 C ATOM 1095 O ASN A 68 -8.657 -13.325 6.438 1.00 0.00 O ATOM 1096 CB ASN A 68 -10.615 -11.338 7.421 1.00 0.00 C ATOM 1097 CG ASN A 68 -10.293 -12.046 8.723 1.00 0.00 C ATOM 1098 OD1 ASN A 68 -10.675 -13.198 8.927 1.00 0.00 O ATOM 1099 ND2 ASN A 68 -9.588 -11.356 9.612 1.00 0.00 N ATOM 0 H ASN A 68 -10.716 -10.743 5.022 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.904 -10.118 6.967 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -11.139 -10.407 7.637 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.293 -11.956 6.832 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -9.342 -11.779 10.507 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -9.292 -10.403 9.400 1.00 0.00 H new ATOM 1106 N GLU A 69 -7.158 -11.837 7.216 1.00 0.00 N ATOM 1107 CA GLU A 69 -6.107 -12.831 7.404 1.00 0.00 C ATOM 1108 C GLU A 69 -5.789 -13.541 6.092 1.00 0.00 C ATOM 1109 O GLU A 69 -5.605 -14.758 6.061 1.00 0.00 O ATOM 1110 CB GLU A 69 -6.525 -13.854 8.463 1.00 0.00 C ATOM 1111 CG GLU A 69 -6.841 -13.236 9.815 1.00 0.00 C ATOM 1112 CD GLU A 69 -7.546 -14.203 10.747 1.00 0.00 C ATOM 1113 OE1 GLU A 69 -7.088 -15.359 10.858 1.00 0.00 O ATOM 1114 OE2 GLU A 69 -8.555 -13.803 11.364 1.00 0.00 O ATOM 0 H GLU A 69 -6.892 -10.887 7.474 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.210 -12.314 7.744 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.401 -14.396 8.107 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.726 -14.585 8.585 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.916 -12.897 10.281 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.466 -12.355 9.671 1.00 0.00 H new ATOM 1121 N SER A 70 -5.727 -12.772 5.009 1.00 0.00 N ATOM 1122 CA SER A 70 -5.436 -13.328 3.693 1.00 0.00 C ATOM 1123 C SER A 70 -3.948 -13.221 3.375 1.00 0.00 C ATOM 1124 O SER A 70 -3.197 -12.557 4.089 1.00 0.00 O ATOM 1125 CB SER A 70 -6.252 -12.605 2.619 1.00 0.00 C ATOM 1126 OG SER A 70 -5.942 -11.222 2.589 1.00 0.00 O ATOM 0 H SER A 70 -5.874 -11.763 5.017 1.00 0.00 H new ATOM 0 HA SER A 70 -5.713 -14.382 3.702 1.00 0.00 H new ATOM 0 HB2 SER A 70 -6.049 -13.048 1.644 1.00 0.00 H new ATOM 0 HB3 SER A 70 -7.316 -12.738 2.815 1.00 0.00 H new ATOM 0 HG SER A 70 -6.534 -10.741 3.204 1.00 0.00 H new ATOM 1132 N GLU A 71 -3.530 -13.880 2.299 1.00 0.00 N ATOM 1133 CA GLU A 71 -2.131 -13.859 1.887 1.00 0.00 C ATOM 1134 C GLU A 71 -1.922 -12.902 0.717 1.00 0.00 C ATOM 1135 O GLU A 71 -2.418 -13.135 -0.386 1.00 0.00 O ATOM 1136 CB GLU A 71 -1.670 -15.266 1.498 1.00 0.00 C ATOM 1137 CG GLU A 71 -0.170 -15.378 1.287 1.00 0.00 C ATOM 1138 CD GLU A 71 0.339 -16.797 1.457 1.00 0.00 C ATOM 1139 OE1 GLU A 71 0.071 -17.399 2.518 1.00 0.00 O ATOM 1140 OE2 GLU A 71 1.004 -17.304 0.530 1.00 0.00 O ATOM 0 H GLU A 71 -4.139 -14.434 1.697 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.536 -13.509 2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.972 -15.966 2.277 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.181 -15.567 0.583 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.080 -15.024 0.287 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.342 -14.725 1.994 1.00 0.00 H new ATOM 1147 N LEU A 72 -1.186 -11.825 0.966 1.00 0.00 N ATOM 1148 CA LEU A 72 -0.911 -10.831 -0.066 1.00 0.00 C ATOM 1149 C LEU A 72 0.581 -10.528 -0.147 1.00 0.00 C ATOM 1150 O LEU A 72 1.191 -10.092 0.830 1.00 0.00 O ATOM 1151 CB LEU A 72 -1.689 -9.545 0.217 1.00 0.00 C ATOM 1152 CG LEU A 72 -1.791 -8.553 -0.942 1.00 0.00 C ATOM 1153 CD1 LEU A 72 -2.752 -9.067 -2.002 1.00 0.00 C ATOM 1154 CD2 LEU A 72 -2.232 -7.186 -0.437 1.00 0.00 C ATOM 0 H LEU A 72 -0.769 -11.617 1.873 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.232 -11.240 -1.024 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.698 -9.816 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.221 -9.039 1.062 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.805 -8.450 -1.395 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.811 -8.348 -2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.394 -10.022 -2.385 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.741 -9.200 -1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.299 -6.493 -1.275 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.207 -7.272 0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.505 -6.813 0.285 1.00 0.00 H new ATOM 1166 N PHE A 73 1.164 -10.761 -1.318 1.00 0.00 N ATOM 1167 CA PHE A 73 2.586 -10.513 -1.527 1.00 0.00 C ATOM 1168 C PHE A 73 3.430 -11.332 -0.555 1.00 0.00 C ATOM 1169 O PHE A 73 4.403 -10.834 0.010 1.00 0.00 O ATOM 1170 CB PHE A 73 2.895 -9.024 -1.360 1.00 0.00 C ATOM 1171 CG PHE A 73 2.739 -8.233 -2.627 1.00 0.00 C ATOM 1172 CD1 PHE A 73 1.538 -8.234 -3.317 1.00 0.00 C ATOM 1173 CD2 PHE A 73 3.795 -7.488 -3.128 1.00 0.00 C ATOM 1174 CE1 PHE A 73 1.391 -7.507 -4.483 1.00 0.00 C ATOM 1175 CE2 PHE A 73 3.654 -6.758 -4.294 1.00 0.00 C ATOM 1176 CZ PHE A 73 2.451 -6.769 -4.973 1.00 0.00 C ATOM 0 H PHE A 73 0.674 -11.121 -2.137 1.00 0.00 H new ATOM 0 HA PHE A 73 2.837 -10.817 -2.543 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.236 -8.608 -0.598 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.916 -8.912 -0.995 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.706 -8.810 -2.939 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.738 -7.478 -2.602 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.449 -7.516 -5.010 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.484 -6.180 -4.673 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.339 -6.202 -5.885 1.00 0.00 H new ATOM 1186 N GLY A 74 3.049 -12.591 -0.366 1.00 0.00 N ATOM 1187 CA GLY A 74 3.780 -13.459 0.539 1.00 0.00 C ATOM 1188 C GLY A 74 3.759 -12.957 1.969 1.00 0.00 C ATOM 1189 O GLY A 74 4.737 -13.107 2.701 1.00 0.00 O ATOM 0 H GLY A 74 2.247 -13.026 -0.823 1.00 0.00 H new ATOM 0 HA2 GLY A 74 3.351 -14.460 0.503 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.813 -13.542 0.202 1.00 0.00 H new ATOM 1193 N ARG A 75 2.642 -12.358 2.367 1.00 0.00 N ATOM 1194 CA ARG A 75 2.498 -11.829 3.718 1.00 0.00 C ATOM 1195 C ARG A 75 1.046 -11.905 4.180 1.00 0.00 C ATOM 1196 O ARG A 75 0.137 -12.112 3.376 1.00 0.00 O ATOM 1197 CB ARG A 75 2.988 -10.381 3.776 1.00 0.00 C ATOM 1198 CG ARG A 75 4.440 -10.212 3.360 1.00 0.00 C ATOM 1199 CD ARG A 75 4.810 -8.744 3.213 1.00 0.00 C ATOM 1200 NE ARG A 75 5.280 -8.170 4.471 1.00 0.00 N ATOM 1201 CZ ARG A 75 6.521 -8.307 4.923 1.00 0.00 C ATOM 1202 NH1 ARG A 75 7.413 -8.994 4.224 1.00 0.00 N ATOM 1203 NH2 ARG A 75 6.873 -7.754 6.077 1.00 0.00 N ATOM 0 H ARG A 75 1.823 -12.227 1.773 1.00 0.00 H new ATOM 0 HA ARG A 75 3.106 -12.438 4.387 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.360 -9.768 3.130 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.864 -10.005 4.791 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.089 -10.679 4.101 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.611 -10.728 2.415 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.586 -8.640 2.455 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.943 -8.185 2.861 1.00 0.00 H new ATOM 0 HE ARG A 75 4.619 -7.634 5.033 1.00 0.00 H new ATOM 0 HH11 ARG A 75 7.147 -9.419 3.336 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.365 -9.097 4.574 1.00 0.00 H new ATOM 0 HH21 ARG A 75 6.190 -7.223 6.618 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.827 -7.860 6.423 1.00 0.00 H new ATOM 1217 N THR A 76 0.835 -11.737 5.482 1.00 0.00 N ATOM 1218 CA THR A 76 -0.505 -11.788 6.052 1.00 0.00 C ATOM 1219 C THR A 76 -1.017 -10.390 6.381 1.00 0.00 C ATOM 1220 O THR A 76 -0.346 -9.620 7.069 1.00 0.00 O ATOM 1221 CB THR A 76 -0.540 -12.648 7.329 1.00 0.00 C ATOM 1222 OG1 THR A 76 0.052 -13.927 7.075 1.00 0.00 O ATOM 1223 CG2 THR A 76 -1.969 -12.834 7.818 1.00 0.00 C ATOM 0 H THR A 76 1.576 -11.564 6.162 1.00 0.00 H new ATOM 0 HA THR A 76 -1.151 -12.241 5.300 1.00 0.00 H new ATOM 0 HB THR A 76 0.028 -12.132 8.103 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.027 -14.467 7.892 1.00 0.00 H new ATOM 0 HG21 THR A 76 -1.968 -13.445 8.721 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.408 -11.861 8.039 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.556 -13.330 7.045 1.00 0.00 H new ATOM 1231 N ILE A 77 -2.207 -10.069 5.885 1.00 0.00 N ATOM 1232 CA ILE A 77 -2.808 -8.763 6.128 1.00 0.00 C ATOM 1233 C ILE A 77 -4.111 -8.895 6.910 1.00 0.00 C ATOM 1234 O ILE A 77 -4.767 -9.936 6.872 1.00 0.00 O ATOM 1235 CB ILE A 77 -3.087 -8.017 4.810 1.00 0.00 C ATOM 1236 CG1 ILE A 77 -4.049 -8.824 3.936 1.00 0.00 C ATOM 1237 CG2 ILE A 77 -1.786 -7.750 4.067 1.00 0.00 C ATOM 1238 CD1 ILE A 77 -4.707 -8.006 2.846 1.00 0.00 C ATOM 0 H ILE A 77 -2.774 -10.695 5.313 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.090 -8.190 6.715 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.553 -7.060 5.043 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.505 -9.651 3.480 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.822 -9.260 4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.000 -7.222 3.138 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.131 -7.140 4.689 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.295 -8.697 3.842 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.375 -8.643 2.266 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.279 -7.194 3.295 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.942 -7.591 2.190 1.00 0.00 H new ATOM 1250 N ARG A 78 -4.481 -7.832 7.616 1.00 0.00 N ATOM 1251 CA ARG A 78 -5.706 -7.828 8.407 1.00 0.00 C ATOM 1252 C ARG A 78 -6.720 -6.843 7.833 1.00 0.00 C ATOM 1253 O ARG A 78 -6.376 -5.714 7.484 1.00 0.00 O ATOM 1254 CB ARG A 78 -5.398 -7.470 9.862 1.00 0.00 C ATOM 1255 CG ARG A 78 -5.089 -8.677 10.733 1.00 0.00 C ATOM 1256 CD ARG A 78 -6.355 -9.275 11.326 1.00 0.00 C ATOM 1257 NE ARG A 78 -6.716 -8.648 12.594 1.00 0.00 N ATOM 1258 CZ ARG A 78 -6.172 -8.981 13.760 1.00 0.00 C ATOM 1259 NH1 ARG A 78 -5.247 -9.929 13.817 1.00 0.00 N ATOM 1260 NH2 ARG A 78 -6.552 -8.364 14.871 1.00 0.00 N ATOM 0 H ARG A 78 -3.950 -6.962 7.657 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.136 -8.829 8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.549 -6.787 9.888 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -6.249 -6.936 10.284 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.572 -9.432 10.141 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.413 -8.384 11.536 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.176 -9.160 10.618 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.213 -10.345 11.478 1.00 0.00 H new ATOM 0 HE ARG A 78 -7.424 -7.914 12.585 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -4.951 -10.405 12.965 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -4.831 -10.183 14.713 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.262 -7.633 14.831 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -6.134 -8.620 15.765 1.00 0.00 H new ATOM 1274 N VAL A 79 -7.972 -7.279 7.738 1.00 0.00 N ATOM 1275 CA VAL A 79 -9.037 -6.436 7.208 1.00 0.00 C ATOM 1276 C VAL A 79 -10.166 -6.274 8.220 1.00 0.00 C ATOM 1277 O VAL A 79 -10.555 -7.230 8.889 1.00 0.00 O ATOM 1278 CB VAL A 79 -9.613 -7.015 5.901 1.00 0.00 C ATOM 1279 CG1 VAL A 79 -10.669 -6.085 5.325 1.00 0.00 C ATOM 1280 CG2 VAL A 79 -8.501 -7.262 4.893 1.00 0.00 C ATOM 0 H VAL A 79 -8.274 -8.211 8.021 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.596 -5.461 7.002 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.088 -7.970 6.125 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -11.064 -6.510 4.403 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.479 -5.964 6.045 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.222 -5.113 5.114 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.925 -7.671 3.976 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.995 -6.322 4.671 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.784 -7.970 5.308 1.00 0.00 H new ATOM 1290 N ASN A 80 -10.687 -5.057 8.326 1.00 0.00 N ATOM 1291 CA ASN A 80 -11.772 -4.769 9.257 1.00 0.00 C ATOM 1292 C ASN A 80 -12.422 -3.425 8.937 1.00 0.00 C ATOM 1293 O ASN A 80 -11.956 -2.690 8.065 1.00 0.00 O ATOM 1294 CB ASN A 80 -11.251 -4.766 10.695 1.00 0.00 C ATOM 1295 CG ASN A 80 -12.316 -5.168 11.697 1.00 0.00 C ATOM 1296 OD1 ASN A 80 -12.648 -4.407 12.606 1.00 0.00 O ATOM 1297 ND2 ASN A 80 -12.856 -6.370 11.536 1.00 0.00 N ATOM 0 H ASN A 80 -10.376 -4.254 7.779 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.524 -5.551 9.152 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.406 -5.450 10.774 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.881 -3.771 10.942 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -13.577 -6.696 12.180 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -12.550 -6.968 10.768 1.00 0.00 H new ATOM 1304 N LEU A 81 -13.499 -3.111 9.648 1.00 0.00 N ATOM 1305 CA LEU A 81 -14.213 -1.856 9.441 1.00 0.00 C ATOM 1306 C LEU A 81 -13.354 -0.666 9.859 1.00 0.00 C ATOM 1307 O LEU A 81 -12.802 -0.642 10.958 1.00 0.00 O ATOM 1308 CB LEU A 81 -15.523 -1.855 10.230 1.00 0.00 C ATOM 1309 CG LEU A 81 -16.663 -2.686 9.639 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -17.952 -2.450 10.411 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -16.853 -2.357 8.165 1.00 0.00 C ATOM 0 H LEU A 81 -13.897 -3.708 10.373 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.436 -1.765 8.378 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.318 -2.220 11.236 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.864 -0.824 10.328 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.401 -3.741 9.725 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -18.752 -3.050 9.976 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -17.810 -2.736 11.453 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -18.220 -1.395 10.358 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -17.668 -2.957 7.760 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -17.093 -1.299 8.056 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -15.935 -2.579 7.621 1.00 0.00 H new ATOM 1323 N ALA A 82 -13.248 0.320 8.974 1.00 0.00 N ATOM 1324 CA ALA A 82 -12.461 1.515 9.252 1.00 0.00 C ATOM 1325 C ALA A 82 -12.730 2.033 10.661 1.00 0.00 C ATOM 1326 O ALA A 82 -13.872 2.316 11.022 1.00 0.00 O ATOM 1327 CB ALA A 82 -12.760 2.595 8.223 1.00 0.00 C ATOM 0 H ALA A 82 -13.697 0.315 8.058 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.406 1.249 9.186 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.165 3.482 8.443 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.510 2.228 7.227 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.819 2.850 8.260 1.00 0.00 H new ATOM 1333 N LYS A 83 -11.670 2.156 11.453 1.00 0.00 N ATOM 1334 CA LYS A 83 -11.790 2.642 12.822 1.00 0.00 C ATOM 1335 C LYS A 83 -12.405 4.037 12.853 1.00 0.00 C ATOM 1336 O LYS A 83 -12.240 4.835 11.930 1.00 0.00 O ATOM 1337 CB LYS A 83 -10.419 2.662 13.501 1.00 0.00 C ATOM 1338 CG LYS A 83 -9.543 3.825 13.068 1.00 0.00 C ATOM 1339 CD LYS A 83 -8.373 4.025 14.016 1.00 0.00 C ATOM 1340 CE LYS A 83 -7.298 2.970 13.805 1.00 0.00 C ATOM 1341 NZ LYS A 83 -6.440 3.280 12.628 1.00 0.00 N ATOM 0 H LYS A 83 -10.718 1.926 11.170 1.00 0.00 H new ATOM 0 HA LYS A 83 -12.447 1.963 13.365 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.558 2.705 14.581 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -9.902 1.728 13.284 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -9.169 3.644 12.060 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.140 4.736 13.028 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -7.946 5.016 13.865 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.727 3.984 15.046 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -6.677 2.900 14.698 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -7.767 1.996 13.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -5.720 2.538 12.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.028 3.322 11.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.972 4.198 12.772 1.00 0.00 H new ATOM 1355 N PRO A 84 -13.130 4.342 13.940 1.00 0.00 N ATOM 1356 CA PRO A 84 -13.782 5.643 14.117 1.00 0.00 C ATOM 1357 C PRO A 84 -12.778 6.767 14.351 1.00 0.00 C ATOM 1358 O PRO A 84 -12.081 6.788 15.365 1.00 0.00 O ATOM 1359 CB PRO A 84 -14.653 5.437 15.359 1.00 0.00 C ATOM 1360 CG PRO A 84 -13.983 4.341 16.114 1.00 0.00 C ATOM 1361 CD PRO A 84 -13.369 3.440 15.079 1.00 0.00 C ATOM 0 HA PRO A 84 -14.342 5.942 13.231 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -14.715 6.348 15.955 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.673 5.164 15.087 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -13.222 4.738 16.786 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -14.699 3.797 16.730 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -12.443 2.990 15.436 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -14.038 2.622 14.811 1.00 0.00 H new ATOM 1369 N MET A 85 -12.712 7.700 13.407 1.00 0.00 N ATOM 1370 CA MET A 85 -11.794 8.829 13.513 1.00 0.00 C ATOM 1371 C MET A 85 -12.075 9.642 14.773 1.00 0.00 C ATOM 1372 O MET A 85 -13.213 9.714 15.235 1.00 0.00 O ATOM 1373 CB MET A 85 -11.909 9.724 12.278 1.00 0.00 C ATOM 1374 CG MET A 85 -13.212 10.504 12.212 1.00 0.00 C ATOM 1375 SD MET A 85 -13.165 12.020 13.187 1.00 0.00 S ATOM 1376 CE MET A 85 -12.395 13.146 12.026 1.00 0.00 C ATOM 0 H MET A 85 -13.282 7.697 12.561 1.00 0.00 H new ATOM 0 HA MET A 85 -10.779 8.436 13.575 1.00 0.00 H new ATOM 0 HB2 MET A 85 -11.074 10.425 12.269 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.818 9.108 11.383 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.430 10.752 11.173 1.00 0.00 H new ATOM 0 HG3 MET A 85 -14.027 9.873 12.567 1.00 0.00 H new ATOM 0 HE1 MET A 85 -13.022 14.030 11.906 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.416 13.444 12.402 1.00 0.00 H new ATOM 0 HE3 MET A 85 -12.278 12.651 11.062 1.00 0.00 H new ATOM 1386 N ARG A 86 -11.030 10.252 15.322 1.00 0.00 N ATOM 1387 CA ARG A 86 -11.164 11.059 16.530 1.00 0.00 C ATOM 1388 C ARG A 86 -10.254 12.282 16.471 1.00 0.00 C ATOM 1389 O ARG A 86 -9.036 12.155 16.341 1.00 0.00 O ATOM 1390 CB ARG A 86 -10.833 10.222 17.767 1.00 0.00 C ATOM 1391 CG ARG A 86 -11.177 10.911 19.077 1.00 0.00 C ATOM 1392 CD ARG A 86 -11.542 9.904 20.157 1.00 0.00 C ATOM 1393 NE ARG A 86 -10.384 9.134 20.602 1.00 0.00 N ATOM 1394 CZ ARG A 86 -10.473 8.035 21.342 1.00 0.00 C ATOM 1395 NH1 ARG A 86 -11.660 7.578 21.717 1.00 0.00 N ATOM 1396 NH2 ARG A 86 -9.373 7.389 21.708 1.00 0.00 N ATOM 0 H ARG A 86 -10.081 10.203 14.950 1.00 0.00 H new ATOM 0 HA ARG A 86 -12.197 11.400 16.596 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -11.372 9.277 17.711 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -9.770 9.983 17.760 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -10.329 11.510 19.408 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.010 11.597 18.921 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -11.978 10.427 21.008 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -12.304 9.224 19.776 1.00 0.00 H new ATOM 0 HE ARG A 86 -9.456 9.458 20.330 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -12.508 8.071 21.437 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.725 6.734 22.285 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -8.458 7.737 21.421 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -9.443 6.545 22.276 1.00 0.00 H new ATOM 1410 N ILE A 87 -10.853 13.464 16.566 1.00 0.00 N ATOM 1411 CA ILE A 87 -10.096 14.709 16.524 1.00 0.00 C ATOM 1412 C ILE A 87 -9.647 15.126 17.920 1.00 0.00 C ATOM 1413 O ILE A 87 -10.348 14.895 18.906 1.00 0.00 O ATOM 1414 CB ILE A 87 -10.923 15.849 15.901 1.00 0.00 C ATOM 1415 CG1 ILE A 87 -12.230 16.042 16.672 1.00 0.00 C ATOM 1416 CG2 ILE A 87 -11.205 15.559 14.434 1.00 0.00 C ATOM 1417 CD1 ILE A 87 -12.950 17.327 16.331 1.00 0.00 C ATOM 0 H ILE A 87 -11.860 13.586 16.673 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.219 14.525 15.903 1.00 0.00 H new ATOM 0 HB ILE A 87 -10.346 16.772 15.965 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -12.891 15.200 16.467 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -12.017 16.027 17.741 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -11.790 16.374 14.008 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.263 15.468 13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -11.764 14.627 14.348 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.868 17.396 16.915 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -12.308 18.177 16.563 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -13.195 17.336 15.269 1.00 0.00 H new ATOM 1429 N LYS A 88 -8.473 15.744 17.997 1.00 0.00 N ATOM 1430 CA LYS A 88 -7.929 16.198 19.272 1.00 0.00 C ATOM 1431 C LYS A 88 -8.027 17.715 19.396 1.00 0.00 C ATOM 1432 O LYS A 88 -7.600 18.448 18.504 1.00 0.00 O ATOM 1433 CB LYS A 88 -6.471 15.757 19.414 1.00 0.00 C ATOM 1434 CG LYS A 88 -6.312 14.306 19.833 1.00 0.00 C ATOM 1435 CD LYS A 88 -6.652 14.109 21.301 1.00 0.00 C ATOM 1436 CE LYS A 88 -6.462 12.661 21.727 1.00 0.00 C ATOM 1437 NZ LYS A 88 -5.030 12.340 21.979 1.00 0.00 N ATOM 0 H LYS A 88 -7.880 15.942 17.191 1.00 0.00 H new ATOM 0 HA LYS A 88 -8.518 15.747 20.071 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -5.960 15.910 18.464 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.977 16.394 20.148 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -6.958 13.677 19.221 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -5.287 13.984 19.650 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -6.021 14.755 21.912 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -7.684 14.410 21.480 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -7.041 12.469 22.630 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -6.851 12.000 20.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.943 11.344 22.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.481 12.499 21.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -4.665 12.953 22.736 1.00 0.00 H new ATOM 1451 N GLU A 89 -8.590 18.179 20.508 1.00 0.00 N ATOM 1452 CA GLU A 89 -8.742 19.609 20.747 1.00 0.00 C ATOM 1453 C GLU A 89 -9.158 19.878 22.190 1.00 0.00 C ATOM 1454 O GLU A 89 -9.747 19.021 22.848 1.00 0.00 O ATOM 1455 CB GLU A 89 -9.776 20.202 19.788 1.00 0.00 C ATOM 1456 CG GLU A 89 -11.180 19.659 19.995 1.00 0.00 C ATOM 1457 CD GLU A 89 -11.978 20.472 20.996 1.00 0.00 C ATOM 1458 OE1 GLU A 89 -11.674 21.671 21.164 1.00 0.00 O ATOM 1459 OE2 GLU A 89 -12.908 19.908 21.611 1.00 0.00 O ATOM 0 H GLU A 89 -8.948 17.586 21.256 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.778 20.085 20.570 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -9.793 21.285 19.910 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.465 20.001 18.763 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.706 19.648 19.040 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.119 18.626 20.338 1.00 0.00 H new ATOM 1466 N SER A 90 -8.845 21.075 22.677 1.00 0.00 N ATOM 1467 CA SER A 90 -9.181 21.456 24.043 1.00 0.00 C ATOM 1468 C SER A 90 -10.596 22.022 24.117 1.00 0.00 C ATOM 1469 O SER A 90 -11.385 21.641 24.981 1.00 0.00 O ATOM 1470 CB SER A 90 -8.180 22.487 24.569 1.00 0.00 C ATOM 1471 OG SER A 90 -8.028 23.561 23.657 1.00 0.00 O ATOM 0 H SER A 90 -8.359 21.797 22.145 1.00 0.00 H new ATOM 0 HA SER A 90 -9.132 20.562 24.665 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.519 22.869 25.532 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.215 22.009 24.737 1.00 0.00 H new ATOM 0 HG SER A 90 -7.385 24.207 24.017 1.00 0.00 H new ATOM 1477 N GLY A 91 -10.910 22.935 23.202 1.00 0.00 N ATOM 1478 CA GLY A 91 -12.230 23.539 23.180 1.00 0.00 C ATOM 1479 C GLY A 91 -12.773 23.796 24.571 1.00 0.00 C ATOM 1480 O GLY A 91 -13.631 23.068 25.071 1.00 0.00 O ATOM 0 H GLY A 91 -10.274 23.267 22.476 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -12.187 24.480 22.631 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.916 22.886 22.640 1.00 0.00 H new ATOM 1484 N PRO A 92 -12.268 24.855 25.222 1.00 0.00 N ATOM 1485 CA PRO A 92 -12.693 25.230 26.574 1.00 0.00 C ATOM 1486 C PRO A 92 -14.119 25.768 26.605 1.00 0.00 C ATOM 1487 O PRO A 92 -14.394 26.855 26.095 1.00 0.00 O ATOM 1488 CB PRO A 92 -11.699 26.326 26.967 1.00 0.00 C ATOM 1489 CG PRO A 92 -11.241 26.904 25.672 1.00 0.00 C ATOM 1490 CD PRO A 92 -11.243 25.767 24.688 1.00 0.00 C ATOM 0 HA PRO A 92 -12.697 24.376 27.252 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.171 27.083 27.593 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.864 25.918 27.536 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.905 27.704 25.345 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.245 27.336 25.768 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.492 26.106 23.682 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.267 25.285 24.629 1.00 0.00 H new ATOM 1498 N SER A 93 -15.023 25.002 27.205 1.00 0.00 N ATOM 1499 CA SER A 93 -16.423 25.401 27.300 1.00 0.00 C ATOM 1500 C SER A 93 -17.152 24.578 28.357 1.00 0.00 C ATOM 1501 O SER A 93 -17.022 23.355 28.407 1.00 0.00 O ATOM 1502 CB SER A 93 -17.114 25.238 25.944 1.00 0.00 C ATOM 1503 OG SER A 93 -17.149 23.877 25.550 1.00 0.00 O ATOM 0 H SER A 93 -14.812 24.101 27.633 1.00 0.00 H new ATOM 0 HA SER A 93 -16.457 26.450 27.594 1.00 0.00 H new ATOM 0 HB2 SER A 93 -18.130 25.630 26.000 1.00 0.00 H new ATOM 0 HB3 SER A 93 -16.587 25.824 25.191 1.00 0.00 H new ATOM 0 HG SER A 93 -17.597 23.799 24.682 1.00 0.00 H new ATOM 1509 N SER A 94 -17.920 25.260 29.202 1.00 0.00 N ATOM 1510 CA SER A 94 -18.668 24.594 30.262 1.00 0.00 C ATOM 1511 C SER A 94 -20.104 25.106 30.318 1.00 0.00 C ATOM 1512 O SER A 94 -20.376 26.164 30.884 1.00 0.00 O ATOM 1513 CB SER A 94 -17.984 24.813 31.613 1.00 0.00 C ATOM 1514 OG SER A 94 -16.842 23.983 31.747 1.00 0.00 O ATOM 0 H SER A 94 -18.040 26.272 29.173 1.00 0.00 H new ATOM 0 HA SER A 94 -18.689 23.527 30.042 1.00 0.00 H new ATOM 0 HB2 SER A 94 -17.691 25.858 31.711 1.00 0.00 H new ATOM 0 HB3 SER A 94 -18.687 24.602 32.419 1.00 0.00 H new ATOM 0 HG SER A 94 -16.422 24.143 32.618 1.00 0.00 H new ATOM 1520 N GLY A 95 -21.020 24.346 29.725 1.00 0.00 N ATOM 1521 CA GLY A 95 -22.417 24.738 29.718 1.00 0.00 C ATOM 1522 C GLY A 95 -23.292 23.752 28.970 1.00 0.00 C ATOM 1523 O GLY A 95 -24.387 24.096 28.526 1.00 0.00 O ATOM 0 H GLY A 95 -20.819 23.466 29.250 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -22.771 24.827 30.745 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -22.512 25.723 29.261 1.00 0.00 H new TER 1527 GLY A 95