USER MOD reduce.3.24.130724 H: found=0, std=0, add=658, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 656 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 28 MET CE :methyl -136:sc= 0 (180deg=-0.549) USER MOD Set 1.2: A 33 SER OG : rot -100:sc= -0.117 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 117:sc= 0.37 USER MOD Single : A 16 ASN : amide:sc= -6.04! C(o=-6!,f=-4.7!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc=-0.00332 X(o=-0.0033,f=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -12.3! C(o=-12!,f=-17!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 123:sc= -6.74! USER MOD Single : A 51 TYR OH : rot -161:sc= -1.17 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -166:sc= -1.09 USER MOD Single : A 65 THR OG1 : rot -41:sc= -4.63! USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.746 -13.903 9.537 1.00 0.00 N ATOM 2 CA GLY A 1 14.682 -15.319 9.218 1.00 0.00 C ATOM 3 C GLY A 1 16.061 -15.970 9.333 1.00 0.00 C ATOM 4 O GLY A 1 16.297 -16.780 10.228 1.00 0.00 O ATOM 0 H1 GLY A 1 13.798 -13.485 9.452 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.091 -13.782 10.510 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.395 -13.428 8.878 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.984 -15.816 9.892 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.297 -15.450 8.207 1.00 0.00 H new ATOM 8 N SER A 2 16.937 -15.592 8.413 1.00 0.00 N ATOM 9 CA SER A 2 18.287 -16.130 8.400 1.00 0.00 C ATOM 10 C SER A 2 19.215 -15.193 7.623 1.00 0.00 C ATOM 11 O SER A 2 18.752 -14.302 6.913 1.00 0.00 O ATOM 12 CB SER A 2 18.316 -17.532 7.789 1.00 0.00 C ATOM 13 OG SER A 2 18.556 -18.537 8.770 1.00 0.00 O ATOM 0 H SER A 2 16.738 -14.920 7.672 1.00 0.00 H new ATOM 0 HA SER A 2 18.635 -16.205 9.430 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.367 -17.730 7.292 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.092 -17.579 7.025 1.00 0.00 H new ATOM 0 HG SER A 2 18.565 -19.418 8.340 1.00 0.00 H new ATOM 19 N SER A 3 20.509 -15.428 7.784 1.00 0.00 N ATOM 20 CA SER A 3 21.507 -14.617 7.107 1.00 0.00 C ATOM 21 C SER A 3 21.051 -14.312 5.679 1.00 0.00 C ATOM 22 O SER A 3 20.291 -15.078 5.089 1.00 0.00 O ATOM 23 CB SER A 3 22.868 -15.315 7.092 1.00 0.00 C ATOM 24 OG SER A 3 22.856 -16.491 6.287 1.00 0.00 O ATOM 0 H SER A 3 20.889 -16.168 8.373 1.00 0.00 H new ATOM 0 HA SER A 3 21.616 -13.681 7.655 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.625 -14.626 6.716 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.153 -15.576 8.111 1.00 0.00 H new ATOM 0 HG SER A 3 23.743 -16.907 6.302 1.00 0.00 H new ATOM 30 N GLY A 4 21.535 -13.191 5.164 1.00 0.00 N ATOM 31 CA GLY A 4 21.187 -12.775 3.816 1.00 0.00 C ATOM 32 C GLY A 4 19.687 -12.495 3.698 1.00 0.00 C ATOM 33 O GLY A 4 18.951 -12.619 4.675 1.00 0.00 O ATOM 0 H GLY A 4 22.165 -12.558 5.656 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.750 -11.880 3.551 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.472 -13.552 3.107 1.00 0.00 H new ATOM 37 N SER A 5 19.280 -12.123 2.493 1.00 0.00 N ATOM 38 CA SER A 5 17.882 -11.825 2.235 1.00 0.00 C ATOM 39 C SER A 5 17.663 -11.597 0.738 1.00 0.00 C ATOM 40 O SER A 5 16.820 -12.250 0.124 1.00 0.00 O ATOM 41 CB SER A 5 17.424 -10.600 3.031 1.00 0.00 C ATOM 42 OG SER A 5 16.016 -10.400 2.940 1.00 0.00 O ATOM 0 H SER A 5 19.894 -12.021 1.685 1.00 0.00 H new ATOM 0 HA SER A 5 17.285 -12.678 2.557 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.706 -10.721 4.077 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.941 -9.714 2.662 1.00 0.00 H new ATOM 0 HG SER A 5 15.763 -9.610 3.462 1.00 0.00 H new ATOM 48 N SER A 6 18.436 -10.669 0.194 1.00 0.00 N ATOM 49 CA SER A 6 18.337 -10.347 -1.219 1.00 0.00 C ATOM 50 C SER A 6 16.926 -9.855 -1.547 1.00 0.00 C ATOM 51 O SER A 6 16.017 -10.658 -1.752 1.00 0.00 O ATOM 52 CB SER A 6 18.691 -11.557 -2.086 1.00 0.00 C ATOM 53 OG SER A 6 20.097 -11.681 -2.282 1.00 0.00 O ATOM 0 H SER A 6 19.134 -10.130 0.706 1.00 0.00 H new ATOM 0 HA SER A 6 19.052 -9.554 -1.439 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.309 -12.464 -1.616 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.197 -11.467 -3.053 1.00 0.00 H new ATOM 0 HG SER A 6 20.282 -12.466 -2.839 1.00 0.00 H new ATOM 59 N GLY A 7 16.786 -8.538 -1.585 1.00 0.00 N ATOM 60 CA GLY A 7 15.501 -7.929 -1.883 1.00 0.00 C ATOM 61 C GLY A 7 14.600 -7.917 -0.647 1.00 0.00 C ATOM 62 O GLY A 7 13.641 -8.683 -0.565 1.00 0.00 O ATOM 0 H GLY A 7 17.542 -7.875 -1.414 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.651 -6.909 -2.238 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.012 -8.478 -2.688 1.00 0.00 H new ATOM 66 N GLY A 8 14.940 -7.038 0.285 1.00 0.00 N ATOM 67 CA GLY A 8 14.174 -6.916 1.513 1.00 0.00 C ATOM 68 C GLY A 8 13.333 -5.637 1.510 1.00 0.00 C ATOM 69 O GLY A 8 13.449 -4.811 2.414 1.00 0.00 O ATOM 0 H GLY A 8 15.736 -6.404 0.214 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.523 -7.783 1.628 1.00 0.00 H new ATOM 0 HA3 GLY A 8 14.850 -6.909 2.368 1.00 0.00 H new ATOM 73 N THR A 9 12.505 -5.514 0.483 1.00 0.00 N ATOM 74 CA THR A 9 11.645 -4.350 0.350 1.00 0.00 C ATOM 75 C THR A 9 10.341 -4.729 -0.356 1.00 0.00 C ATOM 76 O THR A 9 10.150 -5.882 -0.738 1.00 0.00 O ATOM 77 CB THR A 9 12.435 -3.260 -0.377 1.00 0.00 C ATOM 78 OG1 THR A 9 13.117 -3.958 -1.416 1.00 0.00 O ATOM 79 CG2 THR A 9 13.560 -2.680 0.482 1.00 0.00 C ATOM 0 H THR A 9 12.411 -6.201 -0.265 1.00 0.00 H new ATOM 0 HA THR A 9 11.350 -3.962 1.325 1.00 0.00 H new ATOM 0 HB THR A 9 11.757 -2.460 -0.676 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.653 -3.325 -1.938 1.00 0.00 H new ATOM 0 HG21 THR A 9 14.089 -1.911 -0.082 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.138 -2.242 1.386 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.256 -3.473 0.754 1.00 0.00 H new ATOM 87 N VAL A 10 9.478 -3.735 -0.506 1.00 0.00 N ATOM 88 CA VAL A 10 8.197 -3.949 -1.159 1.00 0.00 C ATOM 89 C VAL A 10 7.819 -2.697 -1.953 1.00 0.00 C ATOM 90 O VAL A 10 8.136 -1.580 -1.546 1.00 0.00 O ATOM 91 CB VAL A 10 7.142 -4.342 -0.123 1.00 0.00 C ATOM 92 CG1 VAL A 10 5.733 -4.241 -0.711 1.00 0.00 C ATOM 93 CG2 VAL A 10 7.408 -5.745 0.426 1.00 0.00 C ATOM 0 H VAL A 10 9.640 -2.780 -0.187 1.00 0.00 H new ATOM 0 HA VAL A 10 8.262 -4.775 -1.867 1.00 0.00 H new ATOM 0 HB VAL A 10 7.210 -3.640 0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.002 -4.526 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.545 -3.216 -1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 10 5.648 -4.909 -1.568 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.644 -5.999 1.160 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.381 -6.466 -0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.389 -5.770 0.900 1.00 0.00 H new ATOM 103 N LYS A 11 7.146 -2.925 -3.071 1.00 0.00 N ATOM 104 CA LYS A 11 6.721 -1.830 -3.925 1.00 0.00 C ATOM 105 C LYS A 11 5.303 -1.405 -3.536 1.00 0.00 C ATOM 106 O LYS A 11 4.414 -2.245 -3.403 1.00 0.00 O ATOM 107 CB LYS A 11 6.865 -2.213 -5.400 1.00 0.00 C ATOM 108 CG LYS A 11 8.338 -2.313 -5.799 1.00 0.00 C ATOM 109 CD LYS A 11 8.595 -3.567 -6.637 1.00 0.00 C ATOM 110 CE LYS A 11 9.512 -3.256 -7.822 1.00 0.00 C ATOM 111 NZ LYS A 11 9.396 -4.307 -8.857 1.00 0.00 N ATOM 0 H LYS A 11 6.885 -3.853 -3.405 1.00 0.00 H new ATOM 0 HA LYS A 11 7.365 -0.963 -3.780 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.370 -3.167 -5.582 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.365 -1.471 -6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.626 -1.427 -6.365 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.960 -2.335 -4.904 1.00 0.00 H new ATOM 0 HD2 LYS A 11 9.048 -4.338 -6.014 1.00 0.00 H new ATOM 0 HD3 LYS A 11 7.648 -3.966 -7.000 1.00 0.00 H new ATOM 0 HE2 LYS A 11 9.250 -2.287 -8.248 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.545 -3.185 -7.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 10.025 -4.080 -9.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 9.668 -5.225 -8.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 8.413 -4.355 -9.194 1.00 0.00 H new ATOM 125 N VAL A 12 5.136 -0.102 -3.363 1.00 0.00 N ATOM 126 CA VAL A 12 3.842 0.444 -2.992 1.00 0.00 C ATOM 127 C VAL A 12 3.331 1.345 -4.118 1.00 0.00 C ATOM 128 O VAL A 12 3.985 2.321 -4.481 1.00 0.00 O ATOM 129 CB VAL A 12 3.946 1.168 -1.648 1.00 0.00 C ATOM 130 CG1 VAL A 12 2.634 1.874 -1.302 1.00 0.00 C ATOM 131 CG2 VAL A 12 4.358 0.202 -0.535 1.00 0.00 C ATOM 0 H VAL A 12 5.876 0.592 -3.473 1.00 0.00 H new ATOM 0 HA VAL A 12 3.114 -0.356 -2.860 1.00 0.00 H new ATOM 0 HB VAL A 12 4.722 1.928 -1.737 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.735 2.380 -0.342 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.400 2.606 -2.075 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.831 1.140 -1.242 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.425 0.742 0.409 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.615 -0.591 -0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.328 -0.234 -0.773 1.00 0.00 H new ATOM 141 N TYR A 13 2.168 0.984 -4.639 1.00 0.00 N ATOM 142 CA TYR A 13 1.561 1.748 -5.716 1.00 0.00 C ATOM 143 C TYR A 13 0.641 2.839 -5.165 1.00 0.00 C ATOM 144 O TYR A 13 -0.411 2.542 -4.602 1.00 0.00 O ATOM 145 CB TYR A 13 0.725 0.751 -6.521 1.00 0.00 C ATOM 146 CG TYR A 13 1.552 -0.181 -7.410 1.00 0.00 C ATOM 147 CD1 TYR A 13 2.587 0.328 -8.168 1.00 0.00 C ATOM 148 CD2 TYR A 13 1.263 -1.529 -7.453 1.00 0.00 C ATOM 149 CE1 TYR A 13 3.366 -0.549 -9.004 1.00 0.00 C ATOM 150 CE2 TYR A 13 2.041 -2.406 -8.290 1.00 0.00 C ATOM 151 CZ TYR A 13 3.054 -1.873 -9.024 1.00 0.00 C ATOM 152 OH TYR A 13 3.789 -2.701 -9.813 1.00 0.00 O ATOM 0 H TYR A 13 1.630 0.173 -4.336 1.00 0.00 H new ATOM 0 HA TYR A 13 2.327 2.235 -6.319 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.134 0.148 -5.832 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.022 1.303 -7.145 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.813 1.384 -8.134 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.453 -1.927 -6.859 1.00 0.00 H new ATOM 0 HE1 TYR A 13 4.179 -0.164 -9.601 1.00 0.00 H new ATOM 0 HE2 TYR A 13 1.825 -3.463 -8.334 1.00 0.00 H new ATOM 0 HH TYR A 13 4.249 -3.362 -9.255 1.00 0.00 H new ATOM 162 N LEU A 14 1.072 4.078 -5.346 1.00 0.00 N ATOM 163 CA LEU A 14 0.300 5.215 -4.874 1.00 0.00 C ATOM 164 C LEU A 14 -0.768 5.567 -5.911 1.00 0.00 C ATOM 165 O LEU A 14 -0.701 5.118 -7.054 1.00 0.00 O ATOM 166 CB LEU A 14 1.225 6.383 -4.524 1.00 0.00 C ATOM 167 CG LEU A 14 1.743 6.420 -3.085 1.00 0.00 C ATOM 168 CD1 LEU A 14 3.014 7.266 -2.981 1.00 0.00 C ATOM 169 CD2 LEU A 14 0.655 6.900 -2.122 1.00 0.00 C ATOM 0 H LEU A 14 1.946 4.320 -5.813 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.222 4.964 -3.951 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.082 6.356 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.693 7.314 -4.722 1.00 0.00 H new ATOM 0 HG LEU A 14 2.007 5.404 -2.792 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.361 7.276 -1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.788 6.840 -3.620 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.800 8.286 -3.301 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.050 6.917 -1.106 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.336 7.903 -2.404 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.197 6.222 -2.169 1.00 0.00 H new ATOM 181 N PRO A 15 -1.756 6.388 -5.463 1.00 0.00 N ATOM 182 CA PRO A 15 -2.837 6.805 -6.339 1.00 0.00 C ATOM 183 C PRO A 15 -2.359 7.865 -7.334 1.00 0.00 C ATOM 184 O PRO A 15 -3.078 8.213 -8.269 1.00 0.00 O ATOM 185 CB PRO A 15 -3.925 7.313 -5.407 1.00 0.00 C ATOM 186 CG PRO A 15 -3.239 7.595 -4.080 1.00 0.00 C ATOM 187 CD PRO A 15 -1.868 6.939 -4.116 1.00 0.00 C ATOM 0 HA PRO A 15 -3.211 5.992 -6.961 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.391 8.214 -5.805 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -4.715 6.572 -5.288 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -3.144 8.669 -3.920 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -3.830 7.200 -3.253 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -1.077 7.663 -3.917 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -1.783 6.158 -3.360 1.00 0.00 H new ATOM 195 N ASN A 16 -1.148 8.349 -7.098 1.00 0.00 N ATOM 196 CA ASN A 16 -0.566 9.362 -7.962 1.00 0.00 C ATOM 197 C ASN A 16 0.204 8.679 -9.094 1.00 0.00 C ATOM 198 O ASN A 16 1.305 9.102 -9.444 1.00 0.00 O ATOM 199 CB ASN A 16 0.415 10.246 -7.189 1.00 0.00 C ATOM 200 CG ASN A 16 0.216 11.722 -7.541 1.00 0.00 C ATOM 201 OD1 ASN A 16 0.588 12.189 -8.605 1.00 0.00 O ATOM 202 ND2 ASN A 16 -0.389 12.428 -6.589 1.00 0.00 N ATOM 0 H ASN A 16 -0.554 8.058 -6.321 1.00 0.00 H new ATOM 0 HA ASN A 16 -1.376 9.978 -8.354 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.274 10.102 -6.118 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.438 9.948 -7.419 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -0.567 13.423 -6.727 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -0.675 11.974 -5.721 1.00 0.00 H new ATOM 209 N LYS A 17 -0.405 7.635 -9.635 1.00 0.00 N ATOM 210 CA LYS A 17 0.209 6.889 -10.721 1.00 0.00 C ATOM 211 C LYS A 17 1.708 6.745 -10.450 1.00 0.00 C ATOM 212 O LYS A 17 2.506 6.670 -11.383 1.00 0.00 O ATOM 213 CB LYS A 17 -0.113 7.541 -12.067 1.00 0.00 C ATOM 214 CG LYS A 17 0.396 8.983 -12.114 1.00 0.00 C ATOM 215 CD LYS A 17 0.433 9.505 -13.552 1.00 0.00 C ATOM 216 CE LYS A 17 -0.839 10.285 -13.886 1.00 0.00 C ATOM 217 NZ LYS A 17 -0.680 11.013 -15.165 1.00 0.00 N ATOM 0 H LYS A 17 -1.318 7.287 -9.342 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.204 5.882 -10.774 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.342 6.965 -12.872 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -1.190 7.526 -12.234 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -0.249 9.620 -11.509 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.394 9.034 -11.679 1.00 0.00 H new ATOM 0 HD2 LYS A 17 1.303 10.147 -13.687 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.543 8.669 -14.243 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -1.685 9.601 -13.953 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -1.061 10.990 -13.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -1.553 11.537 -15.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 0.115 11.680 -15.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -0.490 10.334 -15.930 1.00 0.00 H new ATOM 231 N GLN A 18 2.045 6.711 -9.170 1.00 0.00 N ATOM 232 CA GLN A 18 3.434 6.577 -8.765 1.00 0.00 C ATOM 233 C GLN A 18 3.608 5.355 -7.860 1.00 0.00 C ATOM 234 O GLN A 18 2.626 4.760 -7.419 1.00 0.00 O ATOM 235 CB GLN A 18 3.928 7.848 -8.070 1.00 0.00 C ATOM 236 CG GLN A 18 4.328 8.912 -9.094 1.00 0.00 C ATOM 237 CD GLN A 18 5.644 9.585 -8.699 1.00 0.00 C ATOM 238 OE1 GLN A 18 5.703 10.416 -7.807 1.00 0.00 O ATOM 239 NE2 GLN A 18 6.693 9.182 -9.411 1.00 0.00 N ATOM 0 H GLN A 18 1.380 6.774 -8.399 1.00 0.00 H new ATOM 0 HA GLN A 18 4.040 6.432 -9.659 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.145 8.239 -7.420 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.781 7.611 -7.434 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.430 8.455 -10.078 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.541 9.662 -9.171 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.574 8.483 -10.144 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.617 9.572 -9.224 1.00 0.00 H new ATOM 248 N ARG A 19 4.865 5.017 -7.611 1.00 0.00 N ATOM 249 CA ARG A 19 5.180 3.876 -6.768 1.00 0.00 C ATOM 250 C ARG A 19 6.374 4.197 -5.867 1.00 0.00 C ATOM 251 O ARG A 19 7.241 4.987 -6.237 1.00 0.00 O ATOM 252 CB ARG A 19 5.501 2.640 -7.610 1.00 0.00 C ATOM 253 CG ARG A 19 6.605 2.941 -8.626 1.00 0.00 C ATOM 254 CD ARG A 19 6.023 3.139 -10.026 1.00 0.00 C ATOM 255 NE ARG A 19 6.518 4.407 -10.606 1.00 0.00 N ATOM 256 CZ ARG A 19 6.440 4.720 -11.907 1.00 0.00 C ATOM 257 NH1 ARG A 19 5.888 3.858 -12.771 1.00 0.00 N ATOM 258 NH2 ARG A 19 6.916 5.894 -12.343 1.00 0.00 N ATOM 0 H ARG A 19 5.677 5.513 -7.978 1.00 0.00 H new ATOM 0 HA ARG A 19 4.304 3.664 -6.155 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.813 1.823 -6.959 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.603 2.307 -8.131 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.148 3.837 -8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.324 2.122 -8.640 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.303 2.303 -10.667 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.934 3.153 -9.977 1.00 0.00 H new ATOM 0 HE ARG A 19 6.946 5.086 -9.976 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.527 2.964 -12.439 1.00 0.00 H new ATOM 0 HH12 ARG A 19 5.829 4.096 -13.761 1.00 0.00 H new ATOM 0 HH21 ARG A 19 7.338 6.549 -11.685 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.857 6.132 -13.333 1.00 0.00 H new ATOM 272 N THR A 20 6.382 3.566 -4.702 1.00 0.00 N ATOM 273 CA THR A 20 7.456 3.773 -3.746 1.00 0.00 C ATOM 274 C THR A 20 7.846 2.449 -3.086 1.00 0.00 C ATOM 275 O THR A 20 6.984 1.706 -2.620 1.00 0.00 O ATOM 276 CB THR A 20 7.000 4.839 -2.747 1.00 0.00 C ATOM 277 OG1 THR A 20 8.211 5.296 -2.150 1.00 0.00 O ATOM 278 CG2 THR A 20 6.210 4.246 -1.578 1.00 0.00 C ATOM 0 H THR A 20 5.661 2.911 -4.399 1.00 0.00 H new ATOM 0 HA THR A 20 8.360 4.133 -4.238 1.00 0.00 H new ATOM 0 HB THR A 20 6.387 5.580 -3.261 1.00 0.00 H new ATOM 0 HG1 THR A 20 8.008 5.991 -1.490 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.910 5.044 -0.899 1.00 0.00 H new ATOM 0 HG22 THR A 20 5.322 3.741 -1.958 1.00 0.00 H new ATOM 0 HG23 THR A 20 6.834 3.530 -1.043 1.00 0.00 H new ATOM 286 N VAL A 21 9.147 2.195 -3.067 1.00 0.00 N ATOM 287 CA VAL A 21 9.662 0.973 -2.472 1.00 0.00 C ATOM 288 C VAL A 21 9.958 1.218 -0.991 1.00 0.00 C ATOM 289 O VAL A 21 10.759 2.086 -0.650 1.00 0.00 O ATOM 290 CB VAL A 21 10.883 0.486 -3.254 1.00 0.00 C ATOM 291 CG1 VAL A 21 10.975 -1.042 -3.231 1.00 0.00 C ATOM 292 CG2 VAL A 21 10.862 1.013 -4.690 1.00 0.00 C ATOM 0 H VAL A 21 9.859 2.814 -3.454 1.00 0.00 H new ATOM 0 HA VAL A 21 8.919 0.177 -2.527 1.00 0.00 H new ATOM 0 HB VAL A 21 11.773 0.883 -2.766 1.00 0.00 H new ATOM 0 HG11 VAL A 21 11.852 -1.362 -3.794 1.00 0.00 H new ATOM 0 HG12 VAL A 21 11.060 -1.386 -2.200 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.079 -1.467 -3.682 1.00 0.00 H new ATOM 0 HG21 VAL A 21 11.741 0.652 -5.223 1.00 0.00 H new ATOM 0 HG22 VAL A 21 9.962 0.661 -5.194 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.868 2.103 -4.678 1.00 0.00 H new ATOM 302 N VAL A 22 9.295 0.437 -0.151 1.00 0.00 N ATOM 303 CA VAL A 22 9.477 0.557 1.285 1.00 0.00 C ATOM 304 C VAL A 22 10.185 -0.692 1.812 1.00 0.00 C ATOM 305 O VAL A 22 10.189 -1.732 1.154 1.00 0.00 O ATOM 306 CB VAL A 22 8.129 0.811 1.964 1.00 0.00 C ATOM 307 CG1 VAL A 22 8.314 1.129 3.449 1.00 0.00 C ATOM 308 CG2 VAL A 22 7.360 1.928 1.255 1.00 0.00 C ATOM 0 H VAL A 22 8.631 -0.282 -0.438 1.00 0.00 H new ATOM 0 HA VAL A 22 10.111 1.413 1.519 1.00 0.00 H new ATOM 0 HB VAL A 22 7.539 -0.102 1.889 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.341 1.305 3.907 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.801 0.288 3.943 1.00 0.00 H new ATOM 0 HG13 VAL A 22 8.932 2.020 3.556 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.406 2.088 1.757 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.945 2.847 1.284 1.00 0.00 H new ATOM 0 HG23 VAL A 22 7.181 1.645 0.218 1.00 0.00 H new ATOM 318 N THR A 23 10.769 -0.549 2.993 1.00 0.00 N ATOM 319 CA THR A 23 11.479 -1.653 3.615 1.00 0.00 C ATOM 320 C THR A 23 10.516 -2.511 4.438 1.00 0.00 C ATOM 321 O THR A 23 9.623 -1.986 5.102 1.00 0.00 O ATOM 322 CB THR A 23 12.629 -1.070 4.440 1.00 0.00 C ATOM 323 OG1 THR A 23 13.362 -0.283 3.505 1.00 0.00 O ATOM 324 CG2 THR A 23 13.627 -2.139 4.890 1.00 0.00 C ATOM 0 H THR A 23 10.765 0.315 3.535 1.00 0.00 H new ATOM 0 HA THR A 23 11.902 -2.323 2.866 1.00 0.00 H new ATOM 0 HB THR A 23 12.226 -0.558 5.314 1.00 0.00 H new ATOM 0 HG1 THR A 23 14.126 0.134 3.956 1.00 0.00 H new ATOM 0 HG21 THR A 23 14.422 -1.673 5.471 1.00 0.00 H new ATOM 0 HG22 THR A 23 13.115 -2.879 5.505 1.00 0.00 H new ATOM 0 HG23 THR A 23 14.056 -2.628 4.015 1.00 0.00 H new ATOM 332 N VAL A 24 10.729 -3.817 4.367 1.00 0.00 N ATOM 333 CA VAL A 24 9.890 -4.752 5.097 1.00 0.00 C ATOM 334 C VAL A 24 10.389 -4.860 6.539 1.00 0.00 C ATOM 335 O VAL A 24 11.453 -5.424 6.791 1.00 0.00 O ATOM 336 CB VAL A 24 9.858 -6.100 4.373 1.00 0.00 C ATOM 337 CG1 VAL A 24 8.611 -6.899 4.757 1.00 0.00 C ATOM 338 CG2 VAL A 24 9.943 -5.911 2.857 1.00 0.00 C ATOM 0 H VAL A 24 11.470 -4.249 3.815 1.00 0.00 H new ATOM 0 HA VAL A 24 8.861 -4.393 5.135 1.00 0.00 H new ATOM 0 HB VAL A 24 10.732 -6.670 4.689 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.613 -7.852 4.229 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.611 -7.080 5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.719 -6.335 4.484 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.918 -6.884 2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.098 -5.312 2.517 1.00 0.00 H new ATOM 0 HG23 VAL A 24 10.873 -5.402 2.605 1.00 0.00 H new ATOM 348 N ARG A 25 9.598 -4.310 7.448 1.00 0.00 N ATOM 349 CA ARG A 25 9.946 -4.337 8.858 1.00 0.00 C ATOM 350 C ARG A 25 9.061 -5.338 9.605 1.00 0.00 C ATOM 351 O ARG A 25 7.955 -5.644 9.163 1.00 0.00 O ATOM 352 CB ARG A 25 9.785 -2.954 9.492 1.00 0.00 C ATOM 353 CG ARG A 25 10.816 -1.971 8.933 1.00 0.00 C ATOM 354 CD ARG A 25 11.645 -1.347 10.057 1.00 0.00 C ATOM 355 NE ARG A 25 12.977 -0.955 9.545 1.00 0.00 N ATOM 356 CZ ARG A 25 13.976 -0.506 10.317 1.00 0.00 C ATOM 357 NH1 ARG A 25 13.801 -0.392 11.641 1.00 0.00 N ATOM 358 NH2 ARG A 25 15.151 -0.173 9.766 1.00 0.00 N ATOM 0 H ARG A 25 8.717 -3.843 7.235 1.00 0.00 H new ATOM 0 HA ARG A 25 10.990 -4.641 8.935 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.779 -2.578 9.303 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.899 -3.030 10.573 1.00 0.00 H new ATOM 0 HG2 ARG A 25 11.474 -2.487 8.234 1.00 0.00 H new ATOM 0 HG3 ARG A 25 10.309 -1.186 8.372 1.00 0.00 H new ATOM 0 HD2 ARG A 25 11.130 -0.475 10.459 1.00 0.00 H new ATOM 0 HD3 ARG A 25 11.756 -2.058 10.876 1.00 0.00 H new ATOM 0 HE ARG A 25 13.145 -1.031 8.542 1.00 0.00 H new ATOM 0 HH11 ARG A 25 12.907 -0.647 12.061 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.562 -0.050 12.228 1.00 0.00 H new ATOM 0 HH21 ARG A 25 15.285 -0.261 8.759 1.00 0.00 H new ATOM 0 HH22 ARG A 25 15.911 0.169 10.354 1.00 0.00 H new ATOM 372 N ASP A 26 9.582 -5.821 10.723 1.00 0.00 N ATOM 373 CA ASP A 26 8.854 -6.781 11.534 1.00 0.00 C ATOM 374 C ASP A 26 8.553 -6.163 12.901 1.00 0.00 C ATOM 375 O ASP A 26 9.299 -6.368 13.857 1.00 0.00 O ATOM 376 CB ASP A 26 9.678 -8.050 11.761 1.00 0.00 C ATOM 377 CG ASP A 26 10.031 -8.827 10.491 1.00 0.00 C ATOM 378 OD1 ASP A 26 9.079 -9.282 9.821 1.00 0.00 O ATOM 379 OD2 ASP A 26 11.245 -8.947 10.218 1.00 0.00 O ATOM 0 H ASP A 26 10.500 -5.565 11.086 1.00 0.00 H new ATOM 0 HA ASP A 26 7.935 -7.038 11.007 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.602 -7.779 12.272 1.00 0.00 H new ATOM 0 HB3 ASP A 26 9.125 -8.709 12.431 1.00 0.00 H new ATOM 384 N GLY A 27 7.457 -5.419 12.950 1.00 0.00 N ATOM 385 CA GLY A 27 7.048 -4.770 14.184 1.00 0.00 C ATOM 386 C GLY A 27 5.933 -3.754 13.926 1.00 0.00 C ATOM 387 O GLY A 27 4.805 -3.936 14.381 1.00 0.00 O ATOM 0 H GLY A 27 6.840 -5.252 12.155 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.704 -5.520 14.897 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.904 -4.269 14.637 1.00 0.00 H new ATOM 391 N MET A 28 6.288 -2.707 13.196 1.00 0.00 N ATOM 392 CA MET A 28 5.332 -1.662 12.872 1.00 0.00 C ATOM 393 C MET A 28 4.128 -2.235 12.121 1.00 0.00 C ATOM 394 O MET A 28 4.094 -3.424 11.810 1.00 0.00 O ATOM 395 CB MET A 28 6.012 -0.597 12.010 1.00 0.00 C ATOM 396 CG MET A 28 6.511 -1.194 10.692 1.00 0.00 C ATOM 397 SD MET A 28 7.946 -0.300 10.121 1.00 0.00 S ATOM 398 CE MET A 28 7.163 1.185 9.512 1.00 0.00 C ATOM 0 H MET A 28 7.225 -2.560 12.820 1.00 0.00 H new ATOM 0 HA MET A 28 4.979 -1.217 13.802 1.00 0.00 H new ATOM 0 HB2 MET A 28 5.311 0.212 11.804 1.00 0.00 H new ATOM 0 HB3 MET A 28 6.849 -0.162 12.556 1.00 0.00 H new ATOM 0 HG2 MET A 28 6.759 -2.246 10.831 1.00 0.00 H new ATOM 0 HG3 MET A 28 5.722 -1.149 9.941 1.00 0.00 H new ATOM 0 HE1 MET A 28 7.595 1.455 8.548 1.00 0.00 H new ATOM 0 HE2 MET A 28 6.094 1.010 9.394 1.00 0.00 H new ATOM 0 HE3 MET A 28 7.322 1.997 10.221 1.00 0.00 H new ATOM 408 N SER A 29 3.169 -1.361 11.852 1.00 0.00 N ATOM 409 CA SER A 29 1.966 -1.765 11.144 1.00 0.00 C ATOM 410 C SER A 29 1.939 -1.127 9.753 1.00 0.00 C ATOM 411 O SER A 29 2.817 -0.336 9.412 1.00 0.00 O ATOM 412 CB SER A 29 0.710 -1.382 11.928 1.00 0.00 C ATOM 413 OG SER A 29 0.847 -1.653 13.321 1.00 0.00 O ATOM 0 H SER A 29 3.201 -0.375 12.111 1.00 0.00 H new ATOM 0 HA SER A 29 1.979 -2.850 11.040 1.00 0.00 H new ATOM 0 HB2 SER A 29 0.502 -0.322 11.784 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.145 -1.931 11.534 1.00 0.00 H new ATOM 0 HG SER A 29 0.025 -1.393 13.787 1.00 0.00 H new ATOM 419 N VAL A 30 0.921 -1.495 8.989 1.00 0.00 N ATOM 420 CA VAL A 30 0.768 -0.968 7.643 1.00 0.00 C ATOM 421 C VAL A 30 0.543 0.544 7.714 1.00 0.00 C ATOM 422 O VAL A 30 1.050 1.290 6.878 1.00 0.00 O ATOM 423 CB VAL A 30 -0.359 -1.706 6.917 1.00 0.00 C ATOM 424 CG1 VAL A 30 -0.613 -1.098 5.537 1.00 0.00 C ATOM 425 CG2 VAL A 30 -0.054 -3.202 6.810 1.00 0.00 C ATOM 0 H VAL A 30 0.195 -2.151 9.276 1.00 0.00 H new ATOM 0 HA VAL A 30 1.675 -1.135 7.062 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.269 -1.591 7.506 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.418 -1.641 5.043 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.896 -0.051 5.647 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.294 -1.168 4.936 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.870 -3.703 6.290 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.873 -3.346 6.254 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.053 -3.624 7.809 1.00 0.00 H new ATOM 435 N TYR A 31 -0.217 0.950 8.720 1.00 0.00 N ATOM 436 CA TYR A 31 -0.515 2.359 8.911 1.00 0.00 C ATOM 437 C TYR A 31 0.767 3.167 9.125 1.00 0.00 C ATOM 438 O TYR A 31 1.034 4.120 8.394 1.00 0.00 O ATOM 439 CB TYR A 31 -1.372 2.441 10.176 1.00 0.00 C ATOM 440 CG TYR A 31 -1.669 3.871 10.635 1.00 0.00 C ATOM 441 CD1 TYR A 31 -0.691 4.609 11.269 1.00 0.00 C ATOM 442 CD2 TYR A 31 -2.915 4.421 10.414 1.00 0.00 C ATOM 443 CE1 TYR A 31 -0.970 5.954 11.701 1.00 0.00 C ATOM 444 CE2 TYR A 31 -3.195 5.766 10.846 1.00 0.00 C ATOM 445 CZ TYR A 31 -2.209 6.466 11.468 1.00 0.00 C ATOM 446 OH TYR A 31 -2.473 7.737 11.875 1.00 0.00 O ATOM 0 H TYR A 31 -0.635 0.328 9.412 1.00 0.00 H new ATOM 0 HA TYR A 31 -1.021 2.766 8.036 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.315 1.924 9.998 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -0.865 1.910 10.981 1.00 0.00 H new ATOM 0 HD1 TYR A 31 0.284 4.178 11.441 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -3.680 3.843 9.917 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -0.213 6.543 12.198 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -4.166 6.209 10.680 1.00 0.00 H new ATOM 0 HH TYR A 31 -3.396 7.970 11.642 1.00 0.00 H new ATOM 456 N ASP A 32 1.527 2.756 10.130 1.00 0.00 N ATOM 457 CA ASP A 32 2.774 3.429 10.448 1.00 0.00 C ATOM 458 C ASP A 32 3.730 3.313 9.259 1.00 0.00 C ATOM 459 O ASP A 32 4.633 4.132 9.102 1.00 0.00 O ATOM 460 CB ASP A 32 3.450 2.790 11.663 1.00 0.00 C ATOM 461 CG ASP A 32 3.165 3.479 12.999 1.00 0.00 C ATOM 462 OD1 ASP A 32 3.579 4.651 13.133 1.00 0.00 O ATOM 463 OD2 ASP A 32 2.540 2.819 13.856 1.00 0.00 O ATOM 0 H ASP A 32 1.303 1.965 10.734 1.00 0.00 H new ATOM 0 HA ASP A 32 2.547 4.472 10.668 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.131 1.750 11.732 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.527 2.782 11.498 1.00 0.00 H new ATOM 468 N SER A 33 3.498 2.287 8.453 1.00 0.00 N ATOM 469 CA SER A 33 4.327 2.052 7.283 1.00 0.00 C ATOM 470 C SER A 33 3.911 2.991 6.150 1.00 0.00 C ATOM 471 O SER A 33 4.702 3.820 5.702 1.00 0.00 O ATOM 472 CB SER A 33 4.236 0.595 6.826 1.00 0.00 C ATOM 473 OG SER A 33 5.374 -0.163 7.227 1.00 0.00 O ATOM 0 H SER A 33 2.748 1.609 8.587 1.00 0.00 H new ATOM 0 HA SER A 33 5.363 2.255 7.552 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.335 0.141 7.239 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.142 0.561 5.741 1.00 0.00 H new ATOM 0 HG SER A 33 5.991 -0.251 6.471 1.00 0.00 H new ATOM 479 N LEU A 34 2.669 2.830 5.717 1.00 0.00 N ATOM 480 CA LEU A 34 2.137 3.654 4.644 1.00 0.00 C ATOM 481 C LEU A 34 1.985 5.093 5.139 1.00 0.00 C ATOM 482 O LEU A 34 1.760 6.006 4.346 1.00 0.00 O ATOM 483 CB LEU A 34 0.841 3.051 4.099 1.00 0.00 C ATOM 484 CG LEU A 34 0.991 2.111 2.901 1.00 0.00 C ATOM 485 CD1 LEU A 34 1.698 2.811 1.739 1.00 0.00 C ATOM 486 CD2 LEU A 34 1.697 0.815 3.306 1.00 0.00 C ATOM 0 H LEU A 34 2.016 2.141 6.090 1.00 0.00 H new ATOM 0 HA LEU A 34 2.829 3.678 3.803 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.350 2.505 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.175 3.866 3.815 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.006 1.839 2.553 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.791 2.120 0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.117 3.680 1.430 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.690 3.132 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.791 0.165 2.436 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.689 1.047 3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.115 0.309 4.076 1.00 0.00 H new ATOM 498 N ASP A 35 2.115 5.252 6.448 1.00 0.00 N ATOM 499 CA ASP A 35 1.995 6.565 7.058 1.00 0.00 C ATOM 500 C ASP A 35 2.792 7.580 6.236 1.00 0.00 C ATOM 501 O ASP A 35 2.230 8.540 5.713 1.00 0.00 O ATOM 502 CB ASP A 35 2.555 6.565 8.482 1.00 0.00 C ATOM 503 CG ASP A 35 2.773 7.951 9.092 1.00 0.00 C ATOM 504 OD1 ASP A 35 1.784 8.499 9.624 1.00 0.00 O ATOM 505 OD2 ASP A 35 3.925 8.431 9.012 1.00 0.00 O ATOM 0 H ASP A 35 2.302 4.493 7.103 1.00 0.00 H new ATOM 0 HA ASP A 35 0.937 6.827 7.087 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.875 6.005 9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.505 6.031 8.482 1.00 0.00 H new ATOM 510 N LYS A 36 4.091 7.332 6.149 1.00 0.00 N ATOM 511 CA LYS A 36 4.972 8.211 5.399 1.00 0.00 C ATOM 512 C LYS A 36 4.565 8.198 3.925 1.00 0.00 C ATOM 513 O LYS A 36 4.297 9.248 3.342 1.00 0.00 O ATOM 514 CB LYS A 36 6.435 7.833 5.637 1.00 0.00 C ATOM 515 CG LYS A 36 7.289 9.076 5.894 1.00 0.00 C ATOM 516 CD LYS A 36 8.552 9.063 5.030 1.00 0.00 C ATOM 517 CE LYS A 36 8.503 10.164 3.969 1.00 0.00 C ATOM 518 NZ LYS A 36 9.319 11.325 4.389 1.00 0.00 N ATOM 0 H LYS A 36 4.554 6.535 6.586 1.00 0.00 H new ATOM 0 HA LYS A 36 4.872 9.239 5.748 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.505 7.157 6.489 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.821 7.295 4.771 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.707 9.972 5.679 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.565 9.120 6.947 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.430 9.200 5.661 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.656 8.092 4.546 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.871 9.778 3.019 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.471 10.476 3.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.275 12.063 3.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 8.950 11.703 5.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.306 11.026 4.520 1.00 0.00 H new ATOM 532 N ALA A 37 4.530 6.998 3.364 1.00 0.00 N ATOM 533 CA ALA A 37 4.160 6.835 1.968 1.00 0.00 C ATOM 534 C ALA A 37 3.017 7.795 1.633 1.00 0.00 C ATOM 535 O ALA A 37 2.933 8.298 0.513 1.00 0.00 O ATOM 536 CB ALA A 37 3.790 5.374 1.706 1.00 0.00 C ATOM 0 H ALA A 37 4.752 6.129 3.851 1.00 0.00 H new ATOM 0 HA ALA A 37 4.999 7.081 1.317 1.00 0.00 H new ATOM 0 HB1 ALA A 37 3.512 5.251 0.659 1.00 0.00 H new ATOM 0 HB2 ALA A 37 4.644 4.736 1.932 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.949 5.092 2.340 1.00 0.00 H new ATOM 542 N LEU A 38 2.166 8.020 2.623 1.00 0.00 N ATOM 543 CA LEU A 38 1.032 8.911 2.446 1.00 0.00 C ATOM 544 C LEU A 38 1.437 10.331 2.848 1.00 0.00 C ATOM 545 O LEU A 38 1.362 11.254 2.038 1.00 0.00 O ATOM 546 CB LEU A 38 -0.188 8.383 3.204 1.00 0.00 C ATOM 547 CG LEU A 38 -0.748 7.043 2.721 1.00 0.00 C ATOM 548 CD1 LEU A 38 -2.045 6.694 3.456 1.00 0.00 C ATOM 549 CD2 LEU A 38 -0.931 7.040 1.202 1.00 0.00 C ATOM 0 H LEU A 38 2.239 7.601 3.550 1.00 0.00 H new ATOM 0 HA LEU A 38 0.737 8.947 1.397 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.077 8.285 4.257 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.980 9.129 3.143 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.023 6.264 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.422 5.737 3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.850 6.626 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.788 7.470 3.272 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.330 6.076 0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.625 7.831 0.918 1.00 0.00 H new ATOM 0 HD23 LEU A 38 0.031 7.210 0.719 1.00 0.00 H new ATOM 561 N LYS A 39 1.856 10.462 4.098 1.00 0.00 N ATOM 562 CA LYS A 39 2.273 11.753 4.616 1.00 0.00 C ATOM 563 C LYS A 39 3.062 12.500 3.539 1.00 0.00 C ATOM 564 O LYS A 39 2.789 13.667 3.261 1.00 0.00 O ATOM 565 CB LYS A 39 3.038 11.582 5.930 1.00 0.00 C ATOM 566 CG LYS A 39 2.128 11.844 7.132 1.00 0.00 C ATOM 567 CD LYS A 39 0.729 11.272 6.896 1.00 0.00 C ATOM 568 CE LYS A 39 -0.271 12.385 6.573 1.00 0.00 C ATOM 569 NZ LYS A 39 -1.472 12.267 7.430 1.00 0.00 N ATOM 0 H LYS A 39 1.916 9.695 4.767 1.00 0.00 H new ATOM 0 HA LYS A 39 1.404 12.365 4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 39 3.444 10.572 5.990 1.00 0.00 H new ATOM 0 HB3 LYS A 39 3.885 12.268 5.954 1.00 0.00 H new ATOM 0 HG2 LYS A 39 2.562 11.396 8.026 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.060 12.917 7.314 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.759 10.555 6.075 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.400 10.728 7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.197 13.358 6.724 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -0.559 12.330 5.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -2.140 13.029 7.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -1.927 11.346 7.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -1.194 12.342 8.429 1.00 0.00 H new ATOM 583 N VAL A 40 4.025 11.797 2.961 1.00 0.00 N ATOM 584 CA VAL A 40 4.855 12.379 1.920 1.00 0.00 C ATOM 585 C VAL A 40 3.989 13.256 1.014 1.00 0.00 C ATOM 586 O VAL A 40 4.379 14.370 0.666 1.00 0.00 O ATOM 587 CB VAL A 40 5.589 11.274 1.158 1.00 0.00 C ATOM 588 CG1 VAL A 40 4.599 10.292 0.527 1.00 0.00 C ATOM 589 CG2 VAL A 40 6.524 11.865 0.101 1.00 0.00 C ATOM 0 H VAL A 40 4.249 10.830 3.194 1.00 0.00 H new ATOM 0 HA VAL A 40 5.622 13.020 2.356 1.00 0.00 H new ATOM 0 HB VAL A 40 6.198 10.722 1.873 1.00 0.00 H new ATOM 0 HG11 VAL A 40 5.147 9.517 -0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 40 3.993 9.834 1.309 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.951 10.825 -0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.033 11.058 -0.426 1.00 0.00 H new ATOM 0 HG22 VAL A 40 5.944 12.453 -0.610 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.262 12.505 0.585 1.00 0.00 H new ATOM 599 N ARG A 41 2.830 12.722 0.659 1.00 0.00 N ATOM 600 CA ARG A 41 1.906 13.443 -0.200 1.00 0.00 C ATOM 601 C ARG A 41 0.848 14.159 0.642 1.00 0.00 C ATOM 602 O ARG A 41 0.299 15.177 0.222 1.00 0.00 O ATOM 603 CB ARG A 41 1.212 12.496 -1.181 1.00 0.00 C ATOM 604 CG ARG A 41 2.189 11.998 -2.247 1.00 0.00 C ATOM 605 CD ARG A 41 1.468 11.156 -3.302 1.00 0.00 C ATOM 606 NE ARG A 41 1.998 11.470 -4.648 1.00 0.00 N ATOM 607 CZ ARG A 41 1.945 12.684 -5.212 1.00 0.00 C ATOM 608 NH1 ARG A 41 1.387 13.707 -4.550 1.00 0.00 N ATOM 609 NH2 ARG A 41 2.452 12.876 -6.437 1.00 0.00 N ATOM 0 H ARG A 41 2.509 11.799 0.950 1.00 0.00 H new ATOM 0 HA ARG A 41 2.482 14.175 -0.766 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.796 11.647 -0.639 1.00 0.00 H new ATOM 0 HB3 ARG A 41 0.378 13.009 -1.659 1.00 0.00 H new ATOM 0 HG2 ARG A 41 2.675 12.848 -2.725 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.974 11.405 -1.777 1.00 0.00 H new ATOM 0 HD2 ARG A 41 1.602 10.096 -3.087 1.00 0.00 H new ATOM 0 HD3 ARG A 41 0.397 11.355 -3.268 1.00 0.00 H new ATOM 0 HE ARG A 41 2.431 10.715 -5.179 1.00 0.00 H new ATOM 0 HH11 ARG A 41 1.003 13.561 -3.617 1.00 0.00 H new ATOM 0 HH12 ARG A 41 1.347 14.631 -4.980 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.878 12.098 -6.940 1.00 0.00 H new ATOM 0 HH22 ARG A 41 2.412 13.800 -6.867 1.00 0.00 H new ATOM 623 N GLY A 42 0.593 13.600 1.816 1.00 0.00 N ATOM 624 CA GLY A 42 -0.390 14.172 2.720 1.00 0.00 C ATOM 625 C GLY A 42 -1.700 13.382 2.678 1.00 0.00 C ATOM 626 O GLY A 42 -2.736 13.868 3.128 1.00 0.00 O ATOM 0 H GLY A 42 1.050 12.757 2.162 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.004 14.175 3.736 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.579 15.210 2.448 1.00 0.00 H new ATOM 630 N LEU A 43 -1.610 12.178 2.132 1.00 0.00 N ATOM 631 CA LEU A 43 -2.776 11.317 2.025 1.00 0.00 C ATOM 632 C LEU A 43 -3.243 10.922 3.427 1.00 0.00 C ATOM 633 O LEU A 43 -2.460 10.409 4.225 1.00 0.00 O ATOM 634 CB LEU A 43 -2.477 10.122 1.117 1.00 0.00 C ATOM 635 CG LEU A 43 -2.645 10.362 -0.385 1.00 0.00 C ATOM 636 CD1 LEU A 43 -2.051 9.208 -1.194 1.00 0.00 C ATOM 637 CD2 LEU A 43 -4.112 10.614 -0.739 1.00 0.00 C ATOM 0 H LEU A 43 -0.749 11.779 1.759 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.601 11.849 1.552 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.452 9.799 1.301 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.128 9.298 1.408 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.090 11.262 -0.651 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.184 9.403 -2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.988 9.117 -0.972 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.558 8.280 -0.930 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.204 10.782 -1.812 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.709 9.747 -0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.470 11.493 -0.203 1.00 0.00 H new ATOM 649 N ASN A 44 -4.518 11.176 3.684 1.00 0.00 N ATOM 650 CA ASN A 44 -5.099 10.854 4.976 1.00 0.00 C ATOM 651 C ASN A 44 -5.420 9.359 5.027 1.00 0.00 C ATOM 652 O ASN A 44 -5.978 8.807 4.080 1.00 0.00 O ATOM 653 CB ASN A 44 -6.402 11.625 5.202 1.00 0.00 C ATOM 654 CG ASN A 44 -6.535 12.059 6.663 1.00 0.00 C ATOM 655 OD1 ASN A 44 -6.324 13.207 7.018 1.00 0.00 O ATOM 656 ND2 ASN A 44 -6.896 11.080 7.487 1.00 0.00 N ATOM 0 H ASN A 44 -5.165 11.601 3.019 1.00 0.00 H new ATOM 0 HA ASN A 44 -4.379 11.128 5.747 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -6.427 12.502 4.555 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -7.251 11.000 4.926 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -7.012 11.268 8.483 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -7.057 10.141 7.123 1.00 0.00 H new ATOM 663 N GLN A 45 -5.054 8.745 6.143 1.00 0.00 N ATOM 664 CA GLN A 45 -5.296 7.325 6.330 1.00 0.00 C ATOM 665 C GLN A 45 -6.763 7.078 6.684 1.00 0.00 C ATOM 666 O GLN A 45 -7.065 6.485 7.718 1.00 0.00 O ATOM 667 CB GLN A 45 -4.369 6.747 7.401 1.00 0.00 C ATOM 668 CG GLN A 45 -3.087 6.192 6.777 1.00 0.00 C ATOM 669 CD GLN A 45 -2.351 5.277 7.757 1.00 0.00 C ATOM 670 OE1 GLN A 45 -2.684 4.116 7.933 1.00 0.00 O ATOM 671 NE2 GLN A 45 -1.335 5.862 8.385 1.00 0.00 N ATOM 0 H GLN A 45 -4.592 9.206 6.927 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.078 6.813 5.393 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.119 7.521 8.126 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.885 5.956 7.945 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.330 5.639 5.870 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.436 7.015 6.483 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.109 6.838 8.191 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.781 5.335 9.060 1.00 0.00 H new ATOM 680 N ASP A 46 -7.638 7.547 5.805 1.00 0.00 N ATOM 681 CA ASP A 46 -9.067 7.385 6.012 1.00 0.00 C ATOM 682 C ASP A 46 -9.782 7.433 4.661 1.00 0.00 C ATOM 683 O ASP A 46 -10.647 6.604 4.382 1.00 0.00 O ATOM 684 CB ASP A 46 -9.628 8.509 6.885 1.00 0.00 C ATOM 685 CG ASP A 46 -11.127 8.414 7.177 1.00 0.00 C ATOM 686 OD1 ASP A 46 -11.906 8.753 6.259 1.00 0.00 O ATOM 687 OD2 ASP A 46 -11.460 8.006 8.310 1.00 0.00 O ATOM 0 H ASP A 46 -7.384 8.039 4.948 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.230 6.428 6.508 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.088 8.517 7.832 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.428 9.463 6.396 1.00 0.00 H new ATOM 692 N CYS A 47 -9.395 8.414 3.858 1.00 0.00 N ATOM 693 CA CYS A 47 -9.989 8.581 2.542 1.00 0.00 C ATOM 694 C CYS A 47 -9.132 7.821 1.528 1.00 0.00 C ATOM 695 O CYS A 47 -9.243 8.047 0.324 1.00 0.00 O ATOM 696 CB CYS A 47 -10.136 10.059 2.172 1.00 0.00 C ATOM 697 SG CYS A 47 -11.495 10.814 3.137 1.00 0.00 S ATOM 0 H CYS A 47 -8.678 9.101 4.093 1.00 0.00 H new ATOM 0 HA CYS A 47 -10.999 8.171 2.541 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -9.203 10.586 2.369 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -10.338 10.157 1.105 1.00 0.00 H new ATOM 0 HG CYS A 47 -11.610 12.069 2.817 1.00 0.00 H new ATOM 703 N CYS A 48 -8.296 6.937 2.052 1.00 0.00 N ATOM 704 CA CYS A 48 -7.421 6.142 1.207 1.00 0.00 C ATOM 705 C CYS A 48 -7.493 4.687 1.674 1.00 0.00 C ATOM 706 O CYS A 48 -7.669 4.421 2.862 1.00 0.00 O ATOM 707 CB CYS A 48 -5.987 6.675 1.219 1.00 0.00 C ATOM 708 SG CYS A 48 -5.871 8.184 0.191 1.00 0.00 S ATOM 0 H CYS A 48 -8.206 6.754 3.051 1.00 0.00 H new ATOM 0 HA CYS A 48 -7.755 6.206 0.171 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -5.682 6.897 2.241 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -5.304 5.914 0.841 1.00 0.00 H new ATOM 0 HG CYS A 48 -5.416 9.166 0.911 1.00 0.00 H new ATOM 714 N VAL A 49 -7.354 3.783 0.716 1.00 0.00 N ATOM 715 CA VAL A 49 -7.401 2.362 1.014 1.00 0.00 C ATOM 716 C VAL A 49 -6.173 1.678 0.411 1.00 0.00 C ATOM 717 O VAL A 49 -5.539 2.217 -0.495 1.00 0.00 O ATOM 718 CB VAL A 49 -8.721 1.767 0.518 1.00 0.00 C ATOM 719 CG1 VAL A 49 -8.990 2.164 -0.934 1.00 0.00 C ATOM 720 CG2 VAL A 49 -8.732 0.246 0.682 1.00 0.00 C ATOM 0 H VAL A 49 -7.209 4.007 -0.268 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.369 2.196 2.091 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.524 2.176 1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.934 1.728 -1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -9.046 3.250 -1.010 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -8.182 1.797 -1.567 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.681 -0.152 0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.915 -0.188 0.106 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.608 -0.007 1.735 1.00 0.00 H new ATOM 730 N VAL A 50 -5.873 0.499 0.938 1.00 0.00 N ATOM 731 CA VAL A 50 -4.732 -0.264 0.464 1.00 0.00 C ATOM 732 C VAL A 50 -5.192 -1.670 0.073 1.00 0.00 C ATOM 733 O VAL A 50 -5.865 -2.346 0.850 1.00 0.00 O ATOM 734 CB VAL A 50 -3.628 -0.269 1.523 1.00 0.00 C ATOM 735 CG1 VAL A 50 -2.371 -0.969 1.002 1.00 0.00 C ATOM 736 CG2 VAL A 50 -3.311 1.152 1.991 1.00 0.00 C ATOM 0 H VAL A 50 -6.401 0.054 1.689 1.00 0.00 H new ATOM 0 HA VAL A 50 -4.306 0.199 -0.426 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.991 -0.831 2.383 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.602 -0.958 1.774 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.610 -2.000 0.742 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.004 -0.448 0.118 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.523 1.120 2.744 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.978 1.749 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.206 1.601 2.422 1.00 0.00 H new ATOM 746 N TYR A 51 -4.810 -2.069 -1.132 1.00 0.00 N ATOM 747 CA TYR A 51 -5.175 -3.383 -1.635 1.00 0.00 C ATOM 748 C TYR A 51 -3.954 -4.302 -1.704 1.00 0.00 C ATOM 749 O TYR A 51 -2.866 -3.868 -2.079 1.00 0.00 O ATOM 750 CB TYR A 51 -5.710 -3.158 -3.051 1.00 0.00 C ATOM 751 CG TYR A 51 -6.620 -1.936 -3.186 1.00 0.00 C ATOM 752 CD1 TYR A 51 -7.583 -1.684 -2.230 1.00 0.00 C ATOM 753 CD2 TYR A 51 -6.478 -1.085 -4.263 1.00 0.00 C ATOM 754 CE1 TYR A 51 -8.440 -0.534 -2.357 1.00 0.00 C ATOM 755 CE2 TYR A 51 -7.335 0.066 -4.389 1.00 0.00 C ATOM 756 CZ TYR A 51 -8.274 0.284 -3.430 1.00 0.00 C ATOM 757 OH TYR A 51 -9.083 1.371 -3.550 1.00 0.00 O ATOM 0 H TYR A 51 -4.252 -1.506 -1.774 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.908 -3.855 -0.981 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -4.867 -3.048 -3.733 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.261 -4.045 -3.365 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -7.694 -2.349 -1.387 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -5.725 -1.282 -5.011 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -9.198 -0.326 -1.616 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -7.234 0.741 -5.226 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.070 1.687 -4.477 1.00 0.00 H new ATOM 767 N ARG A 52 -4.175 -5.556 -1.337 1.00 0.00 N ATOM 768 CA ARG A 52 -3.107 -6.540 -1.352 1.00 0.00 C ATOM 769 C ARG A 52 -3.135 -7.334 -2.660 1.00 0.00 C ATOM 770 O ARG A 52 -4.205 -7.702 -3.144 1.00 0.00 O ATOM 771 CB ARG A 52 -3.232 -7.507 -0.174 1.00 0.00 C ATOM 772 CG ARG A 52 -3.408 -6.747 1.143 1.00 0.00 C ATOM 773 CD ARG A 52 -2.466 -7.289 2.219 1.00 0.00 C ATOM 774 NE ARG A 52 -2.492 -8.769 2.217 1.00 0.00 N ATOM 775 CZ ARG A 52 -3.445 -9.505 2.804 1.00 0.00 C ATOM 776 NH1 ARG A 52 -4.457 -8.903 3.444 1.00 0.00 N ATOM 777 NH2 ARG A 52 -3.388 -10.842 2.751 1.00 0.00 N ATOM 0 H ARG A 52 -5.079 -5.913 -1.027 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.162 -6.004 -1.268 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -4.083 -8.170 -0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -2.343 -8.136 -0.119 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -3.212 -5.687 0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.440 -6.833 1.482 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.451 -6.935 2.037 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.764 -6.913 3.198 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.736 -9.259 1.738 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.501 -7.885 3.484 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -5.183 -9.463 3.891 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -2.618 -11.301 2.263 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.114 -11.402 3.198 1.00 0.00 H new ATOM 791 N LEU A 53 -1.947 -7.575 -3.195 1.00 0.00 N ATOM 792 CA LEU A 53 -1.823 -8.318 -4.437 1.00 0.00 C ATOM 793 C LEU A 53 -1.806 -9.817 -4.130 1.00 0.00 C ATOM 794 O LEU A 53 -0.777 -10.362 -3.734 1.00 0.00 O ATOM 795 CB LEU A 53 -0.604 -7.840 -5.228 1.00 0.00 C ATOM 796 CG LEU A 53 -0.877 -6.798 -6.315 1.00 0.00 C ATOM 797 CD1 LEU A 53 -1.247 -7.471 -7.639 1.00 0.00 C ATOM 798 CD2 LEU A 53 -1.943 -5.799 -5.862 1.00 0.00 C ATOM 0 H LEU A 53 -1.062 -7.269 -2.791 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.684 -8.133 -5.079 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.119 -7.424 -4.527 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -0.134 -8.707 -5.693 1.00 0.00 H new ATOM 0 HG LEU A 53 0.040 -6.234 -6.486 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.436 -6.708 -8.394 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.425 -8.109 -7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.143 -8.076 -7.502 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.118 -5.070 -6.653 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.870 -6.329 -5.646 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.601 -5.285 -4.964 1.00 0.00 H new ATOM 810 N ILE A 54 -2.959 -10.441 -4.323 1.00 0.00 N ATOM 811 CA ILE A 54 -3.090 -11.866 -4.072 1.00 0.00 C ATOM 812 C ILE A 54 -3.568 -12.563 -5.347 1.00 0.00 C ATOM 813 O ILE A 54 -4.769 -12.647 -5.600 1.00 0.00 O ATOM 814 CB ILE A 54 -3.990 -12.116 -2.860 1.00 0.00 C ATOM 815 CG1 ILE A 54 -3.299 -11.682 -1.565 1.00 0.00 C ATOM 816 CG2 ILE A 54 -4.444 -13.576 -2.806 1.00 0.00 C ATOM 817 CD1 ILE A 54 -3.985 -10.455 -0.962 1.00 0.00 C ATOM 0 H ILE A 54 -3.811 -9.986 -4.650 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.122 -12.298 -3.816 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.886 -11.504 -2.968 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -3.316 -12.502 -0.847 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -2.252 -11.456 -1.766 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -5.082 -13.727 -1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.002 -13.817 -3.711 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -3.572 -14.226 -2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.474 -10.168 -0.043 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.945 -9.630 -1.673 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.025 -10.692 -0.740 1.00 0.00 H new ATOM 829 N LYS A 55 -2.604 -13.045 -6.117 1.00 0.00 N ATOM 830 CA LYS A 55 -2.912 -13.732 -7.360 1.00 0.00 C ATOM 831 C LYS A 55 -3.626 -12.766 -8.308 1.00 0.00 C ATOM 832 O LYS A 55 -4.562 -13.154 -9.006 1.00 0.00 O ATOM 833 CB LYS A 55 -3.697 -15.015 -7.083 1.00 0.00 C ATOM 834 CG LYS A 55 -2.954 -16.240 -7.621 1.00 0.00 C ATOM 835 CD LYS A 55 -3.219 -17.469 -6.749 1.00 0.00 C ATOM 836 CE LYS A 55 -2.177 -17.586 -5.635 1.00 0.00 C ATOM 837 NZ LYS A 55 -1.072 -18.479 -6.051 1.00 0.00 N ATOM 0 H LYS A 55 -1.609 -12.974 -5.904 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.995 -14.048 -7.858 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -3.856 -15.124 -6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -4.682 -14.950 -7.546 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -3.270 -16.441 -8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.884 -16.036 -7.652 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -4.216 -17.402 -6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -3.200 -18.368 -7.366 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.783 -16.599 -5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -2.645 -17.974 -4.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.373 -18.548 -5.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -1.450 -19.425 -6.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.615 -18.093 -6.902 1.00 0.00 H new ATOM 851 N GLY A 56 -3.158 -11.527 -8.303 1.00 0.00 N ATOM 852 CA GLY A 56 -3.740 -10.503 -9.153 1.00 0.00 C ATOM 853 C GLY A 56 -5.169 -10.175 -8.716 1.00 0.00 C ATOM 854 O GLY A 56 -6.086 -10.163 -9.536 1.00 0.00 O ATOM 0 H GLY A 56 -2.382 -11.209 -7.723 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.128 -9.602 -9.114 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.741 -10.843 -10.189 1.00 0.00 H new ATOM 858 N ARG A 57 -5.314 -9.916 -7.425 1.00 0.00 N ATOM 859 CA ARG A 57 -6.616 -9.588 -6.869 1.00 0.00 C ATOM 860 C ARG A 57 -6.465 -8.596 -5.714 1.00 0.00 C ATOM 861 O ARG A 57 -6.015 -8.964 -4.630 1.00 0.00 O ATOM 862 CB ARG A 57 -7.331 -10.843 -6.364 1.00 0.00 C ATOM 863 CG ARG A 57 -7.710 -11.763 -7.527 1.00 0.00 C ATOM 864 CD ARG A 57 -8.998 -11.291 -8.202 1.00 0.00 C ATOM 865 NE ARG A 57 -10.172 -11.889 -7.528 1.00 0.00 N ATOM 866 CZ ARG A 57 -11.420 -11.848 -8.016 1.00 0.00 C ATOM 867 NH1 ARG A 57 -11.664 -11.237 -9.183 1.00 0.00 N ATOM 868 NH2 ARG A 57 -12.424 -12.419 -7.335 1.00 0.00 N ATOM 0 H ARG A 57 -4.551 -9.927 -6.748 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.212 -9.139 -7.663 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.686 -11.378 -5.667 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.228 -10.558 -5.813 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.900 -11.785 -8.256 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.839 -12.782 -7.162 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.061 -10.204 -8.163 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.991 -11.572 -9.255 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.022 -12.362 -6.637 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.900 -10.803 -9.701 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.614 -11.206 -9.554 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -12.238 -12.884 -6.446 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -13.374 -12.388 -7.705 1.00 0.00 H new ATOM 882 N LYS A 58 -6.850 -7.358 -5.985 1.00 0.00 N ATOM 883 CA LYS A 58 -6.764 -6.310 -4.982 1.00 0.00 C ATOM 884 C LYS A 58 -7.569 -6.724 -3.749 1.00 0.00 C ATOM 885 O LYS A 58 -8.798 -6.662 -3.756 1.00 0.00 O ATOM 886 CB LYS A 58 -7.191 -4.966 -5.574 1.00 0.00 C ATOM 887 CG LYS A 58 -6.008 -4.257 -6.237 1.00 0.00 C ATOM 888 CD LYS A 58 -6.005 -4.493 -7.749 1.00 0.00 C ATOM 889 CE LYS A 58 -6.041 -3.167 -8.510 1.00 0.00 C ATOM 890 NZ LYS A 58 -6.659 -3.351 -9.843 1.00 0.00 N ATOM 0 H LYS A 58 -7.223 -7.057 -6.885 1.00 0.00 H new ATOM 0 HA LYS A 58 -5.732 -6.175 -4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.983 -5.123 -6.307 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.604 -4.334 -4.788 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.059 -3.188 -6.032 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.074 -4.620 -5.807 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.114 -5.055 -8.031 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.866 -5.100 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.605 -2.429 -7.940 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.029 -2.778 -8.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.676 -2.441 -10.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.105 -4.040 -10.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.632 -3.702 -9.729 1.00 0.00 H new ATOM 904 N THR A 59 -6.844 -7.135 -2.719 1.00 0.00 N ATOM 905 CA THR A 59 -7.476 -7.559 -1.481 1.00 0.00 C ATOM 906 C THR A 59 -7.334 -6.473 -0.412 1.00 0.00 C ATOM 907 O THR A 59 -6.275 -6.332 0.197 1.00 0.00 O ATOM 908 CB THR A 59 -6.863 -8.899 -1.071 1.00 0.00 C ATOM 909 OG1 THR A 59 -7.610 -9.863 -1.808 1.00 0.00 O ATOM 910 CG2 THR A 59 -7.144 -9.249 0.392 1.00 0.00 C ATOM 0 H THR A 59 -5.825 -7.183 -2.716 1.00 0.00 H new ATOM 0 HA THR A 59 -8.548 -7.704 -1.613 1.00 0.00 H new ATOM 0 HB THR A 59 -5.786 -8.871 -1.237 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.277 -10.762 -1.603 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.687 -10.209 0.631 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.725 -8.477 1.038 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.221 -9.310 0.551 1.00 0.00 H new ATOM 918 N VAL A 60 -8.417 -5.735 -0.216 1.00 0.00 N ATOM 919 CA VAL A 60 -8.426 -4.667 0.769 1.00 0.00 C ATOM 920 C VAL A 60 -7.659 -5.120 2.013 1.00 0.00 C ATOM 921 O VAL A 60 -7.833 -6.245 2.479 1.00 0.00 O ATOM 922 CB VAL A 60 -9.866 -4.249 1.074 1.00 0.00 C ATOM 923 CG1 VAL A 60 -9.905 -3.149 2.137 1.00 0.00 C ATOM 924 CG2 VAL A 60 -10.590 -3.807 -0.199 1.00 0.00 C ATOM 0 H VAL A 60 -9.294 -5.856 -0.723 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.921 -3.783 0.379 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.389 -5.118 1.472 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.940 -2.871 2.335 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.446 -3.514 3.056 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.357 -2.277 1.779 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.611 -3.515 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -10.066 -2.959 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.609 -4.632 -0.912 1.00 0.00 H new ATOM 934 N THR A 61 -6.827 -4.220 2.516 1.00 0.00 N ATOM 935 CA THR A 61 -6.032 -4.513 3.697 1.00 0.00 C ATOM 936 C THR A 61 -6.462 -3.621 4.863 1.00 0.00 C ATOM 937 O THR A 61 -7.074 -2.574 4.657 1.00 0.00 O ATOM 938 CB THR A 61 -4.557 -4.356 3.325 1.00 0.00 C ATOM 939 OG1 THR A 61 -3.883 -5.272 4.184 1.00 0.00 O ATOM 940 CG2 THR A 61 -3.994 -2.990 3.722 1.00 0.00 C ATOM 0 H THR A 61 -6.686 -3.287 2.127 1.00 0.00 H new ATOM 0 HA THR A 61 -6.189 -5.537 4.036 1.00 0.00 H new ATOM 0 HB THR A 61 -4.437 -4.499 2.251 1.00 0.00 H new ATOM 0 HG1 THR A 61 -2.921 -5.083 4.173 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.944 -2.932 3.435 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.553 -2.204 3.214 1.00 0.00 H new ATOM 0 HG23 THR A 61 -4.083 -2.859 4.800 1.00 0.00 H new ATOM 948 N ALA A 62 -6.126 -4.069 6.064 1.00 0.00 N ATOM 949 CA ALA A 62 -6.470 -3.325 7.264 1.00 0.00 C ATOM 950 C ALA A 62 -5.248 -2.536 7.737 1.00 0.00 C ATOM 951 O ALA A 62 -4.136 -3.061 7.761 1.00 0.00 O ATOM 952 CB ALA A 62 -6.990 -4.290 8.332 1.00 0.00 C ATOM 0 H ALA A 62 -5.619 -4.938 6.232 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.265 -2.609 7.057 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.248 -3.732 9.232 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.875 -4.804 7.958 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.218 -5.022 8.568 1.00 0.00 H new ATOM 958 N TRP A 63 -5.496 -1.286 8.102 1.00 0.00 N ATOM 959 CA TRP A 63 -4.429 -0.419 8.573 1.00 0.00 C ATOM 960 C TRP A 63 -3.806 -1.066 9.812 1.00 0.00 C ATOM 961 O TRP A 63 -2.584 -1.095 9.953 1.00 0.00 O ATOM 962 CB TRP A 63 -4.949 0.996 8.836 1.00 0.00 C ATOM 963 CG TRP A 63 -5.406 1.734 7.576 1.00 0.00 C ATOM 964 CD1 TRP A 63 -6.656 2.058 7.218 1.00 0.00 C ATOM 965 CD2 TRP A 63 -4.561 2.231 6.517 1.00 0.00 C ATOM 966 NE1 TRP A 63 -6.679 2.725 6.009 1.00 0.00 N ATOM 967 CE2 TRP A 63 -5.364 2.833 5.570 1.00 0.00 C ATOM 968 CE3 TRP A 63 -3.165 2.174 6.363 1.00 0.00 C ATOM 969 CZ2 TRP A 63 -4.864 3.424 4.403 1.00 0.00 C ATOM 970 CZ3 TRP A 63 -2.680 2.768 5.192 1.00 0.00 C ATOM 971 CH2 TRP A 63 -3.475 3.379 4.229 1.00 0.00 C ATOM 0 H TRP A 63 -6.420 -0.853 8.081 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.657 -0.309 7.812 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.783 0.942 9.536 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -4.164 1.577 9.320 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.535 1.827 7.802 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.507 3.074 5.527 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.517 1.708 7.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -5.514 3.889 3.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -1.613 2.750 5.025 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -3.024 3.817 3.351 1.00 0.00 H new ATOM 982 N ASP A 64 -4.674 -1.570 10.677 1.00 0.00 N ATOM 983 CA ASP A 64 -4.223 -2.215 11.899 1.00 0.00 C ATOM 984 C ASP A 64 -3.224 -3.320 11.549 1.00 0.00 C ATOM 985 O ASP A 64 -2.228 -3.504 12.246 1.00 0.00 O ATOM 986 CB ASP A 64 -5.394 -2.856 12.647 1.00 0.00 C ATOM 987 CG ASP A 64 -6.438 -1.872 13.178 1.00 0.00 C ATOM 988 OD1 ASP A 64 -6.334 -0.681 12.813 1.00 0.00 O ATOM 989 OD2 ASP A 64 -7.318 -2.333 13.937 1.00 0.00 O ATOM 0 H ASP A 64 -5.687 -1.545 10.556 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.763 -1.456 12.531 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -5.888 -3.562 11.980 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.999 -3.431 13.485 1.00 0.00 H new ATOM 994 N THR A 65 -3.526 -4.026 10.469 1.00 0.00 N ATOM 995 CA THR A 65 -2.667 -5.108 10.018 1.00 0.00 C ATOM 996 C THR A 65 -1.195 -4.733 10.206 1.00 0.00 C ATOM 997 O THR A 65 -0.851 -3.553 10.246 1.00 0.00 O ATOM 998 CB THR A 65 -3.032 -5.428 8.568 1.00 0.00 C ATOM 999 OG1 THR A 65 -4.457 -5.472 8.570 1.00 0.00 O ATOM 1000 CG2 THR A 65 -2.617 -6.843 8.158 1.00 0.00 C ATOM 0 H THR A 65 -4.353 -3.870 9.893 1.00 0.00 H new ATOM 0 HA THR A 65 -2.819 -6.009 10.613 1.00 0.00 H new ATOM 0 HB THR A 65 -2.557 -4.704 7.906 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.769 -5.931 9.378 1.00 0.00 H new ATOM 0 HG21 THR A 65 -2.899 -7.019 7.120 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.537 -6.951 8.264 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.118 -7.569 8.798 1.00 0.00 H new ATOM 1008 N ALA A 66 -0.366 -5.761 10.316 1.00 0.00 N ATOM 1009 CA ALA A 66 1.061 -5.554 10.498 1.00 0.00 C ATOM 1010 C ALA A 66 1.725 -5.378 9.131 1.00 0.00 C ATOM 1011 O ALA A 66 1.060 -5.457 8.099 1.00 0.00 O ATOM 1012 CB ALA A 66 1.650 -6.726 11.286 1.00 0.00 C ATOM 0 H ALA A 66 -0.655 -6.739 10.283 1.00 0.00 H new ATOM 0 HA ALA A 66 1.247 -4.647 11.074 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.720 -6.571 11.423 1.00 0.00 H new ATOM 0 HB2 ALA A 66 1.165 -6.790 12.260 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.485 -7.653 10.737 1.00 0.00 H new ATOM 1018 N ILE A 67 3.029 -5.144 9.168 1.00 0.00 N ATOM 1019 CA ILE A 67 3.790 -4.956 7.945 1.00 0.00 C ATOM 1020 C ILE A 67 4.880 -6.027 7.858 1.00 0.00 C ATOM 1021 O ILE A 67 5.756 -5.958 6.997 1.00 0.00 O ATOM 1022 CB ILE A 67 4.326 -3.526 7.861 1.00 0.00 C ATOM 1023 CG1 ILE A 67 4.799 -3.199 6.443 1.00 0.00 C ATOM 1024 CG2 ILE A 67 5.425 -3.290 8.900 1.00 0.00 C ATOM 1025 CD1 ILE A 67 3.661 -2.607 5.609 1.00 0.00 C ATOM 0 H ILE A 67 3.577 -5.080 10.026 1.00 0.00 H new ATOM 0 HA ILE A 67 3.147 -5.082 7.074 1.00 0.00 H new ATOM 0 HB ILE A 67 3.510 -2.842 8.094 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.628 -2.493 6.486 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.174 -4.103 5.963 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.789 -2.266 8.819 1.00 0.00 H new ATOM 0 HG22 ILE A 67 5.022 -3.454 9.899 1.00 0.00 H new ATOM 0 HG23 ILE A 67 6.248 -3.982 8.723 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.023 -2.383 4.606 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.843 -3.325 5.548 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.305 -1.690 6.079 1.00 0.00 H new ATOM 1037 N ALA A 68 4.789 -6.993 8.761 1.00 0.00 N ATOM 1038 CA ALA A 68 5.756 -8.077 8.797 1.00 0.00 C ATOM 1039 C ALA A 68 5.429 -9.083 7.691 1.00 0.00 C ATOM 1040 O ALA A 68 6.274 -9.381 6.849 1.00 0.00 O ATOM 1041 CB ALA A 68 5.754 -8.717 10.186 1.00 0.00 C ATOM 0 H ALA A 68 4.061 -7.047 9.473 1.00 0.00 H new ATOM 0 HA ALA A 68 6.762 -7.700 8.613 1.00 0.00 H new ATOM 0 HB1 ALA A 68 6.479 -9.530 10.213 1.00 0.00 H new ATOM 0 HB2 ALA A 68 6.020 -7.968 10.932 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.761 -9.109 10.404 1.00 0.00 H new ATOM 1047 N PRO A 69 4.168 -9.591 7.731 1.00 0.00 N ATOM 1048 CA PRO A 69 3.720 -10.558 6.743 1.00 0.00 C ATOM 1049 C PRO A 69 3.441 -9.879 5.400 1.00 0.00 C ATOM 1050 O PRO A 69 2.345 -10.001 4.855 1.00 0.00 O ATOM 1051 CB PRO A 69 2.483 -11.198 7.353 1.00 0.00 C ATOM 1052 CG PRO A 69 2.017 -10.249 8.444 1.00 0.00 C ATOM 1053 CD PRO A 69 3.140 -9.261 8.714 1.00 0.00 C ATOM 0 HA PRO A 69 4.474 -11.313 6.520 1.00 0.00 H new ATOM 0 HB2 PRO A 69 1.706 -11.341 6.602 1.00 0.00 H new ATOM 0 HB3 PRO A 69 2.714 -12.181 7.763 1.00 0.00 H new ATOM 0 HG2 PRO A 69 1.114 -9.724 8.133 1.00 0.00 H new ATOM 0 HG3 PRO A 69 1.769 -10.802 9.350 1.00 0.00 H new ATOM 0 HD2 PRO A 69 2.798 -8.232 8.600 1.00 0.00 H new ATOM 0 HD3 PRO A 69 3.519 -9.360 9.731 1.00 0.00 H new ATOM 1061 N LEU A 70 4.452 -9.180 4.905 1.00 0.00 N ATOM 1062 CA LEU A 70 4.330 -8.483 3.637 1.00 0.00 C ATOM 1063 C LEU A 70 5.612 -8.680 2.826 1.00 0.00 C ATOM 1064 O LEU A 70 6.019 -7.794 2.075 1.00 0.00 O ATOM 1065 CB LEU A 70 3.966 -7.014 3.865 1.00 0.00 C ATOM 1066 CG LEU A 70 2.512 -6.736 4.250 1.00 0.00 C ATOM 1067 CD1 LEU A 70 1.547 -7.482 3.326 1.00 0.00 C ATOM 1068 CD2 LEU A 70 2.262 -7.063 5.724 1.00 0.00 C ATOM 0 H LEU A 70 5.360 -9.082 5.360 1.00 0.00 H new ATOM 0 HA LEU A 70 3.513 -8.902 3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.611 -6.618 4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.193 -6.458 2.955 1.00 0.00 H new ATOM 0 HG LEU A 70 2.323 -5.670 4.120 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.520 -7.267 3.622 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.704 -7.157 2.297 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.729 -8.554 3.400 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.221 -6.856 5.971 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.475 -8.117 5.904 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.912 -6.449 6.348 1.00 0.00 H new ATOM 1080 N ASP A 71 6.214 -9.846 3.004 1.00 0.00 N ATOM 1081 CA ASP A 71 7.442 -10.171 2.299 1.00 0.00 C ATOM 1082 C ASP A 71 7.107 -10.586 0.865 1.00 0.00 C ATOM 1083 O ASP A 71 6.304 -11.492 0.649 1.00 0.00 O ATOM 1084 CB ASP A 71 8.172 -11.336 2.970 1.00 0.00 C ATOM 1085 CG ASP A 71 9.179 -12.067 2.080 1.00 0.00 C ATOM 1086 OD1 ASP A 71 9.968 -11.360 1.416 1.00 0.00 O ATOM 1087 OD2 ASP A 71 9.137 -13.316 2.083 1.00 0.00 O ATOM 0 H ASP A 71 5.874 -10.578 3.627 1.00 0.00 H new ATOM 0 HA ASP A 71 8.082 -9.289 2.314 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.694 -10.960 3.850 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.432 -12.055 3.322 1.00 0.00 H new ATOM 1092 N GLY A 72 7.739 -9.903 -0.078 1.00 0.00 N ATOM 1093 CA GLY A 72 7.518 -10.189 -1.485 1.00 0.00 C ATOM 1094 C GLY A 72 6.043 -10.015 -1.855 1.00 0.00 C ATOM 1095 O GLY A 72 5.309 -10.995 -1.974 1.00 0.00 O ATOM 0 H GLY A 72 8.404 -9.152 0.105 1.00 0.00 H new ATOM 0 HA2 GLY A 72 8.130 -9.525 -2.095 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.834 -11.208 -1.707 1.00 0.00 H new ATOM 1099 N GLU A 73 5.654 -8.761 -2.027 1.00 0.00 N ATOM 1100 CA GLU A 73 4.280 -8.445 -2.381 1.00 0.00 C ATOM 1101 C GLU A 73 4.191 -7.028 -2.951 1.00 0.00 C ATOM 1102 O GLU A 73 5.208 -6.357 -3.117 1.00 0.00 O ATOM 1103 CB GLU A 73 3.352 -8.612 -1.177 1.00 0.00 C ATOM 1104 CG GLU A 73 3.501 -7.441 -0.204 1.00 0.00 C ATOM 1105 CD GLU A 73 2.557 -6.295 -0.575 1.00 0.00 C ATOM 1106 OE1 GLU A 73 1.499 -6.601 -1.166 1.00 0.00 O ATOM 1107 OE2 GLU A 73 2.916 -5.140 -0.260 1.00 0.00 O ATOM 0 H GLU A 73 6.266 -7.951 -1.928 1.00 0.00 H new ATOM 0 HA GLU A 73 3.953 -9.145 -3.150 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.318 -8.678 -1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.580 -9.547 -0.665 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.289 -7.778 0.811 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.531 -7.085 -0.213 1.00 0.00 H new ATOM 1114 N GLU A 74 2.964 -6.615 -3.234 1.00 0.00 N ATOM 1115 CA GLU A 74 2.729 -5.290 -3.781 1.00 0.00 C ATOM 1116 C GLU A 74 1.339 -4.790 -3.382 1.00 0.00 C ATOM 1117 O GLU A 74 0.329 -5.361 -3.790 1.00 0.00 O ATOM 1118 CB GLU A 74 2.896 -5.287 -5.302 1.00 0.00 C ATOM 1119 CG GLU A 74 4.303 -4.832 -5.698 1.00 0.00 C ATOM 1120 CD GLU A 74 4.710 -5.423 -7.049 1.00 0.00 C ATOM 1121 OE1 GLU A 74 4.562 -6.655 -7.197 1.00 0.00 O ATOM 1122 OE2 GLU A 74 5.161 -4.629 -7.903 1.00 0.00 O ATOM 0 H GLU A 74 2.123 -7.175 -3.095 1.00 0.00 H new ATOM 0 HA GLU A 74 3.472 -4.610 -3.365 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.709 -6.287 -5.694 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.156 -4.625 -5.752 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.337 -3.744 -5.748 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.017 -5.138 -4.933 1.00 0.00 H new ATOM 1129 N LEU A 75 1.332 -3.728 -2.589 1.00 0.00 N ATOM 1130 CA LEU A 75 0.083 -3.145 -2.130 1.00 0.00 C ATOM 1131 C LEU A 75 -0.282 -1.961 -3.026 1.00 0.00 C ATOM 1132 O LEU A 75 0.598 -1.298 -3.575 1.00 0.00 O ATOM 1133 CB LEU A 75 0.172 -2.788 -0.645 1.00 0.00 C ATOM 1134 CG LEU A 75 0.216 -3.968 0.328 1.00 0.00 C ATOM 1135 CD1 LEU A 75 1.008 -3.612 1.587 1.00 0.00 C ATOM 1136 CD2 LEU A 75 -1.195 -4.460 0.658 1.00 0.00 C ATOM 0 H LEU A 75 2.172 -3.256 -2.253 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.728 -3.869 -2.212 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.065 -2.182 -0.490 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.685 -2.164 -0.390 1.00 0.00 H new ATOM 0 HG LEU A 75 0.739 -4.792 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.023 -4.468 2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.029 -3.348 1.312 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.537 -2.765 2.086 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.135 -5.299 1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.765 -3.651 1.116 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.692 -4.781 -0.258 1.00 0.00 H new ATOM 1148 N ILE A 76 -1.581 -1.729 -3.148 1.00 0.00 N ATOM 1149 CA ILE A 76 -2.072 -0.636 -3.969 1.00 0.00 C ATOM 1150 C ILE A 76 -2.834 0.356 -3.087 1.00 0.00 C ATOM 1151 O ILE A 76 -3.905 0.039 -2.572 1.00 0.00 O ATOM 1152 CB ILE A 76 -2.895 -1.174 -5.141 1.00 0.00 C ATOM 1153 CG1 ILE A 76 -1.995 -1.844 -6.181 1.00 0.00 C ATOM 1154 CG2 ILE A 76 -3.759 -0.071 -5.756 1.00 0.00 C ATOM 1155 CD1 ILE A 76 -2.827 -2.564 -7.244 1.00 0.00 C ATOM 0 H ILE A 76 -2.308 -2.280 -2.692 1.00 0.00 H new ATOM 0 HA ILE A 76 -1.240 -0.092 -4.417 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.572 -1.939 -4.761 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.362 -1.095 -6.656 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -1.332 -2.556 -5.689 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -4.334 -0.480 -6.587 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -4.441 0.321 -5.001 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -3.119 0.733 -6.119 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -2.163 -3.032 -7.971 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.441 -3.329 -6.769 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.471 -1.845 -7.751 1.00 0.00 H new ATOM 1167 N VAL A 77 -2.251 1.537 -2.940 1.00 0.00 N ATOM 1168 CA VAL A 77 -2.862 2.576 -2.129 1.00 0.00 C ATOM 1169 C VAL A 77 -3.696 3.493 -3.026 1.00 0.00 C ATOM 1170 O VAL A 77 -3.150 4.246 -3.830 1.00 0.00 O ATOM 1171 CB VAL A 77 -1.784 3.328 -1.344 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -2.410 4.363 -0.407 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -0.892 2.356 -0.570 1.00 0.00 C ATOM 0 H VAL A 77 -1.363 1.797 -3.369 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.537 2.139 -1.393 1.00 0.00 H new ATOM 0 HB VAL A 77 -1.157 3.860 -2.060 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.623 4.883 0.139 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.983 5.083 -0.991 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.071 3.861 0.300 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -0.135 2.916 -0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.500 1.784 0.131 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -0.405 1.675 -1.268 1.00 0.00 H new ATOM 1183 N GLU A 78 -5.007 3.398 -2.858 1.00 0.00 N ATOM 1184 CA GLU A 78 -5.923 4.209 -3.642 1.00 0.00 C ATOM 1185 C GLU A 78 -6.606 5.250 -2.752 1.00 0.00 C ATOM 1186 O GLU A 78 -6.624 5.111 -1.530 1.00 0.00 O ATOM 1187 CB GLU A 78 -6.956 3.335 -4.355 1.00 0.00 C ATOM 1188 CG GLU A 78 -6.606 3.169 -5.836 1.00 0.00 C ATOM 1189 CD GLU A 78 -7.870 3.109 -6.695 1.00 0.00 C ATOM 1190 OE1 GLU A 78 -8.875 2.563 -6.189 1.00 0.00 O ATOM 1191 OE2 GLU A 78 -7.804 3.610 -7.838 1.00 0.00 O ATOM 0 H GLU A 78 -5.457 2.772 -2.190 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.350 4.733 -4.406 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.002 2.357 -3.877 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.945 3.783 -4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.980 4.000 -6.161 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.024 2.258 -5.976 1.00 0.00 H new ATOM 1198 N VAL A 79 -7.150 6.269 -3.400 1.00 0.00 N ATOM 1199 CA VAL A 79 -7.833 7.333 -2.683 1.00 0.00 C ATOM 1200 C VAL A 79 -9.337 7.237 -2.947 1.00 0.00 C ATOM 1201 O VAL A 79 -9.770 7.246 -4.098 1.00 0.00 O ATOM 1202 CB VAL A 79 -7.242 8.690 -3.073 1.00 0.00 C ATOM 1203 CG1 VAL A 79 -7.079 8.801 -4.590 1.00 0.00 C ATOM 1204 CG2 VAL A 79 -8.096 9.836 -2.528 1.00 0.00 C ATOM 0 H VAL A 79 -7.132 6.381 -4.414 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.685 7.226 -1.608 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.252 8.767 -2.623 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.657 9.774 -4.840 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.411 8.015 -4.943 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.052 8.693 -5.069 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.654 10.789 -2.819 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.104 9.764 -2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.139 9.773 -1.441 1.00 0.00 H new ATOM 1214 N LEU A 80 -10.091 7.148 -1.862 1.00 0.00 N ATOM 1215 CA LEU A 80 -11.538 7.051 -1.962 1.00 0.00 C ATOM 1216 C LEU A 80 -12.091 8.345 -2.560 1.00 0.00 C ATOM 1217 O LEU A 80 -12.741 8.322 -3.605 1.00 0.00 O ATOM 1218 CB LEU A 80 -12.146 6.691 -0.605 1.00 0.00 C ATOM 1219 CG LEU A 80 -11.740 5.334 -0.026 1.00 0.00 C ATOM 1220 CD1 LEU A 80 -12.106 5.239 1.456 1.00 0.00 C ATOM 1221 CD2 LEU A 80 -12.345 4.189 -0.841 1.00 0.00 C ATOM 0 H LEU A 80 -9.728 7.141 -0.909 1.00 0.00 H new ATOM 0 HA LEU A 80 -11.820 6.242 -2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -11.871 7.466 0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.232 6.714 -0.698 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.656 5.242 -0.096 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.807 4.265 1.843 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -11.590 6.023 2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -13.183 5.361 1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -12.042 3.235 -0.409 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -13.432 4.265 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -11.993 4.250 -1.871 1.00 0.00 H new ATOM 1233 N SER A 81 -11.814 9.444 -1.873 1.00 0.00 N ATOM 1234 CA SER A 81 -12.276 10.745 -2.324 1.00 0.00 C ATOM 1235 C SER A 81 -13.792 10.853 -2.145 1.00 0.00 C ATOM 1236 O SER A 81 -14.274 11.711 -1.407 1.00 0.00 O ATOM 1237 CB SER A 81 -11.895 10.989 -3.786 1.00 0.00 C ATOM 1238 OG SER A 81 -11.751 12.377 -4.075 1.00 0.00 O ATOM 0 H SER A 81 -11.275 9.460 -1.007 1.00 0.00 H new ATOM 0 HA SER A 81 -11.790 11.509 -1.718 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.961 10.473 -4.008 1.00 0.00 H new ATOM 0 HB3 SER A 81 -12.658 10.560 -4.436 1.00 0.00 H new ATOM 0 HG SER A 81 -11.506 12.491 -5.017 1.00 0.00 H new ATOM 1244 N GLY A 82 -14.501 9.970 -2.833 1.00 0.00 N ATOM 1245 CA GLY A 82 -15.952 9.955 -2.759 1.00 0.00 C ATOM 1246 C GLY A 82 -16.544 8.999 -3.796 1.00 0.00 C ATOM 1247 O GLY A 82 -15.821 8.462 -4.635 1.00 0.00 O ATOM 0 H GLY A 82 -14.098 9.260 -3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -16.266 9.653 -1.760 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -16.339 10.961 -2.924 1.00 0.00 H new ATOM 1251 N PRO A 83 -17.887 8.809 -3.702 1.00 0.00 N ATOM 1252 CA PRO A 83 -18.585 7.926 -4.622 1.00 0.00 C ATOM 1253 C PRO A 83 -18.738 8.578 -5.998 1.00 0.00 C ATOM 1254 O PRO A 83 -19.834 8.987 -6.376 1.00 0.00 O ATOM 1255 CB PRO A 83 -19.917 7.633 -3.952 1.00 0.00 C ATOM 1256 CG PRO A 83 -20.109 8.724 -2.910 1.00 0.00 C ATOM 1257 CD PRO A 83 -18.775 9.428 -2.722 1.00 0.00 C ATOM 0 HA PRO A 83 -18.039 7.002 -4.814 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -20.729 7.640 -4.679 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -19.912 6.647 -3.488 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -20.872 9.432 -3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -20.451 8.296 -1.968 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -18.866 10.501 -2.892 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -18.398 9.297 -1.708 1.00 0.00 H new ATOM 1265 N SER A 84 -17.622 8.655 -6.708 1.00 0.00 N ATOM 1266 CA SER A 84 -17.618 9.250 -8.034 1.00 0.00 C ATOM 1267 C SER A 84 -18.065 10.711 -7.953 1.00 0.00 C ATOM 1268 O SER A 84 -19.230 11.022 -8.199 1.00 0.00 O ATOM 1269 CB SER A 84 -18.523 8.470 -8.990 1.00 0.00 C ATOM 1270 OG SER A 84 -18.243 7.073 -8.970 1.00 0.00 O ATOM 0 H SER A 84 -16.714 8.315 -6.390 1.00 0.00 H new ATOM 0 HA SER A 84 -16.601 9.209 -8.425 1.00 0.00 H new ATOM 0 HB2 SER A 84 -19.565 8.635 -8.718 1.00 0.00 H new ATOM 0 HB3 SER A 84 -18.394 8.851 -10.003 1.00 0.00 H new ATOM 0 HG SER A 84 -18.843 6.610 -9.592 1.00 0.00 H new ATOM 1276 N SER A 85 -17.117 11.568 -7.607 1.00 0.00 N ATOM 1277 CA SER A 85 -17.398 12.989 -7.491 1.00 0.00 C ATOM 1278 C SER A 85 -17.210 13.673 -8.846 1.00 0.00 C ATOM 1279 O SER A 85 -16.101 13.713 -9.377 1.00 0.00 O ATOM 1280 CB SER A 85 -16.503 13.644 -6.437 1.00 0.00 C ATOM 1281 OG SER A 85 -17.250 14.437 -5.519 1.00 0.00 O ATOM 0 H SER A 85 -16.153 11.306 -7.403 1.00 0.00 H new ATOM 0 HA SER A 85 -18.434 13.107 -7.173 1.00 0.00 H new ATOM 0 HB2 SER A 85 -15.961 12.872 -5.891 1.00 0.00 H new ATOM 0 HB3 SER A 85 -15.758 14.267 -6.931 1.00 0.00 H new ATOM 0 HG SER A 85 -16.642 14.836 -4.862 1.00 0.00 H new ATOM 1287 N GLY A 86 -18.310 14.194 -9.369 1.00 0.00 N ATOM 1288 CA GLY A 86 -18.280 14.874 -10.652 1.00 0.00 C ATOM 1289 C GLY A 86 -19.650 15.467 -10.991 1.00 0.00 C ATOM 1290 O GLY A 86 -19.778 16.238 -11.941 1.00 0.00 O ATOM 0 H GLY A 86 -19.228 14.159 -8.927 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -17.532 15.667 -10.630 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -17.980 14.174 -11.432 1.00 0.00 H new TER 1294 GLY A 86