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 -137:sc= -0.9 (180deg=-0.621) USER MOD Set 1.2: A 33 SER OG : rot -60:sc= -0.997 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 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -1.96 X(o=-2,f=-1.9) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.243 X(o=-0.24,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= -5.01! K(o=-5!,f=-0.8) USER MOD Single : A 45 GLN : amide:sc= -0.994 X(o=-0.99,f=-0.9) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 17:sc= -6.34! USER MOD Single : A 51 TYR OH : rot -164:sc= -0.795 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 -140:sc= -2.99 USER MOD Single : A 65 THR OG1 : rot -161:sc= -5.28! USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 38:sc= 0.0843 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.880 -21.997 -3.993 1.00 0.00 N ATOM 2 CA GLY A 1 8.417 -20.778 -3.351 1.00 0.00 C ATOM 3 C GLY A 1 9.354 -19.608 -3.657 1.00 0.00 C ATOM 4 O GLY A 1 8.996 -18.702 -4.408 1.00 0.00 O ATOM 0 H1 GLY A 1 8.228 -22.776 -3.770 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.912 -21.856 -5.023 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.832 -22.232 -3.646 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.410 -20.542 -3.695 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.359 -20.930 -2.273 1.00 0.00 H new ATOM 8 N SER A 2 10.535 -19.665 -3.060 1.00 0.00 N ATOM 9 CA SER A 2 11.526 -18.621 -3.259 1.00 0.00 C ATOM 10 C SER A 2 11.950 -18.576 -4.728 1.00 0.00 C ATOM 11 O SER A 2 12.461 -19.560 -5.261 1.00 0.00 O ATOM 12 CB SER A 2 12.745 -18.839 -2.361 1.00 0.00 C ATOM 13 OG SER A 2 12.381 -18.972 -0.990 1.00 0.00 O ATOM 0 H SER A 2 10.828 -20.418 -2.438 1.00 0.00 H new ATOM 0 HA SER A 2 11.076 -17.666 -2.988 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.277 -19.734 -2.683 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.433 -18.001 -2.474 1.00 0.00 H new ATOM 0 HG SER A 2 13.187 -19.111 -0.450 1.00 0.00 H new ATOM 19 N SER A 3 11.724 -17.424 -5.342 1.00 0.00 N ATOM 20 CA SER A 3 12.077 -17.238 -6.739 1.00 0.00 C ATOM 21 C SER A 3 12.722 -15.865 -6.938 1.00 0.00 C ATOM 22 O SER A 3 13.860 -15.771 -7.396 1.00 0.00 O ATOM 23 CB SER A 3 10.849 -17.382 -7.641 1.00 0.00 C ATOM 24 OG SER A 3 11.201 -17.794 -8.959 1.00 0.00 O ATOM 0 H SER A 3 11.300 -16.610 -4.897 1.00 0.00 H new ATOM 0 HA SER A 3 12.792 -18.012 -7.017 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.162 -18.108 -7.205 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.320 -16.430 -7.688 1.00 0.00 H new ATOM 0 HG SER A 3 10.390 -17.876 -9.503 1.00 0.00 H new ATOM 30 N GLY A 4 11.969 -14.835 -6.582 1.00 0.00 N ATOM 31 CA GLY A 4 12.453 -13.472 -6.716 1.00 0.00 C ATOM 32 C GLY A 4 13.015 -12.957 -5.389 1.00 0.00 C ATOM 33 O GLY A 4 14.213 -12.704 -5.274 1.00 0.00 O ATOM 0 H GLY A 4 11.027 -14.917 -6.201 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.226 -13.431 -7.483 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.641 -12.825 -7.047 1.00 0.00 H new ATOM 37 N SER A 5 12.123 -12.818 -4.420 1.00 0.00 N ATOM 38 CA SER A 5 12.514 -12.338 -3.105 1.00 0.00 C ATOM 39 C SER A 5 12.808 -10.837 -3.162 1.00 0.00 C ATOM 40 O SER A 5 12.175 -10.050 -2.459 1.00 0.00 O ATOM 41 CB SER A 5 13.734 -13.098 -2.582 1.00 0.00 C ATOM 42 OG SER A 5 13.562 -13.521 -1.233 1.00 0.00 O ATOM 0 H SER A 5 11.130 -13.029 -4.519 1.00 0.00 H new ATOM 0 HA SER A 5 11.687 -12.514 -2.417 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.918 -13.967 -3.214 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.616 -12.461 -2.652 1.00 0.00 H new ATOM 0 HG SER A 5 14.362 -14.004 -0.937 1.00 0.00 H new ATOM 48 N SER A 6 13.768 -10.486 -4.005 1.00 0.00 N ATOM 49 CA SER A 6 14.154 -9.094 -4.162 1.00 0.00 C ATOM 50 C SER A 6 14.682 -8.544 -2.836 1.00 0.00 C ATOM 51 O SER A 6 14.560 -9.193 -1.798 1.00 0.00 O ATOM 52 CB SER A 6 12.977 -8.250 -4.656 1.00 0.00 C ATOM 53 OG SER A 6 12.672 -8.508 -6.024 1.00 0.00 O ATOM 0 H SER A 6 14.290 -11.142 -4.587 1.00 0.00 H new ATOM 0 HA SER A 6 14.945 -9.040 -4.910 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.100 -8.458 -4.044 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.211 -7.193 -4.530 1.00 0.00 H new ATOM 0 HG SER A 6 11.914 -7.951 -6.301 1.00 0.00 H new ATOM 59 N GLY A 7 15.257 -7.353 -2.913 1.00 0.00 N ATOM 60 CA GLY A 7 15.804 -6.708 -1.731 1.00 0.00 C ATOM 61 C GLY A 7 14.785 -6.699 -0.590 1.00 0.00 C ATOM 62 O GLY A 7 13.646 -7.128 -0.767 1.00 0.00 O ATOM 0 H GLY A 7 15.356 -6.818 -3.775 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.707 -7.229 -1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.095 -5.685 -1.972 1.00 0.00 H new ATOM 66 N GLY A 8 15.232 -6.206 0.556 1.00 0.00 N ATOM 67 CA GLY A 8 14.373 -6.136 1.726 1.00 0.00 C ATOM 68 C GLY A 8 13.453 -4.915 1.658 1.00 0.00 C ATOM 69 O GLY A 8 13.517 -4.037 2.516 1.00 0.00 O ATOM 0 H GLY A 8 16.178 -5.851 0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.774 -7.044 1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 8 14.984 -6.086 2.628 1.00 0.00 H new ATOM 73 N THR A 9 12.619 -4.899 0.628 1.00 0.00 N ATOM 74 CA THR A 9 11.687 -3.801 0.437 1.00 0.00 C ATOM 75 C THR A 9 10.444 -4.281 -0.315 1.00 0.00 C ATOM 76 O THR A 9 10.405 -5.411 -0.799 1.00 0.00 O ATOM 77 CB THR A 9 12.430 -2.670 -0.277 1.00 0.00 C ATOM 78 OG1 THR A 9 13.166 -3.331 -1.303 1.00 0.00 O ATOM 79 CG2 THR A 9 13.507 -2.031 0.602 1.00 0.00 C ATOM 0 H THR A 9 12.570 -5.629 -0.083 1.00 0.00 H new ATOM 0 HA THR A 9 11.324 -3.420 1.391 1.00 0.00 H new ATOM 0 HB THR A 9 11.716 -1.907 -0.589 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.676 -2.671 -1.817 1.00 0.00 H new ATOM 0 HG21 THR A 9 14.004 -1.235 0.048 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.046 -1.616 1.498 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.239 -2.786 0.887 1.00 0.00 H new ATOM 87 N VAL A 10 9.459 -3.398 -0.389 1.00 0.00 N ATOM 88 CA VAL A 10 8.218 -3.718 -1.074 1.00 0.00 C ATOM 89 C VAL A 10 7.772 -2.511 -1.902 1.00 0.00 C ATOM 90 O VAL A 10 7.945 -1.368 -1.482 1.00 0.00 O ATOM 91 CB VAL A 10 7.164 -4.171 -0.062 1.00 0.00 C ATOM 92 CG1 VAL A 10 5.816 -4.411 -0.745 1.00 0.00 C ATOM 93 CG2 VAL A 10 7.627 -5.420 0.690 1.00 0.00 C ATOM 0 H VAL A 10 9.495 -2.462 0.014 1.00 0.00 H new ATOM 0 HA VAL A 10 8.365 -4.549 -1.764 1.00 0.00 H new ATOM 0 HB VAL A 10 7.033 -3.371 0.666 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.084 -4.732 -0.003 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.476 -3.488 -1.214 1.00 0.00 H new ATOM 0 HG13 VAL A 10 5.926 -5.185 -1.505 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.859 -5.721 1.403 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.800 -6.229 -0.020 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.552 -5.201 1.223 1.00 0.00 H new ATOM 103 N LYS A 11 7.206 -2.807 -3.063 1.00 0.00 N ATOM 104 CA LYS A 11 6.734 -1.760 -3.953 1.00 0.00 C ATOM 105 C LYS A 11 5.324 -1.338 -3.535 1.00 0.00 C ATOM 106 O LYS A 11 4.431 -2.175 -3.419 1.00 0.00 O ATOM 107 CB LYS A 11 6.834 -2.212 -5.412 1.00 0.00 C ATOM 108 CG LYS A 11 8.162 -1.775 -6.032 1.00 0.00 C ATOM 109 CD LYS A 11 8.244 -2.189 -7.502 1.00 0.00 C ATOM 110 CE LYS A 11 9.380 -3.188 -7.728 1.00 0.00 C ATOM 111 NZ LYS A 11 9.028 -4.139 -8.806 1.00 0.00 N ATOM 0 H LYS A 11 7.064 -3.756 -3.408 1.00 0.00 H new ATOM 0 HA LYS A 11 7.368 -0.877 -3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.742 -3.297 -5.467 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.006 -1.793 -5.984 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.268 -0.693 -5.949 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.989 -2.219 -5.479 1.00 0.00 H new ATOM 0 HD2 LYS A 11 7.298 -2.633 -7.812 1.00 0.00 H new ATOM 0 HD3 LYS A 11 8.401 -1.307 -8.123 1.00 0.00 H new ATOM 0 HE2 LYS A 11 10.294 -2.655 -7.990 1.00 0.00 H new ATOM 0 HE3 LYS A 11 9.582 -3.733 -6.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 9.810 -4.810 -8.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 8.168 -4.660 -8.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 8.858 -3.616 -9.689 1.00 0.00 H new ATOM 125 N VAL A 12 5.169 -0.040 -3.321 1.00 0.00 N ATOM 126 CA VAL A 12 3.883 0.503 -2.918 1.00 0.00 C ATOM 127 C VAL A 12 3.357 1.427 -4.018 1.00 0.00 C ATOM 128 O VAL A 12 3.925 2.489 -4.267 1.00 0.00 O ATOM 129 CB VAL A 12 4.011 1.201 -1.562 1.00 0.00 C ATOM 130 CG1 VAL A 12 2.736 1.977 -1.222 1.00 0.00 C ATOM 131 CG2 VAL A 12 4.353 0.198 -0.459 1.00 0.00 C ATOM 0 H VAL A 12 5.912 0.651 -3.419 1.00 0.00 H new ATOM 0 HA VAL A 12 3.154 -0.297 -2.789 1.00 0.00 H new ATOM 0 HB VAL A 12 4.831 1.916 -1.630 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.853 2.463 -0.254 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.554 2.731 -1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.891 1.289 -1.182 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.438 0.720 0.494 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.565 -0.552 -0.392 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.300 -0.290 -0.691 1.00 0.00 H new ATOM 141 N TYR A 13 2.276 0.989 -4.648 1.00 0.00 N ATOM 142 CA TYR A 13 1.667 1.763 -5.717 1.00 0.00 C ATOM 143 C TYR A 13 0.747 2.847 -5.152 1.00 0.00 C ATOM 144 O TYR A 13 -0.265 2.541 -4.523 1.00 0.00 O ATOM 145 CB TYR A 13 0.831 0.773 -6.531 1.00 0.00 C ATOM 146 CG TYR A 13 1.659 -0.154 -7.423 1.00 0.00 C ATOM 147 CD1 TYR A 13 2.623 0.373 -8.259 1.00 0.00 C ATOM 148 CD2 TYR A 13 1.441 -1.516 -7.393 1.00 0.00 C ATOM 149 CE1 TYR A 13 3.401 -0.499 -9.100 1.00 0.00 C ATOM 150 CE2 TYR A 13 2.220 -2.388 -8.233 1.00 0.00 C ATOM 151 CZ TYR A 13 3.162 -1.837 -9.045 1.00 0.00 C ATOM 152 OH TYR A 13 3.897 -2.661 -9.839 1.00 0.00 O ATOM 0 H TYR A 13 1.806 0.108 -4.439 1.00 0.00 H new ATOM 0 HA TYR A 13 2.431 2.257 -6.318 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.237 0.167 -5.847 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.131 1.330 -7.154 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.794 1.439 -8.282 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.686 -1.928 -6.740 1.00 0.00 H new ATOM 0 HE1 TYR A 13 4.157 -0.100 -9.760 1.00 0.00 H new ATOM 0 HE2 TYR A 13 2.060 -3.456 -8.219 1.00 0.00 H new ATOM 0 HH TYR A 13 3.619 -3.589 -9.694 1.00 0.00 H new ATOM 162 N LEU A 14 1.130 4.091 -5.398 1.00 0.00 N ATOM 163 CA LEU A 14 0.352 5.222 -4.922 1.00 0.00 C ATOM 164 C LEU A 14 -0.743 5.547 -5.940 1.00 0.00 C ATOM 165 O LEU A 14 -0.691 5.088 -7.081 1.00 0.00 O ATOM 166 CB LEU A 14 1.267 6.406 -4.603 1.00 0.00 C ATOM 167 CG LEU A 14 1.809 6.469 -3.174 1.00 0.00 C ATOM 168 CD1 LEU A 14 3.019 7.401 -3.087 1.00 0.00 C ATOM 169 CD2 LEU A 14 0.708 6.866 -2.188 1.00 0.00 C ATOM 0 H LEU A 14 1.969 4.341 -5.921 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.147 4.974 -3.985 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.113 6.382 -5.290 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.720 7.327 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 14 2.150 5.472 -2.893 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.385 7.428 -2.061 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.808 7.035 -3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.728 8.405 -3.394 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.119 6.904 -1.179 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.315 7.847 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.096 6.131 -2.225 1.00 0.00 H new ATOM 181 N PRO A 15 -1.734 6.356 -5.480 1.00 0.00 N ATOM 182 CA PRO A 15 -2.839 6.748 -6.338 1.00 0.00 C ATOM 183 C PRO A 15 -2.398 7.806 -7.352 1.00 0.00 C ATOM 184 O PRO A 15 -3.171 8.193 -8.227 1.00 0.00 O ATOM 185 CB PRO A 15 -3.916 7.247 -5.389 1.00 0.00 C ATOM 186 CG PRO A 15 -3.208 7.553 -4.079 1.00 0.00 C ATOM 187 CD PRO A 15 -1.828 6.918 -4.136 1.00 0.00 C ATOM 0 HA PRO A 15 -3.213 5.924 -6.945 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.405 8.137 -5.786 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -4.691 6.494 -5.247 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -3.127 8.630 -3.931 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -3.776 7.158 -3.237 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -1.045 7.656 -3.960 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -1.716 6.146 -3.375 1.00 0.00 H new ATOM 195 N ASN A 16 -1.157 8.244 -7.200 1.00 0.00 N ATOM 196 CA ASN A 16 -0.604 9.250 -8.091 1.00 0.00 C ATOM 197 C ASN A 16 0.116 8.558 -9.250 1.00 0.00 C ATOM 198 O ASN A 16 1.127 9.055 -9.743 1.00 0.00 O ATOM 199 CB ASN A 16 0.413 10.132 -7.363 1.00 0.00 C ATOM 200 CG ASN A 16 0.170 11.612 -7.665 1.00 0.00 C ATOM 201 OD1 ASN A 16 -0.578 12.296 -6.986 1.00 0.00 O ATOM 202 ND2 ASN A 16 0.843 12.066 -8.718 1.00 0.00 N ATOM 0 H ASN A 16 -0.519 7.921 -6.473 1.00 0.00 H new ATOM 0 HA ASN A 16 -1.426 9.869 -8.452 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.345 9.960 -6.289 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.423 9.856 -7.667 1.00 0.00 H new ATOM 0 HD21 ASN A 16 0.750 13.041 -9.001 1.00 0.00 H new ATOM 0 HD22 ASN A 16 1.453 11.439 -9.243 1.00 0.00 H new ATOM 209 N LYS A 17 -0.434 7.421 -9.651 1.00 0.00 N ATOM 210 CA LYS A 17 0.143 6.655 -10.743 1.00 0.00 C ATOM 211 C LYS A 17 1.644 6.484 -10.503 1.00 0.00 C ATOM 212 O LYS A 17 2.406 6.269 -11.445 1.00 0.00 O ATOM 213 CB LYS A 17 -0.195 7.302 -12.088 1.00 0.00 C ATOM 214 CG LYS A 17 0.494 8.661 -12.232 1.00 0.00 C ATOM 215 CD LYS A 17 0.472 9.136 -13.686 1.00 0.00 C ATOM 216 CE LYS A 17 1.573 10.167 -13.942 1.00 0.00 C ATOM 217 NZ LYS A 17 1.680 10.463 -15.388 1.00 0.00 N ATOM 0 H LYS A 17 -1.273 7.012 -9.239 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.290 5.655 -10.778 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.116 6.645 -12.900 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -1.274 7.427 -12.175 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -0.005 9.394 -11.599 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.525 8.589 -11.885 1.00 0.00 H new ATOM 0 HD2 LYS A 17 0.604 8.284 -14.353 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -0.500 9.572 -13.915 1.00 0.00 H new ATOM 0 HE2 LYS A 17 1.356 11.083 -13.392 1.00 0.00 H new ATOM 0 HE3 LYS A 17 2.526 9.790 -13.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 2.432 11.164 -15.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.908 9.590 -15.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.775 10.843 -15.732 1.00 0.00 H new ATOM 231 N GLN A 18 2.024 6.586 -9.238 1.00 0.00 N ATOM 232 CA GLN A 18 3.420 6.444 -8.863 1.00 0.00 C ATOM 233 C GLN A 18 3.602 5.239 -7.938 1.00 0.00 C ATOM 234 O GLN A 18 2.630 4.576 -7.578 1.00 0.00 O ATOM 235 CB GLN A 18 3.943 7.723 -8.205 1.00 0.00 C ATOM 236 CG GLN A 18 4.518 8.682 -9.250 1.00 0.00 C ATOM 237 CD GLN A 18 6.035 8.810 -9.100 1.00 0.00 C ATOM 238 OE1 GLN A 18 6.543 9.569 -8.290 1.00 0.00 O ATOM 239 NE2 GLN A 18 6.728 8.029 -9.924 1.00 0.00 N ATOM 0 H GLN A 18 1.389 6.765 -8.460 1.00 0.00 H new ATOM 0 HA GLN A 18 4.003 6.274 -9.768 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.135 8.213 -7.662 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.712 7.472 -7.474 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.277 8.323 -10.250 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.054 9.663 -9.143 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.240 7.417 -10.578 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.748 8.042 -9.902 1.00 0.00 H new ATOM 248 N ARG A 19 4.854 4.990 -7.582 1.00 0.00 N ATOM 249 CA ARG A 19 5.175 3.876 -6.706 1.00 0.00 C ATOM 250 C ARG A 19 6.344 4.242 -5.789 1.00 0.00 C ATOM 251 O ARG A 19 7.192 5.056 -6.152 1.00 0.00 O ATOM 252 CB ARG A 19 5.541 2.629 -7.514 1.00 0.00 C ATOM 253 CG ARG A 19 6.635 2.941 -8.538 1.00 0.00 C ATOM 254 CD ARG A 19 6.031 3.474 -9.839 1.00 0.00 C ATOM 255 NE ARG A 19 6.808 4.641 -10.316 1.00 0.00 N ATOM 256 CZ ARG A 19 7.958 4.550 -10.997 1.00 0.00 C ATOM 257 NH1 ARG A 19 8.472 3.347 -11.286 1.00 0.00 N ATOM 258 NH2 ARG A 19 8.593 5.662 -11.390 1.00 0.00 N ATOM 0 H ARG A 19 5.658 5.540 -7.884 1.00 0.00 H new ATOM 0 HA ARG A 19 4.291 3.660 -6.105 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.882 1.842 -6.841 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.656 2.250 -8.026 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.326 3.676 -8.125 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.214 2.040 -8.743 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.032 2.691 -10.598 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.992 3.760 -9.677 1.00 0.00 H new ATOM 0 HE ARG A 19 6.445 5.572 -10.113 1.00 0.00 H new ATOM 0 HH11 ARG A 19 7.988 2.500 -10.988 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.348 3.278 -11.805 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.201 6.578 -11.171 1.00 0.00 H new ATOM 0 HH22 ARG A 19 9.469 5.593 -11.909 1.00 0.00 H new ATOM 272 N THR A 20 6.351 3.623 -4.617 1.00 0.00 N ATOM 273 CA THR A 20 7.401 3.873 -3.645 1.00 0.00 C ATOM 274 C THR A 20 7.810 2.571 -2.954 1.00 0.00 C ATOM 275 O THR A 20 6.955 1.801 -2.517 1.00 0.00 O ATOM 276 CB THR A 20 6.901 4.945 -2.674 1.00 0.00 C ATOM 277 OG1 THR A 20 8.089 5.446 -2.068 1.00 0.00 O ATOM 278 CG2 THR A 20 6.108 4.353 -1.507 1.00 0.00 C ATOM 0 H THR A 20 5.646 2.949 -4.319 1.00 0.00 H new ATOM 0 HA THR A 20 8.305 4.246 -4.127 1.00 0.00 H new ATOM 0 HB THR A 20 6.277 5.659 -3.211 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.857 6.148 -1.425 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.776 5.156 -0.848 1.00 0.00 H new ATOM 0 HG22 THR A 20 5.240 3.817 -1.891 1.00 0.00 H new ATOM 0 HG23 THR A 20 6.742 3.664 -0.949 1.00 0.00 H new ATOM 286 N VAL A 21 9.116 2.364 -2.877 1.00 0.00 N ATOM 287 CA VAL A 21 9.648 1.168 -2.247 1.00 0.00 C ATOM 288 C VAL A 21 9.801 1.413 -0.744 1.00 0.00 C ATOM 289 O VAL A 21 10.480 2.351 -0.331 1.00 0.00 O ATOM 290 CB VAL A 21 10.959 0.760 -2.922 1.00 0.00 C ATOM 291 CG1 VAL A 21 11.178 -0.751 -2.827 1.00 0.00 C ATOM 292 CG2 VAL A 21 10.995 1.228 -4.378 1.00 0.00 C ATOM 0 H VAL A 21 9.822 3.005 -3.241 1.00 0.00 H new ATOM 0 HA VAL A 21 8.959 0.332 -2.372 1.00 0.00 H new ATOM 0 HB VAL A 21 11.775 1.251 -2.392 1.00 0.00 H new ATOM 0 HG11 VAL A 21 12.117 -1.014 -3.315 1.00 0.00 H new ATOM 0 HG12 VAL A 21 11.218 -1.048 -1.779 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.356 -1.270 -3.320 1.00 0.00 H new ATOM 0 HG21 VAL A 21 11.937 0.925 -4.834 1.00 0.00 H new ATOM 0 HG22 VAL A 21 10.166 0.779 -4.925 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.907 2.314 -4.413 1.00 0.00 H new ATOM 302 N VAL A 22 9.158 0.553 0.032 1.00 0.00 N ATOM 303 CA VAL A 22 9.214 0.665 1.479 1.00 0.00 C ATOM 304 C VAL A 22 10.025 -0.503 2.046 1.00 0.00 C ATOM 305 O VAL A 22 10.207 -1.519 1.377 1.00 0.00 O ATOM 306 CB VAL A 22 7.798 0.743 2.053 1.00 0.00 C ATOM 307 CG1 VAL A 22 7.829 0.837 3.580 1.00 0.00 C ATOM 308 CG2 VAL A 22 7.024 1.915 1.447 1.00 0.00 C ATOM 0 H VAL A 22 8.596 -0.224 -0.314 1.00 0.00 H new ATOM 0 HA VAL A 22 9.720 1.585 1.771 1.00 0.00 H new ATOM 0 HB VAL A 22 7.277 -0.176 1.785 1.00 0.00 H new ATOM 0 HG11 VAL A 22 6.810 0.891 3.962 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.323 -0.044 3.989 1.00 0.00 H new ATOM 0 HG13 VAL A 22 8.376 1.731 3.878 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.021 1.947 1.872 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.543 2.847 1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 22 6.956 1.786 0.367 1.00 0.00 H new ATOM 318 N THR A 23 10.490 -0.318 3.272 1.00 0.00 N ATOM 319 CA THR A 23 11.277 -1.344 3.936 1.00 0.00 C ATOM 320 C THR A 23 10.362 -2.401 4.556 1.00 0.00 C ATOM 321 O THR A 23 9.251 -2.092 4.983 1.00 0.00 O ATOM 322 CB THR A 23 12.188 -0.655 4.955 1.00 0.00 C ATOM 323 OG1 THR A 23 12.941 0.271 4.177 1.00 0.00 O ATOM 324 CG2 THR A 23 13.242 -1.602 5.532 1.00 0.00 C ATOM 0 H THR A 23 10.337 0.526 3.823 1.00 0.00 H new ATOM 0 HA THR A 23 11.906 -1.881 3.226 1.00 0.00 H new ATOM 0 HB THR A 23 11.584 -0.248 5.766 1.00 0.00 H new ATOM 0 HG1 THR A 23 13.557 0.763 4.759 1.00 0.00 H new ATOM 0 HG21 THR A 23 13.862 -1.063 6.249 1.00 0.00 H new ATOM 0 HG22 THR A 23 12.748 -2.435 6.033 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.869 -1.984 4.726 1.00 0.00 H new ATOM 332 N VAL A 24 10.862 -3.627 4.586 1.00 0.00 N ATOM 333 CA VAL A 24 10.104 -4.732 5.146 1.00 0.00 C ATOM 334 C VAL A 24 10.573 -4.993 6.579 1.00 0.00 C ATOM 335 O VAL A 24 11.685 -5.472 6.794 1.00 0.00 O ATOM 336 CB VAL A 24 10.226 -5.962 4.244 1.00 0.00 C ATOM 337 CG1 VAL A 24 9.155 -7.001 4.586 1.00 0.00 C ATOM 338 CG2 VAL A 24 10.156 -5.568 2.768 1.00 0.00 C ATOM 0 H VAL A 24 11.784 -3.880 4.231 1.00 0.00 H new ATOM 0 HA VAL A 24 9.044 -4.483 5.191 1.00 0.00 H new ATOM 0 HB VAL A 24 11.201 -6.414 4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 24 9.264 -7.865 3.931 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.271 -7.315 5.623 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.166 -6.563 4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 24 10.245 -6.460 2.149 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.202 -5.080 2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 24 10.971 -4.882 2.535 1.00 0.00 H new ATOM 348 N ARG A 25 9.702 -4.665 7.522 1.00 0.00 N ATOM 349 CA ARG A 25 10.013 -4.857 8.928 1.00 0.00 C ATOM 350 C ARG A 25 9.062 -5.884 9.547 1.00 0.00 C ATOM 351 O ARG A 25 7.980 -6.130 9.018 1.00 0.00 O ATOM 352 CB ARG A 25 9.905 -3.541 9.701 1.00 0.00 C ATOM 353 CG ARG A 25 10.711 -2.435 9.017 1.00 0.00 C ATOM 354 CD ARG A 25 11.424 -1.558 10.048 1.00 0.00 C ATOM 355 NE ARG A 25 12.159 -2.406 11.013 1.00 0.00 N ATOM 356 CZ ARG A 25 12.714 -1.950 12.143 1.00 0.00 C ATOM 357 NH1 ARG A 25 12.622 -0.651 12.458 1.00 0.00 N ATOM 358 NH2 ARG A 25 13.362 -2.793 12.960 1.00 0.00 N ATOM 0 H ARG A 25 8.781 -4.267 7.340 1.00 0.00 H new ATOM 0 HA ARG A 25 11.038 -5.221 8.994 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.859 -3.242 9.773 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.267 -3.683 10.719 1.00 0.00 H new ATOM 0 HG2 ARG A 25 11.444 -2.878 8.343 1.00 0.00 H new ATOM 0 HG3 ARG A 25 10.048 -1.821 8.408 1.00 0.00 H new ATOM 0 HD2 ARG A 25 12.115 -0.881 9.546 1.00 0.00 H new ATOM 0 HD3 ARG A 25 10.698 -0.939 10.575 1.00 0.00 H new ATOM 0 HE ARG A 25 12.248 -3.400 10.804 1.00 0.00 H new ATOM 0 HH11 ARG A 25 12.129 -0.009 11.837 1.00 0.00 H new ATOM 0 HH12 ARG A 25 13.045 -0.304 13.319 1.00 0.00 H new ATOM 0 HH21 ARG A 25 13.432 -3.782 12.721 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.785 -2.445 13.821 1.00 0.00 H new ATOM 372 N ASP A 26 9.502 -6.455 10.659 1.00 0.00 N ATOM 373 CA ASP A 26 8.703 -7.450 11.355 1.00 0.00 C ATOM 374 C ASP A 26 8.313 -6.911 12.732 1.00 0.00 C ATOM 375 O ASP A 26 8.956 -7.227 13.732 1.00 0.00 O ATOM 376 CB ASP A 26 9.492 -8.744 11.560 1.00 0.00 C ATOM 377 CG ASP A 26 8.689 -9.905 12.150 1.00 0.00 C ATOM 378 OD1 ASP A 26 7.952 -9.647 13.126 1.00 0.00 O ATOM 379 OD2 ASP A 26 8.829 -11.024 11.611 1.00 0.00 O ATOM 0 H ASP A 26 10.401 -6.248 11.095 1.00 0.00 H new ATOM 0 HA ASP A 26 7.820 -7.658 10.750 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.903 -9.057 10.600 1.00 0.00 H new ATOM 0 HB3 ASP A 26 10.337 -8.536 12.216 1.00 0.00 H new ATOM 384 N GLY A 27 7.260 -6.106 12.741 1.00 0.00 N ATOM 385 CA GLY A 27 6.777 -5.520 13.979 1.00 0.00 C ATOM 386 C GLY A 27 5.748 -4.421 13.701 1.00 0.00 C ATOM 387 O GLY A 27 4.580 -4.554 14.061 1.00 0.00 O ATOM 0 H GLY A 27 6.728 -5.846 11.910 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.328 -6.294 14.601 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.614 -5.106 14.540 1.00 0.00 H new ATOM 391 N MET A 28 6.221 -3.361 13.062 1.00 0.00 N ATOM 392 CA MET A 28 5.357 -2.240 12.732 1.00 0.00 C ATOM 393 C MET A 28 4.102 -2.714 11.995 1.00 0.00 C ATOM 394 O MET A 28 4.016 -3.872 11.589 1.00 0.00 O ATOM 395 CB MET A 28 6.121 -1.248 11.853 1.00 0.00 C ATOM 396 CG MET A 28 6.325 -1.808 10.443 1.00 0.00 C ATOM 397 SD MET A 28 7.690 -0.978 9.648 1.00 0.00 S ATOM 398 CE MET A 28 6.928 0.594 9.282 1.00 0.00 C ATOM 0 H MET A 28 7.191 -3.255 12.764 1.00 0.00 H new ATOM 0 HA MET A 28 5.050 -1.756 13.659 1.00 0.00 H new ATOM 0 HB2 MET A 28 5.573 -0.308 11.799 1.00 0.00 H new ATOM 0 HB3 MET A 28 7.088 -1.027 12.304 1.00 0.00 H new ATOM 0 HG2 MET A 28 6.519 -2.879 10.493 1.00 0.00 H new ATOM 0 HG3 MET A 28 5.416 -1.676 9.855 1.00 0.00 H new ATOM 0 HE1 MET A 28 7.202 0.905 8.274 1.00 0.00 H new ATOM 0 HE2 MET A 28 5.844 0.498 9.350 1.00 0.00 H new ATOM 0 HE3 MET A 28 7.272 1.340 9.998 1.00 0.00 H new ATOM 408 N SER A 29 3.160 -1.794 11.845 1.00 0.00 N ATOM 409 CA SER A 29 1.914 -2.103 11.164 1.00 0.00 C ATOM 410 C SER A 29 1.946 -1.549 9.738 1.00 0.00 C ATOM 411 O SER A 29 2.980 -1.067 9.278 1.00 0.00 O ATOM 412 CB SER A 29 0.715 -1.537 11.927 1.00 0.00 C ATOM 413 OG SER A 29 0.815 -0.127 12.109 1.00 0.00 O ATOM 0 H SER A 29 3.235 -0.835 12.183 1.00 0.00 H new ATOM 0 HA SER A 29 1.806 -3.187 11.123 1.00 0.00 H new ATOM 0 HB2 SER A 29 -0.202 -1.768 11.385 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.642 -2.024 12.900 1.00 0.00 H new ATOM 0 HG SER A 29 0.030 0.196 12.599 1.00 0.00 H new ATOM 419 N VAL A 30 0.800 -1.637 9.079 1.00 0.00 N ATOM 420 CA VAL A 30 0.683 -1.150 7.714 1.00 0.00 C ATOM 421 C VAL A 30 0.493 0.368 7.733 1.00 0.00 C ATOM 422 O VAL A 30 0.928 1.063 6.816 1.00 0.00 O ATOM 423 CB VAL A 30 -0.447 -1.886 6.991 1.00 0.00 C ATOM 424 CG1 VAL A 30 -0.688 -1.291 5.603 1.00 0.00 C ATOM 425 CG2 VAL A 30 -0.157 -3.385 6.903 1.00 0.00 C ATOM 0 H VAL A 30 -0.055 -2.038 9.464 1.00 0.00 H new ATOM 0 HA VAL A 30 1.596 -1.356 7.155 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.359 -1.756 7.574 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.496 -1.832 5.110 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.961 -0.240 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.221 -1.376 5.008 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.976 -3.884 6.385 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.771 -3.544 6.354 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.059 -3.796 7.908 1.00 0.00 H new ATOM 435 N TYR A 31 -0.157 0.837 8.788 1.00 0.00 N ATOM 436 CA TYR A 31 -0.410 2.260 8.938 1.00 0.00 C ATOM 437 C TYR A 31 0.899 3.037 9.091 1.00 0.00 C ATOM 438 O TYR A 31 1.180 3.946 8.312 1.00 0.00 O ATOM 439 CB TYR A 31 -1.231 2.409 10.221 1.00 0.00 C ATOM 440 CG TYR A 31 -1.335 3.849 10.729 1.00 0.00 C ATOM 441 CD1 TYR A 31 -0.327 4.379 11.509 1.00 0.00 C ATOM 442 CD2 TYR A 31 -2.436 4.616 10.408 1.00 0.00 C ATOM 443 CE1 TYR A 31 -0.425 5.734 11.988 1.00 0.00 C ATOM 444 CE2 TYR A 31 -2.533 5.971 10.886 1.00 0.00 C ATOM 445 CZ TYR A 31 -1.523 6.463 11.653 1.00 0.00 C ATOM 446 OH TYR A 31 -1.616 7.742 12.105 1.00 0.00 O ATOM 0 H TYR A 31 -0.516 0.257 9.547 1.00 0.00 H new ATOM 0 HA TYR A 31 -0.927 2.652 8.062 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.235 2.023 10.045 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -0.784 1.791 11.000 1.00 0.00 H new ATOM 0 HD1 TYR A 31 0.535 3.778 11.760 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -3.225 4.200 9.798 1.00 0.00 H new ATOM 0 HE1 TYR A 31 0.356 6.161 12.599 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -3.389 6.583 10.641 1.00 0.00 H new ATOM 0 HH TYR A 31 -2.452 8.141 11.787 1.00 0.00 H new ATOM 456 N ASP A 32 1.665 2.650 10.101 1.00 0.00 N ATOM 457 CA ASP A 32 2.938 3.299 10.366 1.00 0.00 C ATOM 458 C ASP A 32 3.862 3.110 9.162 1.00 0.00 C ATOM 459 O ASP A 32 4.831 3.849 8.997 1.00 0.00 O ATOM 460 CB ASP A 32 3.623 2.687 11.590 1.00 0.00 C ATOM 461 CG ASP A 32 3.495 3.503 12.878 1.00 0.00 C ATOM 462 OD1 ASP A 32 2.889 4.594 12.801 1.00 0.00 O ATOM 463 OD2 ASP A 32 4.005 3.017 13.910 1.00 0.00 O ATOM 0 H ASP A 32 1.429 1.895 10.745 1.00 0.00 H new ATOM 0 HA ASP A 32 2.746 4.356 10.551 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.206 1.695 11.763 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.681 2.553 11.366 1.00 0.00 H new ATOM 468 N SER A 33 3.530 2.115 8.352 1.00 0.00 N ATOM 469 CA SER A 33 4.319 1.819 7.168 1.00 0.00 C ATOM 470 C SER A 33 3.881 2.717 6.010 1.00 0.00 C ATOM 471 O SER A 33 4.671 3.513 5.503 1.00 0.00 O ATOM 472 CB SER A 33 4.192 0.346 6.776 1.00 0.00 C ATOM 473 OG SER A 33 5.335 -0.411 7.164 1.00 0.00 O ATOM 0 H SER A 33 2.726 1.504 8.492 1.00 0.00 H new ATOM 0 HA SER A 33 5.366 2.017 7.396 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.302 -0.077 7.241 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.055 0.269 5.697 1.00 0.00 H new ATOM 0 HG SER A 33 6.132 -0.047 6.725 1.00 0.00 H new ATOM 479 N LEU A 34 2.623 2.560 5.624 1.00 0.00 N ATOM 480 CA LEU A 34 2.071 3.346 4.534 1.00 0.00 C ATOM 481 C LEU A 34 1.910 4.798 4.990 1.00 0.00 C ATOM 482 O LEU A 34 1.597 5.674 4.184 1.00 0.00 O ATOM 483 CB LEU A 34 0.774 2.716 4.022 1.00 0.00 C ATOM 484 CG LEU A 34 0.924 1.707 2.881 1.00 0.00 C ATOM 485 CD1 LEU A 34 1.549 2.363 1.648 1.00 0.00 C ATOM 486 CD2 LEU A 34 1.711 0.477 3.336 1.00 0.00 C ATOM 0 H LEU A 34 1.970 1.900 6.047 1.00 0.00 H new ATOM 0 HA LEU A 34 2.753 3.351 3.684 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.280 2.219 4.857 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.112 3.515 3.689 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.071 1.365 2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.645 1.625 0.852 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.913 3.181 1.310 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.535 2.751 1.903 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.803 -0.224 2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.704 0.782 3.665 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.187 -0.005 4.162 1.00 0.00 H new ATOM 498 N ASP A 35 2.132 5.008 6.279 1.00 0.00 N ATOM 499 CA ASP A 35 2.016 6.339 6.851 1.00 0.00 C ATOM 500 C ASP A 35 2.749 7.340 5.955 1.00 0.00 C ATOM 501 O ASP A 35 2.118 8.129 5.254 1.00 0.00 O ATOM 502 CB ASP A 35 2.649 6.398 8.242 1.00 0.00 C ATOM 503 CG ASP A 35 2.907 7.808 8.777 1.00 0.00 C ATOM 504 OD1 ASP A 35 3.874 8.432 8.287 1.00 0.00 O ATOM 505 OD2 ASP A 35 2.132 8.230 9.662 1.00 0.00 O ATOM 0 H ASP A 35 2.392 4.279 6.944 1.00 0.00 H new ATOM 0 HA ASP A 35 0.956 6.582 6.927 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.999 5.873 8.943 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.595 5.857 8.217 1.00 0.00 H new ATOM 510 N LYS A 36 4.071 7.275 6.008 1.00 0.00 N ATOM 511 CA LYS A 36 4.897 8.166 5.211 1.00 0.00 C ATOM 512 C LYS A 36 4.459 8.086 3.747 1.00 0.00 C ATOM 513 O LYS A 36 4.226 9.111 3.109 1.00 0.00 O ATOM 514 CB LYS A 36 6.380 7.858 5.427 1.00 0.00 C ATOM 515 CG LYS A 36 7.205 9.146 5.476 1.00 0.00 C ATOM 516 CD LYS A 36 8.420 9.055 4.550 1.00 0.00 C ATOM 517 CE LYS A 36 8.265 9.991 3.350 1.00 0.00 C ATOM 518 NZ LYS A 36 9.268 11.078 3.407 1.00 0.00 N ATOM 0 H LYS A 36 4.591 6.619 6.591 1.00 0.00 H new ATOM 0 HA LYS A 36 4.760 9.199 5.529 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.509 7.304 6.357 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.744 7.219 4.622 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.583 9.992 5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.535 9.332 6.498 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.323 9.313 5.103 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.541 8.029 4.202 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.383 9.428 2.424 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.261 10.415 3.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.149 11.704 2.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.137 11.626 4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.224 10.669 3.395 1.00 0.00 H new ATOM 532 N ALA A 37 4.360 6.859 3.258 1.00 0.00 N ATOM 533 CA ALA A 37 3.954 6.632 1.882 1.00 0.00 C ATOM 534 C ALA A 37 2.837 7.611 1.516 1.00 0.00 C ATOM 535 O ALA A 37 2.715 8.016 0.361 1.00 0.00 O ATOM 536 CB ALA A 37 3.530 5.172 1.708 1.00 0.00 C ATOM 0 H ALA A 37 4.554 6.011 3.791 1.00 0.00 H new ATOM 0 HA ALA A 37 4.787 6.813 1.202 1.00 0.00 H new ATOM 0 HB1 ALA A 37 3.225 5.002 0.675 1.00 0.00 H new ATOM 0 HB2 ALA A 37 4.368 4.518 1.951 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.694 4.954 2.373 1.00 0.00 H new ATOM 542 N LEU A 38 2.050 7.964 2.522 1.00 0.00 N ATOM 543 CA LEU A 38 0.948 8.889 2.320 1.00 0.00 C ATOM 544 C LEU A 38 1.430 10.317 2.582 1.00 0.00 C ATOM 545 O LEU A 38 1.336 11.177 1.708 1.00 0.00 O ATOM 546 CB LEU A 38 -0.256 8.481 3.173 1.00 0.00 C ATOM 547 CG LEU A 38 -0.906 7.142 2.818 1.00 0.00 C ATOM 548 CD1 LEU A 38 -2.216 6.948 3.584 1.00 0.00 C ATOM 549 CD2 LEU A 38 -1.101 7.010 1.306 1.00 0.00 C ATOM 0 H LEU A 38 2.154 7.626 3.479 1.00 0.00 H new ATOM 0 HA LEU A 38 0.606 8.853 1.286 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.058 8.445 4.216 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -1.013 9.262 3.095 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.232 6.343 3.126 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.657 5.989 3.313 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.017 6.966 4.656 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.908 7.751 3.330 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.565 6.049 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.744 7.815 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.134 7.071 0.808 1.00 0.00 H new ATOM 561 N LYS A 39 1.937 10.524 3.788 1.00 0.00 N ATOM 562 CA LYS A 39 2.435 11.833 4.176 1.00 0.00 C ATOM 563 C LYS A 39 3.235 12.433 3.018 1.00 0.00 C ATOM 564 O LYS A 39 3.030 13.589 2.650 1.00 0.00 O ATOM 565 CB LYS A 39 3.222 11.741 5.485 1.00 0.00 C ATOM 566 CG LYS A 39 2.414 11.011 6.560 1.00 0.00 C ATOM 567 CD LYS A 39 0.936 11.400 6.495 1.00 0.00 C ATOM 568 CE LYS A 39 0.744 12.880 6.833 1.00 0.00 C ATOM 569 NZ LYS A 39 -0.675 13.159 7.147 1.00 0.00 N ATOM 0 H LYS A 39 2.014 9.807 4.510 1.00 0.00 H new ATOM 0 HA LYS A 39 1.606 12.512 4.377 1.00 0.00 H new ATOM 0 HB2 LYS A 39 4.162 11.217 5.312 1.00 0.00 H new ATOM 0 HB3 LYS A 39 3.475 12.743 5.833 1.00 0.00 H new ATOM 0 HG2 LYS A 39 2.516 9.934 6.428 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.814 11.251 7.545 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.546 11.197 5.497 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.364 10.787 7.191 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.371 13.149 7.683 1.00 0.00 H new ATOM 0 HE3 LYS A 39 1.065 13.496 5.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.788 14.168 7.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -1.266 12.921 6.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.969 12.585 7.963 1.00 0.00 H new ATOM 583 N VAL A 40 4.131 11.620 2.476 1.00 0.00 N ATOM 584 CA VAL A 40 4.963 12.056 1.368 1.00 0.00 C ATOM 585 C VAL A 40 4.128 12.916 0.416 1.00 0.00 C ATOM 586 O VAL A 40 4.633 13.876 -0.164 1.00 0.00 O ATOM 587 CB VAL A 40 5.595 10.845 0.680 1.00 0.00 C ATOM 588 CG1 VAL A 40 4.521 9.884 0.165 1.00 0.00 C ATOM 589 CG2 VAL A 40 6.528 11.281 -0.451 1.00 0.00 C ATOM 0 H VAL A 40 4.298 10.662 2.784 1.00 0.00 H new ATOM 0 HA VAL A 40 5.785 12.674 1.728 1.00 0.00 H new ATOM 0 HB VAL A 40 6.193 10.314 1.421 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.997 9.032 -0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 40 3.915 9.534 1.001 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.885 10.401 -0.553 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.964 10.400 -0.923 1.00 0.00 H new ATOM 0 HG22 VAL A 40 5.963 11.847 -1.191 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.323 11.907 -0.046 1.00 0.00 H new ATOM 599 N ARG A 41 2.864 12.541 0.286 1.00 0.00 N ATOM 600 CA ARG A 41 1.955 13.265 -0.586 1.00 0.00 C ATOM 601 C ARG A 41 0.976 14.098 0.244 1.00 0.00 C ATOM 602 O ARG A 41 0.491 15.132 -0.214 1.00 0.00 O ATOM 603 CB ARG A 41 1.166 12.306 -1.479 1.00 0.00 C ATOM 604 CG ARG A 41 2.089 11.605 -2.479 1.00 0.00 C ATOM 605 CD ARG A 41 1.281 10.796 -3.496 1.00 0.00 C ATOM 606 NE ARG A 41 1.708 11.141 -4.871 1.00 0.00 N ATOM 607 CZ ARG A 41 2.929 10.891 -5.363 1.00 0.00 C ATOM 608 NH1 ARG A 41 3.851 10.293 -4.596 1.00 0.00 N ATOM 609 NH2 ARG A 41 3.228 11.239 -6.622 1.00 0.00 N ATOM 0 H ARG A 41 2.448 11.745 0.770 1.00 0.00 H new ATOM 0 HA ARG A 41 2.554 13.921 -1.217 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.660 11.563 -0.863 1.00 0.00 H new ATOM 0 HB3 ARG A 41 0.393 12.856 -2.016 1.00 0.00 H new ATOM 0 HG2 ARG A 41 2.698 12.345 -2.999 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.775 10.946 -1.946 1.00 0.00 H new ATOM 0 HD2 ARG A 41 1.422 9.730 -3.319 1.00 0.00 H new ATOM 0 HD3 ARG A 41 0.218 11.002 -3.374 1.00 0.00 H new ATOM 0 HE ARG A 41 1.031 11.597 -5.482 1.00 0.00 H new ATOM 0 HH11 ARG A 41 3.623 10.028 -3.638 1.00 0.00 H new ATOM 0 HH12 ARG A 41 4.780 10.103 -4.971 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.526 11.694 -7.206 1.00 0.00 H new ATOM 0 HH22 ARG A 41 4.157 11.049 -6.997 1.00 0.00 H new ATOM 623 N GLY A 42 0.714 13.618 1.451 1.00 0.00 N ATOM 624 CA GLY A 42 -0.198 14.306 2.349 1.00 0.00 C ATOM 625 C GLY A 42 -1.530 13.560 2.454 1.00 0.00 C ATOM 626 O GLY A 42 -2.495 14.081 3.011 1.00 0.00 O ATOM 0 H GLY A 42 1.118 12.760 1.828 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.254 14.391 3.337 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.372 15.320 1.989 1.00 0.00 H new ATOM 630 N LEU A 43 -1.540 12.352 1.910 1.00 0.00 N ATOM 631 CA LEU A 43 -2.738 11.530 1.935 1.00 0.00 C ATOM 632 C LEU A 43 -3.132 11.256 3.388 1.00 0.00 C ATOM 633 O LEU A 43 -2.353 11.510 4.305 1.00 0.00 O ATOM 634 CB LEU A 43 -2.535 10.262 1.103 1.00 0.00 C ATOM 635 CG LEU A 43 -2.742 10.409 -0.406 1.00 0.00 C ATOM 636 CD1 LEU A 43 -2.173 9.204 -1.157 1.00 0.00 C ATOM 637 CD2 LEU A 43 -4.216 10.648 -0.736 1.00 0.00 C ATOM 0 H LEU A 43 -0.738 11.923 1.449 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.572 12.057 1.472 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.523 9.895 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.219 9.497 1.471 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.191 11.287 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.333 9.334 -2.227 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.105 9.122 -0.957 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.675 8.296 -0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.336 10.749 -1.815 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.809 9.805 -0.382 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.555 11.561 -0.246 1.00 0.00 H new ATOM 649 N ASN A 44 -4.342 10.740 3.552 1.00 0.00 N ATOM 650 CA ASN A 44 -4.849 10.429 4.877 1.00 0.00 C ATOM 651 C ASN A 44 -5.029 8.915 5.007 1.00 0.00 C ATOM 652 O ASN A 44 -5.047 8.200 4.006 1.00 0.00 O ATOM 653 CB ASN A 44 -6.208 11.089 5.116 1.00 0.00 C ATOM 654 CG ASN A 44 -6.481 11.258 6.612 1.00 0.00 C ATOM 655 OD1 ASN A 44 -6.277 12.312 7.191 1.00 0.00 O ATOM 656 ND2 ASN A 44 -6.951 10.164 7.203 1.00 0.00 N ATOM 0 H ASN A 44 -4.985 10.530 2.789 1.00 0.00 H new ATOM 0 HA ASN A 44 -4.133 10.804 5.608 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -6.235 12.062 4.626 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -6.994 10.483 4.665 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -7.164 10.175 8.200 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -7.099 9.314 6.659 1.00 0.00 H new ATOM 663 N GLN A 45 -5.159 8.471 6.249 1.00 0.00 N ATOM 664 CA GLN A 45 -5.337 7.055 6.522 1.00 0.00 C ATOM 665 C GLN A 45 -6.810 6.750 6.802 1.00 0.00 C ATOM 666 O GLN A 45 -7.127 5.982 7.709 1.00 0.00 O ATOM 667 CB GLN A 45 -4.453 6.606 7.687 1.00 0.00 C ATOM 668 CG GLN A 45 -2.980 6.570 7.275 1.00 0.00 C ATOM 669 CD GLN A 45 -2.172 7.623 8.037 1.00 0.00 C ATOM 670 OE1 GLN A 45 -2.575 8.765 8.183 1.00 0.00 O ATOM 671 NE2 GLN A 45 -1.013 7.176 8.512 1.00 0.00 N ATOM 0 H GLN A 45 -5.145 9.067 7.077 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.031 6.493 5.639 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.582 7.286 8.529 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.764 5.617 8.024 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -2.568 5.580 7.469 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.894 6.746 6.203 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.736 6.207 8.353 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.401 7.802 9.035 1.00 0.00 H new ATOM 680 N ASP A 46 -7.671 7.367 6.006 1.00 0.00 N ATOM 681 CA ASP A 46 -9.103 7.171 6.158 1.00 0.00 C ATOM 682 C ASP A 46 -9.770 7.238 4.782 1.00 0.00 C ATOM 683 O ASP A 46 -10.599 6.392 4.449 1.00 0.00 O ATOM 684 CB ASP A 46 -9.718 8.262 7.035 1.00 0.00 C ATOM 685 CG ASP A 46 -11.086 7.919 7.630 1.00 0.00 C ATOM 686 OD1 ASP A 46 -11.529 6.772 7.408 1.00 0.00 O ATOM 687 OD2 ASP A 46 -11.656 8.812 8.293 1.00 0.00 O ATOM 0 H ASP A 46 -7.405 8.003 5.254 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.263 6.200 6.626 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.029 8.483 7.850 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.814 9.172 6.443 1.00 0.00 H new ATOM 692 N CYS A 47 -9.384 8.251 4.021 1.00 0.00 N ATOM 693 CA CYS A 47 -9.934 8.439 2.690 1.00 0.00 C ATOM 694 C CYS A 47 -9.018 7.735 1.687 1.00 0.00 C ATOM 695 O CYS A 47 -9.017 8.067 0.502 1.00 0.00 O ATOM 696 CB CYS A 47 -10.115 9.921 2.356 1.00 0.00 C ATOM 697 SG CYS A 47 -11.570 10.589 3.242 1.00 0.00 S ATOM 0 H CYS A 47 -8.697 8.951 4.301 1.00 0.00 H new ATOM 0 HA CYS A 47 -10.930 7.999 2.641 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -9.221 10.477 2.637 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -10.244 10.047 1.281 1.00 0.00 H new ATOM 0 HG CYS A 47 -11.713 11.848 2.953 1.00 0.00 H new ATOM 703 N CYS A 48 -8.259 6.777 2.198 1.00 0.00 N ATOM 704 CA CYS A 48 -7.340 6.024 1.362 1.00 0.00 C ATOM 705 C CYS A 48 -7.369 4.562 1.812 1.00 0.00 C ATOM 706 O CYS A 48 -7.535 4.276 2.997 1.00 0.00 O ATOM 707 CB CYS A 48 -5.926 6.607 1.409 1.00 0.00 C ATOM 708 SG CYS A 48 -5.861 8.169 0.458 1.00 0.00 S ATOM 0 H CYS A 48 -8.262 6.505 3.181 1.00 0.00 H new ATOM 0 HA CYS A 48 -7.655 6.089 0.321 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -5.633 6.789 2.443 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -5.215 5.891 0.997 1.00 0.00 H new ATOM 0 HG CYS A 48 -7.069 8.606 0.258 1.00 0.00 H new ATOM 714 N VAL A 49 -7.205 3.674 0.842 1.00 0.00 N ATOM 715 CA VAL A 49 -7.211 2.249 1.123 1.00 0.00 C ATOM 716 C VAL A 49 -5.984 1.601 0.477 1.00 0.00 C ATOM 717 O VAL A 49 -5.351 2.195 -0.394 1.00 0.00 O ATOM 718 CB VAL A 49 -8.530 1.629 0.656 1.00 0.00 C ATOM 719 CG1 VAL A 49 -8.782 1.927 -0.823 1.00 0.00 C ATOM 720 CG2 VAL A 49 -8.552 0.123 0.923 1.00 0.00 C ATOM 0 H VAL A 49 -7.067 3.914 -0.140 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.146 2.071 2.196 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.336 2.083 1.232 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.725 1.475 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.830 3.005 -0.974 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.970 1.513 -1.421 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.500 -0.293 0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.732 -0.354 0.386 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.440 -0.059 1.992 1.00 0.00 H new ATOM 730 N VAL A 50 -5.686 0.392 0.930 1.00 0.00 N ATOM 731 CA VAL A 50 -4.546 -0.342 0.407 1.00 0.00 C ATOM 732 C VAL A 50 -4.997 -1.742 -0.014 1.00 0.00 C ATOM 733 O VAL A 50 -5.565 -2.483 0.788 1.00 0.00 O ATOM 734 CB VAL A 50 -3.419 -0.363 1.441 1.00 0.00 C ATOM 735 CG1 VAL A 50 -2.179 -1.067 0.886 1.00 0.00 C ATOM 736 CG2 VAL A 50 -3.080 1.053 1.912 1.00 0.00 C ATOM 0 H VAL A 50 -6.214 -0.097 1.653 1.00 0.00 H new ATOM 0 HA VAL A 50 -4.147 0.152 -0.479 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.768 -0.929 2.305 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.393 -1.068 1.641 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.431 -2.094 0.623 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.829 -0.541 -0.002 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.276 1.009 2.647 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.761 1.653 1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.961 1.506 2.365 1.00 0.00 H new ATOM 746 N TYR A 51 -4.727 -2.063 -1.270 1.00 0.00 N ATOM 747 CA TYR A 51 -5.098 -3.362 -1.807 1.00 0.00 C ATOM 748 C TYR A 51 -3.879 -4.280 -1.911 1.00 0.00 C ATOM 749 O TYR A 51 -2.785 -3.830 -2.250 1.00 0.00 O ATOM 750 CB TYR A 51 -5.643 -3.097 -3.212 1.00 0.00 C ATOM 751 CG TYR A 51 -6.559 -1.874 -3.304 1.00 0.00 C ATOM 752 CD1 TYR A 51 -7.572 -1.700 -2.383 1.00 0.00 C ATOM 753 CD2 TYR A 51 -6.371 -0.945 -4.307 1.00 0.00 C ATOM 754 CE1 TYR A 51 -8.434 -0.550 -2.470 1.00 0.00 C ATOM 755 CE2 TYR A 51 -7.232 0.205 -4.393 1.00 0.00 C ATOM 756 CZ TYR A 51 -8.221 0.346 -3.470 1.00 0.00 C ATOM 757 OH TYR A 51 -9.035 1.433 -3.552 1.00 0.00 O ATOM 0 H TYR A 51 -4.256 -1.447 -1.932 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.827 -3.851 -1.161 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -4.805 -2.963 -3.896 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.192 -3.976 -3.549 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -7.718 -2.426 -1.597 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -5.578 -1.081 -5.027 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -9.232 -0.403 -1.757 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -7.096 0.940 -5.173 1.00 0.00 H new ATOM 0 HH TYR A 51 -8.944 1.844 -4.437 1.00 0.00 H new ATOM 767 N ARG A 52 -4.108 -5.551 -1.614 1.00 0.00 N ATOM 768 CA ARG A 52 -3.043 -6.537 -1.670 1.00 0.00 C ATOM 769 C ARG A 52 -3.357 -7.600 -2.725 1.00 0.00 C ATOM 770 O ARG A 52 -4.517 -7.960 -2.921 1.00 0.00 O ATOM 771 CB ARG A 52 -2.849 -7.216 -0.313 1.00 0.00 C ATOM 772 CG ARG A 52 -3.029 -6.217 0.831 1.00 0.00 C ATOM 773 CD ARG A 52 -3.042 -6.930 2.185 1.00 0.00 C ATOM 774 NE ARG A 52 -4.418 -7.363 2.515 1.00 0.00 N ATOM 775 CZ ARG A 52 -4.738 -8.091 3.593 1.00 0.00 C ATOM 776 NH1 ARG A 52 -3.783 -8.471 4.453 1.00 0.00 N ATOM 777 NH2 ARG A 52 -6.014 -8.439 3.812 1.00 0.00 N ATOM 0 H ARG A 52 -5.016 -5.920 -1.334 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.124 -6.016 -1.938 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -3.565 -8.031 -0.205 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.853 -7.657 -0.262 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -2.222 -5.485 0.809 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -3.961 -5.668 0.696 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.377 -7.793 2.157 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.666 -6.263 2.960 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.170 -7.090 1.882 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.812 -8.206 4.287 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.027 -9.025 5.274 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.741 -8.149 3.158 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -6.258 -8.993 4.633 1.00 0.00 H new ATOM 791 N LEU A 53 -2.304 -8.072 -3.376 1.00 0.00 N ATOM 792 CA LEU A 53 -2.454 -9.086 -4.405 1.00 0.00 C ATOM 793 C LEU A 53 -2.439 -10.472 -3.756 1.00 0.00 C ATOM 794 O LEU A 53 -1.373 -11.034 -3.509 1.00 0.00 O ATOM 795 CB LEU A 53 -1.394 -8.906 -5.494 1.00 0.00 C ATOM 796 CG LEU A 53 -1.824 -8.099 -6.721 1.00 0.00 C ATOM 797 CD1 LEU A 53 -2.432 -9.009 -7.790 1.00 0.00 C ATOM 798 CD2 LEU A 53 -2.772 -6.965 -6.327 1.00 0.00 C ATOM 0 H LEU A 53 -1.344 -7.771 -3.211 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.415 -8.979 -4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.525 -8.420 -5.051 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.072 -9.893 -5.827 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.936 -7.640 -7.156 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.729 -8.411 -8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.695 -9.749 -8.100 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.306 -9.516 -7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.062 -6.407 -7.217 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.661 -7.382 -5.854 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.269 -6.297 -5.628 1.00 0.00 H new ATOM 810 N ILE A 54 -3.634 -10.983 -3.498 1.00 0.00 N ATOM 811 CA ILE A 54 -3.771 -12.291 -2.883 1.00 0.00 C ATOM 812 C ILE A 54 -3.909 -13.353 -3.976 1.00 0.00 C ATOM 813 O ILE A 54 -2.997 -14.151 -4.190 1.00 0.00 O ATOM 814 CB ILE A 54 -4.924 -12.292 -1.877 1.00 0.00 C ATOM 815 CG1 ILE A 54 -4.457 -11.795 -0.507 1.00 0.00 C ATOM 816 CG2 ILE A 54 -5.578 -13.673 -1.793 1.00 0.00 C ATOM 817 CD1 ILE A 54 -4.305 -10.272 -0.499 1.00 0.00 C ATOM 0 H ILE A 54 -4.516 -10.514 -3.704 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.877 -12.537 -2.310 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.685 -11.596 -2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.174 -12.097 0.257 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.505 -12.260 -0.252 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.394 -13.646 -1.071 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.969 -13.951 -2.772 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -4.838 -14.408 -1.476 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.972 -9.945 0.486 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.570 -9.976 -1.247 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.265 -9.809 -0.730 1.00 0.00 H new ATOM 829 N LYS A 55 -5.055 -13.328 -4.640 1.00 0.00 N ATOM 830 CA LYS A 55 -5.323 -14.278 -5.706 1.00 0.00 C ATOM 831 C LYS A 55 -5.543 -13.519 -7.016 1.00 0.00 C ATOM 832 O LYS A 55 -6.537 -13.739 -7.706 1.00 0.00 O ATOM 833 CB LYS A 55 -6.486 -15.196 -5.325 1.00 0.00 C ATOM 834 CG LYS A 55 -6.012 -16.641 -5.159 1.00 0.00 C ATOM 835 CD LYS A 55 -5.459 -16.878 -3.752 1.00 0.00 C ATOM 836 CE LYS A 55 -4.381 -17.964 -3.762 1.00 0.00 C ATOM 837 NZ LYS A 55 -3.271 -17.601 -2.854 1.00 0.00 N ATOM 0 H LYS A 55 -5.809 -12.665 -4.460 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.465 -14.934 -5.857 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -6.939 -14.849 -4.396 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -7.258 -15.149 -6.093 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.841 -17.323 -5.348 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.242 -16.862 -5.898 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.042 -15.950 -3.360 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -6.269 -17.171 -3.084 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.813 -18.916 -3.455 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -4.001 -18.098 -4.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.548 -18.349 -2.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.848 -16.703 -3.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.635 -17.496 -1.885 1.00 0.00 H new ATOM 851 N GLY A 56 -4.598 -12.641 -7.320 1.00 0.00 N ATOM 852 CA GLY A 56 -4.675 -11.848 -8.535 1.00 0.00 C ATOM 853 C GLY A 56 -5.851 -10.871 -8.478 1.00 0.00 C ATOM 854 O GLY A 56 -6.441 -10.544 -9.507 1.00 0.00 O ATOM 0 H GLY A 56 -3.775 -12.461 -6.745 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.745 -11.296 -8.673 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -4.786 -12.506 -9.397 1.00 0.00 H new ATOM 858 N ARG A 57 -6.157 -10.433 -7.266 1.00 0.00 N ATOM 859 CA ARG A 57 -7.252 -9.500 -7.062 1.00 0.00 C ATOM 860 C ARG A 57 -6.919 -8.532 -5.924 1.00 0.00 C ATOM 861 O ARG A 57 -6.335 -8.930 -4.917 1.00 0.00 O ATOM 862 CB ARG A 57 -8.550 -10.238 -6.731 1.00 0.00 C ATOM 863 CG ARG A 57 -8.351 -11.200 -5.558 1.00 0.00 C ATOM 864 CD ARG A 57 -8.949 -12.573 -5.868 1.00 0.00 C ATOM 865 NE ARG A 57 -9.803 -13.019 -4.743 1.00 0.00 N ATOM 866 CZ ARG A 57 -10.540 -14.138 -4.757 1.00 0.00 C ATOM 867 NH1 ARG A 57 -10.533 -14.932 -5.836 1.00 0.00 N ATOM 868 NH2 ARG A 57 -11.285 -14.462 -3.692 1.00 0.00 N ATOM 0 H ARG A 57 -5.666 -10.707 -6.415 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.391 -8.943 -7.989 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.330 -9.517 -6.486 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.891 -10.792 -7.606 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.287 -11.303 -5.344 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.818 -10.789 -4.663 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.537 -12.524 -6.785 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.151 -13.296 -6.039 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.832 -12.438 -3.905 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -9.966 -14.685 -6.647 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.094 -15.784 -5.846 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.291 -13.857 -2.871 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.846 -15.314 -3.702 1.00 0.00 H new ATOM 882 N LYS A 58 -7.306 -7.281 -6.122 1.00 0.00 N ATOM 883 CA LYS A 58 -7.057 -6.254 -5.124 1.00 0.00 C ATOM 884 C LYS A 58 -7.805 -6.606 -3.837 1.00 0.00 C ATOM 885 O LYS A 58 -9.033 -6.546 -3.792 1.00 0.00 O ATOM 886 CB LYS A 58 -7.406 -4.872 -5.680 1.00 0.00 C ATOM 887 CG LYS A 58 -6.226 -4.275 -6.449 1.00 0.00 C ATOM 888 CD LYS A 58 -6.672 -3.739 -7.810 1.00 0.00 C ATOM 889 CE LYS A 58 -5.528 -3.795 -8.824 1.00 0.00 C ATOM 890 NZ LYS A 58 -5.501 -5.110 -9.503 1.00 0.00 N ATOM 0 H LYS A 58 -7.790 -6.955 -6.958 1.00 0.00 H new ATOM 0 HA LYS A 58 -5.997 -6.214 -4.875 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -8.272 -4.949 -6.338 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.685 -4.207 -4.862 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.778 -3.470 -5.866 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.457 -5.034 -6.588 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.516 -4.324 -8.176 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.019 -2.711 -7.704 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.648 -3.001 -9.561 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.578 -3.620 -8.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.719 -5.131 -10.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.364 -5.862 -8.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.401 -5.262 -10.001 1.00 0.00 H new ATOM 904 N THR A 59 -7.033 -6.967 -2.822 1.00 0.00 N ATOM 905 CA THR A 59 -7.607 -7.329 -1.537 1.00 0.00 C ATOM 906 C THR A 59 -7.314 -6.246 -0.497 1.00 0.00 C ATOM 907 O THR A 59 -6.191 -6.141 -0.006 1.00 0.00 O ATOM 908 CB THR A 59 -7.067 -8.707 -1.150 1.00 0.00 C ATOM 909 OG1 THR A 59 -7.867 -9.617 -1.899 1.00 0.00 O ATOM 910 CG2 THR A 59 -7.364 -9.063 0.308 1.00 0.00 C ATOM 0 H THR A 59 -6.015 -7.016 -2.864 1.00 0.00 H new ATOM 0 HA THR A 59 -8.694 -7.394 -1.593 1.00 0.00 H new ATOM 0 HB THR A 59 -5.991 -8.735 -1.319 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.583 -10.535 -1.709 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.960 -10.050 0.531 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.902 -8.325 0.964 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.442 -9.068 0.469 1.00 0.00 H new ATOM 918 N VAL A 60 -8.342 -5.468 -0.193 1.00 0.00 N ATOM 919 CA VAL A 60 -8.208 -4.397 0.780 1.00 0.00 C ATOM 920 C VAL A 60 -7.507 -4.934 2.029 1.00 0.00 C ATOM 921 O VAL A 60 -7.601 -6.121 2.337 1.00 0.00 O ATOM 922 CB VAL A 60 -9.579 -3.787 1.079 1.00 0.00 C ATOM 923 CG1 VAL A 60 -9.497 -2.796 2.241 1.00 0.00 C ATOM 924 CG2 VAL A 60 -10.167 -3.123 -0.168 1.00 0.00 C ATOM 0 H VAL A 60 -9.272 -5.558 -0.603 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.590 -3.593 0.381 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.248 -4.595 1.375 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.485 -2.377 2.432 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.142 -3.311 3.134 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.806 -1.993 1.986 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.141 -2.697 0.072 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -9.499 -2.332 -0.508 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.280 -3.866 -0.957 1.00 0.00 H new ATOM 934 N THR A 61 -6.820 -4.033 2.716 1.00 0.00 N ATOM 935 CA THR A 61 -6.104 -4.400 3.926 1.00 0.00 C ATOM 936 C THR A 61 -6.444 -3.434 5.062 1.00 0.00 C ATOM 937 O THR A 61 -6.908 -2.321 4.817 1.00 0.00 O ATOM 938 CB THR A 61 -4.611 -4.448 3.595 1.00 0.00 C ATOM 939 OG1 THR A 61 -4.107 -5.499 4.414 1.00 0.00 O ATOM 940 CG2 THR A 61 -3.863 -3.205 4.081 1.00 0.00 C ATOM 0 H THR A 61 -6.744 -3.049 2.458 1.00 0.00 H new ATOM 0 HA THR A 61 -6.405 -5.386 4.280 1.00 0.00 H new ATOM 0 HB THR A 61 -4.482 -4.551 2.518 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.233 -5.242 4.774 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.808 -3.290 3.821 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.283 -2.319 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.964 -3.119 5.163 1.00 0.00 H new ATOM 948 N ALA A 62 -6.199 -3.894 6.280 1.00 0.00 N ATOM 949 CA ALA A 62 -6.474 -3.084 7.455 1.00 0.00 C ATOM 950 C ALA A 62 -5.245 -2.232 7.780 1.00 0.00 C ATOM 951 O ALA A 62 -4.133 -2.557 7.367 1.00 0.00 O ATOM 952 CB ALA A 62 -6.879 -3.991 8.618 1.00 0.00 C ATOM 0 H ALA A 62 -5.813 -4.817 6.479 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.306 -2.405 7.267 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.085 -3.383 9.499 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.773 -4.552 8.347 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.068 -4.685 8.838 1.00 0.00 H new ATOM 958 N TRP A 63 -5.487 -1.159 8.518 1.00 0.00 N ATOM 959 CA TRP A 63 -4.414 -0.258 8.904 1.00 0.00 C ATOM 960 C TRP A 63 -3.741 -0.832 10.153 1.00 0.00 C ATOM 961 O TRP A 63 -2.562 -0.582 10.397 1.00 0.00 O ATOM 962 CB TRP A 63 -4.938 1.165 9.107 1.00 0.00 C ATOM 963 CG TRP A 63 -5.402 1.847 7.818 1.00 0.00 C ATOM 964 CD1 TRP A 63 -6.641 2.244 7.495 1.00 0.00 C ATOM 965 CD2 TRP A 63 -4.579 2.198 6.687 1.00 0.00 C ATOM 966 NE1 TRP A 63 -6.675 2.823 6.243 1.00 0.00 N ATOM 967 CE2 TRP A 63 -5.381 2.794 5.736 1.00 0.00 C ATOM 968 CE3 TRP A 63 -3.201 2.018 6.474 1.00 0.00 C ATOM 969 CZ2 TRP A 63 -4.898 3.259 4.506 1.00 0.00 C ATOM 970 CZ3 TRP A 63 -2.733 2.487 5.240 1.00 0.00 C ATOM 971 CH2 TRP A 63 -3.528 3.090 4.272 1.00 0.00 C ATOM 0 H TRP A 63 -6.411 -0.893 8.859 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.670 -0.183 8.111 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.769 1.138 9.811 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -4.153 1.769 9.563 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.504 2.126 8.134 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.498 3.203 5.775 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.554 1.555 7.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -5.547 3.723 3.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -1.681 2.372 5.025 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -3.091 3.427 3.344 1.00 0.00 H new ATOM 982 N ASP A 64 -4.521 -1.589 10.911 1.00 0.00 N ATOM 983 CA ASP A 64 -4.015 -2.199 12.128 1.00 0.00 C ATOM 984 C ASP A 64 -3.135 -3.397 11.766 1.00 0.00 C ATOM 985 O ASP A 64 -2.176 -3.703 12.473 1.00 0.00 O ATOM 986 CB ASP A 64 -5.161 -2.704 13.008 1.00 0.00 C ATOM 987 CG ASP A 64 -5.501 -1.811 14.203 1.00 0.00 C ATOM 988 OD1 ASP A 64 -4.602 -1.634 15.053 1.00 0.00 O ATOM 989 OD2 ASP A 64 -6.652 -1.326 14.239 1.00 0.00 O ATOM 0 H ASP A 64 -5.499 -1.793 10.706 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.447 -1.445 12.672 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.052 -2.813 12.390 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.905 -3.697 13.377 1.00 0.00 H new ATOM 994 N THR A 65 -3.492 -4.041 10.665 1.00 0.00 N ATOM 995 CA THR A 65 -2.746 -5.198 10.200 1.00 0.00 C ATOM 996 C THR A 65 -1.241 -4.947 10.322 1.00 0.00 C ATOM 997 O THR A 65 -0.807 -3.803 10.448 1.00 0.00 O ATOM 998 CB THR A 65 -3.196 -5.508 8.771 1.00 0.00 C ATOM 999 OG1 THR A 65 -4.616 -5.587 8.863 1.00 0.00 O ATOM 1000 CG2 THR A 65 -2.774 -6.906 8.314 1.00 0.00 C ATOM 0 H THR A 65 -4.288 -3.784 10.081 1.00 0.00 H new ATOM 0 HA THR A 65 -2.949 -6.073 10.817 1.00 0.00 H new ATOM 0 HB THR A 65 -2.782 -4.764 8.091 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.968 -6.068 8.085 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.118 -7.075 7.294 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.688 -6.988 8.349 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.215 -7.653 8.974 1.00 0.00 H new ATOM 1008 N ALA A 66 -0.487 -6.036 10.280 1.00 0.00 N ATOM 1009 CA ALA A 66 0.960 -5.948 10.385 1.00 0.00 C ATOM 1010 C ALA A 66 1.563 -5.854 8.982 1.00 0.00 C ATOM 1011 O ALA A 66 0.897 -6.159 7.994 1.00 0.00 O ATOM 1012 CB ALA A 66 1.489 -7.152 11.168 1.00 0.00 C ATOM 0 H ALA A 66 -0.851 -6.983 10.175 1.00 0.00 H new ATOM 0 HA ALA A 66 1.252 -5.051 10.930 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.574 -7.086 11.247 1.00 0.00 H new ATOM 0 HB2 ALA A 66 1.052 -7.157 12.167 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.218 -8.071 10.649 1.00 0.00 H new ATOM 1018 N ILE A 67 2.818 -5.430 8.940 1.00 0.00 N ATOM 1019 CA ILE A 67 3.519 -5.292 7.674 1.00 0.00 C ATOM 1020 C ILE A 67 4.486 -6.465 7.501 1.00 0.00 C ATOM 1021 O ILE A 67 5.343 -6.442 6.620 1.00 0.00 O ATOM 1022 CB ILE A 67 4.192 -3.921 7.582 1.00 0.00 C ATOM 1023 CG1 ILE A 67 4.694 -3.652 6.162 1.00 0.00 C ATOM 1024 CG2 ILE A 67 5.308 -3.787 8.619 1.00 0.00 C ATOM 1025 CD1 ILE A 67 3.781 -2.660 5.437 1.00 0.00 C ATOM 0 H ILE A 67 3.367 -5.178 9.762 1.00 0.00 H new ATOM 0 HA ILE A 67 2.816 -5.333 6.842 1.00 0.00 H new ATOM 0 HB ILE A 67 3.447 -3.159 7.811 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.709 -3.257 6.200 1.00 0.00 H new ATOM 0 HG13 ILE A 67 4.737 -4.587 5.604 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.770 -2.803 8.532 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.891 -3.905 9.619 1.00 0.00 H new ATOM 0 HG23 ILE A 67 6.060 -4.557 8.446 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.160 -2.486 4.430 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.772 -3.069 5.380 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.760 -1.718 5.985 1.00 0.00 H new ATOM 1037 N ALA A 68 4.315 -7.462 8.356 1.00 0.00 N ATOM 1038 CA ALA A 68 5.162 -8.642 8.309 1.00 0.00 C ATOM 1039 C ALA A 68 4.677 -9.568 7.191 1.00 0.00 C ATOM 1040 O ALA A 68 5.440 -9.910 6.289 1.00 0.00 O ATOM 1041 CB ALA A 68 5.159 -9.328 9.676 1.00 0.00 C ATOM 0 H ALA A 68 3.602 -7.477 9.086 1.00 0.00 H new ATOM 0 HA ALA A 68 6.192 -8.366 8.085 1.00 0.00 H new ATOM 0 HB1 ALA A 68 5.794 -10.213 9.640 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.539 -8.639 10.430 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.141 -9.622 9.933 1.00 0.00 H new ATOM 1047 N PRO A 69 3.378 -9.957 7.290 1.00 0.00 N ATOM 1048 CA PRO A 69 2.782 -10.837 6.299 1.00 0.00 C ATOM 1049 C PRO A 69 2.493 -10.082 4.999 1.00 0.00 C ATOM 1050 O PRO A 69 1.369 -10.103 4.502 1.00 0.00 O ATOM 1051 CB PRO A 69 1.527 -11.382 6.960 1.00 0.00 C ATOM 1052 CG PRO A 69 1.218 -10.438 8.111 1.00 0.00 C ATOM 1053 CD PRO A 69 2.444 -9.571 8.345 1.00 0.00 C ATOM 0 HA PRO A 69 3.446 -11.650 6.005 1.00 0.00 H new ATOM 0 HB2 PRO A 69 0.698 -11.420 6.253 1.00 0.00 H new ATOM 0 HB3 PRO A 69 1.685 -12.398 7.320 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.352 -9.819 7.875 1.00 0.00 H new ATOM 0 HG3 PRO A 69 0.971 -11.001 9.011 1.00 0.00 H new ATOM 0 HD2 PRO A 69 2.196 -8.511 8.286 1.00 0.00 H new ATOM 0 HD3 PRO A 69 2.869 -9.745 9.333 1.00 0.00 H new ATOM 1061 N LEU A 70 3.529 -9.433 4.487 1.00 0.00 N ATOM 1062 CA LEU A 70 3.400 -8.674 3.255 1.00 0.00 C ATOM 1063 C LEU A 70 4.657 -8.872 2.405 1.00 0.00 C ATOM 1064 O LEU A 70 4.567 -9.067 1.194 1.00 0.00 O ATOM 1065 CB LEU A 70 3.090 -7.207 3.560 1.00 0.00 C ATOM 1066 CG LEU A 70 1.609 -6.853 3.714 1.00 0.00 C ATOM 1067 CD1 LEU A 70 0.753 -7.621 2.705 1.00 0.00 C ATOM 1068 CD2 LEU A 70 1.139 -7.078 5.153 1.00 0.00 C ATOM 0 H LEU A 70 4.460 -9.417 4.903 1.00 0.00 H new ATOM 0 HA LEU A 70 2.557 -9.040 2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.607 -6.930 4.479 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.509 -6.594 2.762 1.00 0.00 H new ATOM 0 HG LEU A 70 1.487 -5.792 3.497 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.295 -7.351 2.836 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.069 -7.368 1.693 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.874 -8.692 2.866 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.083 -6.819 5.236 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.278 -8.125 5.422 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.721 -6.450 5.828 1.00 0.00 H new ATOM 1080 N ASP A 71 5.800 -8.817 3.073 1.00 0.00 N ATOM 1081 CA ASP A 71 7.073 -8.988 2.395 1.00 0.00 C ATOM 1082 C ASP A 71 6.879 -9.897 1.179 1.00 0.00 C ATOM 1083 O ASP A 71 6.328 -10.990 1.298 1.00 0.00 O ATOM 1084 CB ASP A 71 8.104 -9.643 3.315 1.00 0.00 C ATOM 1085 CG ASP A 71 9.548 -9.590 2.811 1.00 0.00 C ATOM 1086 OD1 ASP A 71 9.956 -8.492 2.375 1.00 0.00 O ATOM 1087 OD2 ASP A 71 10.210 -10.648 2.873 1.00 0.00 O ATOM 0 H ASP A 71 5.871 -8.656 4.078 1.00 0.00 H new ATOM 0 HA ASP A 71 7.431 -8.003 2.097 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.058 -9.159 4.290 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.825 -10.686 3.464 1.00 0.00 H new ATOM 1092 N GLY A 72 7.344 -9.411 0.037 1.00 0.00 N ATOM 1093 CA GLY A 72 7.229 -10.166 -1.199 1.00 0.00 C ATOM 1094 C GLY A 72 5.818 -10.056 -1.780 1.00 0.00 C ATOM 1095 O GLY A 72 5.156 -11.067 -2.007 1.00 0.00 O ATOM 0 H GLY A 72 7.801 -8.504 -0.058 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.954 -9.796 -1.924 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.469 -11.213 -1.013 1.00 0.00 H new ATOM 1099 N GLU A 73 5.400 -8.818 -2.003 1.00 0.00 N ATOM 1100 CA GLU A 73 4.080 -8.562 -2.553 1.00 0.00 C ATOM 1101 C GLU A 73 4.017 -7.156 -3.151 1.00 0.00 C ATOM 1102 O GLU A 73 5.049 -6.519 -3.359 1.00 0.00 O ATOM 1103 CB GLU A 73 2.996 -8.755 -1.491 1.00 0.00 C ATOM 1104 CG GLU A 73 3.002 -7.600 -0.487 1.00 0.00 C ATOM 1105 CD GLU A 73 1.961 -6.544 -0.861 1.00 0.00 C ATOM 1106 OE1 GLU A 73 0.763 -6.903 -0.865 1.00 0.00 O ATOM 1107 OE2 GLU A 73 2.385 -5.400 -1.135 1.00 0.00 O ATOM 0 H GLU A 73 5.952 -7.982 -1.813 1.00 0.00 H new ATOM 0 HA GLU A 73 3.894 -9.283 -3.349 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.019 -8.820 -1.970 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.158 -9.697 -0.968 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.795 -7.981 0.513 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.992 -7.145 -0.456 1.00 0.00 H new ATOM 1114 N GLU A 74 2.797 -6.711 -3.411 1.00 0.00 N ATOM 1115 CA GLU A 74 2.586 -5.391 -3.981 1.00 0.00 C ATOM 1116 C GLU A 74 1.266 -4.802 -3.481 1.00 0.00 C ATOM 1117 O GLU A 74 0.193 -5.306 -3.810 1.00 0.00 O ATOM 1118 CB GLU A 74 2.620 -5.443 -5.510 1.00 0.00 C ATOM 1119 CG GLU A 74 4.017 -5.112 -6.039 1.00 0.00 C ATOM 1120 CD GLU A 74 4.162 -5.529 -7.504 1.00 0.00 C ATOM 1121 OE1 GLU A 74 3.129 -5.498 -8.207 1.00 0.00 O ATOM 1122 OE2 GLU A 74 5.302 -5.869 -7.888 1.00 0.00 O ATOM 0 H GLU A 74 1.943 -7.242 -3.237 1.00 0.00 H new ATOM 0 HA GLU A 74 3.398 -4.741 -3.654 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.324 -6.435 -5.850 1.00 0.00 H new ATOM 0 HB3 GLU A 74 1.896 -4.737 -5.918 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.203 -4.042 -5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.768 -5.622 -5.436 1.00 0.00 H new ATOM 1129 N LEU A 75 1.388 -3.742 -2.696 1.00 0.00 N ATOM 1130 CA LEU A 75 0.217 -3.078 -2.148 1.00 0.00 C ATOM 1131 C LEU A 75 -0.146 -1.882 -3.030 1.00 0.00 C ATOM 1132 O LEU A 75 0.735 -1.211 -3.565 1.00 0.00 O ATOM 1133 CB LEU A 75 0.447 -2.712 -0.680 1.00 0.00 C ATOM 1134 CG LEU A 75 0.531 -3.885 0.299 1.00 0.00 C ATOM 1135 CD1 LEU A 75 1.910 -3.950 0.959 1.00 0.00 C ATOM 1136 CD2 LEU A 75 -0.596 -3.820 1.331 1.00 0.00 C ATOM 0 H LEU A 75 2.280 -3.326 -2.426 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.640 -3.751 -2.155 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.372 -2.139 -0.610 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.361 -2.054 -0.359 1.00 0.00 H new ATOM 0 HG LEU A 75 0.399 -4.809 -0.263 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.943 -4.792 1.650 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.674 -4.079 0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.096 -3.025 1.505 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.513 -4.665 2.014 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.521 -2.890 1.894 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.559 -3.859 0.821 1.00 0.00 H new ATOM 1148 N ILE A 76 -1.445 -1.653 -3.156 1.00 0.00 N ATOM 1149 CA ILE A 76 -1.935 -0.550 -3.964 1.00 0.00 C ATOM 1150 C ILE A 76 -2.695 0.433 -3.071 1.00 0.00 C ATOM 1151 O ILE A 76 -3.788 0.128 -2.596 1.00 0.00 O ATOM 1152 CB ILE A 76 -2.759 -1.073 -5.142 1.00 0.00 C ATOM 1153 CG1 ILE A 76 -1.868 -1.790 -6.159 1.00 0.00 C ATOM 1154 CG2 ILE A 76 -3.573 0.051 -5.785 1.00 0.00 C ATOM 1155 CD1 ILE A 76 -2.709 -2.507 -7.216 1.00 0.00 C ATOM 0 H ILE A 76 -2.173 -2.213 -2.712 1.00 0.00 H new ATOM 0 HA ILE A 76 -1.102 -0.002 -4.405 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.469 -1.807 -4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.208 -1.069 -6.642 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -1.231 -2.511 -5.646 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -4.149 -0.349 -6.620 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -4.252 0.477 -5.046 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.899 0.827 -6.148 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -2.051 -3.008 -7.926 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.350 -3.244 -6.732 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.326 -1.780 -7.744 1.00 0.00 H new ATOM 1167 N VAL A 77 -2.087 1.593 -2.870 1.00 0.00 N ATOM 1168 CA VAL A 77 -2.693 2.622 -2.042 1.00 0.00 C ATOM 1169 C VAL A 77 -3.529 3.552 -2.923 1.00 0.00 C ATOM 1170 O VAL A 77 -2.987 4.283 -3.750 1.00 0.00 O ATOM 1171 CB VAL A 77 -1.611 3.361 -1.251 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -2.231 4.403 -0.318 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -0.735 2.379 -0.471 1.00 0.00 C ATOM 0 H VAL A 77 -1.181 1.843 -3.266 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.366 2.176 -1.309 1.00 0.00 H new ATOM 0 HB VAL A 77 -0.974 3.885 -1.963 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.441 4.914 0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.792 5.129 -0.906 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.902 3.909 0.385 1.00 0.00 H new ATOM 0 HG21 VAL A 77 0.026 2.930 0.082 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.354 1.815 0.227 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -0.252 1.692 -1.165 1.00 0.00 H new ATOM 1183 N GLU A 78 -4.836 3.494 -2.716 1.00 0.00 N ATOM 1184 CA GLU A 78 -5.753 4.321 -3.481 1.00 0.00 C ATOM 1185 C GLU A 78 -6.474 5.307 -2.559 1.00 0.00 C ATOM 1186 O GLU A 78 -6.519 5.108 -1.346 1.00 0.00 O ATOM 1187 CB GLU A 78 -6.754 3.461 -4.254 1.00 0.00 C ATOM 1188 CG GLU A 78 -6.450 3.478 -5.753 1.00 0.00 C ATOM 1189 CD GLU A 78 -7.737 3.585 -6.573 1.00 0.00 C ATOM 1190 OE1 GLU A 78 -8.554 2.644 -6.471 1.00 0.00 O ATOM 1191 OE2 GLU A 78 -7.875 4.604 -7.283 1.00 0.00 O ATOM 0 H GLU A 78 -5.282 2.886 -2.029 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.176 4.890 -4.209 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.720 2.436 -3.884 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.765 3.829 -4.080 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.796 4.318 -5.985 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.913 2.570 -6.029 1.00 0.00 H new ATOM 1198 N VAL A 79 -7.021 6.347 -3.170 1.00 0.00 N ATOM 1199 CA VAL A 79 -7.738 7.364 -2.419 1.00 0.00 C ATOM 1200 C VAL A 79 -9.237 7.236 -2.697 1.00 0.00 C ATOM 1201 O VAL A 79 -9.663 7.274 -3.851 1.00 0.00 O ATOM 1202 CB VAL A 79 -7.184 8.750 -2.754 1.00 0.00 C ATOM 1203 CG1 VAL A 79 -7.023 8.925 -4.265 1.00 0.00 C ATOM 1204 CG2 VAL A 79 -8.069 9.851 -2.166 1.00 0.00 C ATOM 0 H VAL A 79 -6.982 6.508 -4.177 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.593 7.221 -1.348 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.197 8.835 -2.300 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.628 9.919 -4.476 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.334 8.172 -4.647 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.992 8.810 -4.750 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.653 10.826 -2.419 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.075 9.768 -2.578 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.111 9.744 -1.082 1.00 0.00 H new ATOM 1214 N LEU A 80 -9.996 7.085 -1.622 1.00 0.00 N ATOM 1215 CA LEU A 80 -11.438 6.951 -1.736 1.00 0.00 C ATOM 1216 C LEU A 80 -12.013 8.211 -2.386 1.00 0.00 C ATOM 1217 O LEU A 80 -12.574 8.149 -3.479 1.00 0.00 O ATOM 1218 CB LEU A 80 -12.056 6.625 -0.375 1.00 0.00 C ATOM 1219 CG LEU A 80 -11.677 5.270 0.226 1.00 0.00 C ATOM 1220 CD1 LEU A 80 -12.144 5.165 1.679 1.00 0.00 C ATOM 1221 CD2 LEU A 80 -12.211 4.121 -0.632 1.00 0.00 C ATOM 0 H LEU A 80 -9.639 7.052 -0.667 1.00 0.00 H new ATOM 0 HA LEU A 80 -11.692 6.112 -2.384 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -11.768 7.406 0.329 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.141 6.667 -0.471 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.590 5.190 0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.862 4.192 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -11.676 5.952 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -13.228 5.275 1.722 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -11.928 3.169 -0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -13.298 4.185 -0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -11.789 4.189 -1.635 1.00 0.00 H new ATOM 1233 N SER A 81 -11.855 9.325 -1.686 1.00 0.00 N ATOM 1234 CA SER A 81 -12.351 10.597 -2.181 1.00 0.00 C ATOM 1235 C SER A 81 -11.473 11.089 -3.333 1.00 0.00 C ATOM 1236 O SER A 81 -10.292 11.373 -3.141 1.00 0.00 O ATOM 1237 CB SER A 81 -12.398 11.643 -1.065 1.00 0.00 C ATOM 1238 OG SER A 81 -13.617 12.380 -1.074 1.00 0.00 O ATOM 0 H SER A 81 -11.390 9.372 -0.779 1.00 0.00 H new ATOM 0 HA SER A 81 -13.368 10.448 -2.545 1.00 0.00 H new ATOM 0 HB2 SER A 81 -12.280 11.149 -0.100 1.00 0.00 H new ATOM 0 HB3 SER A 81 -11.559 12.330 -1.176 1.00 0.00 H new ATOM 0 HG SER A 81 -13.608 13.036 -0.346 1.00 0.00 H new ATOM 1244 N GLY A 82 -12.084 11.176 -4.506 1.00 0.00 N ATOM 1245 CA GLY A 82 -11.372 11.628 -5.689 1.00 0.00 C ATOM 1246 C GLY A 82 -11.088 13.130 -5.617 1.00 0.00 C ATOM 1247 O GLY A 82 -11.896 13.893 -5.089 1.00 0.00 O ATOM 0 H GLY A 82 -13.064 10.941 -4.662 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.434 11.081 -5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -11.961 11.408 -6.579 1.00 0.00 H new ATOM 1251 N PRO A 83 -9.909 13.520 -6.171 1.00 0.00 N ATOM 1252 CA PRO A 83 -9.509 14.917 -6.174 1.00 0.00 C ATOM 1253 C PRO A 83 -10.300 15.711 -7.216 1.00 0.00 C ATOM 1254 O PRO A 83 -10.080 15.557 -8.417 1.00 0.00 O ATOM 1255 CB PRO A 83 -8.015 14.898 -6.451 1.00 0.00 C ATOM 1256 CG PRO A 83 -7.719 13.532 -7.050 1.00 0.00 C ATOM 1257 CD PRO A 83 -8.928 12.644 -6.805 1.00 0.00 C ATOM 0 HA PRO A 83 -9.719 15.417 -5.228 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -7.735 15.695 -7.140 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -7.446 15.054 -5.535 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -7.519 13.619 -8.118 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -6.829 13.100 -6.593 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -9.311 12.230 -7.738 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -8.676 11.801 -6.162 1.00 0.00 H new ATOM 1265 N SER A 84 -11.204 16.542 -6.719 1.00 0.00 N ATOM 1266 CA SER A 84 -12.028 17.360 -7.592 1.00 0.00 C ATOM 1267 C SER A 84 -12.507 18.606 -6.844 1.00 0.00 C ATOM 1268 O SER A 84 -12.843 18.534 -5.663 1.00 0.00 O ATOM 1269 CB SER A 84 -13.225 16.567 -8.122 1.00 0.00 C ATOM 1270 OG SER A 84 -12.979 16.033 -9.420 1.00 0.00 O ATOM 0 H SER A 84 -11.384 16.666 -5.723 1.00 0.00 H new ATOM 0 HA SER A 84 -11.422 17.666 -8.445 1.00 0.00 H new ATOM 0 HB2 SER A 84 -13.455 15.754 -7.433 1.00 0.00 H new ATOM 0 HB3 SER A 84 -14.102 17.214 -8.156 1.00 0.00 H new ATOM 0 HG SER A 84 -12.049 15.729 -9.478 1.00 0.00 H new ATOM 1276 N SER A 85 -12.522 19.719 -7.562 1.00 0.00 N ATOM 1277 CA SER A 85 -12.954 20.979 -6.981 1.00 0.00 C ATOM 1278 C SER A 85 -13.042 22.053 -8.066 1.00 0.00 C ATOM 1279 O SER A 85 -12.026 22.619 -8.468 1.00 0.00 O ATOM 1280 CB SER A 85 -12.004 21.426 -5.867 1.00 0.00 C ATOM 1281 OG SER A 85 -12.641 22.305 -4.944 1.00 0.00 O ATOM 0 H SER A 85 -12.242 19.775 -8.541 1.00 0.00 H new ATOM 0 HA SER A 85 -13.941 20.833 -6.543 1.00 0.00 H new ATOM 0 HB2 SER A 85 -11.631 20.551 -5.336 1.00 0.00 H new ATOM 0 HB3 SER A 85 -11.140 21.925 -6.306 1.00 0.00 H new ATOM 0 HG SER A 85 -12.003 22.566 -4.248 1.00 0.00 H new ATOM 1287 N GLY A 86 -14.265 22.302 -8.511 1.00 0.00 N ATOM 1288 CA GLY A 86 -14.498 23.298 -9.542 1.00 0.00 C ATOM 1289 C GLY A 86 -14.896 24.642 -8.926 1.00 0.00 C ATOM 1290 O GLY A 86 -15.589 25.437 -9.559 1.00 0.00 O ATOM 0 H GLY A 86 -15.105 21.831 -8.176 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.597 23.422 -10.143 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -15.285 22.954 -10.214 1.00 0.00 H new TER 1294 GLY A 86