USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 744 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 Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 151:sc= 1.78 (180deg=-0.285) USER MOD Single : A 18 GLN : amide:sc= 1.07 K(o=1.1,f=-0.61) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 113:sc= 0.142 USER MOD Single : A 87 ASN : amide:sc= -0.0509 X(o=-0.051,f=-0.22) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 104:sc= 0.961 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -160:sc= -0.154 (180deg=-0.805) USER MOD Single : A 138 MET CE :methyl -111:sc= -0.715 (180deg=-2.67!) USER MOD Single : A 141 LYS NZ :NH3+ -112:sc= 1.08 (180deg=0.44) USER MOD Single : A 144 GLN : amide:sc= -0.504 K(o=-0.5,f=-2.6) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -1.643 3.584 12.983 1.00 1.04 N ATOM 57 CA VAL A 5 -1.641 2.560 11.958 1.00 65.45 C ATOM 58 C VAL A 5 -2.815 2.787 11.015 1.00 14.44 C ATOM 59 O VAL A 5 -3.896 3.190 11.449 1.00 3.41 O ATOM 60 CB VAL A 5 -1.706 1.139 12.578 1.00 44.35 C ATOM 61 CG1 VAL A 5 -2.942 0.974 13.450 1.00 72.32 C ATOM 62 CG2 VAL A 5 -1.672 0.066 11.500 1.00 33.05 C ATOM 0 HA VAL A 5 -0.708 2.629 11.399 1.00 65.45 H new ATOM 0 HB VAL A 5 -0.825 1.019 13.208 1.00 44.35 H new ATOM 0 HG11 VAL A 5 -2.959 -0.032 13.870 1.00 72.32 H new ATOM 0 HG12 VAL A 5 -2.917 1.705 14.259 1.00 72.32 H new ATOM 0 HG13 VAL A 5 -3.836 1.131 12.847 1.00 72.32 H new ATOM 0 HG21 VAL A 5 -1.719 -0.919 11.965 1.00 33.05 H new ATOM 0 HG22 VAL A 5 -2.525 0.193 10.833 1.00 33.05 H new ATOM 0 HG23 VAL A 5 -0.748 0.154 10.928 1.00 33.05 H new ATOM 72 N VAL A 6 -2.607 2.564 9.732 1.00 44.12 N ATOM 73 CA VAL A 6 -3.676 2.733 8.771 1.00 61.22 C ATOM 74 C VAL A 6 -3.978 1.419 8.075 1.00 10.21 C ATOM 75 O VAL A 6 -3.076 0.631 7.781 1.00 55.03 O ATOM 76 CB VAL A 6 -3.353 3.824 7.719 1.00 43.31 C ATOM 77 CG1 VAL A 6 -2.185 3.413 6.834 1.00 25.43 C ATOM 78 CG2 VAL A 6 -4.581 4.150 6.877 1.00 1.31 C ATOM 0 H VAL A 6 -1.715 2.268 9.335 1.00 44.12 H new ATOM 0 HA VAL A 6 -4.554 3.060 9.327 1.00 61.22 H new ATOM 0 HB VAL A 6 -3.061 4.725 8.258 1.00 43.31 H new ATOM 0 HG11 VAL A 6 -1.985 4.200 6.107 1.00 25.43 H new ATOM 0 HG12 VAL A 6 -1.300 3.254 7.450 1.00 25.43 H new ATOM 0 HG13 VAL A 6 -2.433 2.490 6.310 1.00 25.43 H new ATOM 0 HG21 VAL A 6 -4.328 4.918 6.146 1.00 1.31 H new ATOM 0 HG22 VAL A 6 -4.915 3.252 6.358 1.00 1.31 H new ATOM 0 HG23 VAL A 6 -5.380 4.513 7.524 1.00 1.31 H new ATOM 88 N ARG A 7 -5.252 1.173 7.865 1.00 1.41 N ATOM 89 CA ARG A 7 -5.692 0.052 7.071 1.00 25.35 C ATOM 90 C ARG A 7 -6.809 0.521 6.148 1.00 35.13 C ATOM 91 O ARG A 7 -7.901 0.870 6.594 1.00 54.45 O ATOM 92 CB ARG A 7 -6.124 -1.129 7.970 1.00 33.52 C ATOM 93 CG ARG A 7 -7.137 -0.778 9.054 1.00 24.53 C ATOM 94 CD ARG A 7 -8.565 -1.051 8.604 1.00 34.41 C ATOM 95 NE ARG A 7 -9.553 -0.479 9.516 1.00 24.04 N ATOM 96 CZ ARG A 7 -10.347 0.549 9.200 1.00 43.41 C ATOM 97 NH1 ARG A 7 -10.223 1.153 8.023 1.00 64.32 N ATOM 98 NH2 ARG A 7 -11.250 0.985 10.067 1.00 54.32 N ATOM 0 H ARG A 7 -6.009 1.744 8.240 1.00 1.41 H new ATOM 0 HA ARG A 7 -4.870 -0.321 6.460 1.00 25.35 H new ATOM 0 HB2 ARG A 7 -6.546 -1.911 7.339 1.00 33.52 H new ATOM 0 HB3 ARG A 7 -5.237 -1.548 8.445 1.00 33.52 H new ATOM 0 HG2 ARG A 7 -6.922 -1.356 9.953 1.00 24.53 H new ATOM 0 HG3 ARG A 7 -7.035 0.274 9.320 1.00 24.53 H new ATOM 0 HD2 ARG A 7 -8.714 -0.639 7.606 1.00 34.41 H new ATOM 0 HD3 ARG A 7 -8.721 -2.127 8.531 1.00 34.41 H new ATOM 0 HE ARG A 7 -9.642 -0.887 10.447 1.00 24.04 H new ATOM 0 HH11 ARG A 7 -9.520 0.833 7.357 1.00 64.32 H new ATOM 0 HH12 ARG A 7 -10.831 1.937 7.786 1.00 64.32 H new ATOM 0 HH21 ARG A 7 -11.341 0.536 10.978 1.00 54.32 H new ATOM 0 HH22 ARG A 7 -11.854 1.770 9.823 1.00 54.32 H new ATOM 112 N ASP A 8 -6.516 0.589 4.867 1.00 72.04 N ATOM 113 CA ASP A 8 -7.492 1.051 3.901 1.00 14.35 C ATOM 114 C ASP A 8 -7.520 0.080 2.738 1.00 21.01 C ATOM 115 O ASP A 8 -6.669 -0.810 2.652 1.00 2.13 O ATOM 116 CB ASP A 8 -7.152 2.466 3.425 1.00 11.22 C ATOM 117 CG ASP A 8 -8.373 3.247 2.977 1.00 70.23 C ATOM 118 OD1 ASP A 8 -9.031 2.840 1.996 1.00 63.33 O ATOM 119 OD2 ASP A 8 -8.674 4.282 3.603 1.00 60.22 O ATOM 0 H ASP A 8 -5.612 0.331 4.470 1.00 72.04 H new ATOM 0 HA ASP A 8 -8.478 1.091 4.364 1.00 14.35 H new ATOM 0 HB2 ASP A 8 -6.657 3.006 4.232 1.00 11.22 H new ATOM 0 HB3 ASP A 8 -6.442 2.406 2.600 1.00 11.22 H new ATOM 124 N ALA A 9 -8.474 0.249 1.849 1.00 12.33 N ATOM 125 CA ALA A 9 -8.675 -0.698 0.778 1.00 43.12 C ATOM 126 C ALA A 9 -9.035 0.003 -0.520 1.00 0.42 C ATOM 127 O ALA A 9 -10.018 0.742 -0.593 1.00 73.15 O ATOM 128 CB ALA A 9 -9.753 -1.693 1.163 1.00 53.45 C ATOM 0 H ALA A 9 -9.123 1.036 1.848 1.00 12.33 H new ATOM 0 HA ALA A 9 -7.739 -1.232 0.615 1.00 43.12 H new ATOM 0 HB1 ALA A 9 -9.899 -2.404 0.350 1.00 53.45 H new ATOM 0 HB2 ALA A 9 -9.450 -2.228 2.063 1.00 53.45 H new ATOM 0 HB3 ALA A 9 -10.686 -1.163 1.353 1.00 53.45 H new ATOM 134 N VAL A 10 -8.228 -0.228 -1.539 1.00 3.24 N ATOM 135 CA VAL A 10 -8.488 0.317 -2.857 1.00 13.23 C ATOM 136 C VAL A 10 -8.840 -0.808 -3.824 1.00 31.43 C ATOM 137 O VAL A 10 -8.214 -1.869 -3.815 1.00 42.23 O ATOM 138 CB VAL A 10 -7.290 1.134 -3.399 1.00 35.41 C ATOM 139 CG1 VAL A 10 -7.139 2.443 -2.639 1.00 44.14 C ATOM 140 CG2 VAL A 10 -6.001 0.332 -3.314 1.00 31.12 C ATOM 0 H VAL A 10 -7.381 -0.794 -1.477 1.00 3.24 H new ATOM 0 HA VAL A 10 -9.332 1.001 -2.769 1.00 13.23 H new ATOM 0 HB VAL A 10 -7.490 1.359 -4.447 1.00 35.41 H new ATOM 0 HG11 VAL A 10 -6.291 2.999 -3.038 1.00 44.14 H new ATOM 0 HG12 VAL A 10 -8.047 3.036 -2.751 1.00 44.14 H new ATOM 0 HG13 VAL A 10 -6.971 2.233 -1.583 1.00 44.14 H new ATOM 0 HG21 VAL A 10 -5.175 0.929 -3.701 1.00 31.12 H new ATOM 0 HG22 VAL A 10 -5.803 0.070 -2.275 1.00 31.12 H new ATOM 0 HG23 VAL A 10 -6.099 -0.578 -3.905 1.00 31.12 H new ATOM 150 N THR A 11 -9.855 -0.582 -4.641 1.00 0.14 N ATOM 151 CA THR A 11 -10.311 -1.588 -5.578 1.00 43.20 C ATOM 152 C THR A 11 -9.550 -1.464 -6.887 1.00 12.43 C ATOM 153 O THR A 11 -9.755 -0.515 -7.648 1.00 75.34 O ATOM 154 CB THR A 11 -11.818 -1.446 -5.851 1.00 11.11 C ATOM 155 OG1 THR A 11 -12.530 -1.295 -4.615 1.00 70.34 O ATOM 156 CG2 THR A 11 -12.350 -2.659 -6.599 1.00 53.30 C ATOM 0 H THR A 11 -10.379 0.293 -4.672 1.00 0.14 H new ATOM 0 HA THR A 11 -10.126 -2.567 -5.136 1.00 43.20 H new ATOM 0 HB THR A 11 -11.969 -0.561 -6.469 1.00 11.11 H new ATOM 0 HG1 THR A 11 -13.488 -1.204 -4.799 1.00 70.34 H new ATOM 0 HG21 THR A 11 -13.418 -2.535 -6.780 1.00 53.30 H new ATOM 0 HG22 THR A 11 -11.829 -2.756 -7.551 1.00 53.30 H new ATOM 0 HG23 THR A 11 -12.185 -3.556 -6.002 1.00 53.30 H new ATOM 164 N ILE A 12 -8.657 -2.406 -7.135 1.00 4.14 N ATOM 165 CA ILE A 12 -7.820 -2.358 -8.320 1.00 65.22 C ATOM 166 C ILE A 12 -8.285 -3.385 -9.344 1.00 12.44 C ATOM 167 O ILE A 12 -8.523 -4.547 -9.007 1.00 73.05 O ATOM 168 CB ILE A 12 -6.337 -2.627 -7.988 1.00 63.14 C ATOM 169 CG1 ILE A 12 -5.905 -1.877 -6.723 1.00 14.15 C ATOM 170 CG2 ILE A 12 -5.464 -2.216 -9.161 1.00 42.43 C ATOM 171 CD1 ILE A 12 -6.020 -0.373 -6.824 1.00 1.22 C ATOM 0 H ILE A 12 -8.493 -3.212 -6.532 1.00 4.14 H new ATOM 0 HA ILE A 12 -7.910 -1.352 -8.730 1.00 65.22 H new ATOM 0 HB ILE A 12 -6.218 -3.695 -7.803 1.00 63.14 H new ATOM 0 HG12 ILE A 12 -6.512 -2.221 -5.885 1.00 14.15 H new ATOM 0 HG13 ILE A 12 -4.871 -2.137 -6.496 1.00 14.15 H new ATOM 0 HG21 ILE A 12 -4.418 -2.408 -8.921 1.00 42.43 H new ATOM 0 HG22 ILE A 12 -5.745 -2.791 -10.043 1.00 42.43 H new ATOM 0 HG23 ILE A 12 -5.601 -1.153 -9.362 1.00 42.43 H new ATOM 0 HD11 ILE A 12 -5.695 0.080 -5.888 1.00 1.22 H new ATOM 0 HD12 ILE A 12 -5.391 -0.014 -7.639 1.00 1.22 H new ATOM 0 HD13 ILE A 12 -7.057 -0.100 -7.019 1.00 1.22 H new ATOM 183 N GLY A 13 -8.411 -2.957 -10.592 1.00 43.11 N ATOM 184 CA GLY A 13 -8.817 -3.860 -11.652 1.00 0.23 C ATOM 185 C GLY A 13 -7.660 -4.685 -12.191 1.00 40.21 C ATOM 186 O GLY A 13 -7.341 -4.621 -13.375 1.00 73.44 O ATOM 0 H GLY A 13 -8.239 -1.997 -10.891 1.00 43.11 H new ATOM 0 HA2 GLY A 13 -9.592 -4.529 -11.278 1.00 0.23 H new ATOM 0 HA3 GLY A 13 -9.258 -3.284 -12.466 1.00 0.23 H new ATOM 190 N LYS A 14 -7.018 -5.436 -11.307 1.00 20.54 N ATOM 191 CA LYS A 14 -5.943 -6.352 -11.682 1.00 3.21 C ATOM 192 C LYS A 14 -6.207 -7.704 -11.015 1.00 22.05 C ATOM 193 O LYS A 14 -6.853 -7.747 -9.966 1.00 62.11 O ATOM 194 CB LYS A 14 -4.576 -5.808 -11.242 1.00 11.02 C ATOM 195 CG LYS A 14 -4.205 -4.438 -11.807 1.00 31.10 C ATOM 196 CD LYS A 14 -3.418 -4.530 -13.112 1.00 34.32 C ATOM 197 CE LYS A 14 -4.318 -4.583 -14.340 1.00 63.03 C ATOM 198 NZ LYS A 14 -5.169 -3.367 -14.458 1.00 3.43 N ATOM 0 H LYS A 14 -7.226 -5.429 -10.308 1.00 20.54 H new ATOM 0 HA LYS A 14 -5.923 -6.460 -12.766 1.00 3.21 H new ATOM 0 HB2 LYS A 14 -4.560 -5.750 -10.154 1.00 11.02 H new ATOM 0 HB3 LYS A 14 -3.808 -6.523 -11.535 1.00 11.02 H new ATOM 0 HG2 LYS A 14 -5.114 -3.861 -11.976 1.00 31.10 H new ATOM 0 HG3 LYS A 14 -3.615 -3.894 -11.070 1.00 31.10 H new ATOM 0 HD2 LYS A 14 -2.753 -3.670 -13.191 1.00 34.32 H new ATOM 0 HD3 LYS A 14 -2.788 -5.419 -13.090 1.00 34.32 H new ATOM 0 HE2 LYS A 14 -3.705 -4.685 -15.235 1.00 63.03 H new ATOM 0 HE3 LYS A 14 -4.953 -5.467 -14.286 1.00 63.03 H new ATOM 0 HZ1 LYS A 14 -5.378 -3.185 -15.461 1.00 3.43 H new ATOM 0 HZ2 LYS A 14 -6.059 -3.514 -13.940 1.00 3.43 H new ATOM 0 HZ3 LYS A 14 -4.666 -2.551 -14.056 1.00 3.43 H new ATOM 212 N PRO A 15 -5.719 -8.819 -11.603 1.00 55.13 N ATOM 213 CA PRO A 15 -6.044 -10.176 -11.130 1.00 73.52 C ATOM 214 C PRO A 15 -5.739 -10.400 -9.645 1.00 34.43 C ATOM 215 O PRO A 15 -6.641 -10.739 -8.881 1.00 72.22 O ATOM 216 CB PRO A 15 -5.164 -11.089 -12.003 1.00 43.12 C ATOM 217 CG PRO A 15 -4.173 -10.186 -12.660 1.00 25.21 C ATOM 218 CD PRO A 15 -4.843 -8.851 -12.780 1.00 25.20 C ATOM 0 HA PRO A 15 -7.113 -10.372 -11.217 1.00 73.52 H new ATOM 0 HB2 PRO A 15 -4.664 -11.845 -11.398 1.00 43.12 H new ATOM 0 HB3 PRO A 15 -5.763 -11.618 -12.744 1.00 43.12 H new ATOM 0 HG2 PRO A 15 -3.261 -10.112 -12.068 1.00 25.21 H new ATOM 0 HG3 PRO A 15 -3.887 -10.568 -13.640 1.00 25.21 H new ATOM 0 HD2 PRO A 15 -4.121 -8.034 -12.769 1.00 25.20 H new ATOM 0 HD3 PRO A 15 -5.409 -8.764 -13.708 1.00 25.20 H new ATOM 226 N ALA A 16 -4.471 -10.214 -9.253 1.00 52.41 N ATOM 227 CA ALA A 16 -4.050 -10.309 -7.845 1.00 64.41 C ATOM 228 C ALA A 16 -2.530 -10.242 -7.728 1.00 43.43 C ATOM 229 O ALA A 16 -1.982 -9.416 -7.003 1.00 65.45 O ATOM 230 CB ALA A 16 -4.544 -11.593 -7.185 1.00 42.33 C ATOM 0 H ALA A 16 -3.711 -9.995 -9.897 1.00 52.41 H new ATOM 0 HA ALA A 16 -4.497 -9.460 -7.328 1.00 64.41 H new ATOM 0 HB1 ALA A 16 -4.210 -11.621 -6.148 1.00 42.33 H new ATOM 0 HB2 ALA A 16 -5.633 -11.623 -7.217 1.00 42.33 H new ATOM 0 HB3 ALA A 16 -4.142 -12.454 -7.719 1.00 42.33 H new ATOM 236 N GLU A 17 -1.868 -11.127 -8.466 1.00 63.04 N ATOM 237 CA GLU A 17 -0.414 -11.300 -8.408 1.00 74.51 C ATOM 238 C GLU A 17 0.336 -9.993 -8.672 1.00 74.12 C ATOM 239 O GLU A 17 1.269 -9.639 -7.952 1.00 70.13 O ATOM 240 CB GLU A 17 -0.016 -12.359 -9.439 1.00 73.54 C ATOM 241 CG GLU A 17 1.473 -12.633 -9.533 1.00 52.22 C ATOM 242 CD GLU A 17 1.797 -13.580 -10.671 1.00 34.12 C ATOM 243 OE1 GLU A 17 1.784 -13.132 -11.841 1.00 41.02 O ATOM 244 OE2 GLU A 17 2.051 -14.772 -10.408 1.00 51.13 O ATOM 0 H GLU A 17 -2.327 -11.752 -9.129 1.00 63.04 H new ATOM 0 HA GLU A 17 -0.139 -11.618 -7.402 1.00 74.51 H new ATOM 0 HB2 GLU A 17 -0.527 -13.291 -9.197 1.00 73.54 H new ATOM 0 HB3 GLU A 17 -0.375 -12.044 -10.419 1.00 73.54 H new ATOM 0 HG2 GLU A 17 2.008 -11.694 -9.677 1.00 52.22 H new ATOM 0 HG3 GLU A 17 1.825 -13.059 -8.593 1.00 52.22 H new ATOM 251 N GLN A 18 -0.113 -9.259 -9.674 1.00 71.24 N ATOM 252 CA GLN A 18 0.581 -8.055 -10.117 1.00 72.21 C ATOM 253 C GLN A 18 0.278 -6.880 -9.204 1.00 41.25 C ATOM 254 O GLN A 18 0.889 -5.822 -9.313 1.00 41.55 O ATOM 255 CB GLN A 18 0.202 -7.727 -11.564 1.00 13.12 C ATOM 256 CG GLN A 18 1.169 -8.296 -12.598 1.00 41.50 C ATOM 257 CD GLN A 18 1.635 -9.701 -12.266 1.00 23.23 C ATOM 258 OE1 GLN A 18 2.654 -9.885 -11.602 1.00 13.13 O ATOM 259 NE2 GLN A 18 0.897 -10.702 -12.719 1.00 3.13 N ATOM 0 H GLN A 18 -0.959 -9.474 -10.201 1.00 71.24 H new ATOM 0 HA GLN A 18 1.654 -8.244 -10.071 1.00 72.21 H new ATOM 0 HB2 GLN A 18 -0.798 -8.113 -11.764 1.00 13.12 H new ATOM 0 HB3 GLN A 18 0.155 -6.644 -11.681 1.00 13.12 H new ATOM 0 HG2 GLN A 18 0.686 -8.301 -13.575 1.00 41.50 H new ATOM 0 HG3 GLN A 18 2.036 -7.640 -12.675 1.00 41.50 H new ATOM 0 HE21 GLN A 18 0.058 -10.510 -13.267 1.00 3.13 H new ATOM 0 HE22 GLN A 18 1.167 -11.665 -12.520 1.00 3.13 H new ATOM 268 N LEU A 19 -0.664 -7.078 -8.296 1.00 62.34 N ATOM 269 CA LEU A 19 -1.031 -6.043 -7.351 1.00 11.30 C ATOM 270 C LEU A 19 0.030 -5.878 -6.287 1.00 70.54 C ATOM 271 O LEU A 19 0.467 -4.768 -6.023 1.00 62.04 O ATOM 272 CB LEU A 19 -2.372 -6.360 -6.712 1.00 14.24 C ATOM 273 CG LEU A 19 -3.559 -6.228 -7.652 1.00 45.42 C ATOM 274 CD1 LEU A 19 -4.843 -6.633 -6.960 1.00 21.11 C ATOM 275 CD2 LEU A 19 -3.654 -4.803 -8.152 1.00 23.55 C ATOM 0 H LEU A 19 -1.187 -7.948 -8.196 1.00 62.34 H new ATOM 0 HA LEU A 19 -1.115 -5.103 -7.896 1.00 11.30 H new ATOM 0 HB2 LEU A 19 -2.344 -7.377 -6.322 1.00 14.24 H new ATOM 0 HB3 LEU A 19 -2.522 -5.696 -5.861 1.00 14.24 H new ATOM 0 HG LEU A 19 -3.411 -6.896 -8.500 1.00 45.42 H new ATOM 0 HD11 LEU A 19 -5.678 -6.530 -7.653 1.00 21.11 H new ATOM 0 HD12 LEU A 19 -4.769 -7.670 -6.633 1.00 21.11 H new ATOM 0 HD13 LEU A 19 -5.008 -5.991 -6.095 1.00 21.11 H new ATOM 0 HD21 LEU A 19 -4.506 -4.710 -8.826 1.00 23.55 H new ATOM 0 HD22 LEU A 19 -3.785 -4.129 -7.306 1.00 23.55 H new ATOM 0 HD23 LEU A 19 -2.739 -4.543 -8.685 1.00 23.55 H new ATOM 287 N TYR A 20 0.439 -6.967 -5.662 1.00 52.31 N ATOM 288 CA TYR A 20 1.506 -6.877 -4.675 1.00 41.33 C ATOM 289 C TYR A 20 2.842 -6.682 -5.386 1.00 50.34 C ATOM 290 O TYR A 20 3.791 -6.138 -4.827 1.00 63.32 O ATOM 291 CB TYR A 20 1.527 -8.081 -3.725 1.00 22.01 C ATOM 292 CG TYR A 20 2.150 -9.346 -4.271 1.00 42.04 C ATOM 293 CD1 TYR A 20 3.509 -9.584 -4.124 1.00 22.14 C ATOM 294 CD2 TYR A 20 1.377 -10.316 -4.894 1.00 2.44 C ATOM 295 CE1 TYR A 20 4.082 -10.747 -4.583 1.00 33.20 C ATOM 296 CE2 TYR A 20 1.946 -11.485 -5.362 1.00 34.43 C ATOM 297 CZ TYR A 20 3.299 -11.695 -5.202 1.00 73.14 C ATOM 298 OH TYR A 20 3.874 -12.860 -5.654 1.00 51.01 O ATOM 0 H TYR A 20 0.062 -7.903 -5.812 1.00 52.31 H new ATOM 0 HA TYR A 20 1.317 -6.010 -4.042 1.00 41.33 H new ATOM 0 HB2 TYR A 20 2.065 -7.796 -2.821 1.00 22.01 H new ATOM 0 HB3 TYR A 20 0.502 -8.303 -3.429 1.00 22.01 H new ATOM 0 HD1 TYR A 20 4.128 -8.843 -3.640 1.00 22.14 H new ATOM 0 HD2 TYR A 20 0.316 -10.155 -5.015 1.00 2.44 H new ATOM 0 HE1 TYR A 20 5.141 -10.916 -4.458 1.00 33.20 H new ATOM 0 HE2 TYR A 20 1.335 -12.230 -5.850 1.00 34.43 H new ATOM 0 HH TYR A 20 3.188 -13.425 -6.066 1.00 51.01 H new ATOM 308 N ALA A 21 2.886 -7.118 -6.642 1.00 14.35 N ATOM 309 CA ALA A 21 4.056 -6.934 -7.492 1.00 24.04 C ATOM 310 C ALA A 21 4.215 -5.470 -7.900 1.00 33.44 C ATOM 311 O ALA A 21 5.169 -5.109 -8.591 1.00 31.32 O ATOM 312 CB ALA A 21 3.953 -7.819 -8.721 1.00 74.03 C ATOM 0 H ALA A 21 2.115 -7.607 -7.097 1.00 14.35 H new ATOM 0 HA ALA A 21 4.940 -7.221 -6.923 1.00 24.04 H new ATOM 0 HB1 ALA A 21 4.832 -7.674 -9.349 1.00 74.03 H new ATOM 0 HB2 ALA A 21 3.895 -8.863 -8.414 1.00 74.03 H new ATOM 0 HB3 ALA A 21 3.057 -7.557 -9.284 1.00 74.03 H new ATOM 318 N VAL A 22 3.259 -4.638 -7.482 1.00 4.11 N ATOM 319 CA VAL A 22 3.294 -3.195 -7.730 1.00 13.35 C ATOM 320 C VAL A 22 4.608 -2.580 -7.223 1.00 74.02 C ATOM 321 O VAL A 22 5.020 -1.509 -7.667 1.00 45.44 O ATOM 322 CB VAL A 22 2.092 -2.479 -7.060 1.00 43.22 C ATOM 323 CG1 VAL A 22 2.255 -2.439 -5.547 1.00 13.45 C ATOM 324 CG2 VAL A 22 1.907 -1.077 -7.626 1.00 71.03 C ATOM 0 H VAL A 22 2.438 -4.946 -6.961 1.00 4.11 H new ATOM 0 HA VAL A 22 3.229 -3.052 -8.809 1.00 13.35 H new ATOM 0 HB VAL A 22 1.193 -3.053 -7.285 1.00 43.22 H new ATOM 0 HG11 VAL A 22 1.399 -1.932 -5.102 1.00 13.45 H new ATOM 0 HG12 VAL A 22 2.315 -3.456 -5.161 1.00 13.45 H new ATOM 0 HG13 VAL A 22 3.168 -1.900 -5.294 1.00 13.45 H new ATOM 0 HG21 VAL A 22 1.058 -0.597 -7.139 1.00 71.03 H new ATOM 0 HG22 VAL A 22 2.808 -0.490 -7.446 1.00 71.03 H new ATOM 0 HG23 VAL A 22 1.723 -1.139 -8.699 1.00 71.03 H new ATOM 334 N TRP A 23 5.259 -3.278 -6.295 1.00 34.04 N ATOM 335 CA TRP A 23 6.548 -2.861 -5.746 1.00 54.44 C ATOM 336 C TRP A 23 7.606 -2.767 -6.856 1.00 51.43 C ATOM 337 O TRP A 23 8.605 -2.061 -6.724 1.00 23.24 O ATOM 338 CB TRP A 23 6.980 -3.868 -4.673 1.00 50.55 C ATOM 339 CG TRP A 23 8.106 -3.402 -3.801 1.00 33.41 C ATOM 340 CD1 TRP A 23 8.050 -2.424 -2.850 1.00 20.44 C ATOM 341 CD2 TRP A 23 9.448 -3.909 -3.779 1.00 22.34 C ATOM 342 NE1 TRP A 23 9.275 -2.287 -2.243 1.00 11.21 N ATOM 343 CE2 TRP A 23 10.148 -3.187 -2.794 1.00 31.13 C ATOM 344 CE3 TRP A 23 10.125 -4.902 -4.494 1.00 41.14 C ATOM 345 CZ2 TRP A 23 11.492 -3.425 -2.509 1.00 42.31 C ATOM 346 CZ3 TRP A 23 11.458 -5.137 -4.210 1.00 51.12 C ATOM 347 CH2 TRP A 23 12.128 -4.403 -3.223 1.00 21.31 C ATOM 0 H TRP A 23 4.907 -4.151 -5.901 1.00 34.04 H new ATOM 0 HA TRP A 23 6.449 -1.872 -5.299 1.00 54.44 H new ATOM 0 HB2 TRP A 23 6.121 -4.099 -4.043 1.00 50.55 H new ATOM 0 HB3 TRP A 23 7.276 -4.796 -5.162 1.00 50.55 H new ATOM 0 HD1 TRP A 23 7.172 -1.843 -2.610 1.00 20.44 H new ATOM 0 HE1 TRP A 23 9.498 -1.623 -1.502 1.00 11.21 H new ATOM 0 HE3 TRP A 23 9.616 -5.475 -5.255 1.00 41.14 H new ATOM 0 HZ2 TRP A 23 12.012 -2.857 -1.752 1.00 42.31 H new ATOM 0 HZ3 TRP A 23 11.991 -5.899 -4.759 1.00 51.12 H new ATOM 0 HH2 TRP A 23 13.168 -4.614 -3.022 1.00 21.31 H new ATOM 358 N ARG A 24 7.370 -3.483 -7.951 1.00 64.11 N ATOM 359 CA ARG A 24 8.254 -3.447 -9.112 1.00 53.10 C ATOM 360 C ARG A 24 7.567 -2.714 -10.274 1.00 65.31 C ATOM 361 O ARG A 24 8.138 -2.563 -11.352 1.00 42.05 O ATOM 362 CB ARG A 24 8.638 -4.886 -9.511 1.00 3.33 C ATOM 363 CG ARG A 24 9.476 -5.002 -10.781 1.00 33.23 C ATOM 364 CD ARG A 24 10.793 -4.245 -10.679 1.00 41.22 C ATOM 365 NE ARG A 24 11.451 -4.137 -11.982 1.00 42.44 N ATOM 366 CZ ARG A 24 12.751 -3.877 -12.153 1.00 41.00 C ATOM 367 NH1 ARG A 24 13.546 -3.711 -11.100 1.00 61.14 N ATOM 368 NH2 ARG A 24 13.254 -3.783 -13.381 1.00 62.14 N ATOM 0 H ARG A 24 6.566 -4.101 -8.059 1.00 64.11 H new ATOM 0 HA ARG A 24 9.165 -2.902 -8.863 1.00 53.10 H new ATOM 0 HB2 ARG A 24 9.189 -5.340 -8.688 1.00 3.33 H new ATOM 0 HB3 ARG A 24 7.725 -5.466 -9.642 1.00 3.33 H new ATOM 0 HG2 ARG A 24 9.679 -6.053 -10.984 1.00 33.23 H new ATOM 0 HG3 ARG A 24 8.904 -4.619 -11.626 1.00 33.23 H new ATOM 0 HD2 ARG A 24 10.611 -3.248 -10.278 1.00 41.22 H new ATOM 0 HD3 ARG A 24 11.454 -4.755 -9.978 1.00 41.22 H new ATOM 0 HE ARG A 24 10.879 -4.269 -12.816 1.00 42.44 H new ATOM 0 HH11 ARG A 24 13.164 -3.782 -10.157 1.00 61.14 H new ATOM 0 HH12 ARG A 24 14.537 -3.513 -11.236 1.00 61.14 H new ATOM 0 HH21 ARG A 24 12.648 -3.909 -14.191 1.00 62.14 H new ATOM 0 HH22 ARG A 24 14.246 -3.585 -13.512 1.00 62.14 H new ATOM 382 N ASP A 25 6.354 -2.220 -10.016 1.00 73.55 N ATOM 383 CA ASP A 25 5.532 -1.564 -11.037 1.00 40.15 C ATOM 384 C ASP A 25 5.326 -2.483 -12.245 1.00 25.02 C ATOM 385 O ASP A 25 6.030 -2.374 -13.245 1.00 51.21 O ATOM 386 CB ASP A 25 6.166 -0.228 -11.448 1.00 30.11 C ATOM 387 CG ASP A 25 5.472 0.445 -12.622 1.00 30.53 C ATOM 388 OD1 ASP A 25 4.420 1.088 -12.414 1.00 20.03 O ATOM 389 OD2 ASP A 25 5.994 0.354 -13.756 1.00 44.24 O ATOM 0 H ASP A 25 5.914 -2.263 -9.097 1.00 73.55 H new ATOM 0 HA ASP A 25 4.548 -1.357 -10.615 1.00 40.15 H new ATOM 0 HB2 ASP A 25 6.152 0.448 -10.593 1.00 30.11 H new ATOM 0 HB3 ASP A 25 7.212 -0.396 -11.704 1.00 30.11 H new ATOM 394 N LEU A 26 4.379 -3.415 -12.105 1.00 43.42 N ATOM 395 CA LEU A 26 4.064 -4.407 -13.143 1.00 51.35 C ATOM 396 C LEU A 26 5.327 -5.032 -13.741 1.00 62.52 C ATOM 397 O LEU A 26 5.828 -4.578 -14.776 1.00 32.31 O ATOM 398 CB LEU A 26 3.195 -3.798 -14.247 1.00 23.33 C ATOM 399 CG LEU A 26 1.839 -3.263 -13.787 1.00 14.21 C ATOM 400 CD1 LEU A 26 1.032 -2.783 -14.980 1.00 70.04 C ATOM 401 CD2 LEU A 26 1.069 -4.329 -13.021 1.00 74.13 C ATOM 0 H LEU A 26 3.806 -3.505 -11.266 1.00 43.42 H new ATOM 0 HA LEU A 26 3.499 -5.203 -12.657 1.00 51.35 H new ATOM 0 HB2 LEU A 26 3.749 -2.984 -14.716 1.00 23.33 H new ATOM 0 HB3 LEU A 26 3.028 -4.554 -15.014 1.00 23.33 H new ATOM 0 HG LEU A 26 2.012 -2.420 -13.118 1.00 14.21 H new ATOM 0 HD11 LEU A 26 0.068 -2.404 -14.639 1.00 70.04 H new ATOM 0 HD12 LEU A 26 1.575 -1.987 -15.490 1.00 70.04 H new ATOM 0 HD13 LEU A 26 0.873 -3.612 -15.669 1.00 70.04 H new ATOM 0 HD21 LEU A 26 0.107 -3.926 -12.704 1.00 74.13 H new ATOM 0 HD22 LEU A 26 0.905 -5.193 -13.665 1.00 74.13 H new ATOM 0 HD23 LEU A 26 1.642 -4.633 -12.145 1.00 74.13 H new ATOM 413 N PRO A 27 5.846 -6.087 -13.090 1.00 64.32 N ATOM 414 CA PRO A 27 7.121 -6.718 -13.451 1.00 1.51 C ATOM 415 C PRO A 27 7.207 -7.108 -14.925 1.00 21.52 C ATOM 416 O PRO A 27 6.446 -7.948 -15.407 1.00 42.41 O ATOM 417 CB PRO A 27 7.183 -7.972 -12.563 1.00 2.05 C ATOM 418 CG PRO A 27 5.804 -8.149 -12.025 1.00 43.24 C ATOM 419 CD PRO A 27 5.210 -6.772 -11.957 1.00 23.50 C ATOM 0 HA PRO A 27 7.951 -6.029 -13.298 1.00 1.51 H new ATOM 0 HB2 PRO A 27 7.495 -8.844 -13.137 1.00 2.05 H new ATOM 0 HB3 PRO A 27 7.906 -7.846 -11.757 1.00 2.05 H new ATOM 0 HG2 PRO A 27 5.213 -8.798 -12.671 1.00 43.24 H new ATOM 0 HG3 PRO A 27 5.826 -8.614 -11.040 1.00 43.24 H new ATOM 0 HD2 PRO A 27 4.125 -6.794 -12.055 1.00 23.50 H new ATOM 0 HD3 PRO A 27 5.434 -6.281 -11.010 1.00 23.50 H new ATOM 998 N ALA A 64 16.871 -10.017 3.390 1.00 42.33 N ATOM 999 CA ALA A 64 15.572 -9.451 3.765 1.00 21.10 C ATOM 1000 C ALA A 64 14.678 -10.565 4.269 1.00 1.14 C ATOM 1001 O ALA A 64 14.734 -11.688 3.765 1.00 2.20 O ATOM 1002 CB ALA A 64 14.918 -8.748 2.587 1.00 24.30 C ATOM 0 HA ALA A 64 15.723 -8.710 4.550 1.00 21.10 H new ATOM 0 HB1 ALA A 64 13.956 -8.339 2.896 1.00 24.30 H new ATOM 0 HB2 ALA A 64 15.563 -7.940 2.242 1.00 24.30 H new ATOM 0 HB3 ALA A 64 14.765 -9.461 1.777 1.00 24.30 H new ATOM 1008 N GLU A 65 13.879 -10.259 5.268 1.00 62.51 N ATOM 1009 CA GLU A 65 13.039 -11.263 5.894 1.00 31.00 C ATOM 1010 C GLU A 65 11.589 -10.993 5.500 1.00 13.54 C ATOM 1011 O GLU A 65 11.146 -9.853 5.521 1.00 45.23 O ATOM 1012 CB GLU A 65 13.255 -11.200 7.418 1.00 43.32 C ATOM 1013 CG GLU A 65 12.925 -12.482 8.175 1.00 44.22 C ATOM 1014 CD GLU A 65 11.448 -12.682 8.438 1.00 63.13 C ATOM 1015 OE1 GLU A 65 10.950 -12.183 9.469 1.00 43.24 O ATOM 1016 OE2 GLU A 65 10.790 -13.364 7.634 1.00 74.01 O ATOM 0 H GLU A 65 13.792 -9.324 5.666 1.00 62.51 H new ATOM 0 HA GLU A 65 13.294 -12.269 5.562 1.00 31.00 H new ATOM 0 HB2 GLU A 65 14.296 -10.941 7.611 1.00 43.32 H new ATOM 0 HB3 GLU A 65 12.646 -10.392 7.822 1.00 43.32 H new ATOM 0 HG2 GLU A 65 13.300 -13.333 7.607 1.00 44.22 H new ATOM 0 HG3 GLU A 65 13.455 -12.475 9.127 1.00 44.22 H new ATOM 1023 N LEU A 66 10.851 -12.021 5.119 1.00 21.31 N ATOM 1024 CA LEU A 66 9.486 -11.820 4.650 1.00 63.12 C ATOM 1025 C LEU A 66 8.497 -12.452 5.618 1.00 43.50 C ATOM 1026 O LEU A 66 8.480 -13.674 5.786 1.00 62.32 O ATOM 1027 CB LEU A 66 9.265 -12.421 3.248 1.00 24.33 C ATOM 1028 CG LEU A 66 10.246 -11.997 2.145 1.00 32.04 C ATOM 1029 CD1 LEU A 66 10.511 -10.497 2.183 1.00 64.01 C ATOM 1030 CD2 LEU A 66 11.540 -12.797 2.234 1.00 74.33 C ATOM 0 H LEU A 66 11.166 -12.991 5.123 1.00 21.31 H new ATOM 0 HA LEU A 66 9.323 -10.744 4.595 1.00 63.12 H new ATOM 0 HB2 LEU A 66 9.302 -13.507 3.335 1.00 24.33 H new ATOM 0 HB3 LEU A 66 8.257 -12.162 2.923 1.00 24.33 H new ATOM 0 HG LEU A 66 9.784 -12.217 1.182 1.00 32.04 H new ATOM 0 HD11 LEU A 66 11.209 -10.231 1.389 1.00 64.01 H new ATOM 0 HD12 LEU A 66 9.575 -9.958 2.038 1.00 64.01 H new ATOM 0 HD13 LEU A 66 10.939 -10.228 3.148 1.00 64.01 H new ATOM 0 HD21 LEU A 66 12.219 -12.479 1.443 1.00 74.33 H new ATOM 0 HD22 LEU A 66 12.007 -12.626 3.204 1.00 74.33 H new ATOM 0 HD23 LEU A 66 11.320 -13.858 2.119 1.00 74.33 H new ATOM 1042 N THR A 67 7.652 -11.635 6.234 1.00 1.22 N ATOM 1043 CA THR A 67 6.751 -12.137 7.262 1.00 14.21 C ATOM 1044 C THR A 67 5.545 -12.862 6.650 1.00 34.21 C ATOM 1045 O THR A 67 4.965 -13.750 7.273 1.00 71.14 O ATOM 1046 CB THR A 67 6.291 -11.010 8.219 1.00 53.43 C ATOM 1047 OG1 THR A 67 5.379 -11.519 9.201 1.00 70.20 O ATOM 1048 CG2 THR A 67 5.639 -9.866 7.461 1.00 63.23 C ATOM 0 H THR A 67 7.572 -10.636 6.043 1.00 1.22 H new ATOM 0 HA THR A 67 7.312 -12.863 7.851 1.00 14.21 H new ATOM 0 HB THR A 67 7.181 -10.628 8.719 1.00 53.43 H new ATOM 0 HG1 THR A 67 5.101 -10.792 9.797 1.00 70.20 H new ATOM 0 HG21 THR A 67 5.329 -9.093 8.165 1.00 63.23 H new ATOM 0 HG22 THR A 67 6.352 -9.446 6.752 1.00 63.23 H new ATOM 0 HG23 THR A 67 4.767 -10.237 6.922 1.00 63.23 H new ATOM 1056 N ALA A 68 5.187 -12.501 5.421 1.00 75.43 N ATOM 1057 CA ALA A 68 4.100 -13.172 4.717 1.00 72.14 C ATOM 1058 C ALA A 68 4.374 -13.198 3.224 1.00 31.33 C ATOM 1059 O ALA A 68 4.691 -12.171 2.624 1.00 0.41 O ATOM 1060 CB ALA A 68 2.770 -12.497 5.007 1.00 1.32 C ATOM 0 H ALA A 68 5.632 -11.750 4.894 1.00 75.43 H new ATOM 0 HA ALA A 68 4.042 -14.200 5.076 1.00 72.14 H new ATOM 0 HB1 ALA A 68 1.975 -13.015 4.471 1.00 1.32 H new ATOM 0 HB2 ALA A 68 2.569 -12.533 6.078 1.00 1.32 H new ATOM 0 HB3 ALA A 68 2.811 -11.458 4.680 1.00 1.32 H new ATOM 1066 N ASP A 69 4.260 -14.373 2.633 1.00 4.13 N ATOM 1067 CA ASP A 69 4.589 -14.550 1.223 1.00 72.24 C ATOM 1068 C ASP A 69 3.495 -15.314 0.488 1.00 15.34 C ATOM 1069 O ASP A 69 3.662 -15.632 -0.682 1.00 0.14 O ATOM 1070 CB ASP A 69 5.922 -15.295 1.079 1.00 52.21 C ATOM 1071 CG ASP A 69 5.827 -16.755 1.483 1.00 61.31 C ATOM 1072 OD1 ASP A 69 5.506 -17.038 2.661 1.00 33.40 O ATOM 1073 OD2 ASP A 69 6.062 -17.630 0.625 1.00 32.41 O ATOM 0 H ASP A 69 3.943 -15.221 3.103 1.00 4.13 H new ATOM 0 HA ASP A 69 4.674 -13.559 0.776 1.00 72.24 H new ATOM 0 HB2 ASP A 69 6.259 -15.230 0.044 1.00 52.21 H new ATOM 0 HB3 ASP A 69 6.677 -14.802 1.692 1.00 52.21 H new ATOM 1078 N GLU A 70 2.371 -15.547 1.176 1.00 31.24 N ATOM 1079 CA GLU A 70 1.265 -16.389 0.685 1.00 24.51 C ATOM 1080 C GLU A 70 0.678 -15.875 -0.634 1.00 42.33 C ATOM 1081 O GLU A 70 -0.196 -15.002 -0.631 1.00 72.15 O ATOM 1082 CB GLU A 70 0.167 -16.506 1.751 1.00 1.10 C ATOM 1083 CG GLU A 70 0.658 -17.105 3.060 1.00 71.21 C ATOM 1084 CD GLU A 70 -0.465 -17.387 4.037 1.00 23.32 C ATOM 1085 OE1 GLU A 70 -1.020 -18.506 4.007 1.00 71.12 O ATOM 1086 OE2 GLU A 70 -0.797 -16.496 4.843 1.00 55.14 O ATOM 0 H GLU A 70 2.198 -15.153 2.101 1.00 31.24 H new ATOM 0 HA GLU A 70 1.679 -17.377 0.486 1.00 24.51 H new ATOM 0 HB2 GLU A 70 -0.247 -15.517 1.945 1.00 1.10 H new ATOM 0 HB3 GLU A 70 -0.644 -17.120 1.361 1.00 1.10 H new ATOM 0 HG2 GLU A 70 1.193 -18.032 2.852 1.00 71.21 H new ATOM 0 HG3 GLU A 70 1.371 -16.422 3.521 1.00 71.21 H new ATOM 1093 N PRO A 71 1.174 -16.391 -1.781 1.00 42.35 N ATOM 1094 CA PRO A 71 0.866 -15.846 -3.111 1.00 63.21 C ATOM 1095 C PRO A 71 -0.624 -15.873 -3.425 1.00 24.43 C ATOM 1096 O PRO A 71 -1.231 -16.937 -3.535 1.00 14.34 O ATOM 1097 CB PRO A 71 1.626 -16.764 -4.076 1.00 74.41 C ATOM 1098 CG PRO A 71 2.627 -17.479 -3.236 1.00 70.44 C ATOM 1099 CD PRO A 71 2.009 -17.601 -1.876 1.00 41.54 C ATOM 0 HA PRO A 71 1.156 -14.798 -3.185 1.00 63.21 H new ATOM 0 HB2 PRO A 71 0.950 -17.466 -4.565 1.00 74.41 H new ATOM 0 HB3 PRO A 71 2.113 -16.189 -4.864 1.00 74.41 H new ATOM 0 HG2 PRO A 71 2.855 -18.461 -3.651 1.00 70.44 H new ATOM 0 HG3 PRO A 71 3.565 -16.926 -3.191 1.00 70.44 H new ATOM 0 HD2 PRO A 71 1.414 -18.510 -1.783 1.00 41.54 H new ATOM 0 HD3 PRO A 71 2.764 -17.633 -1.091 1.00 41.54 H new ATOM 1107 N GLY A 72 -1.212 -14.692 -3.549 1.00 51.34 N ATOM 1108 CA GLY A 72 -2.621 -14.594 -3.874 1.00 24.34 C ATOM 1109 C GLY A 72 -3.502 -14.580 -2.640 1.00 72.43 C ATOM 1110 O GLY A 72 -4.729 -14.625 -2.741 1.00 72.22 O ATOM 0 H GLY A 72 -0.737 -13.797 -3.430 1.00 51.34 H new ATOM 0 HA2 GLY A 72 -2.795 -13.686 -4.451 1.00 24.34 H new ATOM 0 HA3 GLY A 72 -2.903 -15.434 -4.509 1.00 24.34 H new ATOM 1114 N LYS A 73 -2.878 -14.525 -1.475 1.00 31.33 N ATOM 1115 CA LYS A 73 -3.614 -14.477 -0.224 1.00 73.15 C ATOM 1116 C LYS A 73 -3.199 -13.250 0.578 1.00 50.20 C ATOM 1117 O LYS A 73 -3.982 -12.313 0.742 1.00 35.12 O ATOM 1118 CB LYS A 73 -3.375 -15.760 0.575 1.00 64.44 C ATOM 1119 CG LYS A 73 -4.276 -15.899 1.790 1.00 61.20 C ATOM 1120 CD LYS A 73 -4.160 -17.282 2.404 1.00 41.25 C ATOM 1121 CE LYS A 73 -4.598 -18.363 1.426 1.00 73.33 C ATOM 1122 NZ LYS A 73 -4.451 -19.725 2.002 1.00 72.01 N ATOM 0 H LYS A 73 -1.863 -14.513 -1.370 1.00 31.33 H new ATOM 0 HA LYS A 73 -4.680 -14.402 -0.437 1.00 73.15 H new ATOM 0 HB2 LYS A 73 -3.527 -16.619 -0.079 1.00 64.44 H new ATOM 0 HB3 LYS A 73 -2.335 -15.787 0.900 1.00 64.44 H new ATOM 0 HG2 LYS A 73 -4.010 -15.146 2.531 1.00 61.20 H new ATOM 0 HG3 LYS A 73 -5.310 -15.712 1.502 1.00 61.20 H new ATOM 0 HD2 LYS A 73 -3.129 -17.461 2.709 1.00 41.25 H new ATOM 0 HD3 LYS A 73 -4.772 -17.334 3.304 1.00 41.25 H new ATOM 0 HE2 LYS A 73 -5.638 -18.198 1.145 1.00 73.33 H new ATOM 0 HE3 LYS A 73 -4.006 -18.289 0.514 1.00 73.33 H new ATOM 0 HZ1 LYS A 73 -4.760 -20.432 1.305 1.00 72.01 H new ATOM 0 HZ2 LYS A 73 -3.454 -19.893 2.247 1.00 72.01 H new ATOM 0 HZ3 LYS A 73 -5.036 -19.805 2.858 1.00 72.01 H new ATOM 1136 N ARG A 74 -1.960 -13.244 1.056 1.00 62.24 N ATOM 1137 CA ARG A 74 -1.422 -12.091 1.760 1.00 25.11 C ATOM 1138 C ARG A 74 0.083 -12.016 1.560 1.00 12.50 C ATOM 1139 O ARG A 74 0.783 -13.025 1.647 1.00 41.23 O ATOM 1140 CB ARG A 74 -1.741 -12.145 3.260 1.00 73.14 C ATOM 1141 CG ARG A 74 -1.001 -13.243 3.995 1.00 41.55 C ATOM 1142 CD ARG A 74 -1.185 -13.157 5.499 1.00 74.43 C ATOM 1143 NE ARG A 74 -0.480 -14.242 6.174 1.00 21.12 N ATOM 1144 CZ ARG A 74 0.293 -14.091 7.247 1.00 51.13 C ATOM 1145 NH1 ARG A 74 0.486 -12.890 7.778 1.00 73.44 N ATOM 1146 NH2 ARG A 74 0.892 -15.146 7.782 1.00 12.21 N ATOM 0 H ARG A 74 -1.311 -14.026 0.968 1.00 62.24 H new ATOM 0 HA ARG A 74 -1.894 -11.200 1.346 1.00 25.11 H new ATOM 0 HB2 ARG A 74 -1.492 -11.185 3.711 1.00 73.14 H new ATOM 0 HB3 ARG A 74 -2.813 -12.290 3.390 1.00 73.14 H new ATOM 0 HG2 ARG A 74 -1.353 -14.213 3.643 1.00 41.55 H new ATOM 0 HG3 ARG A 74 0.061 -13.184 3.757 1.00 41.55 H new ATOM 0 HD2 ARG A 74 -0.815 -12.198 5.860 1.00 74.43 H new ATOM 0 HD3 ARG A 74 -2.247 -13.201 5.742 1.00 74.43 H new ATOM 0 HE ARG A 74 -0.587 -15.183 5.796 1.00 21.12 H new ATOM 0 HH11 ARG A 74 0.040 -12.072 7.364 1.00 73.44 H new ATOM 0 HH12 ARG A 74 1.080 -12.785 8.600 1.00 73.44 H new ATOM 0 HH21 ARG A 74 0.760 -16.070 7.371 1.00 12.21 H new ATOM 0 HH22 ARG A 74 1.485 -15.033 8.604 1.00 12.21 H new ATOM 1160 N ILE A 75 0.568 -10.830 1.271 1.00 15.25 N ATOM 1161 CA ILE A 75 1.992 -10.608 1.116 1.00 72.32 C ATOM 1162 C ILE A 75 2.420 -9.464 2.019 1.00 64.23 C ATOM 1163 O ILE A 75 1.834 -8.381 1.989 1.00 35.43 O ATOM 1164 CB ILE A 75 2.400 -10.312 -0.353 1.00 43.52 C ATOM 1165 CG1 ILE A 75 2.231 -11.555 -1.242 1.00 10.03 C ATOM 1166 CG2 ILE A 75 3.841 -9.824 -0.416 1.00 12.22 C ATOM 1167 CD1 ILE A 75 0.803 -11.836 -1.665 1.00 42.33 C ATOM 0 H ILE A 75 -0.006 -9.997 1.137 1.00 15.25 H new ATOM 0 HA ILE A 75 2.502 -11.528 1.401 1.00 72.32 H new ATOM 0 HB ILE A 75 1.739 -9.531 -0.729 1.00 43.52 H new ATOM 0 HG12 ILE A 75 2.844 -11.433 -2.135 1.00 10.03 H new ATOM 0 HG13 ILE A 75 2.616 -12.423 -0.707 1.00 10.03 H new ATOM 0 HG21 ILE A 75 4.111 -9.621 -1.452 1.00 12.22 H new ATOM 0 HG22 ILE A 75 3.942 -8.911 0.171 1.00 12.22 H new ATOM 0 HG23 ILE A 75 4.503 -10.590 -0.012 1.00 12.22 H new ATOM 0 HD11 ILE A 75 0.777 -12.730 -2.289 1.00 42.33 H new ATOM 0 HD12 ILE A 75 0.186 -11.993 -0.780 1.00 42.33 H new ATOM 0 HD13 ILE A 75 0.417 -10.988 -2.230 1.00 42.33 H new ATOM 1179 N ALA A 76 3.420 -9.719 2.839 1.00 33.22 N ATOM 1180 CA ALA A 76 3.881 -8.737 3.797 1.00 3.15 C ATOM 1181 C ALA A 76 5.396 -8.742 3.878 1.00 71.21 C ATOM 1182 O ALA A 76 6.013 -9.764 4.195 1.00 63.13 O ATOM 1183 CB ALA A 76 3.272 -9.012 5.160 1.00 15.33 C ATOM 0 H ALA A 76 3.930 -10.602 2.860 1.00 33.22 H new ATOM 0 HA ALA A 76 3.562 -7.749 3.466 1.00 3.15 H new ATOM 0 HB1 ALA A 76 3.625 -8.267 5.873 1.00 15.33 H new ATOM 0 HB2 ALA A 76 2.185 -8.961 5.090 1.00 15.33 H new ATOM 0 HB3 ALA A 76 3.567 -10.006 5.497 1.00 15.33 H new ATOM 1189 N TRP A 77 5.989 -7.604 3.583 1.00 1.43 N ATOM 1190 CA TRP A 77 7.433 -7.477 3.593 1.00 60.13 C ATOM 1191 C TRP A 77 7.904 -6.865 4.902 1.00 5.44 C ATOM 1192 O TRP A 77 7.176 -6.107 5.544 1.00 31.35 O ATOM 1193 CB TRP A 77 7.908 -6.601 2.435 1.00 2.35 C ATOM 1194 CG TRP A 77 7.434 -7.041 1.079 1.00 70.14 C ATOM 1195 CD1 TRP A 77 7.996 -7.995 0.277 1.00 73.33 C ATOM 1196 CD2 TRP A 77 6.310 -6.523 0.358 1.00 62.21 C ATOM 1197 NE1 TRP A 77 7.286 -8.102 -0.895 1.00 60.50 N ATOM 1198 CE2 TRP A 77 6.247 -7.211 -0.868 1.00 2.51 C ATOM 1199 CE3 TRP A 77 5.344 -5.548 0.633 1.00 15.41 C ATOM 1200 CZ2 TRP A 77 5.265 -6.950 -1.819 1.00 61.42 C ATOM 1201 CZ3 TRP A 77 4.368 -5.292 -0.313 1.00 63.54 C ATOM 1202 CH2 TRP A 77 4.335 -5.991 -1.525 1.00 34.21 C ATOM 0 H TRP A 77 5.491 -6.750 3.332 1.00 1.43 H new ATOM 0 HA TRP A 77 7.855 -8.476 3.485 1.00 60.13 H new ATOM 0 HB2 TRP A 77 7.571 -5.579 2.609 1.00 2.35 H new ATOM 0 HB3 TRP A 77 8.998 -6.582 2.435 1.00 2.35 H new ATOM 0 HD1 TRP A 77 8.869 -8.579 0.528 1.00 73.33 H new ATOM 0 HE1 TRP A 77 7.499 -8.741 -1.661 1.00 60.50 H new ATOM 0 HE3 TRP A 77 5.360 -5.006 1.567 1.00 15.41 H new ATOM 0 HZ2 TRP A 77 5.238 -7.486 -2.756 1.00 61.42 H new ATOM 0 HZ3 TRP A 77 3.619 -4.540 -0.113 1.00 63.54 H new ATOM 0 HH2 TRP A 77 3.559 -5.769 -2.243 1.00 34.21 H new ATOM 1213 N ARG A 78 9.120 -7.203 5.283 1.00 55.30 N ATOM 1214 CA ARG A 78 9.758 -6.638 6.457 1.00 55.53 C ATOM 1215 C ARG A 78 11.262 -6.750 6.294 1.00 63.33 C ATOM 1216 O ARG A 78 11.746 -7.288 5.300 1.00 54.43 O ATOM 1217 CB ARG A 78 9.310 -7.336 7.752 1.00 64.13 C ATOM 1218 CG ARG A 78 9.556 -8.833 7.754 1.00 15.11 C ATOM 1219 CD ARG A 78 9.805 -9.371 9.153 1.00 44.05 C ATOM 1220 NE ARG A 78 8.653 -9.221 10.039 1.00 44.33 N ATOM 1221 CZ ARG A 78 8.322 -10.117 10.972 1.00 75.01 C ATOM 1222 NH1 ARG A 78 9.000 -11.256 11.078 1.00 34.12 N ATOM 1223 NH2 ARG A 78 7.301 -9.888 11.787 1.00 34.40 N ATOM 0 H ARG A 78 9.697 -7.881 4.785 1.00 55.30 H new ATOM 0 HA ARG A 78 9.461 -5.593 6.542 1.00 55.53 H new ATOM 0 HB2 ARG A 78 9.836 -6.889 8.596 1.00 64.13 H new ATOM 0 HB3 ARG A 78 8.247 -7.151 7.905 1.00 64.13 H new ATOM 0 HG2 ARG A 78 8.696 -9.342 7.319 1.00 15.11 H new ATOM 0 HG3 ARG A 78 10.414 -9.059 7.121 1.00 15.11 H new ATOM 0 HD2 ARG A 78 10.071 -10.426 9.088 1.00 44.05 H new ATOM 0 HD3 ARG A 78 10.660 -8.853 9.588 1.00 44.05 H new ATOM 0 HE ARG A 78 8.072 -8.389 9.940 1.00 44.33 H new ATOM 0 HH11 ARG A 78 9.776 -11.448 10.445 1.00 34.12 H new ATOM 0 HH12 ARG A 78 8.744 -11.938 11.792 1.00 34.12 H new ATOM 0 HH21 ARG A 78 6.765 -9.024 11.703 1.00 34.40 H new ATOM 0 HH22 ARG A 78 7.052 -10.575 12.498 1.00 34.40 H new ATOM 1237 N SER A 79 11.996 -6.205 7.232 1.00 22.33 N ATOM 1238 CA SER A 79 13.421 -6.318 7.222 1.00 11.50 C ATOM 1239 C SER A 79 13.865 -7.309 8.293 1.00 71.21 C ATOM 1240 O SER A 79 13.035 -7.993 8.895 1.00 23.32 O ATOM 1241 CB SER A 79 14.040 -4.941 7.457 1.00 53.35 C ATOM 1242 OG SER A 79 13.546 -3.998 6.519 1.00 64.34 O ATOM 0 H SER A 79 11.619 -5.675 8.017 1.00 22.33 H new ATOM 0 HA SER A 79 13.758 -6.689 6.254 1.00 11.50 H new ATOM 0 HB2 SER A 79 13.816 -4.605 8.469 1.00 53.35 H new ATOM 0 HB3 SER A 79 15.125 -5.007 7.376 1.00 53.35 H new ATOM 0 HG SER A 79 13.002 -3.328 6.984 1.00 64.34 H new ATOM 1248 N LEU A 80 15.163 -7.384 8.529 1.00 32.23 N ATOM 1249 CA LEU A 80 15.706 -8.361 9.460 1.00 4.15 C ATOM 1250 C LEU A 80 15.608 -7.863 10.895 1.00 21.21 C ATOM 1251 O LEU A 80 15.734 -6.665 11.151 1.00 72.42 O ATOM 1252 CB LEU A 80 17.167 -8.659 9.121 1.00 32.35 C ATOM 1253 CG LEU A 80 17.462 -8.890 7.641 1.00 22.20 C ATOM 1254 CD1 LEU A 80 18.863 -9.419 7.460 1.00 41.22 C ATOM 1255 CD2 LEU A 80 16.466 -9.845 7.025 1.00 11.22 C ATOM 0 H LEU A 80 15.860 -6.782 8.091 1.00 32.23 H new ATOM 0 HA LEU A 80 15.118 -9.274 9.368 1.00 4.15 H new ATOM 0 HB2 LEU A 80 17.780 -7.829 9.471 1.00 32.35 H new ATOM 0 HB3 LEU A 80 17.479 -9.542 9.678 1.00 32.35 H new ATOM 0 HG LEU A 80 17.374 -7.931 7.131 1.00 22.20 H new ATOM 0 HD11 LEU A 80 19.058 -9.578 6.399 1.00 41.22 H new ATOM 0 HD12 LEU A 80 19.578 -8.698 7.856 1.00 41.22 H new ATOM 0 HD13 LEU A 80 18.967 -10.364 7.994 1.00 41.22 H new ATOM 0 HD21 LEU A 80 16.703 -9.988 5.971 1.00 11.22 H new ATOM 0 HD22 LEU A 80 16.514 -10.804 7.541 1.00 11.22 H new ATOM 0 HD23 LEU A 80 15.461 -9.433 7.118 1.00 11.22 H new ATOM 1267 N PRO A 81 15.363 -8.777 11.849 1.00 62.22 N ATOM 1268 CA PRO A 81 15.385 -8.452 13.279 1.00 63.02 C ATOM 1269 C PRO A 81 16.752 -7.928 13.711 1.00 11.31 C ATOM 1270 O PRO A 81 16.858 -7.078 14.596 1.00 64.23 O ATOM 1271 CB PRO A 81 15.076 -9.787 13.964 1.00 4.13 C ATOM 1272 CG PRO A 81 14.405 -10.608 12.919 1.00 32.44 C ATOM 1273 CD PRO A 81 15.016 -10.188 11.613 1.00 62.43 C ATOM 0 HA PRO A 81 14.674 -7.667 13.535 1.00 63.02 H new ATOM 0 HB2 PRO A 81 15.987 -10.268 14.320 1.00 4.13 H new ATOM 0 HB3 PRO A 81 14.430 -9.646 14.831 1.00 4.13 H new ATOM 0 HG2 PRO A 81 14.560 -11.672 13.099 1.00 32.44 H new ATOM 0 HG3 PRO A 81 13.328 -10.438 12.920 1.00 32.44 H new ATOM 0 HD2 PRO A 81 15.895 -10.784 11.368 1.00 62.43 H new ATOM 0 HD3 PRO A 81 14.315 -10.298 10.785 1.00 62.43 H new ATOM 1281 N GLY A 82 17.798 -8.431 13.062 1.00 43.24 N ATOM 1282 CA GLY A 82 19.141 -7.948 13.313 1.00 21.41 C ATOM 1283 C GLY A 82 19.512 -6.826 12.368 1.00 42.53 C ATOM 1284 O GLY A 82 20.656 -6.724 11.926 1.00 5.23 O ATOM 0 H GLY A 82 17.736 -9.170 12.362 1.00 43.24 H new ATOM 0 HA2 GLY A 82 19.217 -7.598 14.343 1.00 21.41 H new ATOM 0 HA3 GLY A 82 19.850 -8.768 13.202 1.00 21.41 H new ATOM 1288 N ALA A 83 18.529 -5.999 12.047 1.00 12.42 N ATOM 1289 CA ALA A 83 18.716 -4.883 11.139 1.00 34.43 C ATOM 1290 C ALA A 83 17.682 -3.810 11.429 1.00 25.52 C ATOM 1291 O ALA A 83 16.926 -3.912 12.398 1.00 23.30 O ATOM 1292 CB ALA A 83 18.588 -5.349 9.694 1.00 30.21 C ATOM 0 H ALA A 83 17.580 -6.085 12.410 1.00 12.42 H new ATOM 0 HA ALA A 83 19.715 -4.472 11.286 1.00 34.43 H new ATOM 0 HB1 ALA A 83 18.731 -4.501 9.024 1.00 30.21 H new ATOM 0 HB2 ALA A 83 19.345 -6.106 9.487 1.00 30.21 H new ATOM 0 HB3 ALA A 83 17.597 -5.774 9.535 1.00 30.21 H new ATOM 1298 N ARG A 84 17.649 -2.782 10.598 1.00 4.41 N ATOM 1299 CA ARG A 84 16.607 -1.776 10.688 1.00 62.24 C ATOM 1300 C ARG A 84 15.348 -2.286 10.013 1.00 41.40 C ATOM 1301 O ARG A 84 15.257 -2.310 8.787 1.00 72.22 O ATOM 1302 CB ARG A 84 17.055 -0.461 10.049 1.00 73.54 C ATOM 1303 CG ARG A 84 17.442 0.604 11.060 1.00 34.32 C ATOM 1304 CD ARG A 84 18.591 0.152 11.948 1.00 33.24 C ATOM 1305 NE ARG A 84 18.908 1.148 12.967 1.00 63.14 N ATOM 1306 CZ ARG A 84 19.980 1.103 13.754 1.00 50.21 C ATOM 1307 NH1 ARG A 84 20.834 0.089 13.678 1.00 71.43 N ATOM 1308 NH2 ARG A 84 20.191 2.073 14.631 1.00 4.14 N ATOM 0 H ARG A 84 18.330 -2.623 9.856 1.00 4.41 H new ATOM 0 HA ARG A 84 16.401 -1.583 11.741 1.00 62.24 H new ATOM 0 HB2 ARG A 84 17.905 -0.655 9.395 1.00 73.54 H new ATOM 0 HB3 ARG A 84 16.250 -0.079 9.421 1.00 73.54 H new ATOM 0 HG2 ARG A 84 17.726 1.516 10.536 1.00 34.32 H new ATOM 0 HG3 ARG A 84 16.579 0.848 11.679 1.00 34.32 H new ATOM 0 HD2 ARG A 84 18.330 -0.791 12.429 1.00 33.24 H new ATOM 0 HD3 ARG A 84 19.473 -0.036 11.335 1.00 33.24 H new ATOM 0 HE ARG A 84 18.265 1.931 13.084 1.00 63.14 H new ATOM 0 HH11 ARG A 84 20.672 -0.666 13.011 1.00 71.43 H new ATOM 0 HH12 ARG A 84 21.652 0.065 14.286 1.00 71.43 H new ATOM 0 HH21 ARG A 84 19.533 2.850 14.701 1.00 4.14 H new ATOM 0 HH22 ARG A 84 21.011 2.043 15.237 1.00 4.14 H new ATOM 1322 N ILE A 85 14.396 -2.736 10.816 1.00 75.30 N ATOM 1323 CA ILE A 85 13.156 -3.267 10.291 1.00 40.31 C ATOM 1324 C ILE A 85 12.322 -2.135 9.689 1.00 64.02 C ATOM 1325 O ILE A 85 11.915 -2.226 8.536 1.00 3.02 O ATOM 1326 CB ILE A 85 12.382 -4.074 11.378 1.00 65.21 C ATOM 1327 CG1 ILE A 85 11.070 -4.669 10.832 1.00 25.50 C ATOM 1328 CG2 ILE A 85 12.125 -3.235 12.626 1.00 22.42 C ATOM 1329 CD1 ILE A 85 9.876 -3.733 10.867 1.00 13.45 C ATOM 0 H ILE A 85 14.462 -2.742 11.834 1.00 75.30 H new ATOM 0 HA ILE A 85 13.378 -3.974 9.492 1.00 40.31 H new ATOM 0 HB ILE A 85 13.023 -4.908 11.664 1.00 65.21 H new ATOM 0 HG12 ILE A 85 11.234 -4.986 9.802 1.00 25.50 H new ATOM 0 HG13 ILE A 85 10.828 -5.563 11.406 1.00 25.50 H new ATOM 0 HG21 ILE A 85 11.584 -3.832 13.360 1.00 22.42 H new ATOM 0 HG22 ILE A 85 13.076 -2.913 13.050 1.00 22.42 H new ATOM 0 HG23 ILE A 85 11.531 -2.360 12.360 1.00 22.42 H new ATOM 0 HD11 ILE A 85 9.002 -4.243 10.462 1.00 13.45 H new ATOM 0 HD12 ILE A 85 9.678 -3.435 11.896 1.00 13.45 H new ATOM 0 HD13 ILE A 85 10.090 -2.848 10.267 1.00 13.45 H new ATOM 1341 N GLU A 86 12.127 -1.068 10.477 1.00 43.01 N ATOM 1342 CA GLU A 86 11.442 0.162 10.054 1.00 13.53 C ATOM 1343 C GLU A 86 10.114 -0.092 9.334 1.00 33.15 C ATOM 1344 O GLU A 86 9.049 -0.041 9.953 1.00 11.03 O ATOM 1345 CB GLU A 86 12.364 1.028 9.192 1.00 5.53 C ATOM 1346 CG GLU A 86 13.639 1.449 9.910 1.00 22.24 C ATOM 1347 CD GLU A 86 14.425 2.494 9.149 1.00 22.22 C ATOM 1348 OE1 GLU A 86 15.073 2.144 8.144 1.00 55.43 O ATOM 1349 OE2 GLU A 86 14.410 3.671 9.568 1.00 24.14 O ATOM 0 H GLU A 86 12.447 -1.035 11.445 1.00 43.01 H new ATOM 0 HA GLU A 86 11.195 0.699 10.970 1.00 13.53 H new ATOM 0 HB2 GLU A 86 12.628 0.478 8.289 1.00 5.53 H new ATOM 0 HB3 GLU A 86 11.822 1.919 8.875 1.00 5.53 H new ATOM 0 HG2 GLU A 86 13.383 1.840 10.895 1.00 22.24 H new ATOM 0 HG3 GLU A 86 14.267 0.573 10.068 1.00 22.24 H new ATOM 1356 N ASN A 87 10.178 -0.368 8.036 1.00 51.13 N ATOM 1357 CA ASN A 87 8.982 -0.543 7.226 1.00 32.25 C ATOM 1358 C ASN A 87 8.180 -1.761 7.669 1.00 54.53 C ATOM 1359 O ASN A 87 8.720 -2.844 7.884 1.00 5.51 O ATOM 1360 CB ASN A 87 9.342 -0.660 5.737 1.00 53.31 C ATOM 1361 CG ASN A 87 10.342 -1.768 5.436 1.00 22.22 C ATOM 1362 OD1 ASN A 87 11.551 -1.544 5.443 1.00 14.23 O ATOM 1363 ND2 ASN A 87 9.848 -2.966 5.157 1.00 52.15 N ATOM 0 H ASN A 87 11.052 -0.476 7.521 1.00 51.13 H new ATOM 0 HA ASN A 87 8.361 0.341 7.369 1.00 32.25 H new ATOM 0 HB2 ASN A 87 8.432 -0.839 5.165 1.00 53.31 H new ATOM 0 HB3 ASN A 87 9.752 0.290 5.395 1.00 53.31 H new ATOM 0 HD21 ASN A 87 10.477 -3.739 4.939 1.00 52.15 H new ATOM 0 HD22 ASN A 87 8.839 -3.115 5.161 1.00 52.15 H new ATOM 1370 N SER A 88 6.882 -1.564 7.821 1.00 50.25 N ATOM 1371 CA SER A 88 5.974 -2.642 8.171 1.00 40.44 C ATOM 1372 C SER A 88 4.687 -2.502 7.374 1.00 12.42 C ATOM 1373 O SER A 88 4.080 -1.430 7.347 1.00 30.13 O ATOM 1374 CB SER A 88 5.670 -2.618 9.670 1.00 0.21 C ATOM 1375 OG SER A 88 6.861 -2.708 10.434 1.00 62.11 O ATOM 0 H SER A 88 6.430 -0.657 7.706 1.00 50.25 H new ATOM 0 HA SER A 88 6.445 -3.595 7.930 1.00 40.44 H new ATOM 0 HB2 SER A 88 5.141 -1.699 9.922 1.00 0.21 H new ATOM 0 HB3 SER A 88 5.008 -3.446 9.923 1.00 0.21 H new ATOM 0 HG SER A 88 6.640 -2.689 11.388 1.00 62.11 H new ATOM 1381 N GLY A 89 4.283 -3.576 6.723 1.00 20.43 N ATOM 1382 CA GLY A 89 3.094 -3.538 5.902 1.00 31.11 C ATOM 1383 C GLY A 89 2.665 -4.918 5.460 1.00 4.45 C ATOM 1384 O GLY A 89 3.505 -5.790 5.230 1.00 62.31 O ATOM 0 H GLY A 89 4.758 -4.478 6.748 1.00 20.43 H new ATOM 0 HA2 GLY A 89 2.284 -3.068 6.459 1.00 31.11 H new ATOM 0 HA3 GLY A 89 3.279 -2.918 5.025 1.00 31.11 H new ATOM 1388 N GLU A 90 1.361 -5.121 5.363 1.00 62.02 N ATOM 1389 CA GLU A 90 0.810 -6.394 4.926 1.00 51.55 C ATOM 1390 C GLU A 90 -0.360 -6.160 3.980 1.00 65.14 C ATOM 1391 O GLU A 90 -1.300 -5.435 4.317 1.00 3.01 O ATOM 1392 CB GLU A 90 0.351 -7.213 6.137 1.00 40.32 C ATOM 1393 CG GLU A 90 -0.266 -8.551 5.766 1.00 2.42 C ATOM 1394 CD GLU A 90 -0.760 -9.325 6.970 1.00 14.33 C ATOM 1395 OE1 GLU A 90 -1.742 -8.891 7.602 1.00 62.44 O ATOM 1396 OE2 GLU A 90 -0.173 -10.379 7.286 1.00 1.20 O ATOM 0 H GLU A 90 0.659 -4.414 5.583 1.00 62.02 H new ATOM 0 HA GLU A 90 1.585 -6.950 4.398 1.00 51.55 H new ATOM 0 HB2 GLU A 90 1.204 -7.385 6.794 1.00 40.32 H new ATOM 0 HB3 GLU A 90 -0.376 -6.632 6.704 1.00 40.32 H new ATOM 0 HG2 GLU A 90 -1.097 -8.385 5.081 1.00 2.42 H new ATOM 0 HG3 GLU A 90 0.472 -9.150 5.233 1.00 2.42 H new ATOM 1403 N VAL A 91 -0.296 -6.756 2.795 1.00 30.43 N ATOM 1404 CA VAL A 91 -1.377 -6.630 1.831 1.00 33.31 C ATOM 1405 C VAL A 91 -2.163 -7.939 1.744 1.00 64.21 C ATOM 1406 O VAL A 91 -1.587 -9.020 1.607 1.00 13.25 O ATOM 1407 CB VAL A 91 -0.871 -6.220 0.416 1.00 62.40 C ATOM 1408 CG1 VAL A 91 0.148 -5.097 0.504 1.00 5.40 C ATOM 1409 CG2 VAL A 91 -0.291 -7.397 -0.353 1.00 23.53 C ATOM 0 H VAL A 91 0.489 -7.327 2.482 1.00 30.43 H new ATOM 0 HA VAL A 91 -2.029 -5.832 2.186 1.00 33.31 H new ATOM 0 HB VAL A 91 -1.741 -5.864 -0.135 1.00 62.40 H new ATOM 0 HG11 VAL A 91 0.484 -4.831 -0.498 1.00 5.40 H new ATOM 0 HG12 VAL A 91 -0.309 -4.227 0.976 1.00 5.40 H new ATOM 0 HG13 VAL A 91 1.001 -5.426 1.097 1.00 5.40 H new ATOM 0 HG21 VAL A 91 0.048 -7.060 -1.333 1.00 23.53 H new ATOM 0 HG22 VAL A 91 0.552 -7.813 0.199 1.00 23.53 H new ATOM 0 HG23 VAL A 91 -1.056 -8.163 -0.477 1.00 23.53 H new ATOM 1419 N LEU A 92 -3.474 -7.843 1.887 1.00 4.21 N ATOM 1420 CA LEU A 92 -4.352 -8.988 1.697 1.00 54.03 C ATOM 1421 C LEU A 92 -5.175 -8.791 0.435 1.00 65.42 C ATOM 1422 O LEU A 92 -5.539 -7.661 0.096 1.00 53.23 O ATOM 1423 CB LEU A 92 -5.285 -9.175 2.897 1.00 31.14 C ATOM 1424 CG LEU A 92 -4.695 -9.882 4.120 1.00 33.32 C ATOM 1425 CD1 LEU A 92 -3.429 -9.202 4.608 1.00 51.14 C ATOM 1426 CD2 LEU A 92 -5.723 -9.916 5.226 1.00 41.32 C ATOM 0 H LEU A 92 -3.957 -6.980 2.135 1.00 4.21 H new ATOM 0 HA LEU A 92 -3.736 -9.882 1.603 1.00 54.03 H new ATOM 0 HB2 LEU A 92 -5.639 -8.193 3.209 1.00 31.14 H new ATOM 0 HB3 LEU A 92 -6.157 -9.738 2.566 1.00 31.14 H new ATOM 0 HG LEU A 92 -4.430 -10.898 3.828 1.00 33.32 H new ATOM 0 HD11 LEU A 92 -3.042 -9.734 5.477 1.00 51.14 H new ATOM 0 HD12 LEU A 92 -2.682 -9.211 3.814 1.00 51.14 H new ATOM 0 HD13 LEU A 92 -3.653 -8.171 4.884 1.00 51.14 H new ATOM 0 HD21 LEU A 92 -5.304 -10.419 6.097 1.00 41.32 H new ATOM 0 HD22 LEU A 92 -6.002 -8.897 5.495 1.00 41.32 H new ATOM 0 HD23 LEU A 92 -6.606 -10.456 4.885 1.00 41.32 H new ATOM 1438 N PHE A 93 -5.459 -9.878 -0.260 1.00 65.14 N ATOM 1439 CA PHE A 93 -6.229 -9.807 -1.489 1.00 1.34 C ATOM 1440 C PHE A 93 -7.605 -10.412 -1.306 1.00 63.14 C ATOM 1441 O PHE A 93 -7.755 -11.630 -1.195 1.00 52.32 O ATOM 1442 CB PHE A 93 -5.486 -10.502 -2.630 1.00 52.25 C ATOM 1443 CG PHE A 93 -4.189 -9.834 -2.964 1.00 41.41 C ATOM 1444 CD1 PHE A 93 -4.184 -8.581 -3.550 1.00 62.01 C ATOM 1445 CD2 PHE A 93 -2.980 -10.448 -2.684 1.00 22.40 C ATOM 1446 CE1 PHE A 93 -2.998 -7.950 -3.852 1.00 12.11 C ATOM 1447 CE2 PHE A 93 -1.790 -9.820 -2.986 1.00 61.32 C ATOM 1448 CZ PHE A 93 -1.801 -8.569 -3.572 1.00 41.03 C ATOM 0 H PHE A 93 -5.169 -10.819 0.005 1.00 65.14 H new ATOM 0 HA PHE A 93 -6.354 -8.755 -1.746 1.00 1.34 H new ATOM 0 HB2 PHE A 93 -5.296 -11.540 -2.356 1.00 52.25 H new ATOM 0 HB3 PHE A 93 -6.121 -10.518 -3.516 1.00 52.25 H new ATOM 0 HD1 PHE A 93 -5.121 -8.092 -3.773 1.00 62.01 H new ATOM 0 HD2 PHE A 93 -2.969 -11.426 -2.226 1.00 22.40 H new ATOM 0 HE1 PHE A 93 -3.007 -6.971 -4.308 1.00 12.11 H new ATOM 0 HE2 PHE A 93 -0.851 -10.305 -2.765 1.00 61.32 H new ATOM 0 HZ PHE A 93 -0.870 -8.076 -3.811 1.00 41.03 H new ATOM 1458 N ARG A 94 -8.608 -9.554 -1.250 1.00 30.30 N ATOM 1459 CA ARG A 94 -9.981 -10.006 -1.185 1.00 40.24 C ATOM 1460 C ARG A 94 -10.694 -9.636 -2.477 1.00 70.31 C ATOM 1461 O ARG A 94 -10.441 -8.573 -3.051 1.00 32.10 O ATOM 1462 CB ARG A 94 -10.701 -9.388 0.017 1.00 74.50 C ATOM 1463 CG ARG A 94 -10.137 -9.816 1.366 1.00 42.05 C ATOM 1464 CD ARG A 94 -10.917 -9.205 2.517 1.00 2.55 C ATOM 1465 NE ARG A 94 -10.405 -9.629 3.818 1.00 21.34 N ATOM 1466 CZ ARG A 94 -10.825 -9.140 4.986 1.00 24.43 C ATOM 1467 NH1 ARG A 94 -11.776 -8.218 5.029 1.00 0.20 N ATOM 1468 NH2 ARG A 94 -10.300 -9.589 6.117 1.00 40.44 N ATOM 0 H ARG A 94 -8.495 -8.540 -1.248 1.00 30.30 H new ATOM 0 HA ARG A 94 -9.992 -11.089 -1.062 1.00 40.24 H new ATOM 0 HB2 ARG A 94 -10.647 -8.302 -0.059 1.00 74.50 H new ATOM 0 HB3 ARG A 94 -11.756 -9.659 -0.026 1.00 74.50 H new ATOM 0 HG2 ARG A 94 -10.164 -10.903 1.444 1.00 42.05 H new ATOM 0 HG3 ARG A 94 -9.091 -9.517 1.435 1.00 42.05 H new ATOM 0 HD2 ARG A 94 -10.872 -8.118 2.448 1.00 2.55 H new ATOM 0 HD3 ARG A 94 -11.967 -9.487 2.432 1.00 2.55 H new ATOM 0 HE ARG A 94 -9.679 -10.345 3.834 1.00 21.34 H new ATOM 0 HH11 ARG A 94 -12.194 -7.876 4.164 1.00 0.20 H new ATOM 0 HH12 ARG A 94 -12.090 -7.851 5.927 1.00 0.20 H new ATOM 0 HH21 ARG A 94 -9.576 -10.307 6.093 1.00 40.44 H new ATOM 0 HH22 ARG A 94 -10.620 -9.216 7.011 1.00 40.44 H new ATOM 1482 N PRO A 95 -11.584 -10.506 -2.959 1.00 45.52 N ATOM 1483 CA PRO A 95 -12.327 -10.263 -4.188 1.00 2.31 C ATOM 1484 C PRO A 95 -13.380 -9.187 -3.993 1.00 1.44 C ATOM 1485 O PRO A 95 -14.207 -9.273 -3.080 1.00 54.22 O ATOM 1486 CB PRO A 95 -12.989 -11.616 -4.500 1.00 62.43 C ATOM 1487 CG PRO A 95 -12.372 -12.593 -3.551 1.00 65.15 C ATOM 1488 CD PRO A 95 -11.939 -11.793 -2.359 1.00 75.12 C ATOM 0 HA PRO A 95 -11.684 -9.909 -4.994 1.00 2.31 H new ATOM 0 HB2 PRO A 95 -14.069 -11.565 -4.363 1.00 62.43 H new ATOM 0 HB3 PRO A 95 -12.813 -11.910 -5.535 1.00 62.43 H new ATOM 0 HG2 PRO A 95 -13.087 -13.364 -3.265 1.00 65.15 H new ATOM 0 HG3 PRO A 95 -11.523 -13.100 -4.010 1.00 65.15 H new ATOM 0 HD2 PRO A 95 -12.738 -11.693 -1.625 1.00 75.12 H new ATOM 0 HD3 PRO A 95 -11.092 -12.251 -1.848 1.00 75.12 H new ATOM 1496 N ALA A 96 -13.329 -8.160 -4.830 1.00 42.31 N ATOM 1497 CA ALA A 96 -14.325 -7.106 -4.794 1.00 13.14 C ATOM 1498 C ALA A 96 -15.677 -7.679 -5.199 1.00 32.13 C ATOM 1499 O ALA A 96 -15.731 -8.568 -6.050 1.00 54.40 O ATOM 1500 CB ALA A 96 -13.918 -5.954 -5.707 1.00 62.14 C ATOM 0 H ALA A 96 -12.608 -8.037 -5.541 1.00 42.31 H new ATOM 0 HA ALA A 96 -14.400 -6.710 -3.781 1.00 13.14 H new ATOM 0 HB1 ALA A 96 -14.677 -5.173 -5.667 1.00 62.14 H new ATOM 0 HB2 ALA A 96 -12.962 -5.548 -5.377 1.00 62.14 H new ATOM 0 HB3 ALA A 96 -13.824 -6.317 -6.731 1.00 62.14 H new ATOM 1506 N PRO A 97 -16.771 -7.188 -4.586 1.00 4.00 N ATOM 1507 CA PRO A 97 -18.126 -7.719 -4.791 1.00 21.34 C ATOM 1508 C PRO A 97 -18.419 -8.107 -6.240 1.00 21.12 C ATOM 1509 O PRO A 97 -18.335 -7.276 -7.148 1.00 41.15 O ATOM 1510 CB PRO A 97 -19.011 -6.554 -4.363 1.00 31.11 C ATOM 1511 CG PRO A 97 -18.234 -5.863 -3.297 1.00 75.45 C ATOM 1512 CD PRO A 97 -16.774 -6.063 -3.626 1.00 73.53 C ATOM 0 HA PRO A 97 -18.284 -8.642 -4.232 1.00 21.34 H new ATOM 0 HB2 PRO A 97 -19.218 -5.886 -5.199 1.00 31.11 H new ATOM 0 HB3 PRO A 97 -19.973 -6.904 -3.989 1.00 31.11 H new ATOM 0 HG2 PRO A 97 -18.481 -4.802 -3.264 1.00 75.45 H new ATOM 0 HG3 PRO A 97 -18.470 -6.276 -2.316 1.00 75.45 H new ATOM 0 HD2 PRO A 97 -16.337 -5.165 -4.063 1.00 73.53 H new ATOM 0 HD3 PRO A 97 -16.193 -6.298 -2.734 1.00 73.53 H new ATOM 1520 N GLY A 98 -18.727 -9.381 -6.449 1.00 31.11 N ATOM 1521 CA GLY A 98 -19.056 -9.862 -7.777 1.00 54.51 C ATOM 1522 C GLY A 98 -17.843 -10.362 -8.533 1.00 24.23 C ATOM 1523 O GLY A 98 -17.930 -10.652 -9.729 1.00 41.33 O ATOM 0 H GLY A 98 -18.755 -10.093 -5.719 1.00 31.11 H new ATOM 0 HA2 GLY A 98 -19.787 -10.667 -7.697 1.00 54.51 H new ATOM 0 HA3 GLY A 98 -19.527 -9.059 -8.344 1.00 54.51 H new ATOM 1527 N ALA A 99 -16.716 -10.464 -7.828 1.00 74.33 N ATOM 1528 CA ALA A 99 -15.452 -10.902 -8.418 1.00 51.44 C ATOM 1529 C ALA A 99 -15.047 -9.974 -9.558 1.00 41.35 C ATOM 1530 O ALA A 99 -14.475 -10.408 -10.565 1.00 42.14 O ATOM 1531 CB ALA A 99 -15.553 -12.344 -8.900 1.00 13.32 C ATOM 0 H ALA A 99 -16.654 -10.246 -6.834 1.00 74.33 H new ATOM 0 HA ALA A 99 -14.679 -10.858 -7.651 1.00 51.44 H new ATOM 0 HB1 ALA A 99 -14.602 -12.650 -9.335 1.00 13.32 H new ATOM 0 HB2 ALA A 99 -15.792 -12.993 -8.058 1.00 13.32 H new ATOM 0 HB3 ALA A 99 -16.338 -12.422 -9.652 1.00 13.32 H new ATOM 1537 N ARG A 100 -15.338 -8.692 -9.386 1.00 25.42 N ATOM 1538 CA ARG A 100 -15.040 -7.692 -10.401 1.00 1.21 C ATOM 1539 C ARG A 100 -13.548 -7.406 -10.443 1.00 61.34 C ATOM 1540 O ARG A 100 -12.871 -7.691 -11.429 1.00 25.42 O ATOM 1541 CB ARG A 100 -15.821 -6.409 -10.116 1.00 3.43 C ATOM 1542 CG ARG A 100 -15.536 -5.285 -11.098 1.00 12.22 C ATOM 1543 CD ARG A 100 -16.542 -4.163 -10.945 1.00 25.22 C ATOM 1544 NE ARG A 100 -17.894 -4.609 -11.272 1.00 40.00 N ATOM 1545 CZ ARG A 100 -18.948 -3.801 -11.346 1.00 1.03 C ATOM 1546 NH1 ARG A 100 -18.824 -2.506 -11.081 1.00 24.23 N ATOM 1547 NH2 ARG A 100 -20.132 -4.292 -11.678 1.00 34.41 N ATOM 0 H ARG A 100 -15.783 -8.319 -8.547 1.00 25.42 H new ATOM 0 HA ARG A 100 -15.343 -8.079 -11.374 1.00 1.21 H new ATOM 0 HB2 ARG A 100 -16.888 -6.633 -10.134 1.00 3.43 H new ATOM 0 HB3 ARG A 100 -15.584 -6.067 -9.108 1.00 3.43 H new ATOM 0 HG2 ARG A 100 -14.529 -4.901 -10.934 1.00 12.22 H new ATOM 0 HG3 ARG A 100 -15.568 -5.671 -12.117 1.00 12.22 H new ATOM 0 HD2 ARG A 100 -16.519 -3.789 -9.922 1.00 25.22 H new ATOM 0 HD3 ARG A 100 -16.264 -3.333 -11.594 1.00 25.22 H new ATOM 0 HE ARG A 100 -18.039 -5.602 -11.455 1.00 40.00 H new ATOM 0 HH11 ARG A 100 -17.915 -2.124 -10.818 1.00 24.23 H new ATOM 0 HH12 ARG A 100 -19.637 -1.893 -11.140 1.00 24.23 H new ATOM 0 HH21 ARG A 100 -20.234 -5.287 -11.876 1.00 34.41 H new ATOM 0 HH22 ARG A 100 -20.942 -3.675 -11.736 1.00 34.41 H new ATOM 1561 N GLY A 101 -13.047 -6.844 -9.363 1.00 62.31 N ATOM 1562 CA GLY A 101 -11.635 -6.591 -9.248 1.00 51.15 C ATOM 1563 C GLY A 101 -11.118 -7.079 -7.921 1.00 53.32 C ATOM 1564 O GLY A 101 -11.824 -7.788 -7.201 1.00 72.14 O ATOM 0 H GLY A 101 -13.600 -6.556 -8.556 1.00 62.31 H new ATOM 0 HA2 GLY A 101 -11.103 -7.090 -10.058 1.00 51.15 H new ATOM 0 HA3 GLY A 101 -11.441 -5.523 -9.350 1.00 51.15 H new ATOM 1568 N THR A 102 -9.910 -6.697 -7.579 1.00 61.12 N ATOM 1569 CA THR A 102 -9.337 -7.100 -6.317 1.00 20.41 C ATOM 1570 C THR A 102 -9.222 -5.904 -5.388 1.00 11.25 C ATOM 1571 O THR A 102 -8.604 -4.892 -5.728 1.00 2.35 O ATOM 1572 CB THR A 102 -7.960 -7.745 -6.514 1.00 31.03 C ATOM 1573 OG1 THR A 102 -8.030 -8.705 -7.573 1.00 2.52 O ATOM 1574 CG2 THR A 102 -7.498 -8.436 -5.240 1.00 73.10 C ATOM 0 H THR A 102 -9.307 -6.110 -8.155 1.00 61.12 H new ATOM 0 HA THR A 102 -9.999 -7.841 -5.868 1.00 20.41 H new ATOM 0 HB THR A 102 -7.245 -6.962 -6.765 1.00 31.03 H new ATOM 0 HG1 THR A 102 -7.615 -8.334 -8.379 1.00 2.52 H new ATOM 0 HG21 THR A 102 -6.519 -8.886 -5.405 1.00 73.10 H new ATOM 0 HG22 THR A 102 -7.431 -7.706 -4.434 1.00 73.10 H new ATOM 0 HG23 THR A 102 -8.213 -9.212 -4.967 1.00 73.10 H new ATOM 1582 N GLU A 103 -9.839 -6.013 -4.226 1.00 31.24 N ATOM 1583 CA GLU A 103 -9.777 -4.963 -3.236 1.00 33.31 C ATOM 1584 C GLU A 103 -8.615 -5.251 -2.302 1.00 74.31 C ATOM 1585 O GLU A 103 -8.672 -6.175 -1.485 1.00 71.04 O ATOM 1586 CB GLU A 103 -11.094 -4.877 -2.461 1.00 5.42 C ATOM 1587 CG GLU A 103 -11.175 -3.687 -1.520 1.00 70.14 C ATOM 1588 CD GLU A 103 -12.460 -3.664 -0.721 1.00 75.41 C ATOM 1589 OE1 GLU A 103 -12.568 -4.429 0.258 1.00 23.22 O ATOM 1590 OE2 GLU A 103 -13.372 -2.884 -1.066 1.00 53.12 O ATOM 0 H GLU A 103 -10.391 -6.824 -3.947 1.00 31.24 H new ATOM 0 HA GLU A 103 -9.622 -4.001 -3.724 1.00 33.31 H new ATOM 0 HB2 GLU A 103 -11.920 -4.824 -3.171 1.00 5.42 H new ATOM 0 HB3 GLU A 103 -11.227 -5.793 -1.886 1.00 5.42 H new ATOM 0 HG2 GLU A 103 -10.327 -3.711 -0.836 1.00 70.14 H new ATOM 0 HG3 GLU A 103 -11.094 -2.766 -2.097 1.00 70.14 H new ATOM 1597 N VAL A 104 -7.550 -4.484 -2.448 1.00 24.13 N ATOM 1598 CA VAL A 104 -6.367 -4.701 -1.649 1.00 41.44 C ATOM 1599 C VAL A 104 -6.496 -3.944 -0.333 1.00 20.24 C ATOM 1600 O VAL A 104 -6.840 -2.762 -0.304 1.00 1.32 O ATOM 1601 CB VAL A 104 -5.063 -4.278 -2.379 1.00 10.33 C ATOM 1602 CG1 VAL A 104 -4.983 -4.852 -3.785 1.00 11.11 C ATOM 1603 CG2 VAL A 104 -4.898 -2.776 -2.414 1.00 70.00 C ATOM 0 H VAL A 104 -7.484 -3.711 -3.110 1.00 24.13 H new ATOM 0 HA VAL A 104 -6.292 -5.772 -1.463 1.00 41.44 H new ATOM 0 HB VAL A 104 -4.240 -4.696 -1.799 1.00 10.33 H new ATOM 0 HG11 VAL A 104 -4.055 -4.530 -4.257 1.00 11.11 H new ATOM 0 HG12 VAL A 104 -5.006 -5.941 -3.735 1.00 11.11 H new ATOM 0 HG13 VAL A 104 -5.831 -4.497 -4.372 1.00 11.11 H new ATOM 0 HG21 VAL A 104 -3.974 -2.524 -2.933 1.00 70.00 H new ATOM 0 HG22 VAL A 104 -5.743 -2.329 -2.939 1.00 70.00 H new ATOM 0 HG23 VAL A 104 -4.859 -2.390 -1.395 1.00 70.00 H new ATOM 1613 N VAL A 105 -6.271 -4.651 0.751 1.00 0.24 N ATOM 1614 CA VAL A 105 -6.329 -4.063 2.073 1.00 53.30 C ATOM 1615 C VAL A 105 -4.931 -3.964 2.653 1.00 20.40 C ATOM 1616 O VAL A 105 -4.264 -4.977 2.887 1.00 3.04 O ATOM 1617 CB VAL A 105 -7.249 -4.859 3.026 1.00 65.21 C ATOM 1618 CG1 VAL A 105 -8.709 -4.569 2.735 1.00 3.13 C ATOM 1619 CG2 VAL A 105 -6.996 -6.351 2.919 1.00 52.04 C ATOM 0 H VAL A 105 -6.044 -5.645 0.743 1.00 0.24 H new ATOM 0 HA VAL A 105 -6.756 -3.065 1.973 1.00 53.30 H new ATOM 0 HB VAL A 105 -7.017 -4.539 4.042 1.00 65.21 H new ATOM 0 HG11 VAL A 105 -9.337 -5.141 3.418 1.00 3.13 H new ATOM 0 HG12 VAL A 105 -8.902 -3.505 2.869 1.00 3.13 H new ATOM 0 HG13 VAL A 105 -8.939 -4.853 1.708 1.00 3.13 H new ATOM 0 HG21 VAL A 105 -7.659 -6.882 3.602 1.00 52.04 H new ATOM 0 HG22 VAL A 105 -7.188 -6.680 1.898 1.00 52.04 H new ATOM 0 HG23 VAL A 105 -5.959 -6.564 3.180 1.00 52.04 H new ATOM 1629 N VAL A 106 -4.480 -2.743 2.859 1.00 22.10 N ATOM 1630 CA VAL A 106 -3.110 -2.506 3.284 1.00 21.21 C ATOM 1631 C VAL A 106 -3.053 -2.011 4.723 1.00 11.35 C ATOM 1632 O VAL A 106 -3.614 -0.969 5.059 1.00 23.02 O ATOM 1633 CB VAL A 106 -2.405 -1.487 2.363 1.00 64.31 C ATOM 1634 CG1 VAL A 106 -0.941 -1.340 2.745 1.00 51.33 C ATOM 1635 CG2 VAL A 106 -2.537 -1.894 0.903 1.00 32.13 C ATOM 0 H VAL A 106 -5.039 -1.898 2.740 1.00 22.10 H new ATOM 0 HA VAL A 106 -2.589 -3.461 3.219 1.00 21.21 H new ATOM 0 HB VAL A 106 -2.893 -0.521 2.493 1.00 64.31 H new ATOM 0 HG11 VAL A 106 -0.463 -0.617 2.083 1.00 51.33 H new ATOM 0 HG12 VAL A 106 -0.867 -0.993 3.776 1.00 51.33 H new ATOM 0 HG13 VAL A 106 -0.442 -2.304 2.650 1.00 51.33 H new ATOM 0 HG21 VAL A 106 -2.032 -1.161 0.274 1.00 32.13 H new ATOM 0 HG22 VAL A 106 -2.082 -2.873 0.756 1.00 32.13 H new ATOM 0 HG23 VAL A 106 -3.592 -1.940 0.632 1.00 32.13 H new ATOM 1645 N ARG A 107 -2.386 -2.782 5.568 1.00 71.03 N ATOM 1646 CA ARG A 107 -2.163 -2.401 6.955 1.00 35.44 C ATOM 1647 C ARG A 107 -0.705 -2.006 7.152 1.00 10.10 C ATOM 1648 O ARG A 107 0.195 -2.828 6.967 1.00 22.32 O ATOM 1649 CB ARG A 107 -2.537 -3.560 7.890 1.00 55.31 C ATOM 1650 CG ARG A 107 -2.130 -3.345 9.342 1.00 14.11 C ATOM 1651 CD ARG A 107 -2.573 -4.502 10.226 1.00 65.34 C ATOM 1652 NE ARG A 107 -4.023 -4.513 10.429 1.00 11.34 N ATOM 1653 CZ ARG A 107 -4.767 -5.618 10.481 1.00 43.21 C ATOM 1654 NH1 ARG A 107 -4.209 -6.812 10.335 1.00 53.50 N ATOM 1655 NH2 ARG A 107 -6.074 -5.526 10.692 1.00 21.43 N ATOM 0 H ARG A 107 -1.986 -3.685 5.314 1.00 71.03 H new ATOM 0 HA ARG A 107 -2.795 -1.547 7.197 1.00 35.44 H new ATOM 0 HB2 ARG A 107 -3.615 -3.715 7.845 1.00 55.31 H new ATOM 0 HB3 ARG A 107 -2.068 -4.473 7.524 1.00 55.31 H new ATOM 0 HG2 ARG A 107 -1.048 -3.233 9.404 1.00 14.11 H new ATOM 0 HG3 ARG A 107 -2.568 -2.417 9.710 1.00 14.11 H new ATOM 0 HD2 ARG A 107 -2.263 -5.444 9.773 1.00 65.34 H new ATOM 0 HD3 ARG A 107 -2.072 -4.433 11.192 1.00 65.34 H new ATOM 0 HE ARG A 107 -4.495 -3.616 10.538 1.00 11.34 H new ATOM 0 HH11 ARG A 107 -3.204 -6.890 10.182 1.00 53.50 H new ATOM 0 HH12 ARG A 107 -4.785 -7.653 10.376 1.00 53.50 H new ATOM 0 HH21 ARG A 107 -6.508 -4.611 10.814 1.00 21.43 H new ATOM 0 HH22 ARG A 107 -6.645 -6.370 10.732 1.00 21.43 H new ATOM 1669 N LEU A 108 -0.474 -0.747 7.502 1.00 63.23 N ATOM 1670 CA LEU A 108 0.882 -0.263 7.723 1.00 75.53 C ATOM 1671 C LEU A 108 0.913 0.805 8.813 1.00 54.00 C ATOM 1672 O LEU A 108 -0.072 1.513 9.035 1.00 33.22 O ATOM 1673 CB LEU A 108 1.490 0.267 6.411 1.00 43.40 C ATOM 1674 CG LEU A 108 0.775 1.460 5.757 1.00 42.05 C ATOM 1675 CD1 LEU A 108 1.287 2.783 6.316 1.00 61.41 C ATOM 1676 CD2 LEU A 108 0.949 1.419 4.246 1.00 72.55 C ATOM 0 H LEU A 108 -1.203 -0.047 7.638 1.00 63.23 H new ATOM 0 HA LEU A 108 1.490 -1.101 8.064 1.00 75.53 H new ATOM 0 HB2 LEU A 108 2.524 0.553 6.605 1.00 43.40 H new ATOM 0 HB3 LEU A 108 1.516 -0.552 5.692 1.00 43.40 H new ATOM 0 HG LEU A 108 -0.287 1.385 5.990 1.00 42.05 H new ATOM 0 HD11 LEU A 108 0.763 3.609 5.835 1.00 61.41 H new ATOM 0 HD12 LEU A 108 1.108 2.817 7.391 1.00 61.41 H new ATOM 0 HD13 LEU A 108 2.356 2.870 6.123 1.00 61.41 H new ATOM 0 HD21 LEU A 108 0.437 2.270 3.798 1.00 72.55 H new ATOM 0 HD22 LEU A 108 2.010 1.463 4.001 1.00 72.55 H new ATOM 0 HD23 LEU A 108 0.525 0.494 3.856 1.00 72.55 H new ATOM 1688 N THR A 109 2.041 0.900 9.498 1.00 51.11 N ATOM 1689 CA THR A 109 2.225 1.898 10.539 1.00 74.34 C ATOM 1690 C THR A 109 2.807 3.179 9.944 1.00 74.54 C ATOM 1691 O THR A 109 3.606 3.127 9.004 1.00 1.32 O ATOM 1692 CB THR A 109 3.145 1.368 11.667 1.00 64.31 C ATOM 1693 OG1 THR A 109 3.391 2.391 12.640 1.00 62.11 O ATOM 1694 CG2 THR A 109 4.468 0.871 11.102 1.00 0.30 C ATOM 0 H THR A 109 2.848 0.294 9.350 1.00 51.11 H new ATOM 0 HA THR A 109 1.249 2.117 10.973 1.00 74.34 H new ATOM 0 HB THR A 109 2.634 0.534 12.148 1.00 64.31 H new ATOM 0 HG1 THR A 109 3.972 2.038 13.346 1.00 62.11 H new ATOM 0 HG21 THR A 109 5.096 0.504 11.914 1.00 0.30 H new ATOM 0 HG22 THR A 109 4.281 0.063 10.395 1.00 0.30 H new ATOM 0 HG23 THR A 109 4.976 1.689 10.592 1.00 0.30 H new ATOM 1702 N TYR A 110 2.397 4.321 10.478 1.00 31.41 N ATOM 1703 CA TYR A 110 2.857 5.611 9.981 1.00 54.30 C ATOM 1704 C TYR A 110 2.545 6.699 10.997 1.00 13.40 C ATOM 1705 O TYR A 110 1.650 6.546 11.822 1.00 2.25 O ATOM 1706 CB TYR A 110 2.192 5.950 8.636 1.00 2.43 C ATOM 1707 CG TYR A 110 0.746 6.391 8.755 1.00 21.12 C ATOM 1708 CD1 TYR A 110 -0.239 5.513 9.187 1.00 40.45 C ATOM 1709 CD2 TYR A 110 0.372 7.693 8.441 1.00 10.44 C ATOM 1710 CE1 TYR A 110 -1.553 5.920 9.301 1.00 3.14 C ATOM 1711 CE2 TYR A 110 -0.943 8.104 8.553 1.00 44.41 C ATOM 1712 CZ TYR A 110 -1.900 7.214 8.984 1.00 23.52 C ATOM 1713 OH TYR A 110 -3.212 7.615 9.095 1.00 2.43 O ATOM 0 H TYR A 110 1.744 4.381 11.259 1.00 31.41 H new ATOM 0 HA TYR A 110 3.935 5.554 9.829 1.00 54.30 H new ATOM 0 HB2 TYR A 110 2.763 6.741 8.149 1.00 2.43 H new ATOM 0 HB3 TYR A 110 2.242 5.075 7.987 1.00 2.43 H new ATOM 0 HD1 TYR A 110 0.027 4.497 9.438 1.00 40.45 H new ATOM 0 HD2 TYR A 110 1.121 8.394 8.104 1.00 10.44 H new ATOM 0 HE1 TYR A 110 -2.307 5.225 9.638 1.00 3.14 H new ATOM 0 HE2 TYR A 110 -1.218 9.118 8.304 1.00 44.41 H new ATOM 0 HH TYR A 110 -3.289 8.557 8.835 1.00 2.43 H new ATOM 1782 N GLY A 115 7.276 18.618 12.615 1.00 55.32 N ATOM 1783 CA GLY A 115 8.567 19.272 12.586 1.00 14.04 C ATOM 1784 C GLY A 115 8.465 20.729 12.190 1.00 44.04 C ATOM 1785 O GLY A 115 7.630 21.100 11.364 1.00 15.22 O ATOM 0 HA2 GLY A 115 9.032 19.197 13.569 1.00 14.04 H new ATOM 0 HA3 GLY A 115 9.219 18.752 11.884 1.00 14.04 H new ATOM 1789 N SER A 116 9.307 21.556 12.790 1.00 53.32 N ATOM 1790 CA SER A 116 9.322 22.980 12.494 1.00 44.53 C ATOM 1791 C SER A 116 10.218 23.269 11.288 1.00 55.11 C ATOM 1792 O SER A 116 10.038 24.269 10.588 1.00 3.34 O ATOM 1793 CB SER A 116 9.807 23.758 13.720 1.00 52.42 C ATOM 1794 OG SER A 116 9.795 25.157 13.491 1.00 13.00 O ATOM 0 H SER A 116 9.991 21.264 13.488 1.00 53.32 H new ATOM 0 HA SER A 116 8.309 23.300 12.249 1.00 44.53 H new ATOM 0 HB2 SER A 116 9.172 23.524 14.574 1.00 52.42 H new ATOM 0 HB3 SER A 116 10.817 23.440 13.977 1.00 52.42 H new ATOM 0 HG SER A 116 10.109 25.623 14.294 1.00 13.00 H new ATOM 1800 N ALA A 117 11.164 22.373 11.034 1.00 64.41 N ATOM 1801 CA ALA A 117 12.162 22.580 9.990 1.00 35.44 C ATOM 1802 C ALA A 117 11.539 22.532 8.599 1.00 35.20 C ATOM 1803 O ALA A 117 12.022 23.176 7.667 1.00 21.21 O ATOM 1804 CB ALA A 117 13.268 21.545 10.114 1.00 72.30 C ATOM 0 H ALA A 117 11.262 21.492 11.539 1.00 64.41 H new ATOM 0 HA ALA A 117 12.587 23.575 10.124 1.00 35.44 H new ATOM 0 HB1 ALA A 117 14.008 21.708 9.330 1.00 72.30 H new ATOM 0 HB2 ALA A 117 13.746 21.638 11.089 1.00 72.30 H new ATOM 0 HB3 ALA A 117 12.845 20.546 10.011 1.00 72.30 H new ATOM 1810 N GLY A 118 10.462 21.772 8.468 1.00 10.23 N ATOM 1811 CA GLY A 118 9.802 21.624 7.187 1.00 44.34 C ATOM 1812 C GLY A 118 9.098 22.887 6.733 1.00 24.41 C ATOM 1813 O GLY A 118 8.820 23.052 5.548 1.00 22.11 O ATOM 0 H GLY A 118 10.031 21.252 9.232 1.00 10.23 H new ATOM 0 HA2 GLY A 118 10.538 21.335 6.437 1.00 44.34 H new ATOM 0 HA3 GLY A 118 9.076 20.813 7.250 1.00 44.34 H new ATOM 1817 N ALA A 119 8.819 23.787 7.670 1.00 13.03 N ATOM 1818 CA ALA A 119 8.046 24.992 7.382 1.00 62.20 C ATOM 1819 C ALA A 119 8.763 25.921 6.402 1.00 15.11 C ATOM 1820 O ALA A 119 8.129 26.757 5.758 1.00 42.33 O ATOM 1821 CB ALA A 119 7.725 25.729 8.672 1.00 50.11 C ATOM 0 H ALA A 119 9.118 23.704 8.642 1.00 13.03 H new ATOM 0 HA ALA A 119 7.118 24.677 6.905 1.00 62.20 H new ATOM 0 HB1 ALA A 119 7.148 26.626 8.445 1.00 50.11 H new ATOM 0 HB2 ALA A 119 7.144 25.080 9.327 1.00 50.11 H new ATOM 0 HB3 ALA A 119 8.652 26.011 9.171 1.00 50.11 H new ATOM 1827 N VAL A 120 10.077 25.763 6.278 1.00 73.22 N ATOM 1828 CA VAL A 120 10.878 26.642 5.428 1.00 12.21 C ATOM 1829 C VAL A 120 10.547 26.450 3.939 1.00 24.32 C ATOM 1830 O VAL A 120 10.813 27.328 3.115 1.00 31.20 O ATOM 1831 CB VAL A 120 12.393 26.422 5.665 1.00 44.23 C ATOM 1832 CG1 VAL A 120 12.845 25.065 5.143 1.00 70.42 C ATOM 1833 CG2 VAL A 120 13.210 27.546 5.042 1.00 64.43 C ATOM 0 H VAL A 120 10.611 25.036 6.754 1.00 73.22 H new ATOM 0 HA VAL A 120 10.625 27.666 5.704 1.00 12.21 H new ATOM 0 HB VAL A 120 12.565 26.435 6.741 1.00 44.23 H new ATOM 0 HG11 VAL A 120 13.913 24.942 5.325 1.00 70.42 H new ATOM 0 HG12 VAL A 120 12.296 24.276 5.657 1.00 70.42 H new ATOM 0 HG13 VAL A 120 12.650 25.004 4.072 1.00 70.42 H new ATOM 0 HG21 VAL A 120 14.270 27.368 5.222 1.00 64.43 H new ATOM 0 HG22 VAL A 120 13.025 27.578 3.968 1.00 64.43 H new ATOM 0 HG23 VAL A 120 12.920 28.497 5.489 1.00 64.43 H new ATOM 1843 N ILE A 121 9.940 25.314 3.600 1.00 10.01 N ATOM 1844 CA ILE A 121 9.622 25.004 2.207 1.00 31.31 C ATOM 1845 C ILE A 121 8.544 25.950 1.667 1.00 0.21 C ATOM 1846 O ILE A 121 8.438 26.169 0.458 1.00 70.51 O ATOM 1847 CB ILE A 121 9.159 23.533 2.037 1.00 53.22 C ATOM 1848 CG1 ILE A 121 9.115 23.149 0.552 1.00 31.52 C ATOM 1849 CG2 ILE A 121 7.793 23.320 2.678 1.00 54.13 C ATOM 1850 CD1 ILE A 121 8.730 21.705 0.305 1.00 43.14 C ATOM 0 H ILE A 121 9.659 24.596 4.268 1.00 10.01 H new ATOM 0 HA ILE A 121 10.538 25.143 1.633 1.00 31.31 H new ATOM 0 HB ILE A 121 9.881 22.890 2.541 1.00 53.22 H new ATOM 0 HG12 ILE A 121 8.404 23.797 0.040 1.00 31.52 H new ATOM 0 HG13 ILE A 121 10.093 23.335 0.109 1.00 31.52 H new ATOM 0 HG21 ILE A 121 7.488 22.282 2.547 1.00 54.13 H new ATOM 0 HG22 ILE A 121 7.850 23.550 3.742 1.00 54.13 H new ATOM 0 HG23 ILE A 121 7.062 23.976 2.204 1.00 54.13 H new ATOM 0 HD11 ILE A 121 8.721 21.509 -0.767 1.00 43.14 H new ATOM 0 HD12 ILE A 121 9.454 21.048 0.787 1.00 43.14 H new ATOM 0 HD13 ILE A 121 7.738 21.517 0.717 1.00 43.14 H new ATOM 1862 N ALA A 122 7.765 26.531 2.572 1.00 43.32 N ATOM 1863 CA ALA A 122 6.685 27.429 2.191 1.00 61.42 C ATOM 1864 C ALA A 122 7.229 28.737 1.626 1.00 50.30 C ATOM 1865 O ALA A 122 6.538 29.442 0.894 1.00 53.21 O ATOM 1866 CB ALA A 122 5.787 27.700 3.385 1.00 41.51 C ATOM 0 H ALA A 122 7.863 26.395 3.578 1.00 43.32 H new ATOM 0 HA ALA A 122 6.100 26.945 1.409 1.00 61.42 H new ATOM 0 HB1 ALA A 122 4.982 28.373 3.090 1.00 41.51 H new ATOM 0 HB2 ALA A 122 5.363 26.761 3.742 1.00 41.51 H new ATOM 0 HB3 ALA A 122 6.371 28.160 4.182 1.00 41.51 H new ATOM 1872 N ARG A 123 8.481 29.038 1.953 1.00 64.43 N ATOM 1873 CA ARG A 123 9.123 30.268 1.504 1.00 23.41 C ATOM 1874 C ARG A 123 9.415 30.211 0.007 1.00 72.23 C ATOM 1875 O ARG A 123 9.435 31.237 -0.671 1.00 44.41 O ATOM 1876 CB ARG A 123 10.429 30.497 2.273 1.00 21.33 C ATOM 1877 CG ARG A 123 11.104 31.821 1.953 1.00 31.35 C ATOM 1878 CD ARG A 123 12.494 31.899 2.562 1.00 62.00 C ATOM 1879 NE ARG A 123 13.094 33.219 2.380 1.00 30.31 N ATOM 1880 CZ ARG A 123 14.376 33.426 2.091 1.00 15.21 C ATOM 1881 NH1 ARG A 123 15.199 32.400 1.904 1.00 22.42 N ATOM 1882 NH2 ARG A 123 14.834 34.664 1.968 1.00 54.33 N ATOM 0 H ARG A 123 9.074 28.443 2.531 1.00 64.43 H new ATOM 0 HA ARG A 123 8.441 31.096 1.698 1.00 23.41 H new ATOM 0 HB2 ARG A 123 10.223 30.454 3.342 1.00 21.33 H new ATOM 0 HB3 ARG A 123 11.119 29.684 2.049 1.00 21.33 H new ATOM 0 HG2 ARG A 123 11.172 31.944 0.872 1.00 31.35 H new ATOM 0 HG3 ARG A 123 10.494 32.642 2.330 1.00 31.35 H new ATOM 0 HD2 ARG A 123 12.438 31.669 3.626 1.00 62.00 H new ATOM 0 HD3 ARG A 123 13.133 31.143 2.106 1.00 62.00 H new ATOM 0 HE ARG A 123 12.490 34.035 2.481 1.00 30.31 H new ATOM 0 HH11 ARG A 123 14.849 31.445 1.982 1.00 22.42 H new ATOM 0 HH12 ARG A 123 16.181 32.567 1.683 1.00 22.42 H new ATOM 0 HH21 ARG A 123 14.204 35.456 2.095 1.00 54.33 H new ATOM 0 HH22 ARG A 123 15.817 34.825 1.746 1.00 54.33 H new ATOM 1896 N MET A 124 9.629 29.003 -0.503 1.00 72.44 N ATOM 1897 CA MET A 124 10.017 28.821 -1.900 1.00 54.53 C ATOM 1898 C MET A 124 8.854 29.128 -2.839 1.00 20.04 C ATOM 1899 O MET A 124 8.977 29.952 -3.745 1.00 22.31 O ATOM 1900 CB MET A 124 10.516 27.390 -2.128 1.00 60.20 C ATOM 1901 CG MET A 124 11.036 27.135 -3.535 1.00 53.03 C ATOM 1902 SD MET A 124 11.633 25.448 -3.761 1.00 33.44 S ATOM 1903 CE MET A 124 12.962 25.395 -2.559 1.00 74.44 C ATOM 0 H MET A 124 9.541 28.136 0.027 1.00 72.44 H new ATOM 0 HA MET A 124 10.824 29.520 -2.121 1.00 54.53 H new ATOM 0 HB2 MET A 124 11.310 27.174 -1.413 1.00 60.20 H new ATOM 0 HB3 MET A 124 9.703 26.695 -1.920 1.00 60.20 H new ATOM 0 HG2 MET A 124 10.241 27.334 -4.253 1.00 53.03 H new ATOM 0 HG3 MET A 124 11.844 27.834 -3.752 1.00 53.03 H new ATOM 0 HE1 MET A 124 13.645 24.583 -2.808 1.00 74.44 H new ATOM 0 HE2 MET A 124 13.503 26.341 -2.573 1.00 74.44 H new ATOM 0 HE3 MET A 124 12.547 25.229 -1.565 1.00 74.44 H new ATOM 2057 N ARG A 134 -6.599 10.041 2.756 1.00 0.22 N ATOM 2058 CA ARG A 134 -6.373 8.746 2.128 1.00 74.21 C ATOM 2059 C ARG A 134 -5.610 8.952 0.820 1.00 41.34 C ATOM 2060 O ARG A 134 -5.495 8.046 -0.007 1.00 70.12 O ATOM 2061 CB ARG A 134 -7.713 8.058 1.856 1.00 43.11 C ATOM 2062 CG ARG A 134 -8.586 7.915 3.095 1.00 14.11 C ATOM 2063 CD ARG A 134 -9.982 7.430 2.741 1.00 72.14 C ATOM 2064 NE ARG A 134 -9.971 6.091 2.162 1.00 65.43 N ATOM 2065 CZ ARG A 134 -10.646 5.744 1.069 1.00 13.52 C ATOM 2066 NH1 ARG A 134 -11.390 6.634 0.419 1.00 13.20 N ATOM 2067 NH2 ARG A 134 -10.579 4.496 0.623 1.00 10.53 N ATOM 0 HA ARG A 134 -5.787 8.112 2.793 1.00 74.21 H new ATOM 0 HB2 ARG A 134 -8.257 8.626 1.102 1.00 43.11 H new ATOM 0 HB3 ARG A 134 -7.526 7.069 1.437 1.00 43.11 H new ATOM 0 HG2 ARG A 134 -8.122 7.215 3.789 1.00 14.11 H new ATOM 0 HG3 ARG A 134 -8.652 8.875 3.607 1.00 14.11 H new ATOM 0 HD2 ARG A 134 -10.603 7.431 3.637 1.00 72.14 H new ATOM 0 HD3 ARG A 134 -10.438 8.125 2.036 1.00 72.14 H new ATOM 0 HE ARG A 134 -9.410 5.375 2.624 1.00 65.43 H new ATOM 0 HH11 ARG A 134 -11.448 7.595 0.757 1.00 13.20 H new ATOM 0 HH12 ARG A 134 -11.903 6.356 -0.418 1.00 13.20 H new ATOM 0 HH21 ARG A 134 -10.012 3.807 1.118 1.00 10.53 H new ATOM 0 HH22 ARG A 134 -11.095 4.225 -0.214 1.00 10.53 H new ATOM 2081 N ASP A 135 -5.064 10.157 0.674 1.00 51.03 N ATOM 2082 CA ASP A 135 -4.450 10.627 -0.567 1.00 23.11 C ATOM 2083 C ASP A 135 -3.319 9.724 -1.052 1.00 34.55 C ATOM 2084 O ASP A 135 -3.178 9.501 -2.255 1.00 45.21 O ATOM 2085 CB ASP A 135 -3.922 12.048 -0.373 1.00 44.12 C ATOM 2086 CG ASP A 135 -2.932 12.141 0.771 1.00 2.14 C ATOM 2087 OD1 ASP A 135 -3.372 12.306 1.927 1.00 33.04 O ATOM 2088 OD2 ASP A 135 -1.711 12.023 0.520 1.00 72.01 O ATOM 0 H ASP A 135 -5.035 10.846 1.426 1.00 51.03 H new ATOM 0 HA ASP A 135 -5.226 10.607 -1.333 1.00 23.11 H new ATOM 0 HB2 ASP A 135 -3.444 12.385 -1.293 1.00 44.12 H new ATOM 0 HB3 ASP A 135 -4.758 12.721 -0.183 1.00 44.12 H new ATOM 2093 N ASP A 136 -2.517 9.208 -0.129 1.00 54.33 N ATOM 2094 CA ASP A 136 -1.385 8.362 -0.498 1.00 1.15 C ATOM 2095 C ASP A 136 -1.858 7.106 -1.221 1.00 55.03 C ATOM 2096 O ASP A 136 -1.292 6.713 -2.241 1.00 60.23 O ATOM 2097 CB ASP A 136 -0.564 7.982 0.736 1.00 2.52 C ATOM 2098 CG ASP A 136 0.708 7.233 0.380 1.00 53.04 C ATOM 2099 OD1 ASP A 136 0.672 5.989 0.296 1.00 0.10 O ATOM 2100 OD2 ASP A 136 1.754 7.887 0.182 1.00 22.20 O ATOM 0 H ASP A 136 -2.626 9.358 0.874 1.00 54.33 H new ATOM 0 HA ASP A 136 -0.750 8.933 -1.175 1.00 1.15 H new ATOM 0 HB2 ASP A 136 -0.307 8.885 1.290 1.00 2.52 H new ATOM 0 HB3 ASP A 136 -1.172 7.365 1.397 1.00 2.52 H new ATOM 2105 N LEU A 137 -2.928 6.506 -0.716 1.00 14.33 N ATOM 2106 CA LEU A 137 -3.455 5.285 -1.295 1.00 63.14 C ATOM 2107 C LEU A 137 -4.284 5.608 -2.539 1.00 2.31 C ATOM 2108 O LEU A 137 -4.492 4.753 -3.398 1.00 21.05 O ATOM 2109 CB LEU A 137 -4.288 4.530 -0.254 1.00 71.43 C ATOM 2110 CG LEU A 137 -4.529 3.045 -0.550 1.00 11.21 C ATOM 2111 CD1 LEU A 137 -3.211 2.329 -0.785 1.00 41.15 C ATOM 2112 CD2 LEU A 137 -5.277 2.388 0.599 1.00 2.24 C ATOM 0 H LEU A 137 -3.446 6.848 0.094 1.00 14.33 H new ATOM 0 HA LEU A 137 -2.628 4.643 -1.599 1.00 63.14 H new ATOM 0 HB2 LEU A 137 -3.791 4.614 0.713 1.00 71.43 H new ATOM 0 HB3 LEU A 137 -5.255 5.025 -0.160 1.00 71.43 H new ATOM 0 HG LEU A 137 -5.135 2.971 -1.453 1.00 11.21 H new ATOM 0 HD11 LEU A 137 -3.401 1.276 -0.994 1.00 41.15 H new ATOM 0 HD12 LEU A 137 -2.698 2.780 -1.634 1.00 41.15 H new ATOM 0 HD13 LEU A 137 -2.586 2.416 0.104 1.00 41.15 H new ATOM 0 HD21 LEU A 137 -5.440 1.334 0.372 1.00 2.24 H new ATOM 0 HD22 LEU A 137 -4.690 2.476 1.513 1.00 2.24 H new ATOM 0 HD23 LEU A 137 -6.239 2.882 0.737 1.00 2.24 H new ATOM 2124 N MET A 138 -4.744 6.856 -2.635 1.00 60.42 N ATOM 2125 CA MET A 138 -5.472 7.313 -3.818 1.00 31.52 C ATOM 2126 C MET A 138 -4.531 7.406 -5.014 1.00 21.11 C ATOM 2127 O MET A 138 -4.844 6.919 -6.102 1.00 4.13 O ATOM 2128 CB MET A 138 -6.127 8.677 -3.573 1.00 5.34 C ATOM 2129 CG MET A 138 -7.195 8.696 -2.485 1.00 43.13 C ATOM 2130 SD MET A 138 -8.619 7.646 -2.850 1.00 31.22 S ATOM 2131 CE MET A 138 -8.070 6.063 -2.211 1.00 3.22 C ATOM 0 H MET A 138 -4.626 7.565 -1.911 1.00 60.42 H new ATOM 0 HA MET A 138 -6.256 6.585 -4.028 1.00 31.52 H new ATOM 0 HB2 MET A 138 -5.349 9.394 -3.310 1.00 5.34 H new ATOM 0 HB3 MET A 138 -6.574 9.020 -4.506 1.00 5.34 H new ATOM 0 HG2 MET A 138 -6.749 8.374 -1.544 1.00 43.13 H new ATOM 0 HG3 MET A 138 -7.537 9.721 -2.342 1.00 43.13 H new ATOM 0 HE1 MET A 138 -7.900 5.375 -3.039 1.00 3.22 H new ATOM 0 HE2 MET A 138 -7.142 6.197 -1.655 1.00 3.22 H new ATOM 0 HE3 MET A 138 -8.833 5.653 -1.550 1.00 3.22 H new ATOM 2141 N ARG A 139 -3.373 8.027 -4.801 1.00 14.24 N ATOM 2142 CA ARG A 139 -2.339 8.088 -5.831 1.00 5.21 C ATOM 2143 C ARG A 139 -1.882 6.683 -6.197 1.00 0.02 C ATOM 2144 O ARG A 139 -1.712 6.354 -7.373 1.00 1.11 O ATOM 2145 CB ARG A 139 -1.131 8.909 -5.361 1.00 34.15 C ATOM 2146 CG ARG A 139 -1.119 10.350 -5.855 1.00 25.33 C ATOM 2147 CD ARG A 139 -2.056 11.251 -5.064 1.00 54.14 C ATOM 2148 NE ARG A 139 -1.652 11.376 -3.662 1.00 2.44 N ATOM 2149 CZ ARG A 139 -0.754 12.263 -3.214 1.00 71.32 C ATOM 2150 NH1 ARG A 139 -0.139 13.084 -4.054 1.00 70.12 N ATOM 2151 NH2 ARG A 139 -0.477 12.337 -1.918 1.00 35.04 N ATOM 0 H ARG A 139 -3.128 8.493 -3.928 1.00 14.24 H new ATOM 0 HA ARG A 139 -2.770 8.575 -6.706 1.00 5.21 H new ATOM 0 HB2 ARG A 139 -1.110 8.911 -4.271 1.00 34.15 H new ATOM 0 HB3 ARG A 139 -0.219 8.415 -5.696 1.00 34.15 H new ATOM 0 HG2 ARG A 139 -0.104 10.743 -5.791 1.00 25.33 H new ATOM 0 HG3 ARG A 139 -1.404 10.371 -6.907 1.00 25.33 H new ATOM 0 HD2 ARG A 139 -2.080 12.239 -5.523 1.00 54.14 H new ATOM 0 HD3 ARG A 139 -3.069 10.852 -5.114 1.00 54.14 H new ATOM 0 HE ARG A 139 -2.082 10.747 -2.983 1.00 2.44 H new ATOM 0 HH11 ARG A 139 -0.348 13.044 -5.052 1.00 70.12 H new ATOM 0 HH12 ARG A 139 0.543 13.756 -3.703 1.00 70.12 H new ATOM 0 HH21 ARG A 139 -0.949 11.717 -1.259 1.00 35.04 H new ATOM 0 HH22 ARG A 139 0.207 13.014 -1.581 1.00 35.04 H new ATOM 2165 N PHE A 140 -1.696 5.864 -5.171 1.00 12.22 N ATOM 2166 CA PHE A 140 -1.275 4.484 -5.341 1.00 11.32 C ATOM 2167 C PHE A 140 -2.249 3.721 -6.235 1.00 22.43 C ATOM 2168 O PHE A 140 -1.835 3.061 -7.183 1.00 13.33 O ATOM 2169 CB PHE A 140 -1.173 3.815 -3.967 1.00 50.33 C ATOM 2170 CG PHE A 140 -0.672 2.403 -4.001 1.00 32.24 C ATOM 2171 CD1 PHE A 140 0.631 2.122 -4.378 1.00 13.40 C ATOM 2172 CD2 PHE A 140 -1.504 1.355 -3.643 1.00 75.12 C ATOM 2173 CE1 PHE A 140 1.092 0.822 -4.399 1.00 55.45 C ATOM 2174 CE2 PHE A 140 -1.047 0.055 -3.658 1.00 23.40 C ATOM 2175 CZ PHE A 140 0.251 -0.213 -4.037 1.00 44.41 C ATOM 0 H PHE A 140 -1.833 6.139 -4.198 1.00 12.22 H new ATOM 0 HA PHE A 140 -0.299 4.469 -5.826 1.00 11.32 H new ATOM 0 HB2 PHE A 140 -0.510 4.408 -3.336 1.00 50.33 H new ATOM 0 HB3 PHE A 140 -2.156 3.827 -3.497 1.00 50.33 H new ATOM 0 HD1 PHE A 140 1.292 2.929 -4.658 1.00 13.40 H new ATOM 0 HD2 PHE A 140 -2.523 1.559 -3.349 1.00 75.12 H new ATOM 0 HE1 PHE A 140 2.109 0.613 -4.698 1.00 55.45 H new ATOM 0 HE2 PHE A 140 -1.705 -0.753 -3.373 1.00 23.40 H new ATOM 0 HZ PHE A 140 0.610 -1.231 -4.051 1.00 44.41 H new ATOM 2185 N LYS A 141 -3.540 3.840 -5.933 1.00 10.21 N ATOM 2186 CA LYS A 141 -4.587 3.153 -6.686 1.00 55.54 C ATOM 2187 C LYS A 141 -4.508 3.466 -8.178 1.00 75.11 C ATOM 2188 O LYS A 141 -4.394 2.556 -8.995 1.00 42.32 O ATOM 2189 CB LYS A 141 -5.966 3.537 -6.141 1.00 15.25 C ATOM 2190 CG LYS A 141 -7.125 3.125 -7.036 1.00 21.31 C ATOM 2191 CD LYS A 141 -8.453 3.560 -6.443 1.00 42.25 C ATOM 2192 CE LYS A 141 -9.569 3.581 -7.477 1.00 12.23 C ATOM 2193 NZ LYS A 141 -9.764 2.262 -8.137 1.00 61.31 N ATOM 0 H LYS A 141 -3.889 4.412 -5.164 1.00 10.21 H new ATOM 0 HA LYS A 141 -4.434 2.081 -6.563 1.00 55.54 H new ATOM 0 HB2 LYS A 141 -6.098 3.079 -5.161 1.00 15.25 H new ATOM 0 HB3 LYS A 141 -5.999 4.617 -5.996 1.00 15.25 H new ATOM 0 HG2 LYS A 141 -7.001 3.568 -8.024 1.00 21.31 H new ATOM 0 HG3 LYS A 141 -7.119 2.043 -7.169 1.00 21.31 H new ATOM 0 HD2 LYS A 141 -8.725 2.884 -5.632 1.00 42.25 H new ATOM 0 HD3 LYS A 141 -8.346 4.553 -6.007 1.00 42.25 H new ATOM 0 HE2 LYS A 141 -10.499 3.883 -6.996 1.00 12.23 H new ATOM 0 HE3 LYS A 141 -9.343 4.332 -8.234 1.00 12.23 H new ATOM 0 HZ1 LYS A 141 -9.482 2.328 -9.136 1.00 61.31 H new ATOM 0 HZ2 LYS A 141 -9.181 1.545 -7.659 1.00 61.31 H new ATOM 0 HZ3 LYS A 141 -10.766 1.989 -8.078 1.00 61.31 H new ATOM 2207 N ARG A 142 -4.555 4.750 -8.522 1.00 22.43 N ATOM 2208 CA ARG A 142 -4.571 5.180 -9.922 1.00 42.41 C ATOM 2209 C ARG A 142 -3.381 4.621 -10.699 1.00 53.55 C ATOM 2210 O ARG A 142 -3.528 4.156 -11.829 1.00 4.23 O ATOM 2211 CB ARG A 142 -4.580 6.710 -10.007 1.00 62.15 C ATOM 2212 CG ARG A 142 -5.906 7.346 -9.608 1.00 50.31 C ATOM 2213 CD ARG A 142 -6.865 7.456 -10.787 1.00 11.34 C ATOM 2214 NE ARG A 142 -7.301 6.156 -11.298 1.00 62.35 N ATOM 2215 CZ ARG A 142 -7.706 5.945 -12.552 1.00 22.04 C ATOM 2216 NH1 ARG A 142 -7.725 6.944 -13.431 1.00 22.10 N ATOM 2217 NH2 ARG A 142 -8.102 4.732 -12.917 1.00 13.24 N ATOM 0 H ARG A 142 -4.583 5.516 -7.849 1.00 22.43 H new ATOM 0 HA ARG A 142 -5.481 4.787 -10.376 1.00 42.41 H new ATOM 0 HB2 ARG A 142 -3.792 7.104 -9.365 1.00 62.15 H new ATOM 0 HB3 ARG A 142 -4.338 7.008 -11.027 1.00 62.15 H new ATOM 0 HG2 ARG A 142 -6.369 6.754 -8.818 1.00 50.31 H new ATOM 0 HG3 ARG A 142 -5.723 8.338 -9.196 1.00 50.31 H new ATOM 0 HD2 ARG A 142 -7.739 8.032 -10.483 1.00 11.34 H new ATOM 0 HD3 ARG A 142 -6.381 8.011 -11.590 1.00 11.34 H new ATOM 0 HE ARG A 142 -7.295 5.363 -10.657 1.00 62.35 H new ATOM 0 HH11 ARG A 142 -7.429 7.878 -13.148 1.00 22.10 H new ATOM 0 HH12 ARG A 142 -8.036 6.776 -14.388 1.00 22.10 H new ATOM 0 HH21 ARG A 142 -8.096 3.968 -12.241 1.00 13.24 H new ATOM 0 HH22 ARG A 142 -8.413 4.563 -13.874 1.00 13.24 H new ATOM 2231 N GLU A 143 -2.207 4.654 -10.086 1.00 42.13 N ATOM 2232 CA GLU A 143 -0.997 4.172 -10.737 1.00 1.05 C ATOM 2233 C GLU A 143 -0.952 2.643 -10.770 1.00 14.34 C ATOM 2234 O GLU A 143 -0.344 2.050 -11.661 1.00 60.13 O ATOM 2235 CB GLU A 143 0.237 4.712 -10.015 1.00 35.33 C ATOM 2236 CG GLU A 143 0.373 6.224 -10.069 1.00 32.51 C ATOM 2237 CD GLU A 143 1.583 6.720 -9.305 1.00 0.11 C ATOM 2238 OE1 GLU A 143 2.718 6.426 -9.733 1.00 42.51 O ATOM 2239 OE2 GLU A 143 1.406 7.405 -8.272 1.00 2.42 O ATOM 0 H GLU A 143 -2.066 5.009 -9.140 1.00 42.13 H new ATOM 0 HA GLU A 143 -1.004 4.533 -11.766 1.00 1.05 H new ATOM 0 HB2 GLU A 143 0.201 4.398 -8.972 1.00 35.33 H new ATOM 0 HB3 GLU A 143 1.128 4.262 -10.453 1.00 35.33 H new ATOM 0 HG2 GLU A 143 0.447 6.543 -11.109 1.00 32.51 H new ATOM 0 HG3 GLU A 143 -0.526 6.682 -9.658 1.00 32.51 H new ATOM 2246 N GLN A 144 -1.607 2.020 -9.800 1.00 40.15 N ATOM 2247 CA GLN A 144 -1.600 0.568 -9.663 1.00 70.34 C ATOM 2248 C GLN A 144 -2.604 -0.082 -10.614 1.00 41.34 C ATOM 2249 O GLN A 144 -2.330 -1.133 -11.198 1.00 64.34 O ATOM 2250 CB GLN A 144 -1.926 0.191 -8.215 1.00 32.34 C ATOM 2251 CG GLN A 144 -1.894 -1.303 -7.935 1.00 74.44 C ATOM 2252 CD GLN A 144 -2.214 -1.623 -6.487 1.00 23.05 C ATOM 2253 OE1 GLN A 144 -2.980 -0.917 -5.838 1.00 74.11 O ATOM 2254 NE2 GLN A 144 -1.609 -2.677 -5.962 1.00 22.23 N ATOM 0 H GLN A 144 -2.156 2.503 -9.089 1.00 40.15 H new ATOM 0 HA GLN A 144 -0.607 0.200 -9.923 1.00 70.34 H new ATOM 0 HB2 GLN A 144 -1.216 0.688 -7.554 1.00 32.34 H new ATOM 0 HB3 GLN A 144 -2.916 0.574 -7.966 1.00 32.34 H new ATOM 0 HG2 GLN A 144 -2.610 -1.808 -8.583 1.00 74.44 H new ATOM 0 HG3 GLN A 144 -0.908 -1.696 -8.183 1.00 74.44 H new ATOM 0 HE21 GLN A 144 -0.979 -3.240 -6.533 1.00 22.23 H new ATOM 0 HE22 GLN A 144 -1.773 -2.926 -4.987 1.00 22.23 H new ATOM 2263 N GLU A 145 -3.763 0.544 -10.771 1.00 14.23 N ATOM 2264 CA GLU A 145 -4.825 -0.029 -11.587 1.00 43.51 C ATOM 2265 C GLU A 145 -4.589 0.227 -13.071 1.00 73.35 C ATOM 2266 O GLU A 145 -4.872 -0.640 -13.901 1.00 73.13 O ATOM 2267 CB GLU A 145 -6.192 0.507 -11.148 1.00 23.33 C ATOM 2268 CG GLU A 145 -6.368 2.002 -11.331 1.00 25.52 C ATOM 2269 CD GLU A 145 -7.604 2.524 -10.633 1.00 22.33 C ATOM 2270 OE1 GLU A 145 -8.583 1.761 -10.492 1.00 32.33 O ATOM 2271 OE2 GLU A 145 -7.609 3.700 -10.229 1.00 11.43 O ATOM 0 H GLU A 145 -3.991 1.443 -10.347 1.00 14.23 H new ATOM 0 HA GLU A 145 -4.815 -1.109 -11.437 1.00 43.51 H new ATOM 0 HB2 GLU A 145 -6.969 -0.009 -11.712 1.00 23.33 H new ATOM 0 HB3 GLU A 145 -6.344 0.262 -10.097 1.00 23.33 H new ATOM 0 HG2 GLU A 145 -5.490 2.519 -10.945 1.00 25.52 H new ATOM 0 HG3 GLU A 145 -6.430 2.231 -12.395 1.00 25.52 H new ATOM 2278 N LEU A 146 -4.059 1.402 -13.398 1.00 41.32 N ATOM 2279 CA LEU A 146 -3.809 1.759 -14.787 1.00 42.42 C ATOM 2280 C LEU A 146 -2.635 0.950 -15.324 1.00 11.13 C ATOM 2281 O LEU A 146 -2.794 0.129 -16.231 1.00 73.45 O ATOM 2282 CB LEU A 146 -3.510 3.261 -14.900 1.00 63.31 C ATOM 2283 CG LEU A 146 -4.055 3.956 -16.154 1.00 12.42 C ATOM 2284 CD1 LEU A 146 -3.795 5.451 -16.083 1.00 75.11 C ATOM 2285 CD2 LEU A 146 -3.436 3.377 -17.418 1.00 55.13 C ATOM 0 H LEU A 146 -3.796 2.119 -12.722 1.00 41.32 H new ATOM 0 HA LEU A 146 -4.697 1.533 -15.378 1.00 42.42 H new ATOM 0 HB2 LEU A 146 -3.920 3.761 -14.023 1.00 63.31 H new ATOM 0 HB3 LEU A 146 -2.429 3.401 -14.870 1.00 63.31 H new ATOM 0 HG LEU A 146 -5.130 3.782 -16.193 1.00 12.42 H new ATOM 0 HD11 LEU A 146 -4.187 5.931 -16.979 1.00 75.11 H new ATOM 0 HD12 LEU A 146 -4.289 5.865 -15.204 1.00 75.11 H new ATOM 0 HD13 LEU A 146 -2.722 5.631 -16.015 1.00 75.11 H new ATOM 0 HD21 LEU A 146 -3.842 3.890 -18.290 1.00 55.13 H new ATOM 0 HD22 LEU A 146 -2.355 3.512 -17.388 1.00 55.13 H new ATOM 0 HD23 LEU A 146 -3.667 2.314 -17.482 1.00 55.13 H new ATOM 2297 N GLY A 147 -1.470 1.164 -14.728 1.00 70.12 N ATOM 2298 CA GLY A 147 -0.279 0.441 -15.126 1.00 51.14 C ATOM 2299 C GLY A 147 0.161 0.736 -16.551 1.00 34.34 C ATOM 2300 O GLY A 147 -0.383 1.620 -17.216 1.00 72.33 O ATOM 0 H GLY A 147 -1.328 1.831 -13.970 1.00 70.12 H new ATOM 0 HA2 GLY A 147 0.534 0.691 -14.444 1.00 51.14 H new ATOM 0 HA3 GLY A 147 -0.462 -0.629 -15.025 1.00 51.14 H new